#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jbp n PHE 46 N 0.00 0.00 -3.36 3.69 -0.00 -1.26 -5.14 117.46 111.39 2jbp n PHE 46 Ca 0.00 0.00 -0.45 0.00 -0.00 0.00 0.00 57.45 57.00 2jbp n PHE 46 Cb 0.00 0.00 -0.01 0.00 -0.00 0.00 0.00 39.48 39.47 2jbp n PHE 46 CO 0.00 0.00 0.00 -1.01 -0.00 0.00 0.00 176.76 175.75 2jbp s HIS 47 N 0.00 4.03 -0.06 -5.13 3.76 -1.26 -5.02 115.29 111.61 2jbp s HIS 47 Ca 0.00 -2.44 0.03 0.00 -0.15 0.00 0.00 55.06 52.50 2jbp s HIS 47 Cb 0.00 -3.78 0.00 0.00 1.11 0.00 0.00 32.58 29.91 2jbp s HIS 47 CO 0.00 -0.95 -0.16 0.54 -0.85 0.00 0.00 174.74 173.32 2jbp s VAL 48 N -0.69 1.38 0.31 -0.90 0.11 -1.26 -5.12 120.40 114.23 2jbp s VAL 48 Ca 0.25 -0.65 0.08 0.00 -2.93 0.00 0.00 61.98 58.73 2jbp s VAL 48 Cb -0.10 -1.21 -0.04 0.00 -1.53 0.00 0.00 36.38 33.50 2jbp s VAL 48 CO -0.08 0.40 0.19 -0.54 -3.33 0.00 0.00 175.10 171.74 2jbp s LYS 49 N 0.36 2.63 0.49 1.54 -0.14 -1.26 -5.11 119.74 118.25 2jbp s LYS 49 Ca -0.11 -1.31 -0.14 0.00 -1.36 0.00 0.00 55.97 53.05 2jbp s LYS 49 Cb -0.14 -2.38 -0.07 0.00 -1.68 0.00 0.00 37.83 33.56 2jbp s LYS 49 CO 0.04 0.22 0.92 0.45 -0.76 0.00 0.00 175.35 176.22 2jbp s SER 50 N -3.87 6.56 0.69 2.83 0.15 -1.26 -5.06 113.70 113.73 2jbp s SER 50 Ca 0.37 1.42 -0.04 0.00 0.70 0.00 0.00 55.95 58.40 2jbp s SER 50 Cb -0.06 -2.45 0.09 0.00 -1.71 0.00 0.00 66.02 61.90 2jbp s SER 50 CO 0.24 -0.55 0.97 -0.83 1.20 0.00 0.00 173.24 174.27 2jbp s GLY 51 N -3.20 1.76 -0.28 9.45 0.00 -1.26 -5.00 107.32 108.79 2jbp s GLY 51 Ca 0.56 -1.31 -0.26 0.00 0.00 0.00 0.00 44.72 43.71 2jbp s GLY 51 CO 0.33 -0.85 0.91 -2.27 0.00 0.00 0.00 173.10 171.22 2jbp s LEU 52 N -5.14 4.05 -0.61 0.66 2.96 -1.26 -5.01 118.68 114.33 2jbp s LEU 52 Ca 0.63 0.96 -0.13 0.00 -0.22 0.00 0.00 54.13 55.37 2jbp s LEU 52 Cb -0.08 -3.29 0.15 0.00 0.50 0.00 0.00 46.19 43.47 2jbp s LEU 52 CO 0.44 -0.67 0.53 -1.58 -1.32 0.00 0.00 176.35 173.75 2jbp s GLN 53 N 3.15 3.00 0.16 1.98 2.00 -1.26 -5.05 119.66 123.64 2jbp s GLN 53 Ca 0.38 -1.99 -0.32 0.00 -2.00 0.00 0.00 55.36 51.44 2jbp s GLN 53 Cb -0.14 -4.21 -0.10 0.00 0.80 0.00 0.00 33.01 29.36 2jbp s GLN 53 CO 0.11 -1.28 1.64 0.42 -0.50 0.00 0.00 175.29 175.68 2jbp s ILE 54 N 1.04 2.50 0.16 -2.34 -1.09 -1.26 -4.71 121.20 115.49 2jbp s ILE 54 Ca 0.09 0.30 -0.20 0.00 -2.23 0.00 0.00 60.65 58.60 2jbp s ILE 54 Cb -0.23 -3.19 -0.08 0.00 -1.58 0.00 0.00 42.46 37.38 2jbp s ILE 54 CO -0.02 0.02 0.67 -0.54 -1.23 0.00 0.00 174.94 173.85 2jbp s LYS 55 N 1.45 4.29 -0.02 2.79 1.02 0.51 -4.87 119.74 124.91 2jbp s LYS 55 Ca 0.73 0.86 0.14 0.00 0.02 0.00 0.00 55.97 57.72 2jbp s LYS 55 Cb -0.45 -3.09 -0.22 0.00 -0.52 0.00 0.00 37.83 33.55 2jbp s LYS 55 CO 0.32 0.52 0.31 1.63 -0.92 0.00 0.00 175.35 177.21 2jbp n LYS 56 N 1.24 0.45 -1.07 1.68 4.76 -1.26 -0.12 118.16 123.85 2jbp n LYS 56 Ca -0.06 -0.13 -0.33 0.00 -2.87 0.00 0.00 58.31 54.92 2jbp n LYS 56 Cb 0.50 -1.34 0.13 0.00 -1.84 0.00 0.00 35.03 32.49 2jbp n LYS 56 CO 0.00 0.00 0.00 0.54 -1.37 0.00 0.00 177.40 176.57 2jbp s ASN 57 N -3.66 3.51 0.52 4.39 4.22 -1.26 -4.75 114.94 117.92 2jbp s ASN 57 Ca -0.05 2.34 -0.21 0.00 -2.14 0.00 0.00 52.86 52.80 2jbp s ASN 57 Cb 0.09 -2.59 -0.07 0.00 1.28 0.00 0.00 41.25 39.97 2jbp s ASN 57 CO 0.59 -2.72 1.07 0.00 -2.04 0.00 0.00 177.10 174.00 2jbp n ALA 58 N -3.41 0.52 0.15 3.54 0.00 -1.26 -4.82 120.51 115.23 2jbp n ALA 58 Ca 0.13 0.11 0.03 0.00 0.00 0.00 0.00 53.44 53.72 2jbp n ALA 58 Cb 0.51 -2.16 0.07 0.00 0.00 0.00 0.00 19.45 17.87 2jbp n ALA 58 CO 0.00 0.00 0.00 0.97 0.00 0.00 0.00 177.50 178.47 2jbp h ILE 59 N 1.10 0.83 0.00 0.00 2.10 -1.96 -3.07 117.51 116.52 2jbp h ILE 59 Ca -0.48 -2.10 -0.02 0.00 1.08 0.00 0.00 64.86 63.34 2jbp h ILE 59 Cb 1.34 2.36 -0.00 0.00 -1.09 0.00 0.00 36.82 39.42 2jbp h ILE 59 CO 0.54 0.46 -0.09 0.16 -1.08 0.00 0.00 178.15 178.14 2jbp h ILE 60 N 0.00 0.27 -0.39 2.19 3.07 -1.88 0.21 117.51 120.99 2jbp h ILE 60 Ca -0.00 -0.68 0.11 0.00 1.55 0.00 0.00 64.86 65.84 2jbp h ILE 60 Cb 1.32 1.53 -0.02 0.00 -0.27 0.00 0.00 36.82 39.39 2jbp h ILE 60 CO 0.06 0.09 0.79 0.44 -1.05 0.00 0.00 178.15 178.48 2jbp h ASP 61 N 0.00 0.00 0.00 2.16 3.45 -1.90 -3.21 116.42 116.92 2jbp h ASP 61 Ca -0.00 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.46 2jbp h ASP 61 Cb 0.53 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 39.30 2jbp h ASP 61 CO 0.01 0.00 -0.64 0.47 -1.57 0.00 0.00 179.24 177.51 2jbp n ASP 62 N -3.06 3.20 -3.95 6.45 8.00 0.01 -5.00 116.55 122.19 2jbp n ASP 62 Ca 0.08 0.00 -0.14 0.00 0.71 0.00 0.00 54.79 55.44 2jbp n ASP 62 Cb 0.93 0.58 -0.14 0.00 -0.02 0.00 0.00 41.12 42.47 2jbp n ASP 62 CO 0.00 0.00 0.00 -0.31 -0.39 0.00 0.00 177.20 176.50 2jbp s TYR 63 N -1.35 0.35 -0.17 1.24 2.02 -0.88 -1.49 117.35 117.08 2jbp s TYR 63 Ca 0.00 -0.16 -0.29 0.00 -0.37 0.00 0.00 57.07 56.24 2jbp s TYR 63 Cb 0.00 -0.22 -0.01 0.00 -0.40 0.00 0.00 41.96 41.33 2jbp s TYR 63 CO 0.00 -0.03 1.12 0.21 -1.57 0.00 0.00 175.55 175.27 2jbp s LYS 64 N -0.43 4.30 -0.45 -0.62 2.47 0.10 -4.44 119.74 120.67 2jbp s LYS 64 Ca -0.02 1.49 -0.16 0.00 -1.56 0.00 0.00 55.97 55.72 2jbp s LYS 64 Cb -0.03 -3.64 0.05 0.00 -1.46 0.00 0.00 37.83 32.74 2jbp s LYS 64 CO -0.00 -0.57 0.38 0.08 0.16 0.00 0.00 175.35 175.40 2jbp s VAL 65 N 2.92 5.21 0.81 4.02 1.01 -1.26 -1.74 120.40 131.37 2jbp s VAL 65 Ca 0.49 -0.82 -0.12 0.00 0.00 0.00 0.00 61.98 61.54 2jbp s VAL 65 Cb -0.19 -4.06 0.10 0.00 0.00 0.00 0.00 36.38 32.23 2jbp s VAL 65 CO 0.13 -0.49 1.17 0.42 0.00 0.00 0.00 175.10 176.33 2jbp s THR 66 N 1.77 2.05 -1.17 3.92 -4.23 -1.16 -5.03 115.64 111.78 2jbp s THR 66 Ca 0.06 -0.05 0.11 0.00 -1.18 0.00 0.00 61.69 60.63 2jbp s THR 66 Cb -0.21 -2.99 0.21 0.00 1.34 0.00 0.00 72.50 70.84 2jbp s THR 66 CO 0.09 0.00 1.07 -1.54 -0.54 0.00 0.00 174.62 173.70 2jbp n SER 67 N -3.31 2.47 -4.69 3.99 3.41 -1.26 -4.48 113.62 109.75 2jbp n SER 67 Ca 0.09 -1.75 -0.42 0.00 -0.26 0.00 0.00 58.87 56.53 2jbp n SER 67 Cb 0.61 -0.12 -0.03 0.00 -0.26 0.00 0.00 64.21 64.40 2jbp n SER 67 CO 0.00 0.00 0.00 -1.58 -0.16 0.00 0.00 175.04 173.30 2jbp s GLN 68 N -0.97 4.19 -0.51 4.33 0.74 -1.26 -4.93 119.66 121.24 2jbp s GLN 68 Ca 0.19 2.36 -0.21 0.00 0.05 0.00 0.00 55.36 57.74 2jbp s GLN 68 Cb 0.11 -3.66 0.04 0.00 1.10 0.00 0.00 33.01 30.61 2jbp s GLN 68 CO 0.15 -0.76 0.76 0.08 -0.55 0.00 0.00 175.29 174.96 2jbp s VAL 69 N 2.86 4.67 -1.74 1.34 1.01 -1.26 -1.57 120.40 125.70 2jbp s VAL 69 Ca 0.75 -0.05 0.28 0.00 0.00 0.00 0.00 61.98 62.96 2jbp s VAL 69 Cb -0.40 -4.37 0.67 0.00 0.00 0.00 0.00 36.38 32.27 2jbp s VAL 69 CO 0.33 -0.88 2.01 0.18 0.00 0.00 0.00 175.10 176.74 2jbp n LEU 70 N 6.70 0.00 0.00 3.92 4.77 0.22 -4.97 117.00 127.64 2jbp n LEU 70 Ca -0.02 0.13 0.00 0.00 -0.03 0.00 0.00 56.01 56.09 2jbp n LEU 70 Cb 0.47 -0.13 0.00 0.00 -2.33 0.00 0.00 43.42 41.43 2jbp n LEU 70 CO 0.58 -0.01 0.00 0.61 -1.33 0.00 0.00 177.39 177.24 2jbp n GLY 71 N 0.92 3.06 3.00 -0.72 0.00 -1.19 -4.96 105.19 105.29 2jbp n GLY 71 Ca 0.18 -1.16 -0.10 0.00 0.00 0.00 0.00 46.02 44.94 2jbp n GLY 71 CO 0.00 0.00 0.00 0.48 0.00 0.00 0.00 173.32 173.80 2jbp s LEU 72 N 0.00 2.25 0.00 0.99 2.34 -1.26 -0.32 118.68 122.67 2jbp s LEU 72 Ca 0.00 -0.52 -0.06 0.00 0.06 0.00 0.00 54.13 53.61 2jbp s LEU 72 Cb 0.00 0.04 0.02 0.00 -0.56 0.00 0.00 46.19 45.69 2jbp s LEU 72 CO 0.00 -0.28 0.53 0.61 -1.06 0.00 0.00 176.35 176.15 2jbp n GLY 73 N 1.55 1.80 0.00 -3.48 0.00 -1.07 -5.03 105.19 98.97 2jbp n GLY 73 Ca -0.24 -1.45 0.00 0.00 0.00 0.00 0.00 46.02 44.33 2jbp n GLY 73 CO 0.00 0.00 0.00 4.51 0.00 0.00 0.00 173.32 177.83 2jbp n ILE 74 N -0.50 0.00 -0.08 -0.61 3.06 -1.26 -3.11 119.36 116.87 2jbp n ILE 74 Ca -0.03 0.04 -0.23 0.00 -2.50 0.00 0.00 62.75 60.04 2jbp n ILE 74 Cb 0.52 -0.07 -0.12 0.00 0.54 0.00 0.00 39.64 40.51 2jbp n ILE 74 CO 0.00 0.00 0.00 -3.20 -2.50 0.00 0.00 176.55 170.85 2jbp n ASN 75 N -0.51 1.97 -2.61 9.51 5.15 -1.26 -5.05 115.26 122.46 2jbp n ASN 75 Ca 0.00 0.29 -0.06 0.00 -0.60 0.00 0.00 54.58 54.21 2jbp n ASN 75 Cb 0.00 -0.86 -0.00 0.00 -0.53 0.00 0.00 39.78 38.38 2jbp n ASN 75 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 2jbp n GLY 76 N 1.66 3.25 3.46 8.20 0.00 -1.18 -5.09 105.19 115.49 2jbp n GLY 76 Ca -0.37 -2.21 -0.26 0.00 0.00 0.00 0.00 46.02 43.18 2jbp n GLY 76 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2jbp s LYS 77 N -2.47 1.63 -0.25 1.61 -2.85 -1.26 -2.58 119.74 113.56 2jbp s LYS 77 Ca 0.05 -1.58 0.03 0.00 -1.00 0.00 0.00 55.97 53.47 2jbp s LYS 77 Cb -0.00 -1.86 0.06 0.00 -2.06 0.00 0.00 37.83 33.97 2jbp s LYS 77 CO 0.03 0.38 -0.11 0.08 0.10 0.00 0.00 175.35 175.84 2jbp s VAL 78 N -1.95 2.08 0.37 1.79 1.01 0.56 -3.51 120.40 120.76 2jbp s VAL 78 Ca 0.24 -1.55 0.01 0.00 0.00 0.00 0.00 61.98 60.68 2jbp s VAL 78 Cb -0.07 -2.20 -0.02 0.00 0.00 0.00 0.00 36.38 34.09 2jbp s VAL 78 CO 0.12 -0.01 0.57 -0.76 0.00 0.00 0.00 175.10 175.02 2jbp s LEU 79 N 1.15 3.93 0.25 3.92 1.43 0.22 -0.61 118.68 128.97 2jbp s LEU 79 Ca -0.08 0.35 -0.18 0.00 -1.03 0.00 0.00 54.13 53.19 2jbp s LEU 79 Cb -0.19 -3.22 -0.08 0.00 0.03 0.00 0.00 46.19 42.73 2jbp s LEU 79 CO -0.06 -0.40 0.71 -1.58 0.23 0.00 0.00 176.35 175.26 2jbp s GLN 80 N -4.35 4.15 0.11 1.70 2.00 -0.61 -0.47 119.66 122.19 2jbp s GLN 80 Ca 0.42 0.77 -0.15 0.00 -2.00 0.00 0.00 55.36 54.41 2jbp s GLN 80 Cb -0.10 -2.74 0.03 0.00 0.80 0.00 0.00 33.01 31.01 2jbp s GLN 80 CO 0.36 0.32 0.35 0.96 -0.50 0.00 0.00 175.29 176.79 2jbp s ILE 81 N -1.67 0.09 -0.05 -2.34 -4.36 -0.04 -3.00 121.20 109.81 2jbp s ILE 81 Ca 0.46 -0.70 0.05 0.00 -0.26 0.00 0.00 60.65 60.21 2jbp s ILE 81 Cb -0.14 -1.19 -0.01 0.00 1.25 0.00 0.00 42.46 42.37 2jbp s ILE 81 CO 0.20 -0.39 -0.22 -0.36 0.24 0.00 0.00 174.94 174.41 2jbp s PHE 82 N -3.76 2.18 -0.19 1.37 0.08 -0.71 0.18 117.98 117.12 2jbp s PHE 82 Ca 0.03 -0.65 -0.28 0.00 0.12 0.00 0.00 56.93 56.15 2jbp s PHE 82 Cb 0.02 -1.44 -0.05 0.00 -0.57 0.00 0.00 43.02 40.98 2jbp s PHE 82 CO -0.11 -0.21 2.18 1.21 -0.10 0.00 0.00 175.22 178.19 2jbp s ASN 83 N -0.07 5.59 0.33 1.36 3.04 -0.79 0.02 114.94 124.41 2jbp s ASN 83 Ca -0.04 1.98 0.12 0.00 0.04 0.00 0.00 52.86 54.95 2jbp s ASN 83 Cb -0.13 -2.51 0.99 0.00 -1.54 0.00 0.00 41.25 38.05 2jbp s ASN 83 CO 0.03 -1.84 1.69 0.11 -3.04 0.00 0.00 177.10 174.05 2jbp h LYS 84 N 14.45 0.39 0.00 0.43 1.57 -1.56 -2.81 116.57 129.03 2jbp h LYS 84 Ca -0.42 -0.02 0.00 0.00 -1.87 0.00 0.00 60.65 58.34 2jbp h LYS 84 Cb 1.24 -0.09 0.00 0.00 0.08 0.00 0.00 32.23 33.46 2jbp h LYS 84 CO 0.96 0.26 0.00 -2.13 -0.57 0.00 0.00 179.45 177.97 2jbp n ARG 85 N -5.01 0.00 -0.01 3.15 0.63 -1.26 -4.35 116.66 109.82 2jbp n ARG 85 Ca 0.29 0.32 0.00 0.00 -0.92 0.00 0.00 57.85 57.55 2jbp n ARG 85 Cb 0.88 -0.85 0.00 0.00 0.45 0.00 0.00 32.46 32.93 2jbp n ARG 85 CO 0.00 0.00 0.00 2.41 -2.51 0.00 0.00 177.63 177.53 2jbp n THR 86 N -1.47 0.43 0.00 5.15 -1.04 -1.23 -4.80 114.28 111.32 2jbp n THR 86 Ca 0.00 -0.01 0.00 0.00 -2.04 0.00 0.00 64.05 62.00 2jbp n THR 86 Cb 0.00 -0.72 0.00 0.00 -1.82 0.00 0.00 70.33 67.79 2jbp n THR 86 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2jbp n GLN 87 N 0.82 0.00 -0.35 -2.82 1.13 -1.06 -4.82 117.38 110.27 2jbp n GLN 87 Ca 0.00 0.00 -0.27 0.00 -1.94 0.00 0.00 57.00 54.79 2jbp n GLN 87 Cb 0.21 -0.34 0.25 0.00 0.11 0.00 0.00 30.24 30.48 2jbp n GLN 87 CO 0.00 0.00 0.00 -1.91 -1.44 0.00 0.00 177.06 173.71 2jbp n GLU 88 N 0.34 -3.78 -4.77 -1.09 2.13 -1.25 -4.58 120.64 107.63 2jbp n GLU 88 Ca 0.00 -1.12 -0.27 0.00 0.66 0.00 0.00 57.16 56.43 2jbp n GLU 88 Cb 0.00 -1.84 -0.14 0.00 0.27 0.00 0.00 31.44 29.73 2jbp n GLU 88 CO 0.00 0.00 0.00 0.21 -0.41 0.00 0.00 177.13 176.93 2jbp s LYS 89 N -4.50 1.54 0.28 5.31 2.20 -1.26 -1.89 119.74 121.41 2jbp s LYS 89 Ca 0.59 -0.95 -0.13 0.00 -0.36 0.00 0.00 55.97 55.12 2jbp s LYS 89 Cb -0.13 -1.64 0.01 0.00 -1.51 0.00 0.00 37.83 34.56 2jbp s LYS 89 CO 0.53 0.43 0.55 -0.06 -0.36 0.00 0.00 175.35 176.43 2jbp s PHE 90 N -0.75 0.33 0.02 4.03 0.40 0.13 -4.49 117.98 117.65 2jbp s PHE 90 Ca 0.09 -0.72 0.06 0.00 -0.60 0.00 0.00 56.93 55.75 2jbp s PHE 90 Cb -0.09 0.30 -0.03 0.00 0.51 0.00 0.00 43.02 43.71 2jbp s PHE 90 CO 0.01 -1.10 -0.14 0.00 0.70 0.00 0.00 175.22 174.69 2jbp s ALA 91 N -3.73 2.72 -0.08 5.36 0.00 -0.40 -0.86 121.76 124.77 2jbp s ALA 91 Ca 0.21 -1.13 0.01 0.00 0.00 0.00 0.00 51.96 51.06 2jbp s ALA 91 Cb -0.02 -0.87 0.02 0.00 0.00 0.00 0.00 23.12 22.25 2jbp s ALA 91 CO 0.10 0.58 -0.11 -1.17 0.00 0.00 0.00 175.76 175.17 2jbp s LEU 92 N -1.38 1.50 -0.16 0.00 2.96 0.38 -1.03 118.68 120.95 2jbp s LEU 92 Ca 0.15 -0.31 -0.01 0.00 -0.22 0.00 0.00 54.13 53.75 2jbp s LEU 92 Cb -0.11 -0.84 -0.01 0.00 0.50 0.00 0.00 46.19 45.73 2jbp s LEU 92 CO 0.06 -0.02 -0.11 -0.75 -1.32 0.00 0.00 176.35 174.21 2jbp s LYS 93 N 1.02 3.35 -0.12 1.98 2.20 -0.34 -0.61 119.74 127.22 2jbp s LYS 93 Ca -0.08 -0.68 -0.03 0.00 -0.36 0.00 0.00 55.97 54.82 2jbp s LYS 93 Cb -0.15 -2.72 -0.03 0.00 -1.51 0.00 0.00 37.83 33.42 2jbp s LYS 93 CO -0.01 0.08 -0.00 -1.64 -0.36 0.00 0.00 175.35 173.42 2jbp s MET 94 N 0.70 3.34 0.06 4.03 -1.94 -1.23 -1.01 119.30 123.25 2jbp s MET 94 Ca -0.05 -0.44 0.04 0.00 -1.71 0.00 0.00 55.69 53.53 2jbp s MET 94 Cb -0.15 -2.89 -0.03 0.00 2.01 0.00 0.00 34.83 33.78 2jbp s MET 94 CO 0.02 0.50 -0.11 -0.51 -0.01 0.00 0.00 175.02 174.90 2jbp s LEU 95 N -0.31 2.25 -0.13 -0.03 1.43 -0.24 -4.47 118.68 117.19 2jbp s LEU 95 Ca 0.06 -0.56 -0.27 0.00 -1.03 0.00 0.00 54.13 52.33 2jbp s LEU 95 Cb -0.12 -0.38 -0.02 0.00 0.03 0.00 0.00 46.19 45.70 2jbp s LEU 95 CO 0.02 -0.11 0.90 -1.58 0.23 0.00 0.00 176.35 175.81 2jbp s GLN 96 N -1.59 4.37 0.45 1.70 0.74 -1.26 -1.05 119.66 123.02 2jbp s GLN 96 Ca -0.05 1.17 -0.25 0.00 0.05 0.00 0.00 55.36 56.29 2jbp s GLN 96 Cb -0.10 -3.55 -0.09 0.00 1.10 0.00 0.00 33.01 30.38 2jbp s GLN 96 CO 0.01 -0.29 1.35 -3.47 -0.55 0.00 0.00 175.29 172.35 2jbp n ASP 97 N 5.00 2.91 0.00 6.67 2.03 -0.48 -4.71 116.55 127.97 2jbp n ASP 97 Ca 0.06 1.10 0.00 0.00 0.52 0.00 0.00 54.79 56.47 2jbp n ASP 97 Cb 0.49 -1.56 0.00 0.00 -0.72 0.00 0.00 41.12 39.33 2jbp n ASP 97 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2jbp n PRO 99 N 0.00 2.23 -0.33 0.00 -0.05 -1.26 -2.79 135.00 132.81 2jbp n PRO 99 Ca 0.00 0.00 0.12 0.00 -0.05 0.00 0.00 63.50 63.57 2jbp n PRO 99 Cb 0.00 -1.25 0.34 0.00 -0.05 0.00 0.00 33.50 32.53 2jbp n PRO 99 CO 0.00 0.00 0.00 0.87 -0.05 0.00 0.00 175.50 176.32 2jbp h LYS 100 N 0.00 0.74 0.04 0.54 1.79 -1.96 0.34 116.57 118.06 2jbp h LYS 100 Ca -0.27 -0.04 -0.17 0.00 -2.18 0.00 0.00 60.65 57.98 2jbp h LYS 100 Cb 1.60 -0.17 0.02 0.00 -1.58 0.00 0.00 32.23 32.09 2jbp h LYS 100 CO 0.01 0.49 -0.70 0.00 -1.08 0.00 0.00 179.45 178.17 2jbp h ALA 101 N 1.61 0.03 -0.78 3.86 0.00 -1.84 -2.55 119.26 119.59 2jbp h ALA 101 Ca 0.53 -0.62 0.15 0.00 0.00 0.00 0.00 54.91 54.97 2jbp h ALA 101 Cb 0.81 0.05 -0.05 0.00 0.00 0.00 0.00 17.79 18.61 2jbp h ALA 101 CO -0.30 0.38 0.52 0.00 0.00 0.00 0.00 179.25 179.85 2jbp h ARG 102 N -0.14 0.43 -0.13 0.00 2.47 -1.23 -1.50 114.38 114.29 2jbp h ARG 102 Ca -0.10 -0.03 -0.04 0.00 -1.26 0.00 0.00 59.98 58.55 2jbp h ARG 102 Cb 1.44 -0.10 -0.00 0.00 -1.65 0.00 0.00 29.97 29.66 2jbp h ARG 102 CO 0.14 0.29 -0.09 -0.09 0.56 0.00 0.00 179.97 180.77 2jbp h ARG 103 N 0.44 0.28 0.19 0.04 2.43 -0.79 0.04 114.38 117.02 2jbp h ARG 103 Ca 0.38 -0.14 0.01 0.00 -0.81 0.00 0.00 59.98 59.43 2jbp h ARG 103 Cb 0.86 -0.00 -0.04 0.00 -0.42 0.00 0.00 29.97 30.36 2jbp h ARG 103 CO -0.13 0.65 -0.51 1.49 -1.51 0.00 0.00 179.97 179.96 2jbp h GLU 104 N -0.09 -0.75 -0.44 0.20 4.81 -0.89 0.97 114.58 118.39 2jbp h GLU 104 Ca 0.02 0.05 0.09 0.00 -0.13 0.00 0.00 59.36 59.40 2jbp h GLU 104 Cb 0.58 0.17 -0.10 0.00 0.63 0.00 0.00 28.75 30.04 2jbp h GLU 104 CO 0.02 -0.50 -0.26 0.28 -0.73 0.00 0.00 179.01 177.83 2jbp h VAL 105 N -0.78 0.31 0.19 0.32 2.07 -1.30 0.48 116.25 117.55 2jbp h VAL 105 Ca -0.02 0.00 0.01 0.00 0.82 0.00 0.00 66.70 67.52 2jbp h VAL 105 Cb 0.76 0.31 -0.04 0.00 -1.52 0.00 0.00 31.29 30.80 2jbp h VAL 105 CO -0.24 0.00 -0.45 -0.08 0.02 0.00 0.00 177.57 176.82 2jbp h GLU 106 N -0.17 -0.70 0.08 1.57 4.22 0.68 0.36 114.58 120.62 2jbp h GLU 106 Ca 0.20 0.05 -0.00 0.00 0.08 0.00 0.00 59.36 59.69 2jbp h GLU 106 Cb 0.49 0.16 -0.00 0.00 0.50 0.00 0.00 28.75 29.90 2jbp h GLU 106 CO -0.54 -0.47 -0.04 -0.07 -2.18 0.00 0.00 179.01 175.71 2jbp h LEU 107 N -0.73 -0.10 -0.43 1.64 3.38 0.17 -2.05 115.31 117.19 2jbp h LEU 107 Ca 0.00 0.01 0.01 0.00 0.09 0.00 0.00 57.88 57.99 2jbp h LEU 107 Cb 0.72 0.03 -0.03 0.00 0.09 0.00 0.00 40.66 41.48 2jbp h LEU 107 CO -0.21 -0.07 0.27 -0.74 0.09 0.00 0.00 178.44 177.77 2jbp h HIS 108 N -0.12 0.51 -0.97 1.13 2.76 0.37 0.44 115.15 119.27 2jbp h HIS 108 Ca -0.01 0.01 0.12 0.00 -2.20 0.00 0.00 60.37 58.30 2jbp h HIS 108 Cb 0.09 -0.17 -0.08 0.00 1.55 0.00 0.00 27.41 28.81 2jbp h HIS 108 CO -0.08 0.31 0.62 2.35 -1.30 0.00 0.00 177.93 179.83 2jbp h TRP 109 N 0.55 1.07 0.00 5.26 2.91 -0.10 0.17 115.95 125.81 2jbp h TRP 109 Ca 0.17 0.03 -0.05 0.00 1.13 0.00 0.00 58.89 60.16 2jbp h TRP 109 Cb -0.03 -0.34 -0.01 0.00 -0.51 0.00 0.00 29.16 28.28 2jbp h TRP 109 CO -0.06 0.42 -0.24 0.00 -1.03 0.00 0.00 178.44 177.53 2jbp h ARG 110 N 0.93 0.00 -0.02 2.65 3.08 -0.21 -2.91 114.38 117.90 2jbp h ARG 110 Ca 0.48 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.53 2jbp h ARG 110 Cb 0.52 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.57 2jbp h ARG 110 CO -0.25 0.24 -0.12 0.00 -1.07 0.00 0.00 179.97 178.78 2jbp n ALA 111 N -2.48 2.77 0.40 0.04 0.00 0.48 -4.29 120.51 117.42 2jbp n ALA 111 Ca -0.02 -0.60 0.14 0.00 0.00 0.00 0.00 53.44 52.95 2jbp n ALA 111 Cb 0.30 -0.92 0.49 0.00 0.00 0.00 0.00 19.45 19.32 2jbp n ALA 111 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 2jbp h SER 112 N 3.39 0.00 -0.63 0.00 0.87 -1.01 -2.65 113.55 113.52 2jbp h SER 112 Ca 0.00 0.00 0.02 0.00 -1.23 0.00 0.00 61.79 60.58 2jbp h SER 112 Cb 0.79 0.00 -0.04 0.00 -0.44 0.00 0.00 62.40 62.71 2jbp h SER 112 CO 0.00 0.00 0.39 1.56 -0.53 0.00 0.00 176.83 178.25 2jbp h GLN 113 N 0.00 0.76 -6.63 2.24 4.20 -1.78 -3.43 115.11 110.46 2jbp h GLN 113 Ca 0.00 -0.05 -0.58 0.00 0.06 0.00 0.00 58.65 58.08 2jbp h GLN 113 Cb 0.54 -0.17 0.09 0.00 0.30 0.00 0.00 27.48 28.25 2jbp h GLN 113 CO 0.00 0.50 0.53 0.00 -0.67 0.00 0.00 178.83 179.19 2jbp h PRO 115 N 3.44 0.00 -0.54 0.00 0.11 -1.91 -2.71 132.00 130.40 2jbp h PRO 115 Ca -0.45 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.66 2jbp h PRO 115 Cb 1.28 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.39 2jbp h PRO 115 CO 0.70 0.05 0.00 0.72 -0.21 0.00 0.00 178.00 179.26 2jbp n HIS 116 N -3.26 0.70 -4.70 0.65 8.25 -1.26 -4.88 115.22 110.72 2jbp n HIS 116 Ca -0.01 -0.36 -0.33 0.00 -0.26 0.00 0.00 57.72 56.76 2jbp n HIS 116 Cb 0.23 -0.00 -0.13 0.00 1.12 0.00 0.00 29.99 31.21 2jbp n HIS 116 CO 0.00 0.00 0.00 0.42 0.64 0.00 0.00 176.34 177.40 2jbp s ILE 117 N -1.28 3.29 0.14 1.59 1.01 -1.02 0.43 121.20 125.36 2jbp s ILE 117 Ca 0.43 -0.59 -0.31 0.00 0.00 0.00 0.00 60.65 60.18 2jbp s ILE 117 Cb 0.24 -2.38 -0.11 0.00 0.01 0.00 0.00 42.46 40.22 2jbp s ILE 117 CO 0.32 0.53 1.81 0.54 0.00 0.00 0.00 174.94 178.15 2jbp s VAL 118 N 0.10 2.42 0.27 2.92 0.11 -0.69 -4.79 120.40 120.74 2jbp s VAL 118 Ca -0.04 0.04 -0.29 0.00 -2.93 0.00 0.00 61.98 58.75 2jbp s VAL 118 Cb -0.14 -3.03 -0.10 0.00 -1.53 0.00 0.00 36.38 31.58 2jbp s VAL 118 CO 0.04 0.00 1.26 -0.60 -3.33 0.00 0.00 175.10 172.48 2jbp s ARG 119 N 2.40 4.43 -0.23 1.54 3.52 -1.26 -4.86 118.95 124.49 2jbp s ARG 119 Ca 0.80 2.07 -0.20 0.00 -0.13 0.00 0.00 55.73 58.26 2jbp s ARG 119 Cb -0.47 -3.14 -0.02 0.00 -1.56 0.00 0.00 34.95 29.76 2jbp s ARG 119 CO 0.35 -0.13 0.62 0.42 -0.81 0.00 0.00 175.30 175.76 2jbp s ILE 120 N -0.67 5.01 -0.16 4.11 1.01 -1.26 -1.92 121.20 127.32 2jbp s ILE 120 Ca 0.51 1.13 -0.24 0.00 0.00 0.00 0.00 60.65 62.06 2jbp s ILE 120 Cb -0.37 -3.93 -0.23 0.00 0.01 0.00 0.00 42.46 37.94 2jbp s ILE 120 CO 0.45 0.07 0.50 0.58 0.00 0.00 0.00 174.94 176.54 2jbp h VAL 121 N 5.31 1.30 -2.78 2.92 2.07 -1.09 -3.48 116.25 120.49 2jbp h VAL 121 Ca -0.29 -2.29 -0.06 0.00 0.82 0.00 0.00 66.70 64.88 2jbp h VAL 121 Cb 1.13 2.78 -0.16 0.00 -1.52 0.00 0.00 31.29 33.53 2jbp h VAL 121 CO 0.77 0.50 0.05 -1.81 0.02 0.00 0.00 177.57 177.10 2jbp s ASP 122 N -6.64 -0.45 -0.10 0.57 -0.00 -0.83 -5.02 116.67 104.21 2jbp s ASP 122 Ca -0.23 0.17 0.00 0.00 -0.00 0.00 0.00 52.55 52.48 2jbp s ASP 122 Cb 0.02 0.50 0.02 0.00 -0.00 0.00 0.00 42.92 43.46 2jbp s ASP 122 CO 0.66 -0.73 -0.08 -0.69 -0.00 0.00 0.00 175.17 174.33 2jbp s VAL 123 N -2.53 0.98 0.02 -1.27 1.01 -1.26 -0.59 120.40 116.76 2jbp s VAL 123 Ca -0.05 -0.29 -0.01 0.00 0.00 0.00 0.00 61.98 61.64 2jbp s VAL 123 Cb -0.01 -0.99 -0.04 0.00 0.00 0.00 0.00 36.38 35.35 2jbp s VAL 123 CO -0.02 0.35 0.13 -0.31 0.00 0.00 0.00 175.10 175.25 2jbp s TYR 124 N 1.51 3.38 -0.24 5.22 1.51 -0.04 -0.36 117.35 128.33 2jbp s TYR 124 Ca 0.01 0.24 -0.02 0.00 -1.01 0.00 0.00 57.07 56.28 2jbp s TYR 124 Cb -0.13 -1.75 0.02 0.00 -0.11 0.00 0.00 41.96 39.98 2jbp s TYR 124 CO -0.06 0.58 -0.05 -2.00 -1.11 0.00 0.00 175.55 172.91 2jbp s GLU 125 N -2.00 3.00 0.29 -0.62 2.12 0.83 0.09 118.70 122.41 2jbp s GLU 125 Ca 0.27 -0.87 0.02 0.00 0.36 0.00 0.00 54.97 54.75 2jbp s GLU 125 Cb -0.12 -3.00 -0.04 0.00 0.26 0.00 0.00 34.13 31.22 2jbp s GLU 125 CO 0.18 -0.34 0.13 -0.80 -0.54 0.00 0.00 175.26 173.89 2jbp s ASN 126 N 1.38 1.41 -0.20 -1.70 0.02 0.01 -4.45 114.94 111.41 2jbp s ASN 126 Ca 0.02 -1.48 -0.08 0.00 -1.02 0.00 0.00 52.86 50.30 2jbp s ASN 126 Cb -0.16 0.29 -0.04 0.00 0.02 0.00 0.00 41.25 41.37 2jbp s ASN 126 CO -0.04 -0.82 0.08 -0.76 0.02 0.00 0.00 177.10 175.58 2jbp s LEU 127 N -3.35 3.77 -0.21 0.60 1.43 -1.26 0.63 118.68 120.29 2jbp s LEU 127 Ca 0.36 0.02 -0.04 0.00 -1.03 0.00 0.00 54.13 53.45 2jbp s LEU 127 Cb 0.06 -1.97 0.07 0.00 0.03 0.00 0.00 46.19 44.38 2jbp s LEU 127 CO 0.16 0.12 0.08 -0.47 0.23 0.00 0.00 176.35 176.46 2jbp s TYR 128 N 0.72 0.60 -1.02 0.29 5.04 0.13 -4.74 117.35 118.37 2jbp s TYR 128 Ca 0.04 -0.68 -0.07 0.00 -2.44 0.00 0.00 57.07 53.92 2jbp s TYR 128 Cb -0.13 -0.91 0.01 0.00 0.35 0.00 0.00 41.96 41.28 2jbp s TYR 128 CO 0.02 -0.62 0.89 0.00 -1.34 0.00 0.00 175.55 174.50 2jbp n ALA 129 N 5.17 -0.98 -0.56 3.97 0.00 -1.26 -3.28 120.51 123.56 2jbp n ALA 129 Ca -0.07 0.31 0.00 0.00 0.00 0.00 0.00 53.44 53.67 2jbp n ALA 129 Cb 0.47 -4.27 0.00 0.00 0.00 0.00 0.00 19.45 15.64 2jbp n ALA 129 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2jbp n GLY 130 N -1.64 0.00 3.94 0.00 0.00 -1.26 -4.92 105.19 101.32 2jbp n GLY 130 Ca 0.01 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.78 2jbp n GLY 130 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2jbp s ARG 131 N -1.12 3.48 -0.08 1.61 0.52 -1.21 -5.10 118.95 117.05 2jbp s ARG 131 Ca 0.00 -0.49 -0.07 0.00 -0.52 0.00 0.00 55.73 54.65 2jbp s ARG 131 Cb 0.00 -2.84 -0.04 0.00 0.52 0.00 0.00 34.95 32.59 2jbp s ARG 131 CO 0.00 0.38 0.19 -1.59 0.02 0.00 0.00 175.30 174.30 2jbp s LYS 132 N -3.66 3.50 0.06 3.54 -2.85 -1.26 0.23 119.74 119.29 2jbp s LYS 132 Ca 0.37 -0.11 0.08 0.00 -1.00 0.00 0.00 55.97 55.31 2jbp s LYS 132 Cb -0.10 -3.16 -0.03 0.00 -2.06 0.00 0.00 37.83 32.48 2jbp s LYS 132 CO 0.30 0.74 -0.23 0.00 0.10 0.00 0.00 175.35 176.27 2jbp s LEU 134 N -1.36 4.25 -0.23 0.00 1.02 -0.21 -0.81 118.68 121.35 2jbp s LEU 134 Ca 0.09 0.02 -0.05 0.00 0.02 0.00 0.00 54.13 54.22 2jbp s LEU 134 Cb -0.09 -2.42 -0.01 0.00 0.02 0.00 0.00 46.19 43.69 2jbp s LEU 134 CO 0.02 -0.30 -0.01 -0.76 0.02 0.00 0.00 176.35 175.32 2jbp s LEU 135 N 2.11 3.04 -0.21 1.79 1.43 0.11 -1.08 118.68 125.88 2jbp s LEU 135 Ca 0.14 -0.34 -0.09 0.00 -1.03 0.00 0.00 54.13 52.81 2jbp s LEU 135 Cb -0.16 -1.79 -0.05 0.00 0.03 0.00 0.00 46.19 44.23 2jbp s LEU 135 CO 0.11 -0.02 0.11 -0.63 0.23 0.00 0.00 176.35 176.15 2jbp s ILE 136 N 1.49 5.13 -0.30 -0.59 1.01 -0.18 -0.86 121.20 126.90 2jbp s ILE 136 Ca 0.06 0.09 -0.06 0.00 0.00 0.00 0.00 60.65 60.74 2jbp s ILE 136 Cb -0.14 -3.34 0.02 0.00 0.01 0.00 0.00 42.46 39.00 2jbp s ILE 136 CO -0.01 0.42 0.07 -0.69 0.00 0.00 0.00 174.94 174.72 2jbp s VAL 137 N 0.59 3.79 0.32 2.92 1.01 0.24 -1.20 120.40 128.07 2jbp s VAL 137 Ca 0.06 -0.80 0.09 0.00 0.00 0.00 0.00 61.98 61.33 2jbp s VAL 137 Cb -0.12 -2.98 -0.05 0.00 0.00 0.00 0.00 36.38 33.22 2jbp s VAL 137 CO 0.01 0.05 0.02 0.00 0.00 0.00 0.00 175.10 175.18 2jbp s MET 138 N 1.46 2.17 1.06 2.72 0.23 -0.20 -0.46 119.30 126.27 2jbp s MET 138 Ca 0.02 -1.63 -0.13 0.00 -1.03 0.00 0.00 55.69 52.92 2jbp s MET 138 Cb -0.17 -2.03 0.18 0.00 -1.53 0.00 0.00 34.83 31.28 2jbp s MET 138 CO 0.02 0.19 0.81 -0.85 -2.03 0.00 0.00 175.02 173.16 2jbp n GLU 139 N -0.96 -1.40 -3.68 3.16 0.28 -0.81 -1.27 120.64 115.96 2jbp n GLU 139 Ca -0.04 -0.37 -0.38 0.00 -0.16 0.00 0.00 57.16 56.21 2jbp n GLU 139 Cb 0.61 -2.12 -0.12 0.00 1.43 0.00 0.00 31.44 31.25 2jbp n GLU 139 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 2jbp s LEU 141 N 1.63 6.26 0.10 0.00 1.43 -1.26 -4.83 118.68 122.01 2jbp s LEU 141 Ca 0.05 -3.08 -0.00 0.00 -1.03 0.00 0.00 54.13 50.07 2jbp s LEU 141 Cb -0.16 -2.25 -0.23 0.00 0.03 0.00 0.00 46.19 43.58 2jbp s LEU 141 CO 0.06 -0.50 1.21 -2.24 0.23 0.00 0.00 176.35 175.11 2jbp h ASP 142 N 7.30 0.28 0.00 2.29 2.03 -1.57 -3.31 116.42 123.43 2jbp h ASP 142 Ca 0.17 -0.29 0.00 0.00 -0.73 0.00 0.00 57.03 56.18 2jbp h ASP 142 Cb 0.95 -0.09 0.00 0.00 -0.83 0.00 0.00 39.33 39.36 2jbp h ASP 142 CO 0.95 1.20 0.02 0.61 -1.03 0.00 0.00 179.24 180.99 2jbp n GLY 143 N 1.39 -0.04 0.83 7.15 0.00 -0.77 -4.89 105.19 108.86 2jbp n GLY 143 Ca -0.05 0.00 0.01 0.00 0.00 0.00 0.00 46.02 45.98 2jbp n GLY 143 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2jbp n GLY 144 N -0.93 -2.22 3.04 -0.02 0.00 -1.23 -4.44 105.19 99.39 2jbp n GLY 144 Ca 0.00 -1.50 -0.43 0.00 0.00 0.00 0.00 46.02 44.09 2jbp n GLY 144 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 2jbp n GLU 145 N -1.11 4.20 0.00 1.61 0.28 -1.26 0.25 120.64 124.61 2jbp n GLU 145 Ca 0.00 -4.36 0.00 0.00 -0.16 0.00 0.00 57.16 52.64 2jbp n GLU 145 Cb 0.04 -2.60 0.00 0.00 1.43 0.00 0.00 31.44 30.31 2jbp n GLU 145 CO 0.00 0.00 0.00 -0.11 -0.16 0.00 0.00 177.13 176.86 2jbp n LEU 146 N 2.03 0.00 0.24 -1.84 7.94 -1.19 -1.59 117.00 122.58 2jbp n LEU 146 Ca 0.28 0.00 0.10 0.00 -1.11 0.00 0.00 56.01 55.29 2jbp n LEU 146 Cb 0.35 0.00 0.56 0.00 0.53 0.00 0.00 43.42 44.86 2jbp n LEU 146 CO 0.71 0.00 0.94 -0.26 -1.11 0.00 0.00 177.39 177.67 2jbp h PHE 147 N 0.00 0.00 0.00 1.96 0.05 -1.88 -0.87 116.94 116.21 2jbp h PHE 147 Ca 0.00 0.00 0.00 0.00 3.82 0.00 0.00 57.97 61.79 2jbp h PHE 147 Cb 0.00 0.00 0.00 0.00 2.00 0.00 0.00 35.95 37.95 2jbp h PHE 147 CO 0.00 0.00 -0.04 0.77 -0.18 0.00 0.00 178.31 178.86 2jbp h SER 148 N 0.00 0.00 0.00 2.17 0.02 -1.68 -2.97 113.55 111.09 2jbp h SER 148 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 2jbp h SER 148 Cb 0.60 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.14 2jbp h SER 148 CO 0.00 0.24 0.04 0.54 -1.14 0.00 0.00 176.83 176.52 2jbp n ARG 149 N -3.24 0.00 -0.09 3.45 1.74 -0.35 0.90 116.66 119.06 2jbp n ARG 149 Ca -0.01 0.01 -0.15 0.00 -0.77 0.00 0.00 57.85 56.93 2jbp n ARG 149 Cb 0.02 -1.54 -0.05 0.00 -1.02 0.00 0.00 32.46 29.87 2jbp n ARG 149 CO 0.00 0.00 0.00 -0.89 -1.52 0.00 0.00 177.63 175.22 2jbp n ILE 150 N -0.60 1.35 -0.23 0.55 5.41 -1.09 -4.51 119.36 120.22 2jbp n ILE 150 Ca 0.00 -0.05 0.30 0.00 1.00 0.00 0.00 62.75 64.00 2jbp n ILE 150 Cb 0.04 -2.02 0.70 0.00 -0.71 0.00 0.00 39.64 37.66 2jbp n ILE 150 CO 0.00 0.00 0.00 -0.61 0.00 0.00 0.00 176.55 175.94 2jbp h GLN 151 N -0.81 0.05 -4.58 0.38 4.15 0.69 -2.39 115.11 112.61 2jbp h GLN 151 Ca -0.27 -0.00 -0.74 0.00 0.77 0.00 0.00 58.65 58.41 2jbp h GLN 151 Cb 1.13 -0.01 -0.20 0.00 0.21 0.00 0.00 27.48 28.61 2jbp h GLN 151 CO -0.16 0.03 1.05 -0.51 -1.93 0.00 0.00 178.83 177.31 2jbp s ASP 152 N -5.47 7.01 0.00 -0.69 1.11 0.22 -4.68 116.67 114.17 2jbp s ASP 152 Ca -0.05 -2.89 0.00 0.00 0.18 0.00 0.00 52.55 49.79 2jbp s ASP 152 Cb 0.22 -2.36 0.00 0.00 1.07 0.00 0.00 42.92 41.85 2jbp s ASP 152 CO 0.79 -0.73 0.00 0.54 1.18 0.00 0.00 175.17 176.95 2jbp n ARG 153 N 5.28 0.00 -1.97 8.23 1.74 -0.90 -4.74 116.66 124.30 2jbp n ARG 153 Ca 0.31 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.39 2jbp n ARG 153 Cb 0.44 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 31.88 2jbp n ARG 153 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2jbp n ALA 157 N -3.00 0.00 -2.09 7.54 0.00 -1.26 -5.05 120.51 116.65 2jbp n ALA 157 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 53.44 53.02 2jbp n ALA 157 Cb 0.00 -0.43 -0.03 0.00 0.00 0.00 0.00 19.45 18.99 2jbp n ALA 157 CO 0.00 0.00 0.00 0.12 0.00 0.00 0.00 177.50 177.62 2jbp s PHE 158 N -2.47 3.24 -0.03 0.00 5.99 -1.26 -4.99 117.98 118.45 2jbp s PHE 158 Ca 0.00 1.06 0.02 0.00 0.00 0.00 0.00 56.93 58.01 2jbp s PHE 158 Cb 0.00 -3.66 -0.03 0.00 0.00 0.00 0.00 43.02 39.33 2jbp s PHE 158 CO 0.00 -2.20 -0.06 0.95 -0.00 0.00 0.00 175.22 173.91 2jbp s THR 159 N 0.66 3.75 0.32 0.12 -4.23 -1.26 -1.63 115.64 113.37 2jbp s THR 159 Ca 0.61 -0.60 0.08 0.00 -1.18 0.00 0.00 61.69 60.60 2jbp s THR 159 Cb -0.37 -2.59 0.35 0.00 1.34 0.00 0.00 72.50 71.23 2jbp s THR 159 CO 0.34 0.49 1.62 -0.08 -0.54 0.00 0.00 174.62 176.45 2jbp h GLU 160 N 4.86 0.14 0.31 3.99 4.81 -0.73 0.33 114.58 128.29 2jbp h GLU 160 Ca -0.49 -0.01 -0.00 0.00 -0.13 0.00 0.00 59.36 58.73 2jbp h GLU 160 Cb 1.17 -0.03 -0.02 0.00 0.63 0.00 0.00 28.75 30.50 2jbp h GLU 160 CO 0.53 0.09 -0.27 -0.09 -0.73 0.00 0.00 179.01 178.55 2jbp h ARG 161 N 0.15 -0.58 -0.99 1.92 2.43 -1.74 -0.92 114.38 114.65 2jbp h ARG 161 Ca 0.66 0.04 0.20 0.00 -0.81 0.00 0.00 59.98 60.07 2jbp h ARG 161 Cb 1.48 0.13 -0.10 0.00 -0.42 0.00 0.00 29.97 31.07 2jbp h ARG 161 CO -0.73 -0.39 0.62 0.93 -1.51 0.00 0.00 179.97 178.89 2jbp h GLU 162 N -0.60 0.61 -0.17 0.20 5.08 -1.31 0.13 114.58 118.51 2jbp h GLU 162 Ca -0.02 -0.04 -0.00 0.00 -1.00 0.00 0.00 59.36 58.30 2jbp h GLU 162 Cb 0.54 -0.14 -0.01 0.00 0.50 0.00 0.00 28.75 29.64 2jbp h GLU 162 CO -0.03 0.41 0.09 0.00 -1.00 0.00 0.00 179.01 178.47 2jbp h ALA 163 N 1.64 0.22 -0.14 3.43 0.00 -0.18 0.06 119.26 124.29 2jbp h ALA 163 Ca 0.56 -0.06 0.05 0.00 0.00 0.00 0.00 54.91 55.45 2jbp h ALA 163 Cb 1.05 -0.07 -0.05 0.00 0.00 0.00 0.00 17.79 18.72 2jbp h ALA 163 CO -0.33 -0.24 -0.18 1.03 0.00 0.00 0.00 179.25 179.54 2jbp h SER 164 N 0.17 -0.57 -0.61 0.00 0.87 0.30 0.29 113.55 114.00 2jbp h SER 164 Ca 0.06 0.10 0.10 0.00 -1.23 0.00 0.00 61.79 60.83 2jbp h SER 164 Cb 0.08 0.27 -0.08 0.00 -0.44 0.00 0.00 62.40 62.23 2jbp h SER 164 CO -0.01 -0.23 0.19 -0.33 -0.53 0.00 0.00 176.83 175.92 2jbp h GLU 165 N -0.22 0.34 -0.10 2.24 5.08 -0.45 0.24 114.58 121.69 2jbp h GLU 165 Ca 0.10 -0.02 -0.00 0.00 -1.00 0.00 0.00 59.36 58.44 2jbp h GLU 165 Cb 0.38 -0.08 -0.00 0.00 0.50 0.00 0.00 28.75 29.54 2jbp h GLU 165 CO -0.28 0.22 0.06 0.82 -1.00 0.00 0.00 179.01 178.83 2jbp h ILE 166 N 0.35 1.09 -0.68 3.13 2.04 0.01 -2.55 117.51 120.89 2jbp h ILE 166 Ca 0.32 -0.25 0.00 0.00 1.00 0.00 0.00 64.86 65.93 2jbp h ILE 166 Cb 0.43 1.07 -0.03 0.00 -0.74 0.00 0.00 36.82 37.55 2jbp h ILE 166 CO -0.35 0.08 0.43 0.24 0.00 0.00 0.00 178.15 178.55 2jbp h MET 167 N 0.07 0.90 -0.74 2.37 2.86 0.30 -1.94 114.93 118.76 2jbp h MET 167 Ca 0.04 -0.06 -0.01 0.00 -2.06 0.00 0.00 59.70 57.60 2jbp h MET 167 Cb 0.08 -0.20 -0.04 0.00 0.06 0.00 0.00 31.60 31.50 2jbp h MET 167 CO -0.01 0.61 0.40 -0.22 1.06 0.00 0.00 176.91 178.75 2jbp h LYS 168 N 0.92 1.02 -0.07 1.72 3.64 -0.58 0.94 116.57 124.16 2jbp h LYS 168 Ca 0.25 -0.11 -0.03 0.00 -1.27 0.00 0.00 60.65 59.49 2jbp h LYS 168 Cb -0.08 -0.20 -0.00 0.00 -0.41 0.00 0.00 32.23 31.54 2jbp h LYS 168 CO -0.05 0.75 -0.05 0.66 -2.27 0.00 0.00 179.45 178.48 2jbp h SER 169 N 1.03 0.17 -0.75 4.20 4.64 -1.07 0.08 113.55 121.85 2jbp h SER 169 Ca 0.26 -0.46 0.18 0.00 -0.47 0.00 0.00 61.79 61.31 2jbp h SER 169 Cb 0.03 -0.05 -0.04 0.00 -0.31 0.00 0.00 62.40 62.03 2jbp h SER 169 CO -0.04 0.59 0.51 0.40 -0.87 0.00 0.00 176.83 177.43 2jbp h ILE 170 N -0.24 0.71 -0.11 0.95 2.04 -1.24 0.17 117.51 119.79 2jbp h ILE 170 Ca 0.01 -0.08 -0.16 0.00 1.00 0.00 0.00 64.86 65.64 2jbp h ILE 170 Cb 0.54 0.46 -0.01 0.00 -0.74 0.00 0.00 36.82 37.07 2jbp h ILE 170 CO 0.01 0.04 -0.60 1.23 0.00 0.00 0.00 178.15 178.83 2jbp h GLY 171 N 0.23 0.42 1.34 5.37 0.00 0.03 -2.23 103.07 108.21 2jbp h GLY 171 Ca 0.37 -0.51 -0.17 0.00 0.00 0.00 0.00 47.33 47.02 2jbp h GLY 171 CO -0.08 0.46 -0.53 0.83 0.00 0.00 0.00 176.54 177.22 2jbp h GLU 172 N 0.28 0.70 0.43 4.80 5.08 0.13 0.41 114.58 126.41 2jbp h GLU 172 Ca -0.01 -0.43 -0.01 0.00 -1.00 0.00 0.00 59.36 57.91 2jbp h GLU 172 Cb 1.13 0.05 -0.01 0.00 0.50 0.00 0.00 28.75 30.41 2jbp h GLU 172 CO 0.10 1.05 -0.33 0.00 -1.00 0.00 0.00 179.01 178.84 2jbp h ALA 173 N 0.86 -0.76 -0.27 3.43 0.00 -1.17 -0.34 119.26 121.01 2jbp h ALA 173 Ca 0.02 -0.14 0.03 0.00 0.00 0.00 0.00 54.91 54.82 2jbp h ALA 173 Cb 1.10 0.44 -0.01 0.00 0.00 0.00 0.00 17.79 19.31 2jbp h ALA 173 CO 0.11 -0.95 0.18 0.82 0.00 0.00 0.00 179.25 179.41 2jbp h ILE 174 N -0.75 0.99 -0.15 0.00 1.08 -1.04 -1.81 117.51 115.83 2jbp h ILE 174 Ca -0.04 -0.08 -0.19 0.00 -0.39 0.00 0.00 64.86 64.17 2jbp h ILE 174 Cb 0.64 0.74 0.01 0.00 -3.07 0.00 0.00 36.82 35.14 2jbp h ILE 174 CO 0.00 0.04 -0.63 -0.61 -0.69 0.00 0.00 178.15 176.26 2jbp h GLN 175 N 0.22 0.69 -0.87 2.37 4.15 -0.36 -0.71 115.11 120.60 2jbp h GLN 175 Ca 0.11 -0.54 0.01 0.00 0.77 0.00 0.00 58.65 59.00 2jbp h GLN 175 Cb 0.18 0.11 -0.04 0.00 0.21 0.00 0.00 27.48 27.93 2jbp h GLN 175 CO -0.02 1.16 0.57 -0.92 -1.93 0.00 0.00 178.83 177.69 2jbp h TYR 176 N 0.37 1.09 -0.42 3.99 3.20 -0.26 -0.68 116.97 124.26 2jbp h TYR 176 Ca -0.04 0.03 -0.13 0.00 3.14 0.00 0.00 58.73 61.73 2jbp h TYR 176 Cb 1.26 -0.37 -0.01 0.00 1.54 0.00 0.00 36.73 39.16 2jbp h TYR 176 CO 0.10 0.69 -0.24 -0.07 -1.64 0.00 0.00 178.16 176.99 2jbp h LEU 177 N 1.18 0.94 -0.74 2.82 3.38 -1.10 -2.68 115.31 119.10 2jbp h LEU 177 Ca 0.32 -0.42 -0.12 0.00 0.09 0.00 0.00 57.88 57.75 2jbp h LEU 177 Cb -0.14 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.34 2jbp h LEU 177 CO -0.07 1.15 -0.59 0.45 0.09 0.00 0.00 178.44 179.47 2jbp h HIS 178 N 0.73 0.00 0.00 1.13 3.86 -0.91 0.25 115.15 120.20 2jbp h HIS 178 Ca 0.09 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.30 2jbp h HIS 178 Cb 0.81 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.28 2jbp h HIS 178 CO 0.06 0.59 0.00 -1.13 0.86 0.00 0.00 177.93 178.31 2jbp n SER 179 N -3.73 0.48 -0.29 2.45 3.41 -0.28 -1.73 113.62 113.94 2jbp n SER 179 Ca -0.01 0.63 0.06 0.00 -0.26 0.00 0.00 58.87 59.29 2jbp n SER 179 Cb 0.62 -0.73 0.09 0.00 -0.26 0.00 0.00 64.21 63.92 2jbp n SER 179 CO 0.00 0.00 0.00 2.30 -0.16 0.00 0.00 175.04 177.18 2jbp n ILE 180 N -2.04 1.12 -2.90 -1.33 -5.35 -1.00 -5.00 119.36 102.86 2jbp n ILE 180 Ca 0.02 -1.40 -0.09 0.00 -0.27 0.00 0.00 62.75 61.01 2jbp n ILE 180 Cb 0.19 0.08 0.03 0.00 -1.74 0.00 0.00 39.64 38.20 2jbp n ILE 180 CO 0.00 0.00 0.00 0.59 -1.76 0.00 0.00 176.55 175.38 2jbp n ASN 181 N -0.82 -3.59 -4.12 7.28 4.13 -0.70 -4.94 115.26 112.50 2jbp n ASN 181 Ca 0.10 -0.20 -0.32 0.00 1.68 0.00 0.00 54.58 55.83 2jbp n ASN 181 Cb 0.68 -2.20 -0.16 0.00 -1.54 0.00 0.00 39.78 36.55 2jbp n ASN 181 CO 0.00 0.00 0.00 -0.63 0.28 0.00 0.00 177.26 176.91 2jbp s ILE 182 N -3.12 1.95 -0.08 2.41 1.01 0.80 -1.08 121.20 123.09 2jbp s ILE 182 Ca 0.21 -0.89 -0.10 0.00 0.00 0.00 0.00 60.65 59.87 2jbp s ILE 182 Cb -0.09 -1.75 -0.05 0.00 0.01 0.00 0.00 42.46 40.58 2jbp s ILE 182 CO 0.27 0.53 0.24 0.00 0.00 0.00 0.00 174.94 175.98 2jbp s ALA 183 N 1.07 3.80 0.01 9.38 0.00 -0.75 -3.52 121.76 131.76 2jbp s ALA 183 Ca -0.01 -0.48 -0.00 0.00 0.00 0.00 0.00 51.96 51.46 2jbp s ALA 183 Cb -0.14 -2.14 -0.26 0.00 0.00 0.00 0.00 23.12 20.58 2jbp s ALA 183 CO -0.07 0.55 0.87 1.25 0.00 0.00 0.00 175.76 178.36 2jbp h HIS 184 N 4.96 0.36 -0.30 0.00 2.76 -1.90 -1.83 115.15 119.19 2jbp h HIS 184 Ca -0.53 -0.26 -0.13 0.00 -2.20 0.00 0.00 60.37 57.25 2jbp h HIS 184 Cb 1.22 -0.01 -0.05 0.00 1.55 0.00 0.00 27.41 30.12 2jbp h HIS 184 CO 0.73 1.31 -0.12 0.54 -1.30 0.00 0.00 177.93 179.10 2jbp n ARG 185 N -3.40 -1.15 -1.99 5.26 5.12 -1.26 -2.63 116.66 116.61 2jbp n ARG 185 Ca -0.15 0.63 -0.01 0.00 -1.93 0.00 0.00 57.85 56.39 2jbp n ARG 185 Cb 1.03 -4.66 0.05 0.00 -1.16 0.00 0.00 32.46 27.73 2jbp n ARG 185 CO 0.00 0.00 0.00 -3.47 -1.93 0.00 0.00 177.63 172.23 2jbp n ASP 186 N -0.46 -0.63 -4.61 0.55 2.03 -1.26 -4.89 116.55 107.29 2jbp n ASP 186 Ca -0.06 -1.52 -0.43 0.00 0.52 0.00 0.00 54.79 53.30 2jbp n ASP 186 Cb 0.39 0.29 -0.02 0.00 -0.72 0.00 0.00 41.12 41.06 2jbp n ASP 186 CO 0.00 0.00 0.00 -0.69 -1.92 0.00 0.00 177.20 174.59 2jbp s VAL 187 N 0.06 3.63 0.37 5.18 1.01 -1.26 -4.90 120.40 124.47 2jbp s VAL 187 Ca 0.04 0.65 0.05 0.00 0.00 0.00 0.00 61.98 62.71 2jbp s VAL 187 Cb 0.19 -3.80 -0.03 0.00 0.00 0.00 0.00 36.38 32.74 2jbp s VAL 187 CO -0.06 -0.48 0.17 -1.59 0.00 0.00 0.00 175.10 173.15 2jbp s LYS 188 N 5.28 1.81 0.14 2.72 -2.85 -1.26 -4.78 119.74 120.81 2jbp s LYS 188 Ca 0.74 -2.08 -0.14 0.00 -1.00 0.00 0.00 55.97 53.49 2jbp s LYS 188 Cb -0.21 -0.27 0.01 0.00 -2.06 0.00 0.00 37.83 35.31 2jbp s LYS 188 CO 0.33 -0.52 1.62 -1.35 0.10 0.00 0.00 175.35 175.53 2jbp h PRO 189 N 1.97 0.78 0.00 1.78 0.11 -1.96 -2.51 132.00 132.17 2jbp h PRO 189 Ca -0.32 -0.22 0.00 0.00 0.11 0.00 0.00 66.00 65.57 2jbp h PRO 189 Cb 1.26 -0.09 0.00 0.00 0.11 0.00 0.00 31.00 32.28 2jbp h PRO 189 CO 0.51 0.80 0.05 0.39 -0.21 0.00 0.00 178.00 179.53 2jbp n GLU 190 N -4.44 0.07 -0.51 1.05 4.71 -1.26 -0.99 120.64 119.27 2jbp n GLU 190 Ca 0.01 0.55 0.08 0.00 -0.01 0.00 0.00 57.16 57.78 2jbp n GLU 190 Cb 0.26 -1.77 0.28 0.00 -1.01 0.00 0.00 31.44 29.20 2jbp n GLU 190 CO 0.00 0.00 0.00 0.09 0.09 0.00 0.00 177.13 177.31 2jbp n ASN 191 N -1.85 4.16 -4.00 1.62 5.03 -0.94 -4.81 115.26 114.47 2jbp n ASN 191 Ca -0.01 -2.91 -0.31 0.00 0.87 0.00 0.00 54.58 52.23 2jbp n ASN 191 Cb 0.07 -0.55 -0.15 0.00 -1.02 0.00 0.00 39.78 38.13 2jbp n ASN 191 CO 0.00 0.00 0.00 -0.76 -1.83 0.00 0.00 177.26 174.67 2jbp s LEU 192 N -2.65 4.55 0.28 3.41 1.43 -0.16 -1.25 118.68 124.30 2jbp s LEU 192 Ca 0.43 -2.11 0.08 0.00 -1.03 0.00 0.00 54.13 51.50 2jbp s LEU 192 Cb 0.34 -1.56 -0.04 0.00 0.03 0.00 0.00 46.19 44.95 2jbp s LEU 192 CO 0.11 -0.38 0.11 -0.76 0.23 0.00 0.00 176.35 175.66 2jbp s LEU 193 N 0.96 3.42 -0.02 1.79 1.43 -0.47 -3.16 118.68 122.63 2jbp s LEU 193 Ca 0.11 -0.55 -0.02 0.00 -1.03 0.00 0.00 54.13 52.64 2jbp s LEU 193 Cb -0.19 -1.94 -0.04 0.00 0.03 0.00 0.00 46.19 44.06 2jbp s LEU 193 CO -0.09 -0.10 0.12 -0.31 0.23 0.00 0.00 176.35 176.19 2jbp s TYR 194 N -2.29 3.40 0.14 0.29 2.02 0.14 -0.22 117.35 120.83 2jbp s TYR 194 Ca 0.34 0.29 -0.11 0.00 -0.37 0.00 0.00 57.07 57.22 2jbp s TYR 194 Cb -0.06 -1.79 -0.03 0.00 -0.40 0.00 0.00 41.96 39.69 2jbp s TYR 194 CO 0.22 0.60 1.50 1.79 -1.57 0.00 0.00 175.55 178.09 2jbp h THR 195 N 3.15 1.27 -2.71 -0.71 1.35 -0.76 -2.05 112.91 112.45 2jbp h THR 195 Ca -0.50 -1.48 0.00 0.00 -0.55 0.00 0.00 66.41 63.89 2jbp h THR 195 Cb 1.19 1.29 0.00 0.00 -1.73 0.00 0.00 68.15 68.90 2jbp h THR 195 CO 0.64 0.50 0.00 -1.20 -0.25 0.00 0.00 175.52 175.21 2jbp n SER 196 N -4.10 1.01 -0.06 5.36 7.64 -1.26 -3.25 113.62 118.97 2jbp n SER 196 Ca -0.01 -0.70 -0.02 0.00 1.01 0.00 0.00 58.87 59.15 2jbp n SER 196 Cb 0.50 0.00 -0.16 0.00 -1.01 0.00 0.00 64.21 63.55 2jbp n SER 196 CO 0.00 0.00 0.00 0.29 -3.01 0.00 0.00 175.04 172.32 2jbp n LYS 197 N 0.00 0.67 -1.31 1.43 4.76 -1.26 -2.38 118.16 120.07 2jbp n LYS 197 Ca 0.00 -0.06 -0.37 0.00 -2.87 0.00 0.00 58.31 55.00 2jbp n LYS 197 Cb 0.00 -1.54 0.05 0.00 -1.84 0.00 0.00 35.03 31.70 2jbp n LYS 197 CO 0.00 0.00 0.00 0.54 -1.37 0.00 0.00 177.40 176.57 2jbp n ARG 198 N -2.58 0.30 0.06 1.97 1.74 -1.26 -4.92 116.66 111.97 2jbp n ARG 198 Ca -0.21 0.13 -0.13 0.00 -0.77 0.00 0.00 57.85 56.87 2jbp n ARG 198 Cb 0.92 -1.59 -0.14 0.00 -1.02 0.00 0.00 32.46 30.63 2jbp n ARG 198 CO 0.00 0.00 0.00 -1.00 -1.52 0.00 0.00 177.63 175.11 2jbp h PRO 199 N -0.14 0.16 -0.49 5.56 0.13 -2.05 -2.80 132.00 132.38 2jbp h PRO 199 Ca -0.45 -0.28 0.00 0.00 -0.87 0.00 0.00 66.00 64.41 2jbp h PRO 199 Cb 1.38 0.10 0.00 0.00 0.13 0.00 0.00 31.00 32.61 2jbp h PRO 199 CO 0.43 1.02 0.00 0.27 -0.23 0.00 0.00 178.00 179.49 2jbp n ASN 200 N -3.39 2.38 -4.78 1.44 6.94 -1.26 -4.94 115.26 111.66 2jbp n ASN 200 Ca -0.12 -2.13 -0.41 0.00 -0.02 0.00 0.00 54.58 51.90 2jbp n ASN 200 Cb 1.02 -0.34 -0.00 0.00 -2.36 0.00 0.00 39.78 38.09 2jbp n ASN 200 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 2jbp s ALA 201 N -1.61 3.60 0.39 -2.53 0.00 -1.06 -4.96 121.76 115.58 2jbp s ALA 201 Ca 0.26 1.59 -0.25 0.00 0.00 0.00 0.00 51.96 53.56 2jbp s ALA 201 Cb 0.15 -3.62 -0.09 0.00 0.00 0.00 0.00 23.12 19.56 2jbp s ALA 201 CO 0.14 -1.08 1.08 0.42 0.00 0.00 0.00 175.76 176.33 2jbp s ILE 202 N -1.02 3.58 -0.10 0.00 -1.09 -1.26 -4.74 121.20 116.57 2jbp s ILE 202 Ca 0.54 1.27 -0.15 0.00 -2.23 0.00 0.00 60.65 60.08 2jbp s ILE 202 Cb -0.47 -3.68 -0.05 0.00 -1.58 0.00 0.00 42.46 36.68 2jbp s ILE 202 CO 0.62 0.06 0.36 -0.22 -1.23 0.00 0.00 174.94 174.54 2jbp s LEU 203 N -2.50 4.33 0.03 2.97 2.96 -1.26 -0.05 118.68 125.16 2jbp s LEU 203 Ca 0.56 0.71 0.05 0.00 -0.22 0.00 0.00 54.13 55.24 2jbp s LEU 203 Cb -0.25 -2.50 -0.02 0.00 0.50 0.00 0.00 46.19 43.93 2jbp s LEU 203 CO 0.31 0.16 -0.15 -0.54 -1.32 0.00 0.00 176.35 174.81 2jbp s LYS 204 N -0.04 1.06 0.16 1.98 1.02 0.69 -4.60 119.74 120.02 2jbp s LYS 204 Ca 0.21 -0.74 -0.15 0.00 0.02 0.00 0.00 55.97 55.30 2jbp s LYS 204 Cb -0.14 -1.08 -0.07 0.00 -0.52 0.00 0.00 37.83 36.01 2jbp s LYS 204 CO 0.08 0.28 0.57 -1.17 -0.92 0.00 0.00 175.35 174.19 2jbp s LEU 205 N -0.99 4.34 0.28 3.17 2.96 0.17 -1.36 118.68 127.24 2jbp s LEU 205 Ca 0.03 1.13 0.03 0.00 -0.22 0.00 0.00 54.13 55.10 2jbp s LEU 205 Cb -0.08 -3.31 -0.04 0.00 0.50 0.00 0.00 46.19 43.27 2jbp s LEU 205 CO 0.01 0.09 0.18 0.42 -1.32 0.00 0.00 176.35 175.73 2jbp s THR 206 N -1.47 0.13 -0.15 3.68 -4.23 -0.38 -1.70 115.64 111.52 2jbp s THR 206 Ca 0.38 -2.00 -0.02 0.00 -1.18 0.00 0.00 61.69 58.87 2jbp s THR 206 Cb -0.15 -2.51 0.00 0.00 1.34 0.00 0.00 72.50 71.18 2jbp s THR 206 CO 0.19 0.00 0.08 -0.67 -0.54 0.00 0.00 174.62 173.68 2jbp n ASP 207 N -0.88 -4.70 -1.58 3.99 2.03 -1.26 -4.89 116.55 109.25 2jbp n ASP 207 Ca 0.03 0.53 -0.05 0.00 0.52 0.00 0.00 54.79 55.82 2jbp n ASP 207 Cb 0.65 -2.96 0.19 0.00 -0.72 0.00 0.00 41.12 38.28 2jbp n ASP 207 CO 0.00 0.00 0.00 0.49 -1.92 0.00 0.00 177.20 175.77 2jbp n PHE 208 N 0.10 1.64 0.30 -0.67 3.01 -1.26 -4.45 117.46 116.14 2jbp n PHE 208 Ca 0.02 -0.89 0.19 0.00 1.01 0.00 0.00 57.45 57.79 2jbp n PHE 208 Cb 0.06 -0.52 0.99 0.00 -0.01 0.00 0.00 39.48 40.00 2jbp n PHE 208 CO 0.00 0.00 0.00 0.78 1.01 0.00 0.00 176.76 178.55 2jbp h GLY 209 N 3.31 0.00 0.00 1.37 0.00 -1.91 -2.47 103.07 103.37 2jbp h GLY 209 Ca 0.19 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.52 2jbp h GLY 209 CO 0.50 0.00 -0.30 0.69 0.00 0.00 0.00 176.54 177.44 2jbp n PHE 210 N -2.91 0.00 -1.51 5.60 3.72 -1.26 -4.96 117.46 116.14 2jbp n PHE 210 Ca -0.02 0.00 -0.49 0.00 -0.05 0.00 0.00 57.45 56.89 2jbp n PHE 210 Cb 0.12 0.00 -0.04 0.00 -0.94 0.00 0.00 39.48 38.62 2jbp n PHE 210 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 2jbp n ALA 211 N -1.12 -1.81 -2.85 4.37 0.00 -0.93 -4.71 120.51 113.45 2jbp n ALA 211 Ca 0.00 0.46 -0.13 0.00 0.00 0.00 0.00 53.44 53.77 2jbp n ALA 211 Cb 0.00 -1.84 -0.13 0.00 0.00 0.00 0.00 19.45 17.47 2jbp n ALA 211 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.50 177.71 2jbp s LYS 212 N -0.79 0.23 0.66 0.00 2.20 -0.69 -4.91 119.74 116.45 2jbp s LYS 212 Ca 0.69 -0.23 -0.17 0.00 -0.36 0.00 0.00 55.97 55.90 2jbp s LYS 212 Cb -0.91 -0.14 -0.00 0.00 -1.51 0.00 0.00 37.83 35.27 2jbp s LYS 212 CO 0.56 0.03 1.23 -2.00 -0.36 0.00 0.00 175.35 174.81 2jbp s GLU 213 N -0.43 2.55 -0.29 4.03 2.56 -1.26 -1.80 118.70 124.06 2jbp s GLU 213 Ca -0.03 1.86 0.07 0.00 0.00 0.00 0.00 54.97 56.88 2jbp s GLU 213 Cb -0.03 -1.87 0.46 0.00 2.00 0.00 0.00 34.13 34.69 2jbp s GLU 213 CO -0.00 -1.55 1.19 0.25 -0.56 0.00 0.00 175.26 174.59 2jbp n THR 214 N -2.10 2.49 0.00 -1.70 -2.24 -0.24 -4.83 114.28 105.66 2jbp n THR 214 Ca 0.14 -4.16 0.00 0.00 -2.27 0.00 0.00 64.05 57.76 2jbp n THR 214 Cb 0.49 -1.06 0.00 0.00 -2.10 0.00 0.00 70.33 67.66 2jbp n THR 214 CO 0.00 0.00 0.00 1.07 -0.57 0.00 0.00 175.07 175.57 2jbp n THR 215 N -0.72 0.00 -1.23 4.28 5.66 -1.26 -4.75 114.28 116.26 2jbp n THR 215 Ca 0.42 0.00 -0.20 0.00 -3.05 0.00 0.00 64.05 61.22 2jbp n THR 215 Cb 0.96 0.00 -0.07 0.00 -1.55 0.00 0.00 70.33 69.66 2jbp n THR 215 CO 0.00 0.00 0.00 -0.24 -3.05 0.00 0.00 175.07 171.78 2jbp n SER 216 N 0.00 6.09 0.00 1.09 2.88 -1.26 -5.02 113.62 117.40 2jbp n SER 216 Ca 0.00 -2.96 0.00 0.00 -1.33 0.00 0.00 58.87 54.58 2jbp n SER 216 Cb 0.00 -1.25 0.00 0.00 -0.75 0.00 0.00 64.21 62.21 2jbp n SER 216 CO 0.00 0.00 0.00 -2.65 -1.23 0.00 0.00 175.04 171.16 2jbp n PRO 227 N 1.27 0.00 0.00 -1.46 -0.02 -1.26 -5.18 135.00 128.35 2jbp n PRO 227 Ca 0.42 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.90 2jbp n PRO 227 Cb 0.65 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 34.13 2jbp n PRO 227 CO 0.00 0.00 0.00 2.48 1.98 0.00 0.00 175.50 179.96 2jbp n TYR 228 N 0.00 0.00 -0.58 6.00 4.11 -1.26 -4.79 117.16 120.64 2jbp n TYR 228 Ca 0.00 0.00 0.09 0.00 -0.00 0.00 0.00 57.90 57.99 2jbp n TYR 228 Cb 0.00 0.00 0.33 0.00 -0.00 0.00 0.00 39.34 39.68 2jbp n TYR 228 CO 0.00 0.00 0.00 2.48 -0.00 0.00 0.00 176.86 179.34 2jbp n TYR 229 N 0.00 1.32 -2.61 -3.48 0.18 -1.26 -4.98 117.16 106.33 2jbp n TYR 229 Ca 0.00 -0.61 -0.43 0.00 1.88 0.00 0.00 57.90 58.75 2jbp n TYR 229 Cb 0.02 -0.20 -0.02 0.00 -0.38 0.00 0.00 39.34 38.75 2jbp n TYR 229 CO 0.00 0.00 0.00 0.54 -2.08 0.00 0.00 176.86 175.32 2jbp s VAL 230 N -1.74 4.60 0.41 -3.48 0.11 -1.26 -5.02 120.40 114.03 2jbp s VAL 230 Ca 0.48 1.92 -0.24 0.00 -2.93 0.00 0.00 61.98 61.20 2jbp s VAL 230 Cb 0.31 -4.23 -0.08 0.00 -1.53 0.00 0.00 36.38 30.84 2jbp s VAL 230 CO 0.24 -0.10 1.16 0.00 -3.33 0.00 0.00 175.10 173.06 2jbp s ALA 231 N 2.82 3.10 -0.75 1.54 0.00 -1.26 -4.92 121.76 122.29 2jbp s ALA 231 Ca 0.48 0.93 0.26 0.00 0.00 0.00 0.00 51.96 53.63 2jbp s ALA 231 Cb -0.18 -3.37 0.91 0.00 0.00 0.00 0.00 23.12 20.48 2jbp s ALA 231 CO 0.12 -0.53 1.78 -0.35 0.00 0.00 0.00 175.76 176.79 2jbp n PRO 232 N -0.08 0.19 -0.03 0.00 -0.04 -1.26 -2.30 135.00 131.48 2jbp n PRO 232 Ca 0.05 0.21 0.00 0.00 -0.04 0.00 0.00 63.50 63.72 2jbp n PRO 232 Cb 0.47 -1.75 0.02 0.00 -0.04 0.00 0.00 33.50 32.20 2jbp n PRO 232 CO 0.00 0.00 0.00 -0.85 -0.04 0.00 0.00 175.50 174.61 2jbp n GLU 233 N -2.09 1.14 -0.03 0.54 -0.00 -1.26 -3.22 120.64 115.72 2jbp n GLU 233 Ca 0.05 -0.14 -0.04 0.00 -0.00 0.00 0.00 57.16 57.03 2jbp n GLU 233 Cb 0.37 -1.29 -0.02 0.00 -0.00 0.00 0.00 31.44 30.50 2jbp n GLU 233 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.13 177.41 2jbp n VAL 234 N -0.18 0.30 -0.00 3.84 0.31 -0.97 -4.59 118.33 117.05 2jbp n VAL 234 Ca 0.01 -0.12 0.00 0.00 -0.01 0.00 0.00 64.34 64.23 2jbp n VAL 234 Cb 0.17 -0.69 0.00 0.00 -0.91 0.00 0.00 33.84 32.41 2jbp n VAL 234 CO 0.00 0.00 0.00 0.18 -1.32 0.00 0.00 176.83 175.69 2jbp n LEU 235 N -2.66 0.00 -0.53 7.52 4.77 -1.20 -4.77 117.00 120.14 2jbp n LEU 235 Ca -0.09 -0.62 0.04 0.00 -0.03 0.00 0.00 56.01 55.30 2jbp n LEU 235 Cb 0.60 -0.12 -0.02 0.00 -2.33 0.00 0.00 43.42 41.55 2jbp n LEU 235 CO 0.05 -0.68 -0.21 0.61 -1.33 0.00 0.00 177.39 175.84 2jbp n GLY 236 N 3.24 -3.05 0.00 -0.72 0.00 -1.26 -5.00 105.19 98.40 2jbp n GLY 236 Ca 0.00 -1.24 0.00 0.00 0.00 0.00 0.00 46.02 44.78 2jbp n GLY 236 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2jbp n PRO 237 N -2.44 2.96 0.00 1.61 -0.04 -1.26 -4.61 135.00 131.22 2jbp n PRO 237 Ca -0.02 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.44 2jbp n PRO 237 Cb 0.21 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.67 2jbp n PRO 237 CO 0.00 0.00 0.00 -1.91 -0.04 0.00 0.00 175.50 173.55 2jbp n GLU 238 N 0.00 0.00 -2.44 0.54 2.13 -1.26 -5.00 120.64 114.61 2jbp n GLU 238 Ca 0.00 0.00 -0.31 0.00 0.66 0.00 0.00 57.16 57.51 2jbp n GLU 238 Cb 0.00 0.00 -0.02 0.00 0.27 0.00 0.00 31.44 31.69 2jbp n GLU 238 CO 0.00 0.00 0.00 0.15 -0.41 0.00 0.00 177.13 176.87 2jbp s LYS 239 N -2.43 3.79 0.20 5.31 -0.14 -1.26 -4.93 119.74 120.27 2jbp s LYS 239 Ca 0.00 0.70 0.05 0.00 -1.36 0.00 0.00 55.97 55.36 2jbp s LYS 239 Cb 0.00 -2.22 0.58 0.00 -1.68 0.00 0.00 37.83 34.51 2jbp s LYS 239 CO 0.00 -0.26 0.93 0.66 -0.76 0.00 0.00 175.35 175.92 2jbp n TYR 240 N -1.81 0.50 0.00 3.18 0.53 -1.26 -3.56 117.16 114.74 2jbp n TYR 240 Ca 0.05 0.71 0.00 0.00 -1.02 0.00 0.00 57.90 57.64 2jbp n TYR 240 Cb 0.54 -1.02 0.00 0.00 -1.03 0.00 0.00 39.34 37.83 2jbp n TYR 240 CO 0.00 0.00 0.00 -0.25 -1.02 0.00 0.00 176.86 175.59 2jbp n ASP 241 N -4.60 0.00 -0.21 7.72 8.00 -1.26 0.36 116.55 126.56 2jbp n ASP 241 Ca 0.17 0.00 -0.02 0.00 0.71 0.00 0.00 54.79 55.66 2jbp n ASP 241 Cb 0.57 0.00 0.09 0.00 -0.02 0.00 0.00 41.12 41.77 2jbp n ASP 241 CO 0.00 0.00 0.00 0.11 -0.39 0.00 0.00 177.20 176.92 2jbp h LYS 242 N 0.00 0.56 -0.98 -1.24 1.57 -1.96 0.22 116.57 114.73 2jbp h LYS 242 Ca 0.00 -0.03 0.25 0.00 -1.87 0.00 0.00 60.65 59.00 2jbp h LYS 242 Cb 0.00 -0.13 -0.07 0.00 0.08 0.00 0.00 32.23 32.11 2jbp h LYS 242 CO 0.00 0.37 0.66 0.66 -0.57 0.00 0.00 179.45 180.57 2jbp h SER 243 N 0.58 0.32 -0.59 0.86 4.64 -0.40 0.25 113.55 119.22 2jbp h SER 243 Ca 0.29 0.05 0.12 0.00 -0.47 0.00 0.00 61.79 61.78 2jbp h SER 243 Cb 0.24 -0.01 -0.11 0.00 -0.31 0.00 0.00 62.40 62.21 2jbp h SER 243 CO -0.21 0.09 -0.10 0.00 -0.87 0.00 0.00 176.83 175.75 2jbp h ASP 245 N 0.04 0.35 -0.46 0.00 3.32 -0.58 -2.68 116.42 116.41 2jbp h ASP 245 Ca 0.29 -0.10 0.09 0.00 0.02 0.00 0.00 57.03 57.33 2jbp h ASP 245 Cb 0.45 -0.09 -0.02 0.00 0.22 0.00 0.00 39.33 39.89 2jbp h ASP 245 CO -0.57 0.36 0.32 0.24 -1.72 0.00 0.00 179.24 177.86 2jbp h MET 246 N 0.32 0.23 0.69 3.56 2.86 -0.77 0.12 114.93 121.94 2jbp h MET 246 Ca 0.10 -0.01 -0.03 0.00 -2.06 0.00 0.00 59.70 57.69 2jbp h MET 246 Cb 0.09 -0.05 0.01 0.00 0.06 0.00 0.00 31.60 31.70 2jbp h MET 246 CO -0.01 0.15 -0.33 2.35 1.06 0.00 0.00 176.91 180.13 2jbp h TRP 247 N 0.24 -0.86 -0.97 -0.22 2.91 -0.91 -1.72 115.95 114.42 2jbp h TRP 247 Ca 0.21 -0.02 0.26 0.00 1.13 0.00 0.00 58.89 60.48 2jbp h TRP 247 Cb 0.54 0.28 -0.18 0.00 -0.51 0.00 0.00 29.16 29.29 2jbp h TRP 247 CO -0.00 -0.51 0.01 0.43 -1.03 0.00 0.00 178.44 177.35 2jbp n SER 248 N -5.41 -0.12 -0.24 2.65 7.64 -0.59 0.76 113.62 118.31 2jbp n SER 248 Ca -0.12 1.64 -0.06 0.00 1.01 0.00 0.00 58.87 61.34 2jbp n SER 248 Cb 0.38 -0.60 0.07 0.00 -1.01 0.00 0.00 64.21 63.06 2jbp n SER 248 CO 0.00 0.00 0.00 0.25 -3.01 0.00 0.00 175.04 172.28 2jbp h LEU 249 N 0.00 1.04 -0.85 -3.43 5.85 -0.41 0.56 115.31 118.07 2jbp h LEU 249 Ca 0.58 -0.21 -0.04 0.00 0.84 0.00 0.00 57.88 59.05 2jbp h LEU 249 Cb 1.20 -0.27 -0.04 0.00 0.37 0.00 0.00 40.66 41.92 2jbp h LEU 249 CO -0.91 0.99 0.34 1.23 -0.34 0.00 0.00 178.44 179.75 2jbp h GLY 250 N 1.08 1.27 1.19 3.75 0.00 0.13 -1.54 103.07 108.95 2jbp h GLY 250 Ca 0.22 -0.67 -0.14 0.00 0.00 0.00 0.00 47.33 46.75 2jbp h GLY 250 CO -0.00 0.63 -0.28 -2.08 0.00 0.00 0.00 176.54 174.81 2jbp h VAL 251 N 1.16 1.27 -0.47 4.60 2.07 0.48 -0.76 116.25 124.61 2jbp h VAL 251 Ca 0.27 -1.44 -0.03 0.00 0.82 0.00 0.00 66.70 66.32 2jbp h VAL 251 Cb 0.18 1.24 -0.02 0.00 -1.52 0.00 0.00 31.29 31.17 2jbp h VAL 251 CO -0.03 0.49 0.16 0.40 0.02 0.00 0.00 177.57 178.61 2jbp h ILE 252 N 0.77 1.22 -0.93 4.57 2.04 -1.16 -1.49 117.51 122.53 2jbp h ILE 252 Ca 0.09 -0.72 0.02 0.00 1.00 0.00 0.00 64.86 65.24 2jbp h ILE 252 Cb 0.84 0.81 -0.05 0.00 -0.74 0.00 0.00 36.82 37.69 2jbp h ILE 252 CO 0.07 0.26 0.62 -0.03 0.00 0.00 0.00 178.15 179.07 2jbp h MET 253 N 0.62 1.20 0.77 2.37 4.05 -0.97 0.13 114.93 123.11 2jbp h MET 253 Ca 0.15 -0.07 -0.04 0.00 -0.28 0.00 0.00 59.70 59.46 2jbp h MET 253 Cb 0.25 -0.27 0.00 0.00 -0.80 0.00 0.00 31.60 30.78 2jbp h MET 253 CO -0.01 0.80 -0.40 -0.92 0.23 0.00 0.00 176.91 176.61 2jbp h TYR 254 N 1.24 -1.05 -1.01 1.39 5.03 -0.82 -2.49 116.97 119.27 2jbp h TYR 254 Ca 0.35 -0.02 0.05 0.00 2.58 0.00 0.00 58.73 61.69 2jbp h TYR 254 Cb -0.11 0.36 -0.06 0.00 1.55 0.00 0.00 36.73 38.46 2jbp h TYR 254 CO -0.01 -0.63 0.65 0.82 -1.32 0.00 0.00 178.16 177.67 2jbp h ILE 255 N -1.08 1.12 -1.00 1.81 2.04 -0.99 -1.01 117.51 118.40 2jbp h ILE 255 Ca -0.10 -0.42 0.24 0.00 1.00 0.00 0.00 64.86 65.58 2jbp h ILE 255 Cb 0.84 -0.20 -0.09 0.00 -0.74 0.00 0.00 36.82 36.63 2jbp h ILE 255 CO 0.15 0.22 0.65 -0.07 0.00 0.00 0.00 178.15 179.10 2jbp h LEU 256 N 1.22 0.47 0.00 1.44 3.38 -0.47 0.11 115.31 121.46 2jbp h LEU 256 Ca 0.42 0.07 0.00 0.00 0.09 0.00 0.00 57.88 58.46 2jbp h LEU 256 Cb 0.10 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 40.84 2jbp h LEU 256 CO -0.15 0.13 -0.43 0.18 0.09 0.00 0.00 178.44 178.25 2jbp n LEU 257 N -4.60 0.62 0.00 1.67 4.77 -0.39 -4.51 117.00 114.55 2jbp n LEU 257 Ca 0.23 0.27 0.00 0.00 -0.03 0.00 0.00 56.01 56.49 2jbp n LEU 257 Cb 0.80 -0.25 0.00 0.00 -2.33 0.00 0.00 43.42 41.64 2jbp n LEU 257 CO 0.27 -0.04 0.00 0.00 -1.33 0.00 0.00 177.39 176.29 2jbp n GLY 259 N 0.00 1.37 3.08 0.00 0.00 0.34 -4.41 105.19 105.58 2jbp n GLY 259 Ca 0.00 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 45.95 2jbp n GLY 259 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 2jbp s TYR 260 N -3.07 0.50 0.63 1.61 1.13 -1.26 -4.51 117.35 112.38 2jbp s TYR 260 Ca 0.00 -1.01 -0.14 0.00 -1.41 0.00 0.00 57.07 54.50 2jbp s TYR 260 Cb 0.00 -0.37 -0.02 0.00 -1.10 0.00 0.00 41.96 40.46 2jbp s TYR 260 CO 0.00 -0.36 1.06 -1.25 -2.51 0.00 0.00 175.55 172.49 2jbp s PRO 261 N -3.68 3.18 0.24 -3.49 0.04 -1.26 -3.89 135.00 126.15 2jbp s PRO 261 Ca 0.05 1.14 0.12 0.00 0.04 0.00 0.00 61.00 62.34 2jbp s PRO 261 Cb 0.06 -2.02 0.19 0.00 0.04 0.00 0.00 34.50 32.77 2jbp s PRO 261 CO -0.09 -0.91 1.50 -1.00 0.04 0.00 0.00 177.00 176.53 2jbp h PRO 262 N 0.09 0.00 -5.02 0.56 0.13 -1.94 -3.42 132.00 122.40 2jbp h PRO 262 Ca -0.46 0.00 -0.65 0.00 -0.87 0.00 0.00 66.00 64.02 2jbp h PRO 262 Cb 1.22 0.00 -0.25 0.00 0.13 0.00 0.00 31.00 32.10 2jbp h PRO 262 CO 0.57 0.68 -0.67 -0.06 -0.23 0.00 0.00 178.00 178.29 2jbp s PHE 263 N -3.21 3.02 0.13 1.56 0.40 -1.26 -4.72 117.98 113.89 2jbp s PHE 263 Ca 0.01 -0.64 0.00 0.00 -0.60 0.00 0.00 56.93 55.70 2jbp s PHE 263 Cb 0.11 -2.14 0.02 0.00 0.51 0.00 0.00 43.02 41.52 2jbp s PHE 263 CO 0.76 -0.40 0.17 0.66 0.70 0.00 0.00 175.22 177.12 2jbp n TYR 264 N 4.68 -3.20 0.00 0.36 0.53 -1.26 -5.09 117.16 113.18 2jbp n TYR 264 Ca -0.17 -0.33 0.00 0.00 -1.02 0.00 0.00 57.90 56.37 2jbp n TYR 264 Cb 0.51 -0.12 0.00 0.00 -1.03 0.00 0.00 39.34 38.70 2jbp n TYR 264 CO 0.00 0.00 0.00 0.45 -1.02 0.00 0.00 176.86 176.29 2jbp n SER 265 N -2.96 0.04 0.00 7.72 2.88 -1.26 -4.37 113.62 115.66 2jbp n SER 265 Ca 0.03 0.01 0.00 0.00 -1.33 0.00 0.00 58.87 57.58 2jbp n SER 265 Cb 0.11 -0.01 0.00 0.00 -0.75 0.00 0.00 64.21 63.56 2jbp n SER 265 CO 0.00 0.00 0.00 0.59 -1.23 0.00 0.00 175.04 174.40 2jbp n ASN 266 N -2.55 0.00 0.00 -3.46 3.02 -1.26 -4.20 115.26 106.81 2jbp n ASN 266 Ca 0.00 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.55 2jbp n ASN 266 Cb 0.00 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.17 2jbp n ASN 266 CO 0.00 0.00 0.00 -0.24 -2.62 0.00 0.00 177.26 174.40 2jbp n SER 272 N 2.95 0.00 0.08 6.41 2.88 -1.26 -5.14 113.62 119.53 2jbp n SER 272 Ca 0.00 0.00 0.11 0.00 -1.33 0.00 0.00 58.87 57.65 2jbp n SER 272 Cb 0.00 0.00 0.43 0.00 -0.75 0.00 0.00 64.21 63.89 2jbp n SER 272 CO 0.00 0.00 0.00 -2.65 -1.23 0.00 0.00 175.04 171.16 2jbp n PRO 273 N 0.00 0.12 0.06 -1.46 -0.02 -1.26 -2.89 135.00 129.55 2jbp n PRO 273 Ca 0.00 0.31 0.11 0.00 -2.02 0.00 0.00 63.50 61.91 2jbp n PRO 273 Cb 0.00 -1.72 -0.00 0.00 -0.02 0.00 0.00 33.50 31.76 2jbp n PRO 273 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2jbp n GLY 274 N 0.26 -1.31 0.22 -1.23 0.00 -1.26 -3.43 105.19 98.43 2jbp n GLY 274 Ca 0.03 -0.33 -0.16 0.00 0.00 0.00 0.00 46.02 45.56 2jbp n GLY 274 CO 0.00 0.00 0.00 1.98 0.00 0.00 0.00 173.32 175.30 2jbp h MET 275 N 0.00 0.76 -0.17 1.61 -1.53 -1.69 -0.63 114.93 113.28 2jbp h MET 275 Ca 0.00 -0.57 0.05 0.00 -3.44 0.00 0.00 59.70 55.75 2jbp h MET 275 Cb 0.89 0.10 -0.06 0.00 -0.55 0.00 0.00 31.60 31.98 2jbp h MET 275 CO 0.00 1.18 -0.28 -0.22 0.14 0.00 0.00 176.91 177.73 2jbp h LYS 276 N 0.49 -0.32 0.00 0.39 3.64 -1.65 -1.36 116.57 117.75 2jbp h LYS 276 Ca -0.02 0.02 -0.02 0.00 -1.27 0.00 0.00 60.65 59.36 2jbp h LYS 276 Cb 1.25 0.07 -0.00 0.00 -0.41 0.00 0.00 32.23 33.14 2jbp h LYS 276 CO 0.13 -0.21 -0.09 1.79 -2.27 0.00 0.00 179.45 178.80 2jbp h THR 277 N -0.33 0.17 0.00 1.00 1.35 -1.57 -0.35 112.91 113.18 2jbp h THR 277 Ca 0.11 -1.00 -0.11 0.00 -0.55 0.00 0.00 66.41 64.87 2jbp h THR 277 Cb 0.50 1.86 -0.02 0.00 -1.73 0.00 0.00 68.15 68.77 2jbp h THR 277 CO -0.36 0.08 -0.51 0.03 -0.25 0.00 0.00 175.52 174.52 2jbp h ARG 278 N 0.00 0.00 -0.06 4.72 3.08 -0.86 -2.13 114.38 119.12 2jbp h ARG 278 Ca -0.00 0.00 -0.11 0.00 0.07 0.00 0.00 59.98 59.94 2jbp h ARG 278 Cb 0.86 0.00 0.01 0.00 0.08 0.00 0.00 29.97 30.91 2jbp h ARG 278 CO 0.01 0.51 -0.37 0.82 -1.07 0.00 0.00 179.97 179.87 2jbp h ILE 279 N 0.00 1.42 -0.58 2.04 2.04 -0.08 0.95 117.51 123.31 2jbp h ILE 279 Ca -0.01 -1.79 -0.00 0.00 1.00 0.00 0.00 64.86 64.06 2jbp h ILE 279 Cb 0.93 2.36 -0.03 0.00 -0.74 0.00 0.00 36.82 39.35 2jbp h ILE 279 CO 0.07 0.52 0.35 0.03 0.00 0.00 0.00 178.15 179.11 2jbp h ARG 280 N -0.13 0.79 0.00 2.37 3.08 -1.11 -3.04 114.38 116.34 2jbp h ARG 280 Ca -0.03 -0.07 -0.17 0.00 0.07 0.00 0.00 59.98 59.78 2jbp h ARG 280 Cb 1.03 -0.17 -0.02 0.00 0.08 0.00 0.00 29.97 30.89 2jbp h ARG 280 CO 0.08 0.57 -0.80 0.52 -1.07 0.00 0.00 179.97 179.26 2jbp h MET 281 N 0.78 0.00 -0.18 0.04 2.86 -1.44 -3.47 114.93 113.53 2jbp h MET 281 Ca 0.21 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.85 2jbp h MET 281 Cb -0.02 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.64 2jbp h MET 281 CO -0.04 0.80 0.00 0.41 1.06 0.00 0.00 176.91 179.14 2jbp n GLY 282 N 1.27 1.06 3.48 8.32 0.00 -0.48 -4.96 105.19 113.88 2jbp n GLY 282 Ca 0.01 -0.46 -0.43 0.00 0.00 0.00 0.00 46.02 45.14 2jbp n GLY 282 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2jbp s GLN 283 N -2.70 3.21 0.17 1.61 -0.21 0.21 -4.99 119.66 116.95 2jbp s GLN 283 Ca 0.00 -0.57 -0.17 0.00 0.02 0.00 0.00 55.36 54.64 2jbp s GLN 283 Cb 0.00 -4.13 0.03 0.00 1.00 0.00 0.00 33.01 29.91 2jbp s GLN 283 CO 0.00 -1.61 0.48 1.52 -2.12 0.00 0.00 175.29 173.56 2jbp s TYR 284 N 3.88 -0.16 0.36 0.91 1.13 -1.26 -4.79 117.35 117.42 2jbp s TYR 284 Ca 0.25 -0.17 0.04 0.00 -1.41 0.00 0.00 57.07 55.78 2jbp s TYR 284 Cb -0.15 0.34 -0.05 0.00 -1.10 0.00 0.00 41.96 41.00 2jbp s TYR 284 CO 0.15 -0.83 0.07 -1.21 -2.51 0.00 0.00 175.55 171.22 2jbp s GLU 285 N -3.84 1.78 -0.78 -3.49 2.02 -1.26 -5.08 118.70 108.04 2jbp s GLU 285 Ca 0.07 -2.03 0.03 0.00 0.02 0.00 0.00 54.97 53.06 2jbp s GLU 285 Cb 0.00 -0.85 0.27 0.00 0.10 0.00 0.00 34.13 33.65 2jbp s GLU 285 CO -0.07 -0.28 0.97 1.19 0.02 0.00 0.00 175.26 177.09 2jbp n PHE 286 N -0.80 3.24 -1.71 1.61 3.01 -1.26 -5.02 117.46 116.53 2jbp n PHE 286 Ca -0.04 -3.68 -0.38 0.00 1.01 0.00 0.00 57.45 54.36 2jbp n PHE 286 Cb 0.66 -0.78 0.05 0.00 -0.01 0.00 0.00 39.48 39.40 2jbp n PHE 286 CO 0.00 0.00 0.00 -0.35 1.01 0.00 0.00 176.76 177.42 2jbp n PRO 287 N 1.03 1.40 -2.14 -1.08 -0.04 -1.26 -4.47 135.00 128.44 2jbp n PRO 287 Ca 0.28 0.52 -0.30 0.00 -0.04 0.00 0.00 63.50 63.97 2jbp n PRO 287 Cb 0.38 -2.47 -0.00 0.00 -0.04 0.00 0.00 33.50 31.37 2jbp n PRO 287 CO 0.00 0.00 0.00 -0.80 -0.04 0.00 0.00 175.50 174.66 2jbp s ASN 288 N -1.07 6.30 0.26 3.54 0.01 -1.26 -0.82 114.94 121.90 2jbp s ASN 288 Ca 0.75 1.33 0.24 0.00 -0.71 0.00 0.00 52.86 54.46 2jbp s ASN 288 Cb -0.41 -2.42 0.35 0.00 0.41 0.00 0.00 41.25 39.17 2jbp s ASN 288 CO 0.47 -0.75 1.43 1.55 -1.51 0.00 0.00 177.10 178.29 2jbp h PRO 289 N 0.03 0.00 0.27 -0.60 0.13 -2.03 -3.45 132.00 126.35 2jbp h PRO 289 Ca -0.45 0.00 0.01 0.00 -0.87 0.00 0.00 66.00 64.68 2jbp h PRO 289 Cb 1.19 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.29 2jbp h PRO 289 CO 0.62 0.00 -0.39 0.93 -0.23 0.00 0.00 178.00 178.93 2jbp h GLU 290 N 0.00 -0.69 -2.04 0.86 3.07 -1.94 -2.78 114.58 111.05 2jbp h GLU 290 Ca 0.00 0.05 -0.15 0.00 -0.50 0.00 0.00 59.36 58.75 2jbp h GLU 290 Cb 0.89 0.16 -0.06 0.00 -0.84 0.00 0.00 28.75 28.90 2jbp h GLU 290 CO 0.00 -0.46 -0.30 0.91 -1.40 0.00 0.00 179.01 177.76 2jbp n TRP 291 N -5.47 0.00 -0.08 4.33 7.02 -0.00 -4.14 117.44 119.10 2jbp n TRP 291 Ca -0.09 -1.36 -0.16 0.00 -1.02 0.00 0.00 57.50 54.87 2jbp n TRP 291 Cb 0.38 -1.38 -0.05 0.00 -2.42 0.00 0.00 31.31 27.83 2jbp n TRP 291 CO 0.00 0.00 0.00 0.43 -2.02 0.00 0.00 177.69 176.10 2jbp n SER 292 N 2.37 1.43 -2.47 -0.99 7.64 -1.05 -4.60 113.62 115.95 2jbp n SER 292 Ca 0.35 0.24 -0.32 0.00 1.01 0.00 0.00 58.87 60.15 2jbp n SER 292 Cb 0.82 -0.57 0.03 0.00 -1.01 0.00 0.00 64.21 63.48 2jbp n SER 292 CO 0.00 0.00 0.00 -1.84 -3.01 0.00 0.00 175.04 170.19 2jbp n GLU 293 N -3.93 3.13 -3.97 1.43 0.00 -1.26 -4.95 120.64 111.08 2jbp n GLU 293 Ca -0.28 -3.90 -0.35 0.00 0.00 0.00 0.00 57.16 52.63 2jbp n GLU 293 Cb 0.63 -2.27 -0.09 0.00 0.00 0.00 0.00 31.44 29.72 2jbp n GLU 293 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.13 177.21 2jbp s VAL 294 N -5.05 5.00 0.89 3.84 1.01 -1.26 -4.95 120.40 119.88 2jbp s VAL 294 Ca 0.53 0.03 -0.12 0.00 0.00 0.00 0.00 61.98 62.43 2jbp s VAL 294 Cb 0.44 -3.23 0.10 0.00 0.00 0.00 0.00 36.38 33.69 2jbp s VAL 294 CO -0.16 0.51 0.94 -0.24 0.00 0.00 0.00 175.10 176.15 2jbp n SER 295 N 3.01 -0.20 0.11 3.32 2.88 -1.26 -4.87 113.62 116.61 2jbp n SER 295 Ca -0.17 0.44 -0.03 0.00 -1.33 0.00 0.00 58.87 57.78 2jbp n SER 295 Cb 0.53 -1.40 0.05 0.00 -0.75 0.00 0.00 64.21 62.64 2jbp n SER 295 CO 0.00 0.00 0.00 -0.08 -1.23 0.00 0.00 175.04 173.73 2jbp h GLU 296 N -1.52 0.00 -0.84 -1.46 4.57 -1.98 -2.96 114.58 110.39 2jbp h GLU 296 Ca -0.44 0.00 0.16 0.00 -1.18 0.00 0.00 59.36 57.90 2jbp h GLU 296 Cb 1.28 0.00 -0.16 0.00 -0.16 0.00 0.00 28.75 29.72 2jbp h GLU 296 CO 0.40 0.77 -0.25 1.49 -1.18 0.00 0.00 179.01 180.24 2jbp h GLU 297 N 0.00 -0.02 -0.09 1.92 4.81 -1.99 0.27 114.58 119.48 2jbp h GLU 297 Ca -0.01 0.00 -0.06 0.00 -0.13 0.00 0.00 59.36 59.16 2jbp h GLU 297 Cb 1.37 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.75 2jbp h GLU 297 CO 0.10 -0.01 -0.20 0.28 -0.73 0.00 0.00 179.01 178.45 2jbp h VAL 298 N -0.02 1.40 -0.94 0.32 2.07 -1.91 -2.31 116.25 114.87 2jbp h VAL 298 Ca 0.38 -1.52 0.06 0.00 0.82 0.00 0.00 66.70 66.45 2jbp h VAL 298 Cb 0.61 2.18 -0.06 0.00 -1.52 0.00 0.00 31.29 32.50 2jbp h VAL 298 CO -0.87 0.43 0.61 0.11 0.02 0.00 0.00 177.57 177.87 2jbp h LYS 299 N -0.18 1.06 -0.62 1.57 1.57 -1.12 -0.64 116.57 118.22 2jbp h LYS 299 Ca -0.00 -0.06 -0.03 0.00 -1.87 0.00 0.00 60.65 58.68 2jbp h LYS 299 Cb 0.80 -0.24 -0.03 0.00 0.08 0.00 0.00 32.23 32.84 2jbp h LYS 299 CO 0.04 0.70 0.25 1.98 -0.57 0.00 0.00 179.45 181.86 2jbp h MET 300 N 1.09 0.92 0.35 3.15 4.05 -0.39 0.16 114.93 124.27 2jbp h MET 300 Ca 0.40 -0.16 -0.01 0.00 -0.28 0.00 0.00 59.70 59.65 2jbp h MET 300 Cb 0.17 -0.15 -0.01 0.00 -0.80 0.00 0.00 31.60 30.81 2jbp h MET 300 CO -0.15 0.78 -0.25 1.25 0.23 0.00 0.00 176.91 178.77 2jbp h LEU 301 N 0.86 -0.63 -1.52 3.39 5.85 -0.73 -2.14 115.31 120.40 2jbp h LEU 301 Ca 0.21 0.04 0.25 0.00 0.84 0.00 0.00 57.88 59.22 2jbp h LEU 301 Cb 0.20 0.20 -0.07 0.00 0.37 0.00 0.00 40.66 41.35 2jbp h LEU 301 CO -0.02 -0.38 0.66 0.40 -0.34 0.00 0.00 178.44 178.76 2jbp h ILE 302 N -0.59 0.58 -0.11 4.05 2.04 -0.82 -1.00 117.51 121.66 2jbp h ILE 302 Ca -0.03 -0.12 -0.14 0.00 1.00 0.00 0.00 64.86 65.57 2jbp h ILE 302 Cb 0.50 0.21 -0.01 0.00 -0.74 0.00 0.00 36.82 36.78 2jbp h ILE 302 CO 0.02 0.06 -0.54 0.03 0.00 0.00 0.00 178.15 177.72 2jbp h ARG 303 N 0.34 0.31 0.00 2.37 3.08 -0.07 -1.65 114.38 118.76 2jbp h ARG 303 Ca 0.53 -0.19 0.00 0.00 0.07 0.00 0.00 59.98 60.39 2jbp h ARG 303 Cb 1.45 0.02 0.00 0.00 0.08 0.00 0.00 29.97 31.52 2jbp h ARG 303 CO -0.20 0.77 0.00 -0.91 -1.07 0.00 0.00 179.97 178.56 2jbp h ASN 304 N 0.24 0.00 0.23 7.04 4.21 -0.61 -3.09 115.58 123.60 2jbp h ASN 304 Ca 0.00 0.00 -0.35 0.00 1.21 0.00 0.00 56.30 57.17 2jbp h ASN 304 Cb 1.03 0.00 0.02 0.00 -1.12 0.00 0.00 38.32 38.24 2jbp h ASN 304 CO 0.09 0.00 -1.66 -0.07 -1.29 0.00 0.00 177.43 174.49 2jbp h LEU 305 N 0.00 0.68 -1.55 1.61 3.38 -1.23 -2.35 115.31 115.85 2jbp h LEU 305 Ca 0.00 -0.91 0.00 0.00 0.09 0.00 0.00 57.88 57.06 2jbp h LEU 305 Cb 0.89 -0.22 0.00 0.00 0.09 0.00 0.00 40.66 41.42 2jbp h LEU 305 CO 0.00 1.75 0.00 0.18 0.09 0.00 0.00 178.44 180.46 2jbp n LEU 306 N -3.62 2.20 -4.77 1.67 4.77 -0.64 -4.29 117.00 112.32 2jbp n LEU 306 Ca -0.22 -1.11 -0.40 0.00 -0.03 0.00 0.00 56.01 54.25 2jbp n LEU 306 Cb 1.08 -0.42 0.01 0.00 -2.33 0.00 0.00 43.42 41.77 2jbp n LEU 306 CO 0.54 0.37 1.10 -0.54 -1.33 0.00 0.00 177.39 177.53 2jbp s LYS 307 N -1.64 3.80 0.35 3.23 -0.14 -1.17 -4.88 119.74 119.30 2jbp s LYS 307 Ca 0.19 2.49 0.23 0.00 -1.36 0.00 0.00 55.97 57.51 2jbp s LYS 307 Cb 0.13 -2.74 0.21 0.00 -1.68 0.00 0.00 37.83 33.75 2jbp s LYS 307 CO 0.08 -0.75 1.41 1.79 -0.76 0.00 0.00 175.35 177.12 2jbp h THR 308 N 2.50 0.03 -3.55 2.17 1.35 -1.90 -3.43 112.91 110.08 2jbp h THR 308 Ca -0.51 -1.05 -0.62 0.00 -0.55 0.00 0.00 66.41 63.68 2jbp h THR 308 Cb 1.26 1.85 -0.12 0.00 -1.73 0.00 0.00 68.15 69.41 2jbp h THR 308 CO 0.62 0.02 0.30 -0.70 -0.25 0.00 0.00 175.52 175.50 2jbp s GLU 309 N -3.25 3.67 0.28 4.72 2.56 -1.26 -4.93 118.70 120.48 2jbp s GLU 309 Ca 0.04 0.15 0.02 0.00 0.00 0.00 0.00 54.97 55.19 2jbp s GLU 309 Cb 0.07 -3.83 0.67 0.00 2.00 0.00 0.00 34.13 33.04 2jbp s GLU 309 CO 0.71 -0.86 1.70 -1.35 -0.56 0.00 0.00 175.26 174.90 2jbp h PRO 310 N 8.56 0.38 0.00 4.30 0.11 -1.97 0.21 132.00 143.58 2jbp h PRO 310 Ca -0.25 -0.02 -0.14 0.00 0.11 0.00 0.00 66.00 65.69 2jbp h PRO 310 Cb 1.10 -0.09 -0.02 0.00 0.11 0.00 0.00 31.00 32.10 2jbp h PRO 310 CO 0.90 0.25 -0.67 0.00 -0.21 0.00 0.00 178.00 178.27 2jbp h THR 311 N 0.39 1.22 0.00 -1.15 1.03 -1.95 -1.63 112.91 110.83 2jbp h THR 311 Ca 0.53 -2.53 0.00 0.00 -0.01 0.00 0.00 66.41 64.40 2jbp h THR 311 Cb 0.98 2.47 0.00 0.00 -1.07 0.00 0.00 68.15 70.53 2jbp h THR 311 CO -0.52 0.66 0.00 -0.61 -0.01 0.00 0.00 175.52 175.04 2jbp h GLN 312 N 0.00 0.00 -6.91 0.00 4.15 -1.00 -3.45 115.11 107.90 2jbp h GLN 312 Ca -0.01 0.00 -0.49 0.00 0.77 0.00 0.00 58.65 58.92 2jbp h GLN 312 Cb 1.42 0.00 0.02 0.00 0.21 0.00 0.00 27.48 29.13 2jbp h GLN 312 CO 0.09 0.00 0.43 0.50 -1.93 0.00 0.00 178.83 177.92 2jbp s ARG 313 N -3.72 4.32 0.83 1.69 3.52 -0.61 -4.99 118.95 119.98 2jbp s ARG 313 Ca 0.00 1.61 -0.13 0.00 -0.13 0.00 0.00 55.73 57.09 2jbp s ARG 313 Cb 0.09 -2.76 0.08 0.00 -1.56 0.00 0.00 34.95 30.81 2jbp s ARG 313 CO 0.52 -0.03 1.10 -0.12 -0.81 0.00 0.00 175.30 175.96 2jbp n MET 314 N 0.35 0.05 -4.04 5.12 0.00 -0.88 -5.01 117.12 112.71 2jbp n MET 314 Ca 0.03 0.09 -0.26 0.00 -0.00 0.00 0.00 57.70 57.56 2jbp n MET 314 Cb 0.48 -2.35 -0.05 0.00 0.00 0.00 0.00 33.22 31.30 2jbp n MET 314 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 175.97 176.92 2jbp s THR 315 N -2.21 4.73 0.65 1.12 -4.23 -1.26 -4.88 115.64 109.56 2jbp s THR 315 Ca 0.71 -0.96 0.27 0.00 -1.18 0.00 0.00 61.69 60.53 2jbp s THR 315 Cb -0.28 -3.42 0.29 0.00 1.34 0.00 0.00 72.50 70.43 2jbp s THR 315 CO 0.54 -0.10 1.82 -0.29 -0.54 0.00 0.00 174.62 176.05 2jbp h ILE 316 N 1.94 0.09 0.19 2.99 6.09 -1.95 -1.02 117.51 125.84 2jbp h ILE 316 Ca -0.48 0.00 -0.31 0.00 -1.37 0.00 0.00 64.86 62.71 2jbp h ILE 316 Cb 1.20 0.58 0.02 0.00 0.47 0.00 0.00 36.82 39.09 2jbp h ILE 316 CO 0.65 0.00 -1.44 0.74 -3.07 0.00 0.00 178.15 175.02 2jbp h THR 317 N 0.00 1.16 -0.71 2.19 2.02 -1.99 -2.50 112.91 113.08 2jbp h THR 317 Ca 0.06 -2.55 0.04 0.00 0.77 0.00 0.00 66.41 64.73 2jbp h THR 317 Cb 0.96 2.92 -0.04 0.00 -1.74 0.00 0.00 68.15 70.25 2jbp h THR 317 CO -0.00 0.79 0.47 -0.33 0.37 0.00 0.00 175.52 176.82 2jbp h GLU 318 N -0.04 0.80 -0.18 6.66 5.08 -1.61 -2.31 114.58 122.97 2jbp h GLU 318 Ca -0.28 -0.05 -0.01 0.00 -1.00 0.00 0.00 59.36 58.03 2jbp h GLU 318 Cb 1.98 -0.18 -0.01 0.00 0.50 0.00 0.00 28.75 31.05 2jbp h GLU 318 CO 0.18 0.53 0.08 0.35 -1.00 0.00 0.00 179.01 179.15 2jbp h PHE 319 N 0.82 0.27 0.00 4.33 3.04 -1.37 -0.51 116.94 123.52 2jbp h PHE 319 Ca 0.29 -0.02 0.00 0.00 3.98 0.00 0.00 57.97 62.22 2jbp h PHE 319 Cb 0.13 -0.08 0.00 0.00 2.56 0.00 0.00 35.95 38.55 2jbp h PHE 319 CO -0.00 0.32 0.00 -1.33 -2.02 0.00 0.00 178.31 175.28 2jbp n MET 320 N -4.85 0.12 -0.01 1.11 2.81 -0.92 -2.61 117.12 112.76 2jbp n MET 320 Ca -0.04 0.33 0.09 0.00 -1.81 0.00 0.00 57.70 56.27 2jbp n MET 320 Cb 0.11 -1.71 -0.13 0.00 -0.71 0.00 0.00 33.22 30.78 2jbp n MET 320 CO 0.00 0.00 0.00 0.09 1.51 0.00 0.00 175.97 177.57 2jbp n ASN 321 N -1.93 0.78 -4.77 7.83 3.02 -0.92 -4.19 115.26 115.08 2jbp n ASN 321 Ca 0.03 -0.37 -0.40 0.00 -0.03 0.00 0.00 54.58 53.81 2jbp n ASN 321 Cb 0.22 1.52 0.01 0.00 -0.61 0.00 0.00 39.78 40.92 2jbp n ASN 321 CO 0.00 0.00 0.00 -2.28 -2.62 0.00 0.00 177.26 172.36 2jbp s HIS 322 N -3.07 2.49 0.26 3.10 2.46 -0.25 -4.69 115.29 115.59 2jbp s HIS 322 Ca -0.01 1.21 0.02 0.00 0.47 0.00 0.00 55.06 56.75 2jbp s HIS 322 Cb 0.13 -3.98 0.36 0.00 -0.13 0.00 0.00 32.58 28.95 2jbp s HIS 322 CO 0.76 -3.02 1.68 -1.35 -2.47 0.00 0.00 174.74 170.34 2jbp h PRO 323 N 2.58 0.46 -0.56 2.88 0.11 -1.91 0.52 132.00 136.08 2jbp h PRO 323 Ca -0.51 -0.20 0.16 0.00 0.11 0.00 0.00 66.00 65.56 2jbp h PRO 323 Cb 1.26 -0.01 -0.02 0.00 0.11 0.00 0.00 31.00 32.33 2jbp h PRO 323 CO 0.62 0.73 0.44 2.35 -0.21 0.00 0.00 178.00 181.94 2jbp h TRP 324 N 0.39 0.00 0.01 0.65 7.01 -1.90 -0.84 115.95 121.26 2jbp h TRP 324 Ca 0.05 0.00 -0.40 0.00 2.11 0.00 0.00 58.89 60.65 2jbp h TRP 324 Cb 0.77 0.00 -0.06 0.00 -2.10 0.00 0.00 29.16 27.77 2jbp h TRP 324 CO 0.02 0.00 -2.21 -0.89 -2.79 0.00 0.00 178.44 172.58 2jbp n ILE 325 N -4.16 1.54 0.24 2.65 2.08 -0.76 -4.15 119.36 116.79 2jbp n ILE 325 Ca 0.10 -0.34 0.08 0.00 0.56 0.00 0.00 62.75 63.16 2jbp n ILE 325 Cb 0.67 -1.86 0.59 0.00 -0.75 0.00 0.00 39.64 38.29 2jbp n ILE 325 CO 0.00 0.00 0.00 -0.03 0.56 0.00 0.00 176.55 177.08 2jbp h MET 326 N -0.82 0.00 -1.23 0.38 4.05 -0.60 -3.16 114.93 113.54 2jbp h MET 326 Ca -0.59 0.00 -0.55 0.00 -0.28 0.00 0.00 59.70 58.28 2jbp h MET 326 Cb 1.60 0.00 -0.42 0.00 -0.80 0.00 0.00 31.60 31.98 2jbp h MET 326 CO -0.31 0.16 -0.81 1.04 0.23 0.00 0.00 176.91 177.23 2jbp n GLN 327 N -4.07 3.23 0.01 0.39 1.13 -0.35 -4.84 117.38 112.88 2jbp n GLN 327 Ca -0.02 -4.28 0.17 0.00 -1.94 0.00 0.00 57.00 50.92 2jbp n GLN 327 Cb 0.24 -2.15 0.64 0.00 0.11 0.00 0.00 30.24 29.08 2jbp n GLN 327 CO 0.00 0.00 0.00 0.77 -1.44 0.00 0.00 177.06 176.39 2jbp h SER 328 N 2.51 0.09 0.23 1.08 0.02 -1.71 0.59 113.55 116.36 2jbp h SER 328 Ca 0.27 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.22 2jbp h SER 328 Cb 1.12 -0.02 0.00 0.00 0.14 0.00 0.00 62.40 63.64 2jbp h SER 328 CO 0.77 0.05 0.00 0.35 -1.14 0.00 0.00 176.83 176.87 2jbp n THR 329 N -4.42 1.29 -0.52 -2.27 -2.24 -1.26 -0.79 114.28 104.07 2jbp n THR 329 Ca 0.08 0.48 0.06 0.00 -2.27 0.00 0.00 64.05 62.41 2jbp n THR 329 Cb 0.49 -1.43 0.16 0.00 -2.10 0.00 0.00 70.33 67.44 2jbp n THR 329 CO 0.00 0.00 0.00 1.17 -0.57 0.00 0.00 175.07 175.67 2jbp n LYS 330 N -1.89 2.69 -3.45 -0.78 3.00 0.20 -4.98 118.16 112.95 2jbp n LYS 330 Ca 0.01 -2.26 -0.38 0.00 -0.00 0.00 0.00 58.31 55.67 2jbp n LYS 330 Cb 0.08 -1.43 -0.06 0.00 0.00 0.00 0.00 35.03 33.63 2jbp n LYS 330 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.40 177.48 2jbp s VAL 331 N -1.82 4.96 0.30 3.15 1.01 0.03 -5.05 120.40 122.99 2jbp s VAL 331 Ca 0.26 0.93 -0.29 0.00 0.00 0.00 0.00 61.98 62.87 2jbp s VAL 331 Cb 0.19 -3.75 -0.13 0.00 0.00 0.00 0.00 36.38 32.69 2jbp s VAL 331 CO 0.09 0.57 1.35 -2.65 0.00 0.00 0.00 175.10 174.47 2jbp n PRO 332 N 1.79 2.14 -0.24 2.72 -0.02 -1.26 -4.71 135.00 135.42 2jbp n PRO 332 Ca -0.13 0.75 -0.03 0.00 -2.02 0.00 0.00 63.50 62.07 2jbp n PRO 332 Cb 0.52 -2.38 0.05 0.00 -0.02 0.00 0.00 33.50 31.67 2jbp n PRO 332 CO 0.00 0.00 0.00 1.04 1.98 0.00 0.00 175.50 178.52 2jbp n GLN 333 N 1.20 1.43 -1.72 -0.52 1.13 -1.26 -2.57 117.38 115.07 2jbp n GLN 333 Ca 0.07 -0.65 -0.41 0.00 -1.94 0.00 0.00 57.00 54.07 2jbp n GLN 333 Cb 0.34 -1.37 0.01 0.00 0.11 0.00 0.00 30.24 29.34 2jbp n GLN 333 CO 0.00 0.00 0.00 -2.37 -1.44 0.00 0.00 177.06 173.25 2jbp n THR 334 N 0.14 2.43 -2.64 5.09 5.66 -1.26 -4.64 114.28 119.07 2jbp n THR 334 Ca 0.11 -0.50 -0.39 0.00 -3.05 0.00 0.00 64.05 60.22 2jbp n THR 334 Cb 0.67 -1.64 -0.05 0.00 -1.55 0.00 0.00 70.33 67.75 2jbp n THR 334 CO 0.00 0.00 0.00 -2.84 -3.05 0.00 0.00 175.07 169.18 2jbp s PRO 335 N -2.17 4.64 0.29 1.09 0.02 -1.26 -0.18 135.00 137.43 2jbp s PRO 335 Ca 0.59 1.56 0.10 0.00 0.02 0.00 0.00 61.00 63.28 2jbp s PRO 335 Cb -0.51 -3.05 -0.05 0.00 0.02 0.00 0.00 34.50 30.91 2jbp s PRO 335 CO 0.59 0.28 -0.05 -0.51 -0.33 0.00 0.00 177.00 176.98 2jbp s LEU 336 N -1.64 2.97 0.00 -5.54 2.01 -0.65 -4.85 118.68 110.99 2jbp s LEU 336 Ca 0.46 -0.85 0.20 0.00 0.01 0.00 0.00 54.13 53.95 2jbp s LEU 336 Cb -0.26 -1.44 1.17 0.00 0.01 0.00 0.00 46.19 45.66 2jbp s LEU 336 CO 0.33 -0.06 1.57 1.41 1.01 0.00 0.00 176.35 180.61 2jbp n HIS 337 N -0.84 0.00 -0.16 0.29 8.25 -1.26 -4.50 115.22 116.99 2jbp n HIS 337 Ca -0.05 0.00 -0.02 0.00 -0.26 0.00 0.00 57.72 57.39 2jbp n HIS 337 Cb 0.60 0.00 0.07 0.00 1.12 0.00 0.00 29.99 31.78 2jbp n HIS 337 CO 0.00 0.00 0.00 1.15 0.64 0.00 0.00 176.34 178.13 2jbp h THR 338 N 0.00 0.64 -0.24 1.59 2.02 -1.79 -2.50 112.91 112.63 2jbp h THR 338 Ca 0.00 -0.06 -0.03 0.00 0.77 0.00 0.00 66.41 67.09 2jbp h THR 338 Cb 0.00 0.46 -0.01 0.00 -1.74 0.00 0.00 68.15 66.86 2jbp h THR 338 CO 0.00 0.03 0.03 -1.28 0.37 0.00 0.00 175.52 174.67 2jbp h SER 339 N 0.17 0.38 -0.70 4.18 0.87 -1.85 -2.72 113.55 113.88 2jbp h SER 339 Ca 0.26 -0.27 -0.01 0.00 -1.23 0.00 0.00 61.79 60.54 2jbp h SER 339 Cb 0.38 -0.10 -0.03 0.00 -0.44 0.00 0.00 62.40 62.21 2jbp h SER 339 CO -0.39 0.55 0.40 -0.09 -0.53 0.00 0.00 176.83 176.77 2jbp h ARG 340 N 0.20 0.97 0.00 2.24 2.43 -1.82 -2.88 114.38 115.52 2jbp h ARG 340 Ca 0.07 -0.10 0.00 0.00 -0.81 0.00 0.00 59.98 59.14 2jbp h ARG 340 Cb 0.34 -0.19 0.00 0.00 -0.42 0.00 0.00 29.97 29.69 2jbp h ARG 340 CO 0.01 0.71 0.00 0.28 -1.51 0.00 0.00 179.97 179.46 2jbp h VAL 341 N 0.96 0.00 0.02 0.20 2.07 -1.15 -0.83 116.25 117.52 2jbp h VAL 341 Ca 0.25 -0.49 -0.22 0.00 0.82 0.00 0.00 66.70 67.05 2jbp h VAL 341 Cb 0.01 1.48 0.02 0.00 -1.52 0.00 0.00 31.29 31.29 2jbp h VAL 341 CO -0.04 0.00 -0.89 -0.07 0.02 0.00 0.00 177.57 176.59 2jbp h LEU 342 N 0.00 0.75 0.75 2.57 4.07 -1.33 0.25 115.31 122.37 2jbp h LEU 342 Ca 0.00 -0.76 -0.03 0.00 0.08 0.00 0.00 57.88 57.16 2jbp h LEU 342 Cb 0.50 -0.23 0.00 0.00 1.08 0.00 0.00 40.66 42.01 2jbp h LEU 342 CO 0.00 1.42 -0.41 0.11 -1.08 0.00 0.00 178.44 178.48 2jbp h LYS 343 N 0.17 -1.03 -0.99 1.13 1.57 -1.36 0.37 116.57 116.42 2jbp h LYS 343 Ca -0.12 0.07 0.13 0.00 -1.87 0.00 0.00 60.65 58.86 2jbp h LYS 343 Cb 1.57 0.23 -0.14 0.00 0.08 0.00 0.00 32.23 33.97 2jbp h LYS 343 CO 0.17 -0.69 -0.47 1.49 -0.57 0.00 0.00 179.45 179.39 2jbp h GLU 344 N -1.07 -0.01 -0.21 3.15 4.57 -1.20 -1.09 114.58 118.73 2jbp h GLU 344 Ca -0.10 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.08 2jbp h GLU 344 Cb 0.84 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.43 2jbp h GLU 344 CO 0.14 -0.00 0.00 -0.25 -1.18 0.00 0.00 179.01 177.71 2jbp n ASP 345 N -5.39 1.36 -0.10 1.04 8.00 0.89 -4.43 116.55 117.93 2jbp n ASP 345 Ca 0.07 -1.84 -0.00 0.00 0.71 0.00 0.00 54.79 53.73 2jbp n ASP 345 Cb 0.35 -0.14 0.01 0.00 -0.02 0.00 0.00 41.12 41.32 2jbp n ASP 345 CO 0.00 0.00 0.00 1.17 -0.39 0.00 0.00 177.20 177.98 2jbp n LYS 346 N 0.18 -0.06 0.00 -1.24 3.00 0.13 -1.96 118.16 118.21 2jbp n LYS 346 Ca 0.12 0.39 -0.19 0.00 -0.00 0.00 0.00 58.31 58.63 2jbp n LYS 346 Cb 0.24 -0.58 -0.14 0.00 0.00 0.00 0.00 35.03 34.56 2jbp n LYS 346 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.40 178.33 2jbp h GLU 347 N 0.00 0.20 0.00 1.64 5.08 -1.83 -3.30 114.58 116.36 2jbp h GLU 347 Ca 0.09 -0.34 0.00 0.00 -1.00 0.00 0.00 59.36 58.11 2jbp h GLU 347 Cb 0.15 0.13 0.00 0.00 0.50 0.00 0.00 28.75 29.53 2jbp h GLU 347 CO -0.25 1.16 -0.39 2.89 -1.00 0.00 0.00 179.01 181.42 2jbp n ARG 348 N -4.20 0.10 -1.47 2.33 1.85 -1.18 -4.70 116.66 109.39 2jbp n ARG 348 Ca -0.17 0.04 -0.12 0.00 -1.00 0.00 0.00 57.85 56.60 2jbp n ARG 348 Cb 0.76 -1.57 -0.10 0.00 -1.05 0.00 0.00 32.46 30.50 2jbp n ARG 348 CO 0.00 0.00 0.00 1.87 -0.01 0.00 0.00 177.63 179.49 2jbp n TRP 349 N -1.73 0.74 0.00 2.89 -0.00 -0.83 -5.18 117.44 113.34 2jbp n TRP 349 Ca 0.05 -0.09 0.00 0.00 -0.00 0.00 0.00 57.50 57.46 2jbp n TRP 349 Cb 0.37 -2.09 0.00 0.00 -0.00 0.00 0.00 31.31 29.59 2jbp n TRP 349 CO 0.00 0.00 0.00 -0.85 -0.00 0.00 0.00 177.69 176.84