#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 -1.97 0.00 3.17 0.00 -1.26 -5.01 120.51 115.44 1sjr n ALA 41 Ca 0.00 0.11 0.00 0.00 0.00 0.00 0.00 53.44 53.55 1sjr n ALA 41 Cb 0.00 -0.58 0.00 0.00 0.00 0.00 0.00 19.45 18.87 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 -1.28 2.28 2.92 0.00 0.00 -1.26 -5.01 105.19 102.85 1sjr n GLY 42 Ca 0.00 0.30 -0.17 0.00 0.00 0.00 0.00 46.02 46.15 1sjr n GLY 42 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1sjr n GLN 43 N 0.00 0.90 -3.40 1.61 10.64 -1.26 -4.78 117.38 121.09 1sjr n GLN 43 Ca 0.00 -1.03 -0.44 0.00 -1.83 0.00 0.00 57.00 53.69 1sjr n GLN 43 Cb 0.00 -2.31 -0.06 0.00 -0.86 0.00 0.00 30.24 27.02 1sjr n GLN 43 CO 0.00 0.00 0.00 -1.12 -1.83 0.00 0.00 177.06 174.11 1sjr s SER 44 N 4.64 6.12 -1.08 2.61 0.01 -1.26 -4.73 113.70 120.01 1sjr s SER 44 Ca 0.27 -2.02 -0.22 0.00 1.31 0.00 0.00 55.95 55.29 1sjr s SER 44 Cb 0.07 -2.14 0.04 0.00 0.21 0.00 0.00 66.02 64.19 1sjr s SER 44 CO 0.04 -0.75 1.61 -2.16 0.41 0.00 0.00 173.24 172.39 1sjr s PRO 45 N 1.22 3.51 -0.23 12.44 0.04 -1.26 -4.89 135.00 145.82 1sjr s PRO 45 Ca 0.07 -1.24 -0.04 0.00 0.04 0.00 0.00 61.00 59.83 1sjr s PRO 45 Cb -0.25 -5.36 0.09 0.00 0.04 0.00 0.00 34.50 29.01 1sjr s PRO 45 CO -0.00 -2.46 0.15 0.08 0.04 0.00 0.00 177.00 174.81 1sjr s VAL 46 N 5.72 -0.17 0.31 -0.36 1.01 -1.26 -1.66 120.40 124.00 1sjr s VAL 46 Ca 0.52 -0.39 0.07 0.00 0.00 0.00 0.00 61.98 62.18 1sjr s VAL 46 Cb 0.00 -0.78 -0.02 0.00 0.00 0.00 0.00 36.38 35.58 1sjr s VAL 46 CO -0.03 -0.44 0.32 -0.76 0.00 0.00 0.00 175.10 174.19 1sjr s LEU 47 N 2.19 3.80 -0.21 3.92 2.01 -0.66 0.25 118.68 129.97 1sjr s LEU 47 Ca 0.06 -0.32 -0.03 0.00 0.01 0.00 0.00 54.13 53.85 1sjr s LEU 47 Cb -0.16 -2.43 0.07 0.00 0.01 0.00 0.00 46.19 43.68 1sjr s LEU 47 CO -0.22 -0.29 0.04 -0.60 1.01 0.00 0.00 176.35 176.30 1sjr s ARG 48 N -4.01 0.67 0.28 1.70 3.52 0.49 0.14 118.95 121.74 1sjr s ARG 48 Ca 0.40 -0.52 -0.21 0.00 -0.13 0.00 0.00 55.73 55.26 1sjr s ARG 48 Cb -0.07 -2.08 -0.09 0.00 -1.56 0.00 0.00 34.95 31.15 1sjr s ARG 48 CO 0.28 -0.70 0.81 0.42 -0.81 0.00 0.00 175.30 175.29 1sjr s ILE 49 N 1.83 4.46 -0.27 4.11 1.01 0.32 -1.88 121.20 130.78 1sjr s ILE 49 Ca 0.01 1.42 -0.02 0.00 0.00 0.00 0.00 60.65 62.05 1sjr s ILE 49 Cb -0.17 -3.86 0.09 0.00 0.01 0.00 0.00 42.46 38.53 1sjr s ILE 49 CO -0.11 0.11 0.09 -0.63 0.00 0.00 0.00 174.94 174.40 1sjr s ILE 50 N -1.64 0.47 0.03 2.92 1.01 0.18 0.31 121.20 124.48 1sjr s ILE 50 Ca 0.48 -0.94 -0.29 0.00 0.00 0.00 0.00 60.65 59.89 1sjr s ILE 50 Cb -0.16 -1.25 -0.04 0.00 0.01 0.00 0.00 42.46 41.01 1sjr s ILE 50 CO 0.21 -0.55 0.94 -0.69 0.00 0.00 0.00 174.94 174.84 1sjr s VAL 51 N 1.84 4.75 0.40 2.92 1.01 -0.72 -1.16 120.40 129.44 1sjr s VAL 51 Ca 0.06 1.99 0.07 0.00 0.00 0.00 0.00 61.98 64.11 1sjr s VAL 51 Cb -0.17 -4.29 -0.07 0.00 0.00 0.00 0.00 36.38 31.85 1sjr s VAL 51 CO -0.23 0.23 0.01 -1.61 0.00 0.00 0.00 175.10 173.50 1sjr s GLU 52 N 0.59 1.97 0.02 2.72 0.41 -0.29 -3.63 118.70 120.49 1sjr s GLU 52 Ca 0.48 -2.05 0.00 0.00 -0.41 0.00 0.00 54.97 53.00 1sjr s GLU 52 Cb -0.21 -1.69 0.00 0.00 -1.78 0.00 0.00 34.13 30.44 1sjr s GLU 52 CO 0.28 -0.02 0.00 0.09 -0.49 0.00 0.00 175.26 175.11 1sjr n ASN 53 N -0.97 -6.31 -4.77 -0.19 3.02 -1.26 -3.92 115.26 100.86 1sjr n ASN 53 Ca -0.05 1.56 -0.40 0.00 -0.03 0.00 0.00 54.58 55.67 1sjr n ASN 53 Cb 0.66 -3.97 0.02 0.00 -0.61 0.00 0.00 39.78 35.88 1sjr n ASN 53 CO 0.00 0.00 0.00 -0.22 -2.62 0.00 0.00 177.26 174.42 1sjr s LEU 54 N -0.39 4.10 0.09 3.41 1.98 -1.26 -4.45 118.68 122.16 1sjr s LEU 54 Ca 0.00 2.93 0.00 0.00 -2.89 0.00 0.00 54.13 54.17 1sjr s LEU 54 Cb 0.00 -3.94 0.00 0.00 0.66 0.00 0.00 46.19 42.91 1sjr s LEU 54 CO 0.00 -1.20 0.00 2.22 -1.89 0.00 0.00 176.35 175.48 1sjr n PHE 55 N -0.22 -1.91 -3.49 5.38 -1.74 -1.26 -4.95 117.46 109.26 1sjr n PHE 55 Ca 0.05 0.25 -0.11 0.00 -0.56 0.00 0.00 57.45 57.07 1sjr n PHE 55 Cb 0.42 0.95 -0.03 0.00 1.52 0.00 0.00 39.48 42.34 1sjr n PHE 55 CO 0.00 0.00 0.00 -0.47 -0.56 0.00 0.00 176.76 175.73 1sjr s TYR 56 N -2.00 -0.43 -0.82 2.97 5.04 -1.26 -5.11 117.35 115.74 1sjr s TYR 56 Ca 0.00 0.19 -0.26 0.00 -2.44 0.00 0.00 57.07 54.56 1sjr s TYR 56 Cb 0.00 0.48 0.03 0.00 0.35 0.00 0.00 41.96 42.81 1sjr s TYR 56 CO 0.00 -0.82 1.42 -1.25 -1.34 0.00 0.00 175.55 173.57 1sjr s PRO 57 N -3.77 3.21 0.75 4.97 0.04 -1.26 -5.00 135.00 133.94 1sjr s PRO 57 Ca 0.02 -0.41 -0.09 0.00 0.04 0.00 0.00 61.00 60.56 1sjr s PRO 57 Cb -0.00 -4.59 0.16 0.00 0.04 0.00 0.00 34.50 30.11 1sjr s PRO 57 CO -0.12 -2.29 1.02 1.33 0.04 0.00 0.00 177.00 176.97 1sjr n VAL 58 N 6.69 0.00 -2.40 -0.36 0.24 -1.26 -5.11 118.33 116.13 1sjr n VAL 58 Ca 0.15 -1.00 0.00 0.00 -2.04 0.00 0.00 64.34 61.46 1sjr n VAL 58 Cb 0.50 -1.37 0.00 0.00 -1.47 0.00 0.00 33.84 31.50 1sjr n VAL 58 CO 0.00 0.00 0.00 1.07 -2.14 0.00 0.00 176.83 175.76 1sjr n THR 59 N -3.22 0.00 -0.02 3.34 5.66 -1.26 -5.06 114.28 113.72 1sjr n THR 59 Ca 0.14 0.00 -0.15 0.00 -3.05 0.00 0.00 64.05 60.99 1sjr n THR 59 Cb 0.49 0.00 -0.11 0.00 -1.55 0.00 0.00 70.33 69.16 1sjr n THR 59 CO 0.00 0.00 0.00 -0.07 -3.05 0.00 0.00 175.07 171.95 1sjr h LEU 60 N 0.00 0.31 -0.95 1.09 3.38 -1.96 -3.06 115.31 114.11 1sjr h LEU 60 Ca 0.00 -0.72 0.20 0.00 0.09 0.00 0.00 57.88 57.45 1sjr h LEU 60 Cb 0.00 -0.09 -0.18 0.00 0.09 0.00 0.00 40.66 40.48 1sjr h LEU 60 CO 0.00 0.98 -0.21 0.44 0.09 0.00 0.00 178.44 179.74 1sjr h ASP 61 N -0.35 -0.84 -0.29 -0.43 3.32 -1.97 1.04 116.42 116.90 1sjr h ASP 61 Ca -0.03 0.28 -0.06 0.00 0.02 0.00 0.00 57.03 57.24 1sjr h ASP 61 Cb 1.01 0.58 -0.01 0.00 0.22 0.00 0.00 39.33 41.13 1sjr h ASP 61 CO 0.06 -0.32 -0.07 1.62 -1.72 0.00 0.00 179.24 178.82 1sjr h VAL 62 N 0.00 1.28 0.00 -1.35 3.04 -1.98 -1.90 116.25 115.34 1sjr h VAL 62 Ca 0.47 -1.10 -0.00 0.00 -1.01 0.00 0.00 66.70 65.06 1sjr h VAL 62 Cb 0.75 1.40 -0.00 0.00 -2.01 0.00 0.00 31.29 31.43 1sjr h VAL 62 CO -0.97 0.35 -0.02 -0.07 -1.01 0.00 0.00 177.57 175.85 1sjr h LEU 63 N 0.32 0.00 0.00 3.16 3.38 -0.30 -2.42 115.31 119.45 1sjr h LEU 63 Ca 0.07 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 58.04 1sjr h LEU 63 Cb 0.55 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.30 1sjr h LEU 63 CO 0.03 0.02 -0.00 -0.74 0.09 0.00 0.00 178.44 177.84 1sjr h HIS 64 N 0.00 0.00 0.00 1.13 2.76 0.12 -3.06 115.15 116.11 1sjr h HIS 64 Ca -0.00 0.00 0.00 0.00 -2.20 0.00 0.00 60.37 58.17 1sjr h HIS 64 Cb 0.34 0.00 0.00 0.00 1.55 0.00 0.00 27.41 29.30 1sjr h HIS 64 CO 0.00 0.33 0.00 1.04 -1.30 0.00 0.00 177.93 178.00 1sjr n GLN 65 N -4.72 0.12 -0.02 5.26 3.00 -0.74 0.18 117.38 120.46 1sjr n GLN 65 Ca -0.03 0.61 -0.00 0.00 -0.01 0.00 0.00 57.00 57.57 1sjr n GLN 65 Cb 0.16 -1.90 -0.00 0.00 0.00 0.00 0.00 30.24 28.50 1sjr n GLN 65 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.06 177.88 1sjr h ILE 66 N 0.00 0.00 0.00 5.09 1.08 -1.50 -3.37 117.51 118.81 1sjr h ILE 66 Ca 0.00 -0.30 0.00 0.00 -0.39 0.00 0.00 64.86 64.17 1sjr h ILE 66 Cb 0.02 0.00 0.00 0.00 -3.07 0.00 0.00 36.82 33.77 1sjr h ILE 66 CO 0.00 0.00 0.00 0.49 -0.69 0.00 0.00 178.15 177.95 1sjr n PHE 67 N -2.86 0.62 1.46 1.37 3.72 -1.15 -2.40 117.46 118.22 1sjr n PHE 67 Ca -0.00 0.23 0.12 0.00 -0.05 0.00 0.00 57.45 57.74 1sjr n PHE 67 Cb 0.01 -0.87 0.70 0.00 -0.94 0.00 0.00 39.48 38.38 1sjr n PHE 67 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 176.76 177.16 1sjr n SER 68 N -2.05 0.00 -0.10 4.37 2.88 0.13 -2.79 113.62 116.06 1sjr n SER 68 Ca 0.03 -0.71 -0.24 0.00 -1.33 0.00 0.00 58.87 56.63 1sjr n SER 68 Cb 0.26 -0.01 -0.11 0.00 -0.75 0.00 0.00 64.21 63.59 1sjr n SER 68 CO 0.00 0.00 0.00 1.17 -1.23 0.00 0.00 175.04 174.98 1sjr n LYS 69 N -1.01 0.59 0.00 -1.46 0.00 -1.01 -4.14 118.16 111.13 1sjr n LYS 69 Ca 0.17 0.45 0.10 0.00 0.00 0.00 0.00 58.31 59.04 1sjr n LYS 69 Cb 0.09 -1.67 0.47 0.00 0.00 0.00 0.00 35.03 33.91 1sjr n LYS 69 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.40 178.59 1sjr n PHE 70 N -4.25 0.00 0.00 5.64 3.01 -1.20 -4.91 117.46 115.75 1sjr n PHE 70 Ca -0.38 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.08 1sjr n PHE 70 Cb 0.78 -0.43 0.00 0.00 -0.01 0.00 0.00 39.48 39.82 1sjr n PHE 70 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1sjr n GLY 71 N 0.60 1.67 3.70 1.37 0.00 -1.12 -4.68 105.19 106.73 1sjr n GLY 71 Ca 0.07 -0.99 -0.42 0.00 0.00 0.00 0.00 46.02 44.68 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 3.08 -0.53 2.61 2.01 -1.26 -3.66 115.64 115.89 1sjr s THR 72 Ca 0.00 0.60 -0.21 0.00 0.31 0.00 0.00 61.69 62.39 1sjr s THR 72 Cb 0.00 -3.38 0.05 0.00 0.01 0.00 0.00 72.50 69.18 1sjr s THR 72 CO 0.00 0.01 0.76 -0.69 -0.69 0.00 0.00 174.62 174.01 1sjr s VAL 73 N 2.24 4.66 0.07 3.82 1.01 -1.26 -2.78 120.40 128.16 1sjr s VAL 73 Ca 0.71 -0.19 -0.24 0.00 0.00 0.00 0.00 61.98 62.26 1sjr s VAL 73 Cb -0.39 -4.41 -0.16 0.00 0.00 0.00 0.00 36.38 31.42 1sjr s VAL 73 CO 0.31 -0.96 1.66 -0.07 0.00 0.00 0.00 175.10 176.05 1sjr h LEU 74 N 10.27 -0.09 -7.99 3.92 4.07 0.09 -3.40 115.31 122.18 1sjr h LEU 74 Ca -0.27 -0.05 -0.07 0.00 0.08 0.00 0.00 57.88 57.57 1sjr h LEU 74 Cb 1.09 0.02 -0.11 0.00 1.08 0.00 0.00 40.66 42.74 1sjr h LEU 74 CO 1.02 -0.00 -0.16 -0.54 -1.08 0.00 0.00 178.44 177.68 1sjr s LYS 75 N -5.93 1.32 -0.02 1.13 1.02 -1.19 0.08 119.74 116.15 1sjr s LYS 75 Ca -0.14 -1.09 -0.13 0.00 0.02 0.00 0.00 55.97 54.63 1sjr s LYS 75 Cb 0.05 0.45 0.02 0.00 -0.52 0.00 0.00 37.83 37.83 1sjr s LYS 75 CO 0.65 -0.53 0.27 0.42 -0.92 0.00 0.00 175.35 175.25 1sjr s ILE 76 N -3.95 0.05 0.06 2.17 1.01 0.22 -2.37 121.20 118.39 1sjr s ILE 76 Ca 0.16 -0.45 -0.05 0.00 0.00 0.00 0.00 60.65 60.30 1sjr s ILE 76 Cb 0.01 -0.55 -0.02 0.00 0.01 0.00 0.00 42.46 41.91 1sjr s ILE 76 CO 0.01 -0.25 0.09 -0.63 0.00 0.00 0.00 174.94 174.17 1sjr s ILE 77 N -1.13 0.16 -0.01 2.92 -1.09 -1.08 -0.57 121.20 120.40 1sjr s ILE 77 Ca -0.12 -1.30 -0.08 0.00 -2.23 0.00 0.00 60.65 56.92 1sjr s ILE 77 Cb -0.05 -1.18 0.01 0.00 -1.58 0.00 0.00 42.46 39.65 1sjr s ILE 77 CO 0.03 -0.72 0.17 0.42 -1.23 0.00 0.00 174.94 173.62 1sjr s THR 78 N -3.30 0.06 0.03 2.92 -4.23 -1.10 -0.97 115.64 109.06 1sjr s THR 78 Ca 0.01 -0.53 -0.28 0.00 -1.18 0.00 0.00 61.69 59.71 1sjr s THR 78 Cb 0.03 -0.43 0.09 0.00 1.34 0.00 0.00 72.50 73.53 1sjr s THR 78 CO -0.08 -0.29 0.96 0.72 -0.54 0.00 0.00 174.62 175.39 1sjr s PHE 79 N -1.09 -0.24 -0.22 3.99 -0.71 0.26 -4.84 117.98 115.13 1sjr s PHE 79 Ca -0.12 0.06 -0.01 0.00 -1.04 0.00 0.00 56.93 55.82 1sjr s PHE 79 Cb -0.06 0.57 0.06 0.00 -1.21 0.00 0.00 43.02 42.38 1sjr s PHE 79 CO 0.02 -0.59 0.01 0.99 -1.34 0.00 0.00 175.22 174.30 1sjr s THR 80 N -3.08 0.91 -0.69 -4.49 2.01 -1.25 0.26 115.64 109.30 1sjr s THR 80 Ca 0.08 -0.87 -0.21 0.00 0.31 0.00 0.00 61.69 61.00 1sjr s THR 80 Cb -0.01 -1.36 0.08 0.00 0.01 0.00 0.00 72.50 71.23 1sjr s THR 80 CO -0.05 -0.22 0.95 -0.75 -0.69 0.00 0.00 174.62 173.87 1sjr s LYS 81 N 1.67 3.17 -1.45 4.92 2.47 -0.70 -4.23 119.74 125.60 1sjr s LYS 81 Ca -0.02 -1.05 -0.12 0.00 -1.56 0.00 0.00 55.97 53.23 1sjr s LYS 81 Cb -0.18 -4.34 0.05 0.00 -1.46 0.00 0.00 37.83 31.90 1sjr s LYS 81 CO -0.09 -1.77 1.09 0.09 0.16 0.00 0.00 175.35 174.83 1sjr n ASN 82 N 7.33 -5.61 -0.43 1.43 3.02 -1.26 -2.60 115.26 117.13 1sjr n ASN 82 Ca -0.00 -0.66 0.00 0.00 -0.03 0.00 0.00 54.58 53.88 1sjr n ASN 82 Cb 0.45 -4.44 0.00 0.00 -0.61 0.00 0.00 39.78 35.18 1sjr n ASN 82 CO 0.00 0.00 0.00 -3.20 -2.62 0.00 0.00 177.26 171.44 1sjr n ASN 83 N -2.92 -1.45 -3.65 6.41 2.85 -1.26 -5.07 115.26 110.18 1sjr n ASN 83 Ca 0.03 0.00 -0.29 0.00 -0.11 0.00 0.00 54.58 54.20 1sjr n ASN 83 Cb 0.54 -0.36 -0.14 0.00 1.24 0.00 0.00 39.78 41.06 1sjr n ASN 83 CO 0.00 0.00 0.00 -1.10 -2.11 0.00 0.00 177.26 174.05 1sjr s GLN 84 N -3.41 0.61 0.11 1.20 -0.21 -1.07 -5.06 119.66 111.82 1sjr s GLN 84 Ca 0.00 -1.05 -0.31 0.00 0.02 0.00 0.00 55.36 54.02 1sjr s GLN 84 Cb 0.00 -1.71 -0.10 0.00 1.00 0.00 0.00 33.01 32.20 1sjr s GLN 84 CO 0.00 -1.04 1.77 0.12 -2.12 0.00 0.00 175.29 174.02 1sjr s PHE 85 N 1.55 2.23 -0.15 0.91 2.19 -1.24 -1.72 117.98 121.76 1sjr s PHE 85 Ca 0.11 0.09 -0.05 0.00 0.33 0.00 0.00 56.93 57.41 1sjr s PHE 85 Cb -0.18 -4.11 0.07 0.00 -1.31 0.00 0.00 43.02 37.49 1sjr s PHE 85 CO -0.23 -4.54 0.31 -0.65 1.83 0.00 0.00 175.22 171.94 1sjr s GLN 86 N 2.71 0.19 -0.09 10.12 -0.21 0.14 -1.76 119.66 130.77 1sjr s GLN 86 Ca 0.79 0.83 0.03 0.00 0.02 0.00 0.00 55.36 57.03 1sjr s GLN 86 Cb -0.44 0.07 0.00 0.00 1.00 0.00 0.00 33.01 33.64 1sjr s GLN 86 CO 0.35 -0.28 -0.20 0.00 -2.12 0.00 0.00 175.29 173.04 1sjr s ALA 87 N 2.47 1.90 0.67 6.09 0.00 0.15 -0.58 121.76 132.46 1sjr s ALA 87 Ca 0.00 -0.80 -0.11 0.00 0.00 0.00 0.00 51.96 51.05 1sjr s ALA 87 Cb -0.12 -0.74 0.00 0.00 0.00 0.00 0.00 23.12 22.26 1sjr s ALA 87 CO -0.10 0.23 1.06 -0.51 0.00 0.00 0.00 175.76 176.44 1sjr s LEU 88 N 0.44 3.01 0.00 0.00 1.43 -0.14 0.12 118.68 123.55 1sjr s LEU 88 Ca -0.18 1.13 -0.02 0.00 -1.03 0.00 0.00 54.13 54.03 1sjr s LEU 88 Cb -0.17 -3.98 -0.01 0.00 0.03 0.00 0.00 46.19 42.06 1sjr s LEU 88 CO 0.07 -1.21 0.03 -0.22 0.23 0.00 0.00 176.35 175.26 1sjr s LEU 89 N -5.27 1.95 -0.17 1.79 1.98 0.37 -2.63 118.68 116.70 1sjr s LEU 89 Ca 0.57 -0.26 -0.04 0.00 -2.89 0.00 0.00 54.13 51.51 1sjr s LEU 89 Cb -0.11 0.26 0.06 0.00 0.66 0.00 0.00 46.19 47.06 1sjr s LEU 89 CO 0.51 -0.24 0.07 -1.58 -1.89 0.00 0.00 176.35 173.23 1sjr s GLN 90 N -1.02 0.21 0.56 1.98 0.74 -1.00 -1.66 119.66 119.47 1sjr s GLN 90 Ca -0.11 -0.13 0.01 0.00 0.05 0.00 0.00 55.36 55.18 1sjr s GLN 90 Cb -0.07 -1.81 0.04 0.00 1.10 0.00 0.00 33.01 32.27 1sjr s GLN 90 CO -0.00 -0.64 0.78 0.71 -0.55 0.00 0.00 175.29 175.60 1sjr s TYR 91 N 2.07 2.76 -0.46 1.67 2.02 -0.66 0.77 117.35 125.52 1sjr s TYR 91 Ca 0.02 -0.05 0.23 0.00 -0.37 0.00 0.00 57.07 56.90 1sjr s TYR 91 Cb -0.16 -2.76 -0.02 0.00 -0.40 0.00 0.00 41.96 38.63 1sjr s TYR 91 CO -0.08 -0.92 0.95 0.00 -1.57 0.00 0.00 175.55 173.93 1sjr n ALA 92 N -2.36 3.17 -3.13 3.71 0.00 -1.12 -4.67 120.51 116.11 1sjr n ALA 92 Ca 0.09 -0.39 -0.13 0.00 0.00 0.00 0.00 53.44 53.01 1sjr n ALA 92 Cb 0.60 -0.96 -0.12 0.00 0.00 0.00 0.00 19.45 18.97 1sjr n ALA 92 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1sjr s ASP 93 N -4.26 -0.25 0.43 0.00 1.11 -1.26 -5.02 116.67 107.42 1sjr s ASP 93 Ca 0.01 0.48 0.14 0.00 0.18 0.00 0.00 52.55 53.37 1sjr s ASP 93 Cb 0.13 0.50 0.94 0.00 1.07 0.00 0.00 42.92 45.56 1sjr s ASP 93 CO 0.82 -0.10 1.95 1.55 1.18 0.00 0.00 175.17 180.57 1sjr h PRO 94 N 5.70 0.00 -0.79 8.23 0.13 -1.91 -2.78 132.00 140.57 1sjr h PRO 94 Ca -0.26 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 64.86 1sjr h PRO 94 Cb 1.19 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 32.28 1sjr h PRO 94 CO 0.35 0.23 0.47 0.28 -0.23 0.00 0.00 178.00 179.10 1sjr h VAL 95 N 0.00 1.23 -0.07 1.56 2.07 -1.98 0.56 116.25 119.62 1sjr h VAL 95 Ca -0.00 -0.51 -0.17 0.00 0.82 0.00 0.00 66.70 66.84 1sjr h VAL 95 Cb 0.42 0.13 -0.01 0.00 -1.52 0.00 0.00 31.29 30.31 1sjr h VAL 95 CO 0.03 0.24 -0.69 0.77 0.02 0.00 0.00 177.57 177.94 1sjr h SER 96 N 1.09 0.36 -0.29 0.57 4.64 -1.77 -3.10 113.55 115.05 1sjr h SER 96 Ca 0.28 -0.23 -0.10 0.00 -0.47 0.00 0.00 61.79 61.27 1sjr h SER 96 Cb -0.02 -0.11 -0.01 0.00 -0.31 0.00 0.00 62.40 61.96 1sjr h SER 96 CO -0.05 0.94 -0.21 0.00 -0.87 0.00 0.00 176.83 176.64 1sjr h ALA 97 N 1.05 0.42 0.53 5.18 0.00 -1.20 -1.24 119.26 124.00 1sjr h ALA 97 Ca -0.02 -0.36 -0.02 0.00 0.00 0.00 0.00 54.91 54.51 1sjr h ALA 97 Cb 1.24 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.92 1sjr h ALA 97 CO 0.11 0.36 -0.49 1.96 0.00 0.00 0.00 179.25 181.19 1sjr h GLN 98 N 0.39 -0.98 0.17 0.00 1.08 -0.91 0.41 115.11 115.28 1sjr h GLN 98 Ca 0.06 0.07 -0.00 0.00 -1.45 0.00 0.00 58.65 57.32 1sjr h GLN 98 Cb 0.75 0.22 -0.01 0.00 -0.05 0.00 0.00 27.48 28.40 1sjr h GLN 98 CO 0.06 -0.65 -0.13 0.45 -0.95 0.00 0.00 178.83 177.60 1sjr h HIS 99 N -1.01 -0.34 -0.96 2.96 3.86 -1.61 -2.44 115.15 115.61 1sjr h HIS 99 Ca -0.06 -0.00 0.14 0.00 -1.16 0.00 0.00 60.37 59.28 1sjr h HIS 99 Cb 0.87 0.13 -0.08 0.00 1.06 0.00 0.00 27.41 29.39 1sjr h HIS 99 CO -0.23 -0.21 0.61 0.00 0.86 0.00 0.00 177.93 178.96 1sjr h ALA 100 N 0.50 1.67 0.06 2.45 0.00 -1.12 0.54 119.26 123.36 1sjr h ALA 100 Ca -0.01 0.03 0.01 0.00 0.00 0.00 0.00 54.91 54.94 1sjr h ALA 100 Cb 0.28 -0.16 -0.04 0.00 0.00 0.00 0.00 17.79 17.87 1sjr h ALA 100 CO -0.01 0.06 -0.42 -0.22 0.00 0.00 0.00 179.25 178.66 1sjr h LYS 101 N 0.84 -0.55 0.00 0.00 3.11 0.33 0.23 116.57 120.54 1sjr h LYS 101 Ca 0.49 0.04 -0.09 0.00 -2.81 0.00 0.00 60.65 58.27 1sjr h LYS 101 Cb 0.64 0.12 -0.01 0.00 -1.00 0.00 0.00 32.23 31.98 1sjr h LYS 101 CO -0.25 -0.37 -0.44 -0.07 -2.81 0.00 0.00 179.45 175.51 1sjr h LEU 102 N -0.57 0.00 0.00 5.20 4.07 -1.38 0.13 115.31 122.76 1sjr h LEU 102 Ca 0.00 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.96 1sjr h LEU 102 Cb 0.59 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.33 1sjr h LEU 102 CO -0.25 0.44 0.00 -1.20 -1.08 0.00 0.00 178.44 176.35 1sjr n SER 103 N -3.47 0.00 -0.01 -0.43 7.64 0.18 -3.05 113.62 114.49 1sjr n SER 103 Ca 0.00 0.40 0.00 0.00 1.01 0.00 0.00 58.87 60.28 1sjr n SER 103 Cb 0.58 -0.46 0.00 0.00 -1.01 0.00 0.00 64.21 63.33 1sjr n SER 103 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 1sjr n LEU 104 N -1.46 0.30 -4.41 -3.43 4.77 0.76 -4.93 117.00 108.61 1sjr n LEU 104 Ca 0.06 -0.32 -0.44 0.00 -0.03 0.00 0.00 56.01 55.28 1sjr n LEU 104 Cb 0.21 -0.00 -0.05 0.00 -2.33 0.00 0.00 43.42 41.25 1sjr n LEU 104 CO 0.18 0.08 0.37 -1.81 -1.33 0.00 0.00 177.39 174.88 1sjr s ASP 105 N -0.17 6.20 0.00 -1.43 1.01 0.42 -3.91 116.67 118.79 1sjr s ASP 105 Ca 0.00 -1.16 0.00 0.00 0.71 0.00 0.00 52.55 52.10 1sjr s ASP 105 Cb 0.00 -2.30 0.00 0.00 1.01 0.00 0.00 42.92 41.63 1sjr s ASP 105 CO 0.00 -1.00 0.00 0.61 0.21 0.00 0.00 175.17 174.99 1sjr n GLY 106 N 5.23 0.70 4.02 0.21 0.00 -1.21 -4.92 105.19 109.22 1sjr n GLY 106 Ca -0.08 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.73 1sjr n GLY 106 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 1sjr s GLN 107 N -0.78 1.97 0.43 1.61 -2.07 -1.25 -4.93 119.66 114.63 1sjr s GLN 107 Ca 0.00 -1.45 0.02 0.00 -1.82 0.00 0.00 55.36 52.11 1sjr s GLN 107 Cb 0.00 -2.50 0.02 0.00 -1.09 0.00 0.00 33.01 29.44 1sjr s GLN 107 CO 0.00 -1.17 0.15 0.09 -1.32 0.00 0.00 175.29 173.04 1sjr n ASN 108 N -2.53 2.83 0.00 12.60 3.02 -1.26 -3.13 115.26 126.78 1sjr n ASN 108 Ca 0.16 -2.69 0.00 0.00 -0.03 0.00 0.00 54.58 52.02 1sjr n ASN 108 Cb 0.61 0.15 0.00 0.00 -0.61 0.00 0.00 39.78 39.93 1sjr n ASN 108 CO 0.00 0.00 0.00 -0.38 -2.62 0.00 0.00 177.26 174.26 1sjr n ILE 109 N -1.26 0.00 -0.51 2.41 5.41 -1.20 -4.74 119.36 119.48 1sjr n ILE 109 Ca -0.10 0.00 0.11 0.00 1.00 0.00 0.00 62.75 63.75 1sjr n ILE 109 Cb 0.52 -0.67 0.35 0.00 -0.71 0.00 0.00 39.64 39.12 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 -2.50 1.26 -1.62 1.39 4.02 -1.25 -5.01 117.16 113.45 1sjr n TYR 110 Ca 0.00 -0.56 -0.01 0.00 -0.01 0.00 0.00 57.90 57.32 1sjr n TYR 110 Cb 0.43 -0.13 -0.01 0.00 -0.02 0.00 0.00 39.34 39.61 1sjr n TYR 110 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 176.86 175.94 1sjr n ASN 111 N 1.42 -2.39 -2.77 7.72 3.02 -1.26 -4.78 115.26 116.21 1sjr n ASN 111 Ca 0.26 0.39 -0.12 0.00 -0.03 0.00 0.00 54.58 55.08 1sjr n ASN 111 Cb 0.77 -2.08 0.06 0.00 -0.61 0.00 0.00 39.78 37.91 1sjr n ASN 111 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1sjr n ALA 112 N 0.45 -1.72 0.00 5.41 0.00 -1.26 -5.00 120.51 118.39 1sjr n ALA 112 Ca -0.07 0.03 0.00 0.00 0.00 0.00 0.00 53.44 53.40 1sjr n ALA 112 Cb 0.11 -3.18 0.00 0.00 0.00 0.00 0.00 19.45 16.38 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 -3.97 0.77 -4.63 0.00 -1.04 -1.25 -4.43 114.28 99.71 1sjr n THR 115 Ca -0.09 -0.19 -0.27 0.00 -2.04 0.00 0.00 64.05 61.46 1sjr n THR 115 Cb 0.56 0.00 -0.17 0.00 -1.82 0.00 0.00 70.33 68.90 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 1.16 1.72 -0.34 -4.42 0.05 -1.18 -1.14 118.68 114.52 1sjr s LEU 116 Ca 0.63 -0.38 -0.05 0.00 0.05 0.00 0.00 54.13 54.39 1sjr s LEU 116 Cb -0.90 -0.99 0.06 0.00 -2.05 0.00 0.00 46.19 42.30 1sjr s LEU 116 CO 0.46 0.04 0.10 -0.13 -0.55 0.00 0.00 176.35 176.28 1sjr s ARG 117 N 0.73 2.48 0.14 1.48 1.81 -0.31 -3.31 118.95 121.97 1sjr s ARG 117 Ca -0.13 -1.32 -0.08 0.00 -1.72 0.00 0.00 55.73 52.49 1sjr s ARG 117 Cb -0.16 -3.43 -0.06 0.00 -0.45 0.00 0.00 34.95 30.85 1sjr s ARG 117 CO 0.03 -0.73 0.43 0.42 -0.68 0.00 0.00 175.30 174.76 1sjr s ILE 118 N 1.33 5.08 -0.02 1.52 1.01 -1.25 -0.64 121.20 128.22 1sjr s ILE 118 Ca -0.01 0.29 -0.28 0.00 0.00 0.00 0.00 60.65 60.65 1sjr s ILE 118 Cb -0.20 -3.63 0.06 0.00 0.01 0.00 0.00 42.46 38.70 1sjr s ILE 118 CO 0.01 0.10 0.61 1.51 0.00 0.00 0.00 174.94 177.17 1sjr s ASP 119 N -2.17 -0.57 -0.16 3.58 -4.77 -0.79 -4.87 116.67 106.92 1sjr s ASP 119 Ca 0.40 0.54 -0.29 0.00 -3.30 0.00 0.00 52.55 49.89 1sjr s ASP 119 Cb -0.13 0.51 -0.03 0.00 -1.09 0.00 0.00 42.92 42.18 1sjr s ASP 119 CO 0.22 -0.62 1.56 -0.36 0.70 0.00 0.00 175.17 176.66 1sjr s PHE 120 N -1.49 2.21 0.50 2.11 0.08 -1.26 0.18 117.98 120.31 1sjr s PHE 120 Ca -0.10 0.52 -0.21 0.00 0.12 0.00 0.00 56.93 57.26 1sjr s PHE 120 Cb -0.01 -3.87 -0.09 0.00 -0.57 0.00 0.00 43.02 38.48 1sjr s PHE 120 CO 0.07 -2.98 0.78 0.45 -0.10 0.00 0.00 175.22 173.44 1sjr n SER 121 N 7.68 0.13 0.04 1.36 2.88 0.69 -4.88 113.62 121.52 1sjr n SER 121 Ca 0.17 0.88 0.11 0.00 -1.33 0.00 0.00 58.87 58.71 1sjr n SER 121 Cb 0.44 -1.27 -0.06 0.00 -0.75 0.00 0.00 64.21 62.58 1sjr n SER 121 CO 0.00 0.00 0.00 0.29 -1.23 0.00 0.00 175.04 174.10 1sjr n LYS 122 N -0.07 0.53 -0.15 -1.46 5.02 -1.26 -4.00 118.16 116.77 1sjr n LYS 122 Ca 0.11 -0.03 0.03 0.00 -2.02 0.00 0.00 58.31 56.40 1sjr n LYS 122 Cb 0.43 -1.65 0.10 0.00 -0.02 0.00 0.00 35.03 33.90 1sjr n LYS 122 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 1sjr n LEU 123 N -2.31 1.49 -0.91 -0.35 4.77 -1.26 -4.85 117.00 113.58 1sjr n LEU 123 Ca -0.01 -0.75 -0.12 0.00 -0.03 0.00 0.00 56.01 55.10 1sjr n LEU 123 Cb 0.52 -0.25 -0.05 0.00 -2.33 0.00 0.00 43.42 41.31 1sjr n LEU 123 CO 0.42 0.31 -0.11 0.35 -1.33 0.00 0.00 177.39 177.03 1sjr n THR 124 N 0.16 0.00 0.00 -5.08 -2.24 -1.26 -4.79 114.28 101.07 1sjr n THR 124 Ca 0.08 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.86 1sjr n THR 124 Cb 0.27 -1.54 0.00 0.00 -2.10 0.00 0.00 70.33 66.96 1sjr n THR 124 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 1sjr n SER 125 N -1.17 0.00 -4.84 3.42 3.41 -1.26 -4.90 113.62 108.28 1sjr n SER 125 Ca -0.12 0.00 -0.22 0.00 -0.26 0.00 0.00 58.87 58.28 1sjr n SER 125 Cb 0.60 0.00 -0.04 0.00 -0.26 0.00 0.00 64.21 64.51 1sjr n SER 125 CO 0.00 0.00 0.00 -1.48 -0.16 0.00 0.00 175.04 173.40 1sjr s LEU 126 N 0.00 3.36 -0.75 1.04 0.05 -1.26 -4.85 118.68 116.28 1sjr s LEU 126 Ca 0.00 -0.77 -0.18 0.00 0.05 0.00 0.00 54.13 53.23 1sjr s LEU 126 Cb 0.00 -1.95 0.13 0.00 -2.05 0.00 0.00 46.19 42.32 1sjr s LEU 126 CO 0.00 -0.57 0.87 0.54 -0.55 0.00 0.00 176.35 176.64 1sjr s ASN 127 N -4.05 6.43 -0.25 1.48 4.22 -1.26 -4.98 114.94 116.52 1sjr s ASN 127 Ca 0.45 -1.83 -0.00 0.00 -2.14 0.00 0.00 52.86 49.34 1sjr s ASN 127 Cb -0.02 -2.32 0.07 0.00 1.28 0.00 0.00 41.25 40.26 1sjr s ASN 127 CO 0.26 -1.02 0.02 -0.69 -2.04 0.00 0.00 177.10 173.63 1sjr s VAL 128 N 2.31 1.13 0.00 3.54 1.01 -1.26 -4.93 120.40 122.20 1sjr s VAL 128 Ca 0.20 -1.18 0.06 0.00 0.00 0.00 0.00 61.98 61.06 1sjr s VAL 128 Cb -0.15 -1.62 0.09 0.00 0.00 0.00 0.00 36.38 34.70 1sjr s VAL 128 CO -0.01 -0.33 0.96 0.29 0.00 0.00 0.00 175.10 176.01 1sjr n LYS 129 N 4.79 0.00 -3.75 2.72 4.76 -1.26 -5.08 118.16 120.34 1sjr n LYS 129 Ca -0.07 -1.06 -0.10 0.00 -2.87 0.00 0.00 58.31 54.21 1sjr n LYS 129 Cb 0.44 -0.27 -0.05 0.00 -1.84 0.00 0.00 35.03 33.31 1sjr n LYS 129 CO 0.00 0.00 0.00 0.71 -1.37 0.00 0.00 177.40 176.74 1sjr s TYR 130 N 0.00 -0.02 -0.27 2.13 1.51 -1.26 -4.65 117.35 114.79 1sjr s TYR 130 Ca 0.07 -0.34 -0.02 0.00 -1.01 0.00 0.00 57.07 55.78 1sjr s TYR 130 Cb 0.08 0.15 0.09 0.00 -0.11 0.00 0.00 41.96 42.17 1sjr s TYR 130 CO -0.04 -0.69 0.07 1.21 -1.11 0.00 0.00 175.55 174.99 1sjr s ASN 131 N -2.85 3.65 0.00 2.29 3.84 0.20 -4.35 114.94 117.71 1sjr s ASN 131 Ca 0.06 -1.34 0.00 0.00 0.21 0.00 0.00 52.86 51.79 1sjr s ASN 131 Cb 0.02 -0.76 0.00 0.00 -0.55 0.00 0.00 41.25 39.96 1sjr s ASN 131 CO -0.09 -0.37 0.00 -0.46 -2.79 0.00 0.00 177.10 173.39 1sjr n ASN 132 N 4.93 0.00 0.00 -4.21 0.23 -1.13 -3.85 115.26 111.23 1sjr n ASN 132 Ca -0.05 0.00 0.00 0.00 -0.53 0.00 0.00 54.58 54.00 1sjr n ASN 132 Cb 0.44 0.00 0.00 0.00 -2.08 0.00 0.00 39.78 38.14 1sjr n ASN 132 CO 0.00 0.00 0.00 0.47 -0.93 0.00 0.00 177.26 176.80 1sjr n ASP 133 N -0.71 0.00 0.16 0.53 9.92 -1.26 -4.87 116.55 120.33 1sjr n ASP 133 Ca 0.00 0.00 0.03 0.00 -0.53 0.00 0.00 54.79 54.29 1sjr n ASP 133 Cb 0.00 0.01 0.24 0.00 -0.64 0.00 0.00 41.12 40.73 1sjr n ASP 133 CO 0.00 0.00 0.00 0.11 0.13 0.00 0.00 177.20 177.44 1sjr h LYS 134 N 0.00 0.00 -3.95 -1.24 1.57 -1.95 -3.43 116.57 107.57 1sjr h LYS 134 Ca 0.00 0.00 -0.46 0.00 -1.87 0.00 0.00 60.65 58.32 1sjr h LYS 134 Cb 0.00 0.00 -0.37 0.00 0.08 0.00 0.00 32.23 31.94 1sjr h LYS 134 CO 0.00 0.49 -0.78 -1.54 -0.57 0.00 0.00 179.45 177.05 1sjr s SER 135 N -6.57 1.66 -0.24 0.86 1.04 -1.26 -2.70 113.70 106.49 1sjr s SER 135 Ca 0.00 -0.17 0.01 0.00 0.48 0.00 0.00 55.95 56.28 1sjr s SER 135 Cb 0.11 -0.58 0.06 0.00 0.10 0.00 0.00 66.02 65.71 1sjr s SER 135 CO 0.72 -0.14 -0.08 -0.60 0.98 0.00 0.00 173.24 174.12 1sjr s ARG 136 N 1.65 1.90 0.07 4.02 6.06 0.26 -2.85 118.95 130.07 1sjr s ARG 136 Ca 0.01 -1.08 0.03 0.00 -2.50 0.00 0.00 55.73 52.20 1sjr s ARG 136 Cb -0.13 -2.66 -0.04 0.00 0.06 0.00 0.00 34.95 32.18 1sjr s ARG 136 CO -0.05 -0.56 0.04 0.16 -2.50 0.00 0.00 175.30 172.40 1sjr s ASP 137 N 1.30 5.30 -0.43 -2.12 1.47 -1.26 0.72 116.67 121.64 1sjr s ASP 137 Ca -0.06 -0.06 0.09 0.00 1.18 0.00 0.00 52.55 53.70 1sjr s ASP 137 Cb -0.19 -1.37 0.41 0.00 -0.34 0.00 0.00 42.92 41.44 1sjr s ASP 137 CO -0.06 0.19 1.01 -1.22 0.68 0.00 0.00 175.17 175.77 1sjr n TYR 138 N 0.66 2.71 0.00 2.11 4.01 0.11 -4.61 117.16 122.16 1sjr n TYR 138 Ca -0.10 -3.25 0.00 0.00 -0.16 0.00 0.00 57.90 54.39 1sjr n TYR 138 Cb 0.52 -0.25 0.00 0.00 -0.31 0.00 0.00 39.34 39.30 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 -0.28 0.00 -3.10 -0.72 5.66 -1.26 -4.78 114.28 109.80 1sjr n THR 139 Ca 0.29 0.00 -0.17 0.00 -3.05 0.00 0.00 64.05 61.12 1sjr n THR 139 Cb 0.65 -0.21 -0.02 0.00 -1.55 0.00 0.00 70.33 69.20 1sjr n THR 139 CO 0.00 0.00 0.00 0.54 -3.05 0.00 0.00 175.07 172.56 1sjr n ARG 140 N -2.07 1.09 -0.42 1.09 5.12 -1.26 -4.95 116.66 115.25 1sjr n ARG 140 Ca 0.00 -3.42 0.37 0.00 -1.93 0.00 0.00 57.85 52.86 1sjr n ARG 140 Cb 0.00 -1.67 0.56 0.00 -1.16 0.00 0.00 32.46 30.19 1sjr n ARG 140 CO 0.00 0.00 0.00 -2.30 -1.93 0.00 0.00 177.63 173.40 1sjr n PRO 141 N 0.21 0.01 -0.62 5.56 -0.02 -1.26 -1.02 135.00 137.85 1sjr n PRO 141 Ca 0.23 0.93 0.48 0.00 -2.02 0.00 0.00 63.50 63.12 1sjr n PRO 141 Cb 0.67 -2.22 0.74 0.00 -0.02 0.00 0.00 33.50 32.67 1sjr n PRO 141 CO 0.00 0.00 0.00 -0.25 1.98 0.00 0.00 175.50 177.23 1sjr n ASP 142 N -3.36 0.00 -3.65 2.55 8.00 -1.26 -4.59 116.55 114.23 1sjr n ASP 142 Ca 0.30 0.92 -0.33 0.00 0.71 0.00 0.00 54.79 56.39 1sjr n ASP 142 Cb 1.58 -0.45 0.02 0.00 -0.02 0.00 0.00 41.12 42.26 1sjr n ASP 142 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 1sjr n LEU 143 N -3.75 -4.18 -4.62 0.64 7.99 -0.19 -4.93 117.00 107.97 1sjr n LEU 143 Ca 0.40 0.39 -0.30 0.00 -0.01 0.00 0.00 56.01 56.49 1sjr n LEU 143 Cb 1.88 -0.71 0.24 0.00 -0.11 0.00 0.00 43.42 44.71 1sjr n LEU 143 CO 0.40 -4.73 0.64 -2.16 -1.51 0.00 0.00 177.39 170.04 1sjr s PRO 144 N -1.28 -1.12 -0.37 3.23 0.04 -1.26 -4.54 135.00 129.70 1sjr s PRO 144 Ca 0.44 -0.11 0.10 0.00 0.04 0.00 0.00 61.00 61.47 1sjr s PRO 144 Cb -0.31 -1.61 0.45 0.00 0.04 0.00 0.00 34.50 33.06 1sjr s PRO 144 CO 0.65 -3.64 1.08 0.45 0.04 0.00 0.00 177.00 175.58 1sjr n SER 145 N -4.70 3.60 -4.49 6.66 2.88 -1.25 0.60 113.62 116.92 1sjr n SER 145 Ca 0.14 -3.30 -0.17 0.00 -1.33 0.00 0.00 58.87 54.21 1sjr n SER 145 Cb 0.60 -0.46 -0.15 0.00 -0.75 0.00 0.00 64.21 63.45 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 -0.42 -0.33 3.23 0.46 0.00 -1.26 -4.89 105.19 101.97 1sjr n GLY 146 Ca 0.29 0.11 0.00 0.00 0.00 0.00 0.00 46.02 46.42 1sjr n GLY 146 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66