#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1j14 s VAL 17 N 0.00 5.32 -1.48 1.39 1.01 0.75 -4.15 120.40 123.24 1j14 s VAL 17 Ca 0.00 0.47 0.00 0.00 0.00 0.00 0.00 61.98 62.45 1j14 s VAL 17 Cb 0.00 -3.57 0.00 0.00 0.00 0.00 0.00 36.38 32.81 1j14 s VAL 17 CO 0.00 0.47 0.00 0.61 0.00 0.00 0.00 175.10 176.18 1j14 n GLY 18 N 2.91 1.33 0.00 4.51 0.00 -1.24 -1.69 105.19 111.01 1j14 n GLY 18 Ca -0.14 -0.35 0.00 0.00 0.00 0.00 0.00 46.02 45.53 1j14 n GLY 18 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1j14 n GLY 19 N -1.21 1.33 3.18 -0.02 0.00 -1.26 -4.82 105.19 102.39 1j14 n GLY 19 Ca -0.14 -1.96 -0.12 0.00 0.00 0.00 0.00 46.02 43.80 1j14 n GLY 19 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1j14 s TYR 20 N 1.51 0.99 -0.06 1.61 1.13 0.47 -4.91 117.35 118.10 1j14 s TYR 20 Ca 0.00 -0.79 -0.30 0.00 -1.41 0.00 0.00 57.07 54.57 1j14 s TYR 20 Cb 0.00 -0.55 -0.04 0.00 -1.10 0.00 0.00 41.96 40.27 1j14 s TYR 20 CO 0.00 -0.06 1.34 0.99 -2.51 0.00 0.00 175.55 175.31 1j14 s THR 21 N -3.11 3.98 0.49 -3.49 2.01 -1.26 0.63 115.64 114.89 1j14 s THR 21 Ca 0.10 1.29 -0.22 0.00 0.31 0.00 0.00 61.69 63.17 1j14 s THR 21 Cb 0.02 -3.83 -0.07 0.00 0.01 0.00 0.00 72.50 68.63 1j14 s THR 21 CO -0.02 -0.04 1.16 0.00 -0.69 0.00 0.00 174.62 175.03 1j14 s GLN 23 N -2.90 3.85 -0.17 0.00 -1.52 -1.26 -4.81 119.66 112.86 1j14 s GLN 23 Ca 0.67 2.36 -0.39 0.00 -1.95 0.00 0.00 55.36 56.05 1j14 s GLN 23 Cb -0.27 -2.75 -0.16 0.00 -0.22 0.00 0.00 33.01 29.61 1j14 s GLN 23 CO 0.32 -0.66 1.63 -1.91 -0.25 0.00 0.00 175.29 174.43 1j14 n GLU 24 N 0.03 1.17 -2.10 2.91 2.13 -1.26 -1.13 120.64 122.39 1j14 n GLU 24 Ca 0.04 0.43 -0.20 0.00 0.66 0.00 0.00 57.16 58.09 1j14 n GLU 24 Cb 0.42 -2.10 -0.04 0.00 0.27 0.00 0.00 31.44 29.99 1j14 n GLU 24 CO 0.00 0.00 0.00 0.09 -0.41 0.00 0.00 177.13 176.81 1j14 n ASN 25 N 4.58 -5.47 -0.00 4.31 3.02 -1.26 -4.88 115.26 115.55 1j14 n ASN 25 Ca 0.24 0.19 0.14 0.00 -0.03 0.00 0.00 54.58 55.12 1j14 n ASN 25 Cb 0.15 -4.67 0.61 0.00 -0.61 0.00 0.00 39.78 35.26 1j14 n ASN 25 CO 0.00 0.00 0.00 -1.54 -2.62 0.00 0.00 177.26 173.10 1j14 n SER 26 N -1.71 0.06 -3.35 6.41 3.41 -0.28 -3.89 113.62 114.26 1j14 n SER 26 Ca -0.22 0.30 -0.26 0.00 -0.26 0.00 0.00 58.87 58.43 1j14 n SER 26 Cb 0.67 -0.38 -0.08 0.00 -0.26 0.00 0.00 64.21 64.15 1j14 n SER 26 CO 0.00 0.00 0.00 0.52 -0.16 0.00 0.00 175.04 175.40 1j14 n VAL 27 N -1.45 0.98 0.30 -3.33 0.31 -1.26 -4.97 118.33 108.90 1j14 n VAL 27 Ca 0.08 -4.66 0.04 0.00 -0.01 0.00 0.00 64.34 59.79 1j14 n VAL 27 Cb 0.32 -2.03 0.17 0.00 -0.91 0.00 0.00 33.84 31.39 1j14 n VAL 27 CO 0.00 0.00 0.00 -0.81 -1.32 0.00 0.00 176.83 174.70 1j14 n PRO 28 N 1.21 0.05 0.00 5.55 -0.04 -1.25 -2.22 135.00 138.30 1j14 n PRO 28 Ca 0.26 0.30 0.11 0.00 -0.04 0.00 0.00 63.50 64.13 1j14 n PRO 28 Cb 0.46 -1.50 0.06 0.00 -0.04 0.00 0.00 33.50 32.48 1j14 n PRO 28 CO 0.00 0.00 0.00 2.48 -0.04 0.00 0.00 175.50 177.94 1j14 n TYR 29 N -1.39 0.00 -2.60 0.54 0.18 -1.17 -1.60 117.16 111.12 1j14 n TYR 29 Ca 0.03 0.00 -0.42 0.00 1.88 0.00 0.00 57.90 59.39 1j14 n TYR 29 Cb 0.07 -0.02 -0.03 0.00 -0.38 0.00 0.00 39.34 38.99 1j14 n TYR 29 CO 0.00 0.00 0.00 -1.14 -2.08 0.00 0.00 176.86 173.64 1j14 s GLN 30 N -2.43 4.50 0.24 -3.48 2.00 -0.94 -0.81 119.66 118.73 1j14 s GLN 30 Ca 0.20 1.54 0.10 0.00 -2.00 0.00 0.00 55.36 55.21 1j14 s GLN 30 Cb 0.18 -3.43 -0.05 0.00 0.80 0.00 0.00 33.01 30.52 1j14 s GLN 30 CO 0.54 -0.15 -0.18 0.14 -0.50 0.00 0.00 175.29 175.14 1j14 s VAL 31 N 1.13 2.14 -0.15 1.34 -7.23 -0.15 -4.52 120.40 112.96 1j14 s VAL 31 Ca 0.54 -2.28 0.00 0.00 -1.81 0.00 0.00 61.98 58.44 1j14 s VAL 31 Cb -0.24 -2.16 -0.00 0.00 0.56 0.00 0.00 36.38 34.54 1j14 s VAL 31 CO 0.28 -0.45 -0.15 -0.55 -0.31 0.00 0.00 175.10 173.92 1j14 s SER 32 N -3.33 3.75 -0.27 4.85 0.15 -0.60 -2.06 113.70 116.19 1j14 s SER 32 Ca 0.26 -0.44 -0.20 0.00 0.70 0.00 0.00 55.95 56.27 1j14 s SER 32 Cb -0.04 -1.58 -0.02 0.00 -1.71 0.00 0.00 66.02 62.68 1j14 s SER 32 CO 0.11 0.10 0.60 -0.76 1.20 0.00 0.00 173.24 174.49 1j14 s LEU 33 N 0.74 4.08 -0.12 3.45 1.43 0.07 -0.84 118.68 127.49 1j14 s LEU 33 Ca -0.06 0.60 0.00 0.00 -1.03 0.00 0.00 54.13 53.64 1j14 s LEU 33 Cb -0.15 -2.80 -0.02 0.00 0.03 0.00 0.00 46.19 43.25 1j14 s LEU 33 CO 0.01 -0.37 -0.12 0.21 0.23 0.00 0.00 176.35 176.31 1j14 s ASN 34 N 1.53 4.14 -0.33 2.29 2.47 0.19 -1.68 114.94 123.54 1j14 s ASN 34 Ca 0.25 -0.27 0.13 0.00 0.42 0.00 0.00 52.86 53.39 1j14 s ASN 34 Cb -0.15 -1.48 0.46 0.00 -1.45 0.00 0.00 41.25 38.63 1j14 s ASN 34 CO 0.09 0.21 1.09 -0.24 -3.72 0.00 0.00 177.10 174.53 1j14 n SER 37 N 3.25 3.22 0.00 -4.21 2.88 -1.26 -1.18 113.62 116.32 1j14 n SER 37 Ca -0.18 -3.10 0.00 0.00 -1.33 0.00 0.00 58.87 54.27 1j14 n SER 37 Cb 0.53 -0.45 0.00 0.00 -0.75 0.00 0.00 64.21 63.53 1j14 n SER 37 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1j14 n GLY 38 N -0.45 3.45 3.34 0.46 0.00 -1.26 -4.98 105.19 105.75 1j14 n GLY 38 Ca 0.25 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 46.16 1j14 n GLY 38 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1j14 s TYR 39 N -2.96 -0.29 0.03 1.61 1.13 -1.26 -5.13 117.35 110.46 1j14 s TYR 39 Ca 0.00 0.05 -0.30 0.00 -1.41 0.00 0.00 57.07 55.41 1j14 s TYR 39 Cb 0.00 0.32 -0.06 0.00 -1.10 0.00 0.00 41.96 41.12 1j14 s TYR 39 CO 0.00 -0.72 1.36 -1.58 -2.51 0.00 0.00 175.55 172.11 1j14 s HIS 40 N -3.57 3.01 0.00 -3.49 5.65 -1.26 -4.28 115.29 111.35 1j14 s HIS 40 Ca 0.01 0.92 0.00 0.00 0.25 0.00 0.00 55.06 56.25 1j14 s HIS 40 Cb 0.01 -3.62 0.00 0.00 -1.18 0.00 0.00 32.58 27.79 1j14 s HIS 40 CO -0.11 -2.23 0.00 1.97 -0.65 0.00 0.00 174.74 173.72 1j14 n PHE 41 N 4.93 0.00 -3.88 3.88 -1.74 -0.68 -4.97 117.46 114.99 1j14 n PHE 41 Ca 0.12 0.00 -0.07 0.00 -0.56 0.00 0.00 57.45 56.94 1j14 n PHE 41 Cb 0.44 0.00 -0.02 0.00 1.52 0.00 0.00 39.48 41.41 1j14 n PHE 41 CO 0.00 0.00 0.00 0.00 -0.56 0.00 0.00 176.76 176.20 1j14 n GLY 43 N -0.45 3.56 3.79 0.00 0.00 0.46 -0.75 105.19 111.79 1j14 n GLY 43 Ca -0.04 -2.34 0.00 0.00 0.00 0.00 0.00 46.02 43.64 1j14 n GLY 43 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1j14 s GLY 44 N -3.48 -0.22 -0.06 -0.02 0.00 -0.88 -3.57 107.32 99.09 1j14 s GLY 44 Ca 0.03 0.25 0.04 0.00 0.00 0.00 0.00 44.72 45.04 1j14 s GLY 44 CO 0.02 2.08 -0.19 -0.56 0.00 0.00 0.00 173.10 174.44 1j14 s SER 45 N -3.29 2.45 -0.22 1.64 0.01 -0.59 -0.97 113.70 112.73 1j14 s SER 45 Ca 0.20 -0.42 -0.28 0.00 1.31 0.00 0.00 55.95 56.76 1j14 s SER 45 Cb 0.01 -0.87 0.00 0.00 0.21 0.00 0.00 66.02 65.37 1j14 s SER 45 CO -0.01 0.15 0.97 -0.22 0.41 0.00 0.00 173.24 174.54 1j14 s LEU 46 N 0.20 4.11 0.00 2.44 2.96 0.01 -0.87 118.68 127.52 1j14 s LEU 46 Ca -0.09 1.28 0.15 0.00 -0.22 0.00 0.00 54.13 55.25 1j14 s LEU 46 Cb -0.14 -3.43 0.01 0.00 0.50 0.00 0.00 46.19 43.14 1j14 s LEU 46 CO 0.04 -0.60 0.85 2.30 -1.32 0.00 0.00 176.35 177.63 1j14 n ILE 47 N 5.22 0.00 -3.61 6.68 -5.35 -0.27 -1.32 119.36 120.71 1j14 n ILE 47 Ca 0.10 -0.36 -0.02 0.00 -0.27 0.00 0.00 62.75 62.19 1j14 n ILE 47 Cb 0.47 1.20 -0.02 0.00 -1.74 0.00 0.00 39.64 39.55 1j14 n ILE 47 CO 0.00 0.00 0.00 0.54 -1.76 0.00 0.00 176.55 175.33 1j14 s ASN 48 N -1.75 -0.08 0.04 7.28 2.20 -1.17 -4.69 114.94 116.77 1j14 s ASN 48 Ca 0.14 -0.02 0.01 0.00 -0.94 0.00 0.00 52.86 52.05 1j14 s ASN 48 Cb 0.12 0.10 0.07 0.00 -2.00 0.00 0.00 41.25 39.54 1j14 s ASN 48 CO 0.36 -0.16 0.80 -0.90 -2.94 0.00 0.00 177.10 174.25 1j14 n ASP 49 N -0.16 0.03 0.00 3.54 5.75 -1.26 -2.02 116.55 122.44 1j14 n ASP 49 Ca -0.00 0.28 0.00 0.00 -0.01 0.00 0.00 54.79 55.05 1j14 n ASP 49 Cb 0.59 -0.26 0.00 0.00 -1.03 0.00 0.00 41.12 40.41 1j14 n ASP 49 CO 0.00 0.00 0.00 1.67 -0.11 0.00 0.00 177.20 178.76 1j14 n GLN 50 N -1.34 0.11 -4.41 0.11 7.27 -1.26 -1.18 117.38 116.69 1j14 n GLN 50 Ca -0.00 -0.34 -0.20 0.00 0.07 0.00 0.00 57.00 56.53 1j14 n GLN 50 Cb 0.27 -0.55 -0.15 0.00 2.41 0.00 0.00 30.24 32.23 1j14 n GLN 50 CO 0.00 0.00 0.00 -1.58 0.07 0.00 0.00 177.06 175.55 1j14 s TRP 51 N -0.05 0.91 -0.01 3.69 0.52 -0.85 -0.45 118.94 122.70 1j14 s TRP 51 Ca 0.00 -0.19 0.06 0.00 0.02 0.00 0.00 56.10 55.98 1j14 s TRP 51 Cb 0.00 -0.61 -0.01 0.00 -1.15 0.00 0.00 33.47 31.69 1j14 s TRP 51 CO 0.00 -0.05 -0.18 0.08 0.02 0.00 0.00 176.95 176.83 1j14 s VAL 52 N -0.07 1.40 -0.10 4.03 1.01 -0.24 -1.12 120.40 125.32 1j14 s VAL 52 Ca 0.01 -0.78 -0.01 0.00 0.00 0.00 0.00 61.98 61.20 1j14 s VAL 52 Cb -0.06 -1.17 -0.03 0.00 0.00 0.00 0.00 36.38 35.13 1j14 s VAL 52 CO -0.00 0.38 -0.05 0.54 0.00 0.00 0.00 175.10 175.96 1j14 s VAL 53 N -0.44 3.81 0.00 2.92 0.11 -0.05 -0.25 120.40 126.50 1j14 s VAL 53 Ca 0.07 -0.42 0.00 0.00 -2.93 0.00 0.00 61.98 58.69 1j14 s VAL 53 Cb -0.07 -2.59 0.00 0.00 -1.53 0.00 0.00 36.38 32.19 1j14 s VAL 53 CO -0.01 0.57 0.00 -0.24 -3.33 0.00 0.00 175.10 172.09 1j14 n SER 54 N 2.62 0.00 -4.86 3.54 2.88 0.08 -1.54 113.62 116.34 1j14 n SER 54 Ca -0.18 -0.23 -0.37 0.00 -1.33 0.00 0.00 58.87 56.76 1j14 n SER 54 Cb 0.53 0.00 -0.06 0.00 -0.75 0.00 0.00 64.21 63.93 1j14 n SER 54 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1j14 s ALA 55 N -1.77 3.85 0.45 -1.46 0.00 -1.26 -0.67 121.76 120.90 1j14 s ALA 55 Ca 0.00 -0.61 0.13 0.00 0.00 0.00 0.00 51.96 51.48 1j14 s ALA 55 Cb 0.00 -2.02 1.05 0.00 0.00 0.00 0.00 23.12 22.15 1j14 s ALA 55 CO 0.00 0.57 2.03 0.00 0.00 0.00 0.00 175.76 178.36 1j14 h ALA 56 N 5.11 1.96 0.00 0.00 0.00 -1.70 -0.05 119.26 124.59 1j14 h ALA 56 Ca -0.54 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.36 1j14 h ALA 56 Cb 1.22 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.93 1j14 h ALA 56 CO 0.60 -0.04 0.00 -2.39 0.00 0.00 0.00 179.25 177.42 1j14 n HIS 57 N -4.48 0.00 -0.29 0.00 1.44 -1.26 -1.67 115.22 108.97 1j14 n HIS 57 Ca 0.06 0.00 0.11 0.00 -2.01 0.00 0.00 57.72 55.87 1j14 n HIS 57 Cb 0.25 0.00 0.29 0.00 0.12 0.00 0.00 29.99 30.65 1j14 n HIS 57 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 1j14 s TYR 59 N -1.04 2.83 -0.13 0.00 5.04 -0.67 -5.01 117.35 118.37 1j14 s TYR 59 Ca 0.44 0.90 -0.15 0.00 -2.44 0.00 0.00 57.07 55.82 1j14 s TYR 59 Cb 0.23 -3.98 0.04 0.00 0.35 0.00 0.00 41.96 38.60 1j14 s TYR 59 CO 0.30 -3.23 0.42 0.15 -1.34 0.00 0.00 175.55 171.85 1j14 s LYS 60 N -0.61 0.55 0.55 4.97 1.02 -1.26 -5.06 119.74 119.90 1j14 s LYS 60 Ca 0.61 0.45 0.23 0.00 0.02 0.00 0.00 55.97 57.28 1j14 s LYS 60 Cb -0.46 0.26 1.48 0.00 -0.52 0.00 0.00 37.83 38.59 1j14 s LYS 60 CO 0.48 -0.09 2.12 0.66 -0.92 0.00 0.00 175.35 177.59 1j14 h SER 61 N 5.10 0.00 -3.26 2.83 4.64 -2.01 -3.40 113.55 117.46 1j14 h SER 61 Ca -0.27 0.00 -0.43 0.00 -0.47 0.00 0.00 61.79 60.62 1j14 h SER 61 Cb 1.18 0.00 -0.38 0.00 -0.31 0.00 0.00 62.40 62.89 1j14 h SER 61 CO 0.27 0.00 -0.76 -0.13 -0.87 0.00 0.00 176.83 175.34 1j14 s ARG 62 N -4.88 0.52 -0.00 4.77 0.52 -1.26 -5.01 118.95 113.61 1j14 s ARG 62 Ca -0.05 0.14 0.03 0.00 -0.52 0.00 0.00 55.73 55.33 1j14 s ARG 62 Cb 0.17 -0.92 -0.01 0.00 0.52 0.00 0.00 34.95 34.71 1j14 s ARG 62 CO 0.63 -0.31 -0.10 0.42 0.02 0.00 0.00 175.30 175.96 1j14 s ILE 63 N 2.00 0.80 -0.22 1.52 1.01 -1.26 -4.80 121.20 120.25 1j14 s ILE 63 Ca 0.05 -0.50 -0.03 0.00 0.00 0.00 0.00 60.65 60.16 1j14 s ILE 63 Cb -0.12 -0.69 -0.00 0.00 0.01 0.00 0.00 42.46 41.66 1j14 s ILE 63 CO -0.05 0.18 -0.05 -1.58 0.00 0.00 0.00 174.94 173.44 1j14 s GLN 64 N -0.37 3.30 -0.12 2.79 0.74 -0.33 -1.07 119.66 124.61 1j14 s GLN 64 Ca 0.03 -0.67 -0.20 0.00 0.05 0.00 0.00 55.36 54.56 1j14 s GLN 64 Cb -0.04 -2.99 -0.04 0.00 1.10 0.00 0.00 33.01 31.04 1j14 s GLN 64 CO -0.00 -0.22 0.58 0.08 -0.55 0.00 0.00 175.29 175.18 1j14 s VAL 66 N 1.45 5.11 -0.23 1.34 1.01 0.20 -0.64 120.40 128.65 1j14 s VAL 66 Ca 0.05 1.17 -0.03 0.00 0.00 0.00 0.00 61.98 63.17 1j14 s VAL 66 Cb -0.14 -3.92 0.00 0.00 0.00 0.00 0.00 36.38 32.32 1j14 s VAL 66 CO -0.04 0.26 -0.06 -0.13 0.00 0.00 0.00 175.10 175.13 1j14 s ARG 67 N 0.93 3.18 0.28 2.72 0.52 -0.02 -0.55 118.95 126.00 1j14 s ARG 67 Ca 0.30 -0.75 0.08 0.00 -0.52 0.00 0.00 55.73 54.84 1j14 s ARG 67 Cb -0.16 -2.96 -0.04 0.00 0.52 0.00 0.00 34.95 32.31 1j14 s ARG 67 CO 0.13 -0.26 0.15 -0.51 0.02 0.00 0.00 175.30 174.83 1j14 s LEU 68 N 1.42 3.57 -1.13 2.53 1.02 -0.18 -1.56 118.68 124.34 1j14 s LEU 68 Ca 0.04 -0.44 0.00 0.00 0.02 0.00 0.00 54.13 53.75 1j14 s LEU 68 Cb -0.15 -2.10 0.00 0.00 0.02 0.00 0.00 46.19 43.96 1j14 s LEU 68 CO -0.05 -0.10 0.00 0.61 0.02 0.00 0.00 176.35 176.83 1j14 n GLY 69 N -1.13 0.61 3.86 -3.19 0.00 -1.25 -1.66 105.19 102.42 1j14 n GLY 69 Ca -0.06 -0.44 -0.32 0.00 0.00 0.00 0.00 46.02 45.20 1j14 n GLY 69 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1j14 s GLU 70 N -3.77 3.93 0.00 1.61 0.41 -1.26 -4.01 118.70 115.61 1j14 s GLU 70 Ca 0.00 0.51 0.00 0.00 -0.41 0.00 0.00 54.97 55.07 1j14 s GLU 70 Cb 0.00 -2.54 0.00 0.00 -1.78 0.00 0.00 34.13 29.81 1j14 s GLU 70 CO 0.00 0.23 0.00 1.58 -0.49 0.00 0.00 175.26 176.58 1j14 n HIS 71 N -0.22 0.00 -2.96 1.61 -0.00 -1.26 -4.68 115.22 107.71 1j14 n HIS 71 Ca 0.02 0.00 -0.43 0.00 -0.00 0.00 0.00 57.72 57.31 1j14 n HIS 71 Cb 0.53 0.38 -0.05 0.00 -0.00 0.00 0.00 29.99 30.85 1j14 n HIS 71 CO 0.00 0.00 0.00 1.21 -0.00 0.00 0.00 176.34 177.55 1j14 s ASN 72 N -3.59 6.46 0.55 0.26 3.04 -1.26 -1.94 114.94 118.45 1j14 s ASN 72 Ca 0.00 0.07 0.32 0.00 0.04 0.00 0.00 52.86 53.29 1j14 s ASN 72 Cb 0.00 -2.39 1.54 0.00 -1.54 0.00 0.00 41.25 38.86 1j14 s ASN 72 CO 0.00 -0.84 2.07 -0.29 -3.04 0.00 0.00 177.10 175.00 1j14 h ILE 73 N 5.89 0.31 -0.35 -5.21 6.09 -1.00 -3.14 117.51 120.11 1j14 h ILE 73 Ca -0.25 -0.51 0.00 0.00 -1.37 0.00 0.00 64.86 62.73 1j14 h ILE 73 Cb 1.09 1.38 0.00 0.00 0.47 0.00 0.00 36.82 39.76 1j14 h ILE 73 CO 0.94 0.08 0.00 0.59 -3.07 0.00 0.00 178.15 176.69 1j14 n ASN 74 N -3.36 3.05 -3.97 2.19 3.02 -1.26 -4.97 115.26 109.96 1j14 n ASN 74 Ca -0.01 -1.89 -0.19 0.00 -0.03 0.00 0.00 54.58 52.46 1j14 n ASN 74 Cb 0.25 -0.23 -0.15 0.00 -0.61 0.00 0.00 39.78 39.04 1j14 n ASN 74 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 1j14 s VAL 75 N -1.14 0.63 -0.13 2.41 1.01 -1.19 -5.11 120.40 116.88 1j14 s VAL 75 Ca 0.30 -0.27 -0.29 0.00 0.00 0.00 0.00 61.98 61.71 1j14 s VAL 75 Cb 0.17 -0.57 -0.01 0.00 0.00 0.00 0.00 36.38 35.96 1j14 s VAL 75 CO 0.23 0.21 1.07 -0.76 0.00 0.00 0.00 175.10 175.85 1j14 s LEU 76 N 0.25 4.22 -0.00 3.92 1.43 -1.26 -4.71 118.68 122.53 1j14 s LEU 76 Ca -0.03 1.57 0.06 0.00 -1.03 0.00 0.00 54.13 54.70 1j14 s LEU 76 Cb -0.08 -3.55 -0.08 0.00 0.03 0.00 0.00 46.19 42.50 1j14 s LEU 76 CO 0.00 -0.55 0.21 -0.62 0.23 0.00 0.00 176.35 175.63 1j14 n GLU 77 N 5.44 2.77 0.00 1.70 1.02 -1.26 -5.03 120.64 125.28 1j14 n GLU 77 Ca 0.10 -0.03 0.00 0.00 -0.02 0.00 0.00 57.16 57.22 1j14 n GLU 77 Cb 0.47 -0.96 0.00 0.00 -0.02 0.00 0.00 31.44 30.93 1j14 n GLU 77 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1j14 n GLY 78 N 1.59 0.70 0.62 0.62 0.00 -1.26 -4.96 105.19 102.50 1j14 n GLY 78 Ca 0.00 0.00 0.07 0.00 0.00 0.00 0.00 46.02 46.09 1j14 n GLY 78 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1j14 n ASN 79 N 0.00 2.41 -4.80 1.61 3.02 -1.26 -5.03 115.26 111.21 1j14 n ASN 79 Ca 0.00 -1.68 -0.34 0.00 -0.03 0.00 0.00 54.58 52.53 1j14 n ASN 79 Cb 0.00 -0.07 -0.02 0.00 -0.61 0.00 0.00 39.78 39.08 1j14 n ASN 79 CO 0.00 0.00 0.00 -1.61 -2.62 0.00 0.00 177.26 173.03 1j14 s GLU 80 N -1.12 3.69 -0.20 3.52 8.01 -1.26 -4.36 118.70 126.98 1j14 s GLU 80 Ca 0.19 1.37 -0.05 0.00 0.01 0.00 0.00 54.97 56.49 1j14 s GLU 80 Cb 0.12 -2.08 0.07 0.00 -4.31 0.00 0.00 34.13 27.94 1j14 s GLU 80 CO 0.18 -0.53 0.11 -0.65 0.01 0.00 0.00 175.26 174.39 1j14 s GLN 81 N -3.35 0.10 -0.29 1.61 -0.21 -0.66 -4.98 119.66 111.87 1j14 s GLN 81 Ca 0.67 -0.14 -0.14 0.00 0.02 0.00 0.00 55.36 55.78 1j14 s GLN 81 Cb -0.17 -1.64 -0.03 0.00 1.00 0.00 0.00 33.01 32.16 1j14 s GLN 81 CO 0.23 -0.73 0.32 -0.06 -2.12 0.00 0.00 175.29 172.92 1j14 s PHE 82 N 2.15 3.23 -0.02 0.91 0.08 -1.26 -1.01 117.98 122.05 1j14 s PHE 82 Ca 0.04 0.22 0.03 0.00 0.12 0.00 0.00 56.93 57.34 1j14 s PHE 82 Cb -0.16 -2.54 -0.00 0.00 -0.57 0.00 0.00 43.02 39.75 1j14 s PHE 82 CO -0.14 -0.26 -0.12 0.08 -0.10 0.00 0.00 175.22 174.68 1j14 s VAL 83 N 1.97 1.01 0.33 -0.44 1.01 0.28 -4.98 120.40 119.58 1j14 s VAL 83 Ca 0.12 -0.51 -0.19 0.00 0.00 0.00 0.00 61.98 61.40 1j14 s VAL 83 Cb -0.16 -0.87 -0.09 0.00 0.00 0.00 0.00 36.38 35.25 1j14 s VAL 83 CO 0.11 0.30 0.81 0.20 0.00 0.00 0.00 175.10 176.52 1j14 s ASN 84 N -0.02 6.94 0.11 3.32 0.02 -1.26 0.62 114.94 124.67 1j14 s ASN 84 Ca -0.00 1.48 -0.30 0.00 -1.02 0.00 0.00 52.86 53.02 1j14 s ASN 84 Cb -0.08 -2.45 -0.06 0.00 0.02 0.00 0.00 41.25 38.68 1j14 s ASN 84 CO 0.00 -0.18 1.05 0.00 0.02 0.00 0.00 177.10 177.99 1j14 s ALA 85 N -1.89 3.30 -0.26 0.60 0.00 -0.23 -0.80 121.76 122.47 1j14 s ALA 85 Ca 0.53 0.69 -0.14 0.00 0.00 0.00 0.00 51.96 53.05 1j14 s ALA 85 Cb -0.12 -3.34 -0.14 0.00 0.00 0.00 0.00 23.12 19.52 1j14 s ALA 85 CO 0.18 -0.18 -0.23 0.00 0.00 0.00 0.00 175.76 175.53 1j14 n ALA 86 N 2.98 1.14 -4.03 0.00 0.00 0.86 -4.74 120.51 116.72 1j14 n ALA 86 Ca 0.04 -0.99 -0.31 0.00 0.00 0.00 0.00 53.44 52.18 1j14 n ALA 86 Cb 0.48 -0.02 -0.16 0.00 0.00 0.00 0.00 19.45 19.74 1j14 n ALA 86 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 1j14 s LYS 87 N -2.49 2.38 -0.33 0.00 1.02 -0.99 -4.98 119.74 114.35 1j14 s LYS 87 Ca -0.36 -0.65 -0.06 0.00 0.02 0.00 0.00 55.97 54.92 1j14 s LYS 87 Cb 0.13 -2.24 0.04 0.00 -0.52 0.00 0.00 37.83 35.24 1j14 s LYS 87 CO 0.52 -0.26 0.09 0.42 -0.92 0.00 0.00 175.35 175.20 1j14 s ILE 88 N 1.44 3.66 -0.30 2.17 1.01 -1.26 -0.44 121.20 127.48 1j14 s ILE 88 Ca 0.04 -1.17 -0.01 0.00 0.00 0.00 0.00 60.65 59.52 1j14 s ILE 88 Cb -0.13 -3.08 0.06 0.00 0.01 0.00 0.00 42.46 39.31 1j14 s ILE 88 CO -0.11 -0.17 -0.01 -0.63 0.00 0.00 0.00 174.94 174.02 1j14 s ILE 89 N 1.38 2.79 0.43 2.92 1.01 0.49 -4.99 121.20 125.22 1j14 s ILE 89 Ca -0.02 -1.51 -0.14 0.00 0.00 0.00 0.00 60.65 58.98 1j14 s ILE 89 Cb -0.20 -2.64 -0.08 0.00 0.01 0.00 0.00 42.46 39.56 1j14 s ILE 89 CO 0.02 -0.14 0.85 -0.54 0.00 0.00 0.00 174.94 175.13 1j14 s LYS 90 N 1.20 3.90 0.13 2.79 1.02 -1.26 -0.27 119.74 127.25 1j14 s LYS 90 Ca -0.05 0.70 -0.31 0.00 0.02 0.00 0.00 55.97 56.33 1j14 s LYS 90 Cb -0.20 -2.30 -0.10 0.00 -0.52 0.00 0.00 37.83 34.71 1j14 s LYS 90 CO -0.02 -0.08 1.68 -1.58 -0.92 0.00 0.00 175.35 174.42 1j14 s HIS 91 N -2.38 2.62 0.56 3.18 5.65 -0.51 -4.85 115.29 119.57 1j14 s HIS 91 Ca 0.55 0.34 0.31 0.00 0.25 0.00 0.00 55.06 56.51 1j14 s HIS 91 Cb -0.10 -4.02 1.46 0.00 -1.18 0.00 0.00 32.58 28.73 1j14 s HIS 91 CO 0.28 -4.01 1.83 -1.00 -0.65 0.00 0.00 174.74 171.18 1j14 h PRO 92 N 7.72 0.00 -0.61 2.88 0.13 -1.93 0.05 132.00 140.25 1j14 h PRO 92 Ca -0.43 0.00 -0.23 0.00 -0.87 0.00 0.00 66.00 64.47 1j14 h PRO 92 Cb 1.21 0.00 -0.14 0.00 0.13 0.00 0.00 31.00 32.20 1j14 h PRO 92 CO 0.93 0.00 0.21 0.09 -0.23 0.00 0.00 178.00 179.00 1j14 n ASN 93 N -3.96 3.87 -4.71 1.44 4.13 -1.26 -4.98 115.26 109.79 1j14 n ASN 93 Ca 0.17 -3.40 -0.42 0.00 1.68 0.00 0.00 54.58 52.60 1j14 n ASN 93 Cb 0.97 -0.70 -0.03 0.00 -1.54 0.00 0.00 39.78 38.48 1j14 n ASN 93 CO 0.00 0.00 0.00 0.12 0.28 0.00 0.00 177.26 177.66 1j14 s PHE 94 N -3.09 3.17 -0.38 3.10 5.36 0.00 -4.64 117.98 121.50 1j14 s PHE 94 Ca 0.51 0.95 -0.05 0.00 -0.96 0.00 0.00 56.93 57.37 1j14 s PHE 94 Cb 0.42 -3.66 0.07 0.00 -0.34 0.00 0.00 43.02 39.52 1j14 s PHE 94 CO 0.09 -2.32 0.16 0.34 -1.46 0.00 0.00 175.22 172.02 1j14 s ASP 95 N 1.28 5.32 0.30 6.13 -1.08 -0.89 -4.98 116.67 122.74 1j14 s ASP 95 Ca 0.64 -1.52 0.21 0.00 -0.52 0.00 0.00 52.55 51.35 1j14 s ASP 95 Cb -0.35 -1.86 1.09 0.00 -1.46 0.00 0.00 42.92 40.34 1j14 s ASP 95 CO 0.29 -0.44 1.64 -2.11 0.52 0.00 0.00 175.17 175.07 1j14 n ARG 96 N 4.75 0.14 -0.02 4.34 1.85 -1.26 -0.13 116.66 126.33 1j14 n ARG 96 Ca -0.09 0.60 -0.11 0.00 -1.00 0.00 0.00 57.85 57.25 1j14 n ARG 96 Cb 0.43 -1.93 -0.14 0.00 -1.05 0.00 0.00 32.46 29.77 1j14 n ARG 96 CO 0.00 0.00 0.00 0.39 -0.01 0.00 0.00 177.63 178.01 1j14 n GLU 97 N -2.22 0.66 -0.00 2.89 1.02 -1.26 -4.39 120.64 117.34 1j14 n GLU 97 Ca -0.01 0.29 0.08 0.00 -0.02 0.00 0.00 57.16 57.50 1j14 n GLU 97 Cb 0.06 -1.77 -0.11 0.00 -0.02 0.00 0.00 31.44 29.60 1j14 n GLU 97 CO 0.00 0.00 0.00 0.25 1.18 0.00 0.00 177.13 178.56 1j14 n THR 98 N -3.13 0.00 -1.55 2.62 -2.24 -1.00 -4.98 114.28 104.00 1j14 n THR 98 Ca -0.20 -0.28 -0.12 0.00 -2.27 0.00 0.00 64.05 61.18 1j14 n THR 98 Cb 1.05 0.46 -0.04 0.00 -2.10 0.00 0.00 70.33 69.71 1j14 n THR 98 CO 0.00 0.00 0.00 -1.22 -0.57 0.00 0.00 175.07 173.28 1j14 n TYR 99 N -1.79 -0.13 -2.51 4.78 4.02 0.82 -4.99 117.16 117.36 1j14 n TYR 99 Ca -0.01 0.00 -0.40 0.00 -0.01 0.00 0.00 57.90 57.48 1j14 n TYR 99 Cb 0.35 -2.31 -0.05 0.00 -0.02 0.00 0.00 39.34 37.31 1j14 n TYR 99 CO 0.00 0.00 0.00 1.21 -1.01 0.00 0.00 176.86 177.06 1j14 s ASN 100 N -2.78 7.31 -1.42 7.72 2.47 -1.22 -3.10 114.94 123.92 1j14 s ASN 100 Ca 0.00 2.23 -0.05 0.00 0.42 0.00 0.00 52.86 55.45 1j14 s ASN 100 Cb 0.00 -2.62 0.01 0.00 -1.45 0.00 0.00 41.25 37.18 1j14 s ASN 100 CO 0.00 -0.11 0.69 0.59 -3.72 0.00 0.00 177.10 174.55 1j14 n ASN 101 N 1.21 -5.91 -4.17 -4.21 5.03 -1.26 -2.10 115.26 103.85 1j14 n ASN 101 Ca -0.01 -0.32 -0.40 0.00 0.87 0.00 0.00 54.58 54.72 1j14 n ASN 101 Cb 0.45 -4.69 -0.02 0.00 -1.02 0.00 0.00 39.78 34.50 1j14 n ASN 101 CO 0.00 0.00 0.00 -0.67 -1.83 0.00 0.00 177.26 174.76 1j14 n ASP 102 N -2.33 3.86 -3.84 6.41 2.03 -1.18 -4.35 116.55 117.15 1j14 n ASP 102 Ca -0.08 -2.81 -0.12 0.00 0.52 0.00 0.00 54.79 52.30 1j14 n ASP 102 Cb 0.60 -1.61 -0.11 0.00 -0.72 0.00 0.00 41.12 39.28 1j14 n ASP 102 CO 0.00 0.00 0.00 -0.51 -1.92 0.00 0.00 177.20 174.77 1j14 s ILE 103 N 5.37 0.03 0.02 5.18 2.07 -1.26 -4.01 121.20 128.59 1j14 s ILE 103 Ca 0.55 -0.28 -0.06 0.00 -1.41 0.00 0.00 60.65 59.45 1j14 s ILE 103 Cb 0.08 -0.31 -0.00 0.00 0.13 0.00 0.00 42.46 42.35 1j14 s ILE 103 CO 0.05 -0.15 0.11 -0.32 -1.91 0.00 0.00 174.94 172.72 1j14 s MET 104 N -0.50 0.51 -0.01 3.50 -2.45 0.15 -1.43 119.30 119.08 1j14 s MET 104 Ca -0.06 -0.54 0.08 0.00 -1.25 0.00 0.00 55.69 53.92 1j14 s MET 104 Cb -0.04 0.21 -0.02 0.00 1.25 0.00 0.00 34.83 36.23 1j14 s MET 104 CO 0.01 -0.12 -0.24 -0.51 1.05 0.00 0.00 175.02 175.20 1j14 s LEU 105 N -1.65 2.06 -0.13 4.11 1.43 0.63 -0.74 118.68 124.39 1j14 s LEU 105 Ca -0.11 -0.45 0.01 0.00 -1.03 0.00 0.00 54.13 52.54 1j14 s LEU 105 Cb -0.06 -1.24 0.02 0.00 0.03 0.00 0.00 46.19 44.95 1j14 s LEU 105 CO -0.01 0.29 -0.14 -0.63 0.23 0.00 0.00 176.35 176.10 1j14 s ILE 106 N -0.60 1.47 -0.23 -0.59 1.01 0.66 -0.38 121.20 122.54 1j14 s ILE 106 Ca 0.09 -0.59 -0.14 0.00 0.00 0.00 0.00 60.65 60.02 1j14 s ILE 106 Cb -0.09 -1.38 -0.04 0.00 0.01 0.00 0.00 42.46 40.95 1j14 s ILE 106 CO -0.01 0.44 0.32 -0.75 0.00 0.00 0.00 174.94 174.94 1j14 s LYS 107 N 1.38 4.09 0.47 2.79 2.20 0.41 -1.07 119.74 130.01 1j14 s LYS 107 Ca 0.02 0.01 -0.21 0.00 -0.36 0.00 0.00 55.97 55.43 1j14 s LYS 107 Cb -0.13 -3.57 -0.09 0.00 -1.51 0.00 0.00 37.83 32.52 1j14 s LYS 107 CO -0.08 -0.08 1.02 -0.51 -0.36 0.00 0.00 175.35 175.34 1j14 s LEU 108 N 1.46 3.89 0.45 5.43 1.43 0.41 -0.10 118.68 131.66 1j14 s LEU 108 Ca 0.14 1.90 0.31 0.00 -1.03 0.00 0.00 54.13 55.45 1j14 s LEU 108 Cb -0.15 -4.52 1.63 0.00 0.03 0.00 0.00 46.19 43.19 1j14 s LEU 108 CO 0.08 -0.68 1.94 0.77 0.23 0.00 0.00 176.35 178.69 1j14 h SER 109 N 1.72 0.00 -4.74 2.29 4.64 -1.26 -3.42 113.55 112.79 1j14 h SER 109 Ca -0.49 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 60.81 1j14 h SER 109 Cb 1.21 0.00 -0.20 0.00 -0.31 0.00 0.00 62.40 63.10 1j14 h SER 109 CO 0.60 0.00 0.29 -0.94 -0.87 0.00 0.00 176.83 175.90 1j14 s SER 110 N -4.52 -0.58 0.40 4.97 1.04 -1.26 -5.01 113.70 108.73 1j14 s SER 110 Ca -0.03 0.65 -0.26 0.00 0.48 0.00 0.00 55.95 56.79 1j14 s SER 110 Cb 0.09 0.49 -0.09 0.00 0.10 0.00 0.00 66.02 66.61 1j14 s SER 110 CO 0.30 -0.53 1.28 -2.16 0.98 0.00 0.00 173.24 173.12 1j14 s PRO 111 N -1.14 4.01 0.44 4.02 0.04 -1.26 -4.84 135.00 136.27 1j14 s PRO 111 Ca -0.08 2.12 -0.03 0.00 0.04 0.00 0.00 61.00 63.05 1j14 s PRO 111 Cb -0.00 -2.78 -0.03 0.00 0.04 0.00 0.00 34.50 31.73 1j14 s PRO 111 CO 0.08 -0.44 0.70 0.14 0.04 0.00 0.00 177.00 177.52 1j14 s VAL 112 N -1.27 4.84 -0.38 -0.36 -7.23 -0.32 -5.02 120.40 110.66 1j14 s VAL 112 Ca 0.56 -0.08 -0.27 0.00 -1.81 0.00 0.00 61.98 60.38 1j14 s VAL 112 Cb -0.37 -3.82 0.02 0.00 0.56 0.00 0.00 36.38 32.77 1j14 s VAL 112 CO 0.48 -0.70 0.98 -0.54 -0.31 0.00 0.00 175.10 175.01 1j14 s LYS 113 N -4.60 3.84 0.12 4.82 1.02 -1.26 -4.90 119.74 118.77 1j14 s LYS 113 Ca 0.45 0.62 -0.29 0.00 0.02 0.00 0.00 55.97 56.77 1j14 s LYS 113 Cb -0.10 -3.81 -0.06 0.00 -0.52 0.00 0.00 37.83 33.33 1j14 s LYS 113 CO 0.41 -1.02 0.94 -0.51 -0.92 0.00 0.00 175.35 174.26 1j14 s LEU 114 N 3.64 4.51 0.00 3.17 1.43 -1.26 -4.80 118.68 125.37 1j14 s LEU 114 Ca 0.40 1.78 0.00 0.00 -1.03 0.00 0.00 54.13 55.28 1j14 s LEU 114 Cb -0.11 -3.56 0.00 0.00 0.03 0.00 0.00 46.19 42.55 1j14 s LEU 114 CO 0.20 -0.04 0.00 -0.46 0.23 0.00 0.00 176.35 176.29 1j14 n ASN 115 N 2.66 0.00 -0.13 2.29 6.94 0.12 -4.98 115.26 122.16 1j14 n ASN 115 Ca 0.01 -0.87 -0.06 0.00 -0.02 0.00 0.00 54.58 53.65 1j14 n ASN 115 Cb 0.49 0.00 0.01 0.00 -2.36 0.00 0.00 39.78 37.92 1j14 n ASN 115 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1j14 h ALA 116 N 2.00 0.02 -0.00 -2.53 0.00 -1.99 -1.38 119.26 115.38 1j14 h ALA 116 Ca 0.00 0.14 0.00 0.00 0.00 0.00 0.00 54.91 55.05 1j14 h ALA 116 Cb 0.00 0.56 0.00 0.00 0.00 0.00 0.00 17.79 18.35 1j14 h ALA 116 CO 0.00 -0.61 -0.16 2.89 0.00 0.00 0.00 179.25 181.37 1j14 n ARG 117 N -5.40 0.38 -3.64 0.00 0.00 -1.26 -4.56 116.66 102.18 1j14 n ARG 117 Ca 0.02 -0.13 -0.29 0.00 -0.00 0.00 0.00 57.85 57.45 1j14 n ARG 117 Cb 0.31 -1.50 -0.14 0.00 -0.00 0.00 0.00 32.46 31.14 1j14 n ARG 117 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.63 177.71 1j14 s VAL 118 N -2.70 0.72 0.12 8.89 1.01 -0.52 -3.96 120.40 123.95 1j14 s VAL 118 Ca 0.22 -1.66 0.03 0.00 0.00 0.00 0.00 61.98 60.57 1j14 s VAL 118 Cb 0.19 -1.53 -0.04 0.00 0.00 0.00 0.00 36.38 35.00 1j14 s VAL 118 CO 0.53 -0.80 -0.09 0.00 0.00 0.00 0.00 175.10 174.74 1j14 s ALA 119 N 1.26 1.21 0.48 5.51 0.00 -0.63 0.12 121.76 129.72 1j14 s ALA 119 Ca 0.13 -1.40 -0.08 0.00 0.00 0.00 0.00 51.96 50.61 1j14 s ALA 119 Cb -0.20 0.09 -0.05 0.00 0.00 0.00 0.00 23.12 22.97 1j14 s ALA 119 CO -0.15 -0.15 0.82 -0.08 0.00 0.00 0.00 175.76 176.19 1j14 s THR 120 N -3.38 4.84 0.06 0.00 -1.32 -1.26 -3.04 115.64 111.54 1j14 s THR 120 Ca 0.14 0.43 0.08 0.00 -1.21 0.00 0.00 61.69 61.13 1j14 s THR 120 Cb 0.03 -3.82 -0.03 0.00 -1.51 0.00 0.00 72.50 67.16 1j14 s THR 120 CO -0.02 -0.79 -0.20 0.54 -2.21 0.00 0.00 174.62 171.94 1j14 s VAL 121 N -2.69 2.64 0.39 5.08 0.11 -0.44 -4.85 120.40 120.65 1j14 s VAL 121 Ca 0.50 -1.31 -0.24 0.00 -2.93 0.00 0.00 61.98 58.01 1j14 s VAL 121 Cb -0.10 -2.12 -0.10 0.00 -1.53 0.00 0.00 36.38 32.53 1j14 s VAL 121 CO 0.42 0.29 0.99 0.00 -3.33 0.00 0.00 175.10 173.47 1j14 s ALA 122 N -0.94 3.10 0.46 1.54 0.00 -1.21 -4.60 121.76 120.10 1j14 s ALA 122 Ca 0.14 0.55 -0.18 0.00 0.00 0.00 0.00 51.96 52.47 1j14 s ALA 122 Cb -0.10 -3.21 -0.09 0.00 0.00 0.00 0.00 23.12 19.72 1j14 s ALA 122 CO 0.05 0.00 0.94 -0.51 0.00 0.00 0.00 175.76 176.25 1j14 s LEU 123 N -2.67 3.81 0.17 0.00 1.43 -1.26 -0.66 118.68 119.50 1j14 s LEU 123 Ca 0.57 1.60 -0.31 0.00 -1.03 0.00 0.00 54.13 54.96 1j14 s LEU 123 Cb -0.17 -4.48 -0.09 0.00 0.03 0.00 0.00 46.19 41.48 1j14 s LEU 123 CO 0.22 -0.44 1.44 -2.16 0.23 0.00 0.00 176.35 175.63 1j14 s PRO 124 N -3.56 4.29 0.27 1.29 0.04 -1.24 -4.72 135.00 131.37 1j14 s PRO 124 Ca 0.60 2.20 0.24 0.00 0.04 0.00 0.00 61.00 64.08 1j14 s PRO 124 Cb -0.09 -3.18 0.35 0.00 0.04 0.00 0.00 34.50 31.61 1j14 s PRO 124 CO 0.21 -0.46 1.44 0.77 0.04 0.00 0.00 177.00 179.01 1j14 h SER 125 N 6.25 0.00 -5.03 6.66 0.02 -1.94 -3.47 113.55 116.04 1j14 h SER 125 Ca -0.43 -0.04 0.07 0.00 -0.84 0.00 0.00 61.79 60.55 1j14 h SER 125 Cb 1.21 0.00 -0.08 0.00 0.14 0.00 0.00 62.40 63.67 1j14 h SER 125 CO 0.85 0.02 0.30 -0.94 -1.14 0.00 0.00 176.83 175.92 1j14 s SER 127 N -5.29 -0.33 -0.05 3.07 1.04 -1.26 -5.14 113.70 105.75 1j14 s SER 127 Ca 0.06 -0.36 -0.29 0.00 0.48 0.00 0.00 55.95 55.83 1j14 s SER 127 Cb 0.09 0.62 -0.02 0.00 0.10 0.00 0.00 66.02 66.81 1j14 s SER 127 CO 0.70 -1.10 0.95 0.00 0.98 0.00 0.00 173.24 174.76 1j14 s ALA 129 N 1.37 3.47 0.59 0.00 0.00 -1.26 -5.01 121.76 120.92 1j14 s ALA 129 Ca 0.49 1.20 -0.16 0.00 0.00 0.00 0.00 51.96 53.49 1j14 s ALA 129 Cb -0.20 -3.45 -0.04 0.00 0.00 0.00 0.00 23.12 19.43 1j14 s ALA 129 CO 0.23 -0.57 1.06 -1.25 0.00 0.00 0.00 175.76 175.22 1j14 s PRO 130 N -1.76 3.32 0.44 0.00 0.04 -1.26 -4.98 135.00 130.80 1j14 s PRO 130 Ca 0.49 1.19 -0.26 0.00 0.04 0.00 0.00 61.00 62.46 1j14 s PRO 130 Cb -0.38 -2.03 -0.09 0.00 0.04 0.00 0.00 34.50 32.04 1j14 s PRO 130 CO 0.51 -0.81 1.43 0.00 0.04 0.00 0.00 177.00 178.17 1j14 s ALA 132 N -2.47 3.28 0.00 8.56 0.00 -1.26 -2.38 121.76 127.49 1j14 s ALA 132 Ca 0.63 1.48 0.00 0.00 0.00 0.00 0.00 51.96 54.07 1j14 s ALA 132 Cb -0.16 -3.59 0.00 0.00 0.00 0.00 0.00 23.12 19.37 1j14 s ALA 132 CO 0.37 -1.18 0.00 0.41 0.00 0.00 0.00 175.76 175.36 1j14 n GLY 133 N 0.57 2.77 3.74 0.00 0.00 0.67 -4.97 105.19 107.96 1j14 n GLY 133 Ca 0.05 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.65 1j14 n GLY 133 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1j14 s THR 134 N -2.64 2.76 -0.12 2.61 2.01 -1.00 -4.67 115.64 114.59 1j14 s THR 134 Ca 0.00 0.64 -0.21 0.00 0.31 0.00 0.00 61.69 62.42 1j14 s THR 134 Cb 0.00 -3.41 -0.03 0.00 0.01 0.00 0.00 72.50 69.07 1j14 s THR 134 CO 0.00 0.10 0.63 -1.58 -0.69 0.00 0.00 174.62 173.08 1j14 s GLN 135 N -0.32 4.35 0.32 4.92 2.00 -1.26 -0.56 119.66 129.11 1j14 s GLN 135 Ca 0.59 0.70 0.06 0.00 -2.00 0.00 0.00 55.36 54.71 1j14 s GLN 135 Cb -0.41 -3.48 -0.06 0.00 0.80 0.00 0.00 33.01 29.86 1j14 s GLN 135 CO 0.42 0.00 -0.02 0.00 -0.50 0.00 0.00 175.29 175.20 1j14 s LEU 137 N -3.51 2.75 -0.04 0.00 2.96 0.65 -1.50 118.68 119.99 1j14 s LEU 137 Ca 0.33 -0.37 0.05 0.00 -0.22 0.00 0.00 54.13 53.92 1j14 s LEU 137 Cb 0.06 -1.65 -0.02 0.00 0.50 0.00 0.00 46.19 45.08 1j14 s LEU 137 CO 0.14 0.09 -0.17 -0.63 -1.32 0.00 0.00 176.35 174.46 1j14 s ILE 138 N 0.80 2.81 0.05 6.68 1.01 0.07 -1.41 121.20 131.22 1j14 s ILE 138 Ca -0.04 -0.82 -0.05 0.00 0.00 0.00 0.00 60.65 59.75 1j14 s ILE 138 Cb -0.15 -2.07 -0.02 0.00 0.01 0.00 0.00 42.46 40.23 1j14 s ILE 138 CO 0.01 0.59 0.08 -0.94 0.00 0.00 0.00 174.94 174.67 1j14 s SER 139 N -0.66 0.26 0.00 3.58 1.04 -1.24 -0.36 113.70 116.32 1j14 s SER 139 Ca 0.10 -0.70 0.00 0.00 0.48 0.00 0.00 55.95 55.83 1j14 s SER 139 Cb -0.11 0.24 0.00 0.00 0.10 0.00 0.00 66.02 66.26 1j14 s SER 139 CO 0.00 -0.58 0.00 0.61 0.98 0.00 0.00 173.24 174.25 1j14 n GLY 140 N 0.40 1.53 1.54 7.32 0.00 -0.62 -4.51 105.19 110.85 1j14 n GLY 140 Ca -0.17 -0.97 -0.08 0.00 0.00 0.00 0.00 46.02 44.81 1j14 n GLY 140 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 1j14 n TRP 141 N -0.63 1.80 -1.96 1.61 8.01 -1.26 -1.86 117.44 123.15 1j14 n TRP 141 Ca 0.00 -1.49 -0.30 0.00 -1.31 0.00 0.00 57.50 54.40 1j14 n TRP 141 Cb 0.00 -0.62 0.19 0.00 -2.01 0.00 0.00 31.31 28.88 1j14 n TRP 141 CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 177.69 176.88 1j14 s GLY 142 N -1.89 1.80 0.17 6.99 0.00 -1.24 -4.35 107.32 108.79 1j14 s GLY 142 Ca 0.49 -1.28 -0.33 0.00 0.00 0.00 0.00 44.72 43.60 1j14 s GLY 142 CO 0.06 -0.49 1.20 -2.01 0.00 0.00 0.00 173.10 171.87 1j14 n ASN 143 N -3.78 1.49 -0.59 1.64 5.15 0.44 -2.69 115.26 116.92 1j14 n ASN 143 Ca 0.16 1.14 0.10 0.00 -0.60 0.00 0.00 54.58 55.38 1j14 n ASN 143 Cb 0.59 -1.23 0.03 0.00 -0.53 0.00 0.00 39.78 38.65 1j14 n ASN 143 CO 0.00 0.00 0.00 0.35 1.40 0.00 0.00 177.26 179.01 1j14 n THR 144 N 1.66 0.00 -4.05 -0.44 -2.24 -0.68 -0.66 114.28 107.87 1j14 n THR 144 Ca 0.15 -0.37 -0.30 0.00 -2.27 0.00 0.00 64.05 61.26 1j14 n THR 144 Cb 0.24 1.31 -0.06 0.00 -2.10 0.00 0.00 70.33 69.72 1j14 n THR 144 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 1j14 s LEU 145 N -2.06 3.81 0.29 3.22 1.43 -1.26 -4.27 118.68 119.83 1j14 s LEU 145 Ca 0.19 -0.03 0.24 0.00 -1.03 0.00 0.00 54.13 53.51 1j14 s LEU 145 Cb 0.16 -2.48 0.49 0.00 0.03 0.00 0.00 46.19 44.40 1j14 s LEU 145 CO 0.40 0.15 1.58 -1.28 0.23 0.00 0.00 176.35 177.44 1j14 h SER 146 N 3.13 0.00 -3.18 2.29 0.87 -1.95 -3.44 113.55 111.28 1j14 h SER 146 Ca -0.47 -0.03 -0.17 0.00 -1.23 0.00 0.00 61.79 59.89 1j14 h SER 146 Cb 1.17 0.00 -0.29 0.00 -0.44 0.00 0.00 62.40 62.84 1j14 h SER 146 CO 0.65 0.01 -0.44 -0.55 -0.53 0.00 0.00 176.83 175.97 1j14 s SER 147 N -5.21 -0.20 0.00 6.23 0.15 -1.26 -4.50 113.70 108.90 1j14 s SER 147 Ca 0.08 0.65 0.00 0.00 0.70 0.00 0.00 55.95 57.38 1j14 s SER 147 Cb 0.09 0.60 0.00 0.00 -1.71 0.00 0.00 66.02 65.01 1j14 s SER 147 CO 0.66 -0.19 0.00 0.61 1.20 0.00 0.00 173.24 175.52 1j14 n GLY 148 N 4.53 -1.82 2.84 9.45 0.00 -1.26 -4.97 105.19 113.95 1j14 n GLY 148 Ca -0.20 -1.78 -0.15 0.00 0.00 0.00 0.00 46.02 43.89 1j14 n GLY 148 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1j14 s VAL 149 N 0.00 0.12 -0.22 1.61 1.01 -1.26 -4.70 120.40 116.95 1j14 s VAL 149 Ca 0.00 0.05 -0.03 0.00 0.00 0.00 0.00 61.98 62.00 1j14 s VAL 149 Cb 0.00 -0.18 0.11 0.00 0.00 0.00 0.00 36.38 36.31 1j14 s VAL 149 CO 0.00 0.09 0.29 0.21 0.00 0.00 0.00 175.10 175.69 1j14 s ASN 150 N 0.63 0.91 -0.26 3.32 2.47 -1.26 -5.00 114.94 115.76 1j14 s ASN 150 Ca -0.06 -0.05 -0.18 0.00 0.42 0.00 0.00 52.86 52.99 1j14 s ASN 150 Cb -0.09 0.69 -0.03 0.00 -1.45 0.00 0.00 41.25 40.37 1j14 s ASN 150 CO -0.01 -0.32 0.53 -1.61 -3.72 0.00 0.00 177.10 171.97 1j14 s GLU 151 N 2.42 4.08 0.65 0.43 2.02 -1.26 -1.69 118.70 125.35 1j14 s GLU 151 Ca 0.09 0.35 -0.11 0.00 0.02 0.00 0.00 54.97 55.32 1j14 s GLU 151 Cb -0.16 -3.64 -0.02 0.00 0.10 0.00 0.00 34.13 30.41 1j14 s GLU 151 CO -0.14 -0.34 1.04 -1.25 0.02 0.00 0.00 175.26 174.59 1j14 s PRO 152 N 2.28 3.34 -0.12 0.39 0.04 -1.26 -5.01 135.00 134.66 1j14 s PRO 152 Ca 0.22 0.83 -0.10 0.00 0.04 0.00 0.00 61.00 61.98 1j14 s PRO 152 Cb -0.16 -2.05 -0.26 0.00 0.04 0.00 0.00 34.50 32.08 1j14 s PRO 152 CO 0.09 -0.77 0.41 -0.44 0.04 0.00 0.00 177.00 176.32 1j14 h ASP 153 N -0.47 0.38 -3.10 6.66 3.32 -1.93 -3.46 116.42 117.81 1j14 h ASP 153 Ca -0.44 -0.88 -0.59 0.00 0.02 0.00 0.00 57.03 55.14 1j14 h ASP 153 Cb 1.20 -0.12 -0.05 0.00 0.22 0.00 0.00 39.33 40.58 1j14 h ASP 153 CO 0.60 1.77 -0.20 -0.76 -1.72 0.00 0.00 179.24 178.93 1j14 s LEU 154 N -7.26 4.40 0.05 1.55 1.43 -1.26 -0.31 118.68 117.28 1j14 s LEU 154 Ca -0.22 0.90 -0.34 0.00 -1.03 0.00 0.00 54.13 53.44 1j14 s LEU 154 Cb 0.06 -2.87 -0.12 0.00 0.03 0.00 0.00 46.19 43.28 1j14 s LEU 154 CO 0.75 0.22 1.75 -0.11 0.23 0.00 0.00 176.35 179.19 1j14 n LEU 155 N 1.24 3.39 -4.91 1.79 7.94 -0.82 -4.87 117.00 120.76 1j14 n LEU 155 Ca -0.10 1.02 -0.30 0.00 -1.11 0.00 0.00 56.01 55.52 1j14 n LEU 155 Cb 0.52 -1.42 -0.04 0.00 0.53 0.00 0.00 43.42 43.01 1j14 n LEU 155 CO 0.40 -0.12 -0.02 -1.10 -1.11 0.00 0.00 177.39 175.44 1j14 s GLN 156 N 2.52 3.55 0.13 1.96 -1.52 -0.78 -1.55 119.66 123.98 1j14 s GLN 156 Ca 0.85 -0.24 0.06 0.00 -1.95 0.00 0.00 55.36 54.09 1j14 s GLN 156 Cb -0.65 -2.90 -0.04 0.00 -0.22 0.00 0.00 33.01 29.20 1j14 s GLN 156 CO 0.44 0.49 -0.14 0.00 -0.25 0.00 0.00 175.29 175.82 1j14 s LEU 158 N -2.57 -0.12 -0.30 0.00 2.96 0.52 -0.40 118.68 118.76 1j14 s LEU 158 Ca 0.11 0.95 -0.11 0.00 -0.22 0.00 0.00 54.13 54.86 1j14 s LEU 158 Cb -0.04 1.46 -0.03 0.00 0.50 0.00 0.00 46.19 48.08 1j14 s LEU 158 CO 0.04 -0.19 0.19 -1.81 -1.32 0.00 0.00 176.35 173.26 1j14 s ASP 159 N 1.28 5.90 0.01 3.68 1.01 -1.26 -0.75 116.67 126.54 1j14 s ASP 159 Ca -0.08 -0.25 -0.01 0.00 0.71 0.00 0.00 52.55 52.91 1j14 s ASP 159 Cb -0.07 -2.10 -0.01 0.00 1.01 0.00 0.00 42.92 41.75 1j14 s ASP 159 CO -0.12 -0.14 0.01 0.00 0.21 0.00 0.00 175.17 175.13 1j14 s ALA 160 N 1.71 0.00 0.38 5.23 0.00 -0.56 -4.96 121.76 123.56 1j14 s ALA 160 Ca 0.06 -0.30 -0.08 0.00 0.00 0.00 0.00 51.96 51.64 1j14 s ALA 160 Cb -0.17 0.07 -0.06 0.00 0.00 0.00 0.00 23.12 22.97 1j14 s ALA 160 CO 0.10 -0.11 0.70 -1.25 0.00 0.00 0.00 175.76 175.20 1j14 s PRO 161 N -0.91 3.72 -0.06 0.00 0.04 -1.26 -0.53 135.00 136.00 1j14 s PRO 161 Ca -0.10 0.31 -0.30 0.00 0.04 0.00 0.00 61.00 60.95 1j14 s PRO 161 Cb -0.06 -2.47 -0.02 0.00 0.04 0.00 0.00 34.50 31.99 1j14 s PRO 161 CO -0.00 0.03 1.05 -1.17 0.04 0.00 0.00 177.00 176.95 1j14 s LEU 162 N -3.83 4.29 0.34 -3.56 0.20 0.27 -1.66 118.68 114.74 1j14 s LEU 162 Ca 0.49 1.65 -0.07 0.00 0.69 0.00 0.00 54.13 56.89 1j14 s LEU 162 Cb -0.10 -3.56 -0.05 0.00 -0.43 0.00 0.00 46.19 42.04 1j14 s LEU 162 CO 0.32 -0.43 0.63 -0.76 -0.29 0.00 0.00 176.35 175.82 1j14 s LEU 163 N 1.74 3.97 0.33 -0.68 1.43 -0.25 -0.24 118.68 124.97 1j14 s LEU 163 Ca 0.51 0.85 -0.29 0.00 -1.03 0.00 0.00 54.13 54.18 1j14 s LEU 163 Cb -0.21 -3.69 -0.10 0.00 0.03 0.00 0.00 46.19 42.21 1j14 s LEU 163 CO 0.22 -0.28 1.37 -2.84 0.23 0.00 0.00 176.35 175.05 1j14 s PRO 164 N -3.71 4.28 0.37 1.29 0.02 -1.26 -4.59 135.00 131.39 1j14 s PRO 164 Ca 0.46 2.33 0.10 0.00 0.02 0.00 0.00 61.00 63.91 1j14 s PRO 164 Cb -0.11 -3.05 0.87 0.00 0.02 0.00 0.00 34.50 32.24 1j14 s PRO 164 CO 0.31 -0.31 1.88 0.37 -0.33 0.00 0.00 177.00 178.92 1j14 h GLN 165 N 3.48 0.61 -0.77 5.54 5.75 -1.96 -0.78 115.11 126.99 1j14 h GLN 165 Ca -0.49 -0.04 0.05 0.00 -0.15 0.00 0.00 58.65 58.03 1j14 h GLN 165 Cb 1.23 -0.14 -0.06 0.00 1.07 0.00 0.00 27.48 29.58 1j14 h GLN 165 CO 0.67 0.41 0.46 0.00 -2.65 0.00 0.00 178.83 177.72 1j14 h ALA 166 N 1.61 1.04 -0.12 3.38 0.00 -1.99 0.76 119.26 123.93 1j14 h ALA 166 Ca 0.43 -0.00 -0.14 0.00 0.00 0.00 0.00 54.91 55.20 1j14 h ALA 166 Cb 0.74 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 18.32 1j14 h ALA 166 CO -0.18 0.19 -0.52 -0.44 0.00 0.00 0.00 179.25 178.30 1j14 h ASP 167 N 0.86 0.37 0.14 0.00 3.32 -1.53 -1.16 116.42 118.41 1j14 h ASP 167 Ca 0.33 -0.19 -0.01 0.00 0.02 0.00 0.00 57.03 57.19 1j14 h ASP 167 Cb 0.14 -0.10 0.00 0.00 0.22 0.00 0.00 39.33 39.59 1j14 h ASP 167 CO -0.16 0.82 -0.07 0.00 -1.72 0.00 0.00 179.24 178.11 1j14 h GLU 169 N -0.45 0.62 -0.23 0.00 5.08 -0.85 -1.53 114.58 117.22 1j14 h GLU 169 Ca -0.02 -0.10 -0.10 0.00 -1.00 0.00 0.00 59.36 58.14 1j14 h GLU 169 Cb 0.36 -0.11 -0.01 0.00 0.50 0.00 0.00 28.75 29.49 1j14 h GLU 169 CO 0.03 0.56 -0.28 0.00 -1.00 0.00 0.00 179.01 178.32 1j14 h ALA 170 N 1.52 1.10 -0.00 3.43 0.00 -1.16 -2.60 119.26 121.55 1j14 h ALA 170 Ca 0.14 -0.35 -0.21 0.00 0.00 0.00 0.00 54.91 54.48 1j14 h ALA 170 Cb 0.21 -0.12 -0.00 0.00 0.00 0.00 0.00 17.79 17.88 1j14 h ALA 170 CO -0.01 0.56 -0.91 0.77 0.00 0.00 0.00 179.25 179.66 1j14 h SER 171 N 0.39 0.45 -2.51 0.00 0.02 -0.69 -3.38 113.55 107.82 1j14 h SER 171 Ca 0.05 -0.36 -0.60 0.00 -0.84 0.00 0.00 61.79 60.05 1j14 h SER 171 Cb 0.69 -0.14 -0.41 0.00 0.14 0.00 0.00 62.40 62.69 1j14 h SER 171 CO 0.05 1.15 -0.72 -1.22 -1.14 0.00 0.00 176.83 174.95 1j14 n TYR 172 N -3.73 2.18 -1.68 3.45 4.01 -0.64 -4.96 117.16 115.79 1j14 n TYR 172 Ca -0.06 -3.99 -0.49 0.00 -0.16 0.00 0.00 57.90 53.21 1j14 n TYR 172 Cb 0.82 -0.42 -0.05 0.00 -0.31 0.00 0.00 39.34 39.38 1j14 n TYR 172 CO 0.00 0.00 0.00 -2.30 -0.46 0.00 0.00 176.86 174.10 1j14 n PRO 173 N 1.65 2.12 -1.23 -0.72 -0.02 -0.99 -2.08 135.00 133.74 1j14 n PRO 173 Ca 0.25 0.78 -0.08 0.00 -2.02 0.00 0.00 63.50 62.43 1j14 n PRO 173 Cb 0.42 -2.61 -0.03 0.00 -0.02 0.00 0.00 33.50 31.25 1j14 n PRO 173 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1j14 n GLY 174 N 4.35 0.97 0.00 -1.23 0.00 -1.26 -4.86 105.19 103.16 1j14 n GLY 174 Ca 0.23 -0.48 0.00 0.00 0.00 0.00 0.00 46.02 45.77 1j14 n GLY 174 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1j14 n LYS 175 N -2.42 3.56 -3.13 1.61 5.02 -0.88 -5.01 118.16 116.90 1j14 n LYS 175 Ca -0.08 0.00 -0.41 0.00 -2.02 0.00 0.00 58.31 55.80 1j14 n LYS 175 Cb 0.30 -0.58 -0.07 0.00 -0.02 0.00 0.00 35.03 34.66 1j14 n LYS 175 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 1j14 s ILE 176 N -1.05 4.96 0.45 -0.18 -1.09 -1.23 -5.04 121.20 118.03 1j14 s ILE 176 Ca 0.00 0.90 0.08 0.00 -2.23 0.00 0.00 60.65 59.41 1j14 s ILE 176 Cb 0.00 -3.97 0.03 0.00 -1.58 0.00 0.00 42.46 36.94 1j14 s ILE 176 CO 0.00 -0.09 0.62 0.42 -1.23 0.00 0.00 174.94 174.66 1j14 s THR 177 N 2.55 2.80 -1.84 2.92 -4.23 -1.26 -4.99 115.64 111.59 1j14 s THR 177 Ca 0.25 -1.01 0.18 0.00 -1.18 0.00 0.00 61.69 59.93 1j14 s THR 177 Cb -0.15 -2.81 0.46 0.00 1.34 0.00 0.00 72.50 71.34 1j14 s THR 177 CO 0.11 0.00 1.49 -0.90 -0.54 0.00 0.00 174.62 174.78 1j14 n ASP 178 N -1.93 0.00 -1.29 3.99 5.75 -1.26 -1.68 116.55 120.12 1j14 n ASP 178 Ca 0.10 -0.40 0.10 0.00 -0.01 0.00 0.00 54.79 54.57 1j14 n ASP 178 Cb 0.60 -0.08 0.31 0.00 -1.03 0.00 0.00 41.12 40.91 1j14 n ASP 178 CO 0.00 0.00 0.00 0.59 -0.11 0.00 0.00 177.20 177.68 1j14 n ASN 179 N -1.08 4.02 -4.22 -1.12 3.02 -1.26 -4.90 115.26 109.71 1j14 n ASN 179 Ca 0.12 -2.15 -0.22 0.00 -0.03 0.00 0.00 54.58 52.30 1j14 n ASN 179 Cb 0.08 -0.48 -0.13 0.00 -0.61 0.00 0.00 39.78 38.65 1j14 n ASN 179 CO 0.00 0.00 0.00 -0.04 -2.62 0.00 0.00 177.26 174.60 1j14 s MET 180 N -1.27 1.08 -0.05 3.52 -1.94 -0.68 -0.27 119.30 119.69 1j14 s MET 180 Ca 0.45 -0.99 -0.05 0.00 -1.71 0.00 0.00 55.69 53.40 1j14 s MET 180 Cb 0.26 -1.20 0.01 0.00 2.01 0.00 0.00 34.83 35.91 1j14 s MET 180 CO 0.28 0.29 0.14 0.54 -0.01 0.00 0.00 175.02 176.26 1j14 s VAL 181 N -1.04 0.01 0.05 -6.03 0.11 0.03 -4.78 120.40 108.74 1j14 s VAL 181 Ca 0.04 -0.11 -0.13 0.00 -2.93 0.00 0.00 61.98 58.86 1j14 s VAL 181 Cb -0.09 -0.24 -0.06 0.00 -1.53 0.00 0.00 36.38 34.46 1j14 s VAL 181 CO 0.03 -0.06 0.42 0.00 -3.33 0.00 0.00 175.10 172.16 1j14 s VAL 183 N -1.25 -0.04 -5.00 0.00 1.01 -0.99 -1.10 120.40 113.03 1j14 s VAL 183 Ca 0.29 0.15 0.00 0.00 0.00 0.00 0.00 61.98 62.42 1j14 s VAL 183 Cb -0.15 -0.08 0.00 0.00 0.00 0.00 0.00 36.38 36.15 1j14 s VAL 183 CO 0.16 0.06 0.00 0.61 0.00 0.00 0.00 175.10 175.93 1j14 n GLY 184 N 3.83 0.67 3.00 4.51 0.00 -0.66 -3.37 105.19 113.17 1j14 n GLY 184 Ca -0.23 -1.55 -0.25 0.00 0.00 0.00 0.00 46.02 43.99 1j14 n GLY 184 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1j14 s PHE 184 N -3.98 1.52 0.35 1.61 0.08 -1.26 -4.35 117.98 111.94 1j14 s PHE 184 Ca 0.00 -0.62 0.38 0.00 0.12 0.00 0.00 56.93 56.80 1j14 s PHE 184 Cb 0.00 -1.14 1.81 0.00 -0.57 0.00 0.00 43.02 43.12 1j14 s PHE 184 CO 0.00 -0.35 2.15 -0.07 -0.10 0.00 0.00 175.22 176.85 1j14 h LEU 185 N 7.28 0.00 -0.32 -0.37 4.07 -1.96 -2.46 115.31 121.56 1j14 h LEU 185 Ca -0.31 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.65 1j14 h LEU 185 Cb 1.17 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.91 1j14 h LEU 185 CO 0.46 0.01 -0.10 -1.84 -1.08 0.00 0.00 178.44 175.89 1j14 n GLU 186 N -3.12 0.84 -0.02 1.13 0.00 -1.26 0.46 120.64 118.66 1j14 n GLU 186 Ca -0.01 -0.32 0.00 0.00 0.00 0.00 0.00 57.16 56.83 1j14 n GLU 186 Cb 0.21 -1.49 -0.00 0.00 0.00 0.00 0.00 31.44 30.15 1j14 n GLU 186 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 1j14 n GLY 187 N 1.25 -2.07 1.69 -1.84 0.00 -0.93 -4.35 105.19 98.93 1j14 n GLY 187 Ca 0.16 -1.42 0.00 0.00 0.00 0.00 0.00 46.02 44.75 1j14 n GLY 187 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1j14 n GLY 188 N -0.28 2.26 3.16 -0.02 0.00 0.49 -4.92 105.19 105.88 1j14 n GLY 188 Ca 0.00 -0.51 -0.27 0.00 0.00 0.00 0.00 46.02 45.24 1j14 n GLY 188 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1j14 s LYS 188 N 0.00 1.93 -0.14 1.61 1.02 -1.26 -3.71 119.74 119.19 1j14 s LYS 188 Ca 0.00 -0.67 -0.34 0.00 0.02 0.00 0.00 55.97 54.98 1j14 s LYS 188 Cb 0.00 -1.67 0.15 0.00 -0.52 0.00 0.00 37.83 35.79 1j14 s LYS 188 CO 0.00 0.28 1.43 0.34 -0.92 0.00 0.00 175.35 176.48 1j14 s ASP 189 N -0.02 -0.00 0.63 2.83 2.15 -0.68 -4.40 116.67 117.17 1j14 s ASP 189 Ca -0.03 -0.00 -0.05 0.00 0.43 0.00 0.00 52.55 52.90 1j14 s ASP 189 Cb -0.12 0.00 0.04 0.00 -0.30 0.00 0.00 42.92 42.54 1j14 s ASP 189 CO 0.02 -0.01 0.92 -0.94 -0.17 0.00 0.00 175.17 174.99 1j14 s SER 190 N -2.77 5.18 0.37 -0.34 1.04 -1.26 -0.18 113.70 115.74 1j14 s SER 190 Ca 0.14 0.43 -0.07 0.00 0.48 0.00 0.00 55.95 56.93 1j14 s SER 190 Cb 0.06 -1.26 0.03 0.00 0.10 0.00 0.00 66.02 64.95 1j14 s SER 190 CO -0.06 -1.31 0.61 0.00 0.98 0.00 0.00 173.24 173.47 1j14 n GLN 192 N -0.55 1.44 0.00 0.00 3.00 -1.26 -1.25 117.38 118.76 1j14 n GLN 192 Ca -0.03 0.51 0.00 0.00 -0.01 0.00 0.00 57.00 57.47 1j14 n GLN 192 Cb 0.58 -2.01 0.00 0.00 0.00 0.00 0.00 30.24 28.81 1j14 n GLN 192 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 1j14 n GLY 193 N 1.81 3.48 0.05 1.08 0.00 -1.26 -0.42 105.19 109.92 1j14 n GLY 193 Ca 0.13 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.26 1j14 n GLY 193 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1j14 n ASP 194 N 0.00 0.64 -4.58 1.61 8.00 -0.38 -3.72 116.55 118.12 1j14 n ASP 194 Ca 0.00 -0.06 -0.50 0.00 0.71 0.00 0.00 54.79 54.94 1j14 n ASP 194 Cb 0.00 0.63 -0.05 0.00 -0.02 0.00 0.00 41.12 41.69 1j14 n ASP 194 CO 0.00 0.00 0.00 -1.20 -0.39 0.00 0.00 177.20 175.61 1j14 n SER 195 N -2.09 1.37 0.00 -2.24 7.64 -1.25 -0.53 113.62 116.52 1j14 n SER 195 Ca 0.02 1.13 0.00 0.00 1.01 0.00 0.00 58.87 61.03 1j14 n SER 195 Cb 0.45 -1.19 0.00 0.00 -1.01 0.00 0.00 64.21 62.46 1j14 n SER 195 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1j14 n GLY 196 N 2.18 2.38 3.69 0.23 0.00 -0.56 -0.40 105.19 112.70 1j14 n GLY 196 Ca 0.16 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.89 1j14 n GLY 196 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1j14 s GLY 197 N -2.16 1.60 0.33 -0.02 0.00 0.31 -3.37 107.32 104.01 1j14 s GLY 197 Ca 0.00 -0.09 -0.23 0.00 0.00 0.00 0.00 44.72 44.40 1j14 s GLY 197 CO 0.00 0.44 0.89 2.56 0.00 0.00 0.00 173.10 176.99 1j14 s PRO 198 N -4.88 4.39 -0.31 2.90 0.04 -1.26 -1.22 135.00 134.66 1j14 s PRO 198 Ca 0.64 1.14 0.01 0.00 0.04 0.00 0.00 61.00 62.84 1j14 s PRO 198 Cb -0.19 -2.64 0.09 0.00 0.04 0.00 0.00 34.50 31.81 1j14 s PRO 198 CO 0.58 0.22 0.05 0.08 0.04 0.00 0.00 177.00 177.97 1j14 s VAL 199 N -1.76 1.55 -0.20 -0.36 1.01 -0.36 -3.71 120.40 116.58 1j14 s VAL 199 Ca 0.52 -1.75 -0.04 0.00 0.00 0.00 0.00 61.98 60.72 1j14 s VAL 199 Cb -0.15 -2.10 -0.02 0.00 0.00 0.00 0.00 36.38 34.11 1j14 s VAL 199 CO 0.20 -0.54 -0.04 -0.69 0.00 0.00 0.00 175.10 174.03 1j14 s VAL 200 N 1.29 3.54 -0.17 2.92 1.01 -0.50 -0.35 120.40 128.15 1j14 s VAL 200 Ca 0.07 -0.45 0.01 0.00 0.00 0.00 0.00 61.98 61.61 1j14 s VAL 200 Cb -0.18 -2.59 0.02 0.00 0.00 0.00 0.00 36.38 33.63 1j14 s VAL 200 CO -0.15 0.44 -0.17 0.00 0.00 0.00 0.00 175.10 175.22 1j14 n ASN 202 N 4.68 -4.01 0.00 0.00 3.02 -1.26 -1.88 115.26 115.82 1j14 n ASN 202 Ca -0.19 -0.79 0.00 0.00 -0.03 0.00 0.00 54.58 53.56 1j14 n ASN 202 Cb 0.50 -3.89 0.00 0.00 -0.61 0.00 0.00 39.78 35.77 1j14 n ASN 202 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1j14 n GLY 203 N -1.68 0.90 3.35 7.41 0.00 -1.26 -5.03 105.19 108.88 1j14 n GLY 203 Ca -0.03 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.69 1j14 n GLY 203 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1j14 s GLU 204 N -0.15 1.85 -0.48 1.61 2.02 -0.79 -3.36 118.70 119.40 1j14 s GLU 204 Ca 0.00 -1.08 -0.29 0.00 0.02 0.00 0.00 54.97 53.62 1j14 s GLU 204 Cb 0.00 -2.00 0.03 0.00 0.10 0.00 0.00 34.13 32.26 1j14 s GLU 204 CO 0.00 0.52 1.19 -1.17 0.02 0.00 0.00 175.26 175.82 1j14 s LEU 209 N -1.18 3.60 -0.10 1.80 2.96 0.16 -0.61 118.68 125.32 1j14 s LEU 209 Ca 0.12 0.49 0.19 0.00 -0.22 0.00 0.00 54.13 54.70 1j14 s LEU 209 Cb -0.10 -3.51 -0.28 0.00 0.50 0.00 0.00 46.19 42.80 1j14 s LEU 209 CO 0.02 -1.31 0.27 0.00 -1.32 0.00 0.00 176.35 174.01 1j14 n GLN 210 N 7.95 0.76 -4.01 1.98 1.13 0.53 -3.72 117.38 122.00 1j14 n GLN 210 Ca 0.12 -0.11 -0.10 0.00 -1.94 0.00 0.00 57.00 54.98 1j14 n GLN 210 Cb 0.49 -1.48 -0.07 0.00 0.11 0.00 0.00 30.24 29.29 1j14 n GLN 210 CO 0.00 0.00 0.00 0.20 -1.44 0.00 0.00 177.06 175.82 1j14 s GLY 211 N -4.75 0.67 -0.05 1.08 0.00 -0.92 -2.10 107.32 101.25 1j14 s GLY 211 Ca -0.08 -1.04 0.02 0.00 0.00 0.00 0.00 44.72 43.62 1j14 s GLY 211 CO 0.81 -0.90 -0.08 -0.42 0.00 0.00 0.00 173.10 172.51 1j14 s ILE 212 N -4.01 0.77 0.03 0.90 1.01 -1.06 -1.22 121.20 117.61 1j14 s ILE 212 Ca 0.22 -0.27 -0.31 0.00 0.00 0.00 0.00 60.65 60.28 1j14 s ILE 212 Cb 0.03 -0.74 -0.10 0.00 0.01 0.00 0.00 42.46 41.66 1j14 s ILE 212 CO 0.04 0.27 1.92 0.52 0.00 0.00 0.00 174.94 177.69 1j14 n VAL 213 N 3.88 0.64 0.01 2.92 0.31 -0.36 -1.51 118.33 124.22 1j14 n VAL 213 Ca -0.24 -0.11 -0.00 0.00 -0.01 0.00 0.00 64.34 63.97 1j14 n VAL 213 Cb 0.51 -2.17 -0.00 0.00 -0.91 0.00 0.00 33.84 31.28 1j14 n VAL 213 CO 0.00 0.00 0.00 -0.24 -1.32 0.00 0.00 176.83 175.27 1j14 n SER 214 N 6.88 0.37 -1.64 4.52 2.88 -1.02 -1.49 113.62 124.12 1j14 n SER 214 Ca 0.20 0.05 -0.04 0.00 -1.33 0.00 0.00 58.87 57.75 1j14 n SER 214 Cb 0.37 -0.13 0.00 0.00 -0.75 0.00 0.00 64.21 63.70 1j14 n SER 214 CO 0.00 0.00 0.00 -2.67 -1.23 0.00 0.00 175.04 171.14 1j14 n TRP 215 N -2.83 -1.31 0.00 0.66 4.27 -0.75 -4.95 117.44 112.54 1j14 n TRP 215 Ca -0.00 -0.69 0.00 0.00 -3.89 0.00 0.00 57.50 52.92 1j14 n TRP 215 Cb 0.01 0.29 0.00 0.00 -1.36 0.00 0.00 31.31 30.25 1j14 n TRP 215 CO 0.00 0.00 0.00 0.41 -2.29 0.00 0.00 177.69 175.81 1j14 n GLY 216 N -0.19 2.58 3.53 -1.67 0.00 -1.26 -0.27 105.19 107.91 1j14 n GLY 216 Ca -0.02 -0.83 -0.43 0.00 0.00 0.00 0.00 46.02 44.74 1j14 n GLY 216 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1j14 s TYR 217 N -2.00 2.98 0.00 1.61 6.14 -1.26 -4.90 117.35 119.92 1j14 s TYR 217 Ca 0.00 0.06 0.00 0.00 0.64 0.00 0.00 57.07 57.77 1j14 s TYR 217 Cb 0.00 -3.68 0.00 0.00 0.42 0.00 0.00 41.96 38.70 1j14 s TYR 217 CO 0.00 -1.03 0.00 0.41 0.64 0.00 0.00 175.55 175.57 1j14 n GLY 219 N 5.02 -0.79 2.70 8.97 0.00 -1.26 -4.71 105.19 115.12 1j14 n GLY 219 Ca 0.01 -1.16 -0.19 0.00 0.00 0.00 0.00 46.02 44.68 1j14 n GLY 219 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1j14 n ALA 221 N 5.17 -0.44 -2.31 0.00 0.00 -1.26 -4.48 120.51 117.18 1j14 n ALA 221 Ca -0.06 0.15 -0.36 0.00 0.00 0.00 0.00 53.44 53.17 1j14 n ALA 221 Cb 0.50 -1.79 -0.06 0.00 0.00 0.00 0.00 19.45 18.11 1j14 n ALA 221 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1j14 s LEU 221 N -4.46 4.37 0.38 0.00 1.43 -1.26 -0.38 118.68 118.76 1j14 s LEU 221 Ca 0.00 1.15 -0.28 0.00 -1.03 0.00 0.00 54.13 53.97 1j14 s LEU 221 Cb 0.00 -3.24 -0.11 0.00 0.03 0.00 0.00 46.19 42.87 1j14 s LEU 221 CO 0.00 0.13 1.48 -2.84 0.23 0.00 0.00 176.35 175.34 1j14 s PRO 222 N -1.81 4.11 -0.06 1.29 0.02 -1.26 -2.17 135.00 135.11 1j14 s PRO 222 Ca 0.37 2.55 0.00 0.00 0.02 0.00 0.00 61.00 63.94 1j14 s PRO 222 Cb -0.16 -2.96 0.00 0.00 0.02 0.00 0.00 34.50 31.40 1j14 s PRO 222 CO 0.19 -0.52 0.00 -0.25 -0.33 0.00 0.00 177.00 176.09 1j14 n ASP 223 N 0.45 -4.91 -3.27 2.53 8.00 0.17 -4.90 116.55 114.63 1j14 n ASP 223 Ca 0.01 0.01 -0.25 0.00 0.71 0.00 0.00 54.79 55.27 1j14 n ASP 223 Cb 0.39 -2.46 -0.07 0.00 -0.02 0.00 0.00 41.12 38.96 1j14 n ASP 223 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 1j14 n ASN 224 N -0.62 1.34 -4.70 -2.24 3.02 -0.92 -4.75 115.26 106.39 1j14 n ASN 224 Ca -0.01 -2.93 -0.30 0.00 -0.03 0.00 0.00 54.58 51.31 1j14 n ASN 224 Cb 0.33 -0.65 0.14 0.00 -0.61 0.00 0.00 39.78 38.99 1j14 n ASN 224 CO 0.00 0.00 0.00 -2.16 -2.62 0.00 0.00 177.26 172.48 1j14 s PRO 225 N -1.58 1.18 0.46 3.52 0.04 -1.26 -4.36 135.00 132.98 1j14 s PRO 225 Ca 0.36 0.89 -0.21 0.00 0.04 0.00 0.00 61.00 62.08 1j14 s PRO 225 Cb 0.16 -1.79 -0.09 0.00 0.04 0.00 0.00 34.50 32.82 1j14 s PRO 225 CO -0.08 -2.31 1.04 0.20 0.04 0.00 0.00 177.00 175.88 1j14 s GLY 226 N -3.32 2.57 -0.12 0.56 0.00 -1.22 -4.66 107.32 101.14 1j14 s GLY 226 Ca 0.64 0.62 -0.02 0.00 0.00 0.00 0.00 44.72 45.96 1j14 s GLY 226 CO 0.57 0.97 -0.06 0.14 0.00 0.00 0.00 173.10 174.73 1j14 s VAL 227 N -1.89 3.77 0.14 1.40 1.01 0.63 -2.35 120.40 123.10 1j14 s VAL 227 Ca 0.64 -0.42 0.07 0.00 0.00 0.00 0.00 61.98 62.27 1j14 s VAL 227 Cb -0.18 -2.60 -0.04 0.00 0.00 0.00 0.00 36.38 33.56 1j14 s VAL 227 CO 0.22 0.54 -0.16 -0.31 0.00 0.00 0.00 175.10 175.39 1j14 s TYR 228 N -0.12 1.58 0.06 5.22 2.02 0.48 -1.81 117.35 124.78 1j14 s TYR 228 Ca 0.02 -0.51 -0.30 0.00 -0.37 0.00 0.00 57.07 55.90 1j14 s TYR 228 Cb -0.13 -0.81 -0.05 0.00 -0.40 0.00 0.00 41.96 40.56 1j14 s TYR 228 CO 0.03 0.22 1.13 0.99 -1.57 0.00 0.00 175.55 176.35 1j14 s THR 229 N -2.04 4.20 -0.93 -0.71 2.01 -0.57 -0.79 115.64 116.82 1j14 s THR 229 Ca 0.11 1.62 -0.24 0.00 0.31 0.00 0.00 61.69 63.49 1j14 s THR 229 Cb -0.06 -4.04 0.04 0.00 0.01 0.00 0.00 72.50 68.46 1j14 s THR 229 CO 0.04 0.15 1.41 -0.75 -0.69 0.00 0.00 174.62 174.78 1j14 s LYS 230 N 0.85 3.44 0.45 4.92 2.20 0.63 -2.58 119.74 129.65 1j14 s LYS 230 Ca 0.56 -0.82 0.14 0.00 -0.36 0.00 0.00 55.97 55.49 1j14 s LYS 230 Cb -0.27 -4.99 1.07 0.00 -1.51 0.00 0.00 37.83 32.13 1j14 s LYS 230 CO 0.30 -2.21 2.01 0.28 -0.36 0.00 0.00 175.35 175.36 1j14 h VAL 231 N 6.57 0.92 0.00 4.02 2.07 -1.72 -2.17 116.25 125.94 1j14 h VAL 231 Ca 0.05 -0.12 0.00 0.00 0.82 0.00 0.00 66.70 67.45 1j14 h VAL 231 Cb 1.02 0.54 0.00 0.00 -1.52 0.00 0.00 31.29 31.34 1j14 h VAL 231 CO 1.38 0.06 0.02 0.00 0.02 0.00 0.00 177.57 179.05 1j14 n ASN 233 N -2.55 0.30 -0.19 0.00 4.13 -0.81 -4.10 115.26 112.04 1j14 n ASN 233 Ca -0.02 0.19 0.02 0.00 1.68 0.00 0.00 54.58 56.45 1j14 n ASN 233 Cb 0.07 -0.18 0.03 0.00 -1.54 0.00 0.00 39.78 38.16 1j14 n ASN 233 CO 0.00 0.00 0.00 -1.22 0.28 0.00 0.00 177.26 176.32 1j14 n TYR 234 N -1.60 0.05 -0.25 3.10 4.01 0.09 -4.75 117.16 117.81 1j14 n TYR 234 Ca 0.06 -0.15 0.04 0.00 -0.16 0.00 0.00 57.90 57.69 1j14 n TYR 234 Cb 0.35 -0.01 0.14 0.00 -0.31 0.00 0.00 39.34 39.51 1j14 n TYR 234 CO 0.00 0.00 0.00 0.28 -0.46 0.00 0.00 176.86 176.68 1j14 h VAL 235 N 0.80 0.36 -0.03 -0.72 2.07 -1.69 -0.31 116.25 116.72 1j14 h VAL 235 Ca 0.00 -0.03 -0.00 0.00 0.82 0.00 0.00 66.70 67.49 1j14 h VAL 235 Cb 0.30 0.25 -0.00 0.00 -1.52 0.00 0.00 31.29 30.32 1j14 h VAL 235 CO 0.00 0.02 0.02 0.44 0.02 0.00 0.00 177.57 178.07 1j14 h ASP 236 N 0.09 0.04 -0.90 0.57 3.32 -1.90 -1.96 116.42 115.69 1j14 h ASP 236 Ca 0.39 -0.06 0.04 0.00 0.02 0.00 0.00 57.03 57.42 1j14 h ASP 236 Cb 0.68 -0.01 -0.05 0.00 0.22 0.00 0.00 39.33 40.16 1j14 h ASP 236 CO -0.65 0.09 0.58 -0.25 -1.72 0.00 0.00 179.24 177.29 1j14 h TRP 237 N -0.01 1.09 0.59 4.55 7.01 -1.62 0.38 115.95 127.94 1j14 h TRP 237 Ca 0.01 0.03 -0.02 0.00 2.11 0.00 0.00 58.89 61.02 1j14 h TRP 237 Cb 0.06 -0.36 -0.00 0.00 -2.10 0.00 0.00 29.16 26.75 1j14 h TRP 237 CO -0.06 0.62 -0.35 0.82 -2.79 0.00 0.00 178.44 176.69 1j14 h ILE 238 N 1.12 0.28 -0.44 2.65 2.04 -0.86 -0.25 117.51 122.05 1j14 h ILE 238 Ca 0.36 0.00 0.02 0.00 1.00 0.00 0.00 64.86 66.24 1j14 h ILE 238 Cb 0.01 0.28 -0.03 0.00 -0.74 0.00 0.00 36.82 36.34 1j14 h ILE 238 CO -0.12 0.00 0.27 1.56 0.00 0.00 0.00 178.15 179.86 1j14 h GLN 239 N -0.89 0.52 -0.20 2.37 4.20 -1.05 -0.01 115.11 120.05 1j14 h GLN 239 Ca -0.07 -0.03 0.03 0.00 0.06 0.00 0.00 58.65 58.63 1j14 h GLN 239 Cb 0.72 -0.12 -0.03 0.00 0.30 0.00 0.00 27.48 28.35 1j14 h GLN 239 CO 0.08 0.35 0.04 -0.44 -0.67 0.00 0.00 178.83 178.19 1j14 h ASP 240 N 0.54 0.02 -0.55 1.46 3.32 -0.85 -0.57 116.42 119.79 1j14 h ASP 240 Ca 0.17 0.03 -0.03 0.00 0.02 0.00 0.00 57.03 57.23 1j14 h ASP 240 Cb -0.00 0.04 -0.02 0.00 0.22 0.00 0.00 39.33 39.56 1j14 h ASP 240 CO -0.07 0.04 0.24 0.74 -1.72 0.00 0.00 179.24 178.47 1j14 h THR 241 N 0.13 1.21 -0.64 0.35 2.02 -0.66 0.23 112.91 115.56 1j14 h THR 241 Ca 0.09 -0.64 -0.00 0.00 0.77 0.00 0.00 66.41 66.63 1j14 h THR 241 Cb 0.08 0.61 -0.03 0.00 -1.74 0.00 0.00 68.15 67.07 1j14 h THR 241 CO -0.12 0.25 0.39 0.40 0.37 0.00 0.00 175.52 176.81 1j14 h ILE 242 N 0.75 1.18 -0.36 3.11 2.04 -0.76 -1.52 117.51 121.95 1j14 h ILE 242 Ca 0.19 -0.40 -0.10 0.00 1.00 0.00 0.00 64.86 65.54 1j14 h ILE 242 Cb 0.17 0.30 -0.02 0.00 -0.74 0.00 0.00 36.82 36.53 1j14 h ILE 242 CO -0.02 0.19 -0.19 0.00 0.00 0.00 0.00 178.15 178.13 1j14 h ALA 243 N 1.20 1.00 -0.00 1.87 0.00 -0.76 -2.95 119.26 119.62 1j14 h ALA 243 Ca 0.23 -0.34 0.00 0.00 0.00 0.00 0.00 54.91 54.80 1j14 h ALA 243 Cb -0.03 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 17.61 1j14 h ALA 243 CO -0.04 0.59 -0.06 0.00 0.00 0.00 0.00 179.25 179.74 1j14 n ALA 244 N -2.49 2.65 -0.66 0.00 0.00 0.04 -5.10 120.51 114.96 1j14 n ALA 244 Ca 0.00 -0.22 0.00 0.00 0.00 0.00 0.00 53.44 53.22 1j14 n ALA 244 Cb 0.40 -1.41 0.00 0.00 0.00 0.00 0.00 19.45 18.44 1j14 n ALA 244 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59