#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1sjr n ALA 41 N 0.00 0.00 -1.60 3.17 0.00 -1.26 -5.06 120.51 115.77 1sjr n ALA 41 Ca 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 53.44 53.42 1sjr n ALA 41 Cb 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 19.43 1sjr n ALA 41 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1sjr n GLY 42 N 3.28 -0.11 3.77 0.00 0.00 -1.26 -5.14 105.19 105.73 1sjr n GLY 42 Ca 0.00 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.63 1sjr n GLY 42 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 1sjr s GLN 43 N 0.00 4.62 -0.31 1.61 0.00 -1.26 -5.05 119.66 119.28 1sjr s GLN 43 Ca 0.00 1.23 0.01 0.00 -0.00 0.00 0.00 55.36 56.60 1sjr s GLN 43 Cb 0.00 -3.21 0.14 0.00 0.00 0.00 0.00 33.01 29.95 1sjr s GLN 43 CO 0.00 0.53 0.32 -1.12 0.00 0.00 0.00 175.29 175.02 1sjr s SER 44 N -1.23 1.48 -1.07 12.60 0.01 -1.26 -5.05 113.70 119.18 1sjr s SER 44 Ca 0.39 -0.92 -0.22 0.00 1.31 0.00 0.00 55.95 56.51 1sjr s SER 44 Cb -0.23 0.56 0.05 0.00 0.21 0.00 0.00 66.02 66.61 1sjr s SER 44 CO 0.27 -0.36 1.53 -2.16 0.41 0.00 0.00 173.24 172.93 1sjr s PRO 45 N 2.17 3.63 -0.03 12.44 0.04 -1.26 -4.93 135.00 147.05 1sjr s PRO 45 Ca 0.11 -1.27 -0.01 0.00 0.04 0.00 0.00 61.00 59.88 1sjr s PRO 45 Cb -0.14 -5.39 0.03 0.00 0.04 0.00 0.00 34.50 29.04 1sjr s PRO 45 CO -0.26 -2.27 0.03 0.08 0.04 0.00 0.00 177.00 174.61 1sjr s VAL 46 N 5.03 0.05 0.23 -0.36 1.01 -1.26 0.14 120.40 125.25 1sjr s VAL 46 Ca 0.48 0.22 0.08 0.00 0.00 0.00 0.00 61.98 62.77 1sjr s VAL 46 Cb 0.01 -0.21 -0.04 0.00 0.00 0.00 0.00 36.38 36.13 1sjr s VAL 46 CO -0.06 0.15 0.03 -0.76 0.00 0.00 0.00 175.10 174.47 1sjr s LEU 47 N 1.47 3.35 -0.29 3.92 2.01 -0.45 -1.32 118.68 127.36 1sjr s LEU 47 Ca -0.04 -0.49 -0.01 0.00 0.01 0.00 0.00 54.13 53.59 1sjr s LEU 47 Cb -0.13 -1.91 0.09 0.00 0.01 0.00 0.00 46.19 44.26 1sjr s LEU 47 CO -0.03 0.02 0.09 -0.60 1.01 0.00 0.00 176.35 176.85 1sjr s ARG 48 N -3.48 0.64 0.27 1.70 3.52 0.49 -2.35 118.95 119.75 1sjr s ARG 48 Ca 0.30 -0.91 -0.23 0.00 -0.13 0.00 0.00 55.73 54.76 1sjr s ARG 48 Cb -0.08 -1.89 -0.09 0.00 -1.56 0.00 0.00 34.95 31.34 1sjr s ARG 48 CO 0.20 -0.94 0.84 0.42 -0.81 0.00 0.00 175.30 175.01 1sjr s ILE 49 N 1.71 4.39 -0.15 4.11 1.01 0.24 -2.49 121.20 130.02 1sjr s ILE 49 Ca 0.08 1.56 -0.04 0.00 0.00 0.00 0.00 60.65 62.24 1sjr s ILE 49 Cb -0.17 -3.93 0.05 0.00 0.01 0.00 0.00 42.46 38.42 1sjr s ILE 49 CO -0.25 0.17 0.08 -0.63 0.00 0.00 0.00 174.94 174.31 1sjr s ILE 50 N -1.58 -0.06 0.30 2.92 1.01 -0.69 -1.42 121.20 121.68 1sjr s ILE 50 Ca 0.47 -0.08 -0.28 0.00 0.00 0.00 0.00 60.65 60.76 1sjr s ILE 50 Cb -0.18 -0.52 -0.09 0.00 0.01 0.00 0.00 42.46 41.68 1sjr s ILE 50 CO 0.22 -0.20 1.05 -0.69 0.00 0.00 0.00 174.94 175.32 1sjr s VAL 51 N 2.13 3.70 -0.12 2.92 1.01 -1.15 0.24 120.40 129.13 1sjr s VAL 51 Ca 0.02 1.60 -0.03 0.00 0.00 0.00 0.00 61.98 63.57 1sjr s VAL 51 Cb -0.15 -3.97 0.04 0.00 0.00 0.00 0.00 36.38 32.30 1sjr s VAL 51 CO -0.08 0.29 0.04 -1.61 0.00 0.00 0.00 175.10 173.75 1sjr s GLU 52 N -1.66 0.37 -0.71 2.72 0.41 0.85 -4.81 118.70 115.88 1sjr s GLU 52 Ca 0.47 -0.03 -0.03 0.00 -0.41 0.00 0.00 54.97 54.97 1sjr s GLU 52 Cb -0.28 -1.39 0.00 0.00 -1.78 0.00 0.00 34.13 30.68 1sjr s GLU 52 CO 0.35 -0.48 0.42 0.09 -0.49 0.00 0.00 175.26 175.15 1sjr n ASN 53 N 5.18 -3.92 -4.40 -0.19 3.02 -1.26 -3.15 115.26 110.54 1sjr n ASN 53 Ca -0.07 -0.19 -0.41 0.00 -0.03 0.00 0.00 54.58 53.88 1sjr n ASN 53 Cb 0.49 -2.66 0.01 0.00 -0.61 0.00 0.00 39.78 37.01 1sjr n ASN 53 CO 0.00 0.00 0.00 -0.11 -2.62 0.00 0.00 177.26 174.53 1sjr n LEU 54 N -2.34 -0.87 -0.01 3.41 7.94 -1.26 -4.00 117.00 119.86 1sjr n LEU 54 Ca -0.03 0.83 0.01 0.00 -1.11 0.00 0.00 56.01 55.71 1sjr n LEU 54 Cb 0.55 -1.05 -0.04 0.00 0.53 0.00 0.00 43.42 43.41 1sjr n LEU 54 CO 0.27 -3.39 -0.61 0.49 -1.11 0.00 0.00 177.39 173.04 1sjr n PHE 55 N -1.10 0.00 -3.96 1.96 3.01 -1.26 -4.83 117.46 111.28 1sjr n PHE 55 Ca 0.11 0.00 -0.12 0.00 1.01 0.00 0.00 57.45 58.45 1sjr n PHE 55 Cb 0.42 -0.18 -0.13 0.00 -0.01 0.00 0.00 39.48 39.58 1sjr n PHE 55 CO 0.00 0.00 0.00 0.71 1.01 0.00 0.00 176.76 178.48 1sjr s TYR 56 N -2.28 0.19 -0.57 1.38 2.02 -1.26 -5.09 117.35 111.74 1sjr s TYR 56 Ca -0.02 -0.19 -0.27 0.00 -0.37 0.00 0.00 57.07 56.22 1sjr s TYR 56 Cb 0.03 -0.12 -0.01 0.00 -0.40 0.00 0.00 41.96 41.45 1sjr s TYR 56 CO 0.22 -0.06 1.76 -1.25 -1.57 0.00 0.00 175.55 174.66 1sjr s PRO 57 N -0.51 2.85 0.72 -1.71 0.04 -1.26 -4.98 135.00 130.14 1sjr s PRO 57 Ca -0.05 0.67 0.01 0.00 0.04 0.00 0.00 61.00 61.67 1sjr s PRO 57 Cb -0.04 -4.31 0.13 0.00 0.04 0.00 0.00 34.50 30.32 1sjr s PRO 57 CO -0.00 -2.47 0.98 0.14 0.04 0.00 0.00 177.00 175.69 1sjr s VAL 58 N 8.19 2.06 0.00 -0.36 -7.23 -1.26 -5.13 120.40 116.67 1sjr s VAL 58 Ca 0.65 -0.67 0.00 0.00 -1.81 0.00 0.00 61.98 60.15 1sjr s VAL 58 Cb -0.14 -2.39 0.00 0.00 0.56 0.00 0.00 36.38 34.42 1sjr s VAL 58 CO 0.23 0.00 0.00 0.35 -0.31 0.00 0.00 175.10 175.37 1sjr n THR 59 N -2.78 0.00 -0.03 5.32 -2.24 -1.26 -5.08 114.28 108.21 1sjr n THR 59 Ca 0.16 0.00 -0.16 0.00 -2.27 0.00 0.00 64.05 61.78 1sjr n THR 59 Cb 0.61 0.00 -0.13 0.00 -2.10 0.00 0.00 70.33 68.70 1sjr n THR 59 CO 0.00 0.00 0.00 -0.07 -0.57 0.00 0.00 175.07 174.43 1sjr h LEU 60 N 0.00 0.16 -1.52 3.22 4.07 -1.98 -3.11 115.31 116.15 1sjr h LEU 60 Ca 0.00 -0.96 0.48 0.00 0.08 0.00 0.00 57.88 57.48 1sjr h LEU 60 Cb 0.00 -0.05 -0.12 0.00 1.08 0.00 0.00 40.66 41.56 1sjr h LEU 60 CO 0.00 1.17 0.97 0.44 -1.08 0.00 0.00 178.44 179.94 1sjr h ASP 61 N -0.78 0.17 0.02 -0.43 3.32 -1.98 0.27 116.42 117.02 1sjr h ASP 61 Ca -0.07 0.12 -0.00 0.00 0.02 0.00 0.00 57.03 57.10 1sjr h ASP 61 Cb 1.24 0.12 0.00 0.00 0.22 0.00 0.00 39.33 40.91 1sjr h ASP 61 CO 0.04 -0.18 -0.01 0.58 -1.72 0.00 0.00 179.24 177.95 1sjr h VAL 62 N 0.03 1.05 -1.02 -1.35 2.07 -1.99 -3.11 116.25 111.94 1sjr h VAL 62 Ca 0.87 -1.72 0.28 0.00 0.82 0.00 0.00 66.70 66.94 1sjr h VAL 62 Cb 2.91 1.95 -0.06 0.00 -1.52 0.00 0.00 31.29 34.57 1sjr h VAL 62 CO -0.36 0.35 0.70 -0.07 0.02 0.00 0.00 177.57 178.21 1sjr h LEU 63 N -0.98 0.19 0.26 2.57 3.38 -0.53 0.32 115.31 120.52 1sjr h LEU 63 Ca -0.00 0.03 -0.01 0.00 0.09 0.00 0.00 57.88 57.99 1sjr h LEU 63 Cb 0.59 -0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.34 1sjr h LEU 63 CO 0.00 0.05 -0.13 -0.74 0.09 0.00 0.00 178.44 177.72 1sjr h HIS 64 N 0.17 -0.33 0.00 1.13 2.76 -0.90 -2.93 115.15 115.05 1sjr h HIS 64 Ca 0.52 -0.01 0.00 0.00 -2.20 0.00 0.00 60.37 58.68 1sjr h HIS 64 Cb 1.73 0.11 0.00 0.00 1.55 0.00 0.00 27.41 30.79 1sjr h HIS 64 CO -0.00 -0.20 0.01 1.04 -1.30 0.00 0.00 177.93 177.48 1sjr n GLN 65 N -3.45 0.13 0.08 5.26 6.02 -0.88 0.61 117.38 125.15 1sjr n GLN 65 Ca -0.04 0.63 -0.03 0.00 -0.01 0.00 0.00 57.00 57.54 1sjr n GLN 65 Cb 0.14 -1.95 -0.02 0.00 1.02 0.00 0.00 30.24 29.44 1sjr n GLN 65 CO 0.00 0.00 0.00 0.82 -1.01 0.00 0.00 177.06 176.87 1sjr h ILE 66 N 0.00 0.00 0.00 5.09 1.08 -0.31 -3.36 117.51 120.00 1sjr h ILE 66 Ca 0.00 -0.16 -0.17 0.00 -0.39 0.00 0.00 64.86 64.14 1sjr h ILE 66 Cb 0.02 0.00 -0.03 0.00 -3.07 0.00 0.00 36.82 33.75 1sjr h ILE 66 CO 0.00 0.00 -1.00 -0.26 -0.69 0.00 0.00 178.15 176.20 1sjr h PHE 67 N -0.37 0.00 -0.95 1.37 -1.00 -1.36 -3.32 116.94 111.31 1sjr h PHE 67 Ca -0.02 0.00 0.27 0.00 2.81 0.00 0.00 57.97 61.03 1sjr h PHE 67 Cb 0.16 0.00 -0.04 0.00 3.61 0.00 0.00 35.95 39.69 1sjr h PHE 67 CO 0.08 0.69 1.01 1.03 -1.61 0.00 0.00 178.31 179.51 1sjr h SER 68 N 0.00 0.00 -0.08 2.17 0.87 0.10 0.73 113.55 117.34 1sjr h SER 68 Ca -0.08 0.00 -0.10 0.00 -1.23 0.00 0.00 61.79 60.38 1sjr h SER 68 Cb 1.60 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.56 1sjr h SER 68 CO 0.08 0.00 -0.34 0.50 -0.53 0.00 0.00 176.83 176.53 1sjr h LYS 69 N 0.00 0.37 0.00 2.24 3.64 -1.71 -2.97 116.57 118.14 1sjr h LYS 69 Ca 0.45 -0.29 0.00 0.00 -1.27 0.00 0.00 60.65 59.54 1sjr h LYS 69 Cb 2.47 0.06 0.00 0.00 -0.41 0.00 0.00 32.23 34.35 1sjr h LYS 69 CO -0.00 0.93 0.00 1.19 -2.27 0.00 0.00 179.45 179.29 1sjr n PHE 70 N -4.40 0.00 0.00 1.91 3.72 0.25 -4.88 117.46 114.05 1sjr n PHE 70 Ca -0.08 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.32 1sjr n PHE 70 Cb 0.51 -0.32 0.00 0.00 -0.94 0.00 0.00 39.48 38.73 1sjr n PHE 70 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1sjr n GLY 71 N 0.25 1.64 3.68 1.37 0.00 -0.77 -4.69 105.19 106.67 1sjr n GLY 71 Ca 0.08 -0.98 -0.43 0.00 0.00 0.00 0.00 46.02 44.70 1sjr n GLY 71 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1sjr s THR 72 N -2.00 4.18 -0.50 2.61 2.01 -1.26 -3.63 115.64 117.06 1sjr s THR 72 Ca 0.00 1.48 -0.20 0.00 0.31 0.00 0.00 61.69 63.29 1sjr s THR 72 Cb 0.00 -3.96 0.05 0.00 0.01 0.00 0.00 72.50 68.60 1sjr s THR 72 CO 0.00 -0.05 0.65 -0.69 -0.69 0.00 0.00 174.62 173.84 1sjr s VAL 73 N 2.77 4.82 0.09 3.82 1.01 -1.26 -2.81 120.40 128.85 1sjr s VAL 73 Ca 0.57 -0.33 -0.22 0.00 0.00 0.00 0.00 61.98 62.00 1sjr s VAL 73 Cb -0.25 -4.30 -0.12 0.00 0.00 0.00 0.00 36.38 31.71 1sjr s VAL 73 CO 0.20 -0.80 1.71 -0.07 0.00 0.00 0.00 175.10 176.14 1sjr h LEU 74 N 9.82 0.09 -8.32 3.92 3.38 -1.44 -3.42 115.31 119.34 1sjr h LEU 74 Ca -0.27 -0.05 -0.10 0.00 0.09 0.00 0.00 57.88 57.55 1sjr h LEU 74 Cb 1.09 -0.02 -0.10 0.00 0.09 0.00 0.00 40.66 41.72 1sjr h LEU 74 CO 0.96 0.12 -0.22 -0.54 0.09 0.00 0.00 178.44 178.86 1sjr s LYS 75 N -5.98 1.50 -0.14 1.13 3.01 -1.25 -1.54 119.74 116.47 1sjr s LYS 75 Ca -0.13 -1.35 -0.12 0.00 -1.01 0.00 0.00 55.97 53.36 1sjr s LYS 75 Cb 0.06 0.43 0.04 0.00 -1.01 0.00 0.00 37.83 37.36 1sjr s LYS 75 CO 0.68 -0.60 0.38 0.42 0.51 0.00 0.00 175.35 176.73 1sjr s ILE 76 N -4.00 -0.00 -0.06 2.17 1.01 -0.31 -2.83 121.20 117.17 1sjr s ILE 76 Ca 0.26 0.02 -0.03 0.00 0.00 0.00 0.00 60.65 60.90 1sjr s ILE 76 Cb 0.01 -0.54 0.04 0.00 0.01 0.00 0.00 42.46 41.98 1sjr s ILE 76 CO 0.10 0.01 0.12 -0.63 0.00 0.00 0.00 174.94 174.54 1sjr s ILE 77 N 0.37 -0.16 0.19 2.92 1.01 -0.10 -0.83 121.20 124.60 1sjr s ILE 77 Ca -0.01 0.32 0.10 0.00 0.00 0.00 0.00 60.65 61.05 1sjr s ILE 77 Cb -0.04 -0.23 -0.04 0.00 0.01 0.00 0.00 42.46 42.16 1sjr s ILE 77 CO -0.01 0.13 -0.19 0.42 0.00 0.00 0.00 174.94 175.28 1sjr s THR 78 N 1.89 2.04 0.18 2.92 -4.23 0.10 -0.39 115.64 118.14 1sjr s THR 78 Ca -0.01 -2.05 -0.23 0.00 -1.18 0.00 0.00 61.69 58.22 1sjr s THR 78 Cb -0.12 -2.00 0.07 0.00 1.34 0.00 0.00 72.50 71.79 1sjr s THR 78 CO -0.05 -0.31 1.03 0.72 -0.54 0.00 0.00 174.62 175.46 1sjr s PHE 79 N -2.13 0.03 -0.20 3.99 -0.71 -0.50 -4.55 117.98 113.91 1sjr s PHE 79 Ca 0.20 -0.40 -0.04 0.00 -1.04 0.00 0.00 56.93 55.64 1sjr s PHE 79 Cb -0.06 0.69 0.08 0.00 -1.21 0.00 0.00 43.02 42.52 1sjr s PHE 79 CO 0.09 -0.89 0.16 0.99 -1.34 0.00 0.00 175.22 174.22 1sjr s THR 80 N -2.41 -0.20 -1.00 -4.49 2.01 -1.25 -0.08 115.64 108.21 1sjr s THR 80 Ca 0.20 -0.20 -0.15 0.00 0.31 0.00 0.00 61.69 61.85 1sjr s THR 80 Cb -0.02 -0.66 0.18 0.00 0.01 0.00 0.00 72.50 72.01 1sjr s THR 80 CO 0.04 -0.29 1.12 -0.75 -0.69 0.00 0.00 174.62 174.05 1sjr s LYS 81 N 2.23 3.80 -1.03 4.92 2.36 -1.20 -4.42 119.74 126.40 1sjr s LYS 81 Ca 0.05 -2.32 -0.02 0.00 -2.55 0.00 0.00 55.97 51.13 1sjr s LYS 81 Cb -0.16 -4.79 0.00 0.00 -1.05 0.00 0.00 37.83 31.83 1sjr s LYS 81 CO -0.13 -1.59 0.87 0.09 1.55 0.00 0.00 175.35 176.13 1sjr n ASN 82 N 5.23 -2.92 -0.24 1.43 4.13 -1.26 -3.46 115.26 118.16 1sjr n ASN 82 Ca 0.25 -0.50 0.00 0.00 1.68 0.00 0.00 54.58 56.01 1sjr n ASN 82 Cb 0.46 -4.32 0.00 0.00 -1.54 0.00 0.00 39.78 34.38 1sjr n ASN 82 CO 0.00 0.00 0.00 -3.20 0.28 0.00 0.00 177.26 174.34 1sjr n ASN 83 N -2.64 -1.16 -3.23 6.41 5.15 -1.26 -5.03 115.26 113.50 1sjr n ASN 83 Ca -0.18 0.00 -0.26 0.00 -0.60 0.00 0.00 54.58 53.54 1sjr n ASN 83 Cb 0.62 -0.35 -0.06 0.00 -0.53 0.00 0.00 39.78 39.46 1sjr n ASN 83 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1sjr n GLN 84 N -0.55 2.37 -1.63 1.20 6.02 -1.23 -5.05 117.38 118.51 1sjr n GLN 84 Ca 0.00 -4.43 -0.37 0.00 -0.01 0.00 0.00 57.00 52.18 1sjr n GLN 84 Cb 0.35 -2.07 -0.03 0.00 1.02 0.00 0.00 30.24 29.51 1sjr n GLN 84 CO 0.00 0.00 0.00 -0.59 -1.01 0.00 0.00 177.06 175.46 1sjr s PHE 85 N -2.59 1.16 0.21 1.08 -0.12 -1.25 -3.24 117.98 113.24 1sjr s PHE 85 Ca 0.42 1.33 0.10 0.00 -0.05 0.00 0.00 56.93 58.73 1sjr s PHE 85 Cb 0.21 -3.69 -0.04 0.00 -0.63 0.00 0.00 43.02 38.86 1sjr s PHE 85 CO -0.07 -2.72 -0.12 -0.65 -0.05 0.00 0.00 175.22 171.62 1sjr s GLN 86 N 7.83 1.95 -0.11 1.99 -0.21 0.88 -2.93 119.66 129.06 1sjr s GLN 86 Ca 0.94 -1.40 -0.04 0.00 0.02 0.00 0.00 55.36 54.89 1sjr s GLN 86 Cb -0.19 -2.06 0.06 0.00 1.00 0.00 0.00 33.01 31.82 1sjr s GLN 86 CO 0.27 0.41 0.18 0.00 -2.12 0.00 0.00 175.29 174.02 1sjr s ALA 87 N -1.89 -0.19 0.23 6.09 0.00 -0.51 -1.41 121.76 124.09 1sjr s ALA 87 Ca 0.26 0.50 0.09 0.00 0.00 0.00 0.00 51.96 52.80 1sjr s ALA 87 Cb -0.08 -0.94 -0.04 0.00 0.00 0.00 0.00 23.12 22.06 1sjr s ALA 87 CO 0.15 -0.72 0.01 -0.51 0.00 0.00 0.00 175.76 174.69 1sjr s LEU 88 N 2.31 3.28 -0.13 0.00 1.43 0.48 0.79 118.68 126.84 1sjr s LEU 88 Ca 0.04 -0.52 -0.29 0.00 -1.03 0.00 0.00 54.13 52.32 1sjr s LEU 88 Cb -0.13 -1.86 0.08 0.00 0.03 0.00 0.00 46.19 44.32 1sjr s LEU 88 CO -0.07 0.03 0.76 -1.48 0.23 0.00 0.00 176.35 175.82 1sjr s LEU 89 N -3.41 -0.62 -0.16 1.79 0.05 -0.99 -0.92 118.68 114.43 1sjr s LEU 89 Ca 0.30 0.83 -0.06 0.00 0.05 0.00 0.00 54.13 55.25 1sjr s LEU 89 Cb -0.08 2.38 -0.04 0.00 -2.05 0.00 0.00 46.19 46.41 1sjr s LEU 89 CO 0.20 -0.46 0.03 -1.58 -0.55 0.00 0.00 176.35 173.99 1sjr s GLN 90 N -0.76 3.73 0.56 1.48 0.74 -1.13 -1.34 119.66 122.94 1sjr s GLN 90 Ca -0.06 -0.38 0.02 0.00 0.05 0.00 0.00 55.36 54.99 1sjr s GLN 90 Cb -0.01 -3.08 0.04 0.00 1.10 0.00 0.00 33.01 31.06 1sjr s GLN 90 CO 0.06 0.36 0.78 0.71 -0.55 0.00 0.00 175.29 176.65 1sjr s TYR 91 N 0.10 2.64 -0.11 1.67 2.02 0.37 -1.18 117.35 122.86 1sjr s TYR 91 Ca 0.04 -0.12 -0.16 0.00 -0.37 0.00 0.00 57.07 56.46 1sjr s TYR 91 Cb -0.13 -2.72 -0.27 0.00 -0.40 0.00 0.00 41.96 38.44 1sjr s TYR 91 CO 0.01 -0.94 0.55 0.00 -1.57 0.00 0.00 175.55 173.60 1sjr h ALA 92 N 0.06 0.18 -4.13 3.71 0.00 -1.78 -3.42 119.26 113.87 1sjr h ALA 92 Ca -0.41 -1.09 -0.50 0.00 0.00 0.00 0.00 54.91 52.92 1sjr h ALA 92 Cb 1.29 0.48 -0.30 0.00 0.00 0.00 0.00 17.79 19.26 1sjr h ALA 92 CO 0.49 0.82 -0.82 -0.51 0.00 0.00 0.00 179.25 179.24 1sjr s ASP 93 N -7.02 1.75 0.34 0.00 1.11 -1.26 -4.88 116.67 106.71 1sjr s ASP 93 Ca -0.20 -0.27 0.05 0.00 0.18 0.00 0.00 52.55 52.31 1sjr s ASP 93 Cb 0.04 -0.27 0.70 0.00 1.07 0.00 0.00 42.92 44.46 1sjr s ASP 93 CO 0.76 0.17 1.90 -0.65 1.18 0.00 0.00 175.17 178.53 1sjr h PRO 94 N 5.92 0.80 -0.84 8.23 0.11 -1.91 -1.37 132.00 142.93 1sjr h PRO 94 Ca -0.34 -0.05 0.08 0.00 0.11 0.00 0.00 66.00 65.80 1sjr h PRO 94 Cb 1.16 -0.18 -0.06 0.00 0.11 0.00 0.00 31.00 32.04 1sjr h PRO 94 CO 0.49 0.53 0.55 0.28 -0.21 0.00 0.00 178.00 179.63 1sjr h VAL 95 N 0.82 1.01 0.00 3.15 2.07 -2.00 0.33 116.25 121.64 1sjr h VAL 95 Ca 0.40 -0.30 -0.03 0.00 0.82 0.00 0.00 66.70 67.58 1sjr h VAL 95 Cb 0.43 0.05 -0.00 0.00 -1.52 0.00 0.00 31.29 30.25 1sjr h VAL 95 CO -0.16 0.16 -0.15 0.28 0.02 0.00 0.00 177.57 177.72 1sjr h SER 96 N 0.88 0.00 0.34 0.57 0.02 -1.54 -3.10 113.55 110.72 1sjr h SER 96 Ca 0.37 0.00 -0.33 0.00 -0.84 0.00 0.00 61.79 61.00 1sjr h SER 96 Cb 0.31 0.00 0.01 0.00 0.14 0.00 0.00 62.40 62.86 1sjr h SER 96 CO -0.14 0.15 -1.58 0.00 -1.14 0.00 0.00 176.83 174.12 1sjr h ALA 97 N 1.85 0.12 0.71 3.77 0.00 -0.50 -2.95 119.26 122.26 1sjr h ALA 97 Ca -0.00 -1.05 -0.03 0.00 0.00 0.00 0.00 54.91 53.83 1sjr h ALA 97 Cb 0.98 0.30 0.01 0.00 0.00 0.00 0.00 17.79 19.07 1sjr h ALA 97 CO 0.02 0.99 -0.34 1.96 0.00 0.00 0.00 179.25 181.87 1sjr h GLN 98 N 0.10 -0.92 0.02 0.00 1.08 -0.50 -1.17 115.11 113.72 1sjr h GLN 98 Ca -0.27 0.06 0.01 0.00 -1.45 0.00 0.00 58.65 57.00 1sjr h GLN 98 Cb 2.08 0.21 -0.01 0.00 -0.05 0.00 0.00 27.48 29.71 1sjr h GLN 98 CO 0.20 -0.59 -0.04 0.45 -0.95 0.00 0.00 178.83 177.90 1sjr h HIS 99 N -1.05 -0.10 -0.83 2.96 3.86 -1.71 -2.21 115.15 116.06 1sjr h HIS 99 Ca -0.10 0.00 0.17 0.00 -1.16 0.00 0.00 60.37 59.29 1sjr h HIS 99 Cb 0.75 0.04 -0.06 0.00 1.06 0.00 0.00 27.41 29.21 1sjr h HIS 99 CO -0.01 -0.07 0.55 0.00 0.86 0.00 0.00 177.93 179.27 1sjr h ALA 100 N 0.90 2.13 0.22 2.45 0.00 -1.53 0.47 119.26 123.89 1sjr h ALA 100 Ca 0.01 0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.92 1sjr h ALA 100 Cb 0.09 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 17.83 1sjr h ALA 100 CO -0.03 -0.37 -0.10 -0.22 0.00 0.00 0.00 179.25 178.53 1sjr h LYS 101 N 0.44 -0.28 0.00 0.00 3.64 -0.57 -1.88 116.57 117.91 1sjr h LYS 101 Ca 0.42 0.02 -0.11 0.00 -1.27 0.00 0.00 60.65 59.71 1sjr h LYS 101 Cb 0.97 0.06 -0.02 0.00 -0.41 0.00 0.00 32.23 32.84 1sjr h LYS 101 CO -0.15 -0.18 -0.50 -0.07 -2.27 0.00 0.00 179.45 176.27 1sjr h LEU 102 N -0.29 0.00 -1.54 5.20 3.38 -1.16 0.23 115.31 121.13 1sjr h LEU 102 Ca -0.03 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 57.89 1sjr h LEU 102 Cb 0.22 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.97 1sjr h LEU 102 CO 0.05 0.50 -0.23 -1.28 0.09 0.00 0.00 178.44 177.57 1sjr h SER 103 N 0.00 0.00 0.00 -0.43 0.87 0.15 -3.04 113.55 111.10 1sjr h SER 103 Ca -0.01 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.55 1sjr h SER 103 Cb 1.22 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.18 1sjr h SER 103 CO 0.07 0.23 -0.04 0.18 -0.53 0.00 0.00 176.83 176.73 1sjr n LEU 104 N -3.82 1.46 -4.61 2.23 4.77 -0.73 -4.94 117.00 111.36 1sjr n LEU 104 Ca -0.02 -1.68 -0.43 0.00 -0.03 0.00 0.00 56.01 53.85 1sjr n LEU 104 Cb 0.33 -0.08 -0.02 0.00 -2.33 0.00 0.00 43.42 41.31 1sjr n LEU 104 CO 0.34 0.41 1.33 -0.62 -1.33 0.00 0.00 177.39 177.52 1sjr s ASP 105 N -1.13 6.31 -0.68 -1.43 -1.08 0.80 -2.61 116.67 116.84 1sjr s ASP 105 Ca 0.06 1.27 0.00 0.00 -0.52 0.00 0.00 52.55 53.36 1sjr s ASP 105 Cb 0.05 -2.53 0.00 0.00 -1.46 0.00 0.00 42.92 38.98 1sjr s ASP 105 CO 0.01 -1.38 0.00 0.61 0.52 0.00 0.00 175.17 174.93 1sjr n GLY 106 N 4.89 0.47 4.01 2.66 0.00 -1.20 -4.97 105.19 111.05 1sjr n GLY 106 Ca 0.18 -0.65 -0.21 0.00 0.00 0.00 0.00 46.02 45.34 1sjr n GLY 106 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1sjr s GLN 107 N -3.54 2.26 0.27 1.61 -1.52 -1.07 -4.89 119.66 112.77 1sjr s GLN 107 Ca 0.00 -1.76 0.09 0.00 -1.95 0.00 0.00 55.36 51.75 1sjr s GLN 107 Cb 0.00 -2.52 -0.04 0.00 -0.22 0.00 0.00 33.01 30.23 1sjr s GLN 107 CO 0.00 -0.86 0.00 -0.80 -0.25 0.00 0.00 175.29 173.39 1sjr s ASN 108 N -4.61 4.56 0.02 5.90 0.01 -1.26 -2.42 114.94 117.14 1sjr s ASN 108 Ca 0.56 -0.65 0.18 0.00 -0.71 0.00 0.00 52.86 52.24 1sjr s ASN 108 Cb -0.05 -0.85 -0.17 0.00 0.41 0.00 0.00 41.25 40.60 1sjr s ASN 108 CO 0.35 -0.01 0.69 -0.38 -1.51 0.00 0.00 177.10 176.25 1sjr n ILE 109 N -0.91 1.08 0.00 0.60 5.41 -1.20 -4.80 119.36 119.53 1sjr n ILE 109 Ca -0.06 -0.69 0.00 0.00 1.00 0.00 0.00 62.75 63.00 1sjr n ILE 109 Cb 0.59 -0.62 0.00 0.00 -0.71 0.00 0.00 39.64 38.90 1sjr n ILE 109 CO 0.00 0.00 0.00 -1.22 0.00 0.00 0.00 176.55 175.33 1sjr n TYR 110 N -2.80 0.00 -3.15 1.39 4.02 -1.26 -5.11 117.16 110.25 1sjr n TYR 110 Ca -0.12 0.00 0.05 0.00 -0.01 0.00 0.00 57.90 57.82 1sjr n TYR 110 Cb 0.85 0.02 -0.02 0.00 -0.02 0.00 0.00 39.34 40.17 1sjr n TYR 110 CO 0.00 0.00 0.00 1.21 -1.01 0.00 0.00 176.86 177.06 1sjr s ASN 111 N -4.42 -0.43 -1.20 7.72 2.47 -1.26 -4.95 114.94 112.86 1sjr s ASN 111 Ca 0.00 0.27 -0.07 0.00 0.42 0.00 0.00 52.86 53.48 1sjr s ASN 111 Cb 0.00 1.36 0.06 0.00 -1.45 0.00 0.00 41.25 41.22 1sjr s ASN 111 CO 0.00 -0.08 0.39 0.00 -3.72 0.00 0.00 177.10 173.69 1sjr n ALA 112 N 5.48 -1.01 -3.19 1.71 0.00 -1.26 -4.91 120.51 117.32 1sjr n ALA 112 Ca -0.07 0.08 -0.11 0.00 0.00 0.00 0.00 53.44 53.34 1sjr n ALA 112 Cb 0.54 -2.48 -0.03 0.00 0.00 0.00 0.00 19.45 17.47 1sjr n ALA 112 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1sjr n THR 115 N -3.02 0.00 -3.98 0.00 -1.04 -1.19 -4.32 114.28 100.74 1sjr n THR 115 Ca -0.10 0.00 -0.26 0.00 -2.04 0.00 0.00 64.05 61.65 1sjr n THR 115 Cb 0.38 -0.40 -0.04 0.00 -1.82 0.00 0.00 70.33 68.46 1sjr n THR 115 CO 0.00 0.00 0.00 -1.48 -0.64 0.00 0.00 175.07 172.95 1sjr s LEU 116 N 6.05 4.19 -0.28 -4.42 2.34 -1.02 -0.10 118.68 125.44 1sjr s LEU 116 Ca 1.02 0.09 0.02 0.00 0.06 0.00 0.00 54.13 55.33 1sjr s LEU 116 Cb -1.09 -2.78 0.06 0.00 -0.56 0.00 0.00 46.19 41.83 1sjr s LEU 116 CO 0.45 0.06 -0.07 -0.13 -1.06 0.00 0.00 176.35 175.60 1sjr s ARG 117 N -3.16 2.16 -0.08 1.48 1.81 0.14 -3.21 118.95 118.09 1sjr s ARG 117 Ca 0.34 -1.41 -0.17 0.00 -1.72 0.00 0.00 55.73 52.76 1sjr s ARG 117 Cb -0.11 -2.98 -0.05 0.00 -0.45 0.00 0.00 34.95 31.37 1sjr s ARG 117 CO 0.27 -0.63 0.46 0.42 -0.68 0.00 0.00 175.30 175.14 1sjr s ILE 118 N 1.09 5.13 -0.04 1.52 1.01 -1.26 -1.71 121.20 126.94 1sjr s ILE 118 Ca -0.06 0.92 -0.31 0.00 0.00 0.00 0.00 60.65 61.21 1sjr s ILE 118 Cb -0.20 -3.79 0.07 0.00 0.01 0.00 0.00 42.46 38.55 1sjr s ILE 118 CO -0.05 0.40 0.68 -1.81 0.00 0.00 0.00 174.94 174.16 1sjr s ASP 119 N 0.13 -0.65 0.31 3.58 1.11 -1.04 -4.87 116.67 115.24 1sjr s ASP 119 Ca 0.25 0.69 -0.29 0.00 0.18 0.00 0.00 52.55 53.38 1sjr s ASP 119 Cb -0.16 0.54 -0.12 0.00 1.07 0.00 0.00 42.92 44.25 1sjr s ASP 119 CO 0.11 -0.62 1.51 0.49 1.18 0.00 0.00 175.17 177.84 1sjr n PHE 120 N 0.86 2.73 -0.75 4.23 3.01 -1.26 0.18 117.46 126.46 1sjr n PHE 120 Ca -0.19 0.36 -0.33 0.00 1.01 0.00 0.00 57.45 58.30 1sjr n PHE 120 Cb 0.57 -2.54 0.14 0.00 -0.01 0.00 0.00 39.48 37.64 1sjr n PHE 120 CO 0.00 0.00 0.00 0.45 1.01 0.00 0.00 176.76 178.22 1sjr n SER 121 N 1.56 -2.52 0.10 4.37 2.88 -0.43 -4.70 113.62 114.87 1sjr n SER 121 Ca 0.07 0.04 -0.24 0.00 -1.33 0.00 0.00 58.87 57.41 1sjr n SER 121 Cb 0.36 -0.99 -0.15 0.00 -0.75 0.00 0.00 64.21 62.68 1sjr n SER 121 CO 0.00 0.00 0.00 0.50 -1.23 0.00 0.00 175.04 174.31 1sjr h LYS 122 N -1.78 0.44 -0.26 -1.46 1.63 -1.92 -3.30 116.57 109.93 1sjr h LYS 122 Ca -0.49 -0.75 0.00 0.00 -0.85 0.00 0.00 60.65 58.56 1sjr h LYS 122 Cb 1.34 0.28 0.00 0.00 -0.60 0.00 0.00 32.23 33.25 1sjr h LYS 122 CO 0.35 1.36 0.00 1.28 -3.45 0.00 0.00 179.45 178.99 1sjr n LEU 123 N -3.69 1.95 -1.65 5.20 4.77 -1.26 -4.89 117.00 117.43 1sjr n LEU 123 Ca -0.21 -0.87 -0.10 0.00 -0.03 0.00 0.00 56.01 54.79 1sjr n LEU 123 Cb 1.06 -0.17 -0.03 0.00 -2.33 0.00 0.00 43.42 41.95 1sjr n LEU 123 CO 0.54 0.44 -0.11 0.35 -1.33 0.00 0.00 177.39 177.28 1sjr n THR 124 N 0.52 -0.15 -4.01 -5.08 -2.24 -1.25 -4.89 114.28 97.19 1sjr n THR 124 Ca 0.15 0.00 -0.10 0.00 -2.27 0.00 0.00 64.05 61.83 1sjr n THR 124 Cb 0.35 -1.13 -0.11 0.00 -2.10 0.00 0.00 70.33 67.34 1sjr n THR 124 CO 0.00 0.00 0.00 -0.44 -0.57 0.00 0.00 175.07 174.06 1sjr s SER 125 N -1.92 0.44 -0.29 3.42 0.01 -1.26 -4.73 113.70 109.37 1sjr s SER 125 Ca 0.00 -0.51 -0.01 0.00 1.31 0.00 0.00 55.95 56.74 1sjr s SER 125 Cb 0.00 0.08 0.18 0.00 0.21 0.00 0.00 66.02 66.48 1sjr s SER 125 CO 0.00 -0.26 0.54 -0.22 0.41 0.00 0.00 173.24 173.71 1sjr s LEU 126 N -1.48 -1.23 -0.09 2.44 0.20 -1.26 -4.93 118.68 112.33 1sjr s LEU 126 Ca -0.14 0.63 0.01 0.00 0.69 0.00 0.00 54.13 55.32 1sjr s LEU 126 Cb -0.10 1.89 0.02 0.00 -0.43 0.00 0.00 46.19 47.57 1sjr s LEU 126 CO -0.01 -0.28 -0.11 0.21 -0.29 0.00 0.00 176.35 175.88 1sjr s ASN 127 N 2.78 2.02 -0.80 3.68 3.84 -1.26 -4.75 114.94 120.46 1sjr s ASN 127 Ca 0.18 -0.32 -0.25 0.00 0.21 0.00 0.00 52.86 52.67 1sjr s ASN 127 Cb -0.15 -0.87 -0.01 0.00 -0.55 0.00 0.00 41.25 39.67 1sjr s ASN 127 CO -0.21 -0.03 1.74 0.54 -2.79 0.00 0.00 177.10 176.36 1sjr s VAL 128 N 1.10 3.53 -1.47 -5.21 0.11 -1.26 -4.77 120.40 112.43 1sjr s VAL 128 Ca -0.06 -0.12 0.14 0.00 -2.93 0.00 0.00 61.98 59.00 1sjr s VAL 128 Cb -0.14 -4.28 0.49 0.00 -1.53 0.00 0.00 36.38 30.92 1sjr s VAL 128 CO -0.02 -1.22 1.37 0.29 -3.33 0.00 0.00 175.10 172.19 1sjr n LYS 129 N 9.05 2.71 -3.56 1.54 4.01 -1.26 -4.88 118.16 125.77 1sjr n LYS 129 Ca 0.27 -1.95 -0.15 0.00 -0.51 0.00 0.00 58.31 55.97 1sjr n LYS 129 Cb 0.50 -1.62 -0.06 0.00 -0.51 0.00 0.00 35.03 33.34 1sjr n LYS 129 CO 0.00 0.00 0.00 0.71 -1.11 0.00 0.00 177.40 177.00 1sjr s TYR 130 N -1.63 -0.59 -0.31 2.13 2.02 -1.26 -4.70 117.35 113.01 1sjr s TYR 130 Ca 0.35 1.14 -0.01 0.00 -0.37 0.00 0.00 57.07 58.18 1sjr s TYR 130 Cb 0.22 0.39 0.10 0.00 -0.40 0.00 0.00 41.96 42.27 1sjr s TYR 130 CO 0.19 -0.47 0.10 -0.80 -1.57 0.00 0.00 175.55 173.00 1sjr s ASN 131 N -0.77 3.97 -0.30 2.29 0.01 -0.75 -4.26 114.94 115.12 1sjr s ASN 131 Ca -0.05 -1.59 -0.17 0.00 -0.71 0.00 0.00 52.86 50.34 1sjr s ASN 131 Cb -0.01 -0.80 0.17 0.00 0.41 0.00 0.00 41.25 41.02 1sjr s ASN 131 CO 0.05 -0.42 1.18 0.54 -1.51 0.00 0.00 177.10 176.94 1sjr s ASN 132 N 1.68 -0.19 0.00 -1.22 4.22 0.11 -4.49 114.94 115.05 1sjr s ASN 132 Ca 0.10 0.13 0.00 0.00 -2.14 0.00 0.00 52.86 50.95 1sjr s ASN 132 Cb -0.17 1.17 0.00 0.00 1.28 0.00 0.00 41.25 43.53 1sjr s ASN 132 CO -0.27 -0.04 0.00 -0.90 -2.04 0.00 0.00 177.10 173.86 1sjr n ASP 133 N 5.41 0.00 0.30 3.54 5.75 -1.26 -1.22 116.55 129.07 1sjr n ASP 133 Ca -0.09 0.00 0.18 0.00 -0.01 0.00 0.00 54.79 54.87 1sjr n ASP 133 Cb 0.54 0.00 0.94 0.00 -1.03 0.00 0.00 41.12 41.58 1sjr n ASP 133 CO 0.00 0.00 0.00 0.11 -0.11 0.00 0.00 177.20 177.20 1sjr h LYS 134 N 0.00 0.00 -5.50 0.11 1.57 -1.97 -3.41 116.57 107.37 1sjr h LYS 134 Ca 0.00 0.00 -0.68 0.00 -1.87 0.00 0.00 60.65 58.10 1sjr h LYS 134 Cb 0.00 0.00 -0.33 0.00 0.08 0.00 0.00 32.23 31.98 1sjr h LYS 134 CO 0.00 0.04 -0.88 -1.54 -0.57 0.00 0.00 179.45 176.49 1sjr s SER 135 N -5.69 3.07 -0.02 0.86 1.04 -0.36 0.01 113.70 112.62 1sjr s SER 135 Ca -0.03 -0.55 0.00 0.00 0.48 0.00 0.00 55.95 55.86 1sjr s SER 135 Cb 0.13 -1.26 0.02 0.00 0.10 0.00 0.00 66.02 65.00 1sjr s SER 135 CO 0.50 0.18 -0.00 -0.60 0.98 0.00 0.00 173.24 174.30 1sjr s ARG 136 N 0.22 0.21 -0.11 4.02 6.06 -0.01 0.09 118.95 129.43 1sjr s ARG 136 Ca -0.15 0.04 0.00 0.00 -2.50 0.00 0.00 55.73 53.12 1sjr s ARG 136 Cb -0.17 -0.34 -0.02 0.00 0.06 0.00 0.00 34.95 34.48 1sjr s ARG 136 CO 0.08 -0.08 -0.11 0.16 -2.50 0.00 0.00 175.30 172.85 1sjr s ASP 137 N 0.66 4.20 -0.24 -2.12 -4.77 -1.26 -1.17 116.67 111.97 1sjr s ASP 137 Ca -0.06 -0.23 0.11 0.00 -3.30 0.00 0.00 52.55 49.07 1sjr s ASP 137 Cb -0.09 -1.39 0.45 0.00 -1.09 0.00 0.00 42.92 40.79 1sjr s ASP 137 CO -0.01 0.23 1.19 -1.22 0.70 0.00 0.00 175.17 176.06 1sjr n TYR 138 N 3.07 1.50 0.00 2.11 4.01 -0.59 -4.79 117.16 122.47 1sjr n TYR 138 Ca -0.18 -1.86 0.00 0.00 -0.16 0.00 0.00 57.90 55.70 1sjr n TYR 138 Cb 0.53 -0.29 0.00 0.00 -0.31 0.00 0.00 39.34 39.27 1sjr n TYR 138 CO 0.00 0.00 0.00 -2.37 -0.46 0.00 0.00 176.86 174.03 1sjr n THR 139 N -0.75 0.00 -3.64 -0.72 5.66 -1.19 -4.74 114.28 108.89 1sjr n THR 139 Ca 0.29 0.00 -0.39 0.00 -3.05 0.00 0.00 64.05 60.91 1sjr n THR 139 Cb 0.87 0.00 -0.09 0.00 -1.55 0.00 0.00 70.33 69.57 1sjr n THR 139 CO 0.00 0.00 0.00 -0.13 -3.05 0.00 0.00 175.07 171.89 1sjr s ARG 140 N -1.82 2.63 0.00 1.09 1.81 -1.26 -4.90 118.95 116.50 1sjr s ARG 140 Ca 0.00 -2.31 0.30 0.00 -1.72 0.00 0.00 55.73 52.00 1sjr s ARG 140 Cb 0.00 -3.85 1.44 0.00 -0.45 0.00 0.00 34.95 32.09 1sjr s ARG 140 CO 0.00 -1.18 1.98 -0.35 -0.68 0.00 0.00 175.30 175.07 1sjr n PRO 141 N 3.93 0.82 -0.59 3.54 -0.04 -1.26 -3.81 135.00 137.59 1sjr n PRO 141 Ca 0.05 -0.20 -0.11 0.00 -0.04 0.00 0.00 63.50 63.19 1sjr n PRO 141 Cb 0.40 -1.50 0.09 0.00 -0.04 0.00 0.00 33.50 32.45 1sjr n PRO 141 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 1sjr n ASP 142 N -0.91 3.37 -4.88 3.54 8.00 -1.26 -4.90 116.55 119.50 1sjr n ASP 142 Ca 0.17 -2.77 -0.24 0.00 0.71 0.00 0.00 54.79 52.66 1sjr n ASP 142 Cb 0.23 -0.66 -0.04 0.00 -0.02 0.00 0.00 41.12 40.63 1sjr n ASP 142 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1sjr s LEU 143 N -1.58 4.07 1.15 0.64 2.01 -1.25 -5.12 118.68 118.59 1sjr s LEU 143 Ca 0.27 -0.03 -0.18 0.00 0.01 0.00 0.00 54.13 54.20 1sjr s LEU 143 Cb 0.23 -2.63 0.26 0.00 0.01 0.00 0.00 46.19 44.06 1sjr s LEU 143 CO 0.05 0.01 1.15 -2.16 1.01 0.00 0.00 176.35 176.41 1sjr s PRO 144 N -3.51 -0.78 -0.03 1.29 0.04 -1.26 -4.83 135.00 125.92 1sjr s PRO 144 Ca 0.33 -0.09 0.05 0.00 0.04 0.00 0.00 61.00 61.33 1sjr s PRO 144 Cb -0.10 -1.65 0.10 0.00 0.04 0.00 0.00 34.50 32.90 1sjr s PRO 144 CO 0.26 -3.41 1.07 0.45 0.04 0.00 0.00 177.00 175.41 1sjr n SER 145 N -4.54 2.24 0.09 6.66 2.88 -1.26 -1.82 113.62 117.87 1sjr n SER 145 Ca 0.13 -2.21 0.00 0.00 -1.33 0.00 0.00 58.87 55.46 1sjr n SER 145 Cb 0.59 -0.12 0.00 0.00 -0.75 0.00 0.00 64.21 63.94 1sjr n SER 145 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1sjr n GLY 146 N -0.52 -1.25 0.00 0.46 0.00 -1.26 -4.65 105.19 97.97 1sjr n GLY 146 Ca 0.05 0.35 0.00 0.00 0.00 0.00 0.00 46.02 46.41 1sjr n GLY 146 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54