#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 -1.18 -2.36 3.04 0.00 -1.26 -3.27 120.51 115.48 1sjr n ALA 41 Ca 0.00 0.00 -0.20 0.00 0.00 0.00 0.00 53.44 53.24 1sjr n ALA 41 Cb 0.00 -2.02 -0.01 0.00 0.00 0.00 0.00 19.45 17.42 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 -1.16 -0.38 3.67 0.00 0.00 -1.26 -3.05 105.19 103.02 1sjr n GLY 42 Ca -0.11 -0.03 -0.28 0.00 0.00 0.00 0.00 46.02 45.60 1sjr n GLY 42 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 1sjr n GLN 43 N -2.94 -1.17 -3.72 1.61 7.27 -1.20 -4.94 117.38 112.29 1sjr n GLN 43 Ca -0.24 0.60 -0.37 0.00 0.07 0.00 0.00 57.00 57.06 1sjr n GLN 43 Cb 0.68 -3.79 -0.10 0.00 2.41 0.00 0.00 30.24 29.44 1sjr n GLN 43 CO 0.00 0.00 0.00 -1.54 0.07 0.00 0.00 177.06 175.59 1sjr s SER 44 N -3.32 5.36 -1.11 1.69 1.04 -1.17 -4.95 113.70 111.23 1sjr s SER 44 Ca 0.33 -2.20 -0.21 0.00 0.48 0.00 0.00 55.95 54.35 1sjr s SER 44 Cb -0.13 -1.87 0.06 0.00 0.10 0.00 0.00 66.02 64.18 1sjr s SER 44 CO 0.87 -0.54 1.54 -2.16 0.98 0.00 0.00 173.24 173.93 1sjr s PRO 45 N 0.91 3.72 -0.20 4.02 0.04 -1.26 -4.90 135.00 137.33 1sjr s PRO 45 Ca 0.10 -1.43 -0.04 0.00 0.04 0.00 0.00 61.00 59.67 1sjr s PRO 45 Cb -0.23 -5.41 0.08 0.00 0.04 0.00 0.00 34.50 28.98 1sjr s PRO 45 CO -0.03 -2.22 0.14 0.08 0.04 0.00 0.00 177.00 175.01 1sjr s VAL 46 N 4.67 -0.16 0.24 -0.36 1.01 -1.26 -1.43 120.40 123.11 1sjr s VAL 46 Ca 0.48 -0.26 -0.01 0.00 0.00 0.00 0.00 61.98 62.19 1sjr s VAL 46 Cb 0.01 -0.68 -0.04 0.00 0.00 0.00 0.00 36.38 35.67 1sjr s VAL 46 CO -0.04 -0.34 0.44 -0.76 0.00 0.00 0.00 175.10 174.40 1sjr s LEU 47 N 2.19 4.17 -0.26 3.92 1.43 -0.12 0.42 118.68 130.43 1sjr s LEU 47 Ca 0.05 0.46 -0.02 0.00 -1.03 0.00 0.00 54.13 53.58 1sjr s LEU 47 Cb -0.16 -3.25 0.08 0.00 0.03 0.00 0.00 46.19 42.89 1sjr s LEU 47 CO -0.15 -0.11 0.07 -0.60 0.23 0.00 0.00 176.35 175.79 1sjr s ARG 48 N -3.52 0.61 0.19 1.70 3.52 0.50 -1.20 118.95 120.76 1sjr s ARG 48 Ca 0.40 -0.70 -0.24 0.00 -0.13 0.00 0.00 55.73 55.05 1sjr s ARG 48 Cb -0.11 -1.92 -0.08 0.00 -1.56 0.00 0.00 34.95 31.28 1sjr s ARG 48 CO 0.30 -0.84 0.78 0.42 -0.81 0.00 0.00 175.30 175.15 1sjr s ILE 49 N 1.80 4.40 -0.02 4.11 1.01 0.23 -2.38 121.20 130.35 1sjr s ILE 49 Ca 0.05 1.62 -0.00 0.00 0.00 0.00 0.00 60.65 62.31 1sjr s ILE 49 Cb -0.17 -4.06 0.02 0.00 0.01 0.00 0.00 42.46 38.26 1sjr s ILE 49 CO -0.19 0.42 0.03 -0.63 0.00 0.00 0.00 174.94 174.56 1sjr s ILE 50 N -1.28 -0.05 0.39 2.92 1.01 -0.28 -0.25 121.20 123.67 1sjr s ILE 50 Ca 0.39 0.17 -0.13 0.00 0.00 0.00 0.00 60.65 61.08 1sjr s ILE 50 Cb -0.21 -0.07 -0.07 0.00 0.01 0.00 0.00 42.46 42.12 1sjr s ILE 50 CO 0.25 0.07 0.79 0.54 0.00 0.00 0.00 174.94 176.59 1sjr s VAL 51 N 0.85 4.72 -0.18 2.92 0.11 -0.86 -0.19 120.40 127.77 1sjr s VAL 51 Ca -0.07 0.80 -0.02 0.00 -2.93 0.00 0.00 61.98 59.75 1sjr s VAL 51 Cb -0.10 -3.69 0.05 0.00 -1.53 0.00 0.00 36.38 31.11 1sjr s VAL 51 CO -0.02 -0.44 0.02 -1.61 -3.33 0.00 0.00 175.10 169.71 1sjr s GLU 52 N -3.62 0.78 0.00 1.54 2.02 -0.54 -4.78 118.70 114.10 1sjr s GLU 52 Ca 0.53 -0.39 0.00 0.00 0.02 0.00 0.00 54.97 55.13 1sjr s GLU 52 Cb -0.10 -1.97 0.00 0.00 0.10 0.00 0.00 34.13 32.16 1sjr s GLU 52 CO 0.27 -0.57 0.00 0.09 0.02 0.00 0.00 175.26 175.07 1sjr n ASN 53 N 5.03 -1.98 -4.67 -0.19 3.02 -1.26 -3.91 115.26 111.30 1sjr n ASN 53 Ca -0.09 0.00 -0.57 0.00 -0.03 0.00 0.00 54.58 53.89 1sjr n ASN 53 Cb 0.47 -0.99 -0.07 0.00 -0.61 0.00 0.00 39.78 38.58 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 -0.68 1.91 0.00 3.41 -0.00 -1.26 -4.54 117.00 115.85 1sjr n LEU 54 Ca 0.00 1.10 0.00 0.00 -0.00 0.00 0.00 56.01 57.11 1sjr n LEU 54 Cb 0.18 -1.12 0.00 0.00 -0.00 0.00 0.00 43.42 42.48 1sjr n LEU 54 CO 0.00 -0.74 -0.13 0.33 -0.00 0.00 0.00 177.39 176.85 1sjr n PHE 55 N 4.18 0.00 -4.31 1.96 7.35 -1.26 -5.07 117.46 120.30 1sjr n PHE 55 Ca 0.24 0.00 -0.20 0.00 -0.76 0.00 0.00 57.45 56.73 1sjr n PHE 55 Cb 0.13 0.11 -0.13 0.00 0.35 0.00 0.00 39.48 39.94 1sjr n PHE 55 CO 0.00 0.00 0.00 0.71 -0.76 0.00 0.00 176.76 176.71 1sjr s TYR 56 N -1.49 1.26 -0.27 -5.13 2.02 -1.26 -5.11 117.35 107.38 1sjr s TYR 56 Ca 0.00 -0.38 -0.29 0.00 -0.37 0.00 0.00 57.07 56.03 1sjr s TYR 56 Cb 0.00 -0.74 -0.02 0.00 -0.40 0.00 0.00 41.96 40.81 1sjr s TYR 56 CO 0.00 0.05 1.54 -1.25 -1.57 0.00 0.00 175.55 174.32 1sjr s PRO 57 N -1.32 3.76 0.52 -1.71 0.04 -1.26 -5.01 135.00 130.03 1sjr s PRO 57 Ca 0.01 1.47 0.06 0.00 0.04 0.00 0.00 61.00 62.59 1sjr s PRO 57 Cb -0.08 -4.01 0.09 0.00 0.04 0.00 0.00 34.50 30.54 1sjr s PRO 57 CO 0.02 -1.33 0.72 1.33 0.04 0.00 0.00 177.00 177.78 1sjr n VAL 58 N 6.51 0.00 -3.81 -0.36 0.24 -1.26 -5.14 118.33 114.51 1sjr n VAL 58 Ca 0.18 -1.58 -0.09 0.00 -2.04 0.00 0.00 64.34 60.82 1sjr n VAL 58 Cb 0.46 -0.68 0.02 0.00 -1.47 0.00 0.00 33.84 32.18 1sjr n VAL 58 CO 0.00 0.00 0.00 0.28 -2.14 0.00 0.00 176.83 174.97 1sjr s THR 59 N -2.19 0.00 -0.07 3.34 -1.32 -1.26 -5.07 115.64 109.06 1sjr s THR 59 Ca 0.53 -0.98 -0.24 0.00 -1.21 0.00 0.00 61.69 59.78 1sjr s THR 59 Cb -0.04 -2.88 -0.20 0.00 -1.51 0.00 0.00 72.50 67.87 1sjr s THR 59 CO 0.34 0.00 0.92 -0.07 -2.21 0.00 0.00 174.62 173.60 1sjr h LEU 60 N 2.00 -0.06 -1.71 9.08 4.07 -1.99 -3.09 115.31 123.61 1sjr h LEU 60 Ca -0.32 -0.59 0.47 0.00 0.08 0.00 0.00 57.88 57.52 1sjr h LEU 60 Cb 1.25 0.02 -0.06 0.00 1.08 0.00 0.00 40.66 42.94 1sjr h LEU 60 CO 0.40 0.62 1.31 0.44 -1.08 0.00 0.00 178.44 180.14 1sjr h ASP 61 N -0.80 0.00 0.00 -0.43 3.32 -1.99 0.37 116.42 116.89 1sjr h ASP 61 Ca -0.01 0.00 -0.01 0.00 0.02 0.00 0.00 57.03 57.03 1sjr h ASP 61 Cb 0.65 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 40.19 1sjr h ASP 61 CO 0.01 0.00 -0.11 0.58 -1.72 0.00 0.00 179.24 178.00 1sjr h VAL 62 N 0.00 0.83 -0.65 -1.35 2.07 -1.98 -3.00 116.25 112.16 1sjr h VAL 62 Ca 0.77 -1.65 0.10 0.00 0.82 0.00 0.00 66.70 66.74 1sjr h VAL 62 Cb 3.39 1.59 -0.04 0.00 -1.52 0.00 0.00 31.29 34.71 1sjr h VAL 62 CO -0.01 0.28 0.44 0.17 0.02 0.00 0.00 177.57 178.47 1sjr h LEU 63 N -1.00 0.44 0.69 2.57 8.10 -0.36 -0.42 115.31 125.32 1sjr h LEU 63 Ca -0.02 0.01 -0.03 0.00 0.11 0.00 0.00 57.88 57.95 1sjr h LEU 63 Cb 0.54 -0.08 0.01 0.00 -0.44 0.00 0.00 40.66 40.69 1sjr h LEU 63 CO -0.01 0.26 -0.33 -0.74 -4.11 0.00 0.00 178.44 173.51 1sjr h HIS 64 N 0.49 -0.85 0.00 0.17 2.76 -0.75 -2.62 115.15 114.34 1sjr h HIS 64 Ca 0.30 -0.02 0.00 0.00 -2.20 0.00 0.00 60.37 58.45 1sjr h HIS 64 Cb 0.53 0.28 0.00 0.00 1.55 0.00 0.00 27.41 29.77 1sjr h HIS 64 CO -0.00 -0.53 0.00 1.04 -1.30 0.00 0.00 177.93 177.14 1sjr n GLN 65 N -5.34 0.09 0.01 5.26 1.13 -1.05 0.38 117.38 117.87 1sjr n GLN 65 Ca -0.11 0.56 -0.01 0.00 -1.94 0.00 0.00 57.00 55.49 1sjr n GLN 65 Cb 0.36 -1.79 -0.01 0.00 0.11 0.00 0.00 30.24 28.92 1sjr n GLN 65 CO 0.00 0.00 0.00 0.82 -1.44 0.00 0.00 177.06 176.44 1sjr h ILE 66 N 0.00 0.00 0.02 5.09 2.04 -0.86 -3.37 117.51 120.43 1sjr h ILE 66 Ca 0.00 -0.29 -0.21 0.00 1.00 0.00 0.00 64.86 65.36 1sjr h ILE 66 Cb 0.04 0.00 -0.01 0.00 -0.74 0.00 0.00 36.82 36.11 1sjr h ILE 66 CO 0.00 0.00 -0.94 -0.26 0.00 0.00 0.00 178.15 176.95 1sjr h PHE 67 N -0.37 0.28 -0.97 1.37 -1.00 -1.37 -3.22 116.94 111.67 1sjr h PHE 67 Ca -0.01 -0.17 0.28 0.00 2.81 0.00 0.00 57.97 60.89 1sjr h PHE 67 Cb 0.06 -0.03 -0.04 0.00 3.61 0.00 0.00 35.95 39.55 1sjr h PHE 67 CO 0.02 1.01 1.02 1.03 -1.61 0.00 0.00 178.31 179.79 1sjr h SER 68 N 0.09 0.00 -0.10 2.17 0.87 -0.16 1.05 113.55 117.47 1sjr h SER 68 Ca -0.05 0.00 -0.17 0.00 -1.23 0.00 0.00 61.79 60.34 1sjr h SER 68 Cb 1.59 0.00 0.01 0.00 -0.44 0.00 0.00 62.40 63.56 1sjr h SER 68 CO 0.14 0.00 -0.59 0.50 -0.53 0.00 0.00 176.83 176.35 1sjr h LYS 69 N 0.00 0.58 0.00 2.24 3.64 -1.71 -2.93 116.57 118.39 1sjr h LYS 69 Ca 0.46 -0.49 0.00 0.00 -1.27 0.00 0.00 60.65 59.35 1sjr h LYS 69 Cb 2.50 0.11 0.00 0.00 -0.41 0.00 0.00 32.23 34.43 1sjr h LYS 69 CO -0.00 1.11 0.00 1.19 -2.27 0.00 0.00 179.45 179.48 1sjr n PHE 70 N -4.15 0.00 0.00 1.91 3.72 0.36 -4.89 117.46 114.40 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 0.65 -0.33 0.00 0.00 -0.94 0.00 0.00 39.48 38.85 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 1.99 3.69 1.37 0.00 -0.85 -4.62 105.19 107.02 1sjr n GLY 71 Ca 0.08 -0.99 -0.42 0.00 0.00 0.00 0.00 46.02 44.69 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 3.85 -0.52 2.61 2.01 -1.26 -3.78 115.64 116.55 1sjr s THR 72 Ca 0.00 1.21 -0.20 0.00 0.31 0.00 0.00 61.69 63.01 1sjr s THR 72 Cb 0.00 -3.78 0.06 0.00 0.01 0.00 0.00 72.50 68.79 1sjr s THR 72 CO 0.00 -0.01 0.67 -0.69 -0.69 0.00 0.00 174.62 173.90 1sjr s VAL 73 N 2.44 4.81 0.16 3.82 1.01 -1.26 -3.08 120.40 128.30 1sjr s VAL 73 Ca 0.62 -0.46 -0.15 0.00 0.00 0.00 0.00 61.98 61.98 1sjr s VAL 73 Cb -0.30 -4.35 0.04 0.00 0.00 0.00 0.00 36.38 31.77 1sjr s VAL 73 CO 0.25 -0.88 1.81 -0.07 0.00 0.00 0.00 175.10 176.21 1sjr h LEU 74 N 9.89 0.47 -8.43 3.92 4.07 -1.72 -3.41 115.31 120.11 1sjr h LEU 74 Ca -0.28 -0.00 -0.17 0.00 0.08 0.00 0.00 57.88 57.51 1sjr h LEU 74 Cb 1.09 -0.11 -0.11 0.00 1.08 0.00 0.00 40.66 42.62 1sjr h LEU 74 CO 0.99 0.34 -0.30 -0.54 -1.08 0.00 0.00 178.44 177.86 1sjr s LYS 75 N -6.15 1.53 -0.25 1.13 3.01 -1.26 -1.61 119.74 116.13 1sjr s LYS 75 Ca -0.13 -1.50 -0.22 0.00 -1.01 0.00 0.00 55.97 53.12 1sjr s LYS 75 Cb 0.12 0.40 0.07 0.00 -1.01 0.00 0.00 37.83 37.40 1sjr s LYS 75 CO 0.73 -0.60 0.67 0.42 0.51 0.00 0.00 175.35 177.08 1sjr s ILE 76 N -3.84 -0.00 0.05 2.17 1.01 0.15 -2.92 121.20 117.83 1sjr s ILE 76 Ca 0.30 0.00 -0.02 0.00 0.00 0.00 0.00 60.65 60.93 1sjr s ILE 76 Cb 0.02 -0.94 -0.03 0.00 0.01 0.00 0.00 42.46 41.52 1sjr s ILE 76 CO 0.13 0.00 -0.00 -0.63 0.00 0.00 0.00 174.94 174.44 1sjr s ILE 77 N 0.63 0.21 0.01 2.92 1.01 -0.69 0.33 121.20 125.62 1sjr s ILE 77 Ca -0.02 -1.70 -0.10 0.00 0.00 0.00 0.00 60.65 58.83 1sjr s ILE 77 Cb -0.05 -1.45 0.01 0.00 0.01 0.00 0.00 42.46 40.98 1sjr s ILE 77 CO -0.03 -0.94 0.20 0.42 0.00 0.00 0.00 174.94 174.59 1sjr s THR 78 N -3.81 0.09 -0.09 2.92 -4.23 0.68 -1.00 115.64 110.20 1sjr s THR 78 Ca 0.06 -0.71 -0.30 0.00 -1.18 0.00 0.00 61.69 59.56 1sjr s THR 78 Cb 0.07 -0.64 0.11 0.00 1.34 0.00 0.00 72.50 73.38 1sjr s THR 78 CO -0.10 -0.39 0.94 0.72 -0.54 0.00 0.00 174.62 175.26 1sjr s PHE 79 N -1.78 -0.36 -0.40 3.99 -0.12 -0.22 -4.71 117.98 114.38 1sjr s PHE 79 Ca -0.11 0.44 -0.11 0.00 -0.05 0.00 0.00 56.93 57.09 1sjr s PHE 79 Cb -0.05 0.49 0.05 0.00 -0.63 0.00 0.00 43.02 42.88 1sjr s PHE 79 CO 0.00 -0.44 0.25 0.99 -0.05 0.00 0.00 175.22 175.97 1sjr s THR 80 N -2.08 4.55 -1.19 -4.49 2.01 -1.25 -0.49 115.64 112.69 1sjr s THR 80 Ca 0.01 -1.06 -0.13 0.00 0.31 0.00 0.00 61.69 60.83 1sjr s THR 80 Cb -0.01 -3.64 0.20 0.00 0.01 0.00 0.00 72.50 69.06 1sjr s THR 80 CO -0.03 -0.37 1.37 1.17 -0.69 0.00 0.00 174.62 176.07 1sjr n LYS 81 N 5.00 3.41 -2.00 4.92 3.00 -0.77 -4.41 118.16 127.32 1sjr n LYS 81 Ca -0.11 -3.99 -0.02 0.00 -0.00 0.00 0.00 58.31 54.19 1sjr n LYS 81 Cb 0.45 -2.93 0.01 0.00 0.00 0.00 0.00 35.03 32.56 1sjr n LYS 81 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.40 175.69 1sjr n ASN 82 N 4.92 -3.61 -3.80 3.14 5.15 -1.26 -3.92 115.26 115.87 1sjr n ASN 82 Ca 0.34 -0.11 -0.26 0.00 -0.60 0.00 0.00 54.58 53.95 1sjr n ASN 82 Cb 0.42 -2.15 0.03 0.00 -0.53 0.00 0.00 39.78 37.55 1sjr n ASN 82 CO 0.00 0.00 0.00 -0.46 1.40 0.00 0.00 177.26 178.20 1sjr n ASN 83 N -1.58 -3.18 -3.62 1.20 0.23 -1.26 -4.97 115.26 102.08 1sjr n ASN 83 Ca -0.01 -0.79 -0.29 0.00 -0.53 0.00 0.00 54.58 52.96 1sjr n ASN 83 Cb 0.52 -4.01 -0.15 0.00 -2.08 0.00 0.00 39.78 34.05 1sjr n ASN 83 CO 0.00 0.00 0.00 -1.58 -0.93 0.00 0.00 177.26 174.75 1sjr s GLN 84 N -6.31 0.43 -0.15 -3.83 0.74 -1.25 -4.97 119.66 104.32 1sjr s GLN 84 Ca 0.35 -0.79 -0.29 0.00 0.05 0.00 0.00 55.36 54.68 1sjr s GLN 84 Cb -0.18 -1.53 -0.05 0.00 1.10 0.00 0.00 33.01 32.36 1sjr s GLN 84 CO 0.82 -1.01 1.91 0.12 -0.55 0.00 0.00 175.29 176.58 1sjr s PHE 85 N 1.86 1.57 0.00 1.67 2.19 -1.26 -1.84 117.98 122.17 1sjr s PHE 85 Ca 0.10 0.26 0.08 0.00 0.33 0.00 0.00 56.93 57.70 1sjr s PHE 85 Cb -0.17 -4.04 -0.02 0.00 -1.31 0.00 0.00 43.02 37.48 1sjr s PHE 85 CO -0.31 -4.04 -0.26 -0.65 1.83 0.00 0.00 175.22 171.80 1sjr s GLN 86 N 5.17 1.97 -0.16 10.12 -0.21 0.35 -2.04 119.66 134.86 1sjr s GLN 86 Ca 0.86 -0.98 -0.04 0.00 0.02 0.00 0.00 55.36 55.22 1sjr s GLN 86 Cb -0.32 -1.98 0.06 0.00 1.00 0.00 0.00 33.01 31.76 1sjr s GLN 86 CO 0.35 0.53 0.07 0.00 -2.12 0.00 0.00 175.29 174.12 1sjr s ALA 87 N -0.67 0.56 0.31 6.09 0.00 0.66 -1.05 121.76 127.66 1sjr s ALA 87 Ca 0.10 -0.36 0.07 0.00 0.00 0.00 0.00 51.96 51.77 1sjr s ALA 87 Cb -0.10 -1.03 -0.02 0.00 0.00 0.00 0.00 23.12 21.97 1sjr s ALA 87 CO 0.00 -1.10 0.35 -0.51 0.00 0.00 0.00 175.76 174.50 1sjr s LEU 88 N 2.07 3.84 -0.02 0.00 1.43 -0.17 0.76 118.68 126.59 1sjr s LEU 88 Ca 0.02 -0.29 -0.29 0.00 -1.03 0.00 0.00 54.13 52.53 1sjr s LEU 88 Cb -0.16 -2.49 0.08 0.00 0.03 0.00 0.00 46.19 43.66 1sjr s LEU 88 CO -0.08 -0.30 0.74 -1.48 0.23 0.00 0.00 176.35 175.45 1sjr s LEU 89 N -4.03 -0.56 0.05 1.79 0.05 -0.34 -1.70 118.68 113.94 1sjr s LEU 89 Ca 0.40 0.43 0.04 0.00 0.05 0.00 0.00 54.13 55.06 1sjr s LEU 89 Cb -0.08 2.39 -0.04 0.00 -2.05 0.00 0.00 46.19 46.42 1sjr s LEU 89 CO 0.28 -0.65 -0.05 -1.58 -0.55 0.00 0.00 176.35 173.80 1sjr s GLN 90 N -1.94 2.48 0.27 1.48 0.74 -1.15 -0.95 119.66 120.59 1sjr s GLN 90 Ca -0.05 -0.81 0.09 0.00 0.05 0.00 0.00 55.36 54.64 1sjr s GLN 90 Cb -0.00 -2.48 -0.04 0.00 1.10 0.00 0.00 33.01 31.58 1sjr s GLN 90 CO 0.02 0.57 0.04 0.71 -0.55 0.00 0.00 175.29 176.07 1sjr s TYR 91 N -1.13 2.76 -0.78 1.67 2.02 -0.51 -1.96 117.35 119.41 1sjr s TYR 91 Ca 0.20 -0.22 0.25 0.00 -0.37 0.00 0.00 57.07 56.94 1sjr s TYR 91 Cb -0.11 -1.26 0.53 0.00 -0.40 0.00 0.00 41.96 40.72 1sjr s TYR 91 CO 0.12 0.59 1.45 0.00 -1.57 0.00 0.00 175.55 176.14 1sjr n ALA 92 N -0.96 2.97 -3.69 3.71 0.00 -1.18 -4.75 120.51 116.62 1sjr n ALA 92 Ca -0.06 -0.24 -0.12 0.00 0.00 0.00 0.00 53.44 53.02 1sjr n ALA 92 Cb 0.59 -1.22 -0.12 0.00 0.00 0.00 0.00 19.45 18.70 1sjr n ALA 92 CO 0.00 0.00 0.00 0.16 0.00 0.00 0.00 177.50 177.66 1sjr s ASP 93 N -3.79 -0.09 0.48 0.00 -4.77 -1.26 -5.03 116.67 102.21 1sjr s ASP 93 Ca 0.09 0.71 0.24 0.00 -3.30 0.00 0.00 52.55 50.28 1sjr s ASP 93 Cb 0.15 0.75 1.29 0.00 -1.09 0.00 0.00 42.92 44.02 1sjr s ASP 93 CO 0.68 -0.21 1.89 -0.65 0.70 0.00 0.00 175.17 177.59 1sjr h PRO 94 N 7.75 0.18 -0.32 2.11 0.11 -1.92 0.70 132.00 140.61 1sjr h PRO 94 Ca -0.26 -0.01 0.08 0.00 0.11 0.00 0.00 66.00 65.92 1sjr h PRO 94 Cb 1.14 -0.04 -0.01 0.00 0.11 0.00 0.00 31.00 32.19 1sjr h PRO 94 CO 0.23 0.12 0.23 0.28 -0.21 0.00 0.00 178.00 178.64 1sjr h VAL 95 N 0.18 0.88 0.14 3.15 2.07 -1.99 0.21 116.25 120.90 1sjr h VAL 95 Ca 0.41 -0.03 -0.29 0.00 0.82 0.00 0.00 66.70 67.61 1sjr h VAL 95 Cb 1.34 0.79 0.01 0.00 -1.52 0.00 0.00 31.29 31.90 1sjr h VAL 95 CO -0.08 0.02 -1.38 0.28 0.02 0.00 0.00 177.57 176.42 1sjr h SER 96 N 0.09 0.47 -0.19 0.57 0.02 -1.11 -3.07 113.55 110.32 1sjr h SER 96 Ca 0.15 -0.55 -0.10 0.00 -0.84 0.00 0.00 61.79 60.44 1sjr h SER 96 Cb 0.49 -0.15 -0.00 0.00 0.14 0.00 0.00 62.40 62.87 1sjr h SER 96 CO -0.01 1.44 -0.28 0.00 -1.14 0.00 0.00 176.83 176.83 1sjr h ALA 97 N 0.49 0.30 0.63 3.77 0.00 -1.14 0.15 119.26 123.45 1sjr h ALA 97 Ca -0.19 -0.40 -0.03 0.00 0.00 0.00 0.00 54.91 54.29 1sjr h ALA 97 Cb 2.02 -0.06 0.01 0.00 0.00 0.00 0.00 17.79 19.76 1sjr h ALA 97 CO 0.20 0.30 -0.31 1.96 0.00 0.00 0.00 179.25 181.41 1sjr h GLN 98 N 0.20 -0.82 -0.02 0.00 1.08 -0.76 -0.89 115.11 113.90 1sjr h GLN 98 Ca 0.02 0.06 -0.00 0.00 -1.45 0.00 0.00 58.65 57.27 1sjr h GLN 98 Cb 0.86 0.19 -0.00 0.00 -0.05 0.00 0.00 27.48 28.48 1sjr h GLN 98 CO 0.07 -0.55 0.00 0.45 -0.95 0.00 0.00 178.83 177.85 1sjr h HIS 99 N -0.85 0.03 -0.92 2.96 3.86 -1.62 -2.76 115.15 115.85 1sjr h HIS 99 Ca -0.09 -0.00 0.24 0.00 -1.16 0.00 0.00 60.37 59.36 1sjr h HIS 99 Cb 0.65 -0.01 -0.06 0.00 1.06 0.00 0.00 27.41 29.06 1sjr h HIS 99 CO -0.03 0.26 0.63 0.00 0.86 0.00 0.00 177.93 179.65 1sjr h ALA 100 N 0.77 2.49 0.61 2.45 0.00 -0.69 0.49 119.26 125.37 1sjr h ALA 100 Ca 0.01 0.00 -0.03 0.00 0.00 0.00 0.00 54.91 54.89 1sjr h ALA 100 Cb 0.25 0.02 0.01 0.00 0.00 0.00 0.00 17.79 18.06 1sjr h ALA 100 CO 0.00 -0.78 -0.29 -0.22 0.00 0.00 0.00 179.25 177.96 1sjr h LYS 101 N 0.23 -0.79 0.00 0.00 3.64 -0.86 -2.13 116.57 116.66 1sjr h LYS 101 Ca 0.47 0.05 -0.05 0.00 -1.27 0.00 0.00 60.65 59.85 1sjr h LYS 101 Cb 1.45 0.18 -0.01 0.00 -0.41 0.00 0.00 32.23 33.45 1sjr h LYS 101 CO -0.12 -0.48 -0.25 -0.07 -2.27 0.00 0.00 179.45 176.27 1sjr h LEU 102 N -1.00 0.00 -1.16 5.20 3.38 -1.22 0.55 115.31 121.06 1sjr h LEU 102 Ca -0.08 0.00 -0.09 0.00 0.09 0.00 0.00 57.88 57.80 1sjr h LEU 102 Cb 0.68 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.41 1sjr h LEU 102 CO 0.14 0.25 -0.40 -1.28 0.09 0.00 0.00 178.44 177.24 1sjr h SER 103 N 0.00 0.04 0.00 -0.43 0.87 0.06 -3.14 113.55 110.94 1sjr h SER 103 Ca -0.00 -0.02 0.00 0.00 -1.23 0.00 0.00 61.79 60.54 1sjr h SER 103 Cb 0.68 -0.01 0.00 0.00 -0.44 0.00 0.00 62.40 62.63 1sjr h SER 103 CO 0.03 0.44 -0.04 0.18 -0.53 0.00 0.00 176.83 176.91 1sjr n LEU 104 N -4.06 1.79 -4.70 2.23 4.77 -0.81 -4.99 117.00 111.23 1sjr n LEU 104 Ca -0.02 -2.13 -0.42 0.00 -0.03 0.00 0.00 56.01 53.42 1sjr n LEU 104 Cb 0.43 -0.15 -0.03 0.00 -2.33 0.00 0.00 43.42 41.34 1sjr n LEU 104 CO 0.40 0.51 1.13 1.51 -1.33 0.00 0.00 177.39 179.61 1sjr s ASP 105 N -1.57 6.80 -1.48 -1.43 -4.77 0.19 -3.01 116.67 111.39 1sjr s ASP 105 Ca 0.11 2.27 -0.10 0.00 -3.30 0.00 0.00 52.55 51.53 1sjr s ASP 105 Cb 0.10 -2.57 0.06 0.00 -1.09 0.00 0.00 42.92 39.42 1sjr s ASP 105 CO 0.01 -0.72 0.91 0.61 0.70 0.00 0.00 175.17 176.68 1sjr n GLY 106 N 3.64 -0.44 3.75 2.12 0.00 -1.25 -4.98 105.19 108.03 1sjr n GLY 106 Ca 0.13 0.18 -0.29 0.00 0.00 0.00 0.00 46.02 46.04 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 -6.48 2.17 0.48 1.61 -1.52 -1.17 -4.98 119.66 109.77 1sjr s GLN 107 Ca 0.50 -2.13 0.08 0.00 -1.95 0.00 0.00 55.36 51.86 1sjr s GLN 107 Cb -0.25 -1.77 0.02 0.00 -0.22 0.00 0.00 33.01 30.78 1sjr s GLN 107 CO 0.83 -0.28 0.49 -0.80 -0.25 0.00 0.00 175.29 175.29 1sjr s ASN 108 N -3.92 5.04 -0.21 5.90 0.01 -1.26 -2.21 114.94 118.29 1sjr s ASN 108 Ca 0.26 -0.84 -0.13 0.00 -0.71 0.00 0.00 52.86 51.43 1sjr s ASN 108 Cb 0.03 -0.17 -0.09 0.00 0.41 0.00 0.00 41.25 41.44 1sjr s ASN 108 CO 0.14 -0.92 -0.31 -0.38 -1.51 0.00 0.00 177.10 174.13 1sjr n ILE 109 N -1.78 1.38 -0.07 0.60 5.41 -1.21 -4.90 119.36 118.78 1sjr n ILE 109 Ca 0.05 -0.16 -0.08 0.00 1.00 0.00 0.00 62.75 63.57 1sjr n ILE 109 Cb 0.62 -1.98 -0.03 0.00 -0.71 0.00 0.00 39.64 37.54 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 -4.18 0.00 -3.16 1.39 4.02 -1.26 -5.05 117.16 108.92 1sjr n TYR 110 Ca -0.35 0.00 0.05 0.00 -0.01 0.00 0.00 57.90 57.59 1sjr n TYR 110 Cb 0.70 -0.43 -0.02 0.00 -0.02 0.00 0.00 39.34 39.58 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 -5.83 -0.42 -1.68 7.72 3.84 -1.26 -4.97 114.94 112.34 1sjr s ASN 111 Ca -0.25 0.28 -0.13 0.00 0.21 0.00 0.00 52.86 52.97 1sjr s ASN 111 Cb 0.03 1.36 0.13 0.00 -0.55 0.00 0.00 41.25 42.22 1sjr s ASN 111 CO 0.37 -0.08 0.33 0.00 -2.79 0.00 0.00 177.10 174.93 1sjr n ALA 112 N 5.44 -1.52 -3.45 1.71 0.00 -1.26 -4.89 120.51 116.54 1sjr n ALA 112 Ca -0.07 -0.29 -0.16 0.00 0.00 0.00 0.00 53.44 52.92 1sjr n ALA 112 Cb 0.54 -1.71 -0.07 0.00 0.00 0.00 0.00 19.45 18.21 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 -3.54 0.00 -4.10 0.00 -1.04 -1.25 -4.36 114.28 99.99 1sjr n THR 115 Ca -0.12 0.00 -0.36 0.00 -2.04 0.00 0.00 64.05 61.54 1sjr n THR 115 Cb 0.50 -0.41 -0.08 0.00 -1.82 0.00 0.00 70.33 68.53 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 6.47 3.97 -0.13 -4.42 0.05 -0.94 -1.47 118.68 122.21 1sjr s LEU 116 Ca 1.06 0.28 -0.02 0.00 0.05 0.00 0.00 54.13 55.49 1sjr s LEU 116 Cb -1.09 -1.95 -0.03 0.00 -2.05 0.00 0.00 46.19 41.07 1sjr s LEU 116 CO 0.44 0.36 -0.05 -0.13 -0.55 0.00 0.00 176.35 176.43 1sjr s ARG 117 N -0.73 3.36 -0.06 1.48 1.81 0.73 -3.50 118.95 122.04 1sjr s ARG 117 Ca 0.12 -0.52 -0.01 0.00 -1.72 0.00 0.00 55.73 53.60 1sjr s ARG 117 Cb -0.12 -2.81 -0.03 0.00 -0.45 0.00 0.00 34.95 31.54 1sjr s ARG 117 CO 0.03 0.39 -0.01 0.42 -0.68 0.00 0.00 175.30 175.45 1sjr s ILE 118 N -0.06 4.16 -0.04 1.52 1.01 -1.26 -1.13 121.20 125.40 1sjr s ILE 118 Ca 0.01 -0.37 -0.29 0.00 0.00 0.00 0.00 60.65 59.99 1sjr s ILE 118 Cb -0.13 -2.76 0.09 0.00 0.01 0.00 0.00 42.46 39.66 1sjr s ILE 118 CO 0.03 0.55 0.76 1.51 0.00 0.00 0.00 174.94 177.78 1sjr s ASP 119 N -1.03 -0.55 0.21 3.58 1.47 -1.00 -4.90 116.67 114.44 1sjr s ASP 119 Ca 0.15 0.47 -0.32 0.00 1.18 0.00 0.00 52.55 54.03 1sjr s ASP 119 Cb -0.11 0.48 -0.12 0.00 -0.34 0.00 0.00 42.92 42.83 1sjr s ASP 119 CO 0.04 -0.61 1.73 -0.36 0.68 0.00 0.00 175.17 176.65 1sjr s PHE 120 N -1.75 2.86 1.08 2.11 0.40 -1.26 0.19 117.98 121.61 1sjr s PHE 120 Ca -0.06 0.32 -0.17 0.00 -0.60 0.00 0.00 56.93 56.42 1sjr s PHE 120 Cb -0.00 -4.15 0.15 0.00 0.51 0.00 0.00 43.02 39.52 1sjr s PHE 120 CO 0.03 -4.37 0.16 0.45 0.70 0.00 0.00 175.22 172.18 1sjr n SER 121 N 4.08 -2.83 -0.06 1.36 2.88 0.17 -4.76 113.62 114.45 1sjr n SER 121 Ca 0.16 -0.31 -0.20 0.00 -1.33 0.00 0.00 58.87 57.20 1sjr n SER 121 Cb 0.35 -0.84 -0.13 0.00 -0.75 0.00 0.00 64.21 62.84 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 -1.96 0.70 0.00 -1.46 4.76 -1.26 -4.12 118.16 114.82 1sjr n LYS 122 Ca 0.04 0.21 0.10 0.00 -2.87 0.00 0.00 58.31 55.79 1sjr n LYS 122 Cb 0.48 -1.62 0.53 0.00 -1.84 0.00 0.00 35.03 32.59 1sjr n LYS 122 CO 0.00 0.00 0.00 1.28 -1.37 0.00 0.00 177.40 177.31 1sjr n LEU 123 N -3.40 0.00 -1.41 -0.35 7.99 -1.26 -4.82 117.00 113.75 1sjr n LEU 123 Ca -0.39 0.17 -0.13 0.00 -0.01 0.00 0.00 56.01 55.65 1sjr n LEU 123 Cb 1.01 -0.17 -0.05 0.00 -0.11 0.00 0.00 43.42 44.10 1sjr n LEU 123 CO 0.34 -0.06 -0.12 0.35 -1.51 0.00 0.00 177.39 176.38 1sjr n THR 124 N -1.17 -0.02 -3.75 -5.08 -2.24 -1.26 -4.88 114.28 95.88 1sjr n THR 124 Ca 0.11 0.00 -0.13 0.00 -2.27 0.00 0.00 64.05 61.76 1sjr n THR 124 Cb 0.12 -1.24 -0.09 0.00 -2.10 0.00 0.00 70.33 67.02 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 -2.08 -0.27 -0.18 3.42 0.01 -1.26 -4.79 113.70 108.55 1sjr s SER 125 Ca 0.00 0.33 -0.04 0.00 1.31 0.00 0.00 55.95 57.55 1sjr s SER 125 Cb 0.00 0.47 0.08 0.00 0.21 0.00 0.00 66.02 66.78 1sjr s SER 125 CO 0.00 -0.33 0.18 -0.76 0.41 0.00 0.00 173.24 172.74 1sjr s LEU 126 N -0.76 0.03 -0.04 2.44 1.43 -1.26 -4.97 118.68 115.55 1sjr s LEU 126 Ca -0.08 -0.27 -0.01 0.00 -1.03 0.00 0.00 54.13 52.73 1sjr s LEU 126 Cb -0.04 0.19 0.03 0.00 0.03 0.00 0.00 46.19 46.40 1sjr s LEU 126 CO 0.03 -0.32 0.05 0.21 0.23 0.00 0.00 176.35 176.54 1sjr s ASN 127 N 2.27 0.94 -0.58 2.29 3.84 -1.26 -4.76 114.94 117.68 1sjr s ASN 127 Ca 0.05 0.06 -0.27 0.00 0.21 0.00 0.00 52.86 52.91 1sjr s ASN 127 Cb -0.15 -0.15 0.03 0.00 -0.55 0.00 0.00 41.25 40.43 1sjr s ASN 127 CO -0.10 -0.22 1.10 -0.69 -2.79 0.00 0.00 177.10 174.40 1sjr s VAL 128 N 1.90 4.14 -0.90 -5.21 1.01 -1.26 -4.85 120.40 115.24 1sjr s VAL 128 Ca 0.02 0.65 0.17 0.00 0.00 0.00 0.00 61.98 62.81 1sjr s VAL 128 Cb -0.12 -4.67 0.67 0.00 0.00 0.00 0.00 36.38 32.26 1sjr s VAL 128 CO -0.03 -1.28 1.58 0.29 0.00 0.00 0.00 175.10 175.66 1sjr n LYS 129 N 8.11 3.67 -3.64 2.72 4.01 -1.26 -4.90 118.16 126.87 1sjr n LYS 129 Ca 0.06 -2.83 -0.06 0.00 -0.51 0.00 0.00 58.31 54.97 1sjr n LYS 129 Cb 0.48 -1.86 -0.07 0.00 -0.51 0.00 0.00 35.03 33.07 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 -1.98 -0.92 0.01 2.13 2.02 -1.26 -4.73 117.35 112.61 1sjr s TYR 130 Ca 0.48 1.84 0.00 0.00 -0.37 0.00 0.00 57.07 59.02 1sjr s TYR 130 Cb 0.32 0.55 -0.04 0.00 -0.40 0.00 0.00 41.96 42.39 1sjr s TYR 130 CO 0.21 -0.46 0.07 -0.80 -1.57 0.00 0.00 175.55 173.00 1sjr s ASN 131 N 1.56 5.56 0.00 2.29 0.01 -0.56 -4.41 114.94 119.39 1sjr s ASN 131 Ca -0.10 0.10 0.00 0.00 -0.71 0.00 0.00 52.86 52.15 1sjr s ASN 131 Cb -0.05 -1.56 0.00 0.00 0.41 0.00 0.00 41.25 40.05 1sjr s ASN 131 CO -0.18 0.26 0.00 -0.46 -1.51 0.00 0.00 177.10 175.21 1sjr n ASN 132 N 1.13 0.00 -2.20 -1.22 2.04 -1.21 -4.25 115.26 109.55 1sjr n ASN 132 Ca -0.13 0.00 -0.16 0.00 -0.44 0.00 0.00 54.58 53.85 1sjr n ASN 132 Cb 0.53 0.00 -0.15 0.00 -2.53 0.00 0.00 39.78 37.63 1sjr n ASN 132 CO 0.00 0.00 0.00 0.47 -0.44 0.00 0.00 177.26 177.29 1sjr n ASP 133 N 0.52 5.78 -1.04 0.53 9.92 -1.26 -4.50 116.55 126.50 1sjr n ASP 133 Ca 0.00 -2.53 -0.12 0.00 -0.53 0.00 0.00 54.79 51.60 1sjr n ASP 133 Cb 0.00 -1.43 -0.04 0.00 -0.64 0.00 0.00 41.12 39.01 1sjr n ASP 133 CO 0.00 0.00 0.00 0.29 0.13 0.00 0.00 177.20 177.62 1sjr n LYS 134 N 2.55 -0.87 -4.37 -1.24 4.76 -1.26 -4.91 118.16 112.81 1sjr n LYS 134 Ca 0.48 0.85 -0.19 0.00 -2.87 0.00 0.00 58.31 56.58 1sjr n LYS 134 Cb 0.81 -4.90 -0.10 0.00 -1.84 0.00 0.00 35.03 29.00 1sjr n LYS 134 CO 0.00 0.00 0.00 -1.12 -1.37 0.00 0.00 177.40 174.91 1sjr s SER 135 N -2.77 1.72 -0.28 4.39 0.01 -1.26 -0.23 113.70 115.27 1sjr s SER 135 Ca 0.00 -1.45 -0.20 0.00 1.31 0.00 0.00 55.95 55.61 1sjr s SER 135 Cb 0.00 0.19 0.09 0.00 0.21 0.00 0.00 66.02 66.50 1sjr s SER 135 CO 0.00 -0.76 0.76 -0.60 0.41 0.00 0.00 173.24 173.05 1sjr s ARG 136 N -3.92 0.70 -0.12 12.44 6.06 0.15 -3.32 118.95 130.95 1sjr s ARG 136 Ca 0.36 1.04 0.01 0.00 -2.50 0.00 0.00 55.73 54.64 1sjr s ARG 136 Cb 0.07 0.23 -0.01 0.00 0.06 0.00 0.00 34.95 35.30 1sjr s ARG 136 CO 0.15 -0.12 -0.16 0.34 -2.50 0.00 0.00 175.30 173.01 1sjr s ASP 137 N 1.08 3.80 -0.27 -2.12 2.15 -1.26 -0.67 116.67 119.38 1sjr s ASP 137 Ca -0.06 -0.37 0.11 0.00 0.43 0.00 0.00 52.55 52.67 1sjr s ASP 137 Cb -0.05 -1.50 0.56 0.00 -0.30 0.00 0.00 42.92 41.63 1sjr s ASP 137 CO -0.11 0.18 1.54 -1.22 -0.17 0.00 0.00 175.17 175.38 1sjr n TYR 138 N 3.43 1.39 0.00 -5.34 4.01 -0.63 -4.58 117.16 115.44 1sjr n TYR 138 Ca -0.18 -1.31 0.00 0.00 -0.16 0.00 0.00 57.90 56.25 1sjr n TYR 138 Cb 0.53 -0.50 0.00 0.00 -0.31 0.00 0.00 39.34 39.06 1sjr n TYR 138 CO 0.00 0.00 0.00 0.25 -0.46 0.00 0.00 176.86 176.65 1sjr n THR 139 N -0.78 0.00 -3.92 -0.72 -2.24 -1.23 -4.90 114.28 100.49 1sjr n THR 139 Ca 0.32 0.00 -0.30 0.00 -2.27 0.00 0.00 64.05 61.81 1sjr n THR 139 Cb 1.09 -0.41 -0.14 0.00 -2.10 0.00 0.00 70.33 68.78 1sjr n THR 139 CO 0.00 0.00 0.00 -0.60 -0.57 0.00 0.00 175.07 173.90 1sjr s ARG 140 N -1.68 1.98 0.00 -0.78 6.06 -1.26 -4.92 118.95 118.36 1sjr s ARG 140 Ca 0.00 -2.68 0.30 0.00 -2.50 0.00 0.00 55.73 50.85 1sjr s ARG 140 Cb 0.00 -3.24 1.43 0.00 0.06 0.00 0.00 34.95 33.20 1sjr s ARG 140 CO 0.00 -1.14 2.00 -0.35 -2.50 0.00 0.00 175.30 173.31 1sjr n PRO 141 N 2.97 0.42 -0.02 5.12 -0.04 -1.26 -3.42 135.00 138.76 1sjr n PRO 141 Ca 0.08 -0.04 0.04 0.00 -0.04 0.00 0.00 63.50 63.54 1sjr n PRO 141 Cb 0.33 -1.50 0.21 0.00 -0.04 0.00 0.00 33.50 32.50 1sjr n PRO 141 CO 0.00 0.00 0.00 -3.47 -0.04 0.00 0.00 175.50 171.99 1sjr n ASP 142 N -1.26 0.25 -4.84 3.54 2.03 -1.26 -4.86 116.55 110.15 1sjr n ASP 142 Ca 0.13 -1.80 -0.32 0.00 0.52 0.00 0.00 54.79 53.32 1sjr n ASP 142 Cb 0.26 -0.03 -0.01 0.00 -0.72 0.00 0.00 41.12 40.62 1sjr n ASP 142 CO 0.00 0.00 0.00 -0.76 -1.92 0.00 0.00 177.20 174.52 1sjr s LEU 143 N -1.21 3.47 1.18 -2.67 1.02 -1.22 -5.06 118.68 114.19 1sjr s LEU 143 Ca 0.13 1.58 -0.19 0.00 0.02 0.00 0.00 54.13 55.67 1sjr s LEU 143 Cb 0.06 -4.50 0.28 0.00 0.02 0.00 0.00 46.19 42.05 1sjr s LEU 143 CO 0.10 -0.81 1.12 -2.16 0.02 0.00 0.00 176.35 174.61 1sjr s PRO 144 N -4.41 -1.05 -0.31 1.29 0.04 -1.26 -4.78 135.00 124.53 1sjr s PRO 144 Ca 0.59 -0.07 0.10 0.00 0.04 0.00 0.00 61.00 61.65 1sjr s PRO 144 Cb -0.11 -1.62 0.59 0.00 0.04 0.00 0.00 34.50 33.40 1sjr s PRO 144 CO 0.39 -3.59 1.62 -1.13 0.04 0.00 0.00 177.00 174.33 1sjr n SER 145 N -4.67 3.50 0.00 6.66 3.41 -1.26 -1.50 113.62 119.76 1sjr n SER 145 Ca 0.13 -3.48 0.00 0.00 -0.26 0.00 0.00 58.87 55.26 1sjr n SER 145 Cb 0.59 -0.68 0.00 0.00 -0.26 0.00 0.00 64.21 63.86 1sjr n SER 145 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1sjr n GLY 146 N -0.80 0.75 2.07 5.00 0.00 -1.26 -4.59 105.19 106.36 1sjr n GLY 146 Ca 0.37 -0.54 0.00 0.00 0.00 0.00 0.00 46.02 45.86 1sjr n GLY 146 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54