#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 3.98 -0.13 3.17 2.01 -1.25 -4.79 115.64 118.64 1crp s THR 2 Ca 0.00 0.80 0.00 0.00 0.31 0.00 0.00 61.69 62.80 1crp s THR 2 Cb 0.00 -3.43 0.02 0.00 0.01 0.00 0.00 72.50 69.10 1crp s THR 2 CO 0.00 -0.69 -0.12 -0.70 -0.69 0.00 0.00 174.62 172.41 1crp s GLU 3 N -4.53 2.04 0.32 4.92 -6.30 -1.26 -1.81 118.70 112.07 1crp s GLU 3 Ca 0.61 -0.47 0.10 0.00 -2.50 0.00 0.00 54.97 52.71 1crp s GLU 3 Cb -0.15 -1.88 -0.05 0.00 0.00 0.00 0.00 34.13 32.05 1crp s GLU 3 CO 0.45 -0.20 -0.04 0.71 0.02 0.00 0.00 175.26 176.20 1crp s TYR 4 N 1.41 2.52 0.01 5.30 2.02 -0.77 -4.97 117.35 122.87 1crp s TYR 4 Ca 0.02 -0.38 0.07 0.00 -0.37 0.00 0.00 57.07 56.41 1crp s TYR 4 Cb -0.13 -1.34 -0.03 0.00 -0.40 0.00 0.00 41.96 40.06 1crp s TYR 4 CO -0.08 0.56 -0.21 0.15 -1.57 0.00 0.00 175.55 174.40 1crp s LYS 5 N -3.66 2.09 -0.89 -0.62 1.02 -1.26 -2.24 119.74 114.17 1crp s LYS 5 Ca 0.33 -0.95 -0.05 0.00 0.02 0.00 0.00 55.97 55.32 1crp s LYS 5 Cb -0.02 -2.13 0.22 0.00 -0.52 0.00 0.00 37.83 35.38 1crp s LYS 5 CO 0.18 0.55 0.80 -0.51 -0.92 0.00 0.00 175.35 175.46 1crp s LEU 6 N -1.07 5.84 -0.73 3.17 1.43 -0.73 -1.86 118.68 124.74 1crp s LEU 6 Ca 0.12 -3.42 -0.26 0.00 -1.03 0.00 0.00 54.13 49.55 1crp s LEU 6 Cb -0.10 -2.01 -0.10 0.00 0.03 0.00 0.00 46.19 44.00 1crp s LEU 6 CO 0.02 -0.29 2.32 -0.69 0.23 0.00 0.00 176.35 177.94 1crp s VAL 7 N -0.92 3.08 0.21 -1.59 1.01 0.31 -2.21 120.40 120.30 1crp s VAL 7 Ca 0.25 -0.04 -0.21 0.00 0.00 0.00 0.00 61.98 61.98 1crp s VAL 7 Cb -0.10 -3.20 -0.08 0.00 0.00 0.00 0.00 36.38 32.99 1crp s VAL 7 CO -0.09 -0.19 0.74 -0.69 0.00 0.00 0.00 175.10 174.87 1crp s VAL 8 N 13.28 4.52 0.08 2.92 1.01 -0.88 -1.52 120.40 139.81 1crp s VAL 8 Ca 0.89 1.37 -0.16 0.00 0.00 0.00 0.00 61.98 64.08 1crp s VAL 8 Cb -0.13 -3.91 0.03 0.00 0.00 0.00 0.00 36.38 32.37 1crp s VAL 8 CO 0.12 0.26 0.39 -0.69 0.00 0.00 0.00 175.10 175.18 1crp s VAL 9 N -1.46 0.07 -3.72 2.92 1.01 -1.14 -4.67 120.40 113.40 1crp s VAL 9 Ca 0.42 -0.56 0.00 0.00 0.00 0.00 0.00 61.98 61.84 1crp s VAL 9 Cb -0.18 -1.06 0.00 0.00 0.00 0.00 0.00 36.38 35.14 1crp s VAL 9 CO 0.22 -0.31 0.00 0.61 0.00 0.00 0.00 175.10 175.62 1crp n GLY 10 N 0.18 -0.44 3.99 4.51 0.00 -1.26 -1.11 105.19 111.05 1crp n GLY 10 Ca -0.17 -0.72 -0.20 0.00 0.00 0.00 0.00 46.02 44.93 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 4.12 -0.75 4.61 0.00 -1.26 -4.99 121.76 122.49 1crp s ALA 11 Ca 0.00 -1.45 -0.04 0.00 0.00 0.00 0.00 51.96 50.47 1crp s ALA 11 Cb 0.00 -1.92 0.11 0.00 0.00 0.00 0.00 23.12 21.31 1crp s ALA 11 CO 0.00 -0.58 2.58 0.41 0.00 0.00 0.00 175.76 178.17 1crp n GLY 12 N -2.17 4.74 0.00 0.00 0.00 -1.26 -3.97 105.19 102.53 1crp n GLY 12 Ca 0.08 -2.00 0.00 0.00 0.00 0.00 0.00 46.02 44.10 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 1.00 0.00 0.03 -0.02 0.00 -1.26 -5.03 105.19 99.91 1crp n GLY 13 Ca 0.53 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.54 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 0.41 0.00 1.61 0.24 -1.25 -4.97 118.33 114.36 1crp n VAL 14 Ca 0.00 -0.35 0.00 0.00 -2.04 0.00 0.00 64.34 61.95 1crp n VAL 14 Cb 0.00 -0.35 0.00 0.00 -1.47 0.00 0.00 33.84 32.02 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 2.20 1.85 0.30 7.63 0.00 -1.26 -4.51 105.19 111.40 1crp n GLY 15 Ca -0.10 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.81 1crp n GLY 15 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1crp h LYS 16 N 0.00 -0.67 0.79 1.61 1.57 -1.95 -2.21 116.57 115.71 1crp h LYS 16 Ca 0.00 0.05 -0.04 0.00 -1.87 0.00 0.00 60.65 58.79 1crp h LYS 16 Cb 0.00 0.15 0.01 0.00 0.08 0.00 0.00 32.23 32.47 1crp h LYS 16 CO 0.00 -0.45 -0.38 0.77 -0.57 0.00 0.00 179.45 178.82 1crp h SER 17 N -1.09 -0.90 -1.09 0.86 0.02 -1.96 -2.38 113.55 107.01 1crp h SER 17 Ca -0.07 0.02 0.31 0.00 -0.84 0.00 0.00 61.79 61.20 1crp h SER 17 Cb 0.54 0.23 -0.11 0.00 0.14 0.00 0.00 62.40 63.20 1crp h SER 17 CO 0.12 -0.56 0.69 0.00 -1.14 0.00 0.00 176.83 175.93 1crp h ALA 18 N -1.12 2.26 -0.27 3.77 0.00 -1.88 0.36 119.26 122.39 1crp h ALA 18 Ca -0.11 0.09 -0.03 0.00 0.00 0.00 0.00 54.91 54.86 1crp h ALA 18 Cb 0.83 0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.69 1crp h ALA 18 CO 0.18 -0.75 0.03 -0.07 0.00 0.00 0.00 179.25 178.64 1crp h LEU 19 N 0.34 0.44 0.26 0.00 3.38 -1.21 -1.40 115.31 117.12 1crp h LEU 19 Ca 0.67 -0.27 -0.01 0.00 0.09 0.00 0.00 57.88 58.35 1crp h LEU 19 Cb 1.73 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 42.37 1crp h LEU 19 CO -0.38 0.60 -0.13 0.74 0.09 0.00 0.00 178.44 179.37 1crp h THR 20 N 0.27 0.00 -0.76 0.22 2.02 0.20 -2.64 112.91 112.21 1crp h THR 20 Ca 0.08 -0.00 0.22 0.00 0.77 0.00 0.00 66.41 67.48 1crp h THR 20 Cb 0.36 0.00 -0.03 0.00 -1.74 0.00 0.00 68.15 66.73 1crp h THR 20 CO 0.01 0.00 0.70 0.40 0.37 0.00 0.00 175.52 176.99 1crp h ILE 21 N -0.35 0.33 0.80 3.11 5.03 -1.34 -1.59 117.51 123.50 1crp h ILE 21 Ca -0.04 0.00 -0.04 0.00 -0.12 0.00 0.00 64.86 64.66 1crp h ILE 21 Cb 0.27 0.47 0.01 0.00 -3.03 0.00 0.00 36.82 34.54 1crp h ILE 21 CO 0.06 0.00 -0.38 -0.61 -0.68 0.00 0.00 178.15 176.54 1crp h GLN 22 N 0.00 -1.03 0.00 2.37 4.15 -0.90 0.20 115.11 119.90 1crp h GLN 22 Ca 0.36 0.07 0.00 0.00 0.77 0.00 0.00 58.65 59.85 1crp h GLN 22 Cb 1.75 0.23 0.00 0.00 0.21 0.00 0.00 27.48 29.68 1crp h GLN 22 CO -0.00 -0.68 0.00 -0.11 -1.93 0.00 0.00 178.83 176.11 1crp n LEU 23 N -5.50 0.57 -0.00 -2.39 0.00 -0.64 -1.89 117.00 107.14 1crp n LEU 23 Ca -0.14 0.70 0.10 0.00 0.00 0.00 0.00 56.01 56.67 1crp n LEU 23 Cb 0.43 -0.69 -0.13 0.00 0.00 0.00 0.00 43.42 43.04 1crp n LEU 23 CO 0.35 -0.73 -0.12 -0.38 0.00 0.00 0.00 177.39 176.50 1crp n ILE 24 N -2.19 0.00 0.00 1.96 5.41 -0.94 -4.95 119.36 118.65 1crp n ILE 24 Ca 0.00 -0.05 0.00 0.00 1.00 0.00 0.00 62.75 63.70 1crp n ILE 24 Cb 0.13 0.89 0.00 0.00 -0.71 0.00 0.00 39.64 39.95 1crp n ILE 24 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1crp n GLN 25 N -1.58 0.00 0.00 0.38 6.02 0.68 -5.05 117.38 117.83 1crp n GLN 25 Ca 0.03 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 57.02 1crp n GLN 25 Cb 0.35 0.00 0.00 0.00 1.02 0.00 0.00 30.24 31.61 1crp n GLN 25 CO 0.00 0.00 0.00 0.27 -1.01 0.00 0.00 177.06 176.32 1crp n ASN 26 N 0.00 0.00 -2.53 1.08 2.04 -1.20 -4.97 115.26 109.68 1crp n ASN 26 Ca 0.00 0.00 -0.09 0.00 -0.44 0.00 0.00 54.58 54.05 1crp n ASN 26 Cb 0.00 0.00 0.01 0.00 -2.53 0.00 0.00 39.78 37.26 1crp n ASN 26 CO 0.00 0.00 0.00 0.00 -0.44 0.00 0.00 177.26 176.82 1crp n HIS 27 N 0.00 -1.94 -3.97 -2.53 1.44 -1.26 -5.11 115.22 101.86 1crp n HIS 27 Ca 0.00 -1.65 -0.31 0.00 -2.01 0.00 0.00 57.72 53.75 1crp n HIS 27 Cb 0.00 0.70 -0.15 0.00 0.12 0.00 0.00 29.99 30.66 1crp n HIS 27 CO 0.00 0.00 0.00 0.12 -2.81 0.00 0.00 176.34 173.65 1crp s PHE 28 N -3.31 3.37 0.08 -1.40 5.36 -1.26 -4.50 117.98 116.32 1crp s PHE 28 Ca 0.16 -2.91 -0.31 0.00 -0.96 0.00 0.00 56.93 52.91 1crp s PHE 28 Cb -0.03 -2.75 -0.07 0.00 -0.34 0.00 0.00 43.02 39.82 1crp s PHE 28 CO 0.12 -0.89 1.40 0.14 -1.46 0.00 0.00 175.22 174.53 1crp s VAL 29 N 0.65 3.40 -0.24 3.12 -7.23 -1.26 -4.90 120.40 113.95 1crp s VAL 29 Ca 0.13 0.96 0.11 0.00 -1.81 0.00 0.00 61.98 61.37 1crp s VAL 29 Cb -0.21 -3.62 0.25 0.00 0.56 0.00 0.00 36.38 33.37 1crp s VAL 29 CO -0.07 0.05 1.18 -0.90 -0.31 0.00 0.00 175.10 175.05 1crp n ASP 30 N 4.35 2.65 -2.68 4.85 5.68 -1.26 -4.71 116.55 125.43 1crp n ASP 30 Ca 0.12 -2.57 -0.06 0.00 -0.50 0.00 0.00 54.79 51.78 1crp n ASP 30 Cb 0.43 -0.29 0.11 0.00 -1.14 0.00 0.00 41.12 40.22 1crp n ASP 30 CO 0.00 0.00 0.00 -1.84 -1.33 0.00 0.00 177.20 174.03 1crp n GLU 31 N -0.64 1.10 -2.19 0.11 0.28 -1.26 -5.13 120.64 112.91 1crp n GLU 31 Ca 0.12 -1.65 -0.40 0.00 -0.16 0.00 0.00 57.16 55.07 1crp n GLU 31 Cb 0.54 -0.00 -0.02 0.00 1.43 0.00 0.00 31.44 33.38 1crp n GLU 31 CO 0.00 0.00 0.00 -0.47 -0.16 0.00 0.00 177.13 176.50 1crp s TYR 32 N 0.18 3.10 -0.06 -1.84 5.04 -1.26 -4.92 117.35 117.59 1crp s TYR 32 Ca 0.19 1.48 -0.29 0.00 -2.44 0.00 0.00 57.07 56.00 1crp s TYR 32 Cb 0.37 -3.58 -0.07 0.00 0.35 0.00 0.00 41.96 39.03 1crp s TYR 32 CO -0.08 -1.61 1.91 -0.51 -1.34 0.00 0.00 175.55 173.91 1crp s ASP 33 N -0.67 6.30 -0.06 4.32 1.11 -1.26 -4.86 116.67 121.55 1crp s ASP 33 Ca 0.50 2.32 -0.03 0.00 0.18 0.00 0.00 52.55 55.52 1crp s ASP 33 Cb -0.37 -2.53 -0.12 0.00 1.07 0.00 0.00 42.92 40.98 1crp s ASP 33 CO 0.49 -1.22 2.90 -0.81 1.18 0.00 0.00 175.17 177.70 1crp n PRO 34 N 7.70 1.69 -1.49 8.23 -0.04 -1.26 -3.93 135.00 145.90 1crp n PRO 34 Ca 0.21 -0.83 0.01 0.00 -0.04 0.00 0.00 63.50 62.85 1crp n PRO 34 Cb 0.43 -1.65 0.00 0.00 -0.04 0.00 0.00 33.50 32.23 1crp n PRO 34 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 1crp n THR 35 N 1.87 0.07 -5.01 0.52 -2.24 -1.26 -4.59 114.28 103.64 1crp n THR 35 Ca 0.28 -0.88 -0.30 0.00 -2.27 0.00 0.00 64.05 60.88 1crp n THR 35 Cb 0.72 0.90 -0.17 0.00 -2.10 0.00 0.00 70.33 69.69 1crp n THR 35 CO 0.00 0.00 0.00 -0.63 -0.57 0.00 0.00 175.07 173.87 1crp s ILE 36 N -0.22 1.83 -0.04 2.28 1.01 -1.25 -4.98 121.20 119.83 1crp s ILE 36 Ca 0.25 -0.88 -0.00 0.00 0.00 0.00 0.00 60.65 60.02 1crp s ILE 36 Cb 0.30 -1.60 0.03 0.00 0.01 0.00 0.00 42.46 41.19 1crp s ILE 36 CO -0.12 0.51 0.01 -1.61 0.00 0.00 0.00 174.94 173.73 1crp s GLU 37 N 0.47 0.30 0.00 2.79 8.01 -1.26 -4.70 118.70 124.31 1crp s GLU 37 Ca -0.17 0.12 0.00 0.00 0.01 0.00 0.00 54.97 54.93 1crp s GLU 37 Cb -0.17 -0.57 0.00 0.00 -4.31 0.00 0.00 34.13 29.08 1crp s GLU 37 CO 0.07 -0.19 0.00 -3.47 0.01 0.00 0.00 175.26 171.68 1crp n ASP 38 N 4.47 0.00 -3.20 -0.19 2.03 -1.26 -5.13 116.55 113.27 1crp n ASP 38 Ca -0.20 0.00 0.04 0.00 0.52 0.00 0.00 54.79 55.15 1crp n ASP 38 Cb 0.50 0.00 -0.02 0.00 -0.72 0.00 0.00 41.12 40.88 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 -0.55 0.93 1.67 1.04 -1.26 -4.86 113.70 112.67 1crp s SER 39 Ca 0.00 0.43 -0.11 0.00 0.48 0.00 0.00 55.95 56.75 1crp s SER 39 Cb 0.00 1.49 0.15 0.00 0.10 0.00 0.00 66.02 67.77 1crp s SER 39 CO 0.00 -0.10 1.09 -0.31 0.98 0.00 0.00 173.24 174.90 1crp s TYR 40 N 2.81 2.06 -0.03 5.02 2.02 -0.96 -4.80 117.35 123.46 1crp s TYR 40 Ca 0.01 1.35 -0.07 0.00 -0.37 0.00 0.00 57.07 57.99 1crp s TYR 40 Cb -0.09 -3.17 0.01 0.00 -0.40 0.00 0.00 41.96 38.30 1crp s TYR 40 CO -0.13 -2.67 0.15 1.03 -1.57 0.00 0.00 175.55 172.36 1crp s ARG 41 N -4.81 0.36 -0.12 -0.62 0.52 -1.26 -2.05 118.95 110.97 1crp s ARG 41 Ca 0.65 -0.11 -0.06 0.00 -0.52 0.00 0.00 55.73 55.68 1crp s ARG 41 Cb -0.20 0.16 0.05 0.00 0.52 0.00 0.00 34.95 35.48 1crp s ARG 41 CO 0.58 -0.07 0.29 0.21 0.02 0.00 0.00 175.30 176.32 1crp s LYS 42 N -0.72 0.25 -0.83 3.54 2.47 -1.21 -5.01 119.74 118.23 1crp s LYS 42 Ca -0.08 0.59 -0.04 0.00 -1.56 0.00 0.00 55.97 54.88 1crp s LYS 42 Cb -0.05 -0.10 0.21 0.00 -1.46 0.00 0.00 37.83 36.43 1crp s LYS 42 CO 0.01 -0.16 0.70 -1.14 0.16 0.00 0.00 175.35 174.92 1crp s GLN 43 N 1.28 3.17 0.47 4.03 0.74 -1.26 -2.25 119.66 125.85 1crp s GLN 43 Ca -0.09 -2.99 0.04 0.00 0.05 0.00 0.00 55.36 52.37 1crp s GLN 43 Cb -0.10 -3.98 -0.03 0.00 1.10 0.00 0.00 33.01 30.00 1crp s GLN 43 CO -0.09 -1.24 0.07 0.14 -0.55 0.00 0.00 175.29 173.62 1crp s VAL 44 N -0.84 1.65 -0.13 1.34 -7.23 -1.26 -5.02 120.40 108.91 1crp s VAL 44 Ca 0.24 -1.90 -0.01 0.00 -1.81 0.00 0.00 61.98 58.50 1crp s VAL 44 Cb -0.11 -2.55 -0.02 0.00 0.56 0.00 0.00 36.38 34.26 1crp s VAL 44 CO -0.09 0.00 -0.11 -0.69 -0.31 0.00 0.00 175.10 173.90 1crp s VAL 45 N -2.77 3.25 0.00 1.32 1.01 -1.26 -3.07 120.40 118.87 1crp s VAL 45 Ca 0.23 -0.60 -0.05 0.00 0.00 0.00 0.00 61.98 61.57 1crp s VAL 45 Cb 0.04 -2.37 -0.03 0.00 0.00 0.00 0.00 36.38 34.02 1crp s VAL 45 CO 0.12 0.52 0.80 0.40 0.00 0.00 0.00 175.10 176.95 1crp h ILE 46 N 5.24 0.00 -0.02 2.22 1.08 -1.82 -3.44 117.51 120.78 1crp h ILE 46 Ca -0.29 -0.04 -0.15 0.00 -0.39 0.00 0.00 64.86 63.99 1crp h ILE 46 Cb 1.20 0.00 -0.20 0.00 -3.07 0.00 0.00 36.82 34.75 1crp h ILE 46 CO 0.57 0.00 -0.48 0.47 -0.69 0.00 0.00 178.15 178.02 1crp n ASP 47 N -2.57 -0.55 0.00 1.72 9.92 -1.26 -4.95 116.55 118.87 1crp n ASP 47 Ca -0.02 -2.04 0.00 0.00 -0.53 0.00 0.00 54.79 52.20 1crp n ASP 47 Cb 0.07 0.20 0.00 0.00 -0.64 0.00 0.00 41.12 40.75 1crp n ASP 47 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1crp n GLY 48 N -0.18 1.21 3.58 0.44 0.00 -1.26 -5.12 105.19 103.86 1crp n GLY 48 Ca -0.18 -0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.50 1crp n GLY 48 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1crp s GLU 49 N 0.00 3.18 -0.28 1.61 8.01 -1.26 -5.09 118.70 124.87 1crp s GLU 49 Ca 0.00 -0.50 -0.18 0.00 0.01 0.00 0.00 54.97 54.31 1crp s GLU 49 Cb 0.00 -2.77 -0.02 0.00 -4.31 0.00 0.00 34.13 27.02 1crp s GLU 49 CO 0.00 0.51 0.50 0.99 0.01 0.00 0.00 175.26 177.27 1crp s THR 50 N -0.37 5.07 -0.08 3.63 2.01 -1.26 -2.27 115.64 122.37 1crp s THR 50 Ca 0.06 0.75 0.02 0.00 0.31 0.00 0.00 61.69 62.83 1crp s THR 50 Cb -0.12 -3.84 0.02 0.00 0.01 0.00 0.00 72.50 68.57 1crp s THR 50 CO 0.02 0.04 -0.12 0.00 -0.69 0.00 0.00 174.62 173.88 1crp s LEU 52 N 0.92 4.11 -0.44 0.00 0.20 -0.75 -4.31 118.68 118.42 1crp s LEU 52 Ca -0.10 1.82 -0.08 0.00 0.69 0.00 0.00 54.13 56.46 1crp s LEU 52 Cb -0.15 -3.53 0.10 0.00 -0.43 0.00 0.00 46.19 42.17 1crp s LEU 52 CO 0.01 -1.00 0.28 -0.76 -0.29 0.00 0.00 176.35 174.59 1crp s LEU 53 N 4.29 5.36 0.75 -0.68 1.02 -0.95 -1.85 118.68 126.62 1crp s LEU 53 Ca 0.66 -1.73 -0.11 0.00 0.02 0.00 0.00 54.13 52.97 1crp s LEU 53 Cb -0.26 -1.97 0.04 0.00 0.02 0.00 0.00 46.19 44.02 1crp s LEU 53 CO 0.25 -0.60 1.08 -0.62 0.02 0.00 0.00 176.35 176.48 1crp s ASP 54 N 2.30 4.91 -0.08 2.29 2.15 -0.95 -3.33 116.67 123.96 1crp s ASP 54 Ca 0.05 1.42 -0.00 0.00 0.43 0.00 0.00 52.55 54.44 1crp s ASP 54 Cb -0.24 -2.22 0.02 0.00 -0.30 0.00 0.00 42.92 40.18 1crp s ASP 54 CO 0.00 -1.72 -0.05 -0.63 -0.17 0.00 0.00 175.17 172.60 1crp s ILE 55 N -3.12 0.70 -0.92 4.11 -1.09 -0.87 -1.77 121.20 118.23 1crp s ILE 55 Ca 0.59 -0.13 -0.10 0.00 -2.23 0.00 0.00 60.65 58.78 1crp s ILE 55 Cb -0.14 -0.75 0.24 0.00 -1.58 0.00 0.00 42.46 40.23 1crp s ILE 55 CO 0.54 0.29 0.87 -0.22 -1.23 0.00 0.00 174.94 175.20 1crp s LEU 56 N 1.46 6.37 0.19 2.97 2.96 -0.94 -2.27 118.68 129.42 1crp s LEU 56 Ca -0.02 -3.14 0.26 0.00 -0.22 0.00 0.00 54.13 51.02 1crp s LEU 56 Cb -0.13 -2.15 0.81 0.00 0.50 0.00 0.00 46.19 45.22 1crp s LEU 56 CO -0.04 -0.41 1.76 -0.67 -1.32 0.00 0.00 176.35 175.67 1crp n ASP 57 N 3.31 0.76 -0.62 3.68 2.03 -1.26 -2.08 116.55 122.36 1crp n ASP 57 Ca 0.18 0.54 0.03 0.00 0.52 0.00 0.00 54.79 56.05 1crp n ASP 57 Cb 0.42 -0.72 -0.01 0.00 -0.72 0.00 0.00 41.12 40.10 1crp n ASP 57 CO 0.00 0.00 0.00 0.35 -1.92 0.00 0.00 177.20 175.63 1crp n THR 58 N -2.20 0.00 -3.40 5.18 -2.24 -1.26 -4.90 114.28 105.46 1crp n THR 58 Ca 0.06 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.84 1crp n THR 58 Cb 0.42 -0.06 0.00 0.00 -2.10 0.00 0.00 70.33 68.59 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 -0.34 0.00 -1.00 6.98 0.00 -1.26 -4.92 120.51 119.97 1crp n ALA 59 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1crp n ALA 59 Cb 0.08 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.53 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 -1.68 0.00 0.00 0.00 -1.26 -5.05 105.19 97.19 1crp n GLY 60 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1crp n GLY 60 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1crp n GLN 61 N -0.01 0.00 -0.81 1.61 10.64 -1.26 -4.86 117.38 122.69 1crp n GLN 61 Ca 0.00 0.00 -0.01 0.00 -1.83 0.00 0.00 57.00 55.16 1crp n GLN 61 Cb 0.00 0.00 -0.01 0.00 -0.86 0.00 0.00 30.24 29.37 1crp n GLN 61 CO 0.00 0.00 0.00 0.39 -1.83 0.00 0.00 177.06 175.62 1crp n GLU 62 N -0.51 0.00 0.00 2.61 -0.58 -1.26 -4.95 120.64 115.95 1crp n GLU 62 Ca 0.00 -0.92 0.00 0.00 -0.42 0.00 0.00 57.16 55.82 1crp n GLU 62 Cb 0.00 -0.05 0.00 0.00 -0.57 0.00 0.00 31.44 30.82 1crp n GLU 62 CO 0.00 0.00 0.00 0.39 -0.48 0.00 0.00 177.13 177.04 1crp n GLU 63 N 0.11 0.00 -2.59 3.49 1.02 -1.26 -5.07 120.64 116.34 1crp n GLU 63 Ca -0.04 0.00 -0.04 0.00 -0.02 0.00 0.00 57.16 57.06 1crp n GLU 63 Cb 0.74 0.00 -0.03 0.00 -0.02 0.00 0.00 31.44 32.12 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 -4.24 -2.64 -0.32 4.19 -1.26 -4.78 117.16 108.11 1crp n TYR 64 Ca 0.00 2.31 -0.43 0.00 3.31 0.00 0.00 57.90 63.09 1crp n TYR 64 Cb 0.00 -3.89 -0.00 0.00 0.49 0.00 0.00 39.34 35.94 1crp n TYR 64 CO 0.00 0.00 0.00 -1.54 0.91 0.00 0.00 176.86 176.23 1crp s SER 65 N -0.91 6.83 -0.02 2.98 1.04 -1.26 -4.53 113.70 117.82 1crp s SER 65 Ca -0.20 -2.42 0.07 0.00 0.48 0.00 0.00 55.95 53.88 1crp s SER 65 Cb 0.01 -2.55 -0.10 0.00 0.10 0.00 0.00 66.02 63.49 1crp s SER 65 CO 0.77 -1.14 0.12 0.00 0.98 0.00 0.00 173.24 173.97 1crp n ALA 66 N 7.99 2.15 0.32 5.32 0.00 -1.26 -4.53 120.51 130.50 1crp n ALA 66 Ca 0.45 -0.23 0.14 0.00 0.00 0.00 0.00 53.44 53.80 1crp n ALA 66 Cb 0.46 -0.14 0.62 0.00 0.00 0.00 0.00 19.45 20.39 1crp n ALA 66 CO 0.00 0.00 0.00 1.98 0.00 0.00 0.00 177.50 179.48 1crp h MET 67 N 0.00 0.00 0.00 0.00 4.05 -1.96 -2.30 114.93 114.71 1crp h MET 67 Ca -0.05 0.00 -0.09 0.00 -0.28 0.00 0.00 59.70 59.28 1crp h MET 67 Cb 0.60 0.00 -0.01 0.00 -0.80 0.00 0.00 31.60 31.38 1crp h MET 67 CO 0.00 0.00 -0.44 -0.09 0.23 0.00 0.00 176.91 176.61 1crp h ARG 68 N 0.00 0.00 0.05 0.39 1.12 -1.95 -2.68 114.38 111.30 1crp h ARG 68 Ca 0.00 0.00 -0.00 0.00 -1.11 0.00 0.00 59.98 58.87 1crp h ARG 68 Cb 0.29 0.00 0.00 0.00 -0.01 0.00 0.00 29.97 30.25 1crp h ARG 68 CO 0.00 0.44 -0.02 0.22 -3.11 0.00 0.00 179.97 177.50 1crp h ASP 69 N 0.00 -0.05 0.06 -3.80 1.82 -1.72 -2.82 116.42 109.91 1crp h ASP 69 Ca -0.00 -0.41 -0.00 0.00 -0.39 0.00 0.00 57.03 56.22 1crp h ASP 69 Cb 0.81 0.01 -0.00 0.00 0.68 0.00 0.00 39.33 40.84 1crp h ASP 69 CO 0.06 0.40 -0.01 0.06 -1.61 0.00 0.00 179.24 178.13 1crp h GLN 70 N -0.51 0.00 -0.36 0.28 3.07 -1.63 -1.47 115.11 114.48 1crp h GLN 70 Ca -0.01 0.00 -0.14 0.00 0.09 0.00 0.00 58.65 58.59 1crp h GLN 70 Cb 0.46 0.00 -0.01 0.00 0.08 0.00 0.00 27.48 28.01 1crp h GLN 70 CO 0.01 0.01 -0.35 1.88 0.09 0.00 0.00 178.83 180.47 1crp h TYR 71 N 0.00 0.98 0.00 0.06 0.05 -1.23 -1.49 116.97 115.35 1crp h TYR 71 Ca -0.00 -0.28 -0.00 0.00 0.05 0.00 0.00 58.73 58.50 1crp h TYR 71 Cb 0.04 -0.21 -0.00 0.00 1.01 0.00 0.00 36.73 37.57 1crp h TYR 71 CO 0.00 1.06 -0.01 0.52 -1.05 0.00 0.00 178.16 178.68 1crp h MET 72 N 0.69 0.00 0.00 4.88 2.86 -1.13 -0.44 114.93 121.79 1crp h MET 72 Ca 0.07 0.00 -0.05 0.00 -2.06 0.00 0.00 59.70 57.66 1crp h MET 72 Cb 0.91 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.56 1crp h MET 72 CO 0.08 0.01 -0.88 -0.09 1.06 0.00 0.00 176.91 177.10 1crp h ARG 73 N 0.00 0.00 0.00 1.72 1.12 -1.42 -3.42 114.38 112.38 1crp h ARG 73 Ca -0.00 0.00 0.00 0.00 -1.11 0.00 0.00 59.98 58.87 1crp h ARG 73 Cb 0.02 0.00 0.00 0.00 -0.01 0.00 0.00 29.97 29.98 1crp h ARG 73 CO 0.00 0.12 -0.36 0.25 -3.11 0.00 0.00 179.97 176.87 1crp n THR 74 N -2.86 0.75 -0.40 0.20 -2.24 -0.44 -4.96 114.28 104.33 1crp n THR 74 Ca -0.01 0.34 -0.23 0.00 -2.27 0.00 0.00 64.05 61.88 1crp n THR 74 Cb 0.63 -1.95 0.21 0.00 -2.10 0.00 0.00 70.33 67.12 1crp n THR 74 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1crp n GLY 75 N 1.60 -3.02 0.00 3.38 0.00 -0.31 -5.00 105.19 101.84 1crp n GLY 75 Ca -0.05 -1.18 0.00 0.00 0.00 0.00 0.00 46.02 44.79 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 -3.45 0.00 -2.41 1.61 4.71 -1.25 -4.92 120.64 114.94 1crp n GLU 76 Ca 0.09 0.00 -0.38 0.00 -0.01 0.00 0.00 57.16 56.86 1crp n GLU 76 Cb 0.44 -0.38 -0.03 0.00 -1.01 0.00 0.00 31.44 30.46 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 -1.82 0.84 -0.94 0.62 0.00 -0.78 -3.98 107.32 101.26 1crp s GLY 77 Ca 0.00 -1.68 -0.21 0.00 0.00 0.00 0.00 44.72 42.83 1crp s GLY 77 CO 0.00 2.90 1.26 -1.36 0.00 0.00 0.00 173.10 175.91 1crp s PHE 78 N 6.57 2.79 -1.27 1.90 0.08 -1.12 0.11 117.98 127.04 1crp s PHE 78 Ca 0.49 -1.04 -0.16 0.00 0.12 0.00 0.00 56.93 56.35 1crp s PHE 78 Cb -0.05 -4.48 0.11 0.00 -0.57 0.00 0.00 43.02 38.03 1crp s PHE 78 CO 0.03 -1.72 1.63 -0.11 -0.10 0.00 0.00 175.22 174.95 1crp n LEU 79 N 7.77 5.16 -4.56 -0.37 7.94 -0.58 -1.86 117.00 130.51 1crp n LEU 79 Ca 0.25 -4.17 -0.30 0.00 -1.11 0.00 0.00 56.01 50.68 1crp n LEU 79 Cb 0.50 -1.69 -0.05 0.00 0.53 0.00 0.00 43.42 42.72 1crp n LEU 79 CO 0.59 0.45 1.40 0.00 -1.11 0.00 0.00 177.39 178.72 1crp n VAL 81 N 7.62 3.40 -3.30 0.00 0.31 -0.27 -2.62 118.33 123.48 1crp n VAL 81 Ca 0.39 -0.47 -0.08 0.00 -0.01 0.00 0.00 64.34 64.18 1crp n VAL 81 Cb 0.48 -1.08 -0.06 0.00 -0.91 0.00 0.00 33.84 32.27 1crp n VAL 81 CO 0.00 0.00 0.00 0.12 -1.32 0.00 0.00 176.83 175.63 1crp s PHE 82 N -1.62 -1.06 -0.26 3.52 5.36 -0.02 -4.63 117.98 119.27 1crp s PHE 82 Ca 0.75 0.51 -0.29 0.00 -0.96 0.00 0.00 56.93 56.94 1crp s PHE 82 Cb -0.39 -0.07 -0.01 0.00 -0.34 0.00 0.00 43.02 42.21 1crp s PHE 82 CO 0.48 -0.94 1.46 0.00 -1.46 0.00 0.00 175.22 174.76 1crp s ALA 83 N 2.57 3.31 0.57 11.12 0.00 -1.26 -1.46 121.76 136.61 1crp s ALA 83 Ca 0.11 0.28 0.26 0.00 0.00 0.00 0.00 51.96 52.60 1crp s ALA 83 Cb -0.13 -3.82 1.61 0.00 0.00 0.00 0.00 23.12 20.79 1crp s ALA 83 CO -0.27 -1.88 2.17 -0.84 0.00 0.00 0.00 175.76 174.93 1crp h ILE 84 N 6.07 0.64 0.00 0.00 -0.00 -1.66 -0.67 117.51 121.90 1crp h ILE 84 Ca -0.30 0.00 -0.21 0.00 -0.00 0.00 0.00 64.86 64.35 1crp h ILE 84 Cb 1.13 0.93 -0.03 0.00 -0.00 0.00 0.00 36.82 38.85 1crp h ILE 84 CO 1.02 0.00 -1.04 -1.13 -0.00 0.00 0.00 178.15 177.00 1crp h ASN 85 N 0.00 0.00 -2.88 2.16 -0.73 -1.80 -1.94 115.58 110.39 1crp h ASN 85 Ca 0.04 0.00 -0.67 0.00 1.87 0.00 0.00 56.30 57.54 1crp h ASN 85 Cb 0.21 0.00 -0.18 0.00 0.27 0.00 0.00 38.32 38.63 1crp h ASN 85 CO -0.00 1.00 0.26 0.21 -0.37 0.00 0.00 177.43 178.53 1crp s ASN 86 N -6.67 6.19 0.37 1.15 3.84 -0.26 -4.38 114.94 115.19 1crp s ASN 86 Ca 0.01 -1.18 0.07 0.00 0.21 0.00 0.00 52.86 51.97 1crp s ASN 86 Cb 0.10 -2.34 0.72 0.00 -0.55 0.00 0.00 41.25 39.18 1crp s ASN 86 CO 0.82 -1.19 1.92 0.71 -2.79 0.00 0.00 177.10 176.56 1crp h THR 87 N 5.94 1.17 0.00 -5.21 1.35 -1.80 -1.74 112.91 112.62 1crp h THR 87 Ca -0.29 -0.71 -0.00 0.00 -0.55 0.00 0.00 66.41 64.86 1crp h THR 87 Cb 1.08 1.03 -0.00 0.00 -1.73 0.00 0.00 68.15 68.53 1crp h THR 87 CO 1.11 0.24 -0.00 0.50 -0.25 0.00 0.00 175.52 177.11 1crp h LYS 88 N 0.37 0.00 -0.29 4.72 3.64 -1.91 -0.25 116.57 122.85 1crp h LYS 88 Ca 0.08 0.00 -0.12 0.00 -1.27 0.00 0.00 60.65 59.34 1crp h LYS 88 Cb 0.31 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.11 1crp h LYS 88 CO 0.01 0.00 -0.31 0.66 -2.27 0.00 0.00 179.45 177.55 1crp h SER 89 N 0.00 0.63 -0.09 4.20 4.64 -1.61 -2.03 113.55 119.29 1crp h SER 89 Ca -0.00 -0.25 -0.00 0.00 -0.47 0.00 0.00 61.79 61.07 1crp h SER 89 Cb 0.01 -0.17 -0.00 0.00 -0.31 0.00 0.00 62.40 61.92 1crp h SER 89 CO 0.00 0.90 0.04 0.15 -0.87 0.00 0.00 176.83 177.05 1crp h PHE 90 N 0.52 0.14 -0.03 4.77 3.57 -1.07 -2.06 116.94 122.78 1crp h PHE 90 Ca 0.06 -0.01 -0.01 0.00 3.53 0.00 0.00 57.97 61.55 1crp h PHE 90 Cb 0.79 -0.04 -0.00 0.00 2.79 0.00 0.00 35.95 39.48 1crp h PHE 90 CO 0.03 0.23 -0.01 0.93 -2.23 0.00 0.00 178.31 177.26 1crp h GLU 91 N 0.01 0.05 -0.37 1.11 4.39 -1.32 -1.84 114.58 116.61 1crp h GLU 91 Ca 0.03 -0.00 -0.07 0.00 0.34 0.00 0.00 59.36 59.66 1crp h GLU 91 Cb 0.14 -0.01 -0.01 0.00 -0.10 0.00 0.00 28.75 28.77 1crp h GLU 91 CO -0.00 0.06 -0.04 -0.44 -1.16 0.00 0.00 179.01 177.42 1crp h ASP 92 N 0.05 0.68 -0.06 1.42 3.32 -0.72 -2.46 116.42 118.65 1crp h ASP 92 Ca 0.01 -0.34 0.02 0.00 0.02 0.00 0.00 57.03 56.74 1crp h ASP 92 Cb 0.05 -0.18 -0.00 0.00 0.22 0.00 0.00 39.33 39.41 1crp h ASP 92 CO 0.00 0.85 0.04 0.40 -1.72 0.00 0.00 179.24 178.82 1crp h ILE 93 N 0.49 0.89 -0.34 0.35 1.08 -0.69 0.36 117.51 119.64 1crp h ILE 93 Ca 0.10 0.00 -0.06 0.00 -0.39 0.00 0.00 64.86 64.51 1crp h ILE 93 Cb 0.53 0.97 -0.01 0.00 -3.07 0.00 0.00 36.82 35.24 1crp h ILE 93 CO 0.03 0.00 -0.03 -0.74 -0.69 0.00 0.00 178.15 176.71 1crp h HIS 94 N 0.00 0.69 -0.58 1.37 2.76 -1.19 -3.00 115.15 115.20 1crp h HIS 94 Ca 0.03 -0.13 0.00 0.00 -2.20 0.00 0.00 60.37 58.07 1crp h HIS 94 Cb 0.12 -0.17 0.00 0.00 1.55 0.00 0.00 27.41 28.90 1crp h HIS 94 CO 0.00 0.76 0.00 1.04 -1.30 0.00 0.00 177.93 178.43 1crp n GLN 95 N -4.48 4.26 -0.04 5.26 6.02 -0.57 -4.23 117.38 123.60 1crp n GLN 95 Ca -0.02 -3.02 -0.01 0.00 -0.01 0.00 0.00 57.00 53.94 1crp n GLN 95 Cb 0.30 -2.07 -0.11 0.00 1.02 0.00 0.00 30.24 29.37 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 0.76 0.00 0.82 1.08 4.02 0.12 -4.34 117.16 119.62 1crp n TYR 96 Ca 0.26 0.00 0.05 0.00 -0.01 0.00 0.00 57.90 58.20 1crp n TYR 96 Cb 1.04 -0.55 0.15 0.00 -0.02 0.00 0.00 39.34 39.96 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 -2.31 1.93 -0.09 -0.72 -4.01 -1.17 -3.38 116.66 106.90 1crp n ARG 97 Ca -0.14 -1.22 -0.12 0.00 -1.04 0.00 0.00 57.85 55.33 1crp n ARG 97 Cb 0.72 -1.36 -0.11 0.00 -3.04 0.00 0.00 32.46 28.68 1crp n ARG 97 CO 0.00 0.00 0.00 0.39 -3.04 0.00 0.00 177.63 174.98 1crp n GLU 98 N 0.43 0.88 0.06 2.89 -0.58 -1.26 -3.65 120.64 119.40 1crp n GLU 98 Ca 0.11 0.06 -0.08 0.00 -0.42 0.00 0.00 57.16 56.84 1crp n GLU 98 Cb 0.34 -1.42 0.06 0.00 -0.57 0.00 0.00 31.44 29.85 1crp n GLU 98 CO 0.00 0.00 0.00 0.37 -0.48 0.00 0.00 177.13 177.02 1crp h GLN 99 N 0.00 0.34 -0.44 3.49 4.15 -1.77 0.92 115.11 121.80 1crp h GLN 99 Ca -0.46 -0.26 -0.14 0.00 0.77 0.00 0.00 58.65 58.55 1crp h GLN 99 Cb 1.85 0.05 -0.01 0.00 0.21 0.00 0.00 27.48 29.58 1crp h GLN 99 CO -0.03 0.89 -0.29 0.82 -1.93 0.00 0.00 178.83 178.29 1crp h ILE 100 N 0.24 1.27 0.00 2.39 2.04 -1.75 -1.08 117.51 120.62 1crp h ILE 100 Ca -0.02 -1.46 -0.03 0.00 1.00 0.00 0.00 64.86 64.35 1crp h ILE 100 Cb 1.23 1.24 -0.00 0.00 -0.74 0.00 0.00 36.82 38.54 1crp h ILE 100 CO 0.11 0.50 -0.14 0.11 0.00 0.00 0.00 178.15 178.73 1crp h LYS 101 N 0.82 0.00 0.05 2.37 1.57 -1.56 -2.49 116.57 117.32 1crp h LYS 101 Ca 0.09 0.00 -0.00 0.00 -1.87 0.00 0.00 60.65 58.87 1crp h LYS 101 Cb 0.88 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.19 1crp h LYS 101 CO 0.08 0.14 -0.02 -0.09 -0.57 0.00 0.00 179.45 178.99 1crp h ARG 102 N 0.00 -0.06 0.21 3.15 2.43 0.43 0.48 114.38 121.02 1crp h ARG 102 Ca -0.00 0.00 -0.01 0.00 -0.81 0.00 0.00 59.98 59.16 1crp h ARG 102 Cb 0.41 0.01 0.00 0.00 -0.42 0.00 0.00 29.97 29.98 1crp h ARG 102 CO 0.02 0.34 -0.10 0.28 -1.51 0.00 0.00 179.97 179.00 1crp h VAL 103 N -0.47 0.00 0.00 0.20 2.07 -1.08 -2.70 116.25 114.28 1crp h VAL 103 Ca -0.01 -0.01 0.00 0.00 0.82 0.00 0.00 66.70 67.50 1crp h VAL 103 Cb 0.42 0.00 0.00 0.00 -1.52 0.00 0.00 31.29 30.19 1crp h VAL 103 CO 0.01 0.00 0.00 0.11 0.02 0.00 0.00 177.57 177.71 1crp h LYS 104 N -0.28 0.00 -5.74 1.57 1.79 -1.59 -3.46 116.57 108.85 1crp h LYS 104 Ca -0.03 0.00 -0.37 0.00 -2.18 0.00 0.00 60.65 58.07 1crp h LYS 104 Cb 0.21 0.00 0.15 0.00 -1.58 0.00 0.00 32.23 31.01 1crp h LYS 104 CO 0.05 0.00 -0.70 -0.25 -1.08 0.00 0.00 179.45 177.46 1crp n ASP 105 N -2.43 -4.94 0.00 0.86 8.00 0.16 -4.96 116.55 113.24 1crp n ASP 105 Ca 0.00 -0.56 0.00 0.00 0.71 0.00 0.00 54.79 54.94 1crp n ASP 105 Cb 0.15 -5.03 0.00 0.00 -0.02 0.00 0.00 41.12 36.22 1crp n ASP 105 CO 0.00 0.00 0.00 -0.24 -0.39 0.00 0.00 177.20 176.57 1crp n SER 106 N -3.02 0.00 -3.66 -2.24 2.88 -0.66 -5.00 113.62 101.93 1crp n SER 106 Ca -0.09 0.00 -0.34 0.00 -1.33 0.00 0.00 58.87 57.11 1crp n SER 106 Cb 0.60 0.00 -0.04 0.00 -0.75 0.00 0.00 64.21 64.02 1crp n SER 106 CO 0.00 0.00 0.00 -0.67 -1.23 0.00 0.00 175.04 173.14 1crp n ASP 107 N 0.00 4.98 -2.30 -3.46 -0.08 -1.26 -4.43 116.55 110.00 1crp n ASP 107 Ca 0.00 -3.45 0.02 0.00 -1.51 0.00 0.00 54.79 49.85 1crp n ASP 107 Cb 0.00 -0.93 0.04 0.00 2.34 0.00 0.00 41.12 42.57 1crp n ASP 107 CO 0.00 0.00 0.00 0.47 0.12 0.00 0.00 177.20 177.79 1crp n ASP 108 N 0.99 1.36 -4.92 1.67 8.00 -1.26 -5.09 116.55 117.31 1crp n ASP 108 Ca 0.29 -2.03 -0.29 0.00 0.71 0.00 0.00 54.79 53.47 1crp n ASP 108 Cb 0.37 -0.41 -0.04 0.00 -0.02 0.00 0.00 41.12 41.03 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 -2.30 5.22 -0.97 2.53 1.01 -1.26 -4.97 120.40 119.66 1crp s VAL 109 Ca 0.30 -0.26 -0.25 0.00 0.00 0.00 0.00 61.98 61.77 1crp s VAL 109 Cb 0.35 -3.69 -0.09 0.00 0.00 0.00 0.00 36.38 32.95 1crp s VAL 109 CO -0.09 -0.07 2.04 -2.16 0.00 0.00 0.00 175.10 174.81 1crp s PRO 110 N -3.04 2.26 0.41 2.72 0.05 -1.26 -4.91 135.00 131.23 1crp s PRO 110 Ca 0.39 -0.39 -0.14 0.00 0.05 0.00 0.00 61.00 60.91 1crp s PRO 110 Cb -0.12 -5.05 -0.08 0.00 0.05 0.00 0.00 34.50 29.30 1crp s PRO 110 CO 0.28 -3.90 0.82 1.41 0.05 0.00 0.00 177.00 175.66 1crp s MET 111 N 7.32 3.91 -0.21 4.56 1.75 -1.26 -2.81 119.30 132.55 1crp s MET 111 Ca 0.74 0.67 -0.06 0.00 -1.25 0.00 0.00 55.69 55.79 1crp s MET 111 Cb -0.06 -2.33 0.10 0.00 2.84 0.00 0.00 34.83 35.37 1crp s MET 111 CO 0.06 -0.03 0.43 0.08 -0.65 0.00 0.00 175.02 174.90 1crp s VAL 112 N -2.30 -0.67 -0.41 10.11 1.01 -0.78 -4.31 120.40 123.05 1crp s VAL 112 Ca 0.54 0.13 -0.16 0.00 0.00 0.00 0.00 61.98 62.49 1crp s VAL 112 Cb -0.10 -0.70 0.02 0.00 0.00 0.00 0.00 36.38 35.59 1crp s VAL 112 CO 0.26 0.04 0.39 -0.22 0.00 0.00 0.00 175.10 175.57 1crp s LEU 113 N 2.62 4.89 0.19 3.92 2.96 -1.10 -1.23 118.68 130.93 1crp s LEU 113 Ca 0.00 -0.69 -0.08 0.00 -0.22 0.00 0.00 54.13 53.14 1crp s LEU 113 Cb -0.12 -2.31 -0.07 0.00 0.50 0.00 0.00 46.19 44.19 1crp s LEU 113 CO -0.14 -0.51 0.48 -0.69 -1.32 0.00 0.00 176.35 174.18 1crp s VAL 114 N 1.98 5.02 -0.86 1.68 1.01 -1.08 -2.34 120.40 125.81 1crp s VAL 114 Ca 0.10 0.33 0.00 0.00 0.00 0.00 0.00 61.98 62.41 1crp s VAL 114 Cb -0.18 -3.62 0.23 0.00 0.00 0.00 0.00 36.38 32.81 1crp s VAL 114 CO 0.12 -0.01 0.84 0.61 0.00 0.00 0.00 175.10 176.66 1crp n GLY 115 N 0.00 4.36 3.63 4.51 0.00 0.97 -0.84 105.19 117.82 1crp n GLY 115 Ca -0.01 -2.64 -0.29 0.00 0.00 0.00 0.00 46.02 43.08 1crp n GLY 115 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1crp s ASN 116 N -0.89 2.51 -0.80 1.61 3.84 -0.53 -0.81 114.94 119.86 1crp s ASN 116 Ca 0.30 1.64 -0.02 0.00 0.21 0.00 0.00 52.86 54.99 1crp s ASN 116 Cb -0.01 -2.29 -0.02 0.00 -0.55 0.00 0.00 41.25 38.38 1crp s ASN 116 CO -0.08 -3.27 0.68 0.29 -2.79 0.00 0.00 177.10 171.93 1crp n LYS 117 N -4.31 -3.42 -0.77 0.43 5.02 0.17 -2.07 118.16 113.21 1crp n LYS 117 Ca 0.07 0.60 0.04 0.00 -2.02 0.00 0.00 58.31 57.00 1crp n LYS 117 Cb 0.54 -4.75 0.33 0.00 -0.02 0.00 0.00 35.03 31.13 1crp n LYS 117 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1crp n ASP 119 N -0.03 2.90 -4.75 0.00 5.68 -1.26 -4.99 116.55 114.10 1crp n ASP 119 Ca 0.29 -0.05 -0.31 0.00 -0.50 0.00 0.00 54.79 54.22 1crp n ASP 119 Cb 1.13 1.36 0.11 0.00 -1.14 0.00 0.00 41.12 42.58 1crp n ASP 119 CO 0.00 0.00 0.00 -0.76 -1.33 0.00 0.00 177.20 175.11 1crp s LEU 120 N -3.50 3.00 -0.02 -2.12 1.43 -1.26 -4.96 118.68 111.24 1crp s LEU 120 Ca -0.03 1.92 -0.05 0.00 -1.03 0.00 0.00 54.13 54.94 1crp s LEU 120 Cb 0.05 -4.53 -0.28 0.00 0.03 0.00 0.00 46.19 41.46 1crp s LEU 120 CO 0.35 -2.28 0.76 0.00 0.23 0.00 0.00 176.35 175.41 1crp h ALA 121 N -1.27 0.27 -3.19 4.21 0.00 -1.96 -3.46 119.26 113.86 1crp h ALA 121 Ca -0.43 -1.16 -0.37 0.00 0.00 0.00 0.00 54.91 52.95 1crp h ALA 121 Cb 1.24 0.37 0.20 0.00 0.00 0.00 0.00 17.79 19.60 1crp h ALA 121 CO 0.49 1.14 -0.02 0.00 0.00 0.00 0.00 179.25 180.86 1crp n ALA 122 N -2.74 -4.13 -3.10 0.00 0.00 -1.26 -5.06 120.51 104.22 1crp n ALA 122 Ca -0.20 -1.53 0.04 0.00 0.00 0.00 0.00 53.44 51.75 1crp n ALA 122 Cb 1.05 -0.12 0.00 0.00 0.00 0.00 0.00 19.45 20.38 1crp n ALA 122 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 1crp s ARG 123 N -5.22 0.29 0.21 0.00 0.52 -1.26 -4.98 118.95 108.51 1crp s ARG 123 Ca 0.67 0.17 -0.03 0.00 -0.52 0.00 0.00 55.73 56.02 1crp s ARG 123 Cb -0.09 0.10 0.17 0.00 0.52 0.00 0.00 34.95 35.65 1crp s ARG 123 CO 0.53 -0.51 1.58 1.79 0.02 0.00 0.00 175.30 178.71 1crp h THR 124 N 4.71 1.29 -3.18 0.02 1.35 -1.76 -3.41 112.91 111.93 1crp h THR 124 Ca -0.05 -1.55 -0.59 0.00 -0.55 0.00 0.00 66.41 63.67 1crp h THR 124 Cb 1.19 1.50 -0.06 0.00 -1.73 0.00 0.00 68.15 69.05 1crp h THR 124 CO -0.02 0.50 -0.12 -0.69 -0.25 0.00 0.00 175.52 174.93 1crp s VAL 125 N -4.30 4.97 -0.56 6.82 1.01 -0.73 -4.98 120.40 122.63 1crp s VAL 125 Ca -0.08 1.02 -0.02 0.00 0.00 0.00 0.00 61.98 62.90 1crp s VAL 125 Cb 0.12 -3.81 0.32 0.00 0.00 0.00 0.00 36.38 33.01 1crp s VAL 125 CO 0.83 0.50 2.11 -1.84 0.00 0.00 0.00 175.10 176.70 1crp n GLU 126 N 2.29 2.38 0.00 2.72 0.28 -1.26 -4.96 120.64 122.09 1crp n GLU 126 Ca -0.11 -2.66 0.00 0.00 -0.16 0.00 0.00 57.16 54.23 1crp n GLU 126 Cb 0.52 -2.05 0.00 0.00 1.43 0.00 0.00 31.44 31.33 1crp n GLU 126 CO 0.00 0.00 0.00 0.43 -0.16 0.00 0.00 177.13 177.40 1crp n SER 127 N -0.27 0.00 -0.28 -1.84 7.64 -1.26 -3.95 113.62 113.65 1crp n SER 127 Ca 0.50 0.00 0.32 0.00 1.01 0.00 0.00 58.87 60.70 1crp n SER 127 Cb 0.57 0.00 0.54 0.00 -1.01 0.00 0.00 64.21 64.31 1crp n SER 127 CO 0.00 0.00 0.00 -0.09 -3.01 0.00 0.00 175.04 171.94 1crp h ARG 128 N 0.00 0.00 0.33 1.43 9.65 -1.99 0.77 114.38 124.57 1crp h ARG 128 Ca 0.00 0.00 -0.02 0.00 -1.10 0.00 0.00 59.98 58.86 1crp h ARG 128 Cb 0.00 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 28.58 1crp h ARG 128 CO 0.00 0.00 -0.16 1.96 2.80 0.00 0.00 179.97 184.57 1crp h GLN 129 N 0.00 -0.43 0.00 0.20 4.20 -1.96 -1.39 115.11 115.74 1crp h GLN 129 Ca 0.55 0.03 -0.01 0.00 0.06 0.00 0.00 58.65 59.29 1crp h GLN 129 Cb 2.94 0.10 -0.00 0.00 0.30 0.00 0.00 27.48 30.82 1crp h GLN 129 CO -0.01 -0.15 -0.03 0.00 -0.67 0.00 0.00 178.83 177.98 1crp h ALA 130 N -0.10 1.76 -0.19 3.87 0.00 -1.19 -0.68 119.26 122.73 1crp h ALA 130 Ca -0.05 -0.03 -0.13 0.00 0.00 0.00 0.00 54.91 54.71 1crp h ALA 130 Cb 0.47 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.25 1crp h ALA 130 CO 0.07 0.04 -0.43 1.96 0.00 0.00 0.00 179.25 180.89 1crp h GLN 131 N 0.00 0.44 0.00 0.00 1.08 -1.21 -1.90 115.11 113.52 1crp h GLN 131 Ca -0.00 -0.23 -0.08 0.00 -1.45 0.00 0.00 58.65 56.89 1crp h GLN 131 Cb 0.06 0.01 -0.01 0.00 -0.05 0.00 0.00 27.48 27.48 1crp h GLN 131 CO 0.00 0.80 -0.39 -0.44 -0.95 0.00 0.00 178.83 177.85 1crp h ASP 132 N 0.36 0.00 0.00 1.46 3.32 -0.02 -2.23 116.42 119.32 1crp h ASP 132 Ca 0.03 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.08 1crp h ASP 132 Cb 0.91 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.46 1crp h ASP 132 CO 0.08 0.39 -0.05 0.25 -1.72 0.00 0.00 179.24 178.18 1crp h LEU 133 N 0.00 0.00 -0.57 1.55 6.46 -1.21 -3.24 115.31 118.30 1crp h LEU 133 Ca -0.00 0.00 0.08 0.00 -0.12 0.00 0.00 57.88 57.84 1crp h LEU 133 Cb 0.86 0.00 -0.07 0.00 -0.73 0.00 0.00 40.66 40.72 1crp h LEU 133 CO 0.05 0.13 0.21 0.00 -0.62 0.00 0.00 178.44 178.21 1crp h ALA 134 N -1.78 0.71 0.61 1.25 0.00 -1.50 -0.99 119.26 117.57 1crp h ALA 134 Ca 0.00 0.08 -0.02 0.00 0.00 0.00 0.00 54.91 54.96 1crp h ALA 134 Cb 0.05 0.05 -0.01 0.00 0.00 0.00 0.00 17.79 17.88 1crp h ALA 134 CO 0.00 -0.20 -0.40 -0.09 0.00 0.00 0.00 179.25 178.56 1crp h ARG 135 N 0.39 -0.93 0.00 0.00 2.43 -1.59 -1.16 114.38 113.52 1crp h ARG 135 Ca 0.28 0.06 0.00 0.00 -0.81 0.00 0.00 59.98 59.51 1crp h ARG 135 Cb 0.33 0.21 0.00 0.00 -0.42 0.00 0.00 29.97 30.09 1crp h ARG 135 CO -0.28 -0.62 0.00 0.66 -1.51 0.00 0.00 179.97 178.22 1crp h SER 136 N -0.97 0.00 1.06 -3.80 4.64 -1.54 -1.50 113.55 111.45 1crp h SER 136 Ca -0.07 0.00 -0.16 0.00 -0.47 0.00 0.00 61.79 61.09 1crp h SER 136 Cb 0.79 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.86 1crp h SER 136 CO 0.06 0.00 -0.99 1.88 -0.87 0.00 0.00 176.83 176.90 1crp h TYR 137 N 0.00 0.00 -0.39 4.77 -1.99 -0.31 -3.48 116.97 115.56 1crp h TYR 137 Ca 0.00 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.73 1crp h TYR 137 Cb 0.06 0.00 0.00 0.00 2.00 0.00 0.00 36.73 38.79 1crp h TYR 137 CO 0.00 0.64 0.00 0.41 -0.00 0.00 0.00 178.16 179.21 1crp n GLY 138 N 1.33 1.02 3.11 3.88 0.00 -0.52 -5.08 105.19 108.93 1crp n GLY 138 Ca -0.04 -0.35 -0.16 0.00 0.00 0.00 0.00 46.02 45.48 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 -2.39 0.82 0.53 -0.61 -4.36 -0.96 -4.97 121.20 109.26 1crp s ILE 139 Ca 0.00 -1.14 -0.21 0.00 -0.26 0.00 0.00 60.65 59.04 1crp s ILE 139 Cb 0.00 -0.83 -0.05 0.00 1.25 0.00 0.00 42.46 42.83 1crp s ILE 139 CO 0.00 -0.27 1.25 -2.16 0.24 0.00 0.00 174.94 174.00 1crp s PRO 140 N -1.55 3.28 -0.04 0.37 0.04 -1.26 -4.36 135.00 131.48 1crp s PRO 140 Ca -0.05 1.96 0.05 0.00 0.04 0.00 0.00 61.00 62.99 1crp s PRO 140 Cb -0.10 -2.20 -0.02 0.00 0.04 0.00 0.00 34.50 32.22 1crp s PRO 140 CO 0.01 -0.99 -0.18 -0.47 0.04 0.00 0.00 177.00 175.41 1crp s TYR 141 N -1.47 2.59 0.34 0.56 5.04 -1.26 -2.72 117.35 120.42 1crp s TYR 141 Ca 0.71 -0.24 0.03 0.00 -2.44 0.00 0.00 57.07 55.13 1crp s TYR 141 Cb -0.33 -1.59 -0.02 0.00 0.35 0.00 0.00 41.96 40.37 1crp s TYR 141 CO 0.39 0.13 0.36 0.42 -1.34 0.00 0.00 175.55 175.51 1crp s ILE 142 N -0.71 0.00 -0.23 3.14 1.01 -0.99 -5.02 121.20 118.41 1crp s ILE 142 Ca 0.11 -1.83 -0.04 0.00 0.00 0.00 0.00 60.65 58.90 1crp s ILE 142 Cb -0.10 -2.57 0.12 0.00 0.01 0.00 0.00 42.46 39.92 1crp s ILE 142 CO 0.00 0.00 0.36 -1.61 0.00 0.00 0.00 174.94 173.69 1crp s GLU 143 N -3.26 0.32 0.47 2.79 2.02 -1.26 -0.02 118.70 119.76 1crp s GLU 143 Ca 0.36 0.58 0.05 0.00 0.02 0.00 0.00 54.97 55.98 1crp s GLU 143 Cb 0.01 -0.42 -0.03 0.00 0.10 0.00 0.00 34.13 33.79 1crp s GLU 143 CO 0.25 -0.57 0.10 0.95 0.02 0.00 0.00 175.26 176.01 1crp s THR 144 N 2.53 1.70 -0.29 3.63 -4.23 0.01 -4.29 115.64 114.70 1crp s THR 144 Ca 0.10 -1.86 0.01 0.00 -1.18 0.00 0.00 61.69 58.76 1crp s THR 144 Cb -0.15 -2.56 0.19 0.00 1.34 0.00 0.00 72.50 71.32 1crp s THR 144 CO -0.15 0.00 0.57 -0.55 -0.54 0.00 0.00 174.62 173.95 1crp s SER 145 N -3.90 -1.22 0.12 3.99 0.15 -0.17 -0.66 113.70 112.01 1crp s SER 145 Ca 0.25 0.50 0.14 0.00 0.70 0.00 0.00 55.95 57.55 1crp s SER 145 Cb 0.04 1.97 0.64 0.00 -1.71 0.00 0.00 66.02 66.96 1crp s SER 145 CO 0.14 -0.28 1.44 0.00 1.20 0.00 0.00 173.24 175.73 1crp n ALA 146 N 5.42 1.38 1.66 5.45 0.00 -1.26 -2.19 120.51 130.96 1crp n ALA 146 Ca 0.01 0.04 0.14 0.00 0.00 0.00 0.00 53.44 53.63 1crp n ALA 146 Cb 0.52 -1.22 0.80 0.00 0.00 0.00 0.00 19.45 19.55 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 -1.81 0.78 -0.41 0.00 0.00 -1.26 -4.01 118.16 111.44 1crp n LYS 147 Ca 0.01 0.01 0.00 0.00 0.00 0.00 0.00 58.31 58.33 1crp n LYS 147 Cb 0.11 -1.50 0.00 0.00 0.00 0.00 0.00 35.03 33.64 1crp n LYS 147 CO 0.00 0.00 0.00 -2.37 0.00 0.00 0.00 177.40 175.03 1crp n THR 148 N -1.06 0.00 -3.18 3.15 5.66 -0.93 -5.00 114.28 112.92 1crp n THR 148 Ca 0.19 0.00 -0.21 0.00 -3.05 0.00 0.00 64.05 60.98 1crp n THR 148 Cb 0.12 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 68.90 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 -3.42 -3.60 1.09 1.74 -0.94 -4.92 116.66 106.61 1crp n ARG 149 Ca 0.00 0.54 -0.40 0.00 -0.77 0.00 0.00 57.85 57.22 1crp n ARG 149 Cb 0.47 -5.25 -0.11 0.00 -1.02 0.00 0.00 32.46 26.54 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 -5.82 2.95 0.00 5.56 0.74 -1.14 -4.39 119.66 117.55 1crp s GLN 150 Ca 0.33 -1.00 0.00 0.00 0.05 0.00 0.00 55.36 54.74 1crp s GLN 150 Cb -0.17 -3.71 0.00 0.00 1.10 0.00 0.00 33.01 30.23 1crp s GLN 150 CO 0.40 -0.64 0.00 0.41 -0.55 0.00 0.00 175.29 174.91 1crp n GLY 151 N 5.00 3.13 0.41 2.59 0.00 -1.26 -0.99 105.19 114.07 1crp n GLY 151 Ca -0.12 0.00 0.21 0.00 0.00 0.00 0.00 46.02 46.11 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 0.67 0.36 1.61 2.07 -1.84 -2.49 116.25 116.63 1crp h VAL 152 Ca 0.00 -0.10 -0.02 0.00 0.82 0.00 0.00 66.70 67.40 1crp h VAL 152 Cb 0.00 0.35 0.00 0.00 -1.52 0.00 0.00 31.29 30.13 1crp h VAL 152 CO 0.00 0.05 -0.17 -0.33 0.02 0.00 0.00 177.57 177.14 1crp h GLU 153 N 0.29 -0.46 -0.46 1.57 5.08 -1.90 -2.68 114.58 116.01 1crp h GLU 153 Ca 0.43 0.03 0.13 0.00 -1.00 0.00 0.00 59.36 58.95 1crp h GLU 153 Cb 1.23 0.10 -0.02 0.00 0.50 0.00 0.00 28.75 30.56 1crp h GLU 153 CO -0.12 -0.31 0.55 -0.44 -1.00 0.00 0.00 179.01 177.69 1crp h ASP 154 N -0.48 0.00 0.00 1.42 3.32 -1.89 -1.30 116.42 117.49 1crp h ASP 154 Ca -0.05 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.00 1crp h ASP 154 Cb 0.37 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.92 1crp h ASP 154 CO 0.08 0.00 0.00 0.00 -1.72 0.00 0.00 179.24 177.60 1crp n ALA 155 N -2.28 -0.22 0.18 3.45 0.00 -0.97 -2.32 120.51 118.35 1crp n ALA 155 Ca 0.09 0.00 -0.14 0.00 0.00 0.00 0.00 53.44 53.38 1crp n ALA 155 Cb 0.73 0.00 -0.08 0.00 0.00 0.00 0.00 19.45 20.10 1crp n ALA 155 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 177.50 178.24 1crp h PHE 156 N 0.00 -0.41 -0.25 0.00 0.04 -1.34 -2.63 116.94 112.34 1crp h PHE 156 Ca 0.00 -0.01 0.06 0.00 2.80 0.00 0.00 57.97 60.82 1crp h PHE 156 Cb 0.00 0.14 -0.07 0.00 2.20 0.00 0.00 35.95 38.21 1crp h PHE 156 CO 0.10 -0.15 -0.31 1.88 -0.60 0.00 0.00 178.31 179.23 1crp h TYR 157 N -0.62 -0.86 -0.13 -0.55 -1.99 -1.42 0.35 116.97 111.75 1crp h TYR 157 Ca -0.05 0.05 0.03 0.00 2.00 0.00 0.00 58.73 60.76 1crp h TYR 157 Cb 0.45 0.42 -0.01 0.00 2.00 0.00 0.00 36.73 39.59 1crp h TYR 157 CO -0.01 -0.38 0.09 1.15 -0.00 0.00 0.00 178.16 179.01 1crp h THR 158 N -0.32 0.96 -0.33 -2.88 2.02 -1.50 -1.84 112.91 109.02 1crp h THR 158 Ca 0.13 -0.01 -0.01 0.00 0.77 0.00 0.00 66.41 67.28 1crp h THR 158 Cb 0.53 0.91 -0.01 0.00 -1.74 0.00 0.00 68.15 67.84 1crp h THR 158 CO -0.43 0.01 0.15 -0.07 0.37 0.00 0.00 175.52 175.55 1crp h LEU 159 N 0.04 0.43 -1.46 2.58 4.07 -0.55 -2.12 115.31 118.31 1crp h LEU 159 Ca 0.06 -0.14 -0.04 0.00 0.08 0.00 0.00 57.88 57.83 1crp h LEU 159 Cb 0.18 -0.11 -0.01 0.00 1.08 0.00 0.00 40.66 41.81 1crp h LEU 159 CO -0.00 0.46 -0.21 0.58 -1.08 0.00 0.00 178.44 178.18 1crp h VAL 160 N 0.38 0.66 0.00 1.22 2.07 -0.82 -2.46 116.25 117.30 1crp h VAL 160 Ca 0.11 -0.92 -0.11 0.00 0.82 0.00 0.00 66.70 66.60 1crp h VAL 160 Cb 0.14 1.59 -0.02 0.00 -1.52 0.00 0.00 31.29 31.49 1crp h VAL 160 CO -0.01 0.21 -0.50 0.03 0.02 0.00 0.00 177.57 177.31 1crp h ARG 161 N 0.00 0.00 0.19 1.57 3.08 -0.89 -2.18 114.38 116.15 1crp h ARG 161 Ca -0.00 0.00 -0.29 0.00 0.07 0.00 0.00 59.98 59.76 1crp h ARG 161 Cb 0.58 0.00 0.02 0.00 0.08 0.00 0.00 29.97 30.65 1crp h ARG 161 CO 0.03 0.50 -1.32 0.93 -1.07 0.00 0.00 179.97 179.04 1crp h GLU 162 N 0.00 0.40 -0.31 0.04 3.07 -1.00 -3.32 114.58 113.46 1crp h GLU 162 Ca -0.01 -0.68 -0.07 0.00 -0.50 0.00 0.00 59.36 58.11 1crp h GLU 162 Cb 1.02 0.25 -0.02 0.00 -0.84 0.00 0.00 28.75 29.17 1crp h GLU 162 CO 0.07 1.32 -0.12 0.82 -1.40 0.00 0.00 179.01 179.70 1crp h ILE 163 N -0.09 1.23 -0.07 3.13 2.04 -1.48 -2.18 117.51 120.09 1crp h ILE 163 Ca -0.25 -1.02 0.02 0.00 1.00 0.00 0.00 64.86 64.61 1crp h ILE 163 Cb 1.93 1.12 -0.00 0.00 -0.74 0.00 0.00 36.82 39.14 1crp h ILE 163 CO 0.19 0.34 0.13 -0.09 0.00 0.00 0.00 178.15 178.71 1crp h ARG 164 N 0.48 0.00 0.00 2.37 2.43 -1.48 -2.80 114.38 115.39 1crp h ARG 164 Ca 0.09 0.00 -0.00 0.00 -0.81 0.00 0.00 59.98 59.26 1crp h ARG 164 Cb 0.49 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.04 1crp h ARG 164 CO 0.03 0.00 -0.00 0.37 -1.51 0.00 0.00 179.97 178.86 1crp h GLN 165 N 0.00 -0.01 0.00 0.20 4.15 -1.51 -3.52 115.11 114.43 1crp h GLN 165 Ca 0.03 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.45 1crp h GLN 165 Cb 0.28 0.00 0.00 0.00 0.21 0.00 0.00 27.48 27.97 1crp h GLN 165 CO -0.00 -0.00 0.00 1.58 -1.93 0.00 0.00 178.83 178.48