#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1j16 s VAL 17 N 0.00 5.23 -1.06 1.39 1.01 0.68 -4.15 120.40 123.50 1j16 s VAL 17 Ca 0.00 0.68 0.00 0.00 0.00 0.00 0.00 61.98 62.66 1j16 s VAL 17 Cb 0.00 -3.68 0.00 0.00 0.00 0.00 0.00 36.38 32.70 1j16 s VAL 17 CO 0.00 0.43 0.00 0.61 0.00 0.00 0.00 175.10 176.14 1j16 n GLY 18 N 2.95 0.92 0.00 4.51 0.00 -1.24 -1.60 105.19 110.71 1j16 n GLY 18 Ca -0.12 -0.53 0.00 0.00 0.00 0.00 0.00 46.02 45.37 1j16 n GLY 18 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1j16 n GLY 19 N -1.55 1.62 3.08 -0.02 0.00 -1.26 -4.80 105.19 102.26 1j16 n GLY 19 Ca -0.11 -1.93 -0.10 0.00 0.00 0.00 0.00 46.02 43.88 1j16 n GLY 19 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1j16 s TYR 20 N 2.04 0.59 -0.00 1.61 1.13 0.39 -4.94 117.35 118.17 1j16 s TYR 20 Ca 0.00 -0.76 -0.30 0.00 -1.41 0.00 0.00 57.07 54.59 1j16 s TYR 20 Cb 0.00 -0.38 -0.06 0.00 -1.10 0.00 0.00 41.96 40.42 1j16 s TYR 20 CO 0.00 -0.20 1.44 0.99 -2.51 0.00 0.00 175.55 175.27 1j16 s THR 21 N -2.65 3.64 0.59 -3.49 2.01 -1.26 0.20 115.64 114.68 1j16 s THR 21 Ca -0.01 1.01 -0.19 0.00 0.31 0.00 0.00 61.69 62.81 1j16 s THR 21 Cb -0.01 -3.65 -0.04 0.00 0.01 0.00 0.00 72.50 68.81 1j16 s THR 21 CO -0.04 -0.01 1.18 0.00 -0.69 0.00 0.00 174.62 175.06 1j16 s GLN 23 N -3.40 3.73 -0.20 0.00 -1.52 -1.26 -4.84 119.66 112.18 1j16 s GLN 23 Ca 0.75 2.16 -0.38 0.00 -1.95 0.00 0.00 55.36 55.94 1j16 s GLN 23 Cb -0.28 -2.60 -0.15 0.00 -0.22 0.00 0.00 33.01 29.77 1j16 s GLN 23 CO 0.32 -0.69 1.74 -1.91 -0.25 0.00 0.00 175.29 174.50 1j16 n GLU 24 N -0.23 1.40 -1.92 2.91 2.13 -1.26 -1.36 120.64 122.31 1j16 n GLU 24 Ca 0.06 0.51 -0.21 0.00 0.66 0.00 0.00 57.16 58.18 1j16 n GLU 24 Cb 0.44 -2.23 -0.06 0.00 0.27 0.00 0.00 31.44 29.86 1j16 n GLU 24 CO 0.00 0.00 0.00 0.09 -0.41 0.00 0.00 177.13 176.81 1j16 n ASN 25 N 5.37 -5.65 0.00 4.31 3.02 -1.26 -4.87 115.26 116.18 1j16 n ASN 25 Ca 0.25 0.30 0.14 0.00 -0.03 0.00 0.00 54.58 55.23 1j16 n ASN 25 Cb 0.17 -4.85 0.65 0.00 -0.61 0.00 0.00 39.78 35.15 1j16 n ASN 25 CO 0.00 0.00 0.00 -1.54 -2.62 0.00 0.00 177.26 173.10 1j16 n SER 26 N -1.59 0.00 -3.39 6.41 3.41 -0.46 -3.78 113.62 114.21 1j16 n SER 26 Ca -0.22 0.34 -0.26 0.00 -0.26 0.00 0.00 58.87 58.47 1j16 n SER 26 Cb 0.68 -0.45 -0.08 0.00 -0.26 0.00 0.00 64.21 64.10 1j16 n SER 26 CO 0.00 0.00 0.00 0.52 -0.16 0.00 0.00 175.04 175.40 1j16 n VAL 27 N -1.45 1.60 0.33 -3.33 0.31 -1.26 -4.97 118.33 109.56 1j16 n VAL 27 Ca 0.09 -4.91 0.20 0.00 -0.01 0.00 0.00 64.34 59.70 1j16 n VAL 27 Cb 0.32 -2.07 1.05 0.00 -0.91 0.00 0.00 33.84 32.23 1j16 n VAL 27 CO 0.00 0.00 0.00 1.55 -1.32 0.00 0.00 176.83 177.06 1j16 h PRO 28 N 4.22 0.00 -0.00 5.55 0.13 -1.78 -1.62 132.00 138.50 1j16 h PRO 28 Ca 0.17 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.30 1j16 h PRO 28 Cb 0.72 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.85 1j16 h PRO 28 CO 0.74 0.00 -0.40 2.48 -0.23 0.00 0.00 178.00 180.59 1j16 n TYR 29 N -3.03 0.00 -2.54 1.56 0.18 -1.15 -1.89 117.16 110.29 1j16 n TYR 29 Ca -0.02 0.00 -0.42 0.00 1.88 0.00 0.00 57.90 59.33 1j16 n TYR 29 Cb 0.20 -0.24 -0.03 0.00 -0.38 0.00 0.00 39.34 38.89 1j16 n TYR 29 CO 0.00 0.00 0.00 -1.14 -2.08 0.00 0.00 176.86 173.64 1j16 s GLN 30 N -2.88 4.43 0.24 -3.48 2.00 -0.61 -0.90 119.66 118.45 1j16 s GLN 30 Ca 0.15 1.60 0.10 0.00 -2.00 0.00 0.00 55.36 55.20 1j16 s GLN 30 Cb 0.18 -3.47 -0.05 0.00 0.80 0.00 0.00 33.01 30.47 1j16 s GLN 30 CO 0.64 -0.28 -0.18 0.14 -0.50 0.00 0.00 175.29 175.12 1j16 s VAL 31 N 1.57 2.13 -0.12 1.34 -7.23 -0.63 -4.48 120.40 112.97 1j16 s VAL 31 Ca 0.55 -2.27 -0.01 0.00 -1.81 0.00 0.00 61.98 58.43 1j16 s VAL 31 Cb -0.24 -2.15 -0.02 0.00 0.56 0.00 0.00 36.38 34.52 1j16 s VAL 31 CO 0.25 -0.46 -0.08 -0.55 -0.31 0.00 0.00 175.10 173.95 1j16 s SER 32 N -3.33 4.49 -0.20 4.85 0.15 -0.22 -2.21 113.70 117.24 1j16 s SER 32 Ca 0.25 -0.17 -0.15 0.00 0.70 0.00 0.00 55.95 56.59 1j16 s SER 32 Cb -0.04 -1.55 -0.04 0.00 -1.71 0.00 0.00 66.02 62.69 1j16 s SER 32 CO 0.11 0.22 0.34 -0.76 1.20 0.00 0.00 173.24 174.35 1j16 s LEU 33 N 0.04 4.16 -0.03 3.45 1.43 0.62 -0.82 118.68 127.53 1j16 s LEU 33 Ca -0.02 0.45 0.04 0.00 -1.03 0.00 0.00 54.13 53.57 1j16 s LEU 33 Cb -0.14 -2.43 -0.00 0.00 0.03 0.00 0.00 46.19 43.65 1j16 s LEU 33 CO 0.03 -0.03 -0.15 0.21 0.23 0.00 0.00 176.35 176.64 1j16 s ASN 34 N 0.98 1.94 -0.30 2.29 2.47 0.01 -1.54 114.94 120.79 1j16 s ASN 34 Ca 0.17 -0.31 0.17 0.00 0.42 0.00 0.00 52.86 53.31 1j16 s ASN 34 Cb -0.14 -0.48 0.48 0.00 -1.45 0.00 0.00 41.25 39.66 1j16 s ASN 34 CO 0.07 0.15 1.09 -1.54 -3.72 0.00 0.00 177.10 173.15 1j16 n SER 37 N 3.09 2.53 0.00 -4.21 3.41 -1.26 -0.99 113.62 116.19 1j16 n SER 37 Ca -0.17 -2.68 0.00 0.00 -0.26 0.00 0.00 58.87 55.75 1j16 n SER 37 Cb 0.53 -0.46 0.00 0.00 -0.26 0.00 0.00 64.21 64.02 1j16 n SER 37 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1j16 n GLY 38 N -0.50 0.91 3.51 5.00 0.00 -1.26 -5.02 105.19 107.83 1j16 n GLY 38 Ca 0.18 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 46.12 1j16 n GLY 38 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1j16 s TYR 39 N -2.08 -0.34 0.07 1.61 1.13 -1.26 -5.14 117.35 111.35 1j16 s TYR 39 Ca 0.00 0.22 -0.31 0.00 -1.41 0.00 0.00 57.07 55.57 1j16 s TYR 39 Cb 0.00 0.53 -0.06 0.00 -1.10 0.00 0.00 41.96 41.33 1j16 s TYR 39 CO 0.00 -0.52 1.29 -1.58 -2.51 0.00 0.00 175.55 172.23 1j16 s HIS 40 N -3.00 3.30 0.00 -3.49 5.65 -1.26 -4.27 115.29 112.21 1j16 s HIS 40 Ca 0.05 1.12 0.00 0.00 0.25 0.00 0.00 55.06 56.48 1j16 s HIS 40 Cb -0.01 -3.54 0.00 0.00 -1.18 0.00 0.00 32.58 27.85 1j16 s HIS 40 CO -0.08 -1.80 0.00 1.97 -0.65 0.00 0.00 174.74 174.18 1j16 n PHE 41 N 4.15 0.00 -3.70 3.88 -1.74 -0.59 -4.99 117.46 114.47 1j16 n PHE 41 Ca 0.10 0.00 -0.08 0.00 -0.56 0.00 0.00 57.45 56.91 1j16 n PHE 41 Cb 0.45 0.00 -0.02 0.00 1.52 0.00 0.00 39.48 41.43 1j16 n PHE 41 CO 0.00 0.00 0.00 0.00 -0.56 0.00 0.00 176.76 176.20 1j16 n GLY 43 N -0.43 2.68 3.77 0.00 0.00 0.53 -0.27 105.19 111.46 1j16 n GLY 43 Ca -0.08 -2.28 -0.03 0.00 0.00 0.00 0.00 46.02 43.63 1j16 n GLY 43 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1j16 s GLY 44 N -4.09 -0.17 -0.05 -0.02 0.00 -0.94 -3.52 107.32 98.53 1j16 s GLY 44 Ca 0.32 0.08 0.03 0.00 0.00 0.00 0.00 44.72 45.15 1j16 s GLY 44 CO 0.20 0.67 -0.12 -0.56 0.00 0.00 0.00 173.10 173.30 1j16 s SER 45 N -3.07 1.70 -0.18 1.64 0.01 -0.34 -1.61 113.70 111.85 1j16 s SER 45 Ca 0.15 -0.28 -0.29 0.00 1.31 0.00 0.00 55.95 56.84 1j16 s SER 45 Cb -0.01 -0.70 -0.00 0.00 0.21 0.00 0.00 66.02 65.52 1j16 s SER 45 CO 0.02 0.05 1.13 -0.22 0.41 0.00 0.00 173.24 174.63 1j16 s LEU 46 N 0.51 4.16 -0.01 2.44 2.96 -0.08 -1.06 118.68 127.59 1j16 s LEU 46 Ca -0.11 1.54 0.13 0.00 -0.22 0.00 0.00 54.13 55.47 1j16 s LEU 46 Cb -0.14 -3.54 -0.19 0.00 0.50 0.00 0.00 46.19 42.81 1j16 s LEU 46 CO 0.03 -0.67 0.36 2.30 -1.32 0.00 0.00 176.35 177.05 1j16 n ILE 47 N 5.20 0.00 -3.81 6.68 -5.35 -0.62 -1.13 119.36 120.34 1j16 n ILE 47 Ca 0.12 -0.28 -0.08 0.00 -0.27 0.00 0.00 62.75 62.24 1j16 n ILE 47 Cb 0.46 0.39 -0.02 0.00 -1.74 0.00 0.00 39.64 38.73 1j16 n ILE 47 CO 0.00 0.00 0.00 0.54 -1.76 0.00 0.00 176.55 175.33 1j16 s ASN 48 N -3.23 -0.29 0.00 7.28 2.20 -1.19 -4.62 114.94 115.09 1j16 s ASN 48 Ca -0.03 -0.55 0.00 0.00 -0.94 0.00 0.00 52.86 51.35 1j16 s ASN 48 Cb 0.09 0.69 0.00 0.00 -2.00 0.00 0.00 41.25 40.03 1j16 s ASN 48 CO 0.56 -1.27 0.92 -0.90 -2.94 0.00 0.00 177.10 173.47 1j16 n ASP 49 N -0.44 0.00 -0.05 3.54 5.68 -1.26 -2.61 116.55 121.41 1j16 n ASP 49 Ca -0.06 0.43 0.00 0.00 -0.50 0.00 0.00 54.79 54.66 1j16 n ASP 49 Cb 0.60 -0.43 0.00 0.00 -1.14 0.00 0.00 41.12 40.16 1j16 n ASP 49 CO 0.00 0.00 0.00 1.67 -1.33 0.00 0.00 177.20 177.54 1j16 n GLN 50 N -1.42 0.48 -4.20 0.11 7.27 -1.26 -0.45 117.38 117.90 1j16 n GLN 50 Ca 0.00 -0.74 -0.17 0.00 0.07 0.00 0.00 57.00 56.16 1j16 n GLN 50 Cb 0.06 -0.60 -0.15 0.00 2.41 0.00 0.00 30.24 31.97 1j16 n GLN 50 CO 0.00 0.00 0.00 -1.58 0.07 0.00 0.00 177.06 175.55 1j16 s TRP 51 N -0.21 0.57 -0.03 3.69 0.52 -1.07 -0.42 118.94 121.98 1j16 s TRP 51 Ca 0.01 -0.11 0.05 0.00 0.02 0.00 0.00 56.10 56.07 1j16 s TRP 51 Cb 0.01 -0.39 -0.01 0.00 -1.15 0.00 0.00 33.47 31.93 1j16 s TRP 51 CO 0.00 -0.03 -0.18 0.08 0.02 0.00 0.00 176.95 176.84 1j16 s VAL 52 N -0.02 1.47 -0.11 4.03 1.01 -0.24 -1.59 120.40 124.95 1j16 s VAL 52 Ca 0.01 -0.76 -0.02 0.00 0.00 0.00 0.00 61.98 61.20 1j16 s VAL 52 Cb -0.04 -1.25 -0.03 0.00 0.00 0.00 0.00 36.38 35.06 1j16 s VAL 52 CO -0.00 0.42 -0.02 0.54 0.00 0.00 0.00 175.10 176.04 1j16 s VAL 53 N -0.17 4.14 0.00 2.92 0.11 -0.22 -0.43 120.40 126.74 1j16 s VAL 53 Ca 0.01 -0.30 0.00 0.00 -2.93 0.00 0.00 61.98 58.76 1j16 s VAL 53 Cb -0.10 -2.76 0.00 0.00 -1.53 0.00 0.00 36.38 31.99 1j16 s VAL 53 CO 0.01 0.56 0.00 -0.24 -3.33 0.00 0.00 175.10 172.10 1j16 n SER 54 N 2.65 0.00 -4.85 3.54 2.88 0.26 -1.20 113.62 116.90 1j16 n SER 54 Ca -0.18 -0.09 -0.36 0.00 -1.33 0.00 0.00 58.87 56.91 1j16 n SER 54 Cb 0.53 0.00 -0.06 0.00 -0.75 0.00 0.00 64.21 63.93 1j16 n SER 54 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1j16 s ALA 55 N -1.72 3.80 0.48 -1.46 0.00 -1.26 -0.87 121.76 120.73 1j16 s ALA 55 Ca 0.00 -0.68 0.13 0.00 0.00 0.00 0.00 51.96 51.40 1j16 s ALA 55 Cb 0.00 -1.88 1.11 0.00 0.00 0.00 0.00 23.12 22.35 1j16 s ALA 55 CO 0.00 0.63 2.10 0.00 0.00 0.00 0.00 175.76 178.50 1j16 h ALA 56 N 4.83 1.91 0.00 0.00 0.00 -1.68 -0.85 119.26 123.47 1j16 h ALA 56 Ca -0.54 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.36 1j16 h ALA 56 Cb 1.22 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.94 1j16 h ALA 56 CO 0.59 0.07 0.00 -2.39 0.00 0.00 0.00 179.25 177.52 1j16 n HIS 57 N -4.51 0.00 1.15 0.00 1.44 -1.26 -1.47 115.22 110.57 1j16 n HIS 57 Ca 0.00 0.00 0.11 0.00 -2.01 0.00 0.00 57.72 55.82 1j16 n HIS 57 Cb 0.11 -0.47 0.36 0.00 0.12 0.00 0.00 29.99 30.10 1j16 n HIS 57 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 1j16 n TYR 59 N 0.44 2.60 -3.83 0.00 9.36 -0.54 -5.02 117.16 120.16 1j16 n TYR 59 Ca 0.16 0.48 -0.10 0.00 3.32 0.00 0.00 57.90 61.76 1j16 n TYR 59 Cb 0.36 -2.46 -0.08 0.00 -0.63 0.00 0.00 39.34 36.53 1j16 n TYR 59 CO 0.00 0.00 0.00 0.15 0.22 0.00 0.00 176.86 177.23 1j16 s LYS 60 N -2.16 0.76 0.46 2.98 1.02 -1.26 -5.06 119.74 116.48 1j16 s LYS 60 Ca 0.57 -0.72 0.12 0.00 0.02 0.00 0.00 55.97 55.97 1j16 s LYS 60 Cb -0.49 0.32 1.06 0.00 -0.52 0.00 0.00 37.83 38.19 1j16 s LYS 60 CO 0.61 -0.23 2.08 0.66 -0.92 0.00 0.00 175.35 177.54 1j16 h SER 61 N 3.18 0.17 -3.77 2.83 4.64 -2.01 -3.42 113.55 115.17 1j16 h SER 61 Ca -0.33 -0.01 -0.21 0.00 -0.47 0.00 0.00 61.79 60.77 1j16 h SER 61 Cb 1.20 -0.04 -0.27 0.00 -0.31 0.00 0.00 62.40 62.97 1j16 h SER 61 CO 0.50 0.17 -0.65 -0.13 -0.87 0.00 0.00 176.83 175.86 1j16 s ARG 62 N -5.12 0.08 -0.06 4.77 0.52 -1.26 -5.05 118.95 112.82 1j16 s ARG 62 Ca -0.06 0.08 -0.04 0.00 -0.52 0.00 0.00 55.73 55.19 1j16 s ARG 62 Cb 0.17 0.04 0.03 0.00 0.52 0.00 0.00 34.95 35.70 1j16 s ARG 62 CO 0.70 -0.01 0.15 0.42 0.02 0.00 0.00 175.30 176.58 1j16 s ILE 63 N 0.01 -0.02 -0.21 1.52 1.01 -1.26 -4.85 121.20 117.39 1j16 s ILE 63 Ca -0.00 0.09 -0.07 0.00 0.00 0.00 0.00 60.65 60.66 1j16 s ILE 63 Cb -0.01 -0.23 -0.04 0.00 0.01 0.00 0.00 42.46 42.20 1j16 s ILE 63 CO 0.00 0.04 0.07 -1.58 0.00 0.00 0.00 174.94 173.47 1j16 s GLN 64 N 0.63 3.86 -0.20 2.79 0.74 -0.16 -0.88 119.66 126.44 1j16 s GLN 64 Ca -0.05 -0.39 -0.17 0.00 0.05 0.00 0.00 55.36 54.80 1j16 s GLN 64 Cb -0.06 -3.27 -0.04 0.00 1.10 0.00 0.00 33.01 30.75 1j16 s GLN 64 CO -0.03 0.10 0.44 0.08 -0.55 0.00 0.00 175.29 175.32 1j16 s VAL 66 N 0.86 5.17 -0.29 1.34 1.01 0.92 -0.81 120.40 128.59 1j16 s VAL 66 Ca 0.04 0.79 -0.05 0.00 0.00 0.00 0.00 61.98 62.76 1j16 s VAL 66 Cb -0.14 -3.77 0.02 0.00 0.00 0.00 0.00 36.38 32.50 1j16 s VAL 66 CO 0.02 0.23 0.04 -0.13 0.00 0.00 0.00 175.10 175.26 1j16 s ARG 67 N 1.41 2.86 0.26 2.72 0.52 0.00 -0.73 118.95 126.00 1j16 s ARG 67 Ca 0.21 -0.99 0.08 0.00 -0.52 0.00 0.00 55.73 54.50 1j16 s ARG 67 Cb -0.15 -3.27 -0.04 0.00 0.52 0.00 0.00 34.95 32.01 1j16 s ARG 67 CO 0.09 -0.49 0.13 -0.51 0.02 0.00 0.00 175.30 174.53 1j16 s LEU 68 N 1.41 3.57 -1.07 2.53 1.02 0.32 -1.05 118.68 125.41 1j16 s LEU 68 Ca 0.00 -0.42 0.00 0.00 0.02 0.00 0.00 54.13 53.74 1j16 s LEU 68 Cb -0.18 -2.10 0.00 0.00 0.02 0.00 0.00 46.19 43.93 1j16 s LEU 68 CO 0.00 -0.04 0.00 0.61 0.02 0.00 0.00 176.35 176.94 1j16 n GLY 69 N -1.08 1.11 3.83 -3.19 0.00 -1.26 -1.48 105.19 103.12 1j16 n GLY 69 Ca -0.07 -0.56 -0.35 0.00 0.00 0.00 0.00 46.02 45.03 1j16 n GLY 69 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1j16 s GLU 70 N -2.93 4.10 0.00 1.61 0.41 -1.26 -3.87 118.70 116.76 1j16 s GLU 70 Ca 0.00 0.67 0.00 0.00 -0.41 0.00 0.00 54.97 55.23 1j16 s GLU 70 Cb 0.00 -2.86 0.00 0.00 -1.78 0.00 0.00 34.13 29.49 1j16 s GLU 70 CO 0.00 0.41 0.00 1.58 -0.49 0.00 0.00 175.26 176.76 1j16 n HIS 71 N 0.65 0.00 -3.01 1.61 -0.00 -1.26 -4.63 115.22 108.58 1j16 n HIS 71 Ca -0.03 0.00 -0.43 0.00 -0.00 0.00 0.00 57.72 57.26 1j16 n HIS 71 Cb 0.52 0.17 -0.06 0.00 -0.00 0.00 0.00 29.99 30.62 1j16 n HIS 71 CO 0.00 0.00 0.00 1.21 -0.00 0.00 0.00 176.34 177.55 1j16 s ASN 72 N -3.60 6.42 0.00 0.26 3.84 -1.26 -2.27 114.94 118.33 1j16 s ASN 72 Ca 0.00 -0.04 0.17 0.00 0.21 0.00 0.00 52.86 53.21 1j16 s ASN 72 Cb 0.00 -2.37 0.81 0.00 -0.55 0.00 0.00 41.25 39.14 1j16 s ASN 72 CO 0.00 -0.81 1.54 2.30 -2.79 0.00 0.00 177.10 177.34 1j16 n ILE 73 N 5.94 0.65 0.28 -5.21 -5.35 -0.23 -3.08 119.36 112.36 1j16 n ILE 73 Ca 0.01 0.16 0.05 0.00 -0.27 0.00 0.00 62.75 62.71 1j16 n ILE 73 Cb 0.48 -0.87 0.07 0.00 -1.74 0.00 0.00 39.64 37.58 1j16 n ILE 73 CO 0.00 0.00 0.00 0.59 -1.76 0.00 0.00 176.55 175.38 1j16 n ASN 74 N -1.39 2.13 -3.91 7.28 3.02 -1.26 -4.96 115.26 116.16 1j16 n ASN 74 Ca 0.06 -1.58 -0.19 0.00 -0.03 0.00 0.00 54.58 52.84 1j16 n ASN 74 Cb 0.17 -0.06 -0.16 0.00 -0.61 0.00 0.00 39.78 39.12 1j16 n ASN 74 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 1j16 s VAL 75 N -0.90 0.55 -0.47 2.41 1.01 -1.18 -5.10 120.40 116.72 1j16 s VAL 75 Ca 0.15 -0.16 -0.29 0.00 0.00 0.00 0.00 61.98 61.67 1j16 s VAL 75 Cb 0.09 -0.55 0.03 0.00 0.00 0.00 0.00 36.38 35.95 1j16 s VAL 75 CO 0.13 0.21 1.16 -0.76 0.00 0.00 0.00 175.10 175.85 1j16 s LEU 76 N 0.69 3.64 0.00 3.92 1.43 -1.26 -4.65 118.68 122.44 1j16 s LEU 76 Ca -0.09 0.51 0.21 0.00 -1.03 0.00 0.00 54.13 53.73 1j16 s LEU 76 Cb -0.12 -3.55 -0.15 0.00 0.03 0.00 0.00 46.19 42.39 1j16 s LEU 76 CO 0.00 -1.26 0.93 -0.62 0.23 0.00 0.00 176.35 175.64 1j16 n GLU 77 N 7.83 0.59 0.00 1.70 1.02 -1.26 -5.01 120.64 125.50 1j16 n GLU 77 Ca 0.12 -0.32 0.00 0.00 -0.02 0.00 0.00 57.16 56.95 1j16 n GLU 77 Cb 0.49 -1.46 0.00 0.00 -0.02 0.00 0.00 31.44 30.45 1j16 n GLU 77 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1j16 n GLY 78 N 1.45 0.69 0.04 0.62 0.00 -1.26 -4.96 105.19 101.77 1j16 n GLY 78 Ca 0.05 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.08 1j16 n GLY 78 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1j16 n ASN 79 N 0.00 2.01 -4.78 1.61 3.02 -1.26 -5.06 115.26 110.81 1j16 n ASN 79 Ca 0.00 -1.96 -0.36 0.00 -0.03 0.00 0.00 54.58 52.22 1j16 n ASN 79 Cb 0.00 -0.01 -0.04 0.00 -0.61 0.00 0.00 39.78 39.12 1j16 n ASN 79 CO 0.00 0.00 0.00 -1.61 -2.62 0.00 0.00 177.26 173.03 1j16 s GLU 80 N -0.96 4.09 -0.10 3.52 8.01 -1.25 -4.29 118.70 127.71 1j16 s GLU 80 Ca 0.01 1.54 -0.02 0.00 0.01 0.00 0.00 54.97 56.51 1j16 s GLU 80 Cb 0.01 -2.50 0.04 0.00 -4.31 0.00 0.00 34.13 27.36 1j16 s GLU 80 CO 0.01 -0.21 0.03 -0.65 0.01 0.00 0.00 175.26 174.45 1j16 s GLN 81 N -2.56 0.39 -0.22 1.61 -0.21 -0.55 -4.98 119.66 113.14 1j16 s GLN 81 Ca 0.59 0.04 -0.05 0.00 0.02 0.00 0.00 55.36 55.96 1j16 s GLN 81 Cb -0.23 -1.20 -0.02 0.00 1.00 0.00 0.00 33.01 32.56 1j16 s GLN 81 CO 0.28 -0.42 0.01 -0.06 -2.12 0.00 0.00 175.29 172.98 1j16 s PHE 82 N 2.02 3.02 -0.02 0.91 0.08 -1.26 -0.52 117.98 122.20 1j16 s PHE 82 Ca 0.03 -0.62 0.01 0.00 0.12 0.00 0.00 56.93 56.47 1j16 s PHE 82 Cb -0.14 -2.14 0.01 0.00 -0.57 0.00 0.00 43.02 40.19 1j16 s PHE 82 CO -0.06 -0.39 -0.04 0.08 -0.10 0.00 0.00 175.22 174.71 1j16 s VAL 83 N 1.36 0.39 0.43 -0.44 1.01 0.09 -4.98 120.40 118.28 1j16 s VAL 83 Ca 0.05 -0.12 -0.22 0.00 0.00 0.00 0.00 61.98 61.69 1j16 s VAL 83 Cb -0.15 -0.39 -0.09 0.00 0.00 0.00 0.00 36.38 35.75 1j16 s VAL 83 CO 0.01 0.16 1.01 0.20 0.00 0.00 0.00 175.10 176.47 1j16 s ASN 84 N 0.46 6.69 0.07 3.32 0.01 -1.26 -0.06 114.94 124.16 1j16 s ASN 84 Ca -0.05 1.89 -0.30 0.00 -0.71 0.00 0.00 52.86 53.68 1j16 s ASN 84 Cb -0.09 -2.56 -0.05 0.00 0.41 0.00 0.00 41.25 38.96 1j16 s ASN 84 CO -0.00 -0.54 1.11 0.00 -1.51 0.00 0.00 177.10 176.16 1j16 s ALA 85 N -1.91 3.31 -0.22 0.60 0.00 -0.06 -0.76 121.76 122.72 1j16 s ALA 85 Ca 0.62 0.74 -0.17 0.00 0.00 0.00 0.00 51.96 53.15 1j16 s ALA 85 Cb -0.16 -3.39 -0.18 0.00 0.00 0.00 0.00 23.12 19.39 1j16 s ALA 85 CO 0.20 -0.32 0.04 0.00 0.00 0.00 0.00 175.76 175.69 1j16 n ALA 86 N 3.60 0.95 -3.10 0.00 0.00 0.12 -4.74 120.51 117.34 1j16 n ALA 86 Ca 0.07 -0.71 -0.27 0.00 0.00 0.00 0.00 53.44 52.53 1j16 n ALA 86 Cb 0.48 -0.35 -0.16 0.00 0.00 0.00 0.00 19.45 19.41 1j16 n ALA 86 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 1j16 s LYS 87 N -2.43 2.07 -0.30 0.00 1.02 -0.96 -4.97 119.74 114.16 1j16 s LYS 87 Ca -0.31 -0.63 0.02 0.00 0.02 0.00 0.00 55.97 55.07 1j16 s LYS 87 Cb 0.09 -1.70 0.08 0.00 -0.52 0.00 0.00 37.83 35.78 1j16 s LYS 87 CO 0.58 0.18 0.00 0.42 -0.92 0.00 0.00 175.35 175.62 1j16 s ILE 88 N 0.25 1.87 -0.37 2.17 1.01 -1.26 -0.44 121.20 124.43 1j16 s ILE 88 Ca -0.10 -1.80 -0.04 0.00 0.00 0.00 0.00 60.65 58.71 1j16 s ILE 88 Cb -0.14 -2.24 0.08 0.00 0.01 0.00 0.00 42.46 40.16 1j16 s ILE 88 CO 0.04 -0.39 0.14 -0.63 0.00 0.00 0.00 174.94 174.11 1j16 s ILE 89 N 1.16 3.46 0.46 2.92 1.01 0.82 -4.98 121.20 126.06 1j16 s ILE 89 Ca 0.03 -1.61 -0.20 0.00 0.00 0.00 0.00 60.65 58.87 1j16 s ILE 89 Cb -0.19 -3.16 -0.10 0.00 0.01 0.00 0.00 42.46 39.03 1j16 s ILE 89 CO -0.10 -0.42 0.97 -0.54 0.00 0.00 0.00 174.94 174.86 1j16 s LYS 90 N 1.26 4.07 0.27 2.79 1.02 -1.26 -0.54 119.74 127.35 1j16 s LYS 90 Ca 0.02 1.12 -0.31 0.00 0.02 0.00 0.00 55.97 56.82 1j16 s LYS 90 Cb -0.22 -2.15 -0.12 0.00 -0.52 0.00 0.00 37.83 34.82 1j16 s LYS 90 CO -0.01 -0.17 1.61 1.58 -0.92 0.00 0.00 175.35 177.44 1j16 n HIS 91 N -0.96 2.79 0.16 3.18 -0.00 -0.28 -4.85 115.22 115.25 1j16 n HIS 91 Ca 0.07 0.22 0.17 0.00 -0.00 0.00 0.00 57.72 58.18 1j16 n HIS 91 Cb 0.54 -2.61 0.78 0.00 -0.00 0.00 0.00 29.99 28.70 1j16 n HIS 91 CO 0.00 0.00 0.00 -1.00 -0.00 0.00 0.00 176.34 175.34 1j16 h PRO 92 N 5.19 0.00 -0.53 1.57 0.13 -1.92 -1.74 132.00 134.70 1j16 h PRO 92 Ca -0.46 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 64.67 1j16 h PRO 92 Cb 1.22 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.35 1j16 h PRO 92 CO 0.83 0.00 0.01 0.09 -0.23 0.00 0.00 178.00 178.69 1j16 n ASN 93 N -3.99 5.44 -4.72 1.44 5.03 -1.26 -4.97 115.26 112.22 1j16 n ASN 93 Ca 0.03 -2.96 -0.42 0.00 0.87 0.00 0.00 54.58 52.10 1j16 n ASN 93 Cb 0.38 -0.67 -0.03 0.00 -1.02 0.00 0.00 39.78 38.44 1j16 n ASN 93 CO 0.00 0.00 0.00 0.12 -1.83 0.00 0.00 177.26 175.55 1j16 s PHE 94 N -2.79 2.99 -0.32 3.10 5.36 -0.66 -4.62 117.98 121.04 1j16 s PHE 94 Ca 0.53 0.60 -0.04 0.00 -0.96 0.00 0.00 56.93 57.05 1j16 s PHE 94 Cb 0.41 -3.99 0.05 0.00 -0.34 0.00 0.00 43.02 39.14 1j16 s PHE 94 CO 0.15 -3.63 0.06 0.34 -1.46 0.00 0.00 175.22 170.68 1j16 s ASP 95 N 1.02 5.10 0.61 6.13 -1.08 -0.59 -4.98 116.67 122.89 1j16 s ASP 95 Ca 0.70 -1.26 0.39 0.00 -0.52 0.00 0.00 52.55 51.86 1j16 s ASP 95 Cb -0.46 -1.79 1.92 0.00 -1.46 0.00 0.00 42.92 41.14 1j16 s ASP 95 CO 0.34 -0.31 2.19 0.08 0.52 0.00 0.00 175.17 178.00 1j16 h ARG 96 N 8.10 0.00 0.14 4.34 0.11 -1.93 0.68 114.38 125.82 1j16 h ARG 96 Ca -0.22 0.00 -0.22 0.00 0.10 0.00 0.00 59.98 59.64 1j16 h ARG 96 Cb 1.07 0.00 0.02 0.00 1.11 0.00 0.00 29.97 32.17 1j16 h ARG 96 CO 0.57 0.01 -0.95 0.93 0.10 0.00 0.00 179.97 180.63 1j16 h GLU 97 N 0.00 0.40 0.00 0.08 4.39 -1.97 -3.38 114.58 114.10 1j16 h GLU 97 Ca -0.00 -0.61 0.00 0.00 0.34 0.00 0.00 59.36 59.09 1j16 h GLU 97 Cb 0.24 0.22 0.00 0.00 -0.10 0.00 0.00 28.75 29.11 1j16 h GLU 97 CO 0.00 1.27 -1.29 0.25 -1.16 0.00 0.00 179.01 178.09 1j16 n THR 98 N -4.03 0.00 -1.40 1.13 -2.24 -1.12 -4.98 114.28 101.63 1j16 n THR 98 Ca -0.14 -0.25 -0.11 0.00 -2.27 0.00 0.00 64.05 61.28 1j16 n THR 98 Cb 0.87 0.55 -0.05 0.00 -2.10 0.00 0.00 70.33 69.61 1j16 n THR 98 CO 0.00 0.00 0.00 -1.22 -0.57 0.00 0.00 175.07 173.28 1j16 n TYR 99 N -1.74 -0.04 -2.22 4.78 4.02 0.24 -4.99 117.16 117.21 1j16 n TYR 99 Ca 0.00 0.00 -0.41 0.00 -0.01 0.00 0.00 57.90 57.48 1j16 n TYR 99 Cb 0.35 -2.17 -0.03 0.00 -0.02 0.00 0.00 39.34 37.48 1j16 n TYR 99 CO 0.00 0.00 0.00 1.21 -1.01 0.00 0.00 176.86 177.06 1j16 s ASN 100 N -2.85 6.91 -1.18 7.72 2.47 -1.22 -2.73 114.94 124.07 1j16 s ASN 100 Ca 0.00 2.56 -0.05 0.00 0.42 0.00 0.00 52.86 55.79 1j16 s ASN 100 Cb 0.00 -2.64 0.01 0.00 -1.45 0.00 0.00 41.25 37.17 1j16 s ASN 100 CO 0.00 -0.43 1.01 0.59 -3.72 0.00 0.00 177.10 174.55 1j16 n ASN 101 N 1.06 -4.49 -4.21 -4.21 4.13 -1.26 -1.54 115.26 104.74 1j16 n ASN 101 Ca 0.00 -0.52 -0.43 0.00 1.68 0.00 0.00 54.58 55.32 1j16 n ASN 101 Cb 0.43 -4.64 0.00 0.00 -1.54 0.00 0.00 39.78 34.02 1j16 n ASN 101 CO 0.00 0.00 0.00 -0.67 0.28 0.00 0.00 177.26 176.87 1j16 n ASP 102 N -2.72 4.58 -3.82 6.41 2.03 -1.11 -4.23 116.55 117.70 1j16 n ASP 102 Ca -0.09 -2.91 -0.12 0.00 0.52 0.00 0.00 54.79 52.19 1j16 n ASP 102 Cb 0.59 -1.68 -0.11 0.00 -0.72 0.00 0.00 41.12 39.20 1j16 n ASP 102 CO 0.00 0.00 0.00 -0.51 -1.92 0.00 0.00 177.20 174.77 1j16 s ILE 103 N 3.36 0.04 -0.03 5.18 2.07 -1.26 -3.93 121.20 126.62 1j16 s ILE 103 Ca 0.49 -0.34 -0.13 0.00 -1.41 0.00 0.00 60.65 59.26 1j16 s ILE 103 Cb 0.08 -0.40 0.02 0.00 0.13 0.00 0.00 42.46 42.28 1j16 s ILE 103 CO 0.01 -0.18 0.29 -0.32 -1.91 0.00 0.00 174.94 172.82 1j16 s MET 104 N -0.68 0.60 -0.04 3.50 -2.45 -0.05 -1.13 119.30 119.05 1j16 s MET 104 Ca -0.08 -0.12 0.05 0.00 -1.25 0.00 0.00 55.69 54.30 1j16 s MET 104 Cb -0.04 0.27 -0.02 0.00 1.25 0.00 0.00 34.83 36.28 1j16 s MET 104 CO 0.01 -0.15 -0.19 -0.51 1.05 0.00 0.00 175.02 175.22 1j16 s LEU 105 N -1.11 2.43 -0.15 4.11 1.43 0.30 -0.58 118.68 125.10 1j16 s LEU 105 Ca -0.12 -0.33 0.01 0.00 -1.03 0.00 0.00 54.13 52.67 1j16 s LEU 105 Cb -0.05 -1.46 0.02 0.00 0.03 0.00 0.00 46.19 44.72 1j16 s LEU 105 CO 0.03 0.32 -0.19 -0.63 0.23 0.00 0.00 176.35 176.12 1j16 s ILE 106 N -0.58 1.88 -0.23 -0.59 1.01 0.43 -0.13 121.20 122.99 1j16 s ILE 106 Ca 0.08 -0.84 -0.13 0.00 0.00 0.00 0.00 60.65 59.76 1j16 s ILE 106 Cb -0.11 -1.70 -0.04 0.00 0.01 0.00 0.00 42.46 40.62 1j16 s ILE 106 CO 0.01 0.51 0.29 -0.75 0.00 0.00 0.00 174.94 175.00 1j16 s LYS 107 N 1.19 4.11 0.51 2.79 2.20 0.42 -1.07 119.74 129.88 1j16 s LYS 107 Ca 0.01 -0.03 -0.20 0.00 -0.36 0.00 0.00 55.97 55.39 1j16 s LYS 107 Cb -0.14 -3.55 -0.07 0.00 -1.51 0.00 0.00 37.83 32.56 1j16 s LYS 107 CO -0.08 -0.02 1.08 -0.51 -0.36 0.00 0.00 175.35 175.46 1j16 s LEU 108 N 1.28 3.82 0.62 5.43 1.43 0.44 0.15 118.68 131.84 1j16 s LEU 108 Ca 0.13 2.05 0.40 0.00 -1.03 0.00 0.00 54.13 55.68 1j16 s LEU 108 Cb -0.14 -4.55 2.02 0.00 0.03 0.00 0.00 46.19 43.54 1j16 s LEU 108 CO 0.07 -0.97 2.23 0.77 0.23 0.00 0.00 176.35 178.68 1j16 h SER 109 N 1.44 0.00 -5.01 2.29 4.64 -1.24 -3.41 113.55 112.26 1j16 h SER 109 Ca -0.50 0.00 -0.07 0.00 -0.47 0.00 0.00 61.79 60.75 1j16 h SER 109 Cb 1.24 0.00 -0.18 0.00 -0.31 0.00 0.00 62.40 63.15 1j16 h SER 109 CO 0.58 0.01 0.01 -0.94 -0.87 0.00 0.00 176.83 175.62 1j16 s SER 110 N -5.44 -0.44 0.48 4.97 1.04 -1.26 -5.01 113.70 108.03 1j16 s SER 110 Ca -0.03 0.31 -0.22 0.00 0.48 0.00 0.00 55.95 56.49 1j16 s SER 110 Cb 0.12 0.47 -0.07 0.00 0.10 0.00 0.00 66.02 66.63 1j16 s SER 110 CO 0.47 -0.63 1.16 -2.16 0.98 0.00 0.00 173.24 173.06 1j16 s PRO 111 N -1.84 3.68 0.56 4.02 0.04 -1.26 -4.83 135.00 135.37 1j16 s PRO 111 Ca -0.09 1.75 -0.04 0.00 0.04 0.00 0.00 61.00 62.66 1j16 s PRO 111 Cb -0.01 -2.33 0.01 0.00 0.04 0.00 0.00 34.50 32.20 1j16 s PRO 111 CO 0.03 -0.62 0.85 0.14 0.04 0.00 0.00 177.00 177.45 1j16 s VAL 112 N -1.58 3.65 -0.38 -0.36 -7.23 0.40 -5.00 120.40 109.90 1j16 s VAL 112 Ca 0.65 -0.13 -0.22 0.00 -1.81 0.00 0.00 61.98 60.48 1j16 s VAL 112 Cb -0.28 -3.43 0.01 0.00 0.56 0.00 0.00 36.38 33.24 1j16 s VAL 112 CO 0.33 -0.41 0.70 -0.54 -0.31 0.00 0.00 175.10 174.88 1j16 s LYS 113 N -4.90 3.60 0.09 4.82 1.02 -1.26 -4.92 119.74 118.19 1j16 s LYS 113 Ca 0.53 0.05 -0.30 0.00 0.02 0.00 0.00 55.97 56.27 1j16 s LYS 113 Cb -0.10 -3.85 -0.05 0.00 -0.52 0.00 0.00 37.83 33.30 1j16 s LYS 113 CO 0.43 -0.87 1.02 -0.51 -0.92 0.00 0.00 175.35 174.51 1j16 s LEU 114 N 2.94 4.45 0.00 3.17 1.43 -1.26 -4.81 118.68 124.60 1j16 s LEU 114 Ca 0.27 1.84 -0.01 0.00 -1.03 0.00 0.00 54.13 55.20 1j16 s LEU 114 Cb -0.14 -3.59 0.00 0.00 0.03 0.00 0.00 46.19 42.50 1j16 s LEU 114 CO 0.17 -0.20 0.08 -0.46 0.23 0.00 0.00 176.35 176.18 1j16 n ASN 115 N 3.15 -0.23 -0.19 2.29 2.04 0.07 -4.98 115.26 117.40 1j16 n ASN 115 Ca 0.04 -1.23 0.06 0.00 -0.44 0.00 0.00 54.58 53.01 1j16 n ASN 115 Cb 0.49 0.40 0.34 0.00 -2.53 0.00 0.00 39.78 38.49 1j16 n ASN 115 CO 0.00 0.00 0.00 0.00 -0.44 0.00 0.00 177.26 176.82 1j16 h ALA 116 N 1.71 1.69 0.00 -2.53 0.00 -1.99 -2.55 119.26 115.59 1j16 h ALA 116 Ca -0.04 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.85 1j16 h ALA 116 Cb 0.16 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 17.75 1j16 h ALA 116 CO 0.05 0.20 -0.67 0.54 0.00 0.00 0.00 179.25 179.37 1j16 n ARG 117 N -4.48 0.05 -3.72 0.00 1.74 -1.26 -4.67 116.66 104.33 1j16 n ARG 117 Ca 0.11 0.00 -0.30 0.00 -0.77 0.00 0.00 57.85 56.90 1j16 n ARG 117 Cb 0.22 -1.52 -0.15 0.00 -1.02 0.00 0.00 32.46 29.99 1j16 n ARG 117 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 1j16 s VAL 118 N -3.04 0.80 0.09 1.55 1.01 -0.96 -4.28 120.40 115.58 1j16 s VAL 118 Ca 0.09 -1.35 -0.00 0.00 0.00 0.00 0.00 61.98 60.72 1j16 s VAL 118 Cb 0.17 -1.61 -0.04 0.00 0.00 0.00 0.00 36.38 34.89 1j16 s VAL 118 CO 0.75 -0.68 -0.00 0.00 0.00 0.00 0.00 175.10 175.16 1j16 s ALA 119 N 1.66 0.75 0.36 5.51 0.00 -0.79 -0.75 121.76 128.50 1j16 s ALA 119 Ca 0.10 -1.34 -0.06 0.00 0.00 0.00 0.00 51.96 50.65 1j16 s ALA 119 Cb -0.17 0.47 -0.05 0.00 0.00 0.00 0.00 23.12 23.36 1j16 s ALA 119 CO -0.26 -0.39 0.66 0.95 0.00 0.00 0.00 175.76 176.72 1j16 s THR 120 N -3.90 4.93 -0.00 0.00 -4.23 -1.26 -2.94 115.64 108.23 1j16 s THR 120 Ca 0.14 0.23 0.07 0.00 -1.18 0.00 0.00 61.69 60.95 1j16 s THR 120 Cb 0.07 -3.76 -0.03 0.00 1.34 0.00 0.00 72.50 70.12 1j16 s THR 120 CO -0.05 -0.49 -0.22 0.54 -0.54 0.00 0.00 174.62 173.87 1j16 s VAL 121 N -2.30 2.45 0.52 2.29 0.11 -0.28 -4.86 120.40 118.32 1j16 s VAL 121 Ca 0.47 -1.08 -0.19 0.00 -2.93 0.00 0.00 61.98 58.25 1j16 s VAL 121 Cb -0.10 -1.93 -0.07 0.00 -1.53 0.00 0.00 36.38 32.75 1j16 s VAL 121 CO 0.33 0.50 1.05 0.00 -3.33 0.00 0.00 175.10 173.65 1j16 s ALA 122 N -0.73 2.83 0.54 1.54 0.00 -1.24 -4.54 121.76 120.16 1j16 s ALA 122 Ca 0.12 0.55 -0.11 0.00 0.00 0.00 0.00 51.96 52.51 1j16 s ALA 122 Cb -0.10 -3.25 -0.05 0.00 0.00 0.00 0.00 23.12 19.72 1j16 s ALA 122 CO 0.01 -0.47 0.95 -0.51 0.00 0.00 0.00 175.76 175.74 1j16 s LEU 123 N -3.78 3.47 0.40 0.00 1.43 -1.26 -0.79 118.68 118.14 1j16 s LEU 123 Ca 0.66 1.34 -0.26 0.00 -1.03 0.00 0.00 54.13 54.84 1j16 s LEU 123 Cb -0.16 -4.32 -0.09 0.00 0.03 0.00 0.00 46.19 41.64 1j16 s LEU 123 CO 0.25 -0.69 1.26 -2.16 0.23 0.00 0.00 176.35 175.24 1j16 s PRO 124 N -4.66 4.02 0.14 1.29 0.04 -1.25 -4.68 135.00 129.89 1j16 s PRO 124 Ca 0.54 2.07 0.23 0.00 0.04 0.00 0.00 61.00 63.88 1j16 s PRO 124 Cb -0.11 -2.76 0.13 0.00 0.04 0.00 0.00 34.50 31.80 1j16 s PRO 124 CO 0.44 -0.42 1.13 0.43 0.04 0.00 0.00 177.00 178.61 1j16 n SER 125 N 0.16 0.73 -3.76 6.66 7.64 -1.26 -4.96 113.62 118.84 1j16 n SER 125 Ca 0.04 0.14 -0.04 0.00 1.01 0.00 0.00 58.87 60.02 1j16 n SER 125 Cb 0.44 0.44 -0.01 0.00 -1.01 0.00 0.00 64.21 64.07 1j16 n SER 125 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 1j16 s SER 127 N -4.66 -0.18 -0.27 6.43 1.04 -1.26 -5.12 113.70 109.68 1j16 s SER 127 Ca 0.03 -0.44 -0.27 0.00 0.48 0.00 0.00 55.95 55.74 1j16 s SER 127 Cb 0.12 0.52 0.01 0.00 0.10 0.00 0.00 66.02 66.77 1j16 s SER 127 CO 0.77 -0.96 0.96 0.00 0.98 0.00 0.00 173.24 174.99 1j16 s ALA 129 N 3.22 2.96 0.63 0.00 0.00 -1.26 -5.02 121.76 122.30 1j16 s ALA 129 Ca 0.40 1.15 -0.11 0.00 0.00 0.00 0.00 51.96 53.40 1j16 s ALA 129 Cb -0.14 -3.47 -0.03 0.00 0.00 0.00 0.00 23.12 19.47 1j16 s ALA 129 CO 0.10 -0.97 1.04 -1.25 0.00 0.00 0.00 175.76 174.68 1j16 s PRO 130 N -2.70 3.48 0.43 0.00 0.04 -1.26 -5.00 135.00 129.99 1j16 s PRO 130 Ca 0.66 0.72 -0.26 0.00 0.04 0.00 0.00 61.00 62.16 1j16 s PRO 130 Cb -0.35 -2.07 -0.09 0.00 0.04 0.00 0.00 34.50 32.03 1j16 s PRO 130 CO 0.42 -0.65 1.41 0.00 0.04 0.00 0.00 177.00 178.22 1j16 n ALA 132 N -2.80 1.92 0.00 8.56 0.00 -1.26 -2.24 120.51 124.70 1j16 n ALA 132 Ca 0.06 0.27 0.00 0.00 0.00 0.00 0.00 53.44 53.77 1j16 n ALA 132 Cb 0.54 -2.37 0.00 0.00 0.00 0.00 0.00 19.45 17.63 1j16 n ALA 132 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1j16 n GLY 133 N 0.61 0.88 3.74 0.00 0.00 0.34 -4.98 105.19 105.78 1j16 n GLY 133 Ca 0.05 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.65 1j16 n GLY 133 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1j16 s THR 134 N -2.24 2.94 0.02 2.61 2.01 -0.95 -4.77 115.64 115.26 1j16 s THR 134 Ca 0.00 0.78 -0.22 0.00 0.31 0.00 0.00 61.69 62.56 1j16 s THR 134 Cb 0.00 -3.50 -0.05 0.00 0.01 0.00 0.00 72.50 68.96 1j16 s THR 134 CO 0.00 0.12 0.65 -1.10 -0.69 0.00 0.00 174.62 173.60 1j16 s GLN 135 N -0.21 4.38 0.30 4.92 -1.52 -1.26 -1.28 119.66 124.98 1j16 s GLN 135 Ca 0.58 0.85 0.03 0.00 -1.95 0.00 0.00 55.36 54.87 1j16 s GLN 135 Cb -0.39 -3.34 -0.04 0.00 -0.22 0.00 0.00 33.01 29.02 1j16 s GLN 135 CO 0.40 0.35 0.15 0.00 -0.25 0.00 0.00 175.29 175.95 1j16 s LEU 137 N -3.36 1.97 -0.06 0.00 2.96 0.39 -1.21 118.68 119.37 1j16 s LEU 137 Ca 0.36 -0.57 0.00 0.00 -0.22 0.00 0.00 54.13 53.70 1j16 s LEU 137 Cb 0.05 -1.35 -0.03 0.00 0.50 0.00 0.00 46.19 45.36 1j16 s LEU 137 CO 0.17 0.02 -0.05 -0.63 -1.32 0.00 0.00 176.35 174.54 1j16 s ILE 138 N 1.13 3.87 0.09 6.68 1.01 0.08 -1.44 121.20 132.62 1j16 s ILE 138 Ca -0.01 -0.46 -0.09 0.00 0.00 0.00 0.00 60.65 60.09 1j16 s ILE 138 Cb -0.14 -2.61 -0.00 0.00 0.01 0.00 0.00 42.46 39.72 1j16 s ILE 138 CO -0.07 0.57 0.20 -0.94 0.00 0.00 0.00 174.94 174.69 1j16 s SER 139 N -0.94 0.11 0.00 3.58 1.04 -1.18 -0.59 113.70 115.73 1j16 s SER 139 Ca 0.14 -0.65 0.00 0.00 0.48 0.00 0.00 55.95 55.92 1j16 s SER 139 Cb -0.11 0.34 0.00 0.00 0.10 0.00 0.00 66.02 66.35 1j16 s SER 139 CO 0.03 -0.73 0.00 0.61 0.98 0.00 0.00 173.24 174.12 1j16 n GLY 140 N -0.07 0.71 1.37 7.32 0.00 -0.56 -4.38 105.19 109.59 1j16 n GLY 140 Ca -0.15 -1.14 -0.03 0.00 0.00 0.00 0.00 46.02 44.70 1j16 n GLY 140 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 1j16 n TRP 141 N -0.84 1.55 -1.42 1.61 8.01 -1.26 -1.87 117.44 123.21 1j16 n TRP 141 Ca 0.00 -1.32 -0.28 0.00 -1.31 0.00 0.00 57.50 54.59 1j16 n TRP 141 Cb 0.00 -0.53 0.22 0.00 -2.01 0.00 0.00 31.31 28.99 1j16 n TRP 141 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 1j16 n GLY 142 N -0.73 -2.17 3.63 6.99 0.00 -1.25 -4.35 105.19 107.32 1j16 n GLY 142 Ca 0.34 -1.59 -0.46 0.00 0.00 0.00 0.00 46.02 44.31 1j16 n GLY 142 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1j16 n ASN 143 N -4.34 2.21 -1.01 1.61 5.15 0.58 -2.77 115.26 116.69 1j16 n ASN 143 Ca 0.15 1.14 0.12 0.00 -0.60 0.00 0.00 54.58 55.39 1j16 n ASN 143 Cb 0.56 -1.35 0.14 0.00 -0.53 0.00 0.00 39.78 38.60 1j16 n ASN 143 CO 0.00 0.00 0.00 0.35 1.40 0.00 0.00 177.26 179.01 1j16 n THR 144 N 1.76 0.22 -4.39 -0.44 -2.24 -0.57 -0.83 114.28 107.78 1j16 n THR 144 Ca 0.13 -0.61 -0.32 0.00 -2.27 0.00 0.00 64.05 60.98 1j16 n THR 144 Cb 0.29 1.27 -0.10 0.00 -2.10 0.00 0.00 70.33 69.68 1j16 n THR 144 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 1j16 s LEU 145 N -1.72 3.25 0.06 3.22 1.43 -1.26 -4.24 118.68 119.42 1j16 s LEU 145 Ca 0.32 -0.13 0.27 0.00 -1.03 0.00 0.00 54.13 53.55 1j16 s LEU 145 Cb 0.20 -1.88 0.86 0.00 0.03 0.00 0.00 46.19 45.41 1j16 s LEU 145 CO 0.30 0.27 1.70 -1.54 0.23 0.00 0.00 176.35 177.30 1j16 n SER 146 N 1.42 0.37 -3.72 2.29 3.41 -1.26 -4.70 113.62 111.43 1j16 n SER 146 Ca -0.15 0.28 -0.13 0.00 -0.26 0.00 0.00 58.87 58.62 1j16 n SER 146 Cb 0.52 -0.29 -0.13 0.00 -0.26 0.00 0.00 64.21 64.05 1j16 n SER 146 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 1j16 s SER 147 N -3.46 -0.08 0.00 4.04 0.15 -1.26 -4.60 113.70 108.49 1j16 s SER 147 Ca 0.12 0.49 0.00 0.00 0.70 0.00 0.00 55.95 57.25 1j16 s SER 147 Cb 0.17 0.41 0.00 0.00 -1.71 0.00 0.00 66.02 64.88 1j16 s SER 147 CO 0.61 -0.18 0.00 0.61 1.20 0.00 0.00 173.24 175.48 1j16 n GLY 148 N 4.47 -1.87 2.85 9.45 0.00 -1.26 -4.96 105.19 113.86 1j16 n GLY 148 Ca -0.21 -1.57 -0.15 0.00 0.00 0.00 0.00 46.02 44.08 1j16 n GLY 148 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1j16 s VAL 149 N 0.00 0.11 -0.12 1.61 1.01 -1.26 -4.68 120.40 117.07 1j16 s VAL 149 Ca 0.00 0.04 -0.04 0.00 0.00 0.00 0.00 61.98 61.98 1j16 s VAL 149 Cb 0.00 -0.16 0.06 0.00 0.00 0.00 0.00 36.38 36.27 1j16 s VAL 149 CO 0.00 0.08 0.15 0.21 0.00 0.00 0.00 175.10 175.54 1j16 s ASN 150 N 0.53 1.25 -0.30 3.32 2.47 -1.26 -4.99 114.94 115.96 1j16 s ASN 150 Ca -0.05 -0.00 -0.16 0.00 0.42 0.00 0.00 52.86 53.07 1j16 s ASN 150 Cb -0.07 0.14 -0.03 0.00 -1.45 0.00 0.00 41.25 39.84 1j16 s ASN 150 CO -0.01 -0.28 0.40 -1.61 -3.72 0.00 0.00 177.10 171.88 1j16 s GLU 151 N 2.25 3.86 0.43 0.43 2.02 -1.26 -1.51 118.70 124.92 1j16 s GLU 151 Ca 0.04 -0.07 -0.22 0.00 0.02 0.00 0.00 54.97 54.74 1j16 s GLU 151 Cb -0.14 -3.71 -0.09 0.00 0.10 0.00 0.00 34.13 30.29 1j16 s GLU 151 CO -0.07 -0.39 1.02 -1.25 0.02 0.00 0.00 175.26 174.58 1j16 s PRO 152 N 2.12 4.09 0.03 0.39 0.04 -1.26 -4.98 135.00 135.43 1j16 s PRO 152 Ca 0.15 1.37 -0.17 0.00 0.04 0.00 0.00 61.00 62.39 1j16 s PRO 152 Cb -0.16 -2.34 -0.28 0.00 0.04 0.00 0.00 34.50 31.76 1j16 s PRO 152 CO 0.11 -0.18 1.08 -0.44 0.04 0.00 0.00 177.00 177.61 1j16 h ASP 153 N 2.13 0.77 -3.00 6.66 3.32 -1.94 -3.46 116.42 120.88 1j16 h ASP 153 Ca -0.49 -0.82 -0.61 0.00 0.02 0.00 0.00 57.03 55.13 1j16 h ASP 153 Cb 1.21 -0.24 -0.05 0.00 0.22 0.00 0.00 39.33 40.47 1j16 h ASP 153 CO 0.61 1.50 -0.27 -0.76 -1.72 0.00 0.00 179.24 178.60 1j16 s LEU 154 N -7.99 4.40 0.17 1.55 1.43 -1.26 -1.07 118.68 115.90 1j16 s LEU 154 Ca -0.11 0.79 -0.33 0.00 -1.03 0.00 0.00 54.13 53.45 1j16 s LEU 154 Cb 0.05 -2.72 -0.13 0.00 0.03 0.00 0.00 46.19 43.42 1j16 s LEU 154 CO 0.90 0.26 1.65 -0.11 0.23 0.00 0.00 176.35 179.28 1j16 n LEU 155 N 1.35 3.47 -4.85 1.79 7.94 -0.96 -4.89 117.00 120.85 1j16 n LEU 155 Ca -0.12 1.07 -0.33 0.00 -1.11 0.00 0.00 56.01 55.52 1j16 n LEU 155 Cb 0.53 -1.48 -0.06 0.00 0.53 0.00 0.00 43.42 42.94 1j16 n LEU 155 CO 0.39 -0.09 -0.20 -1.10 -1.11 0.00 0.00 177.39 175.28 1j16 s GLN 156 N 1.23 3.27 0.13 1.96 -1.52 -0.78 -1.14 119.66 122.81 1j16 s GLN 156 Ca 0.78 -0.42 0.09 0.00 -1.95 0.00 0.00 55.36 53.86 1j16 s GLN 156 Cb -0.61 -2.98 -0.04 0.00 -0.22 0.00 0.00 33.01 29.16 1j16 s GLN 156 CO 0.36 0.65 -0.20 0.00 -0.25 0.00 0.00 175.29 175.85 1j16 s LEU 158 N -2.28 -0.21 -0.23 0.00 2.96 0.24 -0.47 118.68 118.70 1j16 s LEU 158 Ca 0.11 0.76 -0.22 0.00 -0.22 0.00 0.00 54.13 54.56 1j16 s LEU 158 Cb -0.08 1.04 -0.02 0.00 0.50 0.00 0.00 46.19 47.64 1j16 s LEU 158 CO 0.06 -0.21 0.71 -1.81 -1.32 0.00 0.00 176.35 173.78 1j16 s ASP 159 N 2.01 6.72 -0.02 3.68 1.01 -1.26 -0.74 116.67 128.06 1j16 s ASP 159 Ca -0.04 0.89 -0.15 0.00 0.71 0.00 0.00 52.55 53.96 1j16 s ASP 159 Cb -0.11 -2.38 0.02 0.00 1.01 0.00 0.00 42.92 41.46 1j16 s ASP 159 CO -0.11 -0.40 0.32 0.00 0.21 0.00 0.00 175.17 175.19 1j16 s ALA 160 N 2.44 -0.81 0.15 5.23 0.00 -0.35 -4.97 121.76 123.45 1j16 s ALA 160 Ca 0.31 0.39 0.01 0.00 0.00 0.00 0.00 51.96 52.66 1j16 s ALA 160 Cb -0.16 0.03 -0.04 0.00 0.00 0.00 0.00 23.12 22.96 1j16 s ALA 160 CO 0.09 -0.26 0.30 -1.25 0.00 0.00 0.00 175.76 174.65 1j16 s PRO 161 N -1.22 3.47 0.27 0.00 0.04 -1.26 -0.13 135.00 136.17 1j16 s PRO 161 Ca -0.13 -0.49 -0.29 0.00 0.04 0.00 0.00 61.00 60.13 1j16 s PRO 161 Cb -0.05 -2.94 -0.09 0.00 0.04 0.00 0.00 34.50 31.46 1j16 s PRO 161 CO 0.04 0.50 1.19 -0.51 0.04 0.00 0.00 177.00 178.26 1j16 s LEU 162 N -3.13 4.49 0.16 -3.56 1.43 -0.40 -1.61 118.68 116.06 1j16 s LEU 162 Ca 0.36 2.39 0.06 0.00 -1.03 0.00 0.00 54.13 55.91 1j16 s LEU 162 Cb -0.11 -3.63 -0.04 0.00 0.03 0.00 0.00 46.19 42.44 1j16 s LEU 162 CO 0.28 -0.32 0.04 -0.76 0.23 0.00 0.00 176.35 175.82 1j16 s LEU 163 N -1.19 3.46 0.33 1.79 1.43 0.19 -0.50 118.68 124.20 1j16 s LEU 163 Ca 0.48 -0.30 -0.28 0.00 -1.03 0.00 0.00 54.13 53.01 1j16 s LEU 163 Cb -0.35 -2.11 -0.09 0.00 0.03 0.00 0.00 46.19 43.67 1j16 s LEU 163 CO 0.43 0.10 1.17 -2.84 0.23 0.00 0.00 176.35 175.43 1j16 s PRO 164 N -2.90 4.37 0.18 1.29 0.02 -1.26 -4.44 135.00 132.27 1j16 s PRO 164 Ca 0.28 1.89 -0.13 0.00 0.02 0.00 0.00 61.00 63.07 1j16 s PRO 164 Cb -0.10 -2.97 0.18 0.00 0.02 0.00 0.00 34.50 31.63 1j16 s PRO 164 CO 0.20 -0.06 1.74 0.37 -0.33 0.00 0.00 177.00 178.92 1j16 h GLN 165 N 3.28 0.31 -0.88 5.54 4.15 -1.98 -1.56 115.11 123.97 1j16 h GLN 165 Ca -0.48 -0.02 0.07 0.00 0.77 0.00 0.00 58.65 59.00 1j16 h GLN 165 Cb 1.22 -0.07 -0.07 0.00 0.21 0.00 0.00 27.48 28.78 1j16 h GLN 165 CO 0.65 0.20 0.54 0.00 -1.93 0.00 0.00 178.83 178.29 1j16 h ALA 166 N 1.35 1.23 -0.31 3.38 0.00 -1.99 -1.58 119.26 121.34 1j16 h ALA 166 Ca 0.24 0.00 -0.03 0.00 0.00 0.00 0.00 54.91 55.12 1j16 h ALA 166 Cb 0.28 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.85 1j16 h ALA 166 CO -0.27 0.25 0.06 -0.44 0.00 0.00 0.00 179.25 178.85 1j16 h ASP 167 N 0.95 0.48 -0.32 0.00 5.19 -1.75 -2.14 116.42 118.82 1j16 h ASP 167 Ca 0.40 -0.24 0.04 0.00 -0.62 0.00 0.00 57.03 56.60 1j16 h ASP 167 Cb 0.24 -0.13 -0.04 0.00 0.18 0.00 0.00 39.33 39.59 1j16 h ASP 167 CO -0.20 0.60 0.10 0.00 -3.12 0.00 0.00 179.24 176.62 1j16 n GLU 169 N -5.04 0.26 -0.31 0.00 1.02 -0.65 -3.98 120.64 111.95 1j16 n GLU 169 Ca 0.00 0.19 0.09 0.00 -0.02 0.00 0.00 57.16 57.42 1j16 n GLU 169 Cb 0.12 -1.78 0.20 0.00 -0.02 0.00 0.00 31.44 29.96 1j16 n GLU 169 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1j16 h ALA 170 N 2.53 0.90 0.00 0.62 0.00 -1.25 -3.08 119.26 118.97 1j16 h ALA 170 Ca 0.00 0.31 0.00 0.00 0.00 0.00 0.00 54.91 55.22 1j16 h ALA 170 Cb 0.74 0.55 0.00 0.00 0.00 0.00 0.00 17.79 19.08 1j16 h ALA 170 CO 0.00 -0.47 -0.23 0.43 0.00 0.00 0.00 179.25 178.98 1j16 n SER 171 N -5.46 0.63 -4.91 0.00 7.64 -1.26 -5.09 113.62 105.18 1j16 n SER 171 Ca 0.18 -1.95 -0.28 0.00 1.01 0.00 0.00 58.87 57.82 1j16 n SER 171 Cb 0.58 -0.17 0.06 0.00 -1.01 0.00 0.00 64.21 63.67 1j16 n SER 171 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 1j16 s SER 172 N -1.10 4.99 -0.51 6.43 1.04 -1.15 -4.83 113.70 118.56 1j16 s SER 172 Ca 0.06 0.78 0.02 0.00 0.48 0.00 0.00 55.95 57.28 1j16 s SER 172 Cb 0.05 -1.46 0.51 0.00 0.10 0.00 0.00 66.02 65.22 1j16 s SER 172 CO 0.01 -1.55 1.81 -1.54 0.98 0.00 0.00 173.24 172.94 1j16 n SER 173 N -3.02 5.76 -3.74 7.02 3.41 -1.26 -4.96 113.62 116.81 1j16 n SER 173 Ca 0.07 -3.75 -0.05 0.00 -0.26 0.00 0.00 58.87 54.88 1j16 n SER 173 Cb 0.59 -0.80 -0.01 0.00 -0.26 0.00 0.00 64.21 63.73 1j16 n SER 173 CO 0.00 0.00 0.00 0.72 -0.16 0.00 0.00 175.04 175.60 1j16 s PHE 174 N -3.61 -0.13 0.13 7.33 -0.12 -1.26 -5.05 117.98 115.27 1j16 s PHE 174 Ca 0.58 -0.25 0.02 0.00 -0.05 0.00 0.00 56.93 57.23 1j16 s PHE 174 Cb 0.47 0.68 -0.04 0.00 -0.63 0.00 0.00 43.02 43.50 1j16 s PHE 174 CO 0.02 -1.03 -0.05 0.96 -0.05 0.00 0.00 175.22 175.08 1j16 s ILE 175 N -3.44 0.74 0.25 -4.49 -4.36 -1.26 -4.72 121.20 103.92 1j16 s ILE 175 Ca 0.12 -1.97 0.09 0.00 -0.26 0.00 0.00 60.65 58.64 1j16 s ILE 175 Cb -0.03 -1.86 -0.05 0.00 1.25 0.00 0.00 42.46 41.76 1j16 s ILE 175 CO 0.05 -0.71 -0.14 0.27 0.24 0.00 0.00 174.94 174.64 1j16 s ILE 176 N -3.60 1.98 0.65 8.37 -4.36 -1.26 -5.15 121.20 117.83 1j16 s ILE 176 Ca 0.17 -2.25 0.03 0.00 -0.26 0.00 0.00 60.65 58.33 1j16 s ILE 176 Cb 0.05 -2.25 0.10 0.00 1.25 0.00 0.00 42.46 41.62 1j16 s ILE 176 CO -0.01 -0.45 0.90 0.42 0.24 0.00 0.00 174.94 176.04 1j16 s THR 177 N -2.81 2.21 -1.03 8.37 -4.23 -1.26 -4.99 115.64 111.90 1j16 s THR 177 Ca 0.27 -0.74 0.15 0.00 -1.18 0.00 0.00 61.69 60.18 1j16 s THR 177 Cb -0.01 -2.47 0.13 0.00 1.34 0.00 0.00 72.50 71.49 1j16 s THR 177 CO 0.11 0.00 1.47 -0.67 -0.54 0.00 0.00 174.62 174.99 1j16 n ASP 178 N -2.58 0.00 -1.48 3.99 4.64 -1.26 -1.81 116.55 118.06 1j16 n ASP 178 Ca 0.14 0.47 0.09 0.00 -1.38 0.00 0.00 54.79 54.11 1j16 n ASP 178 Cb 0.61 -0.48 0.33 0.00 -1.04 0.00 0.00 41.12 40.53 1j16 n ASP 178 CO 0.00 0.00 0.00 0.59 -0.82 0.00 0.00 177.20 176.97 1j16 n ASN 179 N -1.48 4.36 -4.20 1.67 3.02 -1.26 -4.90 115.26 112.47 1j16 n ASN 179 Ca 0.04 -2.38 -0.16 0.00 -0.03 0.00 0.00 54.58 52.05 1j16 n ASN 179 Cb 0.17 -0.55 -0.11 0.00 -0.61 0.00 0.00 39.78 38.68 1j16 n ASN 179 CO 0.00 0.00 0.00 -0.04 -2.62 0.00 0.00 177.26 174.60 1j16 s MET 180 N -1.78 0.90 -0.05 3.52 -1.94 -0.75 -0.77 119.30 118.43 1j16 s MET 180 Ca 0.47 -1.17 -0.04 0.00 -1.71 0.00 0.00 55.69 53.24 1j16 s MET 180 Cb 0.30 -0.68 0.01 0.00 2.01 0.00 0.00 34.83 36.47 1j16 s MET 180 CO 0.23 0.12 0.12 0.54 -0.01 0.00 0.00 175.02 176.03 1j16 s VAL 181 N -2.24 -0.00 0.09 -6.03 0.11 0.22 -4.74 120.40 107.81 1j16 s VAL 181 Ca 0.06 0.02 -0.21 0.00 -2.93 0.00 0.00 61.98 58.92 1j16 s VAL 181 Cb -0.04 -0.18 -0.07 0.00 -1.53 0.00 0.00 36.38 34.56 1j16 s VAL 181 CO 0.01 0.01 0.61 0.00 -3.33 0.00 0.00 175.10 172.40 1j16 s VAL 183 N -1.10 0.13 -1.28 0.00 1.01 -0.94 -0.63 120.40 117.58 1j16 s VAL 183 Ca 0.30 -0.01 0.00 0.00 0.00 0.00 0.00 61.98 62.28 1j16 s VAL 183 Cb -0.20 -0.15 0.00 0.00 0.00 0.00 0.00 36.38 36.02 1j16 s VAL 183 CO 0.20 0.07 0.00 0.61 0.00 0.00 0.00 175.10 175.98 1j16 n GLY 184 N 3.42 0.45 2.93 4.51 0.00 -0.63 -3.05 105.19 112.81 1j16 n GLY 184 Ca -0.18 -1.51 -0.23 0.00 0.00 0.00 0.00 46.02 44.10 1j16 n GLY 184 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1j16 s PHE 184 N -3.09 1.11 0.42 1.61 0.08 -1.26 -4.36 117.98 112.50 1j16 s PHE 184 Ca 0.00 -0.41 0.31 0.00 0.12 0.00 0.00 56.93 56.94 1j16 s PHE 184 Cb 0.00 -0.92 1.60 0.00 -0.57 0.00 0.00 43.02 43.13 1j16 s PHE 184 CO 0.00 -0.30 2.12 -0.07 -0.10 0.00 0.00 175.22 176.87 1j16 h LEU 185 N 7.43 0.00 -0.05 -0.37 3.38 -1.95 -1.79 115.31 121.96 1j16 h LEU 185 Ca -0.32 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.65 1j16 h LEU 185 Cb 1.16 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.91 1j16 h LEU 185 CO 0.44 0.08 -0.07 -1.84 0.09 0.00 0.00 178.44 177.14 1j16 n GLU 186 N -3.50 0.28 0.00 1.13 0.00 -1.26 0.49 120.64 117.78 1j16 n GLU 186 Ca -0.02 -0.05 0.00 0.00 0.00 0.00 0.00 57.16 57.10 1j16 n GLU 186 Cb 0.21 -1.50 0.00 0.00 0.00 0.00 0.00 31.44 30.15 1j16 n GLU 186 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 1j16 n GLY 187 N 1.38 -1.79 2.38 -1.84 0.00 -0.67 -4.17 105.19 100.49 1j16 n GLY 187 Ca 0.11 -1.36 0.00 0.00 0.00 0.00 0.00 46.02 44.77 1j16 n GLY 187 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1j16 n GLY 188 N 0.00 1.97 2.98 -0.02 0.00 0.83 -4.90 105.19 106.06 1j16 n GLY 188 Ca 0.00 -0.31 -0.26 0.00 0.00 0.00 0.00 46.02 45.46 1j16 n GLY 188 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1j16 s LYS 188 N 0.00 1.67 0.00 1.61 1.02 -1.26 -3.73 119.74 119.06 1j16 s LYS 188 Ca 0.00 -0.36 -0.30 0.00 0.02 0.00 0.00 55.97 55.33 1j16 s LYS 188 Cb 0.00 -1.51 0.11 0.00 -0.52 0.00 0.00 37.83 35.90 1j16 s LYS 188 CO 0.00 -0.10 1.15 0.34 -0.92 0.00 0.00 175.35 175.82 1j16 s ASP 189 N 1.10 -0.13 0.78 2.83 2.15 -0.63 -4.31 116.67 118.45 1j16 s ASP 189 Ca -0.06 -0.17 -0.09 0.00 0.43 0.00 0.00 52.55 52.66 1j16 s ASP 189 Cb -0.14 0.27 0.11 0.00 -0.30 0.00 0.00 42.92 42.85 1j16 s ASP 189 CO -0.02 -0.48 1.11 0.00 -0.17 0.00 0.00 175.17 175.61 1j16 s ALA 190 N -2.73 2.95 0.32 3.66 0.00 -1.26 -0.23 121.76 124.48 1j16 s ALA 190 Ca 0.12 -1.08 -0.11 0.00 0.00 0.00 0.00 51.96 50.90 1j16 s ALA 190 Cb 0.02 -2.60 0.04 0.00 0.00 0.00 0.00 23.12 20.58 1j16 s ALA 190 CO -0.03 -1.65 0.62 0.00 0.00 0.00 0.00 175.76 174.70 1j16 n GLN 192 N -0.44 1.63 0.00 0.00 3.00 -1.26 -1.20 117.38 119.11 1j16 n GLN 192 Ca -0.06 0.58 0.00 0.00 -0.01 0.00 0.00 57.00 57.51 1j16 n GLN 192 Cb 0.49 -2.12 0.00 0.00 0.00 0.00 0.00 30.24 28.61 1j16 n GLN 192 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 1j16 n GLY 193 N 1.79 3.35 0.11 1.08 0.00 -1.26 -0.31 105.19 109.96 1j16 n GLY 193 Ca 0.12 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.25 1j16 n GLY 193 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1j16 h ASP 194 N 0.00 0.00 -1.52 1.61 3.32 -1.46 -3.31 116.42 115.06 1j16 h ASP 194 Ca 0.00 -0.07 -0.67 0.00 0.02 0.00 0.00 57.03 56.31 1j16 h ASP 194 Cb 0.00 0.00 0.09 0.00 0.22 0.00 0.00 39.33 39.64 1j16 h ASP 194 CO 0.00 0.03 -0.09 -1.20 -1.72 0.00 0.00 179.24 176.27 1j16 n SER 195 N -2.55 0.14 0.00 6.45 7.64 -1.26 -1.23 113.62 122.82 1j16 n SER 195 Ca 0.02 1.15 0.00 0.00 1.01 0.00 0.00 58.87 61.05 1j16 n SER 195 Cb 0.51 -1.08 0.00 0.00 -1.01 0.00 0.00 64.21 62.63 1j16 n SER 195 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1j16 n GLY 196 N 1.79 2.60 3.74 0.23 0.00 0.41 -0.35 105.19 113.61 1j16 n GLY 196 Ca 0.16 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.89 1j16 n GLY 196 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1j16 s GLY 197 N -1.86 1.60 0.41 -0.02 0.00 -0.36 -3.39 107.32 103.70 1j16 s GLY 197 Ca 0.00 -0.68 -0.16 0.00 0.00 0.00 0.00 44.72 43.88 1j16 s GLY 197 CO 0.00 -0.00 0.86 2.56 0.00 0.00 0.00 173.10 176.52 1j16 s PRO 198 N -5.32 4.02 -0.31 2.90 0.04 -1.26 -1.13 135.00 133.94 1j16 s PRO 198 Ca 0.67 0.83 -0.01 0.00 0.04 0.00 0.00 61.00 62.53 1j16 s PRO 198 Cb -0.13 -2.28 0.10 0.00 0.04 0.00 0.00 34.50 32.23 1j16 s PRO 198 CO 0.55 -0.03 0.11 0.08 0.04 0.00 0.00 177.00 177.76 1j16 s VAL 199 N -2.25 0.71 -0.15 -0.36 1.01 -0.73 -3.09 120.40 115.54 1j16 s VAL 199 Ca 0.57 -1.36 -0.05 0.00 0.00 0.00 0.00 61.98 61.14 1j16 s VAL 199 Cb -0.10 -1.55 -0.03 0.00 0.00 0.00 0.00 36.38 34.70 1j16 s VAL 199 CO 0.21 -0.71 -0.00 -0.69 0.00 0.00 0.00 175.10 173.91 1j16 s VAL 200 N 1.62 4.23 -0.09 2.92 1.01 -0.52 -1.12 120.40 128.45 1j16 s VAL 200 Ca 0.10 -0.24 0.00 0.00 0.00 0.00 0.00 61.98 61.84 1j16 s VAL 200 Cb -0.18 -2.86 0.02 0.00 0.00 0.00 0.00 36.38 33.36 1j16 s VAL 200 CO -0.25 0.50 -0.07 0.00 0.00 0.00 0.00 175.10 175.28 1j16 n ASN 202 N 4.58 -1.34 -0.16 0.00 3.02 -1.26 -1.67 115.26 118.44 1j16 n ASN 202 Ca -0.16 -0.96 -0.02 0.00 -0.03 0.00 0.00 54.58 53.41 1j16 n ASN 202 Cb 0.51 -3.23 -0.01 0.00 -0.61 0.00 0.00 39.78 36.43 1j16 n ASN 202 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1j16 n GLY 203 N -1.81 0.50 3.15 7.41 0.00 -1.26 -5.01 105.19 108.16 1j16 n GLY 203 Ca -0.21 -0.19 -0.22 0.00 0.00 0.00 0.00 46.02 45.39 1j16 n GLY 203 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1j16 s GLU 204 N -1.23 1.14 -0.68 1.61 2.02 -0.67 -3.71 118.70 117.18 1j16 s GLU 204 Ca 0.00 -0.67 -0.27 0.00 0.02 0.00 0.00 54.97 54.04 1j16 s GLU 204 Cb 0.00 -1.14 0.03 0.00 0.10 0.00 0.00 34.13 33.12 1j16 s GLU 204 CO 0.00 0.30 1.27 -1.17 0.02 0.00 0.00 175.26 175.68 1j16 s LEU 209 N -0.75 3.26 0.01 1.80 2.96 0.03 -0.64 118.68 125.35 1j16 s LEU 209 Ca 0.05 -0.23 0.20 0.00 -0.22 0.00 0.00 54.13 53.92 1j16 s LEU 209 Cb -0.07 -2.77 -0.19 0.00 0.50 0.00 0.00 46.19 43.66 1j16 s LEU 209 CO 0.00 -1.73 0.62 0.00 -1.32 0.00 0.00 176.35 173.92 1j16 n GLN 210 N 9.05 0.64 -3.98 1.98 1.13 -0.28 -3.88 117.38 122.05 1j16 n GLN 210 Ca 0.05 0.04 -0.09 0.00 -1.94 0.00 0.00 57.00 55.06 1j16 n GLN 210 Cb 0.49 -1.67 -0.08 0.00 0.11 0.00 0.00 30.24 29.09 1j16 n GLN 210 CO 0.00 0.00 0.00 0.20 -1.44 0.00 0.00 177.06 175.82 1j16 s GLY 211 N -4.76 0.47 -0.07 1.08 0.00 -0.93 -1.87 107.32 101.23 1j16 s GLY 211 Ca -0.05 -0.96 0.02 0.00 0.00 0.00 0.00 44.72 43.73 1j16 s GLY 211 CO 0.84 -0.98 -0.11 -0.42 0.00 0.00 0.00 173.10 172.44 1j16 s ILE 212 N -3.95 1.08 -0.00 0.90 1.01 -1.03 -1.78 121.20 117.43 1j16 s ILE 212 Ca 0.14 -0.42 -0.34 0.00 0.00 0.00 0.00 60.65 60.04 1j16 s ILE 212 Cb 0.05 -1.01 -0.12 0.00 0.01 0.00 0.00 42.46 41.39 1j16 s ILE 212 CO -0.04 0.35 1.80 0.52 0.00 0.00 0.00 174.94 177.58 1j16 n VAL 213 N 4.08 0.43 0.05 2.92 0.31 -0.28 -0.99 118.33 124.85 1j16 n VAL 213 Ca -0.21 -0.08 0.00 0.00 -0.01 0.00 0.00 64.34 64.05 1j16 n VAL 213 Cb 0.51 -1.83 0.00 0.00 -0.91 0.00 0.00 33.84 31.61 1j16 n VAL 213 CO 0.00 0.00 0.00 -0.24 -1.32 0.00 0.00 176.83 175.27 1j16 n SER 214 N 5.78 0.90 -2.62 4.52 2.88 -1.01 -0.44 113.62 123.63 1j16 n SER 214 Ca 0.21 0.16 -0.06 0.00 -1.33 0.00 0.00 58.87 57.84 1j16 n SER 214 Cb 0.31 -0.24 0.02 0.00 -0.75 0.00 0.00 64.21 63.55 1j16 n SER 214 CO 0.00 0.00 0.00 -2.67 -1.23 0.00 0.00 175.04 171.14 1j16 n TRP 215 N -3.40 -1.96 0.00 0.66 4.27 -0.77 -4.92 117.44 111.31 1j16 n TRP 215 Ca 0.00 -1.47 0.00 0.00 -3.89 0.00 0.00 57.50 52.14 1j16 n TRP 215 Cb 0.00 0.73 0.00 0.00 -1.36 0.00 0.00 31.31 30.68 1j16 n TRP 215 CO 0.00 0.00 0.00 0.41 -2.29 0.00 0.00 177.69 175.81 1j16 n GLY 216 N -0.49 -0.35 3.38 -1.67 0.00 -1.26 -0.31 105.19 104.49 1j16 n GLY 216 Ca -0.06 -0.94 -0.40 0.00 0.00 0.00 0.00 46.02 44.61 1j16 n GLY 216 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1j16 s TYR 217 N -2.00 3.24 0.00 1.61 5.04 -1.26 -4.96 117.35 119.02 1j16 s TYR 217 Ca 0.00 -0.91 0.00 0.00 -2.44 0.00 0.00 57.07 53.72 1j16 s TYR 217 Cb 0.00 -2.43 0.00 0.00 0.35 0.00 0.00 41.96 39.88 1j16 s TYR 217 CO 0.00 -0.62 0.00 0.41 -1.34 0.00 0.00 175.55 174.00 1j16 n GLY 219 N 4.99 0.34 3.09 8.97 0.00 -1.26 -4.68 105.19 116.65 1j16 n GLY 219 Ca -0.12 -0.88 -0.12 0.00 0.00 0.00 0.00 46.02 44.90 1j16 n GLY 219 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1j16 n ALA 221 N 4.89 -0.33 -2.01 0.00 0.00 -1.26 -4.48 120.51 117.31 1j16 n ALA 221 Ca -0.14 0.20 -0.37 0.00 0.00 0.00 0.00 53.44 53.13 1j16 n ALA 221 Cb 0.51 -1.71 -0.06 0.00 0.00 0.00 0.00 19.45 18.20 1j16 n ALA 221 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1j16 s LEU 221 N -3.92 4.37 0.49 0.00 1.43 -1.26 -0.12 118.68 119.67 1j16 s LEU 221 Ca 0.00 1.54 -0.23 0.00 -1.03 0.00 0.00 54.13 54.41 1j16 s LEU 221 Cb 0.00 -3.65 -0.07 0.00 0.03 0.00 0.00 46.19 42.50 1j16 s LEU 221 CO 0.00 0.03 1.28 -2.65 0.23 0.00 0.00 176.35 175.24 1j16 n PRO 222 N 0.80 1.75 -0.88 1.29 -0.02 -1.26 -2.16 135.00 134.51 1j16 n PRO 222 Ca -0.02 0.63 0.00 0.00 -2.02 0.00 0.00 63.50 62.09 1j16 n PRO 222 Cb 0.51 -2.44 0.00 0.00 -0.02 0.00 0.00 33.50 31.54 1j16 n PRO 222 CO 0.00 0.00 0.00 -0.25 1.98 0.00 0.00 175.50 177.23 1j16 n ASP 223 N -0.37 -2.98 -3.43 2.55 8.00 0.18 -4.88 116.55 115.62 1j16 n ASP 223 Ca 0.09 0.00 -0.26 0.00 0.71 0.00 0.00 54.79 55.32 1j16 n ASP 223 Cb 0.42 -2.06 -0.09 0.00 -0.02 0.00 0.00 41.12 39.38 1j16 n ASP 223 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 1j16 n ASN 224 N -0.38 1.48 -4.72 -2.24 3.02 -0.92 -2.94 115.26 108.55 1j16 n ASN 224 Ca 0.00 -2.91 -0.32 0.00 -0.03 0.00 0.00 54.58 51.32 1j16 n ASN 224 Cb 0.19 -0.65 0.12 0.00 -0.61 0.00 0.00 39.78 38.83 1j16 n ASN 224 CO 0.00 0.00 0.00 -2.84 -2.62 0.00 0.00 177.26 171.80 1j16 s PRO 225 N -1.28 1.74 0.60 3.52 0.02 -1.26 -4.44 135.00 133.90 1j16 s PRO 225 Ca 0.34 1.48 -0.17 0.00 0.02 0.00 0.00 61.00 62.67 1j16 s PRO 225 Cb 0.09 -1.81 -0.03 0.00 0.02 0.00 0.00 34.50 32.77 1j16 s PRO 225 CO -0.12 -2.08 1.09 0.20 -0.33 0.00 0.00 177.00 175.76 1j16 s GLY 226 N -2.73 2.29 -0.12 0.52 0.00 -1.17 -4.72 107.32 101.39 1j16 s GLY 226 Ca 0.67 0.57 -0.01 0.00 0.00 0.00 0.00 44.72 45.95 1j16 s GLY 226 CO 0.53 0.91 -0.07 0.14 0.00 0.00 0.00 173.10 174.62 1j16 s VAL 227 N -2.21 3.63 0.09 1.40 1.01 0.58 -2.23 120.40 122.67 1j16 s VAL 227 Ca 0.67 -0.47 0.06 0.00 0.00 0.00 0.00 61.98 62.24 1j16 s VAL 227 Cb -0.20 -2.54 -0.03 0.00 0.00 0.00 0.00 36.38 33.61 1j16 s VAL 227 CO 0.35 0.54 -0.16 -0.31 0.00 0.00 0.00 175.10 175.51 1j16 s TYR 228 N -0.07 1.41 0.13 5.22 2.02 0.05 -1.84 117.35 124.27 1j16 s TYR 228 Ca 0.00 -0.45 -0.31 0.00 -0.37 0.00 0.00 57.07 55.94 1j16 s TYR 228 Cb -0.13 -0.78 -0.08 0.00 -0.40 0.00 0.00 41.96 40.57 1j16 s TYR 228 CO 0.03 0.11 1.30 0.99 -1.57 0.00 0.00 175.55 176.41 1j16 s THR 229 N -1.31 3.50 -0.96 -0.71 2.01 -0.16 -0.61 115.64 117.40 1j16 s THR 229 Ca 0.02 1.14 -0.22 0.00 0.31 0.00 0.00 61.69 62.93 1j16 s THR 229 Cb -0.10 -3.73 0.07 0.00 0.01 0.00 0.00 72.50 68.75 1j16 s THR 229 CO 0.03 0.12 1.34 -0.75 -0.69 0.00 0.00 174.62 174.67 1j16 s LYS 230 N 0.62 3.54 0.51 4.92 2.20 0.05 -2.46 119.74 129.12 1j16 s LYS 230 Ca 0.60 -1.18 0.24 0.00 -0.36 0.00 0.00 55.97 55.27 1j16 s LYS 230 Cb -0.34 -5.12 1.35 0.00 -1.51 0.00 0.00 37.83 32.21 1j16 s LYS 230 CO 0.33 -2.09 1.98 0.28 -0.36 0.00 0.00 175.35 175.49 1j16 h VAL 231 N 6.48 0.74 -0.01 4.02 2.07 -1.67 -2.03 116.25 125.86 1j16 h VAL 231 Ca 0.13 -0.02 0.00 0.00 0.82 0.00 0.00 66.70 67.63 1j16 h VAL 231 Cb 1.02 0.66 -0.00 0.00 -1.52 0.00 0.00 31.29 31.45 1j16 h VAL 231 CO 1.33 0.01 0.02 0.00 0.02 0.00 0.00 177.57 178.95 1j16 n ASN 233 N -3.36 0.07 -0.04 0.00 4.13 -0.76 -3.97 115.26 111.33 1j16 n ASN 233 Ca -0.03 0.06 0.01 0.00 1.68 0.00 0.00 54.58 56.30 1j16 n ASN 233 Cb 0.09 -0.32 0.02 0.00 -1.54 0.00 0.00 39.78 38.03 1j16 n ASN 233 CO 0.00 0.00 0.00 -1.22 0.28 0.00 0.00 177.26 176.32 1j16 n TYR 234 N -1.35 0.02 -0.27 3.10 4.01 0.06 -4.77 117.16 117.97 1j16 n TYR 234 Ca 0.11 -0.53 0.03 0.00 -0.16 0.00 0.00 57.90 57.35 1j16 n TYR 234 Cb 0.29 -0.06 0.16 0.00 -0.31 0.00 0.00 39.34 39.42 1j16 n TYR 234 CO 0.00 0.00 0.00 0.28 -0.46 0.00 0.00 176.86 176.68 1j16 h VAL 235 N 0.10 0.84 -0.18 -0.72 2.07 -1.68 -0.20 116.25 116.47 1j16 h VAL 235 Ca 0.00 -0.22 -0.03 0.00 0.82 0.00 0.00 66.70 67.26 1j16 h VAL 235 Cb 0.54 0.13 -0.01 0.00 -1.52 0.00 0.00 31.29 30.43 1j16 h VAL 235 CO 0.00 0.12 -0.02 0.44 0.02 0.00 0.00 177.57 178.13 1j16 h ASP 236 N 0.66 0.33 -0.45 0.57 3.32 -1.90 -1.50 116.42 117.43 1j16 h ASP 236 Ca 0.39 -0.33 0.05 0.00 0.02 0.00 0.00 57.03 57.15 1j16 h ASP 236 Cb 0.42 -0.09 -0.05 0.00 0.22 0.00 0.00 39.33 39.84 1j16 h ASP 236 CO -0.28 0.58 0.19 -0.25 -1.72 0.00 0.00 179.24 177.75 1j16 h TRP 237 N 0.06 0.34 0.13 4.55 7.01 -1.75 0.11 115.95 126.40 1j16 h TRP 237 Ca 0.05 0.02 0.01 0.00 2.11 0.00 0.00 58.89 61.08 1j16 h TRP 237 Cb 0.42 -0.09 -0.02 0.00 -2.10 0.00 0.00 29.16 27.37 1j16 h TRP 237 CO 0.04 0.15 -0.19 0.82 -2.79 0.00 0.00 178.44 176.47 1j16 h ILE 238 N 0.38 0.58 -0.39 2.65 2.04 -0.94 0.54 117.51 122.37 1j16 h ILE 238 Ca 0.20 0.00 -0.01 0.00 1.00 0.00 0.00 64.86 66.06 1j16 h ILE 238 Cb 0.17 0.58 -0.02 0.00 -0.74 0.00 0.00 36.82 36.81 1j16 h ILE 238 CO -0.18 0.00 0.21 1.56 0.00 0.00 0.00 178.15 179.74 1j16 h GLN 239 N -0.37 0.55 -0.29 2.37 4.20 -0.92 -0.65 115.11 119.99 1j16 h GLN 239 Ca 0.02 -0.07 0.00 0.00 0.06 0.00 0.00 58.65 58.66 1j16 h GLN 239 Cb 0.38 -0.11 -0.01 0.00 0.30 0.00 0.00 27.48 28.04 1j16 h GLN 239 CO -0.09 0.45 0.18 -0.44 -0.67 0.00 0.00 178.83 178.27 1j16 h ASP 240 N 0.50 0.34 -0.47 1.46 3.32 -0.64 -0.44 116.42 120.48 1j16 h ASP 240 Ca 0.14 -0.03 0.01 0.00 0.02 0.00 0.00 57.03 57.17 1j16 h ASP 240 Cb 0.07 -0.09 -0.03 0.00 0.22 0.00 0.00 39.33 39.51 1j16 h ASP 240 CO -0.02 0.27 0.30 0.74 -1.72 0.00 0.00 179.24 178.81 1j16 h THR 241 N 0.38 1.10 -0.56 0.35 2.02 -0.68 0.37 112.91 115.90 1j16 h THR 241 Ca 0.11 -0.21 -0.02 0.00 0.77 0.00 0.00 66.41 67.05 1j16 h THR 241 Cb -0.02 0.43 -0.03 0.00 -1.74 0.00 0.00 68.15 66.80 1j16 h THR 241 CO -0.02 0.11 0.26 0.40 0.37 0.00 0.00 175.52 176.64 1j16 h ILE 242 N 0.61 1.21 -0.33 3.11 2.04 -0.80 -2.46 117.51 120.89 1j16 h ILE 242 Ca 0.18 -0.59 -0.07 0.00 1.00 0.00 0.00 64.86 65.37 1j16 h ILE 242 Cb -0.05 0.56 -0.02 0.00 -0.74 0.00 0.00 36.82 36.58 1j16 h ILE 242 CO -0.05 0.24 -0.11 0.00 0.00 0.00 0.00 178.15 178.23 1j16 h ALA 243 N 1.10 1.20 0.00 1.87 0.00 -0.64 -2.78 119.26 120.01 1j16 h ALA 243 Ca 0.19 -0.27 0.00 0.00 0.00 0.00 0.00 54.91 54.83 1j16 h ALA 243 Cb 0.13 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 17.77 1j16 h ALA 243 CO -0.02 0.51 0.00 0.00 0.00 0.00 0.00 179.25 179.74 1j16 n ALA 244 N -2.48 2.13 -0.35 0.00 0.00 0.08 -5.10 120.51 114.80 1j16 n ALA 244 Ca 0.01 -0.07 0.00 0.00 0.00 0.00 0.00 53.44 53.38 1j16 n ALA 244 Cb 0.32 -1.41 0.00 0.00 0.00 0.00 0.00 19.45 18.36 1j16 n ALA 244 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59