#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 4.85 -0.17 2.03 2.01 -1.26 -4.72 115.64 118.37 1crp s THR 2 Ca 0.00 0.41 -0.01 0.00 0.31 0.00 0.00 61.69 62.41 1crp s THR 2 Cb 0.00 -3.87 -0.00 0.00 0.01 0.00 0.00 72.50 68.64 1crp s THR 2 CO 0.00 -0.94 -0.13 -1.61 -0.69 0.00 0.00 174.62 171.25 1crp s GLU 3 N -4.87 3.24 -0.18 4.92 2.02 -1.24 -1.31 118.70 121.29 1crp s GLU 3 Ca 0.50 -0.73 -0.00 0.00 0.02 0.00 0.00 54.97 54.76 1crp s GLU 3 Cb -0.10 -2.69 0.04 0.00 0.10 0.00 0.00 34.13 31.48 1crp s GLU 3 CO 0.48 -0.02 -0.06 0.71 0.02 0.00 0.00 175.26 176.38 1crp s TYR 4 N 0.93 1.87 0.28 1.61 2.02 -0.94 -4.91 117.35 118.20 1crp s TYR 4 Ca -0.03 -1.23 -0.29 0.00 -0.37 0.00 0.00 57.07 55.16 1crp s TYR 4 Cb -0.15 -1.39 -0.09 0.00 -0.40 0.00 0.00 41.96 39.93 1crp s TYR 4 CO -0.01 -0.65 0.99 0.21 -1.57 0.00 0.00 175.55 174.51 1crp s LYS 5 N 1.58 4.69 -0.75 -0.62 2.20 -1.26 0.05 119.74 125.63 1crp s LYS 5 Ca -0.00 1.53 -0.00 0.00 -0.36 0.00 0.00 55.97 57.14 1crp s LYS 5 Cb -0.16 -3.10 0.19 0.00 -1.51 0.00 0.00 37.83 33.25 1crp s LYS 5 CO -0.08 0.34 0.58 -0.51 -0.36 0.00 0.00 175.35 175.33 1crp s LEU 6 N -1.55 5.20 -0.86 5.43 1.43 -0.11 -1.99 118.68 126.24 1crp s LEU 6 Ca 0.45 -3.46 -0.25 0.00 -1.03 0.00 0.00 54.13 49.84 1crp s LEU 6 Cb -0.26 -1.81 -0.05 0.00 0.03 0.00 0.00 46.19 44.10 1crp s LEU 6 CO 0.32 -0.22 1.97 -0.69 0.23 0.00 0.00 176.35 177.96 1crp s VAL 7 N -0.94 3.41 0.34 -1.59 1.01 0.18 -2.91 120.40 119.90 1crp s VAL 7 Ca 0.23 -0.28 -0.17 0.00 0.00 0.00 0.00 61.98 61.76 1crp s VAL 7 Cb -0.12 -3.93 -0.09 0.00 0.00 0.00 0.00 36.38 32.24 1crp s VAL 7 CO -0.10 -0.88 0.79 -0.69 0.00 0.00 0.00 175.10 174.23 1crp s VAL 8 N 10.28 4.59 -0.28 2.92 1.01 -1.14 -2.28 120.40 135.51 1crp s VAL 8 Ca 0.71 1.12 -0.25 0.00 0.00 0.00 0.00 61.98 63.56 1crp s VAL 8 Cb -0.08 -3.63 0.13 0.00 0.00 0.00 0.00 36.38 32.80 1crp s VAL 8 CO 0.02 -0.19 1.05 0.68 0.00 0.00 0.00 175.10 176.66 1crp s VAL 9 N -2.00 0.00 0.00 2.92 -7.23 -1.13 -4.73 120.40 108.23 1crp s VAL 9 Ca 0.55 0.00 0.00 0.00 -1.81 0.00 0.00 61.98 60.72 1crp s VAL 9 Cb -0.10 -1.00 0.00 0.00 0.56 0.00 0.00 36.38 35.84 1crp s VAL 9 CO 0.17 0.00 0.00 0.61 -0.31 0.00 0.00 175.10 175.57 1crp n GLY 10 N 2.23 -0.07 4.88 2.32 0.00 -1.26 -1.23 105.19 112.05 1crp n GLY 10 Ca -0.12 0.63 0.06 0.00 0.00 0.00 0.00 46.02 46.58 1crp n GLY 10 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1crp n ALA 11 N 0.00 -1.25 -3.79 4.61 0.00 -1.26 -4.40 120.51 114.41 1crp n ALA 11 Ca 0.00 0.13 -0.30 0.00 0.00 0.00 0.00 53.44 53.28 1crp n ALA 11 Cb 0.00 -0.42 -0.13 0.00 0.00 0.00 0.00 19.45 18.90 1crp n ALA 11 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 1crp s GLY 12 N -5.24 1.95 0.00 0.00 0.00 -1.26 -4.70 107.32 98.06 1crp s GLY 12 Ca 0.00 -2.84 0.00 0.00 0.00 0.00 0.00 44.72 41.88 1crp s GLY 12 CO 0.00 1.36 0.00 0.61 0.00 0.00 0.00 173.10 175.07 1crp n GLY 13 N 3.37 0.97 0.21 0.20 0.00 -1.26 -5.02 105.19 103.66 1crp n GLY 13 Ca 0.08 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.20 1crp n GLY 13 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 173.32 172.93 1crp h VAL 14 N 0.00 0.35 0.00 1.61 -1.51 -1.84 -3.47 116.25 111.40 1crp h VAL 14 Ca 0.00 -1.22 0.00 0.00 -1.23 0.00 0.00 66.70 64.25 1crp h VAL 14 Cb 0.00 1.94 0.00 0.00 -2.13 0.00 0.00 31.29 31.10 1crp h VAL 14 CO 0.00 0.17 0.00 0.61 -1.23 0.00 0.00 177.57 177.12 1crp n GLY 15 N 0.65 1.97 0.18 5.19 0.00 -1.26 -4.41 105.19 107.52 1crp n GLY 15 Ca 0.02 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.89 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 -0.37 0.51 1.61 1.57 -1.92 -2.62 116.57 115.34 1crp h LYS 16 Ca 0.00 0.03 -0.02 0.00 -1.87 0.00 0.00 60.65 58.78 1crp h LYS 16 Cb 0.00 0.09 0.00 0.00 0.08 0.00 0.00 32.23 32.40 1crp h LYS 16 CO 0.00 -0.22 -0.24 0.77 -0.57 0.00 0.00 179.45 179.18 1crp h SER 17 N -0.43 -0.58 -0.93 0.86 0.02 -1.97 -3.01 113.55 107.52 1crp h SER 17 Ca -0.04 -0.04 0.22 0.00 -0.84 0.00 0.00 61.79 61.09 1crp h SER 17 Cb 0.33 0.15 -0.17 0.00 0.14 0.00 0.00 62.40 62.84 1crp h SER 17 CO 0.07 -0.17 -0.10 0.00 -1.14 0.00 0.00 176.83 175.49 1crp h ALA 18 N -0.98 0.85 -0.52 3.77 0.00 -1.90 0.26 119.26 120.75 1crp h ALA 18 Ca -0.07 0.34 -0.11 0.00 0.00 0.00 0.00 54.91 55.07 1crp h ALA 18 Cb 0.58 0.62 -0.02 0.00 0.00 0.00 0.00 17.79 18.97 1crp h ALA 18 CO 0.11 -0.46 -0.11 1.37 0.00 0.00 0.00 179.25 180.16 1crp h LEU 19 N 0.02 0.96 0.32 0.00 8.10 -1.54 -1.18 115.31 121.98 1crp h LEU 19 Ca 0.50 -0.31 -0.02 0.00 0.11 0.00 0.00 57.88 58.16 1crp h LEU 19 Cb 0.90 -0.26 0.00 0.00 -0.44 0.00 0.00 40.66 40.86 1crp h LEU 19 CO -0.90 1.08 -0.15 0.74 -4.11 0.00 0.00 178.44 175.09 1crp h THR 20 N 0.86 0.00 -0.94 0.15 2.02 -0.39 -2.44 112.91 112.17 1crp h THR 20 Ca 0.14 -0.01 0.27 0.00 0.77 0.00 0.00 66.41 67.58 1crp h THR 20 Cb 0.65 0.00 -0.04 0.00 -1.74 0.00 0.00 68.15 67.03 1crp h THR 20 CO 0.05 0.00 0.76 0.40 0.37 0.00 0.00 175.52 177.10 1crp h ILE 21 N -0.44 0.38 0.53 3.11 2.04 -1.26 -0.81 117.51 121.06 1crp h ILE 21 Ca -0.04 0.00 -0.02 0.00 1.00 0.00 0.00 64.86 65.80 1crp h ILE 21 Cb 0.33 0.45 -0.01 0.00 -0.74 0.00 0.00 36.82 36.84 1crp h ILE 21 CO 0.07 0.00 -0.37 -0.61 0.00 0.00 0.00 178.15 177.24 1crp h GLN 22 N 0.00 -0.84 0.00 2.37 5.75 -0.72 0.44 115.11 122.11 1crp h GLN 22 Ca 0.45 0.06 -0.00 0.00 -0.15 0.00 0.00 58.65 59.00 1crp h GLN 22 Cb 1.96 0.19 -0.00 0.00 1.07 0.00 0.00 27.48 30.70 1crp h GLN 22 CO -0.00 -0.56 -0.00 1.25 -2.65 0.00 0.00 178.83 176.87 1crp h LEU 23 N -0.87 0.00 0.00 -2.39 5.85 -0.94 -0.32 115.31 116.64 1crp h LEU 23 Ca -0.06 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.66 1crp h LEU 23 Cb 0.73 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.76 1crp h LEU 23 CO 0.03 0.00 0.00 -0.38 -0.34 0.00 0.00 178.44 177.75 1crp n ILE 24 N -3.46 0.00 0.30 4.05 5.41 -0.28 -4.63 119.36 120.74 1crp n ILE 24 Ca -0.03 0.00 0.16 0.00 1.00 0.00 0.00 62.75 63.88 1crp n ILE 24 Cb 0.08 -0.48 0.92 0.00 -0.71 0.00 0.00 39.64 39.45 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 -4.42 0.38 1.08 -0.35 -3.47 115.11 108.33 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 0.02 -0.07 -1.71 -0.95 0.00 0.00 178.83 176.12 1crp n ASN 26 N -3.73 -5.53 -3.57 1.46 5.15 -0.13 -5.01 115.26 103.90 1crp n ASN 26 Ca -0.03 0.05 -0.05 0.00 -0.60 0.00 0.00 54.58 53.95 1crp n ASN 26 Cb 0.11 -3.62 -0.02 0.00 -0.53 0.00 0.00 39.78 35.72 1crp n ASN 26 CO 0.00 0.00 0.00 -1.38 1.40 0.00 0.00 177.26 177.28 1crp s HIS 27 N -2.75 -0.19 -0.23 1.20 -3.43 -1.26 -5.04 115.29 103.59 1crp s HIS 27 Ca 0.04 0.11 -0.15 0.00 -0.80 0.00 0.00 55.06 54.25 1crp s HIS 27 Cb -0.01 0.53 -0.04 0.00 -1.43 0.00 0.00 32.58 31.63 1crp s HIS 27 CO 0.46 -0.33 0.39 0.12 -2.00 0.00 0.00 174.74 173.37 1crp s PHE 28 N -2.66 3.32 -0.18 0.38 5.36 -1.26 -4.46 117.98 118.48 1crp s PHE 28 Ca 0.08 0.54 -0.06 0.00 -0.96 0.00 0.00 56.93 56.53 1crp s PHE 28 Cb -0.01 -2.54 -0.04 0.00 -0.34 0.00 0.00 43.02 40.09 1crp s PHE 28 CO -0.06 -0.09 0.03 0.14 -1.46 0.00 0.00 175.22 173.78 1crp s VAL 29 N 1.61 4.50 -0.15 3.12 -7.23 -1.26 -4.98 120.40 116.01 1crp s VAL 29 Ca 0.17 -0.14 0.16 0.00 -1.81 0.00 0.00 61.98 60.36 1crp s VAL 29 Cb -0.15 -3.02 0.43 0.00 0.56 0.00 0.00 36.38 34.20 1crp s VAL 29 CO 0.08 0.46 1.20 -0.90 -0.31 0.00 0.00 175.10 175.63 1crp n ASP 30 N 3.64 1.66 -2.66 4.85 5.75 -1.26 -4.79 116.55 123.75 1crp n ASP 30 Ca -0.17 -3.28 -0.04 0.00 -0.01 0.00 0.00 54.79 51.29 1crp n ASP 30 Cb 0.52 -0.45 0.01 0.00 -1.03 0.00 0.00 41.12 40.17 1crp n ASP 30 CO 0.00 0.00 0.00 -1.84 -0.11 0.00 0.00 177.20 175.25 1crp n GLU 31 N -0.60 0.21 -0.61 0.11 0.28 -1.26 -5.16 120.64 113.61 1crp n GLU 31 Ca 0.16 -0.74 -0.29 0.00 -0.16 0.00 0.00 57.16 56.13 1crp n GLU 31 Cb 0.84 -0.03 0.26 0.00 1.43 0.00 0.00 31.44 33.94 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 0.04 0.74 -0.47 -1.84 5.04 -1.26 -4.96 117.35 114.64 1crp s TYR 32 Ca 0.06 0.89 -0.15 0.00 -2.44 0.00 0.00 57.07 55.43 1crp s TYR 32 Cb 0.10 -3.08 0.07 0.00 0.35 0.00 0.00 41.96 39.40 1crp s TYR 32 CO -0.04 -4.16 0.38 -0.51 -1.34 0.00 0.00 175.55 169.88 1crp s ASP 33 N -2.93 6.09 0.58 4.32 1.01 -1.26 -4.92 116.67 119.56 1crp s ASP 33 Ca 0.68 -1.34 0.37 0.00 0.71 0.00 0.00 52.55 52.97 1crp s ASP 33 Cb -0.19 -2.16 2.01 0.00 1.01 0.00 0.00 42.92 43.58 1crp s ASP 33 CO 0.61 -0.63 2.13 -0.65 0.21 0.00 0.00 175.17 176.84 1crp h PRO 34 N 8.72 0.00 -1.75 8.23 0.11 -1.99 -2.75 132.00 142.57 1crp h PRO 34 Ca -0.28 0.00 -0.46 0.00 0.11 0.00 0.00 66.00 65.37 1crp h PRO 34 Cb 1.11 0.00 -0.18 0.00 0.11 0.00 0.00 31.00 32.04 1crp h PRO 34 CO 0.86 0.00 0.47 0.25 -0.21 0.00 0.00 178.00 179.37 1crp n THR 35 N -2.84 3.16 -3.61 -1.15 -2.24 -1.26 -3.37 114.28 102.97 1crp n THR 35 Ca -0.02 -2.57 -0.17 0.00 -2.27 0.00 0.00 64.05 59.02 1crp n THR 35 Cb 0.11 -1.46 -0.15 0.00 -2.10 0.00 0.00 70.33 66.74 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 -2.58 -0.29 -0.11 2.28 1.01 -1.04 -5.08 121.20 115.39 1crp s ILE 36 Ca 0.49 0.17 0.03 0.00 0.00 0.00 0.00 60.65 61.34 1crp s ILE 36 Cb 0.35 -0.45 -0.00 0.00 0.01 0.00 0.00 42.46 42.36 1crp s ILE 36 CO -0.14 0.01 -0.22 -1.61 0.00 0.00 0.00 174.94 172.98 1crp s GLU 37 N 2.31 3.10 0.05 2.79 2.02 -1.26 -4.79 118.70 122.92 1crp s GLU 37 Ca 0.04 -0.85 -0.18 0.00 0.02 0.00 0.00 54.97 54.00 1crp s GLU 37 Cb -0.13 -2.36 0.06 0.00 0.10 0.00 0.00 34.13 31.79 1crp s GLU 37 CO -0.08 0.16 0.85 -3.47 0.02 0.00 0.00 175.26 172.74 1crp n ASP 38 N 3.58 -1.05 -4.18 -0.19 -0.08 -1.26 -5.12 116.55 108.25 1crp n ASP 38 Ca -0.19 -1.40 -0.32 0.00 -1.51 0.00 0.00 54.79 51.37 1crp n ASP 38 Cb 0.53 1.67 -0.17 0.00 2.34 0.00 0.00 41.12 45.50 1crp n ASP 38 CO 0.00 0.00 0.00 -0.94 0.12 0.00 0.00 177.20 176.38 1crp s SER 39 N -2.93 3.09 0.04 1.67 1.04 -1.26 -3.93 113.70 111.41 1crp s SER 39 Ca 0.20 -0.59 -0.28 0.00 0.48 0.00 0.00 55.95 55.75 1crp s SER 39 Cb -0.01 -1.43 -0.05 0.00 0.10 0.00 0.00 66.02 64.63 1crp s SER 39 CO 0.02 0.09 0.88 -0.31 0.98 0.00 0.00 173.24 174.90 1crp s TYR 40 N 0.74 3.71 0.08 5.02 2.02 -0.36 -4.86 117.35 123.70 1crp s TYR 40 Ca -0.09 1.61 0.02 0.00 -0.37 0.00 0.00 57.07 58.25 1crp s TYR 40 Cb -0.16 -2.98 -0.04 0.00 -0.40 0.00 0.00 41.96 38.38 1crp s TYR 40 CO -0.00 0.14 0.11 1.03 -1.57 0.00 0.00 175.55 175.26 1crp s ARG 41 N 0.40 3.02 -0.28 -0.62 0.52 -1.26 -1.31 118.95 119.41 1crp s ARG 41 Ca 0.45 -0.63 -0.21 0.00 -0.52 0.00 0.00 55.73 54.81 1crp s ARG 41 Cb -0.21 -2.80 0.11 0.00 0.52 0.00 0.00 34.95 32.57 1crp s ARG 41 CO 0.26 0.57 0.89 0.21 0.02 0.00 0.00 175.30 177.26 1crp s LYS 42 N -2.44 0.58 -0.27 3.54 2.47 -1.26 -4.99 119.74 117.38 1crp s LYS 42 Ca 0.31 0.81 0.03 0.00 -1.56 0.00 0.00 55.97 55.55 1crp s LYS 42 Cb -0.12 0.22 0.06 0.00 -1.46 0.00 0.00 37.83 36.52 1crp s LYS 42 CO 0.23 -0.09 -0.09 -1.14 0.16 0.00 0.00 175.35 174.42 1crp s GLN 43 N 0.79 2.24 0.16 4.03 0.74 -1.26 -2.68 119.66 123.67 1crp s GLN 43 Ca -0.03 -1.36 0.01 0.00 0.05 0.00 0.00 55.36 54.03 1crp s GLN 43 Cb -0.05 -2.93 -0.04 0.00 1.10 0.00 0.00 33.01 31.09 1crp s GLN 43 CO -0.09 -0.59 0.03 0.14 -0.55 0.00 0.00 175.29 174.22 1crp s VAL 44 N 1.11 0.47 0.33 1.34 -7.23 -1.17 -4.94 120.40 110.32 1crp s VAL 44 Ca -0.08 -1.96 -0.19 0.00 -1.81 0.00 0.00 61.98 57.94 1crp s VAL 44 Cb -0.20 -2.12 -0.10 0.00 0.56 0.00 0.00 36.38 34.52 1crp s VAL 44 CO -0.05 -0.44 0.83 -0.69 -0.31 0.00 0.00 175.10 174.44 1crp s VAL 45 N -3.80 4.50 0.00 1.32 1.01 -1.26 -1.99 120.40 120.17 1crp s VAL 45 Ca 0.25 1.31 0.00 0.00 0.00 0.00 0.00 61.98 63.54 1crp s VAL 45 Cb 0.07 -3.72 0.00 0.00 0.00 0.00 0.00 36.38 32.73 1crp s VAL 45 CO 0.04 -0.10 0.00 -0.38 0.00 0.00 0.00 175.10 174.66 1crp n ILE 46 N -0.09 0.00 0.32 2.22 5.41 -1.26 -4.89 119.36 121.06 1crp n ILE 46 Ca 0.03 0.00 0.21 0.00 1.00 0.00 0.00 62.75 63.99 1crp n ILE 46 Cb 0.52 0.00 1.01 0.00 -0.71 0.00 0.00 39.64 40.47 1crp n ILE 46 CO 0.00 0.00 0.00 0.44 0.00 0.00 0.00 176.55 176.99 1crp h ASP 47 N 0.00 0.00 -4.65 4.38 3.32 -1.93 -3.48 116.42 114.07 1crp h ASP 47 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 1crp h ASP 47 Cb 0.00 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.55 1crp h ASP 47 CO 0.00 0.00 0.00 0.61 -1.72 0.00 0.00 179.24 178.13 1crp n GLY 48 N -0.63 3.69 2.32 2.75 0.00 -1.26 -5.01 105.19 107.04 1crp n GLY 48 Ca -0.02 -1.77 -0.16 0.00 0.00 0.00 0.00 46.02 44.08 1crp n GLY 48 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1crp n GLU 49 N -1.35 -1.24 -1.42 1.61 1.02 -1.26 -4.68 120.64 113.33 1crp n GLU 49 Ca 0.00 0.80 0.17 0.00 -0.02 0.00 0.00 57.16 58.11 1crp n GLU 49 Cb 0.00 -5.15 -0.09 0.00 -0.02 0.00 0.00 31.44 26.19 1crp n GLU 49 CO 0.00 0.00 0.00 2.41 1.18 0.00 0.00 177.13 180.72 1crp n THR 50 N -3.85 -0.66 -3.54 2.62 -1.04 -1.26 -4.87 114.28 101.68 1crp n THR 50 Ca -0.18 0.81 -0.00 0.00 -2.04 0.00 0.00 64.05 62.63 1crp n THR 50 Cb 0.63 -1.29 -0.05 0.00 -1.82 0.00 0.00 70.33 67.80 1crp n THR 50 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1crp s LEU 52 N 1.77 4.26 -0.28 0.00 2.96 -0.43 -3.04 118.68 123.92 1crp s LEU 52 Ca -0.06 1.18 0.03 0.00 -0.22 0.00 0.00 54.13 55.05 1crp s LEU 52 Cb -0.04 -3.14 0.07 0.00 0.50 0.00 0.00 46.19 43.58 1crp s LEU 52 CO -0.16 -0.22 -0.06 -0.76 -1.32 0.00 0.00 176.35 173.83 1crp s LEU 53 N 1.32 3.70 0.34 -0.68 1.02 -1.09 -2.22 118.68 121.06 1crp s LEU 53 Ca 0.38 -1.59 -0.28 0.00 0.02 0.00 0.00 54.13 52.65 1crp s LEU 53 Cb -0.17 -1.52 -0.10 0.00 0.02 0.00 0.00 46.19 44.41 1crp s LEU 53 CO 0.16 -0.25 1.31 -0.62 0.02 0.00 0.00 176.35 176.97 1crp s ASP 54 N 1.09 6.71 -0.16 2.29 -1.08 0.11 -4.10 116.67 121.52 1crp s ASP 54 Ca -0.03 2.69 -0.01 0.00 -0.52 0.00 0.00 52.55 54.69 1crp s ASP 54 Cb -0.20 -2.65 -0.01 0.00 -1.46 0.00 0.00 42.92 38.61 1crp s ASP 54 CO -0.06 -0.58 -0.12 -0.63 0.52 0.00 0.00 175.17 174.30 1crp s ILE 55 N -1.16 2.91 -0.08 4.11 -1.09 -0.43 -0.94 121.20 124.53 1crp s ILE 55 Ca 0.50 -0.68 0.02 0.00 -2.23 0.00 0.00 60.65 58.26 1crp s ILE 55 Cb -0.40 -2.25 0.01 0.00 -1.58 0.00 0.00 42.46 38.24 1crp s ILE 55 CO 0.53 0.50 -0.14 -0.22 -1.23 0.00 0.00 174.94 174.37 1crp s LEU 56 N 0.87 1.69 0.00 2.97 0.20 -1.15 -1.22 118.68 122.03 1crp s LEU 56 Ca -0.03 -0.36 0.02 0.00 0.69 0.00 0.00 54.13 54.44 1crp s LEU 56 Cb -0.15 -0.96 -0.01 0.00 -0.43 0.00 0.00 46.19 44.65 1crp s LEU 56 CO -0.00 0.04 0.07 -0.67 -0.29 0.00 0.00 176.35 175.49 1crp n ASP 57 N 3.94 2.33 -4.34 3.68 2.03 -1.25 -2.89 116.55 120.04 1crp n ASP 57 Ca -0.21 -3.13 -0.18 0.00 0.52 0.00 0.00 54.79 51.80 1crp n ASP 57 Cb 0.52 0.66 -0.10 0.00 -0.72 0.00 0.00 41.12 41.47 1crp n ASP 57 CO 0.00 0.00 0.00 0.42 -1.92 0.00 0.00 177.20 175.70 1crp s THR 58 N -2.90 0.93 0.09 5.18 -4.23 -1.26 -4.72 115.64 108.73 1crp s THR 58 Ca 0.10 -2.02 -0.05 0.00 -1.18 0.00 0.00 61.69 58.54 1crp s THR 58 Cb 0.00 -2.49 0.02 0.00 1.34 0.00 0.00 72.50 71.38 1crp s THR 58 CO 0.07 -0.19 0.25 0.00 -0.54 0.00 0.00 174.62 174.21 1crp n ALA 59 N -0.47 -0.61 0.00 3.99 0.00 -1.26 -5.02 120.51 117.14 1crp n ALA 59 Ca -0.03 -0.34 0.00 0.00 0.00 0.00 0.00 53.44 53.06 1crp n ALA 59 Cb 0.65 0.25 0.00 0.00 0.00 0.00 0.00 19.45 20.35 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 -0.17 2.71 3.42 0.00 0.00 -1.22 -4.88 105.19 105.04 1crp n GLY 60 Ca -0.02 -0.81 -0.19 0.00 0.00 0.00 0.00 46.02 45.00 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 0.00 -6.92 -1.02 1.61 6.02 -1.26 -4.89 117.38 110.92 1crp n GLN 61 Ca 0.00 0.82 -0.02 0.00 -0.01 0.00 0.00 57.00 57.79 1crp n GLN 61 Cb 0.00 -5.77 -0.02 0.00 1.02 0.00 0.00 30.24 25.47 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 -4.35 0.00 -0.35 -1.09 1.02 -1.26 -5.14 120.64 109.47 1crp n GLU 62 Ca -0.17 -1.16 0.05 0.00 -0.02 0.00 0.00 57.16 55.85 1crp n GLU 62 Cb 0.62 0.14 -0.01 0.00 -0.02 0.00 0.00 31.44 32.17 1crp n GLU 62 CO 0.00 0.00 0.00 0.39 1.18 0.00 0.00 177.13 178.70 1crp n GLU 63 N 0.16 -0.70 0.00 3.49 4.71 -1.26 -4.88 120.64 122.16 1crp n GLU 63 Ca -0.09 0.46 0.00 0.00 -0.01 0.00 0.00 57.16 57.52 1crp n GLU 63 Cb 0.81 -0.86 0.00 0.00 -1.01 0.00 0.00 31.44 30.38 1crp n GLU 63 CO 0.00 0.00 0.00 0.98 0.09 0.00 0.00 177.13 178.20 1crp n TYR 64 N -2.29 0.00 -2.27 -0.32 9.36 -1.26 -4.98 117.16 115.41 1crp n TYR 64 Ca 0.00 0.00 -0.01 0.00 3.32 0.00 0.00 57.90 61.21 1crp n TYR 64 Cb 0.16 0.06 0.00 0.00 -0.63 0.00 0.00 39.34 38.93 1crp n TYR 64 CO 0.00 0.00 0.00 0.43 0.22 0.00 0.00 176.86 177.51 1crp n SER 65 N 0.38 -5.74 0.00 2.98 7.64 -1.26 -4.88 113.62 112.74 1crp n SER 65 Ca 0.00 0.79 0.15 0.00 1.01 0.00 0.00 58.87 60.81 1crp n SER 65 Cb 0.00 -3.70 0.81 0.00 -1.01 0.00 0.00 64.21 60.31 1crp n SER 65 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1crp n ALA 66 N 0.28 2.52 0.36 -0.43 0.00 -1.26 -3.42 120.51 118.56 1crp n ALA 66 Ca 0.01 -0.16 0.12 0.00 0.00 0.00 0.00 53.44 53.41 1crp n ALA 66 Cb 0.06 -1.47 0.51 0.00 0.00 0.00 0.00 19.45 18.54 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 -1.13 0.19 0.17 0.00 1.56 -1.26 -1.83 117.12 114.82 1crp n MET 67 Ca 0.18 0.46 0.05 0.00 -0.27 0.00 0.00 57.70 58.12 1crp n MET 67 Cb 0.16 -1.90 0.15 0.00 2.15 0.00 0.00 33.22 33.78 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 0.00 0.10 2.12 2.43 -1.92 -1.54 114.38 115.56 1crp h ARG 68 Ca 0.00 0.00 -0.00 0.00 -0.81 0.00 0.00 59.98 59.17 1crp h ARG 68 Cb 0.32 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.87 1crp h ARG 68 CO 0.00 0.40 -0.05 0.22 -1.51 0.00 0.00 179.97 179.03 1crp h ASP 69 N 0.00 -0.11 0.29 -3.80 1.82 -1.62 -1.27 116.42 111.73 1crp h ASP 69 Ca -0.00 -0.40 -0.13 0.00 -0.39 0.00 0.00 57.03 56.10 1crp h ASP 69 Cb 1.19 0.03 -0.01 0.00 0.68 0.00 0.00 39.33 41.22 1crp h ASP 69 CO 0.05 0.37 -0.52 1.56 -1.61 0.00 0.00 179.24 179.09 1crp h GLN 70 N -0.63 0.26 -0.20 0.28 1.08 -1.62 -1.39 115.11 112.89 1crp h GLN 70 Ca -0.01 -0.15 -0.03 0.00 -1.45 0.00 0.00 58.65 57.00 1crp h GLN 70 Cb 0.50 0.01 -0.01 0.00 -0.05 0.00 0.00 27.48 27.94 1crp h GLN 70 CO 0.02 0.72 -0.03 -0.92 -0.95 0.00 0.00 178.83 177.68 1crp h TYR 71 N 0.20 0.29 0.00 2.96 3.20 -1.27 -1.04 116.97 121.32 1crp h TYR 71 Ca 0.01 -0.02 -0.08 0.00 3.14 0.00 0.00 58.73 61.77 1crp h TYR 71 Cb 0.99 -0.09 -0.01 0.00 1.54 0.00 0.00 36.73 39.16 1crp h TYR 71 CO 0.02 0.33 -0.62 0.52 -1.64 0.00 0.00 178.16 176.77 1crp h MET 72 N 0.28 0.00 -0.88 1.82 2.86 -0.76 -3.17 114.93 115.09 1crp h MET 72 Ca 0.06 0.00 -0.26 0.00 -2.06 0.00 0.00 59.70 57.44 1crp h MET 72 Cb 0.24 0.00 -0.16 0.00 0.06 0.00 0.00 31.60 31.74 1crp h MET 72 CO 0.01 0.30 0.33 -2.13 1.06 0.00 0.00 176.91 176.48 1crp n ARG 73 N -3.08 2.81 0.11 1.72 0.63 -0.44 -4.50 116.66 113.92 1crp n ARG 73 Ca 0.00 -2.46 0.00 0.00 -0.92 0.00 0.00 57.85 54.47 1crp n ARG 73 Cb 0.69 -2.01 0.00 0.00 0.45 0.00 0.00 32.46 31.59 1crp n ARG 73 CO 0.00 0.00 0.00 0.25 -2.51 0.00 0.00 177.63 175.37 1crp n THR 74 N -0.33 0.25 -0.48 5.15 -2.24 -0.94 -4.99 114.28 110.69 1crp n THR 74 Ca 0.39 0.08 -0.08 0.00 -2.27 0.00 0.00 64.05 62.16 1crp n THR 74 Cb 1.29 -0.75 0.07 0.00 -2.10 0.00 0.00 70.33 68.84 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 1.95 -2.90 0.00 3.38 0.00 -1.20 -5.00 105.19 101.42 1crp n GLY 75 Ca 0.00 -1.40 0.00 0.00 0.00 0.00 0.00 46.02 44.62 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 -2.62 0.00 -2.60 1.61 4.71 -1.25 -4.97 120.64 115.53 1crp n GLU 76 Ca 0.04 0.00 -0.42 0.00 -0.01 0.00 0.00 57.16 56.77 1crp n GLU 76 Cb 0.17 -0.40 -0.03 0.00 -1.01 0.00 0.00 31.44 30.17 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 -1.65 1.11 -0.71 0.62 0.00 -0.84 -4.19 107.32 101.67 1crp s GLY 77 Ca 0.00 -0.97 -0.18 0.00 0.00 0.00 0.00 44.72 43.57 1crp s GLY 77 CO 0.00 2.49 0.81 -1.36 0.00 0.00 0.00 173.10 175.04 1crp s PHE 78 N 5.01 3.15 -1.09 1.90 0.40 -1.12 0.48 117.98 126.71 1crp s PHE 78 Ca 0.40 -1.23 -0.18 0.00 -0.60 0.00 0.00 56.93 55.32 1crp s PHE 78 Cb -0.08 -4.04 0.12 0.00 0.51 0.00 0.00 43.02 39.52 1crp s PHE 78 CO 0.23 -1.29 1.39 -1.17 0.70 0.00 0.00 175.22 175.08 1crp s LEU 79 N 2.26 4.53 -0.95 -0.37 2.96 -0.96 -1.23 118.68 124.91 1crp s LEU 79 Ca 0.17 -2.26 -0.24 0.00 -0.22 0.00 0.00 54.13 51.57 1crp s LEU 79 Cb -0.17 -2.47 -0.07 0.00 0.50 0.00 0.00 46.19 43.98 1crp s LEU 79 CO 0.00 -1.08 2.01 0.00 -1.32 0.00 0.00 176.35 175.96 1crp s VAL 81 N 11.14 3.54 -0.30 0.00 1.01 -0.37 -1.60 120.40 133.82 1crp s VAL 81 Ca 0.73 0.65 -0.00 0.00 0.00 0.00 0.00 61.98 63.36 1crp s VAL 81 Cb -0.06 -3.20 0.19 0.00 0.00 0.00 0.00 36.38 33.31 1crp s VAL 81 CO 0.04 -0.51 0.60 0.72 0.00 0.00 0.00 175.10 175.94 1crp s PHE 82 N -2.57 -1.63 0.26 5.22 -0.12 -1.01 -4.23 117.98 113.90 1crp s PHE 82 Ca 0.64 1.62 -0.30 0.00 -0.05 0.00 0.00 56.93 58.84 1crp s PHE 82 Cb -0.18 0.53 -0.10 0.00 -0.63 0.00 0.00 43.02 42.64 1crp s PHE 82 CO 0.44 -0.91 1.37 0.00 -0.05 0.00 0.00 175.22 176.08 1crp s ALA 83 N 2.85 3.57 -0.54 1.99 0.00 -1.26 -1.04 121.76 127.33 1crp s ALA 83 Ca 0.19 1.26 -0.01 0.00 0.00 0.00 0.00 51.96 53.40 1crp s ALA 83 Cb -0.14 -3.52 0.37 0.00 0.00 0.00 0.00 23.12 19.83 1crp s ALA 83 CO -0.22 -0.66 2.02 0.44 0.00 0.00 0.00 175.76 177.34 1crp n ILE 84 N 1.98 3.32 0.03 0.00 -5.35 -0.78 -4.09 119.36 114.47 1crp n ILE 84 Ca 0.05 -2.45 0.00 0.00 -0.27 0.00 0.00 62.75 60.08 1crp n ILE 84 Cb 0.41 -1.20 0.00 0.00 -1.74 0.00 0.00 39.64 37.11 1crp n ILE 84 CO 0.00 0.00 0.00 0.59 -1.76 0.00 0.00 176.55 175.38 1crp n ASN 85 N -0.48 0.20 0.10 7.28 4.13 -1.26 -2.90 115.26 122.33 1crp n ASN 85 Ca 0.51 0.10 -0.04 0.00 1.68 0.00 0.00 54.58 56.84 1crp n ASN 85 Cb 0.66 -0.01 0.05 0.00 -1.54 0.00 0.00 39.78 38.94 1crp n ASN 85 CO 0.00 0.00 0.00 -0.55 0.28 0.00 0.00 177.26 176.99 1crp h ASN 86 N 0.00 0.00 0.00 6.41 7.08 -1.97 -3.41 115.58 123.69 1crp h ASN 86 Ca 0.00 0.00 0.00 0.00 -3.08 0.00 0.00 56.30 53.22 1crp h ASN 86 Cb 0.38 0.00 0.00 0.00 -2.08 0.00 0.00 38.32 36.62 1crp h ASN 86 CO 0.00 0.77 0.00 0.41 -2.08 0.00 0.00 177.43 176.53 1crp n THR 87 N -3.61 0.00 0.30 6.14 -1.04 -1.26 -4.79 114.28 110.03 1crp n THR 87 Ca -0.01 0.00 0.19 0.00 -2.04 0.00 0.00 64.05 62.20 1crp n THR 87 Cb 0.75 0.00 0.96 0.00 -1.82 0.00 0.00 70.33 70.22 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 0.40 0.00 -0.10 -2.82 1.63 -1.91 -1.16 116.57 112.61 1crp h LYS 88 Ca 0.00 0.00 -0.16 0.00 -0.85 0.00 0.00 60.65 59.64 1crp h LYS 88 Cb 0.00 0.00 -0.01 0.00 -0.60 0.00 0.00 32.23 31.62 1crp h LYS 88 CO 0.00 0.00 -0.63 0.77 -3.45 0.00 0.00 179.45 176.14 1crp h SER 89 N 0.00 0.42 0.19 4.20 0.02 -1.87 -0.78 113.55 115.74 1crp h SER 89 Ca 0.00 -0.25 -0.01 0.00 -0.84 0.00 0.00 61.79 60.69 1crp h SER 89 Cb 0.16 -0.12 0.00 0.00 0.14 0.00 0.00 62.40 62.58 1crp h SER 89 CO 0.00 0.95 -0.09 0.15 -1.14 0.00 0.00 176.83 176.70 1crp h PHE 90 N 0.27 -0.24 0.00 3.45 3.57 -1.45 -1.31 116.94 121.23 1crp h PHE 90 Ca -0.01 -0.01 -0.01 0.00 3.53 0.00 0.00 57.97 61.47 1crp h PHE 90 Cb 1.17 0.08 -0.00 0.00 2.79 0.00 0.00 35.95 39.99 1crp h PHE 90 CO 0.03 0.07 -0.05 0.93 -2.23 0.00 0.00 178.31 177.07 1crp h GLU 91 N -0.56 0.00 0.06 1.11 5.08 -1.51 -2.22 114.58 116.54 1crp h GLU 91 Ca -0.03 0.00 -0.24 0.00 -1.00 0.00 0.00 59.36 58.10 1crp h GLU 91 Cb 0.42 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.65 1crp h GLU 91 CO 0.04 0.05 -1.09 -0.44 -1.00 0.00 0.00 179.01 176.56 1crp h ASP 92 N 0.00 0.21 0.49 1.42 5.19 -0.76 -3.20 116.42 119.77 1crp h ASP 92 Ca -0.00 -0.22 -0.10 0.00 -0.62 0.00 0.00 57.03 56.09 1crp h ASP 92 Cb 0.27 -0.07 -0.01 0.00 0.18 0.00 0.00 39.33 39.70 1crp h ASP 92 CO 0.01 1.16 -0.47 0.40 -3.12 0.00 0.00 179.24 177.21 1crp h ILE 93 N 0.04 1.32 -0.68 0.35 1.08 -0.62 0.31 117.51 119.31 1crp h ILE 93 Ca -0.07 -1.63 -0.04 0.00 -0.39 0.00 0.00 64.86 62.73 1crp h ILE 93 Cb 1.83 1.88 -0.03 0.00 -3.07 0.00 0.00 36.82 37.43 1crp h ILE 93 CO 0.16 0.46 0.25 -0.74 -0.69 0.00 0.00 178.15 177.59 1crp h HIS 94 N 0.00 1.03 -0.08 1.37 2.76 -1.51 -2.49 115.15 116.22 1crp h HIS 94 Ca -0.00 -0.08 0.00 0.00 -2.20 0.00 0.00 60.37 58.09 1crp h HIS 94 Cb 0.85 -0.31 0.00 0.00 1.55 0.00 0.00 27.41 29.50 1crp h HIS 94 CO 0.00 0.80 0.00 1.04 -1.30 0.00 0.00 177.93 178.47 1crp n GLN 95 N -4.29 1.98 0.01 5.26 6.02 -1.03 -4.28 117.38 121.05 1crp n GLN 95 Ca 0.06 -1.82 0.03 0.00 -0.01 0.00 0.00 57.00 55.26 1crp n GLN 95 Cb 0.19 -1.41 -0.11 0.00 1.02 0.00 0.00 30.24 29.94 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 1.20 0.55 0.57 1.08 4.02 0.11 -3.94 117.16 120.74 1crp n TYR 96 Ca 0.13 0.18 0.04 0.00 -0.01 0.00 0.00 57.90 58.24 1crp n TYR 96 Cb 0.53 -0.90 0.16 0.00 -0.02 0.00 0.00 39.34 39.11 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 -2.67 2.23 -0.09 -0.72 -4.01 -0.96 -3.72 116.66 106.72 1crp n ARG 97 Ca -0.11 -1.30 -0.12 0.00 -1.04 0.00 0.00 57.85 55.28 1crp n ARG 97 Cb 0.78 -1.53 -0.08 0.00 -3.04 0.00 0.00 32.46 28.58 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 0.38 0.54 0.26 2.89 1.02 -1.25 -4.24 120.64 120.24 1crp n GLU 98 Ca 0.12 0.09 0.11 0.00 -0.02 0.00 0.00 57.16 57.47 1crp n GLU 98 Cb 0.47 -1.36 0.69 0.00 -0.02 0.00 0.00 31.44 31.22 1crp n GLU 98 CO 0.00 0.00 0.00 0.37 1.18 0.00 0.00 177.13 178.68 1crp h GLN 99 N 0.00 0.00 -0.37 3.49 5.75 -1.72 -0.75 115.11 121.51 1crp h GLN 99 Ca -0.40 0.00 -0.16 0.00 -0.15 0.00 0.00 58.65 57.94 1crp h GLN 99 Cb 1.64 0.00 -0.01 0.00 1.07 0.00 0.00 27.48 30.18 1crp h GLN 99 CO -0.06 0.13 -0.41 0.82 -2.65 0.00 0.00 178.83 176.66 1crp h ILE 100 N 0.00 1.27 0.00 2.39 2.04 -1.76 -1.60 117.51 119.86 1crp h ILE 100 Ca -0.00 -1.59 -0.04 0.00 1.00 0.00 0.00 64.86 64.23 1crp h ILE 100 Cb 0.32 1.42 -0.01 0.00 -0.74 0.00 0.00 36.82 37.82 1crp h ILE 100 CO 0.02 0.53 -0.18 0.11 0.00 0.00 0.00 178.15 178.62 1crp h LYS 101 N 0.74 0.00 0.63 2.37 1.57 -1.36 -2.40 116.57 118.13 1crp h LYS 101 Ca 0.05 0.00 -0.03 0.00 -1.87 0.00 0.00 60.65 58.80 1crp h LYS 101 Cb 1.01 0.00 0.01 0.00 0.08 0.00 0.00 32.23 33.33 1crp h LYS 101 CO 0.10 0.18 -0.30 -0.09 -0.57 0.00 0.00 179.45 178.77 1crp h ARG 102 N 0.00 -0.81 0.06 3.15 2.43 -0.30 0.43 114.38 119.34 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 0.40 0.18 -0.00 0.00 -0.42 0.00 0.00 29.97 30.13 1crp h ARG 102 CO 0.02 -0.51 -0.05 0.28 -1.51 0.00 0.00 179.97 178.20 1crp h VAL 103 N -1.15 0.00 0.00 0.20 2.07 -1.22 -2.01 116.25 114.14 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 0.68 0.00 0.00 0.00 -1.52 0.00 0.00 31.29 30.45 1crp h VAL 103 CO 0.14 0.00 0.00 0.11 0.02 0.00 0.00 177.57 177.84 1crp h LYS 104 N -0.11 0.00 -5.69 1.57 1.79 -1.58 -3.46 116.57 109.09 1crp h LYS 104 Ca -0.01 0.00 -0.37 0.00 -2.18 0.00 0.00 60.65 58.09 1crp h LYS 104 Cb 0.10 0.00 0.15 0.00 -1.58 0.00 0.00 32.23 30.89 1crp h LYS 104 CO -0.00 0.00 -0.70 -0.25 -1.08 0.00 0.00 179.45 177.42 1crp n ASP 105 N -2.59 -4.81 -3.69 0.86 9.92 0.14 -4.97 116.55 111.41 1crp n ASP 105 Ca -0.01 -0.56 -0.05 0.00 -0.53 0.00 0.00 54.79 53.65 1crp n ASP 105 Cb 0.13 -4.98 -0.01 0.00 -0.64 0.00 0.00 41.12 35.62 1crp n ASP 105 CO 0.00 0.00 0.00 -0.44 0.13 0.00 0.00 177.20 176.89 1crp s SER 106 N -3.67 -0.22 -0.69 -2.24 0.01 -0.64 -5.00 113.70 101.24 1crp s SER 106 Ca 0.37 -0.30 0.05 0.00 1.31 0.00 0.00 55.95 57.39 1crp s SER 106 Cb -0.16 0.46 0.24 0.00 0.21 0.00 0.00 66.02 66.76 1crp s SER 106 CO 0.71 -0.82 0.76 0.47 0.41 0.00 0.00 173.24 174.78 1crp n ASP 107 N -0.42 3.86 -2.72 2.44 8.00 -1.26 -4.18 116.55 122.28 1crp n ASP 107 Ca -0.07 -3.40 -0.08 0.00 0.71 0.00 0.00 54.79 51.96 1crp n ASP 107 Cb 0.61 -0.74 0.10 0.00 -0.02 0.00 0.00 41.12 41.07 1crp n ASP 107 CO 0.00 0.00 0.00 -0.90 -0.39 0.00 0.00 177.20 175.91 1crp n ASP 108 N 1.12 -1.91 -4.93 -2.24 5.68 -1.26 -5.13 116.55 107.87 1crp n ASP 108 Ca 0.28 -2.96 -0.27 0.00 -0.50 0.00 0.00 54.79 51.34 1crp n ASP 108 Cb 0.39 1.29 -0.03 0.00 -1.14 0.00 0.00 41.12 41.63 1crp n ASP 108 CO 0.00 0.00 0.00 -0.69 -1.33 0.00 0.00 177.20 175.18 1crp s VAL 109 N 0.06 5.21 -1.30 2.12 1.01 -1.26 -4.97 120.40 121.27 1crp s VAL 109 Ca 0.23 -0.42 -0.17 0.00 0.00 0.00 0.00 61.98 61.61 1crp s VAL 109 Cb 0.36 -3.74 0.03 0.00 0.00 0.00 0.00 36.38 33.02 1crp s VAL 109 CO -0.07 -0.19 1.93 -0.81 0.00 0.00 0.00 175.10 175.96 1crp n PRO 110 N -0.73 2.81 -2.20 2.72 -0.04 -1.26 -4.94 135.00 131.36 1crp n PRO 110 Ca -0.05 -2.88 -0.32 0.00 -0.04 0.00 0.00 63.50 60.21 1crp n PRO 110 Cb 0.54 -3.41 -0.02 0.00 -0.04 0.00 0.00 33.50 30.57 1crp n PRO 110 CO 0.00 0.00 0.00 1.41 -0.04 0.00 0.00 175.50 176.87 1crp s MET 111 N 4.18 3.78 -0.27 0.54 1.75 -1.26 -2.80 119.30 125.22 1crp s MET 111 Ca 0.53 0.91 -0.00 0.00 -1.25 0.00 0.00 55.69 55.88 1crp s MET 111 Cb 0.08 -2.11 0.16 0.00 2.84 0.00 0.00 34.83 35.79 1crp s MET 111 CO 0.03 -0.41 0.44 0.08 -0.65 0.00 0.00 175.02 174.51 1crp s VAL 112 N -2.79 -0.71 -0.61 10.11 1.01 -0.36 -4.49 120.40 122.56 1crp s VAL 112 Ca 0.58 -0.12 -0.25 0.00 0.00 0.00 0.00 61.98 62.20 1crp s VAL 112 Cb -0.11 -0.91 0.04 0.00 0.00 0.00 0.00 36.38 35.41 1crp s VAL 112 CO 0.39 -0.14 1.03 -0.22 0.00 0.00 0.00 175.10 176.16 1crp s LEU 113 N 2.62 3.94 -0.55 3.92 2.96 -0.99 -0.35 118.68 130.23 1crp s LEU 113 Ca 0.13 -0.44 -0.10 0.00 -0.22 0.00 0.00 54.13 53.50 1crp s LEU 113 Cb -0.14 -2.75 0.14 0.00 0.50 0.00 0.00 46.19 43.94 1crp s LEU 113 CO -0.21 -1.40 0.43 -0.69 -1.32 0.00 0.00 176.35 173.16 1crp s VAL 114 N 4.37 4.45 -0.38 1.68 1.01 -0.63 -2.11 120.40 128.80 1crp s VAL 114 Ca 0.31 -1.99 -0.28 0.00 0.00 0.00 0.00 61.98 60.02 1crp s VAL 114 Cb -0.12 -3.89 -0.03 0.00 0.00 0.00 0.00 36.38 32.34 1crp s VAL 114 CO 0.18 -0.83 1.96 -0.83 0.00 0.00 0.00 175.10 175.57 1crp s GLY 115 N 2.48 0.50 0.78 4.51 0.00 -0.34 -2.40 107.32 112.84 1crp s GLY 115 Ca 0.08 0.17 -0.07 0.00 0.00 0.00 0.00 44.72 44.91 1crp s GLY 115 CO -0.02 3.49 1.09 0.21 0.00 0.00 0.00 173.10 177.88 1crp s ASN 116 N 7.55 4.16 -0.61 1.64 2.47 -0.21 -1.74 114.94 128.21 1crp s ASN 116 Ca 0.84 0.09 -0.03 0.00 0.42 0.00 0.00 52.86 54.17 1crp s ASN 116 Cb -0.22 -0.48 0.00 0.00 -1.45 0.00 0.00 41.25 39.11 1crp s ASN 116 CO 0.31 -2.01 0.53 1.17 -3.72 0.00 0.00 177.10 173.37 1crp n LYS 117 N -3.12 -3.55 0.00 0.43 3.00 -0.38 -1.87 118.16 112.67 1crp n LYS 117 Ca 0.13 0.38 0.15 0.00 -0.00 0.00 0.00 58.31 58.96 1crp n LYS 117 Cb 0.60 -4.04 0.73 0.00 0.00 0.00 0.00 35.03 32.32 1crp n LYS 117 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1crp s ASP 119 N -2.19 6.19 -0.00 0.00 -4.77 -1.26 -4.98 116.67 109.65 1crp s ASP 119 Ca 0.38 -1.64 -0.05 0.00 -3.30 0.00 0.00 52.55 47.94 1crp s ASP 119 Cb 0.21 -2.24 0.02 0.00 -1.09 0.00 0.00 42.92 39.81 1crp s ASP 119 CO 0.40 -0.94 0.22 0.00 0.70 0.00 0.00 175.17 175.55 1crp n LEU 120 N 5.64 0.00 -0.00 2.11 -0.00 -1.26 -5.07 117.00 118.42 1crp n LEU 120 Ca -0.12 -0.07 -0.00 0.00 -0.00 0.00 0.00 56.01 55.82 1crp n LEU 120 Cb 0.41 0.32 -0.00 0.00 -0.00 0.00 0.00 43.42 44.15 1crp n LEU 120 CO 0.55 -0.02 -0.50 0.00 -0.00 0.00 0.00 177.39 177.42 1crp n ALA 121 N -2.64 2.35 -2.78 1.47 0.00 -1.26 -4.88 120.51 112.76 1crp n ALA 121 Ca -0.02 -0.00 -0.43 0.00 0.00 0.00 0.00 53.44 52.99 1crp n ALA 121 Cb 0.10 0.50 -0.03 0.00 0.00 0.00 0.00 19.45 20.02 1crp n ALA 121 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1crp s ALA 122 N -2.00 3.14 -0.44 0.00 0.00 -1.26 -4.97 121.76 116.22 1crp s ALA 122 Ca -0.00 -2.60 -0.24 0.00 0.00 0.00 0.00 51.96 49.12 1crp s ALA 122 Cb 0.00 -4.24 0.02 0.00 0.00 0.00 0.00 23.12 18.90 1crp s ALA 122 CO 0.00 -3.22 0.83 0.50 0.00 0.00 0.00 175.76 173.87 1crp s ARG 123 N 3.53 3.49 0.21 0.00 3.52 -1.26 -4.87 118.95 123.57 1crp s ARG 123 Ca 0.38 0.03 0.06 0.00 -0.13 0.00 0.00 55.73 56.07 1crp s ARG 123 Cb -0.03 -3.92 0.14 0.00 -1.56 0.00 0.00 34.95 29.58 1crp s ARG 123 CO -0.09 -1.12 1.48 1.79 -0.81 0.00 0.00 175.30 176.55 1crp h THR 124 N 5.98 1.48 -3.49 4.11 1.35 -1.76 -3.38 112.91 117.19 1crp h THR 124 Ca -0.24 -2.41 -0.76 0.00 -0.55 0.00 0.00 66.41 62.45 1crp h THR 124 Cb 1.08 2.30 -0.27 0.00 -1.73 0.00 0.00 68.15 69.53 1crp h THR 124 CO 0.97 0.70 -0.14 -0.69 -0.25 0.00 0.00 175.52 176.11 1crp s VAL 125 N -3.41 4.99 0.65 6.82 1.01 -1.23 -5.03 120.40 124.20 1crp s VAL 125 Ca -0.02 -2.15 -0.18 0.00 0.00 0.00 0.00 61.98 59.63 1crp s VAL 125 Cb 0.11 -4.16 -0.01 0.00 0.00 0.00 0.00 36.38 32.32 1crp s VAL 125 CO 0.80 -0.92 1.26 -1.83 0.00 0.00 0.00 175.10 174.41 1crp s GLU 126 N 0.74 2.59 1.13 2.72 -1.05 -1.26 -4.95 118.70 118.61 1crp s GLU 126 Ca 0.12 1.95 -0.13 0.00 -0.15 0.00 0.00 54.97 56.76 1crp s GLU 126 Cb -0.20 -1.86 0.24 0.00 -0.44 0.00 0.00 34.13 31.87 1crp s GLU 126 CO -0.03 -1.54 0.87 0.43 0.95 0.00 0.00 175.26 175.93 1crp n SER 127 N -1.96 -1.56 0.00 0.83 7.64 -1.26 -3.02 113.62 114.28 1crp n SER 127 Ca 0.15 -0.06 0.00 0.00 1.01 0.00 0.00 58.87 59.97 1crp n SER 127 Cb 0.49 -1.25 0.00 0.00 -1.01 0.00 0.00 64.21 62.44 1crp n SER 127 CO 0.00 0.00 0.00 -1.14 -3.01 0.00 0.00 175.04 170.89 1crp n ARG 128 N -4.35 0.00 -0.11 1.43 0.63 -1.26 -4.77 116.66 108.23 1crp n ARG 128 Ca 0.04 0.00 -0.18 0.00 -0.92 0.00 0.00 57.85 56.79 1crp n ARG 128 Cb 0.55 -2.63 -0.12 0.00 0.45 0.00 0.00 32.46 30.71 1crp n ARG 128 CO 0.00 0.00 0.00 1.04 -2.51 0.00 0.00 177.63 176.16 1crp n GLN 129 N -2.00 0.66 0.18 -0.14 1.13 -1.17 -3.29 117.38 112.75 1crp n GLN 129 Ca 0.00 0.15 0.06 0.00 -1.94 0.00 0.00 57.00 55.27 1crp n GLN 129 Cb 0.00 -1.54 0.21 0.00 0.11 0.00 0.00 30.24 29.02 1crp n GLN 129 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 1crp h ALA 130 N 0.08 0.85 0.11 -1.58 0.00 -1.86 -1.63 119.26 115.23 1crp h ALA 130 Ca -0.56 -0.32 -0.27 0.00 0.00 0.00 0.00 54.91 53.76 1crp h ALA 130 Cb 1.94 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 19.67 1crp h ALA 130 CO -0.06 0.44 -1.24 -0.56 0.00 0.00 0.00 179.25 177.83 1crp h GLN 131 N 0.00 0.23 0.00 0.00 3.07 -1.94 -2.20 115.11 114.27 1crp h GLN 131 Ca -0.00 -0.39 -0.10 0.00 0.09 0.00 0.00 58.65 58.25 1crp h GLN 131 Cb 1.09 0.15 -0.01 0.00 0.08 0.00 0.00 27.48 28.78 1crp h GLN 131 CO 0.05 1.17 -0.45 -0.44 0.09 0.00 0.00 178.83 179.25 1crp h ASP 132 N 0.06 0.00 0.34 0.06 5.19 -1.53 -1.36 116.42 119.19 1crp h ASP 132 Ca -0.13 0.00 -0.32 0.00 -0.62 0.00 0.00 57.03 55.96 1crp h ASP 132 Cb 1.95 0.00 -0.01 0.00 0.18 0.00 0.00 39.33 41.45 1crp h ASP 132 CO 0.19 0.45 -1.70 0.25 -3.12 0.00 0.00 179.24 175.31 1crp h LEU 133 N 0.00 0.37 0.00 1.55 6.46 -1.34 -3.35 115.31 119.01 1crp h LEU 133 Ca -0.00 -0.62 -0.14 0.00 -0.12 0.00 0.00 57.88 57.00 1crp h LEU 133 Cb 1.25 -0.12 -0.02 0.00 -0.73 0.00 0.00 40.66 41.03 1crp h LEU 133 CO 0.06 1.53 -0.75 0.00 -0.62 0.00 0.00 178.44 178.67 1crp h ALA 134 N 0.41 0.61 -0.19 1.25 0.00 -1.46 -3.26 119.26 116.61 1crp h ALA 134 Ca -0.31 -0.61 -0.02 0.00 0.00 0.00 0.00 54.91 53.97 1crp h ALA 134 Cb 2.03 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 19.78 1crp h ALA 134 CO 0.13 0.80 0.04 0.00 0.00 0.00 0.00 179.25 180.23 1crp h ARG 135 N 0.00 0.27 -0.48 0.00 2.47 -1.37 -0.84 114.38 114.43 1crp h ARG 135 Ca -0.03 -0.03 -0.05 0.00 -1.26 0.00 0.00 59.98 58.61 1crp h ARG 135 Cb 1.50 -0.05 -0.02 0.00 -1.65 0.00 0.00 29.97 29.74 1crp h ARG 135 CO 0.07 0.26 0.11 1.03 0.56 0.00 0.00 179.97 182.00 1crp h SER 136 N 0.27 0.67 1.42 7.04 0.87 -1.68 -2.00 113.55 120.14 1crp h SER 136 Ca 0.07 -0.11 0.00 0.00 -1.23 0.00 0.00 61.79 60.51 1crp h SER 136 Cb 0.12 -0.17 0.00 0.00 -0.44 0.00 0.00 62.40 61.90 1crp h SER 136 CO -0.00 0.67 -0.39 1.88 -0.53 0.00 0.00 176.83 178.46 1crp h TYR 137 N 0.70 0.00 -1.24 2.24 0.05 -1.41 -3.48 116.97 113.84 1crp h TYR 137 Ca 0.16 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.94 1crp h TYR 137 Cb 0.27 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.01 1crp h TYR 137 CO 0.01 0.00 0.00 0.41 -1.05 0.00 0.00 178.16 177.53 1crp n GLY 138 N 1.20 0.81 3.25 3.88 0.00 -0.43 -5.07 105.19 108.83 1crp n GLY 138 Ca 0.03 -0.59 -0.24 0.00 0.00 0.00 0.00 46.02 45.22 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 -2.94 1.60 0.43 -0.61 -4.36 -1.03 -5.01 121.20 109.29 1crp s ILE 139 Ca 0.00 -1.38 -0.24 0.00 -0.26 0.00 0.00 60.65 58.77 1crp s ILE 139 Cb 0.00 -1.44 -0.08 0.00 1.25 0.00 0.00 42.46 42.19 1crp s ILE 139 CO 0.00 0.01 1.24 -2.16 0.24 0.00 0.00 174.94 174.27 1crp s PRO 140 N -1.62 3.84 -0.31 0.37 0.04 -1.26 -4.42 135.00 131.64 1crp s PRO 140 Ca 0.06 1.98 -0.03 0.00 0.04 0.00 0.00 61.00 63.05 1crp s PRO 140 Cb -0.09 -2.59 0.05 0.00 0.04 0.00 0.00 34.50 31.90 1crp s PRO 140 CO 0.03 -0.54 0.03 -0.47 0.04 0.00 0.00 177.00 176.09 1crp s TYR 141 N -1.38 3.26 0.50 0.56 5.04 -1.26 -2.35 117.35 121.73 1crp s TYR 141 Ca 0.60 -1.76 0.04 0.00 -2.44 0.00 0.00 57.07 53.51 1crp s TYR 141 Cb -0.34 -2.16 -0.01 0.00 0.35 0.00 0.00 41.96 39.80 1crp s TYR 141 CO 0.42 -0.79 0.14 0.42 -1.34 0.00 0.00 175.55 174.41 1crp s ILE 142 N 1.29 1.54 0.16 3.14 1.01 -0.90 -4.99 121.20 122.45 1crp s ILE 142 Ca -0.04 -1.81 0.08 0.00 0.00 0.00 0.00 60.65 58.88 1crp s ILE 142 Cb -0.20 -2.35 -0.04 0.00 0.01 0.00 0.00 42.46 39.88 1crp s ILE 142 CO -0.00 0.00 -0.17 -1.61 0.00 0.00 0.00 174.94 173.16 1crp s GLU 143 N -3.98 1.24 0.10 2.79 2.02 -1.26 -1.20 118.70 118.40 1crp s GLU 143 Ca 0.21 -1.39 -0.13 0.00 0.02 0.00 0.00 54.97 53.68 1crp s GLU 143 Cb 0.02 -1.25 0.02 0.00 0.10 0.00 0.00 34.13 33.02 1crp s GLU 143 CO 0.12 0.25 0.31 0.95 0.02 0.00 0.00 175.26 176.91 1crp s THR 144 N -2.11 0.10 -0.29 3.63 -4.23 -0.71 -4.25 115.64 107.77 1crp s THR 144 Ca 0.15 -0.81 0.03 0.00 -1.18 0.00 0.00 61.69 59.88 1crp s THR 144 Cb -0.05 -1.20 0.20 0.00 1.34 0.00 0.00 72.50 72.78 1crp s THR 144 CO 0.06 -0.45 0.60 -0.55 -0.54 0.00 0.00 174.62 173.74 1crp s SER 145 N -2.72 -1.51 0.44 3.99 0.15 -0.19 -1.25 113.70 112.61 1crp s SER 145 Ca 0.02 0.53 0.20 0.00 0.70 0.00 0.00 55.95 57.40 1crp s SER 145 Cb 0.03 2.10 1.02 0.00 -1.71 0.00 0.00 66.02 67.46 1crp s SER 145 CO -0.10 -0.28 1.92 0.00 1.20 0.00 0.00 173.24 175.98 1crp h ALA 146 N 8.00 1.30 0.00 5.45 0.00 -1.91 0.28 119.26 132.38 1crp h ALA 146 Ca -0.12 -0.23 0.00 0.00 0.00 0.00 0.00 54.91 54.56 1crp h ALA 146 Cb 1.18 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.93 1crp h ALA 146 CO 0.20 0.31 0.00 -0.22 0.00 0.00 0.00 179.25 179.55 1crp h LYS 147 N 0.00 0.00 0.00 0.00 3.64 -1.95 -3.13 116.57 115.13 1crp h LYS 147 Ca -0.00 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.38 1crp h LYS 147 Cb 0.54 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.36 1crp h LYS 147 CO 0.03 0.00 -0.01 -2.37 -2.27 0.00 0.00 179.45 174.83 1crp n THR 148 N -2.69 0.00 -3.11 1.00 5.66 -0.91 -5.01 114.28 109.22 1crp n THR 148 Ca -0.02 0.00 -0.22 0.00 -3.05 0.00 0.00 64.05 60.77 1crp n THR 148 Cb 0.09 0.83 0.01 0.00 -1.55 0.00 0.00 70.33 69.72 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 -3.89 -3.59 1.09 1.74 0.93 -4.93 116.66 108.02 1crp n ARG 149 Ca 0.00 0.68 -0.38 0.00 -0.77 0.00 0.00 57.85 57.38 1crp n ARG 149 Cb 0.50 -5.45 -0.11 0.00 -1.02 0.00 0.00 32.46 26.39 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 -5.77 3.94 0.00 5.56 -0.44 -0.93 -4.24 119.66 117.78 1crp s GLN 150 Ca 0.31 -0.33 0.00 0.00 -2.50 0.00 0.00 55.36 52.85 1crp s GLN 150 Cb -0.15 -3.66 0.00 0.00 -1.64 0.00 0.00 33.01 27.55 1crp s GLN 150 CO 0.39 -0.19 0.00 0.41 0.50 0.00 0.00 175.29 176.40 1crp n GLY 151 N 5.06 3.13 0.40 2.59 0.00 -1.26 -1.02 105.19 114.09 1crp n GLY 151 Ca -0.14 0.00 0.20 0.00 0.00 0.00 0.00 46.02 46.08 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 0.68 0.01 1.61 2.07 -1.77 0.90 116.25 119.74 1crp h VAL 152 Ca 0.00 -0.12 -0.22 0.00 0.82 0.00 0.00 66.70 67.19 1crp h VAL 152 Cb 0.00 0.31 -0.00 0.00 -1.52 0.00 0.00 31.29 30.07 1crp h VAL 152 CO 0.00 0.06 -0.92 -0.33 0.02 0.00 0.00 177.57 176.40 1crp h GLU 153 N 0.34 0.32 0.00 1.57 5.08 -1.90 -2.91 114.58 117.08 1crp h GLU 153 Ca 0.44 -0.35 -0.05 0.00 -1.00 0.00 0.00 59.36 58.40 1crp h GLU 153 Cb 1.19 0.10 -0.01 0.00 0.50 0.00 0.00 28.75 30.53 1crp h GLU 153 CO -0.14 1.04 -0.26 -0.44 -1.00 0.00 0.00 179.01 178.21 1crp h ASP 154 N 0.17 0.00 0.00 1.42 3.32 -1.21 -2.15 116.42 117.98 1crp h ASP 154 Ca -0.07 0.00 -0.02 0.00 0.02 0.00 0.00 57.03 56.96 1crp h ASP 154 Cb 1.56 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 41.11 1crp h ASP 154 CO 0.15 0.26 -0.18 0.00 -1.72 0.00 0.00 179.24 177.75 1crp h ALA 155 N 1.74 0.02 -0.57 3.45 0.00 -1.32 -2.90 119.26 119.68 1crp h ALA 155 Ca -0.00 -0.31 0.01 0.00 0.00 0.00 0.00 54.91 54.61 1crp h ALA 155 Cb 0.67 0.14 -0.03 0.00 0.00 0.00 0.00 17.79 18.58 1crp h ALA 155 CO 0.03 0.14 0.38 0.74 0.00 0.00 0.00 179.25 180.54 1crp h PHE 156 N -1.00 0.71 0.22 0.00 -1.00 -1.59 -1.53 116.94 112.76 1crp h PHE 156 Ca -0.03 0.02 -0.01 0.00 2.81 0.00 0.00 57.97 60.76 1crp h PHE 156 Cb 0.44 -0.24 0.00 0.00 3.61 0.00 0.00 35.95 39.76 1crp h PHE 156 CO 0.05 0.45 -0.11 1.88 -1.61 0.00 0.00 178.31 178.97 1crp h TYR 157 N 0.77 -0.27 -0.03 -0.55 -1.99 -1.53 -2.77 116.97 110.60 1crp h TYR 157 Ca 0.21 -0.01 0.01 0.00 2.00 0.00 0.00 58.73 60.94 1crp h TYR 157 Cb -0.09 0.09 -0.00 0.00 2.00 0.00 0.00 36.73 38.73 1crp h TYR 157 CO 0.00 0.11 0.05 1.15 -0.00 0.00 0.00 178.16 179.47 1crp h THR 158 N -0.76 0.33 -0.10 -2.88 2.02 -1.34 -1.66 112.91 108.53 1crp h THR 158 Ca -0.03 0.00 -0.13 0.00 0.77 0.00 0.00 66.41 67.02 1crp h THR 158 Cb 0.50 0.96 0.01 0.00 -1.74 0.00 0.00 68.15 67.88 1crp h THR 158 CO 0.05 0.00 -0.44 -0.07 0.37 0.00 0.00 175.52 175.43 1crp h LEU 159 N 0.00 0.56 -0.90 2.58 4.07 -1.14 -2.74 115.31 117.74 1crp h LEU 159 Ca 0.01 -0.63 -0.00 0.00 0.08 0.00 0.00 57.88 57.34 1crp h LEU 159 Cb 0.11 -0.16 -0.00 0.00 1.08 0.00 0.00 40.66 41.69 1crp h LEU 159 CO -0.00 1.10 -0.02 0.58 -1.08 0.00 0.00 178.44 179.02 1crp h VAL 160 N 0.05 0.04 -0.00 1.22 2.07 -1.06 -2.54 116.25 116.02 1crp h VAL 160 Ca -0.03 -0.74 -0.04 0.00 0.82 0.00 0.00 66.70 66.72 1crp h VAL 160 Cb 1.08 1.71 0.00 0.00 -1.52 0.00 0.00 31.29 32.56 1crp h VAL 160 CO 0.09 0.02 -0.13 0.03 0.02 0.00 0.00 177.57 177.59 1crp h ARG 161 N 0.00 0.10 -0.33 1.57 3.08 -1.27 -2.00 114.38 115.53 1crp h ARG 161 Ca -0.00 -0.10 -0.10 0.00 0.07 0.00 0.00 59.98 59.85 1crp h ARG 161 Cb 0.71 0.03 -0.01 0.00 0.08 0.00 0.00 29.97 30.78 1crp h ARG 161 CO 0.00 0.84 -0.17 1.05 -1.07 0.00 0.00 179.97 180.63 1crp h GLU 162 N -0.60 0.70 -0.54 0.04 4.11 -1.51 -2.56 114.58 114.22 1crp h GLU 162 Ca -0.02 -0.31 -0.06 0.00 0.07 0.00 0.00 59.36 59.05 1crp h GLU 162 Cb 0.89 -0.02 -0.02 0.00 0.50 0.00 0.00 28.75 30.09 1crp h GLU 162 CO 0.03 0.91 0.10 0.82 0.07 0.00 0.00 179.01 180.93 1crp h ILE 163 N 0.47 1.23 0.70 -1.06 2.04 -1.56 -2.49 117.51 116.84 1crp h ILE 163 Ca 0.07 -0.89 -0.03 0.00 1.00 0.00 0.00 64.86 65.01 1crp h ILE 163 Cb 0.70 0.72 0.01 0.00 -0.74 0.00 0.00 36.82 37.51 1crp h ILE 163 CO 0.05 0.33 -0.33 -0.09 0.00 0.00 0.00 178.15 178.10 1crp h ARG 164 N 0.81 -0.90 -0.02 2.37 2.43 -1.24 -3.25 114.38 114.58 1crp h ARG 164 Ca 0.17 0.06 0.02 0.00 -0.81 0.00 0.00 59.98 59.42 1crp h ARG 164 Cb 0.35 0.20 -0.06 0.00 -0.42 0.00 0.00 29.97 30.05 1crp h ARG 164 CO 0.01 -0.57 -0.52 0.37 -1.51 0.00 0.00 179.97 177.74 1crp h GLN 165 N -1.06 -0.62 0.00 0.20 -0.00 -1.40 -3.51 115.11 108.72 1crp h GLN 165 Ca -0.10 0.04 0.00 0.00 -0.00 0.00 0.00 58.65 58.60 1crp h GLN 165 Cb 0.74 0.14 0.00 0.00 0.00 0.00 0.00 27.48 28.37 1crp h GLN 165 CO 0.16 -0.41 0.00 0.72 0.00 0.00 0.00 178.83 179.29