#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1crp s THR 2 N 0.00 0.10 -0.11 1.12 2.01 -1.26 -5.03 115.64 112.47 1crp s THR 2 Ca 0.00 -2.00 0.04 0.00 0.31 0.00 0.00 61.69 60.04 1crp s THR 2 Cb 0.00 -2.51 0.00 0.00 0.01 0.00 0.00 72.50 70.00 1crp s THR 2 CO 0.00 0.00 -0.23 -0.70 -0.69 0.00 0.00 174.62 173.00 1crp s GLU 3 N -3.95 3.01 0.12 4.92 2.12 -1.26 -2.39 118.70 121.26 1crp s GLU 3 Ca 0.39 -0.86 0.04 0.00 0.36 0.00 0.00 54.97 54.89 1crp s GLU 3 Cb 0.06 -2.31 -0.04 0.00 0.26 0.00 0.00 34.13 32.10 1crp s GLU 3 CO 0.16 0.13 -0.09 0.71 -0.54 0.00 0.00 175.26 175.63 1crp s TYR 4 N 0.46 1.12 -0.08 5.30 2.02 -0.76 -5.01 117.35 120.40 1crp s TYR 4 Ca -0.16 -0.78 0.04 0.00 -0.37 0.00 0.00 57.07 55.80 1crp s TYR 4 Cb -0.17 -0.60 -0.00 0.00 -0.40 0.00 0.00 41.96 40.79 1crp s TYR 4 CO 0.06 0.00 -0.22 0.15 -1.57 0.00 0.00 175.55 173.98 1crp s LYS 5 N -3.58 2.69 -1.07 -0.62 1.02 -1.26 -1.20 119.74 115.72 1crp s LYS 5 Ca 0.13 -0.80 -0.08 0.00 0.02 0.00 0.00 55.97 55.24 1crp s LYS 5 Cb 0.02 -2.10 0.27 0.00 -0.52 0.00 0.00 37.83 35.50 1crp s LYS 5 CO -0.01 0.20 1.04 -0.51 -0.92 0.00 0.00 175.35 175.16 1crp s LEU 6 N 0.27 6.22 -0.41 3.17 1.43 -1.09 -2.14 118.68 126.13 1crp s LEU 6 Ca -0.14 -3.60 -0.28 0.00 -1.03 0.00 0.00 54.13 49.08 1crp s LEU 6 Cb -0.16 -2.16 -0.08 0.00 0.03 0.00 0.00 46.19 43.82 1crp s LEU 6 CO 0.07 -0.28 2.34 0.52 0.23 0.00 0.00 176.35 179.23 1crp n VAL 7 N 2.67 0.11 -3.45 -1.59 0.31 0.30 -2.90 118.33 113.78 1crp n VAL 7 Ca 0.23 -0.56 -0.37 0.00 -0.01 0.00 0.00 64.34 63.64 1crp n VAL 7 Cb 0.39 -2.41 -0.06 0.00 -0.91 0.00 0.00 33.84 30.85 1crp n VAL 7 CO 0.00 0.00 0.00 -0.69 -1.32 0.00 0.00 176.83 174.82 1crp s VAL 8 N 9.96 4.96 -0.19 2.52 1.01 -1.08 -1.60 120.40 135.97 1crp s VAL 8 Ca 1.03 0.82 -0.23 0.00 0.00 0.00 0.00 61.98 63.61 1crp s VAL 8 Cb -0.40 -3.73 0.06 0.00 0.00 0.00 0.00 36.38 32.31 1crp s VAL 8 CO 0.34 0.45 0.62 0.68 0.00 0.00 0.00 175.10 177.19 1crp s VAL 9 N -1.23 0.00 0.00 2.92 -7.23 -1.14 -4.83 120.40 108.89 1crp s VAL 9 Ca 0.29 -0.02 0.00 0.00 -1.81 0.00 0.00 61.98 60.44 1crp s VAL 9 Cb -0.16 -0.87 0.00 0.00 0.56 0.00 0.00 36.38 35.90 1crp s VAL 9 CO 0.16 -0.01 0.00 0.61 -0.31 0.00 0.00 175.10 175.55 1crp n GLY 10 N 2.39 -0.80 3.39 2.32 0.00 -1.26 -0.71 105.19 110.52 1crp n GLY 10 Ca -0.15 0.60 -0.19 0.00 0.00 0.00 0.00 46.02 46.28 1crp n GLY 10 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1crp s ALA 11 N -1.00 2.08 -1.29 4.61 0.00 -1.25 -4.66 121.76 120.25 1crp s ALA 11 Ca 0.00 -1.97 -0.09 0.00 0.00 0.00 0.00 51.96 49.90 1crp s ALA 11 Cb 0.00 0.80 0.16 0.00 0.00 0.00 0.00 23.12 24.08 1crp s ALA 11 CO 0.00 -0.36 1.93 0.41 0.00 0.00 0.00 175.76 177.74 1crp n GLY 12 N -0.58 4.79 0.00 0.00 0.00 -1.26 -3.98 105.19 104.15 1crp n GLY 12 Ca -0.02 -2.08 0.00 0.00 0.00 0.00 0.00 46.02 43.93 1crp n GLY 12 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1crp n GLY 13 N 2.77 0.00 0.09 -0.02 0.00 -1.26 -5.05 105.19 101.72 1crp n GLY 13 Ca 0.42 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 46.36 1crp n GLY 13 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 1crp n VAL 14 N 0.00 1.26 0.00 1.61 0.24 -1.26 -4.92 118.33 115.26 1crp n VAL 14 Ca 0.00 -0.82 0.00 0.00 -2.04 0.00 0.00 64.34 61.48 1crp n VAL 14 Cb 0.00 -0.43 0.00 0.00 -1.47 0.00 0.00 33.84 31.94 1crp n VAL 14 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1crp n GLY 15 N 1.73 1.98 0.10 7.63 0.00 -1.26 -4.46 105.19 110.90 1crp n GLY 15 Ca -0.30 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 45.64 1crp n GLY 15 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 1crp h LYS 16 N 0.00 0.11 0.12 1.61 2.10 -1.94 -2.36 116.57 116.22 1crp h LYS 16 Ca 0.00 -0.14 -0.01 0.00 -2.00 0.00 0.00 60.65 58.51 1crp h LYS 16 Cb 0.00 0.04 0.00 0.00 -0.90 0.00 0.00 32.23 31.37 1crp h LYS 16 CO 0.00 0.95 -0.06 0.77 -2.00 0.00 0.00 179.45 179.11 1crp h SER 17 N 0.05 -0.14 -0.69 7.07 0.02 -1.95 -2.20 113.55 115.71 1crp h SER 17 Ca -0.04 -0.01 0.20 0.00 -0.84 0.00 0.00 61.79 61.10 1crp h SER 17 Cb 1.58 0.04 -0.03 0.00 0.14 0.00 0.00 62.40 64.13 1crp h SER 17 CO 0.13 0.35 0.57 0.00 -1.14 0.00 0.00 176.83 176.74 1crp h ALA 18 N -1.02 2.54 -0.06 3.77 0.00 -1.91 0.24 119.26 122.82 1crp h ALA 18 Ca -0.02 -0.02 -0.16 0.00 0.00 0.00 0.00 54.91 54.71 1crp h ALA 18 Cb 0.15 0.05 0.01 0.00 0.00 0.00 0.00 17.79 18.00 1crp h ALA 18 CO 0.03 -0.93 -0.57 -0.07 0.00 0.00 0.00 179.25 177.71 1crp h LEU 19 N 0.00 0.61 0.69 0.00 3.38 -1.45 -2.15 115.31 116.39 1crp h LEU 19 Ca 0.33 -0.69 -0.03 0.00 0.09 0.00 0.00 57.88 57.58 1crp h LEU 19 Cb 1.47 -0.18 0.01 0.00 0.09 0.00 0.00 40.66 42.04 1crp h LEU 19 CO -0.00 1.21 -0.33 0.74 0.09 0.00 0.00 178.44 180.14 1crp h THR 20 N 0.07 0.00 -0.60 0.22 2.02 0.11 -2.11 112.91 112.61 1crp h THR 20 Ca -0.05 -0.01 0.18 0.00 0.77 0.00 0.00 66.41 67.29 1crp h THR 20 Cb 1.24 0.00 -0.02 0.00 -1.74 0.00 0.00 68.15 67.62 1crp h THR 20 CO 0.12 0.00 0.53 0.40 0.37 0.00 0.00 175.52 176.94 1crp h ILE 21 N -0.94 0.45 0.73 3.11 5.03 -1.43 -1.74 117.51 122.72 1crp h ILE 21 Ca -0.10 0.00 -0.03 0.00 -0.12 0.00 0.00 64.86 64.61 1crp h ILE 21 Cb 0.71 0.60 -0.00 0.00 -3.03 0.00 0.00 36.82 35.10 1crp h ILE 21 CO 0.16 0.00 -0.45 -0.61 -0.68 0.00 0.00 178.15 176.57 1crp h GLN 22 N 0.00 -1.07 -0.01 2.37 -0.00 -0.70 0.28 115.11 115.99 1crp h GLN 22 Ca 0.29 0.07 0.00 0.00 -0.00 0.00 0.00 58.65 59.01 1crp h GLN 22 Cb 1.35 0.24 -0.00 0.00 0.00 0.00 0.00 27.48 29.07 1crp h GLN 22 CO -0.00 -0.71 0.07 1.25 0.00 0.00 0.00 178.83 179.44 1crp h LEU 23 N -1.11 0.00 0.00 -2.39 5.85 -1.07 0.83 115.31 117.42 1crp h LEU 23 Ca -0.10 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.62 1crp h LEU 23 Cb 0.89 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.92 1crp h LEU 23 CO 0.10 0.00 0.00 -0.38 -0.34 0.00 0.00 178.44 177.82 1crp n ILE 24 N -3.13 0.00 0.26 4.05 5.41 -0.51 -4.65 119.36 120.78 1crp n ILE 24 Ca -0.03 0.00 0.13 0.00 1.00 0.00 0.00 62.75 63.85 1crp n ILE 24 Cb 0.14 -0.45 0.68 0.00 -0.71 0.00 0.00 39.64 39.30 1crp n ILE 24 CO 0.00 0.00 0.00 1.56 0.00 0.00 0.00 176.55 178.11 1crp h GLN 25 N 0.00 0.00 -4.25 0.38 1.08 -0.62 -3.48 115.11 108.22 1crp h GLN 25 Ca 0.00 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.20 1crp h GLN 25 Cb 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.43 1crp h GLN 25 CO 0.00 0.13 -0.32 -1.71 -0.95 0.00 0.00 178.83 175.98 1crp n ASN 26 N -3.51 -5.31 -3.64 1.46 2.85 0.29 -5.02 115.26 102.37 1crp n ASN 26 Ca -0.01 0.38 -0.02 0.00 -0.11 0.00 0.00 54.58 54.82 1crp n ASN 26 Cb 0.28 -3.44 -0.03 0.00 1.24 0.00 0.00 39.78 37.84 1crp n ASN 26 CO 0.00 0.00 0.00 -1.38 -2.11 0.00 0.00 177.26 173.77 1crp s HIS 27 N -1.73 -0.03 -0.73 1.20 -3.43 -1.26 -5.03 115.29 104.28 1crp s HIS 27 Ca 0.12 0.03 -0.18 0.00 -0.80 0.00 0.00 55.06 54.22 1crp s HIS 27 Cb -0.03 0.50 0.13 0.00 -1.43 0.00 0.00 32.58 31.75 1crp s HIS 27 CO 0.43 -0.04 0.83 0.12 -2.00 0.00 0.00 174.74 174.09 1crp s PHE 28 N -1.71 3.16 0.03 0.38 5.36 -1.26 -4.50 117.98 119.44 1crp s PHE 28 Ca 0.11 -1.26 -0.30 0.00 -0.96 0.00 0.00 56.93 54.52 1crp s PHE 28 Cb -0.01 -4.06 -0.04 0.00 -0.34 0.00 0.00 43.02 38.57 1crp s PHE 28 CO -0.04 -1.30 1.06 0.14 -1.46 0.00 0.00 175.22 173.62 1crp s VAL 29 N 2.25 4.53 -0.62 3.12 -7.23 -1.26 -4.92 120.40 116.27 1crp s VAL 29 Ca 0.18 1.83 0.16 0.00 -1.81 0.00 0.00 61.98 62.34 1crp s VAL 29 Cb -0.16 -4.17 0.75 0.00 0.56 0.00 0.00 36.38 33.36 1crp s VAL 29 CO -0.01 0.15 1.67 -0.67 -0.31 0.00 0.00 175.10 175.93 1crp n ASP 30 N 3.86 5.15 0.00 4.85 -0.08 -1.26 -4.71 116.55 124.37 1crp n ASP 30 Ca 0.07 -2.73 0.00 0.00 -1.51 0.00 0.00 54.79 50.62 1crp n ASP 30 Cb 0.49 -0.62 0.00 0.00 2.34 0.00 0.00 41.12 43.33 1crp n ASP 30 CO 0.00 0.00 0.00 -1.84 0.12 0.00 0.00 177.20 175.48 1crp n GLU 31 N 0.74 0.00 -1.42 -0.67 0.28 -1.26 -5.03 120.64 113.27 1crp n GLU 31 Ca 0.26 0.00 -0.31 0.00 -0.16 0.00 0.00 57.16 56.96 1crp n GLU 31 Cb 1.04 0.00 0.03 0.00 1.43 0.00 0.00 31.44 33.94 1crp n GLU 31 CO 0.00 0.00 0.00 0.98 -0.16 0.00 0.00 177.13 177.95 1crp n TYR 32 N 0.00 2.44 -2.36 -1.84 9.36 -1.26 -4.94 117.16 118.56 1crp n TYR 32 Ca 0.00 -2.38 0.00 0.00 3.32 0.00 0.00 57.90 58.84 1crp n TYR 32 Cb 0.00 -1.26 0.00 0.00 -0.63 0.00 0.00 39.34 37.45 1crp n TYR 32 CO 0.00 0.00 0.00 -0.25 0.22 0.00 0.00 176.86 176.83 1crp n ASP 33 N -0.15 -9.71 0.30 2.98 9.92 -1.26 -4.73 116.55 113.90 1crp n ASP 33 Ca 0.50 1.88 0.20 0.00 -0.53 0.00 0.00 54.79 56.85 1crp n ASP 33 Cb 0.51 -5.29 1.06 0.00 -0.64 0.00 0.00 41.12 36.76 1crp n ASP 33 CO 0.00 0.00 0.00 1.55 0.13 0.00 0.00 177.20 178.88 1crp h PRO 34 N 4.34 0.00 -3.85 -0.24 0.13 -2.02 -3.33 132.00 127.03 1crp h PRO 34 Ca 0.00 0.00 -0.69 0.00 -0.87 0.00 0.00 66.00 64.44 1crp h PRO 34 Cb 0.00 0.00 -0.36 0.00 0.13 0.00 0.00 31.00 30.77 1crp h PRO 34 CO 0.00 0.00 -0.46 0.95 -0.23 0.00 0.00 178.00 178.26 1crp s THR 35 N -3.99 3.39 -0.07 1.56 -4.23 -1.26 -4.78 115.64 106.25 1crp s THR 35 Ca -0.04 -2.74 -0.03 0.00 -1.18 0.00 0.00 61.69 57.70 1crp s THR 35 Cb 0.11 -3.26 0.04 0.00 1.34 0.00 0.00 72.50 70.73 1crp s THR 35 CO 0.38 -0.81 0.07 -0.63 -0.54 0.00 0.00 174.62 173.09 1crp s ILE 36 N 0.27 -0.10 -0.12 2.99 -1.09 -1.25 -5.09 121.20 116.80 1crp s ILE 36 Ca 0.14 0.28 -0.02 0.00 -2.23 0.00 0.00 60.65 58.83 1crp s ILE 36 Cb -0.22 -0.26 0.04 0.00 -1.58 0.00 0.00 42.46 40.45 1crp s ILE 36 CO -0.03 0.07 0.01 -1.61 -1.23 0.00 0.00 174.94 172.15 1crp s GLU 37 N 2.16 0.67 0.00 2.79 8.01 -1.26 -4.34 118.70 126.72 1crp s GLU 37 Ca 0.04 -0.12 0.00 0.00 0.01 0.00 0.00 54.97 54.90 1crp s GLU 37 Cb -0.13 -1.46 0.00 0.00 -4.31 0.00 0.00 34.13 28.23 1crp s GLU 37 CO -0.04 -0.44 0.00 -3.47 0.01 0.00 0.00 175.26 171.32 1crp n ASP 38 N 5.10 0.00 -3.61 -0.19 2.03 -1.26 -5.08 116.55 113.54 1crp n ASP 38 Ca -0.08 0.00 -0.08 0.00 0.52 0.00 0.00 54.79 55.15 1crp n ASP 38 Cb 0.49 0.00 -0.06 0.00 -0.72 0.00 0.00 41.12 40.83 1crp n ASP 38 CO 0.00 0.00 0.00 -0.94 -1.92 0.00 0.00 177.20 174.34 1crp s SER 39 N 2.00 -0.29 -0.21 1.67 1.04 -1.26 -4.91 113.70 111.73 1crp s SER 39 Ca 0.00 0.42 0.00 0.00 0.48 0.00 0.00 55.95 56.85 1crp s SER 39 Cb 0.00 0.38 0.05 0.00 0.10 0.00 0.00 66.02 66.55 1crp s SER 39 CO 0.00 -0.19 -0.06 -0.31 0.98 0.00 0.00 173.24 173.66 1crp s TYR 40 N -0.58 2.19 0.12 5.02 2.02 -1.01 -5.05 117.35 120.06 1crp s TYR 40 Ca 0.03 -1.56 0.03 0.00 -0.37 0.00 0.00 57.07 55.20 1crp s TYR 40 Cb -0.02 -1.51 -0.04 0.00 -0.40 0.00 0.00 41.96 39.99 1crp s TYR 40 CO -0.04 -0.73 0.13 1.03 -1.57 0.00 0.00 175.55 174.36 1crp s ARG 41 N 1.47 2.99 -0.20 -0.62 0.52 -1.26 -1.33 118.95 120.52 1crp s ARG 41 Ca -0.04 -0.73 -0.28 0.00 -0.52 0.00 0.00 55.73 54.16 1crp s ARG 41 Cb -0.18 -2.75 0.11 0.00 0.52 0.00 0.00 34.95 32.66 1crp s ARG 41 CO -0.07 0.53 0.95 0.21 0.02 0.00 0.00 175.30 176.95 1crp s LYS 42 N -2.75 0.64 0.03 3.54 2.47 -1.26 -4.98 119.74 117.43 1crp s LYS 42 Ca 0.31 0.37 0.07 0.00 -1.56 0.00 0.00 55.97 55.17 1crp s LYS 42 Cb -0.11 0.30 -0.02 0.00 -1.46 0.00 0.00 37.83 36.54 1crp s LYS 42 CO 0.24 -0.15 -0.22 1.14 0.16 0.00 0.00 175.35 176.51 1crp s GLN 43 N -0.56 1.55 0.35 4.03 -2.07 -1.26 -2.32 119.66 119.38 1crp s GLN 43 Ca -0.01 -0.92 -0.10 0.00 -1.82 0.00 0.00 55.36 52.51 1crp s GLN 43 Cb -0.02 -1.63 0.02 0.00 -1.09 0.00 0.00 33.01 30.29 1crp s GLN 43 CO -0.00 0.43 0.61 0.14 -1.32 0.00 0.00 175.29 175.15 1crp s VAL 44 N -0.72 0.00 -0.29 3.63 -7.23 -1.25 -5.00 120.40 109.54 1crp s VAL 44 Ca 0.08 -1.31 -0.06 0.00 -1.81 0.00 0.00 61.98 58.88 1crp s VAL 44 Cb -0.09 -2.65 0.01 0.00 0.56 0.00 0.00 36.38 34.21 1crp s VAL 44 CO 0.01 0.00 0.07 -0.69 -0.31 0.00 0.00 175.10 174.18 1crp s VAL 45 N -2.92 3.92 0.03 1.32 1.01 -1.26 -2.51 120.40 119.98 1crp s VAL 45 Ca 0.23 -0.65 -0.28 0.00 0.00 0.00 0.00 61.98 61.27 1crp s VAL 45 Cb -0.03 -2.99 -0.16 0.00 0.00 0.00 0.00 36.38 33.20 1crp s VAL 45 CO 0.15 0.12 1.22 0.40 0.00 0.00 0.00 175.10 176.99 1crp h ILE 46 N 5.84 0.00 0.00 2.22 1.08 -1.90 -3.43 117.51 121.33 1crp h ILE 46 Ca -0.33 -0.19 -0.12 0.00 -0.39 0.00 0.00 64.86 63.83 1crp h ILE 46 Cb 1.13 0.00 -0.15 0.00 -3.07 0.00 0.00 36.82 34.73 1crp h ILE 46 CO 0.60 0.00 -0.38 0.47 -0.69 0.00 0.00 178.15 178.15 1crp n ASP 47 N -5.26 -0.55 0.00 1.72 8.00 -1.26 -4.96 116.55 114.24 1crp n ASP 47 Ca -0.13 -1.89 0.00 0.00 0.71 0.00 0.00 54.79 53.49 1crp n ASP 47 Cb 0.40 0.16 0.00 0.00 -0.02 0.00 0.00 41.12 41.66 1crp n ASP 47 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1crp n GLY 48 N 0.08 1.40 3.34 0.44 0.00 -1.26 -5.11 105.19 104.08 1crp n GLY 48 Ca -0.19 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.49 1crp n GLY 48 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1crp s GLU 49 N 0.00 3.37 0.73 1.61 2.56 -1.26 -5.09 118.70 120.62 1crp s GLU 49 Ca 0.00 -0.67 -0.11 0.00 0.00 0.00 0.00 54.97 54.19 1crp s GLU 49 Cb 0.00 -2.77 0.03 0.00 2.00 0.00 0.00 34.13 33.39 1crp s GLU 49 CO 0.00 0.04 1.07 0.99 -0.56 0.00 0.00 175.26 176.80 1crp s THR 50 N 0.82 3.72 -0.29 -1.70 2.01 -1.26 -3.04 115.64 115.89 1crp s THR 50 Ca -0.03 0.56 -0.14 0.00 0.31 0.00 0.00 61.69 62.38 1crp s THR 50 Cb -0.15 -3.26 0.13 0.00 0.01 0.00 0.00 72.50 69.23 1crp s THR 50 CO 0.01 -0.73 0.83 0.00 -0.69 0.00 0.00 174.62 174.04 1crp s LEU 52 N 2.00 4.40 -0.42 0.00 0.20 -1.01 -3.81 118.68 120.04 1crp s LEU 52 Ca -0.07 2.03 0.02 0.00 0.69 0.00 0.00 54.13 56.79 1crp s LEU 52 Cb -0.06 -3.89 0.14 0.00 -0.43 0.00 0.00 46.19 41.95 1crp s LEU 52 CO -0.18 -0.16 0.26 -0.76 -0.29 0.00 0.00 176.35 175.22 1crp s LEU 53 N -1.90 2.07 -0.68 -0.68 1.02 -0.98 -1.83 118.68 115.70 1crp s LEU 53 Ca 0.49 -2.63 -0.26 0.00 0.02 0.00 0.00 54.13 51.75 1crp s LEU 53 Cb -0.24 -0.77 -0.08 0.00 0.02 0.00 0.00 46.19 45.11 1crp s LEU 53 CO 0.31 -0.25 2.26 -0.62 0.02 0.00 0.00 176.35 178.06 1crp s ASP 54 N 0.43 4.46 0.27 2.29 2.15 -0.34 -4.15 116.67 121.78 1crp s ASP 54 Ca 0.21 0.32 -0.29 0.00 0.43 0.00 0.00 52.55 53.22 1crp s ASP 54 Cb -0.18 -2.53 -0.09 0.00 -0.30 0.00 0.00 42.92 39.81 1crp s ASP 54 CO -0.04 -3.16 0.99 -0.63 -0.17 0.00 0.00 175.17 172.16 1crp s ILE 55 N 12.40 3.92 -0.37 4.11 1.09 -0.44 -2.66 121.20 139.25 1crp s ILE 55 Ca 0.87 1.84 0.03 0.00 -1.10 0.00 0.00 60.65 62.29 1crp s ILE 55 Cb -0.13 -4.14 0.11 0.00 -1.06 0.00 0.00 42.46 37.24 1crp s ILE 55 CO 0.14 0.37 0.11 -0.22 -0.10 0.00 0.00 174.94 175.25 1crp s LEU 56 N -1.49 3.92 0.29 2.97 2.96 -1.14 -2.39 118.68 123.80 1crp s LEU 56 Ca 0.44 -2.22 0.15 0.00 -0.22 0.00 0.00 54.13 52.28 1crp s LEU 56 Cb -0.26 -1.40 0.30 0.00 0.50 0.00 0.00 46.19 45.33 1crp s LEU 56 CO 0.33 -0.35 1.55 -0.78 -1.32 0.00 0.00 176.35 175.77 1crp h ASP 57 N 7.45 0.00 -2.13 3.68 3.58 -1.88 -2.87 116.42 124.26 1crp h ASP 57 Ca -0.07 0.00 0.26 0.00 0.42 0.00 0.00 57.03 57.64 1crp h ASP 57 Cb 0.99 0.00 -0.06 0.00 1.72 0.00 0.00 39.33 41.97 1crp h ASP 57 CO 0.53 0.55 -0.34 0.35 -2.88 0.00 0.00 179.24 177.45 1crp n THR 58 N -3.43 0.00 -3.16 2.25 -2.24 -1.26 -4.85 114.28 101.58 1crp n THR 58 Ca 0.00 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.78 1crp n THR 58 Cb 0.67 -0.32 0.00 0.00 -2.10 0.00 0.00 70.33 68.57 1crp n THR 58 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1crp n ALA 59 N -1.65 0.00 -1.18 6.98 0.00 -1.26 -4.85 120.51 118.54 1crp n ALA 59 Ca 0.01 0.00 0.15 0.00 0.00 0.00 0.00 53.44 53.60 1crp n ALA 59 Cb 0.43 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 19.83 1crp n ALA 59 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1crp n GLY 60 N 0.00 -2.57 0.00 0.00 0.00 -1.26 -5.02 105.19 96.34 1crp n GLY 60 Ca 0.00 -1.17 0.00 0.00 0.00 0.00 0.00 46.02 44.85 1crp n GLY 60 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1crp n GLN 61 N -3.98 2.82 -1.68 1.61 6.02 -1.26 -5.07 117.38 115.85 1crp n GLN 61 Ca -0.03 0.00 -0.43 0.00 -0.01 0.00 0.00 57.00 56.53 1crp n GLN 61 Cb 0.55 0.00 -0.03 0.00 1.02 0.00 0.00 30.24 31.78 1crp n GLN 61 CO 0.00 0.00 0.00 0.39 -1.01 0.00 0.00 177.06 176.44 1crp n GLU 62 N 0.00 2.75 0.00 -1.09 4.71 -1.26 -4.78 120.64 120.97 1crp n GLU 62 Ca 0.00 1.00 0.00 0.00 -0.01 0.00 0.00 57.16 58.15 1crp n GLU 62 Cb 0.00 -2.91 0.00 0.00 -1.01 0.00 0.00 31.44 27.52 1crp n GLU 62 CO 0.00 0.00 0.00 0.39 0.09 0.00 0.00 177.13 177.61 1crp n GLU 63 N 6.20 0.00 -3.35 3.49 1.02 -1.26 -4.98 120.64 121.77 1crp n GLU 63 Ca 0.19 0.00 -0.16 0.00 -0.02 0.00 0.00 57.16 57.17 1crp n GLU 63 Cb 0.37 0.00 0.08 0.00 -0.02 0.00 0.00 31.44 31.88 1crp n GLU 63 CO 0.00 0.00 0.00 0.98 1.18 0.00 0.00 177.13 179.29 1crp n TYR 64 N 0.00 -2.24 -3.31 -0.32 9.36 -1.26 -4.95 117.16 114.44 1crp n TYR 64 Ca 0.00 0.90 -0.44 0.00 3.32 0.00 0.00 57.90 61.68 1crp n TYR 64 Cb 0.00 -4.74 -0.08 0.00 -0.63 0.00 0.00 39.34 33.89 1crp n TYR 64 CO 0.00 0.00 0.00 -1.12 0.22 0.00 0.00 176.86 175.96 1crp s SER 65 N -4.03 6.18 -0.15 2.98 0.01 -1.26 -4.89 113.70 112.55 1crp s SER 65 Ca 0.14 -0.90 0.15 0.00 1.31 0.00 0.00 55.95 56.66 1crp s SER 65 Cb -0.02 -2.23 0.42 0.00 0.21 0.00 0.00 66.02 64.40 1crp s SER 65 CO 0.72 -0.66 1.20 0.00 0.41 0.00 0.00 173.24 174.91 1crp n ALA 66 N 5.61 3.25 0.00 1.44 0.00 -1.26 -4.72 120.51 124.83 1crp n ALA 66 Ca -0.09 -3.00 0.00 0.00 0.00 0.00 0.00 53.44 50.35 1crp n ALA 66 Cb 0.46 -0.47 0.00 0.00 0.00 0.00 0.00 19.45 19.44 1crp n ALA 66 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 177.50 177.38 1crp n MET 67 N -0.64 0.00 -0.16 0.00 1.56 -1.26 -4.58 117.12 112.04 1crp n MET 67 Ca 0.15 0.00 -0.08 0.00 -0.27 0.00 0.00 57.70 57.50 1crp n MET 67 Cb 0.83 -0.48 0.01 0.00 2.15 0.00 0.00 33.22 35.73 1crp n MET 67 CO 0.00 0.00 0.00 -0.09 -0.73 0.00 0.00 175.97 175.15 1crp h ARG 68 N 0.00 0.64 -0.51 2.12 2.43 -1.98 -1.63 114.38 115.45 1crp h ARG 68 Ca 0.00 -0.07 0.00 0.00 -0.81 0.00 0.00 59.98 59.10 1crp h ARG 68 Cb 0.53 -0.13 -0.03 0.00 -0.42 0.00 0.00 29.97 29.93 1crp h ARG 68 CO 0.00 0.50 0.32 0.22 -1.51 0.00 0.00 179.97 179.49 1crp h ASP 69 N 0.61 0.60 -0.18 -3.80 3.58 -1.87 -0.50 116.42 114.85 1crp h ASP 69 Ca 0.16 -0.02 -0.07 0.00 0.42 0.00 0.00 57.03 57.52 1crp h ASP 69 Cb 0.04 -0.15 -0.02 0.00 1.72 0.00 0.00 39.33 40.92 1crp h ASP 69 CO -0.03 0.45 -0.10 1.56 -2.88 0.00 0.00 179.24 178.24 1crp h GLN 70 N 0.70 0.54 0.00 0.28 4.20 -1.58 -1.83 115.11 117.42 1crp h GLN 70 Ca 0.18 -0.15 -0.10 0.00 0.06 0.00 0.00 58.65 58.65 1crp h GLN 70 Cb -0.05 -0.06 -0.01 0.00 0.30 0.00 0.00 27.48 27.66 1crp h GLN 70 CO -0.04 0.64 -0.46 -0.92 -0.67 0.00 0.00 178.83 177.38 1crp h TYR 71 N 0.50 0.00 0.00 2.96 3.20 -0.32 -2.16 116.97 121.15 1crp h TYR 71 Ca 0.09 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.96 1crp h TYR 71 Cb 0.48 0.00 0.00 0.00 1.54 0.00 0.00 36.73 38.75 1crp h TYR 71 CO 0.02 0.46 0.00 0.52 -1.64 0.00 0.00 178.16 177.52 1crp h MET 72 N 0.00 0.00 0.00 1.82 2.86 -0.43 -1.42 114.93 117.76 1crp h MET 72 Ca -0.00 0.00 -0.38 0.00 -2.06 0.00 0.00 59.70 57.25 1crp h MET 72 Cb 0.94 0.00 -0.07 0.00 0.06 0.00 0.00 31.60 32.53 1crp h MET 72 CO 0.06 0.00 -2.43 -2.13 1.06 0.00 0.00 176.91 173.47 1crp n ARG 73 N -2.89 0.66 0.05 1.72 0.00 -0.86 -4.57 116.66 110.78 1crp n ARG 73 Ca -0.02 0.11 -0.08 0.00 -0.00 0.00 0.00 57.85 57.87 1crp n ARG 73 Cb 0.11 -1.53 -0.05 0.00 0.00 0.00 0.00 32.46 30.98 1crp n ARG 73 CO 0.00 0.00 0.00 1.79 0.00 0.00 0.00 177.63 179.42 1crp h THR 74 N 0.00 0.51 -2.45 5.15 1.35 -1.08 -3.46 112.91 112.92 1crp h THR 74 Ca -0.56 -1.08 -0.28 0.00 -0.55 0.00 0.00 66.41 63.94 1crp h THR 74 Cb 2.00 0.89 0.17 0.00 -1.73 0.00 0.00 68.15 69.47 1crp h THR 74 CO -0.05 0.15 -0.14 0.61 -0.25 0.00 0.00 175.52 175.84 1crp n GLY 75 N 0.94 -3.33 0.00 5.82 0.00 -0.57 -4.99 105.19 103.05 1crp n GLY 75 Ca -0.06 -1.08 0.00 0.00 0.00 0.00 0.00 46.02 44.88 1crp n GLY 75 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1crp n GLU 76 N -4.19 0.00 -2.61 1.61 4.71 -1.23 -4.96 120.64 113.97 1crp n GLU 76 Ca 0.11 0.00 -0.43 0.00 -0.01 0.00 0.00 57.16 56.83 1crp n GLU 76 Cb 0.46 -0.40 -0.02 0.00 -1.01 0.00 0.00 31.44 30.47 1crp n GLU 76 CO 0.00 0.00 0.00 0.20 0.09 0.00 0.00 177.13 177.42 1crp s GLY 77 N -2.19 1.33 -0.78 0.62 0.00 -0.91 -4.05 107.32 101.34 1crp s GLY 77 Ca 0.00 -0.43 -0.14 0.00 0.00 0.00 0.00 44.72 44.15 1crp s GLY 77 CO 0.00 2.39 0.72 -1.36 0.00 0.00 0.00 173.10 174.85 1crp s PHE 78 N 4.33 3.69 -0.86 1.90 0.40 -1.14 0.11 117.98 126.41 1crp s PHE 78 Ca 0.47 -1.94 -0.23 0.00 -0.60 0.00 0.00 56.93 54.63 1crp s PHE 78 Cb -0.08 -3.79 0.06 0.00 0.51 0.00 0.00 43.02 39.72 1crp s PHE 78 CO 0.29 -0.99 1.26 -1.17 0.70 0.00 0.00 175.22 175.32 1crp s LEU 79 N 0.34 3.81 -1.00 -0.37 2.96 -0.63 -2.31 118.68 121.47 1crp s LEU 79 Ca 0.16 -1.17 -0.23 0.00 -0.22 0.00 0.00 54.13 52.67 1crp s LEU 79 Cb -0.13 -2.51 -0.03 0.00 0.50 0.00 0.00 46.19 44.02 1crp s LEU 79 CO -0.07 -1.52 1.82 0.00 -1.32 0.00 0.00 176.35 175.26 1crp s VAL 81 N 8.75 3.41 -0.18 0.00 1.01 0.12 -2.48 120.40 131.02 1crp s VAL 81 Ca 0.63 1.04 -0.08 0.00 0.00 0.00 0.00 61.98 63.58 1crp s VAL 81 Cb -0.04 -3.67 0.07 0.00 0.00 0.00 0.00 36.38 32.75 1crp s VAL 81 CO 0.00 0.10 0.40 0.72 0.00 0.00 0.00 175.10 176.32 1crp s PHE 82 N 0.85 -0.66 0.01 5.22 -0.12 -0.92 -3.87 117.98 118.49 1crp s PHE 82 Ca 0.62 1.35 -0.30 0.00 -0.05 0.00 0.00 56.93 58.54 1crp s PHE 82 Cb -0.35 0.26 -0.04 0.00 -0.63 0.00 0.00 43.02 42.26 1crp s PHE 82 CO 0.32 -0.39 1.06 0.00 -0.05 0.00 0.00 175.22 176.16 1crp s ALA 83 N 1.89 3.25 -1.87 1.99 0.00 -1.26 -1.50 121.76 124.26 1crp s ALA 83 Ca -0.06 0.64 0.30 0.00 0.00 0.00 0.00 51.96 52.83 1crp s ALA 83 Cb -0.10 -3.38 1.70 0.00 0.00 0.00 0.00 23.12 21.34 1crp s ALA 83 CO -0.12 -0.33 2.08 0.44 0.00 0.00 0.00 175.76 177.83 1crp n ILE 84 N 3.95 0.02 -0.29 0.00 -6.64 -1.02 -3.07 119.36 112.31 1crp n ILE 84 Ca 0.07 0.00 0.05 0.00 -1.77 0.00 0.00 62.75 61.11 1crp n ILE 84 Cb 0.49 -0.54 0.13 0.00 -1.44 0.00 0.00 39.64 38.29 1crp n ILE 84 CO 0.00 0.00 0.00 -3.20 -1.77 0.00 0.00 176.55 171.58 1crp n ASN 85 N -1.07 2.83 -0.05 7.28 2.85 -1.26 -2.04 115.26 123.80 1crp n ASN 85 Ca 0.20 -2.19 -0.08 0.00 -0.11 0.00 0.00 54.58 52.40 1crp n ASN 85 Cb 0.13 -0.23 -0.05 0.00 1.24 0.00 0.00 39.78 40.87 1crp n ASN 85 CO 0.00 0.00 0.00 -3.20 -2.11 0.00 0.00 177.26 171.95 1crp n ASN 86 N 0.06 2.68 0.00 1.20 2.85 -1.17 -4.82 115.26 116.06 1crp n ASN 86 Ca 0.11 -0.01 0.00 0.00 -0.11 0.00 0.00 54.58 54.56 1crp n ASN 86 Cb 0.46 -0.20 0.00 0.00 1.24 0.00 0.00 39.78 41.29 1crp n ASN 86 CO 0.00 0.00 0.00 0.41 -2.11 0.00 0.00 177.26 175.56 1crp n THR 87 N -2.95 0.00 0.16 -0.44 -1.04 -1.24 -4.66 114.28 104.10 1crp n THR 87 Ca -0.19 0.00 0.04 0.00 -2.04 0.00 0.00 64.05 61.86 1crp n THR 87 Cb 0.69 0.00 0.46 0.00 -1.82 0.00 0.00 70.33 69.66 1crp n THR 87 CO 0.00 0.00 0.00 0.50 -0.64 0.00 0.00 175.07 174.93 1crp h LYS 88 N 0.00 0.17 -0.18 -2.82 3.64 -1.95 -1.13 116.57 114.30 1crp h LYS 88 Ca 0.00 -0.03 -0.05 0.00 -1.27 0.00 0.00 60.65 59.30 1crp h LYS 88 Cb 0.00 -0.03 -0.01 0.00 -0.41 0.00 0.00 32.23 31.78 1crp h LYS 88 CO 0.00 0.26 -0.11 0.66 -2.27 0.00 0.00 179.45 177.99 1crp h SER 89 N 0.16 0.27 0.30 4.20 4.64 -1.84 -2.02 113.55 119.27 1crp h SER 89 Ca 0.04 -0.05 -0.01 0.00 -0.47 0.00 0.00 61.79 61.29 1crp h SER 89 Cb 0.26 -0.07 0.00 0.00 -0.31 0.00 0.00 62.40 62.28 1crp h SER 89 CO 0.01 0.41 -0.14 0.15 -0.87 0.00 0.00 176.83 176.39 1crp h PHE 90 N 0.27 -0.37 -0.24 4.77 3.57 -1.47 -2.01 116.94 121.46 1crp h PHE 90 Ca 0.06 -0.01 0.07 0.00 3.53 0.00 0.00 57.97 61.62 1crp h PHE 90 Cb 0.37 0.12 -0.01 0.00 2.79 0.00 0.00 35.95 39.22 1crp h PHE 90 CO 0.01 -0.08 0.28 0.93 -2.23 0.00 0.00 178.31 177.21 1crp h GLU 91 N -0.65 0.00 -0.14 1.11 4.39 -1.31 0.29 114.58 118.27 1crp h GLU 91 Ca -0.04 0.00 -0.14 0.00 0.34 0.00 0.00 59.36 59.52 1crp h GLU 91 Cb 0.46 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.12 1crp h GLU 91 CO 0.07 0.00 -0.47 -0.44 -1.16 0.00 0.00 179.01 177.01 1crp h ASP 92 N 0.00 0.65 -0.16 1.42 3.32 -0.78 -2.97 116.42 117.90 1crp h ASP 92 Ca 0.11 -0.61 0.05 0.00 0.02 0.00 0.00 57.03 56.60 1crp h ASP 92 Cb 0.66 -0.19 -0.01 0.00 0.22 0.00 0.00 39.33 40.02 1crp h ASP 92 CO -0.00 1.15 0.17 0.40 -1.72 0.00 0.00 179.24 179.23 1crp h ILE 93 N 0.19 0.52 0.21 0.35 1.08 -0.24 0.64 117.51 120.26 1crp h ILE 93 Ca -0.02 0.00 -0.01 0.00 -0.39 0.00 0.00 64.86 64.44 1crp h ILE 93 Cb 1.09 0.87 0.00 0.00 -3.07 0.00 0.00 36.82 35.72 1crp h ILE 93 CO 0.10 0.00 -0.11 -0.74 -0.69 0.00 0.00 178.15 176.71 1crp h HIS 94 N 0.00 -0.27 0.00 1.37 -0.00 -1.34 -1.83 115.15 113.07 1crp h HIS 94 Ca 0.07 -0.01 0.00 0.00 -0.00 0.00 0.00 60.37 60.44 1crp h HIS 94 Cb 0.41 0.09 0.00 0.00 -0.00 0.00 0.00 27.41 27.91 1crp h HIS 94 CO 0.00 -0.17 0.00 1.04 -0.00 0.00 0.00 177.93 178.80 1crp n GLN 95 N -2.80 0.98 -0.02 5.26 6.02 -1.08 -3.19 117.38 122.55 1crp n GLN 95 Ca -0.04 0.00 -0.05 0.00 -0.01 0.00 0.00 57.00 56.91 1crp n GLN 95 Cb 0.11 -1.43 -0.13 0.00 1.02 0.00 0.00 30.24 29.82 1crp n GLN 95 CO 0.00 0.00 0.00 0.66 -1.01 0.00 0.00 177.06 176.71 1crp n TYR 96 N -0.93 0.73 0.52 1.08 4.02 0.19 -3.76 117.16 119.02 1crp n TYR 96 Ca 0.20 0.26 0.07 0.00 -0.01 0.00 0.00 57.90 58.42 1crp n TYR 96 Cb 0.09 -1.08 0.20 0.00 -0.02 0.00 0.00 39.34 38.54 1crp n TYR 96 CO 0.00 0.00 0.00 2.89 -1.01 0.00 0.00 176.86 178.74 1crp n ARG 97 N -2.89 2.12 -0.07 -0.72 -4.01 -0.70 -3.95 116.66 106.45 1crp n ARG 97 Ca -0.17 -1.65 -0.09 0.00 -1.04 0.00 0.00 57.85 54.90 1crp n ARG 97 Cb 0.98 -1.39 -0.08 0.00 -3.04 0.00 0.00 32.46 28.93 1crp n ARG 97 CO 0.00 0.00 0.00 -0.85 -3.04 0.00 0.00 177.63 173.74 1crp n GLU 98 N 0.80 0.79 0.29 2.89 0.28 -1.25 -4.38 120.64 120.07 1crp n GLU 98 Ca 0.15 0.06 0.15 0.00 -0.16 0.00 0.00 57.16 57.37 1crp n GLU 98 Cb 0.41 -1.30 0.87 0.00 1.43 0.00 0.00 31.44 32.84 1crp n GLU 98 CO 0.00 0.00 0.00 0.37 -0.16 0.00 0.00 177.13 177.34 1crp h GLN 99 N 0.00 0.00 -0.45 3.44 5.75 -1.68 -0.49 115.11 121.68 1crp h GLN 99 Ca -0.34 0.00 -0.14 0.00 -0.15 0.00 0.00 58.65 58.03 1crp h GLN 99 Cb 1.58 0.00 -0.01 0.00 1.07 0.00 0.00 27.48 30.12 1crp h GLN 99 CO -0.04 0.05 -0.26 0.82 -2.65 0.00 0.00 178.83 176.76 1crp h ILE 100 N 0.00 1.27 0.00 2.39 2.04 -1.77 -1.52 117.51 119.93 1crp h ILE 100 Ca -0.00 -1.43 -0.06 0.00 1.00 0.00 0.00 64.86 64.37 1crp h ILE 100 Cb 0.17 1.20 -0.01 0.00 -0.74 0.00 0.00 36.82 37.44 1crp h ILE 100 CO 0.01 0.49 -0.27 0.11 0.00 0.00 0.00 178.15 178.48 1crp h LYS 101 N 0.82 0.00 0.64 2.37 6.56 -1.29 -2.26 116.57 123.42 1crp h LYS 101 Ca 0.10 0.00 -0.03 0.00 -1.06 0.00 0.00 60.65 59.66 1crp h LYS 101 Cb 0.84 0.00 0.01 0.00 -0.57 0.00 0.00 32.23 32.51 1crp h LYS 101 CO 0.07 0.27 -0.31 -0.09 -2.06 0.00 0.00 179.45 177.34 1crp h ARG 102 N 0.00 -0.83 0.09 3.15 2.43 -0.53 0.50 114.38 119.19 1crp h ARG 102 Ca -0.00 0.06 -0.00 0.00 -0.81 0.00 0.00 59.98 59.22 1crp h ARG 102 Cb 0.54 0.19 -0.01 0.00 -0.42 0.00 0.00 29.97 30.28 1crp h ARG 102 CO 0.04 -0.55 -0.11 0.28 -1.51 0.00 0.00 179.97 178.11 1crp h VAL 103 N -1.13 0.00 0.00 0.20 2.07 -1.25 -1.39 116.25 114.75 1crp h VAL 103 Ca -0.09 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.43 1crp h VAL 103 Cb 0.66 0.00 0.00 0.00 -1.52 0.00 0.00 31.29 30.43 1crp h VAL 103 CO 0.14 0.00 0.00 0.50 0.02 0.00 0.00 177.57 178.23 1crp h LYS 104 N -0.20 0.00 -5.68 1.57 1.63 -1.55 -3.46 116.57 108.88 1crp h LYS 104 Ca -0.01 0.00 -0.35 0.00 -0.85 0.00 0.00 60.65 59.44 1crp h LYS 104 Cb 0.18 0.00 0.16 0.00 -0.60 0.00 0.00 32.23 31.97 1crp h LYS 104 CO -0.03 0.00 -0.73 -3.47 -3.45 0.00 0.00 179.45 171.78 1crp n ASP 105 N -2.66 -3.73 -3.60 4.20 2.03 0.16 -4.97 116.55 107.99 1crp n ASP 105 Ca -0.01 -0.58 -0.04 0.00 0.52 0.00 0.00 54.79 54.68 1crp n ASP 105 Cb 0.12 -5.04 -0.02 0.00 -0.72 0.00 0.00 41.12 35.47 1crp n ASP 105 CO 0.00 0.00 0.00 -0.44 -1.92 0.00 0.00 177.20 174.84 1crp s SER 106 N -3.94 -0.13 -0.80 1.67 0.01 -0.46 -5.00 113.70 105.05 1crp s SER 106 Ca 0.23 -0.02 0.02 0.00 1.31 0.00 0.00 55.95 57.49 1crp s SER 106 Cb -0.10 0.15 0.25 0.00 0.21 0.00 0.00 66.02 66.54 1crp s SER 106 CO 0.72 -0.25 0.93 -0.90 0.41 0.00 0.00 173.24 174.15 1crp n ASP 107 N -0.15 4.48 -2.69 2.44 5.68 -1.26 -4.20 116.55 120.84 1crp n ASP 107 Ca -0.01 -3.37 -0.07 0.00 -0.50 0.00 0.00 54.79 50.84 1crp n ASP 107 Cb 0.59 -0.89 0.08 0.00 -1.14 0.00 0.00 41.12 39.76 1crp n ASP 107 CO 0.00 0.00 0.00 0.47 -1.33 0.00 0.00 177.20 176.34 1crp n ASP 108 N 1.29 -0.34 -4.92 -1.12 8.00 -1.26 -5.12 116.55 113.09 1crp n ASP 108 Ca 0.27 -2.50 -0.30 0.00 0.71 0.00 0.00 54.79 52.97 1crp n ASP 108 Cb 0.38 0.29 -0.04 0.00 -0.02 0.00 0.00 41.12 41.73 1crp n ASP 108 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 1crp s VAL 109 N -1.37 5.30 -1.17 2.53 1.01 -1.26 -4.98 120.40 120.46 1crp s VAL 109 Ca 0.23 -0.30 -0.22 0.00 0.00 0.00 0.00 61.98 61.69 1crp s VAL 109 Cb 0.42 -3.65 -0.03 0.00 0.00 0.00 0.00 36.38 33.12 1crp s VAL 109 CO -0.04 0.05 1.85 -2.16 0.00 0.00 0.00 175.10 174.79 1crp s PRO 110 N -2.73 2.99 0.38 2.72 0.04 -1.26 -4.93 135.00 132.21 1crp s PRO 110 Ca 0.37 -1.29 -0.18 0.00 0.04 0.00 0.00 61.00 59.94 1crp s PRO 110 Cb -0.12 -5.31 -0.10 0.00 0.04 0.00 0.00 34.50 29.00 1crp s PRO 110 CO 0.27 -3.31 0.85 1.41 0.04 0.00 0.00 177.00 176.26 1crp s MET 111 N 5.81 4.13 -0.27 4.56 1.75 -1.26 -2.89 119.30 131.12 1crp s MET 111 Ca 0.63 0.91 0.00 0.00 -1.25 0.00 0.00 55.69 55.98 1crp s MET 111 Cb -0.00 -2.31 0.16 0.00 2.84 0.00 0.00 34.83 35.51 1crp s MET 111 CO 0.08 0.06 0.43 0.08 -0.65 0.00 0.00 175.02 175.03 1crp s VAL 112 N -2.08 -0.69 -0.26 10.11 1.01 -0.98 -4.33 120.40 123.18 1crp s VAL 112 Ca 0.58 -0.16 -0.25 0.00 0.00 0.00 0.00 61.98 62.15 1crp s VAL 112 Cb -0.10 -0.93 -0.00 0.00 0.00 0.00 0.00 36.38 35.36 1crp s VAL 112 CO 0.15 -0.17 0.87 -0.22 0.00 0.00 0.00 175.10 175.73 1crp s LEU 113 N 2.60 4.07 -0.07 3.92 2.96 -0.86 -1.67 118.68 129.63 1crp s LEU 113 Ca 0.12 1.01 0.03 0.00 -0.22 0.00 0.00 54.13 55.07 1crp s LEU 113 Cb -0.14 -3.24 -0.02 0.00 0.50 0.00 0.00 46.19 43.30 1crp s LEU 113 CO -0.24 -0.58 -0.16 -0.69 -1.32 0.00 0.00 176.35 173.36 1crp s VAL 114 N 2.97 2.83 -0.56 1.68 1.01 -1.03 -2.31 120.40 124.99 1crp s VAL 114 Ca 0.36 -0.79 -0.14 0.00 0.00 0.00 0.00 61.98 61.42 1crp s VAL 114 Cb -0.15 -2.11 0.14 0.00 0.00 0.00 0.00 36.38 34.26 1crp s VAL 114 CO 0.09 0.57 0.49 -0.83 0.00 0.00 0.00 175.10 175.42 1crp s GLY 115 N -0.35 2.16 0.73 4.51 0.00 -0.82 -2.17 107.32 111.37 1crp s GLY 115 Ca 0.03 -2.65 -0.12 0.00 0.00 0.00 0.00 44.72 41.98 1crp s GLY 115 CO 0.02 1.18 1.11 0.21 0.00 0.00 0.00 173.10 175.62 1crp s ASN 116 N 3.12 5.19 -0.78 1.64 2.47 -0.56 -0.62 114.94 125.40 1crp s ASN 116 Ca 0.06 1.10 -0.04 0.00 0.42 0.00 0.00 52.86 54.40 1crp s ASN 116 Cb -0.26 -1.84 0.00 0.00 -1.45 0.00 0.00 41.25 37.70 1crp s ASN 116 CO 0.00 -1.50 0.68 0.29 -3.72 0.00 0.00 177.10 172.85 1crp n LYS 117 N -3.10 -4.54 0.08 0.43 5.02 -0.43 -2.43 118.16 113.19 1crp n LYS 117 Ca 0.07 0.50 0.01 0.00 -2.02 0.00 0.00 58.31 56.87 1crp n LYS 117 Cb 0.58 -4.51 -0.04 0.00 -0.02 0.00 0.00 35.03 31.04 1crp n LYS 117 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1crp h ASP 119 N 0.00 0.00 -3.87 0.00 2.03 -1.92 -3.43 116.42 109.23 1crp h ASP 119 Ca -0.09 0.00 -0.56 0.00 -0.73 0.00 0.00 57.03 55.65 1crp h ASP 119 Cb 1.48 0.00 0.15 0.00 -0.83 0.00 0.00 39.33 40.13 1crp h ASP 119 CO 0.05 0.00 0.48 0.18 -1.03 0.00 0.00 179.24 178.92 1crp n LEU 120 N -3.78 5.03 0.01 0.15 4.77 -1.25 -4.93 117.00 116.99 1crp n LEU 120 Ca 0.01 0.94 -0.17 0.00 -0.03 0.00 0.00 56.01 56.76 1crp n LEU 120 Cb 0.31 -1.52 -0.12 0.00 -2.33 0.00 0.00 43.42 39.76 1crp n LEU 120 CO 0.27 -0.92 0.23 0.00 -1.33 0.00 0.00 177.39 175.64 1crp h ALA 121 N 1.19 0.00 -2.83 -1.18 0.00 -1.93 -3.45 119.26 111.06 1crp h ALA 121 Ca -0.50 -0.58 -0.54 0.00 0.00 0.00 0.00 54.91 53.29 1crp h ALA 121 Cb 1.32 0.05 0.14 0.00 0.00 0.00 0.00 17.79 19.30 1crp h ALA 121 CO 0.56 0.27 0.45 0.00 0.00 0.00 0.00 179.25 180.53 1crp s ALA 122 N -2.86 2.33 -0.39 0.00 0.00 -1.26 -5.01 121.76 114.57 1crp s ALA 122 Ca -0.14 1.00 0.03 0.00 0.00 0.00 0.00 51.96 52.84 1crp s ALA 122 Cb 0.02 -3.48 0.16 0.00 0.00 0.00 0.00 23.12 19.81 1crp s ALA 122 CO 0.80 -1.56 0.37 1.03 0.00 0.00 0.00 175.76 176.39 1crp s ARG 123 N -3.60 0.71 0.27 0.00 0.52 -1.26 -4.85 118.95 110.75 1crp s ARG 123 Ca 0.77 -1.19 0.05 0.00 -0.52 0.00 0.00 55.73 54.84 1crp s ARG 123 Cb -0.31 -0.90 0.39 0.00 0.52 0.00 0.00 34.95 34.65 1crp s ARG 123 CO 0.40 -1.25 1.66 1.79 0.02 0.00 0.00 175.30 177.92 1crp h THR 124 N 4.95 1.33 -3.04 0.02 1.35 -1.87 -3.38 112.91 112.26 1crp h THR 124 Ca 0.09 -1.63 -0.65 0.00 -0.55 0.00 0.00 66.41 63.67 1crp h THR 124 Cb 1.02 1.75 -0.16 0.00 -1.73 0.00 0.00 68.15 69.03 1crp h THR 124 CO 0.22 0.49 0.33 -0.69 -0.25 0.00 0.00 175.52 175.63 1crp s VAL 125 N -4.06 4.59 0.51 6.82 1.01 -0.86 -5.01 120.40 123.40 1crp s VAL 125 Ca -0.05 -0.29 -0.23 0.00 0.00 0.00 0.00 61.98 61.41 1crp s VAL 125 Cb 0.13 -4.49 -0.06 0.00 0.00 0.00 0.00 36.38 31.96 1crp s VAL 125 CO 0.78 -1.10 1.34 -1.61 0.00 0.00 0.00 175.10 174.51 1crp s GLU 126 N 3.38 3.35 0.46 2.72 0.41 -1.26 -4.87 118.70 122.88 1crp s GLU 126 Ca 0.21 2.20 0.13 0.00 -0.41 0.00 0.00 54.97 57.10 1crp s GLU 126 Cb -0.17 -2.36 1.03 0.00 -1.78 0.00 0.00 34.13 30.85 1crp s GLU 126 CO 0.13 -1.02 2.05 0.77 -0.49 0.00 0.00 175.26 176.70 1crp h SER 127 N 1.73 0.13 0.27 -0.19 0.02 -1.95 -0.62 113.55 112.95 1crp h SER 127 Ca -0.51 -0.01 -0.10 0.00 -0.84 0.00 0.00 61.79 60.33 1crp h SER 127 Cb 1.29 -0.03 -0.01 0.00 0.14 0.00 0.00 62.40 63.78 1crp h SER 127 CO 0.58 0.18 -0.42 -0.09 -1.14 0.00 0.00 176.83 175.95 1crp h ARG 128 N 0.15 0.19 0.12 3.45 9.65 -1.98 -1.52 114.38 124.45 1crp h ARG 128 Ca 0.04 -0.09 -0.01 0.00 -1.10 0.00 0.00 59.98 58.82 1crp h ARG 128 Cb 0.14 -0.00 0.00 0.00 -1.39 0.00 0.00 29.97 28.72 1crp h ARG 128 CO 0.00 0.58 -0.06 1.96 2.80 0.00 0.00 179.97 185.26 1crp h GLN 129 N 0.16 -0.16 0.00 0.20 4.20 -1.47 -0.88 115.11 117.17 1crp h GLN 129 Ca 0.01 0.01 -0.02 0.00 0.06 0.00 0.00 58.65 58.72 1crp h GLN 129 Cb 0.81 0.04 -0.00 0.00 0.30 0.00 0.00 27.48 28.62 1crp h GLN 129 CO 0.06 0.20 -0.09 0.00 -0.67 0.00 0.00 178.83 178.33 1crp h ALA 130 N 0.28 1.30 0.00 3.87 0.00 -1.39 -1.16 119.26 122.15 1crp h ALA 130 Ca -0.02 -0.08 -0.12 0.00 0.00 0.00 0.00 54.91 54.69 1crp h ALA 130 Cb 0.42 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.18 1crp h ALA 130 CO 0.03 0.11 -0.58 1.96 0.00 0.00 0.00 179.25 180.77 1crp h GLN 131 N 0.00 0.00 0.00 0.00 4.20 -0.99 -2.23 115.11 116.10 1crp h GLN 131 Ca -0.00 0.00 -0.04 0.00 0.06 0.00 0.00 58.65 58.67 1crp h GLN 131 Cb 0.27 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.04 1crp h GLN 131 CO 0.01 0.56 -0.82 -0.44 -0.67 0.00 0.00 178.83 177.47 1crp h ASP 132 N 0.00 0.00 0.19 1.46 3.32 -0.00 -2.61 116.42 118.77 1crp h ASP 132 Ca -0.01 0.00 -0.35 0.00 0.02 0.00 0.00 57.03 56.69 1crp h ASP 132 Cb 1.44 0.00 -0.04 0.00 0.22 0.00 0.00 39.33 40.94 1crp h ASP 132 CO 0.07 0.14 -2.06 -0.11 -1.72 0.00 0.00 179.24 175.56 1crp n LEU 133 N -2.85 1.81 0.02 1.55 7.94 -0.66 -3.79 117.00 121.02 1crp n LEU 133 Ca -0.01 0.17 -0.20 0.00 -1.11 0.00 0.00 56.01 54.86 1crp n LEU 133 Cb 0.61 -0.48 -0.14 0.00 0.53 0.00 0.00 43.42 43.95 1crp n LEU 133 CO 0.39 0.69 -0.16 0.00 -1.11 0.00 0.00 177.39 177.20 1crp h ALA 134 N 0.46 0.04 -0.41 1.96 0.00 -1.55 -3.30 119.26 116.47 1crp h ALA 134 Ca -0.43 -0.87 0.07 0.00 0.00 0.00 0.00 54.91 53.67 1crp h ALA 134 Cb 2.04 0.28 -0.02 0.00 0.00 0.00 0.00 17.79 20.09 1crp h ALA 134 CO 0.04 0.55 0.28 -0.09 0.00 0.00 0.00 179.25 180.04 1crp h ARG 135 N -0.42 0.26 -0.08 0.00 9.65 -1.65 -0.76 114.38 121.38 1crp h ARG 135 Ca -0.21 -0.02 -0.00 0.00 -1.10 0.00 0.00 59.98 58.65 1crp h ARG 135 Cb 1.63 -0.06 -0.00 0.00 -1.39 0.00 0.00 29.97 30.15 1crp h ARG 135 CO 0.08 0.17 0.04 0.66 2.80 0.00 0.00 179.97 183.73 1crp h SER 136 N 0.27 0.10 1.00 -3.80 4.64 -1.66 -2.00 113.55 112.10 1crp h SER 136 Ca 0.18 -0.11 0.00 0.00 -0.47 0.00 0.00 61.79 61.39 1crp h SER 136 Cb 0.38 -0.03 0.00 0.00 -0.31 0.00 0.00 62.40 62.44 1crp h SER 136 CO -0.04 0.18 0.00 -1.22 -0.87 0.00 0.00 176.83 174.88 1crp n TYR 137 N -4.97 0.76 -2.41 4.77 4.01 -0.72 -4.90 117.16 113.69 1crp n TYR 137 Ca -0.06 0.26 -0.03 0.00 -0.16 0.00 0.00 57.90 57.91 1crp n TYR 137 Cb 0.08 -0.93 0.01 0.00 -0.31 0.00 0.00 39.34 38.20 1crp n TYR 137 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1crp n GLY 138 N 0.55 0.48 3.28 2.72 0.00 -0.37 -5.06 105.19 106.78 1crp n GLY 138 Ca 0.04 -0.45 -0.26 0.00 0.00 0.00 0.00 46.02 45.35 1crp n GLY 138 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1crp s ILE 139 N -3.05 1.78 0.46 -0.61 -4.36 -0.95 -5.00 121.20 109.47 1crp s ILE 139 Ca 0.04 -1.29 -0.24 0.00 -0.26 0.00 0.00 60.65 58.90 1crp s ILE 139 Cb -0.02 -1.55 -0.07 0.00 1.25 0.00 0.00 42.46 42.07 1crp s ILE 139 CO 0.12 0.21 1.29 -2.16 0.24 0.00 0.00 174.94 174.64 1crp s PRO 140 N -1.29 3.66 -0.04 0.37 0.04 -1.26 -4.38 135.00 132.10 1crp s PRO 140 Ca 0.08 2.10 0.04 0.00 0.04 0.00 0.00 61.00 63.26 1crp s PRO 140 Cb -0.09 -2.52 -0.03 0.00 0.04 0.00 0.00 34.50 31.90 1crp s PRO 140 CO 0.02 -0.72 -0.15 -0.47 0.04 0.00 0.00 177.00 175.72 1crp s TYR 141 N -1.34 2.69 0.00 0.56 5.04 -1.26 -2.04 117.35 121.00 1crp s TYR 141 Ca 0.63 -0.17 0.00 0.00 -2.44 0.00 0.00 57.07 55.09 1crp s TYR 141 Cb -0.37 -1.61 0.00 0.00 0.35 0.00 0.00 41.96 40.33 1crp s TYR 141 CO 0.45 0.19 0.00 -0.89 -1.34 0.00 0.00 175.55 173.96 1crp n ILE 142 N 2.24 0.00 -3.36 3.14 5.41 -0.98 -5.01 119.36 120.81 1crp n ILE 142 Ca -0.17 0.00 -0.14 0.00 1.00 0.00 0.00 62.75 63.44 1crp n ILE 142 Cb 0.52 0.00 -0.08 0.00 -0.71 0.00 0.00 39.64 39.37 1crp n ILE 142 CO 0.00 0.00 0.00 -1.61 0.00 0.00 0.00 176.55 174.94 1crp s GLU 143 N -1.73 0.41 0.54 0.38 2.02 -1.26 -1.95 118.70 117.11 1crp s GLU 143 Ca 0.00 -0.17 -0.05 0.00 0.02 0.00 0.00 54.97 54.77 1crp s GLU 143 Cb 0.00 -0.54 -0.01 0.00 0.10 0.00 0.00 34.13 33.68 1crp s GLU 143 CO 0.00 -1.06 0.84 0.95 0.02 0.00 0.00 175.26 176.00 1crp s THR 144 N 2.26 4.14 -0.36 3.63 -4.23 0.21 -4.03 115.64 117.27 1crp s THR 144 Ca 0.11 0.03 0.06 0.00 -1.18 0.00 0.00 61.69 60.70 1crp s THR 144 Cb -0.13 -3.60 0.18 0.00 1.34 0.00 0.00 72.50 70.28 1crp s THR 144 CO -0.27 -0.59 0.54 -0.55 -0.54 0.00 0.00 174.62 173.21 1crp s SER 145 N -4.22 -0.72 0.15 3.99 0.15 0.29 -1.31 113.70 112.03 1crp s SER 145 Ca 0.51 -0.70 0.16 0.00 0.70 0.00 0.00 55.95 56.62 1crp s SER 145 Cb -0.10 1.57 0.74 0.00 -1.71 0.00 0.00 66.02 66.51 1crp s SER 145 CO 0.44 -0.24 1.50 0.00 1.20 0.00 0.00 173.24 176.14 1crp n ALA 146 N 4.71 1.40 1.99 5.45 0.00 -1.26 -1.93 120.51 130.87 1crp n ALA 146 Ca 0.08 0.06 0.12 0.00 0.00 0.00 0.00 53.44 53.70 1crp n ALA 146 Cb 0.53 -1.26 0.69 0.00 0.00 0.00 0.00 19.45 19.41 1crp n ALA 146 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 1crp n LYS 147 N -1.91 1.00 -0.59 0.00 4.81 -1.26 -4.13 118.16 116.08 1crp n LYS 147 Ca 0.01 0.00 -0.02 0.00 -0.87 0.00 0.00 58.31 57.43 1crp n LYS 147 Cb 0.13 -1.36 -0.02 0.00 0.02 0.00 0.00 35.03 33.79 1crp n LYS 147 CO 0.00 0.00 0.00 -2.37 1.17 0.00 0.00 177.40 176.20 1crp n THR 148 N -0.86 0.00 -2.84 3.15 5.66 -0.92 -4.98 114.28 113.49 1crp n THR 148 Ca 0.17 0.00 -0.16 0.00 -3.05 0.00 0.00 64.05 61.01 1crp n THR 148 Cb 0.08 0.17 -0.00 0.00 -1.55 0.00 0.00 70.33 69.02 1crp n THR 148 CO 0.00 0.00 0.00 0.54 -3.05 0.00 0.00 175.07 172.56 1crp n ARG 149 N 0.00 -2.81 -3.49 1.09 1.74 -0.81 -4.91 116.66 107.47 1crp n ARG 149 Ca -0.09 0.50 -0.41 0.00 -0.77 0.00 0.00 57.85 57.07 1crp n ARG 149 Cb 0.40 -5.13 -0.10 0.00 -1.02 0.00 0.00 32.46 26.60 1crp n ARG 149 CO 0.00 0.00 0.00 -1.14 -1.52 0.00 0.00 177.63 174.97 1crp s GLN 150 N -5.44 3.41 0.00 5.56 0.74 -0.91 -4.26 119.66 118.75 1crp s GLN 150 Ca 0.17 -0.67 0.00 0.00 0.05 0.00 0.00 55.36 54.91 1crp s GLN 150 Cb -0.09 -3.84 0.00 0.00 1.10 0.00 0.00 33.01 30.18 1crp s GLN 150 CO 0.21 -0.52 0.00 0.41 -0.55 0.00 0.00 175.29 174.84 1crp n GLY 151 N 5.09 3.25 0.37 2.59 0.00 -1.26 0.11 105.19 115.34 1crp n GLY 151 Ca -0.12 0.00 0.06 0.00 0.00 0.00 0.00 46.02 45.97 1crp n GLY 151 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1crp h VAL 152 N 0.00 0.98 -0.02 1.61 2.07 -1.83 -1.25 116.25 117.80 1crp h VAL 152 Ca 0.00 -0.34 -0.20 0.00 0.82 0.00 0.00 66.70 66.99 1crp h VAL 152 Cb 0.00 -0.10 -0.01 0.00 -1.52 0.00 0.00 31.29 29.67 1crp h VAL 152 CO 0.00 0.18 -0.83 -0.33 0.02 0.00 0.00 177.57 176.61 1crp h GLU 153 N 0.99 0.30 0.00 1.57 5.08 -1.90 -2.99 114.58 117.62 1crp h GLU 153 Ca 0.45 -0.29 -0.06 0.00 -1.00 0.00 0.00 59.36 58.46 1crp h GLU 153 Cb 0.38 0.08 -0.01 0.00 0.50 0.00 0.00 28.75 29.70 1crp h GLU 153 CO -0.20 0.97 -0.26 -0.44 -1.00 0.00 0.00 179.01 178.08 1crp h ASP 154 N 0.18 0.00 0.00 1.42 5.19 -1.66 -1.75 116.42 119.80 1crp h ASP 154 Ca -0.05 0.00 -0.01 0.00 -0.62 0.00 0.00 57.03 56.35 1crp h ASP 154 Cb 1.44 0.00 -0.00 0.00 0.18 0.00 0.00 39.33 40.95 1crp h ASP 154 CO 0.13 0.26 -0.09 0.00 -3.12 0.00 0.00 179.24 176.43 1crp h ALA 155 N 1.74 0.01 0.00 3.45 0.00 -1.31 -2.93 119.26 120.22 1crp h ALA 155 Ca -0.00 -0.24 -0.02 0.00 0.00 0.00 0.00 54.91 54.65 1crp h ALA 155 Cb 0.58 0.07 -0.00 0.00 0.00 0.00 0.00 17.79 18.44 1crp h ALA 155 CO 0.03 0.07 -0.07 0.74 0.00 0.00 0.00 179.25 180.02 1crp h PHE 156 N -1.00 0.00 0.06 0.00 0.04 -1.58 -1.57 116.94 112.89 1crp h PHE 156 Ca -0.01 0.00 -0.00 0.00 2.80 0.00 0.00 57.97 60.75 1crp h PHE 156 Cb 0.40 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.55 1crp h PHE 156 CO 0.08 0.07 -0.03 1.88 -0.60 0.00 0.00 178.31 179.71 1crp h TYR 157 N 0.00 -0.08 -0.01 -0.55 -1.99 -1.43 -2.98 116.97 109.93 1crp h TYR 157 Ca -0.00 -0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.73 1crp h TYR 157 Cb 0.26 0.03 -0.00 0.00 2.00 0.00 0.00 36.73 39.02 1crp h TYR 157 CO 0.00 0.15 0.02 1.15 -0.00 0.00 0.00 178.16 179.48 1crp h THR 158 N -1.01 0.15 0.20 -2.88 2.02 -1.47 -2.08 112.91 107.85 1crp h THR 158 Ca -0.01 0.00 -0.01 0.00 0.77 0.00 0.00 66.41 67.16 1crp h THR 158 Cb 0.27 0.98 0.00 0.00 -1.74 0.00 0.00 68.15 67.66 1crp h THR 158 CO 0.01 0.00 -0.10 0.25 0.37 0.00 0.00 175.52 176.06 1crp h LEU 159 N 0.00 -0.23 -2.18 2.58 6.46 -1.33 -2.52 115.31 118.08 1crp h LEU 159 Ca 0.00 -0.28 -0.01 0.00 -0.12 0.00 0.00 57.88 57.47 1crp h LEU 159 Cb 0.05 0.06 -0.00 0.00 -0.73 0.00 0.00 40.66 40.04 1crp h LEU 159 CO -0.00 0.29 -0.06 0.58 -0.62 0.00 0.00 178.44 178.63 1crp h VAL 160 N -0.89 0.56 -0.07 1.05 2.07 -1.30 -1.98 116.25 115.68 1crp h VAL 160 Ca -0.03 -0.28 -0.20 0.00 0.82 0.00 0.00 66.70 67.01 1crp h VAL 160 Cb 0.50 1.18 0.00 0.00 -1.52 0.00 0.00 31.29 31.45 1crp h VAL 160 CO 0.05 0.06 -0.80 0.03 0.02 0.00 0.00 177.57 176.93 1crp h ARG 161 N 0.00 0.50 -0.32 1.57 3.08 -1.37 -2.01 114.38 115.84 1crp h ARG 161 Ca -0.00 -0.44 -0.12 0.00 0.07 0.00 0.00 59.98 59.50 1crp h ARG 161 Cb 0.17 0.10 -0.01 0.00 0.08 0.00 0.00 29.97 30.32 1crp h ARG 161 CO 0.01 1.07 -0.26 0.93 -1.07 0.00 0.00 179.97 180.65 1crp h GLU 162 N 0.32 0.74 -0.22 0.04 5.08 -0.91 -2.72 114.58 116.90 1crp h GLU 162 Ca -0.05 -0.37 -0.09 0.00 -1.00 0.00 0.00 59.36 57.86 1crp h GLU 162 Cb 1.40 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.64 1crp h GLU 162 CO 0.14 0.98 -0.25 0.82 -1.00 0.00 0.00 179.01 179.71 1crp h ILE 163 N 0.50 1.26 0.68 3.13 2.04 -1.48 -2.82 117.51 120.81 1crp h ILE 163 Ca 0.06 -1.22 -0.03 0.00 1.00 0.00 0.00 64.86 64.66 1crp h ILE 163 Cb 0.82 1.36 0.01 0.00 -0.74 0.00 0.00 36.82 38.27 1crp h ILE 163 CO 0.07 0.38 -0.33 -0.09 0.00 0.00 0.00 178.15 178.19 1crp h ARG 164 N 0.37 -0.88 -0.16 2.37 2.43 -1.20 -3.25 114.38 114.06 1crp h ARG 164 Ca 0.06 0.06 0.04 0.00 -0.81 0.00 0.00 59.98 59.33 1crp h ARG 164 Cb 0.64 0.20 -0.07 0.00 -0.42 0.00 0.00 29.97 30.32 1crp h ARG 164 CO 0.05 -0.59 -0.44 0.37 -1.51 0.00 0.00 179.97 177.85 1crp h GLN 165 N -0.97 -0.47 0.00 0.20 -0.00 -1.51 -3.51 115.11 108.85 1crp h GLN 165 Ca -0.09 0.03 0.00 0.00 -0.00 0.00 0.00 58.65 58.59 1crp h GLN 165 Cb 0.70 0.11 0.00 0.00 0.00 0.00 0.00 27.48 28.29 1crp h GLN 165 CO 0.15 -0.31 0.00 1.58 0.00 0.00 0.00 178.83 180.25