#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jbp s PHE 46 N 0.00 -0.22 -0.28 3.69 0.08 -1.26 -5.17 117.98 114.82 2jbp s PHE 46 Ca 0.00 -0.09 -0.01 0.00 0.12 0.00 0.00 56.93 56.95 2jbp s PHE 46 Cb 0.00 0.39 0.09 0.00 -0.57 0.00 0.00 43.02 42.93 2jbp s PHE 46 CO 0.00 -0.84 0.08 -1.01 -0.10 0.00 0.00 175.22 173.34 2jbp s HIS 47 N -3.83 1.47 -0.07 0.36 3.76 -1.26 -5.11 115.29 110.61 2jbp s HIS 47 Ca 0.06 -1.45 -0.06 0.00 -0.15 0.00 0.00 55.06 53.45 2jbp s HIS 47 Cb -0.00 -1.47 0.02 0.00 1.11 0.00 0.00 32.58 32.23 2jbp s HIS 47 CO -0.07 -0.80 0.18 0.54 -0.85 0.00 0.00 174.74 173.73 2jbp s VAL 48 N 1.70 0.00 0.33 -0.90 0.11 -1.26 -5.16 120.40 115.23 2jbp s VAL 48 Ca 0.06 -0.02 0.08 0.00 -2.93 0.00 0.00 61.98 59.17 2jbp s VAL 48 Cb -0.17 -0.26 -0.04 0.00 -1.53 0.00 0.00 36.38 34.38 2jbp s VAL 48 CO -0.21 -0.01 0.20 -0.54 -3.33 0.00 0.00 175.10 171.21 2jbp s LYS 49 N 0.06 2.55 0.65 1.54 -0.14 -1.26 -5.13 119.74 118.00 2jbp s LYS 49 Ca -0.00 -1.41 -0.14 0.00 -1.36 0.00 0.00 55.97 53.06 2jbp s LYS 49 Cb -0.01 -2.32 -0.01 0.00 -1.68 0.00 0.00 37.83 33.81 2jbp s LYS 49 CO 0.00 0.14 1.08 -1.54 -0.76 0.00 0.00 175.35 174.27 2jbp s SER 50 N -3.89 5.38 0.66 2.83 1.04 -1.26 -5.08 113.70 113.38 2jbp s SER 50 Ca 0.38 1.84 -0.04 0.00 0.48 0.00 0.00 55.95 58.61 2jbp s SER 50 Cb -0.04 -2.53 0.06 0.00 0.10 0.00 0.00 66.02 63.60 2jbp s SER 50 CO 0.24 -1.44 0.95 -0.83 0.98 0.00 0.00 173.24 173.14 2jbp s GLY 51 N -2.94 1.74 -0.25 7.32 0.00 -1.26 -5.03 107.32 106.89 2jbp s GLY 51 Ca 0.63 -1.09 -0.23 0.00 0.00 0.00 0.00 44.72 44.04 2jbp s GLY 51 CO 0.43 -0.71 0.77 -2.27 0.00 0.00 0.00 173.10 171.32 2jbp s LEU 52 N -5.11 4.07 -0.69 0.66 2.96 -1.26 -5.01 118.68 114.31 2jbp s LEU 52 Ca 0.60 0.91 -0.16 0.00 -0.22 0.00 0.00 54.13 55.26 2jbp s LEU 52 Cb -0.10 -3.08 0.16 0.00 0.50 0.00 0.00 46.19 43.67 2jbp s LEU 52 CO 0.43 -0.48 0.70 -1.58 -1.32 0.00 0.00 176.35 174.10 2jbp s GLN 53 N 2.75 3.28 0.16 1.98 2.00 -1.26 -5.05 119.66 123.52 2jbp s GLN 53 Ca 0.32 -1.92 -0.33 0.00 -2.00 0.00 0.00 55.36 51.44 2jbp s GLN 53 Cb -0.15 -4.39 -0.12 0.00 0.80 0.00 0.00 33.01 29.14 2jbp s GLN 53 CO 0.08 -1.40 1.71 -0.89 -0.50 0.00 0.00 175.29 174.29 2jbp n ILE 54 N 4.85 0.10 -3.09 -2.34 2.08 -1.26 -4.65 119.36 115.04 2jbp n ILE 54 Ca 0.01 -0.02 -0.37 0.00 0.56 0.00 0.00 62.75 62.93 2jbp n ILE 54 Cb 0.44 -1.86 -0.06 0.00 -0.75 0.00 0.00 39.64 37.41 2jbp n ILE 54 CO 0.00 0.00 0.00 -0.54 0.56 0.00 0.00 176.55 176.57 2jbp s LYS 55 N 1.53 4.29 -0.01 0.38 1.02 0.12 -4.89 119.74 122.17 2jbp s LYS 55 Ca 0.78 0.90 0.13 0.00 0.02 0.00 0.00 55.97 57.80 2jbp s LYS 55 Cb -0.57 -2.94 -0.19 0.00 -0.52 0.00 0.00 37.83 33.61 2jbp s LYS 55 CO 0.36 0.43 0.33 1.63 -0.92 0.00 0.00 175.35 177.18 2jbp n LYS 56 N 0.87 0.88 -1.94 1.68 4.76 -1.26 -0.26 118.16 122.90 2jbp n LYS 56 Ca -0.03 -0.09 -0.34 0.00 -2.87 0.00 0.00 58.31 54.97 2jbp n LYS 56 Cb 0.51 -1.26 0.03 0.00 -1.84 0.00 0.00 35.03 32.47 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 -3.22 5.23 0.31 4.39 4.22 -1.26 -4.72 114.94 119.89 2jbp s ASN 57 Ca -0.03 2.18 -0.27 0.00 -2.14 0.00 0.00 52.86 52.60 2jbp s ASN 57 Cb 0.08 -2.57 -0.14 0.00 1.28 0.00 0.00 41.25 39.90 2jbp s ASN 57 CO 0.53 -1.56 0.81 0.00 -2.04 0.00 0.00 177.10 174.84 2jbp n ALA 58 N -1.91 -1.01 0.41 3.54 0.00 -1.26 -4.81 120.51 115.47 2jbp n ALA 58 Ca 0.12 0.34 0.12 0.00 0.00 0.00 0.00 53.44 54.02 2jbp n ALA 58 Cb 0.51 -1.89 0.28 0.00 0.00 0.00 0.00 19.45 18.35 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 1.50 0.00 0.00 0.00 2.10 -1.95 -2.90 117.51 116.25 2jbp h ILE 59 Ca -0.38 -0.75 -0.12 0.00 1.08 0.00 0.00 64.86 64.69 2jbp h ILE 59 Cb 1.37 1.75 -0.02 0.00 -1.09 0.00 0.00 36.82 38.84 2jbp h ILE 59 CO 0.58 0.00 -0.57 0.16 -1.08 0.00 0.00 178.15 177.23 2jbp h ILE 60 N 0.00 1.38 -1.58 2.19 3.07 -1.87 -1.22 117.51 119.47 2jbp h ILE 60 Ca 0.00 -1.98 0.46 0.00 1.55 0.00 0.00 64.86 64.89 2jbp h ILE 60 Cb 0.88 2.08 -0.06 0.00 -0.27 0.00 0.00 36.82 39.44 2jbp h ILE 60 CO 0.00 0.56 1.21 0.44 -1.05 0.00 0.00 178.15 179.31 2jbp h ASP 61 N 0.00 0.00 0.00 2.16 3.45 -1.87 -3.02 116.42 117.14 2jbp h ASP 61 Ca -0.01 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.45 2jbp h ASP 61 Cb 1.03 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 39.80 2jbp h ASP 61 CO 0.07 0.00 -0.40 0.47 -1.57 0.00 0.00 179.24 177.81 2jbp n ASP 62 N -3.90 2.02 -4.01 6.45 8.00 -0.55 -4.93 116.55 119.62 2jbp n ASP 62 Ca 0.35 -0.18 -0.19 0.00 0.71 0.00 0.00 54.79 55.47 2jbp n ASP 62 Cb 1.70 0.77 -0.15 0.00 -0.02 0.00 0.00 41.12 43.42 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 -1.17 0.88 -0.15 1.24 2.02 -0.65 -0.13 117.35 119.38 2jbp s TYR 63 Ca 0.00 -0.19 -0.27 0.00 -0.37 0.00 0.00 57.07 56.24 2jbp s TYR 63 Cb 0.00 -0.59 -0.01 0.00 -0.40 0.00 0.00 41.96 40.96 2jbp s TYR 63 CO 0.00 -0.05 0.92 0.21 -1.57 0.00 0.00 175.55 175.06 2jbp s LYS 64 N -0.03 4.34 -0.48 -0.62 2.47 0.25 -4.36 119.74 121.30 2jbp s LYS 64 Ca 0.01 1.20 -0.14 0.00 -1.56 0.00 0.00 55.97 55.48 2jbp s LYS 64 Cb -0.06 -3.57 0.10 0.00 -1.46 0.00 0.00 37.83 32.84 2jbp s LYS 64 CO -0.00 -0.36 0.39 0.08 0.16 0.00 0.00 175.35 175.63 2jbp s VAL 65 N 2.21 4.90 0.79 4.02 1.01 -1.26 -1.34 120.40 130.74 2jbp s VAL 65 Ca 0.43 -1.35 -0.07 0.00 0.00 0.00 0.00 61.98 61.00 2jbp s VAL 65 Cb -0.17 -4.04 0.14 0.00 0.00 0.00 0.00 36.38 32.31 2jbp s VAL 65 CO 0.14 -0.67 1.10 0.42 0.00 0.00 0.00 175.10 176.08 2jbp s THR 66 N 1.55 2.13 -0.85 3.92 -4.23 -1.15 -5.03 115.64 111.98 2jbp s THR 66 Ca 0.04 -0.35 0.09 0.00 -1.18 0.00 0.00 61.69 60.29 2jbp s THR 66 Cb -0.26 -2.78 0.20 0.00 1.34 0.00 0.00 72.50 71.00 2jbp s THR 66 CO 0.04 0.00 1.09 -1.54 -0.54 0.00 0.00 174.62 173.66 2jbp n SER 67 N -3.14 2.46 -4.64 3.99 3.41 -1.26 -4.60 113.62 109.83 2jbp n SER 67 Ca 0.14 -1.82 -0.42 0.00 -0.26 0.00 0.00 58.87 56.50 2jbp n SER 67 Cb 0.60 -0.13 -0.03 0.00 -0.26 0.00 0.00 64.21 64.39 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 -0.93 3.86 0.19 4.33 0.74 -1.26 -4.91 119.66 121.69 2jbp s GLN 68 Ca 0.16 2.34 -0.21 0.00 0.05 0.00 0.00 55.36 57.70 2jbp s GLN 68 Cb 0.09 -4.19 -0.08 0.00 1.10 0.00 0.00 33.01 29.94 2jbp s GLN 68 CO 0.12 -1.26 0.72 0.08 -0.55 0.00 0.00 175.29 174.40 2jbp s VAL 69 N 5.44 4.54 0.00 1.34 1.01 -1.26 -1.51 120.40 129.96 2jbp s VAL 69 Ca 0.88 1.36 0.00 0.00 0.00 0.00 0.00 61.98 64.23 2jbp s VAL 69 Cb -0.38 -3.92 0.00 0.00 0.00 0.00 0.00 36.38 32.08 2jbp s VAL 69 CO 0.38 0.31 0.36 0.18 0.00 0.00 0.00 175.10 176.33 2jbp n LEU 70 N 1.02 0.29 0.00 3.92 4.77 -0.42 -4.93 117.00 121.66 2jbp n LEU 70 Ca -0.04 -0.29 0.00 0.00 -0.03 0.00 0.00 56.01 55.65 2jbp n LEU 70 Cb 0.50 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.59 2jbp n LEU 70 CO 0.44 0.07 0.00 0.61 -1.33 0.00 0.00 177.39 177.18 2jbp n GLY 71 N -0.05 1.03 3.35 -0.72 0.00 -1.24 -4.94 105.19 102.62 2jbp n GLY 71 Ca 0.00 -0.63 -0.15 0.00 0.00 0.00 0.00 46.02 45.24 2jbp n GLY 71 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2jbp s LEU 72 N 0.00 1.27 0.00 0.99 1.02 -1.26 -1.12 118.68 119.57 2jbp s LEU 72 Ca 0.00 -1.52 0.00 0.00 0.02 0.00 0.00 54.13 52.63 2jbp s LEU 72 Cb 0.00 0.89 0.00 0.00 0.02 0.00 0.00 46.19 47.10 2jbp s LEU 72 CO 0.00 -1.08 0.00 0.61 0.02 0.00 0.00 176.35 175.90 2jbp n GLY 73 N -0.50 -2.68 0.02 -3.19 0.00 -1.26 -4.95 105.19 92.63 2jbp n GLY 73 Ca 0.03 -0.40 0.00 0.00 0.00 0.00 0.00 46.02 45.65 2jbp n GLY 73 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 2jbp n ASN 75 N 0.00 0.00 -3.75 1.61 2.04 -1.26 -4.92 115.26 108.98 2jbp n ASN 75 Ca 0.00 0.04 -0.12 0.00 -0.44 0.00 0.00 54.58 54.05 2jbp n ASN 75 Cb 0.00 0.00 -0.13 0.00 -2.53 0.00 0.00 39.78 37.12 2jbp n ASN 75 CO 0.00 0.00 0.00 -0.83 -0.44 0.00 0.00 177.26 175.99 2jbp s GLY 76 N -0.75 -0.15 0.17 4.83 0.00 -1.26 -4.95 107.32 105.20 2jbp s GLY 76 Ca 0.00 0.90 -0.26 0.00 0.00 0.00 0.00 44.72 45.36 2jbp s GLY 76 CO 0.00 1.05 0.79 -1.59 0.00 0.00 0.00 173.10 173.35 2jbp s LYS 77 N 0.91 4.60 -0.39 2.90 -2.85 -1.26 -4.65 119.74 119.01 2jbp s LYS 77 Ca -0.06 1.19 -0.14 0.00 -1.00 0.00 0.00 55.97 55.96 2jbp s LYS 77 Cb -0.08 -3.27 0.01 0.00 -2.06 0.00 0.00 37.83 32.43 2jbp s LYS 77 CO -0.06 0.56 0.28 0.08 0.10 0.00 0.00 175.35 176.31 2jbp s VAL 78 N -1.12 5.24 0.41 1.79 1.01 -0.28 -4.21 120.40 123.24 2jbp s VAL 78 Ca 0.36 -0.53 -0.03 0.00 0.00 0.00 0.00 61.98 61.79 2jbp s VAL 78 Cb -0.23 -3.84 -0.04 0.00 0.00 0.00 0.00 36.38 32.27 2jbp s VAL 78 CO 0.27 -0.21 0.67 -0.76 0.00 0.00 0.00 175.10 175.07 2jbp s LEU 79 N 1.69 3.82 0.27 3.92 1.43 0.30 -1.30 118.68 128.81 2jbp s LEU 79 Ca 0.05 0.72 -0.28 0.00 -1.03 0.00 0.00 54.13 53.59 2jbp s LEU 79 Cb -0.18 -3.63 -0.09 0.00 0.03 0.00 0.00 46.19 42.31 2jbp s LEU 79 CO 0.10 -0.43 0.94 -1.58 0.23 0.00 0.00 176.35 175.60 2jbp s GLN 80 N -4.48 4.75 0.11 1.70 2.00 -0.57 -0.53 119.66 122.63 2jbp s GLN 80 Ca 0.44 1.42 -0.11 0.00 -2.00 0.00 0.00 55.36 55.11 2jbp s GLN 80 Cb -0.10 -3.10 0.01 0.00 0.80 0.00 0.00 33.01 30.62 2jbp s GLN 80 CO 0.40 0.43 0.25 0.96 -0.50 0.00 0.00 175.29 176.84 2jbp s ILE 81 N -1.34 0.12 -0.02 -2.34 -4.36 0.70 -2.95 121.20 111.00 2jbp s ILE 81 Ca 0.44 -1.04 0.05 0.00 -0.26 0.00 0.00 60.65 59.84 2jbp s ILE 81 Cb -0.23 -1.34 -0.01 0.00 1.25 0.00 0.00 42.46 42.13 2jbp s ILE 81 CO 0.29 -0.53 -0.17 -0.36 0.24 0.00 0.00 174.94 174.40 2jbp s PHE 82 N -3.86 1.60 -0.18 1.37 0.08 -0.45 0.79 117.98 117.33 2jbp s PHE 82 Ca 0.06 -0.34 -0.29 0.00 0.12 0.00 0.00 56.93 56.47 2jbp s PHE 82 Cb 0.04 -1.04 -0.04 0.00 -0.57 0.00 0.00 43.02 41.41 2jbp s PHE 82 CO -0.10 -0.06 1.75 1.21 -0.10 0.00 0.00 175.22 177.92 2jbp s ASN 83 N -0.29 6.27 0.46 1.36 3.04 0.23 0.86 114.94 126.87 2jbp s ASN 83 Ca 0.04 1.82 0.25 0.00 0.04 0.00 0.00 52.86 55.02 2jbp s ASN 83 Cb -0.08 -2.53 1.28 0.00 -1.54 0.00 0.00 41.25 38.38 2jbp s ASN 83 CO 0.00 -1.32 1.80 0.11 -3.04 0.00 0.00 177.10 174.65 2jbp h LYS 84 N 11.28 0.22 -0.75 0.43 1.57 -0.84 1.93 116.57 130.41 2jbp h LYS 84 Ca -0.37 -0.01 -0.55 0.00 -1.87 0.00 0.00 60.65 57.85 2jbp h LYS 84 Cb 1.18 -0.05 -0.41 0.00 0.08 0.00 0.00 32.23 33.03 2jbp h LYS 84 CO 0.99 0.15 -0.67 2.89 -0.57 0.00 0.00 179.45 182.23 2jbp n ARG 85 N -4.45 3.49 -0.34 3.15 1.85 -1.26 -4.37 116.66 114.73 2jbp n ARG 85 Ca 0.24 -4.07 0.00 0.00 -1.00 0.00 0.00 57.85 53.02 2jbp n ARG 85 Cb 1.00 -2.26 0.00 0.00 -1.05 0.00 0.00 32.46 30.14 2jbp n ARG 85 CO 0.00 0.00 0.00 -2.37 -0.01 0.00 0.00 177.63 175.25 2jbp n THR 86 N -0.74 0.00 0.00 8.89 5.66 -0.25 -4.99 114.28 122.85 2jbp n THR 86 Ca 0.45 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.45 2jbp n THR 86 Cb 0.94 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 69.72 2jbp n THR 86 CO 0.00 0.00 0.00 1.67 -3.05 0.00 0.00 175.07 173.69 2jbp n GLN 87 N 0.00 0.00 -1.50 1.09 -0.06 0.64 -4.82 117.38 112.73 2jbp n GLN 87 Ca 0.00 0.00 -0.38 0.00 -2.00 0.00 0.00 57.00 54.62 2jbp n GLN 87 Cb 0.50 -2.00 0.04 0.00 -4.06 0.00 0.00 30.24 24.72 2jbp n GLN 87 CO 0.00 0.00 0.00 -1.91 -0.20 0.00 0.00 177.06 174.95 2jbp n GLU 88 N -0.75 0.60 -2.95 3.69 2.13 -1.24 -3.96 120.64 118.15 2jbp n GLU 88 Ca 0.00 0.23 -0.36 0.00 0.66 0.00 0.00 57.16 57.69 2jbp n GLU 88 Cb 0.00 -1.80 -0.06 0.00 0.27 0.00 0.00 31.44 29.85 2jbp n GLU 88 CO 0.00 0.00 0.00 0.15 -0.41 0.00 0.00 177.13 176.87 2jbp s LYS 89 N -2.22 4.40 0.15 5.31 1.02 -1.26 -0.60 119.74 126.54 2jbp s LYS 89 Ca 0.70 1.08 -0.11 0.00 0.02 0.00 0.00 55.97 57.66 2jbp s LYS 89 Cb -0.44 -2.84 0.01 0.00 -0.52 0.00 0.00 37.83 34.03 2jbp s LYS 89 CO 0.53 0.34 0.33 -0.06 -0.92 0.00 0.00 175.35 175.56 2jbp s PHE 90 N -1.57 0.16 -0.12 3.18 0.40 0.24 -4.56 117.98 115.71 2jbp s PHE 90 Ca 0.46 -0.53 -0.04 0.00 -0.60 0.00 0.00 56.93 56.22 2jbp s PHE 90 Cb -0.17 0.07 -0.04 0.00 0.51 0.00 0.00 43.02 43.39 2jbp s PHE 90 CO 0.22 -0.72 0.03 0.00 0.70 0.00 0.00 175.22 175.46 2jbp s ALA 91 N -3.90 3.38 -0.13 5.36 0.00 -0.35 -0.22 121.76 125.90 2jbp s ALA 91 Ca 0.11 -0.77 0.02 0.00 0.00 0.00 0.00 51.96 51.32 2jbp s ALA 91 Cb 0.03 -1.68 0.01 0.00 0.00 0.00 0.00 23.12 21.48 2jbp s ALA 91 CO -0.05 0.45 -0.18 -1.17 0.00 0.00 0.00 175.76 174.81 2jbp s LEU 92 N -0.46 1.89 -0.13 0.00 2.96 0.31 -0.25 118.68 123.00 2jbp s LEU 92 Ca 0.09 -0.52 -0.02 0.00 -0.22 0.00 0.00 54.13 53.47 2jbp s LEU 92 Cb -0.12 -1.26 -0.02 0.00 0.50 0.00 0.00 46.19 45.29 2jbp s LEU 92 CO 0.02 0.03 -0.08 -0.75 -1.32 0.00 0.00 176.35 174.25 2jbp s LYS 93 N 0.99 3.42 -0.12 1.98 2.20 -0.25 -0.54 119.74 127.43 2jbp s LYS 93 Ca -0.05 -0.59 -0.01 0.00 -0.36 0.00 0.00 55.97 54.97 2jbp s LYS 93 Cb -0.15 -2.75 -0.02 0.00 -1.51 0.00 0.00 37.83 33.40 2jbp s LYS 93 CO -0.03 0.30 -0.09 -1.64 -0.36 0.00 0.00 175.35 173.52 2jbp s MET 94 N 0.18 3.26 0.03 4.03 -1.94 -1.26 -0.94 119.30 122.67 2jbp s MET 94 Ca -0.04 -0.61 0.03 0.00 -1.71 0.00 0.00 55.69 53.35 2jbp s MET 94 Cb -0.14 -2.68 -0.02 0.00 2.01 0.00 0.00 34.83 34.00 2jbp s MET 94 CO 0.04 0.35 -0.10 -0.51 -0.01 0.00 0.00 175.02 174.79 2jbp s LEU 95 N 0.03 2.18 -0.14 -0.03 1.43 -0.42 -4.48 118.68 117.24 2jbp s LEU 95 Ca -0.03 -0.42 -0.29 0.00 -1.03 0.00 0.00 54.13 52.36 2jbp s LEU 95 Cb -0.14 -0.35 -0.02 0.00 0.03 0.00 0.00 46.19 45.71 2jbp s LEU 95 CO 0.04 -0.06 1.24 -1.58 0.23 0.00 0.00 176.35 176.22 2jbp s GLN 96 N -1.12 4.26 0.18 1.70 0.74 -1.26 -0.58 119.66 123.57 2jbp s GLN 96 Ca -0.03 1.65 -0.33 0.00 0.05 0.00 0.00 55.36 56.70 2jbp s GLN 96 Cb -0.08 -3.71 -0.14 0.00 1.10 0.00 0.00 33.01 30.18 2jbp s GLN 96 CO 0.01 -0.64 1.40 -3.47 -0.55 0.00 0.00 175.29 172.04 2jbp n ASP 97 N 6.26 2.41 0.00 6.67 2.03 -0.95 -4.74 116.55 128.23 2jbp n ASP 97 Ca 0.13 1.12 0.00 0.00 0.52 0.00 0.00 54.79 56.56 2jbp n ASP 97 Cb 0.45 -1.35 0.00 0.00 -0.72 0.00 0.00 41.12 39.50 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 0.68 -0.32 0.00 -0.04 -1.26 -2.46 135.00 131.60 2jbp n PRO 99 Ca 0.00 0.17 0.19 0.00 -0.04 0.00 0.00 63.50 63.83 2jbp n PRO 99 Cb 0.00 -1.57 0.39 0.00 -0.04 0.00 0.00 33.50 32.29 2jbp n PRO 99 CO 0.00 0.00 0.00 0.87 -0.04 0.00 0.00 175.50 176.33 2jbp h LYS 100 N 0.02 0.25 0.01 0.54 1.79 -1.97 0.19 116.57 117.39 2jbp h LYS 100 Ca -0.54 -0.01 -0.25 0.00 -2.18 0.00 0.00 60.65 57.67 2jbp h LYS 100 Cb 1.94 -0.06 0.01 0.00 -1.58 0.00 0.00 32.23 32.54 2jbp h LYS 100 CO -0.04 0.16 -1.00 0.00 -1.08 0.00 0.00 179.45 177.49 2jbp h ALA 101 N 1.83 0.25 -0.82 3.86 0.00 -1.85 -2.46 119.26 120.06 2jbp h ALA 101 Ca 0.66 -0.71 0.07 0.00 0.00 0.00 0.00 54.91 54.92 2jbp h ALA 101 Cb 1.44 0.02 -0.05 0.00 0.00 0.00 0.00 17.79 19.19 2jbp h ALA 101 CO -0.64 0.76 0.54 0.00 0.00 0.00 0.00 179.25 179.90 2jbp h ARG 102 N 0.30 0.88 0.31 0.00 2.47 -0.63 -2.05 114.38 115.64 2jbp h ARG 102 Ca -0.11 -0.05 -0.01 0.00 -1.26 0.00 0.00 59.98 58.55 2jbp h ARG 102 Cb 1.65 -0.20 0.00 0.00 -1.65 0.00 0.00 29.97 29.77 2jbp h ARG 102 CO 0.18 0.58 -0.15 -0.09 0.56 0.00 0.00 179.97 181.06 2jbp h ARG 103 N 0.90 -0.40 -0.49 0.04 2.43 -0.54 0.11 114.38 116.44 2jbp h ARG 103 Ca 0.36 0.03 0.07 0.00 -0.81 0.00 0.00 59.98 59.62 2jbp h ARG 103 Cb 0.23 0.09 -0.10 0.00 -0.42 0.00 0.00 29.97 29.78 2jbp h ARG 103 CO -0.13 -0.14 -0.47 1.49 -1.51 0.00 0.00 179.97 179.21 2jbp h GLU 104 N -0.61 -0.29 -0.50 0.20 4.81 -1.05 0.72 114.58 117.86 2jbp h GLU 104 Ca -0.04 0.02 0.05 0.00 -0.13 0.00 0.00 59.36 59.25 2jbp h GLU 104 Cb 0.44 0.07 -0.04 0.00 0.63 0.00 0.00 28.75 29.84 2jbp h GLU 104 CO 0.07 -0.19 0.24 0.28 -0.73 0.00 0.00 179.01 178.68 2jbp h VAL 105 N -0.30 0.95 0.29 0.32 2.07 -1.26 0.18 116.25 118.49 2jbp h VAL 105 Ca 0.14 -0.16 0.00 0.00 0.82 0.00 0.00 66.70 67.49 2jbp h VAL 105 Cb 0.58 0.43 -0.02 0.00 -1.52 0.00 0.00 31.29 30.75 2jbp h VAL 105 CO -0.63 0.09 -0.30 -0.08 0.02 0.00 0.00 177.57 176.67 2jbp h GLU 106 N 0.48 -0.60 -0.32 1.57 4.22 0.17 0.28 114.58 120.38 2jbp h GLU 106 Ca 0.22 0.04 -0.05 0.00 0.08 0.00 0.00 59.36 59.65 2jbp h GLU 106 Cb 0.14 0.14 -0.01 0.00 0.50 0.00 0.00 28.75 29.51 2jbp h GLU 106 CO -0.16 -0.40 -0.00 -0.07 -2.18 0.00 0.00 179.01 176.19 2jbp h LEU 107 N -0.63 0.57 -0.21 1.64 3.38 0.90 -2.76 115.31 118.21 2jbp h LEU 107 Ca -0.01 -0.31 -0.02 0.00 0.09 0.00 0.00 57.88 57.63 2jbp h LEU 107 Cb 0.57 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 41.16 2jbp h LEU 107 CO -0.06 0.74 0.04 -0.74 0.09 0.00 0.00 178.44 178.51 2jbp h HIS 108 N 0.38 0.35 -0.90 1.13 2.76 -0.57 -2.16 115.15 116.14 2jbp h HIS 108 Ca 0.09 -0.05 0.18 0.00 -2.20 0.00 0.00 60.37 58.40 2jbp h HIS 108 Cb 0.45 -0.10 -0.11 0.00 1.55 0.00 0.00 27.41 29.21 2jbp h HIS 108 CO 0.04 0.46 0.47 2.35 -1.30 0.00 0.00 177.93 179.94 2jbp h TRP 109 N 0.14 0.81 0.00 5.26 2.91 -0.93 0.14 115.95 124.27 2jbp h TRP 109 Ca 0.06 0.04 -0.05 0.00 1.13 0.00 0.00 58.89 60.07 2jbp h TRP 109 Cb 0.29 -0.22 -0.01 0.00 -0.51 0.00 0.00 29.16 28.72 2jbp h TRP 109 CO 0.01 0.12 -0.22 -0.09 -1.03 0.00 0.00 178.44 177.24 2jbp h ARG 110 N 0.59 0.00 -0.02 2.65 2.43 -1.10 -2.56 114.38 116.37 2jbp h ARG 110 Ca 0.52 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.69 2jbp h ARG 110 Cb 0.84 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.39 2jbp h ARG 110 CO -0.42 0.22 -0.41 0.00 -1.51 0.00 0.00 179.97 177.85 2jbp n ALA 111 N -2.33 3.40 0.70 2.80 0.00 0.31 -4.28 120.51 121.10 2jbp n ALA 111 Ca -0.01 -0.63 0.13 0.00 0.00 0.00 0.00 53.44 52.93 2jbp n ALA 111 Cb 0.32 -0.75 0.47 0.00 0.00 0.00 0.00 19.45 19.49 2jbp n ALA 111 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 2jbp n SER 112 N 0.08 0.56 -0.29 0.00 2.88 -0.22 -2.52 113.62 114.11 2jbp n SER 112 Ca 0.09 0.56 0.01 0.00 -1.33 0.00 0.00 58.87 58.20 2jbp n SER 112 Cb 0.45 -0.71 0.15 0.00 -0.75 0.00 0.00 64.21 63.35 2jbp n SER 112 CO 0.00 0.00 0.00 1.56 -1.23 0.00 0.00 175.04 175.37 2jbp h GLN 113 N 0.00 0.84 -6.74 -1.46 4.20 -1.75 -3.43 115.11 106.78 2jbp h GLN 113 Ca 0.00 -0.05 -0.55 0.00 0.06 0.00 0.00 58.65 58.11 2jbp h GLN 113 Cb 0.63 -0.19 0.08 0.00 0.30 0.00 0.00 27.48 28.30 2jbp h GLN 113 CO 0.00 0.56 0.81 0.00 -0.67 0.00 0.00 178.83 179.52 2jbp h PRO 115 N 4.63 0.00 -0.42 0.00 0.11 -1.91 -2.43 132.00 131.98 2jbp h PRO 115 Ca -0.46 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.65 2jbp h PRO 115 Cb 1.24 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.35 2jbp h PRO 115 CO 0.78 0.00 0.00 0.72 -0.21 0.00 0.00 178.00 179.29 2jbp n HIS 116 N -4.38 0.94 -5.11 0.65 8.25 -1.26 -4.86 115.22 109.44 2jbp n HIS 116 Ca 0.07 -0.65 -0.32 0.00 -0.26 0.00 0.00 57.72 56.56 2jbp n HIS 116 Cb 0.49 -0.18 -0.16 0.00 1.12 0.00 0.00 29.99 31.26 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 -1.82 2.37 0.13 1.59 1.01 -0.92 -0.42 121.20 123.14 2jbp s ILE 117 Ca 0.38 -0.93 -0.31 0.00 0.00 0.00 0.00 60.65 59.78 2jbp s ILE 117 Cb 0.25 -1.91 -0.11 0.00 0.01 0.00 0.00 42.46 40.71 2jbp s ILE 117 CO 0.17 0.56 1.82 0.55 0.00 0.00 0.00 174.94 178.04 2jbp n VAL 118 N 3.15 0.33 -2.45 2.92 3.14 -0.59 -4.78 118.33 120.06 2jbp n VAL 118 Ca -0.18 -0.06 -0.41 0.00 -2.96 0.00 0.00 64.34 60.73 2jbp n VAL 118 Cb 0.52 -2.09 -0.04 0.00 -1.06 0.00 0.00 33.84 31.18 2jbp n VAL 118 CO 0.00 0.00 0.00 -0.60 -6.46 0.00 0.00 176.83 169.77 2jbp s ARG 119 N 2.58 4.55 -0.19 1.45 3.52 -1.26 -4.85 118.95 124.75 2jbp s ARG 119 Ca 0.82 1.80 -0.20 0.00 -0.13 0.00 0.00 55.73 58.02 2jbp s ARG 119 Cb -0.49 -3.25 -0.03 0.00 -1.56 0.00 0.00 34.95 29.62 2jbp s ARG 119 CO 0.37 0.02 0.57 0.42 -0.81 0.00 0.00 175.30 175.87 2jbp s ILE 120 N -0.29 5.07 -0.16 4.11 1.01 -1.26 -1.60 121.20 128.08 2jbp s ILE 120 Ca 0.50 1.06 -0.12 0.00 0.00 0.00 0.00 60.65 62.09 2jbp s ILE 120 Cb -0.31 -3.89 -0.23 0.00 0.01 0.00 0.00 42.46 38.04 2jbp s ILE 120 CO 0.37 0.16 0.30 0.52 0.00 0.00 0.00 174.94 176.29 2jbp n VAL 121 N 4.52 1.69 -3.49 2.92 0.31 0.17 -4.94 118.33 119.52 2jbp n VAL 121 Ca -0.03 -0.42 -0.14 0.00 -0.01 0.00 0.00 64.34 63.74 2jbp n VAL 121 Cb 0.50 -1.85 -0.04 0.00 -0.91 0.00 0.00 33.84 31.54 2jbp n VAL 121 CO 0.00 0.00 0.00 -1.81 -1.32 0.00 0.00 176.83 173.70 2jbp s ASP 122 N -6.98 -0.55 -0.08 4.52 -0.00 -0.87 -5.01 116.67 107.70 2jbp s ASP 122 Ca -0.25 0.23 0.02 0.00 -0.00 0.00 0.00 52.55 52.55 2jbp s ASP 122 Cb 0.06 0.55 0.01 0.00 -0.00 0.00 0.00 42.92 43.55 2jbp s ASP 122 CO 0.70 -0.81 -0.13 -0.69 -0.00 0.00 0.00 175.17 174.24 2jbp s VAL 123 N -2.73 1.24 -0.01 -1.27 1.01 -1.26 -1.00 120.40 116.39 2jbp s VAL 123 Ca -0.04 -0.52 0.03 0.00 0.00 0.00 0.00 61.98 61.46 2jbp s VAL 123 Cb -0.01 -1.14 -0.03 0.00 0.00 0.00 0.00 36.38 35.20 2jbp s VAL 123 CO -0.04 0.38 -0.09 -0.31 0.00 0.00 0.00 175.10 175.04 2jbp s TYR 124 N 0.79 2.83 -0.30 5.22 1.51 0.28 0.13 117.35 127.82 2jbp s TYR 124 Ca -0.12 -0.07 -0.05 0.00 -1.01 0.00 0.00 57.07 55.81 2jbp s TYR 124 Cb -0.15 -1.60 0.02 0.00 -0.11 0.00 0.00 41.96 40.11 2jbp s TYR 124 CO 0.02 0.33 0.05 -2.00 -1.11 0.00 0.00 175.55 172.84 2jbp s GLU 125 N -1.26 2.89 0.42 -0.62 2.12 0.65 0.42 118.70 123.32 2jbp s GLU 125 Ca 0.15 -0.98 0.04 0.00 0.36 0.00 0.00 54.97 54.54 2jbp s GLU 125 Cb -0.11 -3.30 -0.02 0.00 0.26 0.00 0.00 34.13 30.96 2jbp s GLU 125 CO 0.06 -0.50 0.15 -0.80 -0.54 0.00 0.00 175.26 173.63 2jbp s ASN 126 N 1.43 2.87 -0.10 -1.70 0.02 -0.77 -4.44 114.94 112.25 2jbp s ASN 126 Ca 0.01 -1.74 -0.04 0.00 -1.02 0.00 0.00 52.86 50.07 2jbp s ASN 126 Cb -0.18 0.61 -0.04 0.00 0.02 0.00 0.00 41.25 41.67 2jbp s ASN 126 CO 0.01 -1.00 0.05 -0.76 0.02 0.00 0.00 177.10 175.43 2jbp s LEU 127 N -3.63 3.89 -0.20 0.60 1.43 -1.26 0.27 118.68 119.78 2jbp s LEU 127 Ca 0.22 0.27 -0.04 0.00 -1.03 0.00 0.00 54.13 53.55 2jbp s LEU 127 Cb 0.01 -1.92 0.09 0.00 0.03 0.00 0.00 46.19 44.41 2jbp s LEU 127 CO 0.15 0.39 0.20 -0.47 0.23 0.00 0.00 176.35 176.86 2jbp s TYR 128 N -0.93 -0.20 -1.08 0.29 5.04 0.44 -4.93 117.35 115.98 2jbp s TYR 128 Ca 0.14 0.13 -0.10 0.00 -2.44 0.00 0.00 57.07 54.80 2jbp s TYR 128 Cb -0.12 -0.42 -0.05 0.00 0.35 0.00 0.00 41.96 41.73 2jbp s TYR 128 CO 0.03 -0.59 0.88 0.00 -1.34 0.00 0.00 175.55 174.53 2jbp n ALA 129 N 5.31 -2.48 0.00 3.97 0.00 -1.26 -2.28 120.51 123.77 2jbp n ALA 129 Ca -0.06 0.02 0.00 0.00 0.00 0.00 0.00 53.44 53.41 2jbp n ALA 129 Cb 0.49 -5.16 0.00 0.00 0.00 0.00 0.00 19.45 14.78 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 -1.36 1.12 3.88 0.00 0.00 -1.26 -4.89 105.19 102.68 2jbp n GLY 130 Ca -0.09 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.63 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 0.00 3.74 0.09 1.61 0.52 -0.96 -5.10 118.95 118.84 2jbp s ARG 131 Ca 0.00 0.47 0.04 0.00 -0.52 0.00 0.00 55.73 55.73 2jbp s ARG 131 Cb 0.00 -2.35 -0.04 0.00 0.52 0.00 0.00 34.95 33.08 2jbp s ARG 131 CO 0.00 -0.12 0.01 -1.59 0.02 0.00 0.00 175.30 173.62 2jbp s LYS 132 N -4.10 2.60 0.08 3.54 -2.85 -1.26 -0.42 119.74 117.33 2jbp s LYS 132 Ca 0.51 -0.81 0.07 0.00 -1.00 0.00 0.00 55.97 54.74 2jbp s LYS 132 Cb -0.10 -2.57 -0.03 0.00 -2.06 0.00 0.00 37.83 33.06 2jbp s LYS 132 CO 0.35 0.55 -0.19 0.00 0.10 0.00 0.00 175.35 176.16 2jbp s LEU 134 N -1.75 4.03 -0.22 0.00 1.02 0.25 -1.84 118.68 120.16 2jbp s LEU 134 Ca 0.04 0.01 -0.04 0.00 0.02 0.00 0.00 54.13 54.16 2jbp s LEU 134 Cb -0.10 -2.15 -0.01 0.00 0.02 0.00 0.00 46.19 43.95 2jbp s LEU 134 CO 0.03 -0.07 -0.03 -0.76 0.02 0.00 0.00 176.35 175.54 2jbp s LEU 135 N 1.79 2.96 -0.16 1.79 1.43 0.17 -1.30 118.68 125.36 2jbp s LEU 135 Ca 0.08 -0.40 -0.05 0.00 -1.03 0.00 0.00 54.13 52.72 2jbp s LEU 135 Cb -0.16 -1.75 -0.03 0.00 0.03 0.00 0.00 46.19 44.28 2jbp s LEU 135 CO 0.11 -0.03 -0.00 -0.63 0.23 0.00 0.00 176.35 176.03 2jbp s ILE 136 N 1.48 4.23 -0.26 -0.59 1.01 -0.11 -0.55 121.20 126.41 2jbp s ILE 136 Ca 0.06 -0.24 -0.03 0.00 0.00 0.00 0.00 60.65 60.44 2jbp s ILE 136 Cb -0.14 -2.87 0.02 0.00 0.01 0.00 0.00 42.46 39.47 2jbp s ILE 136 CO -0.03 0.49 -0.02 -0.69 0.00 0.00 0.00 174.94 174.69 2jbp s VAL 137 N 0.32 3.25 0.23 2.92 1.01 -0.17 -1.09 120.40 126.87 2jbp s VAL 137 Ca -0.01 -0.88 0.10 0.00 0.00 0.00 0.00 61.98 61.20 2jbp s VAL 137 Cb -0.13 -2.65 -0.05 0.00 0.00 0.00 0.00 36.38 33.55 2jbp s VAL 137 CO 0.02 0.18 -0.19 0.00 0.00 0.00 0.00 175.10 175.11 2jbp s MET 138 N 1.39 1.50 1.11 2.72 0.23 0.65 0.46 119.30 127.36 2jbp s MET 138 Ca 0.01 -1.63 -0.17 0.00 -1.03 0.00 0.00 55.69 52.87 2jbp s MET 138 Cb -0.17 -1.54 0.13 0.00 -1.53 0.00 0.00 34.83 31.72 2jbp s MET 138 CO -0.02 0.29 0.22 -0.85 -2.03 0.00 0.00 175.02 172.63 2jbp n GLU 139 N -0.29 -1.59 -3.85 3.16 0.28 -0.63 -1.21 120.64 116.52 2jbp n GLU 139 Ca -0.08 -0.44 -0.36 0.00 -0.16 0.00 0.00 57.16 56.12 2jbp n GLU 139 Cb 0.59 -1.80 -0.13 0.00 1.43 0.00 0.00 31.44 31.53 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 1.47 5.35 0.21 0.00 1.43 -1.26 -4.78 118.68 121.11 2jbp s LEU 141 Ca 0.04 -2.89 0.26 0.00 -1.03 0.00 0.00 54.13 50.51 2jbp s LEU 141 Cb -0.16 -2.36 0.77 0.00 0.03 0.00 0.00 46.19 44.47 2jbp s LEU 141 CO -0.01 -0.73 1.75 -0.90 0.23 0.00 0.00 176.35 176.69 2jbp n ASP 142 N 5.27 0.85 0.00 2.29 5.75 -0.62 -4.03 116.55 126.05 2jbp n ASP 142 Ca 0.31 0.56 0.04 0.00 -0.01 0.00 0.00 54.79 55.68 2jbp n ASP 142 Cb 0.44 -0.76 0.22 0.00 -1.03 0.00 0.00 41.12 39.98 2jbp n ASP 142 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2jbp n GLY 143 N 1.30 -0.33 0.46 6.12 0.00 0.16 -4.66 105.19 108.24 2jbp n GLY 143 Ca 0.05 -0.05 0.06 0.00 0.00 0.00 0.00 46.02 46.09 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 -0.29 -2.56 3.70 -0.02 0.00 -1.25 -4.44 105.19 100.31 2jbp n GLY 144 Ca 0.05 -1.34 -0.40 0.00 0.00 0.00 0.00 46.02 44.33 2jbp n GLY 144 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2jbp n GLU 145 N -2.89 1.70 -0.11 1.61 1.02 -1.26 -2.40 120.64 118.31 2jbp n GLU 145 Ca -0.02 0.61 -0.06 0.00 -0.02 0.00 0.00 57.16 57.68 2jbp n GLU 145 Cb 0.22 -2.40 0.02 0.00 -0.02 0.00 0.00 31.44 29.26 2jbp n GLU 145 CO 0.00 0.00 0.00 1.25 1.18 0.00 0.00 177.13 179.56 2jbp h LEU 146 N 1.65 0.06 0.00 -4.62 5.85 -1.54 0.20 115.31 116.91 2jbp h LEU 146 Ca -0.49 0.05 0.00 0.00 0.84 0.00 0.00 57.88 58.29 2jbp h LEU 146 Cb 1.31 0.06 0.00 0.00 0.37 0.00 0.00 40.66 42.40 2jbp h LEU 146 CO 0.58 0.07 0.00 0.49 -0.34 0.00 0.00 178.44 179.24 2jbp n PHE 147 N -5.06 0.00 -0.02 1.25 3.72 -1.26 -2.83 117.46 113.26 2jbp n PHE 147 Ca 0.02 0.00 -0.13 0.00 -0.05 0.00 0.00 57.45 57.28 2jbp n PHE 147 Cb 0.16 -0.27 -0.14 0.00 -0.94 0.00 0.00 39.48 38.29 2jbp n PHE 147 CO 0.00 0.00 0.00 0.43 -0.05 0.00 0.00 176.76 177.14 2jbp n SER 148 N -1.27 1.32 0.42 4.37 7.64 0.68 -1.58 113.62 125.21 2jbp n SER 148 Ca 0.09 0.31 -0.17 0.00 1.01 0.00 0.00 58.87 60.12 2jbp n SER 148 Cb 0.15 -0.32 -0.08 0.00 -1.01 0.00 0.00 64.21 62.95 2jbp n SER 148 CO 0.00 0.00 0.00 0.03 -3.01 0.00 0.00 175.04 172.06 2jbp h ARG 149 N 0.03 -1.05 -0.87 1.43 2.47 -1.39 -0.17 114.38 114.82 2jbp h ARG 149 Ca -0.35 0.07 0.15 0.00 -1.26 0.00 0.00 59.98 58.59 2jbp h ARG 149 Cb 2.03 0.24 -0.15 0.00 -1.65 0.00 0.00 29.97 30.44 2jbp h ARG 149 CO 0.08 -0.70 -0.28 -0.89 0.56 0.00 0.00 179.97 178.73 2jbp n ILE 150 N -5.45 -0.42 0.21 2.04 2.08 -1.13 -0.19 119.36 116.51 2jbp n ILE 150 Ca -0.14 2.02 -0.16 0.00 0.56 0.00 0.00 62.75 65.04 2jbp n ILE 150 Cb 0.43 -2.73 -0.08 0.00 -0.75 0.00 0.00 39.64 36.50 2jbp n ILE 150 CO 0.00 0.00 0.00 -0.61 0.56 0.00 0.00 176.55 176.50 2jbp h GLN 151 N 0.00 -0.78 -3.95 0.38 4.15 -0.96 -3.33 115.11 110.63 2jbp h GLN 151 Ca 0.36 0.05 -0.76 0.00 0.77 0.00 0.00 58.65 59.07 2jbp h GLN 151 Cb 0.58 0.18 -0.19 0.00 0.21 0.00 0.00 27.48 28.26 2jbp h GLN 151 CO -0.88 -0.52 1.48 -0.25 -1.93 0.00 0.00 178.83 176.73 2jbp n ASP 152 N -5.50 5.33 0.00 -0.69 9.92 0.73 -4.69 116.55 121.64 2jbp n ASP 152 Ca -0.10 -3.08 0.00 0.00 -0.53 0.00 0.00 54.79 51.08 2jbp n ASP 152 Cb 0.40 -1.48 0.00 0.00 -0.64 0.00 0.00 41.12 39.40 2jbp n ASP 152 CO 0.00 0.00 0.00 0.54 0.13 0.00 0.00 177.20 177.87 2jbp n ARG 153 N 4.19 0.00 0.00 -1.24 1.74 -1.25 -4.87 116.66 115.22 2jbp n ARG 153 Ca 0.36 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.44 2jbp n ARG 153 Cb 0.39 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 31.83 2jbp n ARG 153 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2jbp n GLY 154 N 4.93 1.77 3.00 -0.13 0.00 -1.26 -4.86 105.19 108.64 2jbp n GLY 154 Ca 0.00 0.27 0.00 0.00 0.00 0.00 0.00 46.02 46.29 2jbp n GLY 154 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2jbp n ASP 155 N 0.00 -2.39 0.00 1.61 8.00 -1.26 -4.63 116.55 117.88 2jbp n ASP 155 Ca 0.00 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.50 2jbp n ASP 155 Cb 0.00 -2.23 0.00 0.00 -0.02 0.00 0.00 41.12 38.87 2jbp n ASP 155 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2jbp n GLN 156 N -0.07 0.00 0.00 -1.24 6.02 -1.26 -4.80 117.38 116.02 2jbp n GLN 156 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.99 2jbp n GLN 156 Cb 0.20 -1.99 0.00 0.00 1.02 0.00 0.00 30.24 29.47 2jbp n GLN 156 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2jbp n ALA 157 N 0.17 0.00 -2.68 -1.58 0.00 -1.26 -4.75 120.51 110.41 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 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.42 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 0.00 3.52 0.12 0.00 5.99 -1.26 -4.92 117.98 121.43 2jbp s PHE 158 Ca 0.00 1.59 0.08 0.00 0.00 0.00 0.00 56.93 58.60 2jbp s PHE 158 Cb 0.00 -3.19 -0.04 0.00 0.00 0.00 0.00 43.02 39.79 2jbp s PHE 158 CO 0.00 -0.26 -0.13 0.95 -0.00 0.00 0.00 175.22 175.78 2jbp s THR 159 N 1.88 3.13 0.30 0.12 -4.23 -1.26 0.41 115.64 116.00 2jbp s THR 159 Ca 0.49 -1.43 0.04 0.00 -1.18 0.00 0.00 61.69 59.62 2jbp s THR 159 Cb -0.19 -2.47 0.31 0.00 1.34 0.00 0.00 72.50 71.48 2jbp s THR 159 CO 0.20 0.07 1.67 -0.08 -0.54 0.00 0.00 174.62 175.93 2jbp h GLU 160 N 3.52 0.28 0.19 3.99 4.81 -0.40 -0.93 114.58 126.04 2jbp h GLU 160 Ca -0.49 -0.02 -0.01 0.00 -0.13 0.00 0.00 59.36 58.72 2jbp h GLU 160 Cb 1.17 -0.06 0.00 0.00 0.63 0.00 0.00 28.75 30.49 2jbp h GLU 160 CO 0.50 0.19 -0.09 -0.09 -0.73 0.00 0.00 179.01 178.79 2jbp h ARG 161 N 0.29 -0.25 -1.06 1.92 2.43 -1.76 -0.66 114.38 115.29 2jbp h ARG 161 Ca 0.58 0.02 0.29 0.00 -0.81 0.00 0.00 59.98 60.06 2jbp h ARG 161 Cb 1.18 0.06 -0.12 0.00 -0.42 0.00 0.00 29.97 30.67 2jbp h ARG 161 CO -0.60 -0.00 0.65 0.93 -1.51 0.00 0.00 179.97 179.43 2jbp h GLU 162 N -0.46 0.38 0.30 0.20 5.08 -1.54 0.12 114.58 118.67 2jbp h GLU 162 Ca -0.03 -0.02 -0.01 0.00 -1.00 0.00 0.00 59.36 58.30 2jbp h GLU 162 Cb 0.36 -0.09 0.00 0.00 0.50 0.00 0.00 28.75 29.52 2jbp h GLU 162 CO 0.04 0.25 -0.15 0.00 -1.00 0.00 0.00 179.01 178.16 2jbp h ALA 163 N 1.69 -0.41 -0.48 3.43 0.00 -0.63 0.11 119.26 122.97 2jbp h ALA 163 Ca 0.66 -0.15 0.10 0.00 0.00 0.00 0.00 54.91 55.52 2jbp h ALA 163 Cb 1.59 0.16 -0.09 0.00 0.00 0.00 0.00 17.79 19.45 2jbp h ALA 163 CO -0.42 -0.64 -0.13 1.03 0.00 0.00 0.00 179.25 179.09 2jbp h SER 164 N -0.58 -0.47 -0.68 0.00 0.87 0.39 0.36 113.55 113.44 2jbp h SER 164 Ca -0.04 0.15 0.05 0.00 -1.23 0.00 0.00 61.79 60.71 2jbp h SER 164 Cb 0.43 0.31 -0.05 0.00 -0.44 0.00 0.00 62.40 62.64 2jbp h SER 164 CO 0.07 -0.17 0.40 -0.33 -0.53 0.00 0.00 176.83 176.27 2jbp h GLU 165 N -0.01 0.72 -0.07 2.24 5.08 -0.38 -0.74 114.58 121.42 2jbp h GLU 165 Ca 0.23 -0.04 -0.00 0.00 -1.00 0.00 0.00 59.36 58.55 2jbp h GLU 165 Cb 0.36 -0.16 -0.00 0.00 0.50 0.00 0.00 28.75 29.45 2jbp h GLU 165 CO -0.50 0.48 0.04 0.82 -1.00 0.00 0.00 179.01 178.85 2jbp h ILE 166 N 0.74 1.06 -0.73 3.13 2.04 0.10 -2.40 117.51 121.45 2jbp h ILE 166 Ca 0.29 -0.17 0.12 0.00 1.00 0.00 0.00 64.86 66.10 2jbp h ILE 166 Cb 0.13 1.05 -0.08 0.00 -0.74 0.00 0.00 36.82 37.17 2jbp h ILE 166 CO -0.15 0.05 0.33 0.24 0.00 0.00 0.00 178.15 178.62 2jbp h MET 167 N 0.05 0.52 -0.13 2.37 2.86 0.18 -1.72 114.93 119.06 2jbp h MET 167 Ca 0.03 -0.03 -0.06 0.00 -2.06 0.00 0.00 59.70 57.58 2jbp h MET 167 Cb 0.05 -0.12 -0.01 0.00 0.06 0.00 0.00 31.60 31.58 2jbp h MET 167 CO -0.00 0.34 -0.19 -0.22 1.06 0.00 0.00 176.91 177.90 2jbp h LYS 168 N 0.53 0.21 -0.05 1.72 3.64 -0.66 0.30 116.57 122.26 2jbp h LYS 168 Ca 0.38 -0.06 -0.14 0.00 -1.27 0.00 0.00 60.65 59.57 2jbp h LYS 168 Cb 0.49 -0.02 0.01 0.00 -0.41 0.00 0.00 32.23 32.29 2jbp h LYS 168 CO -0.33 0.40 -0.51 0.66 -2.27 0.00 0.00 179.45 177.40 2jbp h SER 169 N 0.20 0.53 -0.73 4.20 4.64 -0.99 -0.37 113.55 121.03 2jbp h SER 169 Ca 0.04 -0.70 0.13 0.00 -0.47 0.00 0.00 61.79 60.79 2jbp h SER 169 Cb 0.45 -0.16 -0.09 0.00 -0.31 0.00 0.00 62.40 62.29 2jbp h SER 169 CO 0.03 1.15 0.28 0.40 -0.87 0.00 0.00 176.83 177.82 2jbp h ILE 170 N -0.05 0.66 -0.89 0.95 2.04 -1.16 -0.65 117.51 118.41 2jbp h ILE 170 Ca -0.05 -0.15 0.06 0.00 1.00 0.00 0.00 64.86 65.73 2jbp h ILE 170 Cb 1.19 0.20 -0.06 0.00 -0.74 0.00 0.00 36.82 37.41 2jbp h ILE 170 CO 0.10 0.08 0.58 1.23 0.00 0.00 0.00 178.15 180.14 2jbp h GLY 171 N 0.42 1.30 1.15 5.37 0.00 -0.15 -1.62 103.07 109.54 2jbp h GLY 171 Ca 0.40 -0.41 -0.11 0.00 0.00 0.00 0.00 47.33 47.20 2jbp h GLY 171 CO -0.40 0.30 -0.11 0.83 0.00 0.00 0.00 176.54 177.16 2jbp h GLU 172 N 1.02 1.00 0.17 4.80 5.08 0.41 0.49 114.58 127.55 2jbp h GLU 172 Ca 0.38 -0.37 0.01 0.00 -1.00 0.00 0.00 59.36 58.38 2jbp h GLU 172 Cb 0.18 -0.06 -0.02 0.00 0.50 0.00 0.00 28.75 29.35 2jbp h GLU 172 CO -0.14 1.05 -0.22 0.00 -1.00 0.00 0.00 179.01 178.70 2jbp h ALA 173 N 0.97 -0.41 -0.97 3.43 0.00 -0.53 -1.76 119.26 119.99 2jbp h ALA 173 Ca 0.14 -0.05 0.01 0.00 0.00 0.00 0.00 54.91 55.00 2jbp h ALA 173 Cb 0.67 0.32 -0.05 0.00 0.00 0.00 0.00 17.79 18.74 2jbp h ALA 173 CO 0.05 -0.76 0.63 0.82 0.00 0.00 0.00 179.25 179.99 2jbp h ILE 174 N -0.44 1.25 -0.41 0.00 1.08 -1.08 -1.96 117.51 115.96 2jbp h ILE 174 Ca 0.01 -0.49 -0.10 0.00 -0.39 0.00 0.00 64.86 63.89 2jbp h ILE 174 Cb 0.43 -0.16 -0.02 0.00 -3.07 0.00 0.00 36.82 34.00 2jbp h ILE 174 CO -0.08 0.25 -0.15 -0.61 -0.69 0.00 0.00 178.15 176.87 2jbp h GLN 175 N 1.33 0.75 -0.34 2.37 4.15 -0.67 -0.59 115.11 122.11 2jbp h GLN 175 Ca 0.35 -0.26 -0.02 0.00 0.77 0.00 0.00 58.65 59.49 2jbp h GLN 175 Cb -0.13 -0.06 -0.01 0.00 0.21 0.00 0.00 27.48 27.49 2jbp h GLN 175 CO -0.07 0.86 0.13 -0.92 -1.93 0.00 0.00 178.83 176.89 2jbp h TYR 176 N 0.67 0.52 -0.48 3.99 3.20 -0.77 -0.52 116.97 123.58 2jbp h TYR 176 Ca 0.11 -0.04 0.00 0.00 3.14 0.00 0.00 58.73 61.94 2jbp h TYR 176 Cb 0.63 -0.15 -0.02 0.00 1.54 0.00 0.00 36.73 38.72 2jbp h TYR 176 CO 0.03 0.49 0.31 -0.07 -1.64 0.00 0.00 178.16 177.28 2jbp h LEU 177 N 0.40 0.56 -0.82 2.82 3.38 -0.99 -2.55 115.31 118.10 2jbp h LEU 177 Ca 0.11 -0.03 -0.12 0.00 0.09 0.00 0.00 57.88 57.93 2jbp h LEU 177 Cb 0.20 -0.14 -0.02 0.00 0.09 0.00 0.00 40.66 40.79 2jbp h LEU 177 CO -0.01 0.42 -0.59 0.45 0.09 0.00 0.00 178.44 178.81 2jbp h HIS 178 N 0.65 0.01 0.00 1.13 3.86 -0.90 0.40 115.15 120.30 2jbp h HIS 178 Ca 0.17 -0.00 -0.01 0.00 -1.16 0.00 0.00 60.37 59.37 2jbp h HIS 178 Cb -0.05 -0.00 -0.00 0.00 1.06 0.00 0.00 27.41 28.41 2jbp h HIS 178 CO -0.04 0.59 -0.04 0.66 0.86 0.00 0.00 177.93 179.96 2jbp h SER 179 N 0.01 0.00 -0.27 2.45 4.64 -0.68 -1.92 113.55 117.78 2jbp h SER 179 Ca -0.01 0.00 -0.13 0.00 -0.47 0.00 0.00 61.79 61.18 2jbp h SER 179 Cb 1.04 0.00 -0.08 0.00 -0.31 0.00 0.00 62.40 63.05 2jbp h SER 179 CO 0.08 0.04 -0.15 2.30 -0.87 0.00 0.00 176.83 178.23 2jbp n ILE 180 N -3.16 2.45 -3.66 0.95 -5.35 -0.97 -4.98 119.36 104.63 2jbp n ILE 180 Ca 0.00 -2.77 -0.24 0.00 -0.27 0.00 0.00 62.75 59.47 2jbp n ILE 180 Cb 0.31 -0.30 0.06 0.00 -1.74 0.00 0.00 39.64 37.98 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 -1.09 -4.69 -4.18 7.28 4.13 -0.72 -4.94 115.26 111.04 2jbp n ASN 181 Ca 0.29 -0.64 -0.33 0.00 1.68 0.00 0.00 54.58 55.58 2jbp n ASN 181 Cb 0.95 -4.66 -0.16 0.00 -1.54 0.00 0.00 39.78 34.36 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 -3.36 2.15 -0.03 2.41 1.01 0.09 -0.75 121.20 122.73 2jbp s ILE 182 Ca 0.44 -0.95 -0.07 0.00 0.00 0.00 0.00 60.65 60.07 2jbp s ILE 182 Cb -0.20 -1.87 -0.05 0.00 0.01 0.00 0.00 42.46 40.35 2jbp s ILE 182 CO 0.76 0.54 0.24 0.00 0.00 0.00 0.00 174.94 176.49 2jbp s ALA 183 N 0.82 3.85 -0.07 9.38 0.00 -0.74 -3.43 121.76 131.57 2jbp s ALA 183 Ca -0.07 -0.57 -0.01 0.00 0.00 0.00 0.00 51.96 51.31 2jbp s ALA 183 Cb -0.15 -2.06 -0.26 0.00 0.00 0.00 0.00 23.12 20.65 2jbp s ALA 183 CO -0.02 0.63 0.55 1.25 0.00 0.00 0.00 175.76 178.18 2jbp h HIS 184 N 4.28 0.34 -0.42 0.00 2.76 -1.88 -1.90 115.15 118.34 2jbp h HIS 184 Ca -0.51 -0.25 -0.18 0.00 -2.20 0.00 0.00 60.37 57.22 2jbp h HIS 184 Cb 1.21 -0.01 -0.07 0.00 1.55 0.00 0.00 27.41 30.08 2jbp h HIS 184 CO 0.70 1.48 -0.16 0.54 -1.30 0.00 0.00 177.93 179.19 2jbp n ARG 185 N -3.35 -1.11 -2.23 5.26 1.74 -1.26 -2.96 116.66 112.74 2jbp n ARG 185 Ca -0.24 0.75 -0.02 0.00 -0.77 0.00 0.00 57.85 57.57 2jbp n ARG 185 Cb 1.05 -4.81 0.07 0.00 -1.02 0.00 0.00 32.46 27.75 2jbp n ARG 185 CO 0.00 0.00 0.00 -3.47 -1.52 0.00 0.00 177.63 172.64 2jbp n ASP 186 N -0.42 -0.92 -4.60 0.55 2.03 -1.26 -4.90 116.55 107.03 2jbp n ASP 186 Ca -0.09 -1.74 -0.43 0.00 0.52 0.00 0.00 54.79 53.05 2jbp n ASP 186 Cb 0.41 0.46 -0.02 0.00 -0.72 0.00 0.00 41.12 41.26 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 0.08 3.91 0.22 5.18 1.01 -1.26 -4.89 120.40 124.65 2jbp s VAL 187 Ca 0.06 0.93 0.00 0.00 0.00 0.00 0.00 61.98 62.97 2jbp s VAL 187 Cb 0.26 -4.21 -0.04 0.00 0.00 0.00 0.00 36.38 32.38 2jbp s VAL 187 CO -0.07 -0.76 0.14 -1.59 0.00 0.00 0.00 175.10 172.82 2jbp s LYS 188 N 4.91 1.28 0.21 2.72 -2.85 -1.26 -4.75 119.74 120.00 2jbp s LYS 188 Ca 0.61 -1.69 -0.09 0.00 -1.00 0.00 0.00 55.97 53.80 2jbp s LYS 188 Cb -0.13 0.21 0.25 0.00 -2.06 0.00 0.00 37.83 36.10 2jbp s LYS 188 CO 0.32 -0.40 1.79 -1.35 0.10 0.00 0.00 175.35 175.81 2jbp h PRO 189 N 2.54 0.57 0.00 1.78 0.11 -1.96 -1.39 132.00 133.66 2jbp h PRO 189 Ca -0.35 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.72 2jbp h PRO 189 Cb 1.25 -0.13 0.00 0.00 0.11 0.00 0.00 31.00 32.23 2jbp h PRO 189 CO 0.52 0.38 0.16 0.93 -0.21 0.00 0.00 178.00 179.78 2jbp h GLU 190 N 0.59 0.00 -0.49 1.05 3.07 -1.97 -0.96 114.58 115.87 2jbp h GLU 190 Ca 0.30 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.16 2jbp h GLU 190 Cb 0.25 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.16 2jbp h GLU 190 CO -0.22 0.00 0.00 0.09 -1.40 0.00 0.00 179.01 177.48 2jbp n ASN 191 N -2.87 4.62 -4.02 1.42 5.03 -0.52 -4.76 115.26 114.16 2jbp n ASN 191 Ca -0.02 -2.70 -0.31 0.00 0.87 0.00 0.00 54.58 52.42 2jbp n ASN 191 Cb 0.21 -0.56 -0.14 0.00 -1.02 0.00 0.00 39.78 38.26 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 -2.29 4.73 0.16 3.41 1.43 -0.36 -1.29 118.68 124.47 2jbp s LEU 192 Ca 0.47 -2.33 0.08 0.00 -1.03 0.00 0.00 54.13 51.31 2jbp s LEU 192 Cb 0.34 -1.65 -0.04 0.00 0.03 0.00 0.00 46.19 44.86 2jbp s LEU 192 CO 0.17 -0.36 -0.05 -0.76 0.23 0.00 0.00 176.35 175.57 2jbp s LEU 193 N 0.66 3.15 0.06 1.79 1.43 -0.40 -1.73 118.68 123.65 2jbp s LEU 193 Ca 0.12 -0.45 -0.09 0.00 -1.03 0.00 0.00 54.13 52.68 2jbp s LEU 193 Cb -0.21 -1.84 -0.06 0.00 0.03 0.00 0.00 46.19 44.11 2jbp s LEU 193 CO -0.06 0.11 0.38 -0.31 0.23 0.00 0.00 176.35 176.70 2jbp s TYR 194 N -1.61 3.58 0.24 0.29 2.02 -1.01 -0.38 117.35 120.49 2jbp s TYR 194 Ca 0.25 0.75 -0.05 0.00 -0.37 0.00 0.00 57.07 57.65 2jbp s TYR 194 Cb -0.10 -2.13 0.35 0.00 -0.40 0.00 0.00 41.96 39.69 2jbp s TYR 194 CO 0.16 0.54 1.84 1.79 -1.57 0.00 0.00 175.55 178.31 2jbp h THR 195 N 2.90 1.01 -3.05 -0.71 1.35 -1.09 0.48 112.91 113.80 2jbp h THR 195 Ca -0.49 -0.32 -0.05 0.00 -0.55 0.00 0.00 66.41 65.00 2jbp h THR 195 Cb 1.19 0.00 0.00 0.00 -1.73 0.00 0.00 68.15 67.62 2jbp h THR 195 CO 0.66 0.17 0.24 -1.54 -0.25 0.00 0.00 175.52 174.80 2jbp n SER 196 N -4.65 -2.17 -0.19 5.36 3.41 -1.26 -1.59 113.62 112.53 2jbp n SER 196 Ca 0.13 -2.58 0.15 0.00 -0.26 0.00 0.00 58.87 56.30 2jbp n SER 196 Cb 0.20 3.64 0.72 0.00 -0.26 0.00 0.00 64.21 68.52 2jbp n SER 196 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 2jbp n LYS 197 N -0.53 1.13 -1.25 4.33 4.01 -1.26 -3.77 118.16 120.82 2jbp n LYS 197 Ca -0.08 -0.38 -0.31 0.00 -0.51 0.00 0.00 58.31 57.03 2jbp n LYS 197 Cb 0.58 -1.49 0.09 0.00 -0.51 0.00 0.00 35.03 33.70 2jbp n LYS 197 CO 0.00 0.00 0.00 1.03 -1.11 0.00 0.00 177.40 177.32 2jbp s ARG 198 N -2.13 2.18 0.00 1.97 3.00 -1.26 -4.90 118.95 117.81 2jbp s ARG 198 Ca 0.40 1.24 0.00 0.00 0.00 0.00 0.00 55.73 57.36 2jbp s ARG 198 Cb 0.21 -1.88 0.00 0.00 0.00 0.00 0.00 34.95 33.28 2jbp s ARG 198 CO 0.39 -1.71 0.47 -0.35 0.00 0.00 0.00 175.30 174.10 2jbp n PRO 199 N -3.48 0.64 0.00 3.54 -0.04 -1.26 -2.24 135.00 132.16 2jbp n PRO 199 Ca 0.10 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.56 2jbp n PRO 199 Cb 0.53 -1.16 0.00 0.00 -0.04 0.00 0.00 33.50 32.82 2jbp n PRO 199 CO 0.00 0.00 0.00 0.27 -0.04 0.00 0.00 175.50 175.73 2jbp n ASN 200 N -0.15 0.00 -4.51 3.54 0.23 -1.26 -5.10 115.26 108.02 2jbp n ASN 200 Ca 0.00 -1.00 -0.40 0.00 -0.53 0.00 0.00 54.58 52.65 2jbp n ASN 200 Cb 0.08 0.00 0.02 0.00 -2.08 0.00 0.00 39.78 37.80 2jbp n ASN 200 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 2jbp n ALA 201 N 0.00 -0.84 -2.34 -2.53 0.00 -0.95 -4.92 120.51 108.92 2jbp n ALA 201 Ca 0.00 0.12 -0.31 0.00 0.00 0.00 0.00 53.44 53.25 2jbp n ALA 201 Cb 0.36 -1.89 -0.04 0.00 0.00 0.00 0.00 19.45 17.88 2jbp n ALA 201 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 2jbp s ILE 202 N -1.49 4.88 -0.15 0.00 -1.09 -1.26 -4.73 121.20 117.36 2jbp s ILE 202 Ca 0.66 0.48 -0.19 0.00 -2.23 0.00 0.00 60.65 59.37 2jbp s ILE 202 Cb -0.54 -3.67 -0.04 0.00 -1.58 0.00 0.00 42.46 36.64 2jbp s ILE 202 CO 0.56 -0.25 0.52 -0.22 -1.23 0.00 0.00 174.94 174.31 2jbp s LEU 203 N -3.26 4.23 0.03 2.97 2.96 -1.26 -0.52 118.68 123.83 2jbp s LEU 203 Ca 0.48 0.80 0.06 0.00 -0.22 0.00 0.00 54.13 55.25 2jbp s LEU 203 Cb -0.11 -2.74 -0.02 0.00 0.50 0.00 0.00 46.19 43.82 2jbp s LEU 203 CO 0.25 -0.09 -0.17 -0.54 -1.32 0.00 0.00 176.35 174.48 2jbp s LYS 204 N 1.06 1.20 0.16 1.98 1.02 0.49 -4.56 119.74 121.09 2jbp s LYS 204 Ca 0.26 -0.79 -0.03 0.00 0.02 0.00 0.00 55.97 55.43 2jbp s LYS 204 Cb -0.15 -1.24 -0.05 0.00 -0.52 0.00 0.00 37.83 35.87 2jbp s LYS 204 CO 0.11 0.32 0.37 -1.17 -0.92 0.00 0.00 175.35 174.06 2jbp s LEU 205 N -0.98 4.25 0.23 3.17 2.96 0.44 -1.28 118.68 127.48 2jbp s LEU 205 Ca 0.05 0.53 -0.00 0.00 -0.22 0.00 0.00 54.13 54.48 2jbp s LEU 205 Cb -0.08 -3.27 -0.04 0.00 0.50 0.00 0.00 46.19 43.31 2jbp s LEU 205 CO 0.01 0.03 0.19 0.42 -1.32 0.00 0.00 176.35 175.67 2jbp s THR 206 N -1.71 0.00 -0.16 3.68 -4.23 -0.41 -1.54 115.64 111.27 2jbp s THR 206 Ca 0.40 -1.95 -0.00 0.00 -1.18 0.00 0.00 61.69 58.96 2jbp s THR 206 Cb -0.12 -2.48 0.00 0.00 1.34 0.00 0.00 72.50 71.24 2jbp s THR 206 CO 0.26 0.00 0.01 -0.67 -0.54 0.00 0.00 174.62 173.68 2jbp n ASP 207 N -0.52 -5.09 -1.79 3.99 2.03 -1.26 -4.89 116.55 109.02 2jbp n ASP 207 Ca 0.03 0.72 -0.05 0.00 0.52 0.00 0.00 54.79 56.01 2jbp n ASP 207 Cb 0.65 -3.23 0.25 0.00 -0.72 0.00 0.00 41.12 38.07 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 0.33 2.03 -0.38 -0.67 3.01 -1.26 -4.47 117.46 116.06 2jbp n PHE 208 Ca 0.00 -1.01 0.33 0.00 1.01 0.00 0.00 57.45 57.78 2jbp n PHE 208 Cb 0.01 -0.60 0.66 0.00 -0.01 0.00 0.00 39.48 39.55 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 3.10 0.61 -0.09 1.37 0.00 -1.91 -1.90 103.07 104.25 2jbp h GLY 209 Ca 0.22 -0.08 0.00 0.00 0.00 0.00 0.00 47.33 47.47 2jbp h GLY 209 CO 0.61 -0.11 -0.28 0.69 0.00 0.00 0.00 176.54 177.45 2jbp n PHE 210 N -4.39 0.00 -1.52 5.60 0.99 -1.26 -4.96 117.46 111.92 2jbp n PHE 210 Ca 0.29 0.00 -0.51 0.00 -0.00 0.00 0.00 57.45 57.23 2jbp n PHE 210 Cb 1.23 0.00 -0.05 0.00 -1.00 0.00 0.00 39.48 39.67 2jbp n PHE 210 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.76 176.76 2jbp n ALA 211 N -0.94 -1.94 -2.76 4.37 0.00 -0.71 -4.73 120.51 113.79 2jbp n ALA 211 Ca 0.02 0.49 -0.16 0.00 0.00 0.00 0.00 53.44 53.78 2jbp n ALA 211 Cb 0.12 -1.87 -0.13 0.00 0.00 0.00 0.00 19.45 17.57 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 -0.48 0.62 0.37 0.00 2.20 -0.71 -4.90 119.74 116.84 2jbp s LYS 212 Ca 0.75 -0.54 -0.26 0.00 -0.36 0.00 0.00 55.97 55.55 2jbp s LYS 212 Cb -0.96 -0.53 -0.09 0.00 -1.51 0.00 0.00 37.83 34.74 2jbp s LYS 212 CO 0.55 0.13 1.13 -2.00 -0.36 0.00 0.00 175.35 174.80 2jbp s GLU 213 N -0.90 4.23 -0.76 4.03 2.56 -1.26 -1.79 118.70 124.80 2jbp s GLU 213 Ca -0.02 1.78 0.01 0.00 0.00 0.00 0.00 54.97 56.74 2jbp s GLU 213 Cb -0.06 -2.78 0.19 0.00 2.00 0.00 0.00 34.13 33.47 2jbp s GLU 213 CO 0.00 -0.15 0.59 0.95 -0.56 0.00 0.00 175.26 176.09 2jbp s THR 214 N -1.40 3.56 0.06 -1.70 -4.23 0.08 -4.91 115.64 107.10 2jbp s THR 214 Ca 0.54 -3.93 -0.05 0.00 -1.18 0.00 0.00 61.69 57.07 2jbp s THR 214 Cb -0.30 -3.28 -0.02 0.00 1.34 0.00 0.00 72.50 70.25 2jbp s THR 214 CO 0.37 -1.01 0.10 0.42 -0.54 0.00 0.00 174.62 173.96 2jbp s THR 215 N -1.21 0.16 0.00 3.99 -4.23 -1.26 -4.84 115.64 108.26 2jbp s THR 215 Ca 0.25 -1.34 0.00 0.00 -1.18 0.00 0.00 61.69 59.41 2jbp s THR 215 Cb -0.09 -1.26 0.00 0.00 1.34 0.00 0.00 72.50 72.49 2jbp s THR 215 CO -0.12 -0.74 0.00 -2.65 -0.54 0.00 0.00 174.62 170.56 2jbp n PRO 227 N 0.24 0.00 -2.75 3.99 -0.02 -1.26 -4.32 135.00 130.88 2jbp n PRO 227 Ca -0.16 0.00 -0.04 0.00 -2.02 0.00 0.00 63.50 61.28 2jbp n PRO 227 Cb 0.61 0.00 0.01 0.00 -0.02 0.00 0.00 33.50 34.10 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 5.88 -3.43 0.00 6.00 0.18 -1.26 -4.91 117.16 119.62 2jbp n TYR 228 Ca 0.00 -1.28 0.00 0.00 1.88 0.00 0.00 57.90 58.50 2jbp n TYR 228 Cb 0.00 1.44 0.00 0.00 -0.38 0.00 0.00 39.34 40.40 2jbp n TYR 228 CO 0.00 0.00 0.00 2.48 -2.08 0.00 0.00 176.86 177.26 2jbp n TYR 229 N 2.86 0.00 -0.67 -3.48 0.18 -1.26 -5.17 117.16 109.62 2jbp n TYR 229 Ca 0.17 0.00 -0.10 0.00 1.88 0.00 0.00 57.90 59.85 2jbp n TYR 229 Cb 0.57 0.00 0.08 0.00 -0.38 0.00 0.00 39.34 39.62 2jbp n TYR 229 CO 0.00 0.00 0.00 1.33 -2.08 0.00 0.00 176.86 176.11 2jbp n VAL 230 N 0.00 0.00 -4.14 -3.48 0.24 -1.26 -5.10 118.33 104.59 2jbp n VAL 230 Ca 0.00 -0.16 -0.15 0.00 -2.04 0.00 0.00 64.34 61.99 2jbp n VAL 230 Cb 0.00 -1.06 -0.13 0.00 -1.47 0.00 0.00 33.84 31.18 2jbp n VAL 230 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2jbp s ALA 231 N -2.98 0.60 0.66 2.33 0.00 -1.26 -5.06 121.76 116.05 2jbp s ALA 231 Ca 0.23 -0.57 0.33 0.00 0.00 0.00 0.00 51.96 51.95 2jbp s ALA 231 Cb -0.02 -0.05 1.78 0.00 0.00 0.00 0.00 23.12 24.83 2jbp s ALA 231 CO 0.18 0.06 2.01 -1.00 0.00 0.00 0.00 175.76 177.01 2jbp h PRO 232 N 5.14 0.00 -0.01 0.00 0.13 -1.99 -1.50 132.00 133.77 2jbp h PRO 232 Ca -0.33 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.80 2jbp h PRO 232 Cb 1.20 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.33 2jbp h PRO 232 CO 0.45 0.00 -0.04 0.39 -0.23 0.00 0.00 178.00 178.57 2jbp n GLU 233 N -2.97 1.27 -0.09 0.86 4.71 -1.26 -3.25 120.64 119.90 2jbp n GLU 233 Ca -0.02 -0.56 -0.17 0.00 -0.01 0.00 0.00 57.16 56.40 2jbp n GLU 233 Cb 0.33 -1.49 -0.13 0.00 -1.01 0.00 0.00 31.44 29.14 2jbp n GLU 233 CO 0.00 0.00 0.00 0.28 0.09 0.00 0.00 177.13 177.50 2jbp n VAL 234 N -0.38 1.55 0.25 2.62 0.31 -0.56 -4.26 118.33 117.86 2jbp n VAL 234 Ca 0.19 -0.63 0.14 0.00 -0.01 0.00 0.00 64.34 64.03 2jbp n VAL 234 Cb 0.28 -1.37 0.52 0.00 -0.91 0.00 0.00 33.84 32.36 2jbp n VAL 234 CO 0.00 0.00 0.00 -0.07 -1.32 0.00 0.00 176.83 175.44 2jbp h LEU 235 N 0.02 0.00 0.00 7.52 3.38 -1.65 -3.44 115.31 121.14 2jbp h LEU 235 Ca -0.53 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.44 2jbp h LEU 235 Cb 1.97 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.72 2jbp h LEU 235 CO -0.03 0.09 0.00 0.61 0.09 0.00 0.00 178.44 179.20 2jbp n GLY 236 N 0.26 0.80 0.00 0.83 0.00 -1.20 -5.09 105.19 100.79 2jbp n GLY 236 Ca 0.01 0.60 0.00 0.00 0.00 0.00 0.00 46.02 46.63 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 0.00 0.00 -0.83 1.61 -0.04 -1.26 -4.62 135.00 129.86 2jbp n PRO 237 Ca 0.00 0.28 0.00 0.00 -0.04 0.00 0.00 63.50 63.74 2jbp n PRO 237 Cb 0.00 -1.04 0.00 0.00 -0.04 0.00 0.00 33.50 32.42 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 -0.87 -2.37 0.00 0.54 2.13 -1.26 -4.96 120.64 113.85 2jbp n GLU 238 Ca 0.00 1.75 0.00 0.00 0.66 0.00 0.00 57.16 59.57 2jbp n GLU 238 Cb 0.00 -1.95 0.00 0.00 0.27 0.00 0.00 31.44 29.76 2jbp n GLU 238 CO 0.00 0.00 0.00 1.63 -0.41 0.00 0.00 177.13 178.35 2jbp n LYS 239 N -0.68 3.50 -1.38 5.31 4.76 -1.26 -4.97 118.16 123.44 2jbp n LYS 239 Ca 0.00 0.00 -0.10 0.00 -2.87 0.00 0.00 58.31 55.34 2jbp n LYS 239 Cb 0.00 0.00 0.11 0.00 -1.84 0.00 0.00 35.03 33.30 2jbp n LYS 239 CO 0.00 0.00 0.00 0.66 -1.37 0.00 0.00 177.40 176.69 2jbp n TYR 240 N 0.00 1.51 -0.08 2.13 4.02 -1.26 -4.79 117.16 118.69 2jbp n TYR 240 Ca 0.00 -1.90 -0.07 0.00 -0.01 0.00 0.00 57.90 55.92 2jbp n TYR 240 Cb 0.00 -0.30 0.10 0.00 -0.02 0.00 0.00 39.34 39.12 2jbp n TYR 240 CO 0.00 0.00 0.00 -0.44 -1.01 0.00 0.00 176.86 175.41 2jbp h ASP 241 N 1.65 0.76 0.02 7.72 3.32 -2.01 -3.18 116.42 124.71 2jbp h ASP 241 Ca 0.20 -0.27 -0.00 0.00 0.02 0.00 0.00 57.03 56.98 2jbp h ASP 241 Cb 1.30 -0.21 0.00 0.00 0.22 0.00 0.00 39.33 40.64 2jbp h ASP 241 CO 0.42 0.96 -0.01 0.11 -1.72 0.00 0.00 179.24 179.00 2jbp h LYS 242 N 0.66 -0.02 -0.21 3.56 1.57 -1.96 -2.57 116.57 117.59 2jbp h LYS 242 Ca 0.09 0.00 0.06 0.00 -1.87 0.00 0.00 60.65 58.94 2jbp h LYS 242 Cb 0.73 0.01 -0.01 0.00 0.08 0.00 0.00 32.23 33.03 2jbp h LYS 242 CO 0.06 0.11 0.41 0.66 -0.57 0.00 0.00 179.45 180.12 2jbp h SER 243 N -0.16 0.00 -0.43 0.86 4.64 -1.90 0.93 113.55 117.49 2jbp h SER 243 Ca -0.00 0.00 0.08 0.00 -0.47 0.00 0.00 61.79 61.40 2jbp h SER 243 Cb 0.15 0.00 -0.07 0.00 -0.31 0.00 0.00 62.40 62.17 2jbp h SER 243 CO 0.00 0.00 -0.01 0.00 -0.87 0.00 0.00 176.83 175.96 2jbp h ASP 245 N 0.10 0.17 -1.05 0.00 3.32 0.78 -2.75 116.42 116.99 2jbp h ASP 245 Ca 0.21 -0.39 0.27 0.00 0.02 0.00 0.00 57.03 57.14 2jbp h ASP 245 Cb 0.31 -0.05 -0.09 0.00 0.22 0.00 0.00 39.33 39.72 2jbp h ASP 245 CO -0.36 0.52 0.68 0.24 -1.72 0.00 0.00 179.24 178.60 2jbp h MET 246 N -0.19 0.35 0.17 3.56 2.86 -1.30 0.17 114.93 120.55 2jbp h MET 246 Ca 0.02 -0.02 -0.01 0.00 -2.06 0.00 0.00 59.70 57.63 2jbp h MET 246 Cb 0.46 -0.08 0.00 0.00 0.06 0.00 0.00 31.60 32.04 2jbp h MET 246 CO 0.01 0.23 -0.08 2.35 1.06 0.00 0.00 176.91 180.48 2jbp h TRP 247 N 0.36 -0.21 -0.92 -0.22 2.91 -1.23 -2.26 115.95 114.38 2jbp h TRP 247 Ca 0.59 -0.00 0.24 0.00 1.13 0.00 0.00 58.89 60.85 2jbp h TRP 247 Cb 1.57 0.07 -0.16 0.00 -0.51 0.00 0.00 29.16 30.13 2jbp h TRP 247 CO -0.00 0.17 0.06 0.77 -1.03 0.00 0.00 178.44 178.41 2jbp h SER 248 N -0.65 -0.36 -0.26 2.65 0.02 -0.91 -0.14 113.55 113.91 2jbp h SER 248 Ca -0.02 0.25 -0.01 0.00 -0.84 0.00 0.00 61.79 61.17 2jbp h SER 248 Cb 0.47 0.41 -0.01 0.00 0.14 0.00 0.00 62.40 63.41 2jbp h SER 248 CO 0.04 -0.28 0.14 0.25 -1.14 0.00 0.00 176.83 175.84 2jbp h LEU 249 N 0.07 0.33 -1.46 5.07 5.85 -0.60 -1.38 115.31 123.19 2jbp h LEU 249 Ca 0.55 -0.09 0.09 0.00 0.84 0.00 0.00 57.88 59.27 2jbp h LEU 249 Cb 1.10 -0.08 -0.05 0.00 0.37 0.00 0.00 40.66 42.00 2jbp h LEU 249 CO -0.81 0.32 0.47 1.23 -0.34 0.00 0.00 178.44 179.31 2jbp h GLY 250 N 0.31 0.86 1.00 3.75 0.00 -0.45 -0.17 103.07 108.37 2jbp h GLY 250 Ca 0.09 -0.25 -0.17 0.00 0.00 0.00 0.00 47.33 47.00 2jbp h GLY 250 CO -0.01 0.15 -0.57 -2.08 0.00 0.00 0.00 176.54 174.03 2jbp h VAL 251 N 0.62 1.32 -0.44 4.60 2.07 -0.35 -1.15 116.25 122.92 2jbp h VAL 251 Ca 0.33 -1.82 -0.06 0.00 0.82 0.00 0.00 66.70 65.97 2jbp h VAL 251 Cb 0.46 2.01 -0.02 0.00 -1.52 0.00 0.00 31.29 32.22 2jbp h VAL 251 CO -0.11 0.56 0.06 0.40 0.02 0.00 0.00 177.57 178.50 2jbp h ILE 252 N 0.34 1.25 -0.87 4.57 2.04 -1.07 -1.23 117.51 122.54 2jbp h ILE 252 Ca -0.03 -0.92 0.03 0.00 1.00 0.00 0.00 64.86 64.95 2jbp h ILE 252 Cb 1.20 0.98 -0.05 0.00 -0.74 0.00 0.00 36.82 38.21 2jbp h ILE 252 CO 0.12 0.32 0.57 -0.03 0.00 0.00 0.00 178.15 179.13 2jbp h MET 253 N 0.60 1.05 0.27 2.37 4.05 -0.86 0.21 114.93 122.63 2jbp h MET 253 Ca 0.13 -0.06 -0.01 0.00 -0.28 0.00 0.00 59.70 59.48 2jbp h MET 253 Cb 0.40 -0.24 0.00 0.00 -0.80 0.00 0.00 31.60 30.96 2jbp h MET 253 CO 0.01 0.70 -0.13 -0.92 0.23 0.00 0.00 176.91 176.80 2jbp h TYR 254 N 1.09 -0.34 -0.90 1.39 5.03 -0.85 -2.59 116.97 119.80 2jbp h TYR 254 Ca 0.35 -0.01 -0.01 0.00 2.58 0.00 0.00 58.73 61.64 2jbp h TYR 254 Cb 0.02 0.11 -0.04 0.00 1.55 0.00 0.00 36.73 38.37 2jbp h TYR 254 CO -0.00 -0.09 0.53 0.82 -1.32 0.00 0.00 178.16 178.10 2jbp h ILE 255 N -0.54 1.25 -0.95 1.81 2.04 -0.35 -1.53 117.51 119.24 2jbp h ILE 255 Ca -0.04 -0.57 0.24 0.00 1.00 0.00 0.00 64.86 65.49 2jbp h ILE 255 Cb 0.40 -0.00 -0.07 0.00 -0.74 0.00 0.00 36.82 36.41 2jbp h ILE 255 CO 0.06 0.27 0.64 -0.07 0.00 0.00 0.00 178.15 179.05 2jbp h LEU 256 N 1.25 0.33 -0.17 1.44 3.38 -0.44 0.22 115.31 121.32 2jbp h LEU 256 Ca 0.32 0.04 0.00 0.00 0.09 0.00 0.00 57.88 58.34 2jbp h LEU 256 Cb -0.03 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 40.70 2jbp h LEU 256 CO -0.06 0.11 -0.31 0.18 0.09 0.00 0.00 178.44 178.45 2jbp n LEU 257 N -4.48 0.57 0.00 1.67 4.77 -0.58 -4.61 117.00 114.33 2jbp n LEU 257 Ca 0.21 -0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.19 2jbp n LEU 257 Cb 0.81 -0.24 0.00 0.00 -2.33 0.00 0.00 43.42 41.67 2jbp n LEU 257 CO 0.31 0.12 0.00 0.00 -1.33 0.00 0.00 177.39 176.49 2jbp n GLY 259 N 0.00 0.77 3.23 0.00 0.00 0.69 -4.54 105.19 105.35 2jbp n GLY 259 Ca 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.92 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 -2.84 0.01 0.52 1.61 1.13 -1.26 -4.24 117.35 112.29 2jbp s TYR 260 Ca 0.00 -0.32 -0.18 0.00 -1.41 0.00 0.00 57.07 55.16 2jbp s TYR 260 Cb 0.00 0.04 -0.07 0.00 -1.10 0.00 0.00 41.96 40.83 2jbp s TYR 260 CO 0.00 -0.55 1.03 -1.25 -2.51 0.00 0.00 175.55 172.27 2jbp s PRO 261 N -3.38 3.68 0.25 -3.49 0.04 -1.26 -4.02 135.00 126.82 2jbp s PRO 261 Ca 0.01 1.23 0.06 0.00 0.04 0.00 0.00 61.00 62.33 2jbp s PRO 261 Cb 0.02 -2.08 0.29 0.00 0.04 0.00 0.00 34.50 32.77 2jbp s PRO 261 CO -0.09 -0.51 1.58 -1.00 0.04 0.00 0.00 177.00 177.03 2jbp h PRO 262 N 1.10 0.20 -4.72 0.56 0.13 -1.93 -3.41 132.00 123.93 2jbp h PRO 262 Ca -0.48 -0.13 -0.69 0.00 -0.87 0.00 0.00 66.00 63.83 2jbp h PRO 262 Cb 1.21 0.02 -0.24 0.00 0.13 0.00 0.00 31.00 32.12 2jbp h PRO 262 CO 0.59 0.73 -0.56 -0.06 -0.23 0.00 0.00 178.00 178.47 2jbp s PHE 263 N -3.77 3.20 0.72 1.56 2.99 -1.26 -4.72 117.98 116.69 2jbp s PHE 263 Ca -0.04 -0.81 -0.03 0.00 0.00 0.00 0.00 56.93 56.06 2jbp s PHE 263 Cb 0.12 -2.36 0.11 0.00 0.00 0.00 0.00 43.02 40.89 2jbp s PHE 263 CO 0.79 -0.55 1.00 0.71 -0.00 0.00 0.00 175.22 177.17 2jbp s TYR 264 N 1.56 1.98 0.01 0.36 4.12 -1.26 -5.09 117.35 119.03 2jbp s TYR 264 Ca 0.03 -0.07 -0.02 0.00 0.02 0.00 0.00 57.07 57.03 2jbp s TYR 264 Cb -0.18 -3.11 -0.01 0.00 -1.52 0.00 0.00 41.96 37.14 2jbp s TYR 264 CO 0.05 -1.64 -0.05 0.43 0.02 0.00 0.00 175.55 174.37 2jbp n SER 265 N -2.87 0.69 0.00 2.29 7.64 -1.26 -4.52 113.62 115.59 2jbp n SER 265 Ca 0.13 0.10 0.00 0.00 1.01 0.00 0.00 58.87 60.11 2jbp n SER 265 Cb 0.60 -0.24 0.00 0.00 -1.01 0.00 0.00 64.21 63.57 2jbp n SER 265 CO 0.00 0.00 0.00 0.59 -3.01 0.00 0.00 175.04 172.62 2jbp n ASN 266 N -3.37 0.00 0.00 6.43 3.02 -1.26 -4.78 115.26 115.30 2jbp n ASN 266 Ca -0.05 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.50 2jbp n ASN 266 Cb 0.33 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.50 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 0.00 0.00 0.27 6.41 2.88 -1.26 -5.18 113.62 116.74 2jbp n SER 272 Ca 0.00 0.00 0.17 0.00 -1.33 0.00 0.00 58.87 57.71 2jbp n SER 272 Cb 0.00 0.00 0.66 0.00 -0.75 0.00 0.00 64.21 64.12 2jbp n SER 272 CO 0.00 0.00 0.00 -0.65 -1.23 0.00 0.00 175.04 173.16 2jbp h PRO 273 N 0.00 0.00 0.00 -1.46 0.11 -2.00 -3.13 132.00 125.53 2jbp h PRO 273 Ca 0.00 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.11 2jbp h PRO 273 Cb 0.00 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.11 2jbp h PRO 273 CO 0.00 0.00 -0.79 0.41 -0.21 0.00 0.00 178.00 177.41 2jbp n GLY 274 N 0.09 -1.25 0.15 -0.55 0.00 -1.26 -3.27 105.19 99.10 2jbp n GLY 274 Ca 0.01 -0.37 -0.22 0.00 0.00 0.00 0.00 46.02 45.44 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 0.52 -0.40 1.61 -1.53 -1.78 -0.66 114.93 112.69 2jbp h MET 275 Ca 0.00 -0.78 0.08 0.00 -3.44 0.00 0.00 59.70 55.56 2jbp h MET 275 Cb 0.65 0.28 -0.09 0.00 -0.55 0.00 0.00 31.60 31.89 2jbp h MET 275 CO 0.00 1.36 -0.27 -0.22 0.14 0.00 0.00 176.91 177.92 2jbp h LYS 276 N 0.19 -0.19 -0.01 0.39 3.64 -1.67 -1.78 116.57 117.14 2jbp h LYS 276 Ca -0.20 0.01 -0.16 0.00 -1.27 0.00 0.00 60.65 59.03 2jbp h LYS 276 Cb 2.01 0.04 -0.02 0.00 -0.41 0.00 0.00 32.23 33.85 2jbp h LYS 276 CO 0.24 -0.13 -0.75 1.79 -2.27 0.00 0.00 179.45 178.33 2jbp h THR 277 N -0.20 1.50 0.00 1.00 1.35 -1.53 -0.71 112.91 114.32 2jbp h THR 277 Ca 0.19 -2.47 -0.06 0.00 -0.55 0.00 0.00 66.41 63.52 2jbp h THR 277 Cb 0.50 2.34 -0.01 0.00 -1.73 0.00 0.00 68.15 69.25 2jbp h THR 277 CO -0.52 0.71 -0.28 0.03 -0.25 0.00 0.00 175.52 175.21 2jbp h ARG 278 N 0.05 0.00 -0.37 4.72 3.08 -1.16 0.85 114.38 121.56 2jbp h ARG 278 Ca -0.02 0.00 -0.09 0.00 0.07 0.00 0.00 59.98 59.94 2jbp h ARG 278 Cb 1.32 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 31.36 2jbp h ARG 278 CO 0.10 0.28 -0.14 0.82 -1.07 0.00 0.00 179.97 179.97 2jbp h ILE 279 N 0.00 1.28 0.09 2.04 2.04 -0.88 0.28 117.51 122.36 2jbp h ILE 279 Ca -0.00 -1.24 -0.26 0.00 1.00 0.00 0.00 64.86 64.36 2jbp h ILE 279 Cb 0.72 1.31 0.01 0.00 -0.74 0.00 0.00 36.82 38.12 2jbp h ILE 279 CO 0.04 0.41 -1.15 0.03 0.00 0.00 0.00 178.15 177.47 2jbp h ARG 280 N 0.54 0.33 -0.27 2.37 3.08 -1.14 -3.32 114.38 115.96 2jbp h ARG 280 Ca 0.09 -0.48 -0.16 0.00 0.07 0.00 0.00 59.98 59.50 2jbp h ARG 280 Cb 0.67 0.16 -0.00 0.00 0.08 0.00 0.00 29.97 30.88 2jbp h ARG 280 CO 0.05 1.19 -0.49 0.52 -1.07 0.00 0.00 179.97 180.17 2jbp h MET 281 N 0.13 0.75 -0.08 0.04 2.86 -0.87 -3.47 114.93 114.29 2jbp h MET 281 Ca -0.12 -0.44 0.00 0.00 -2.06 0.00 0.00 59.70 57.08 2jbp h MET 281 Cb 1.85 0.04 0.00 0.00 0.06 0.00 0.00 31.60 33.54 2jbp h MET 281 CO 0.19 1.06 0.00 0.41 1.06 0.00 0.00 176.91 179.64 2jbp n GLY 282 N 0.22 1.40 3.43 8.32 0.00 0.49 -4.97 105.19 114.08 2jbp n GLY 282 Ca -0.03 -0.21 -0.44 0.00 0.00 0.00 0.00 46.02 45.34 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 -1.62 3.59 0.02 1.61 -0.21 0.67 -4.99 119.66 118.73 2jbp s GLN 283 Ca 0.00 -1.83 0.00 0.00 0.02 0.00 0.00 55.36 53.55 2jbp s GLN 283 Cb 0.00 -4.84 -0.02 0.00 1.00 0.00 0.00 33.01 29.16 2jbp s GLN 283 CO 0.00 -1.71 -0.03 1.52 -2.12 0.00 0.00 175.29 172.95 2jbp s TYR 284 N 2.39 0.27 0.35 0.91 1.13 -1.26 -4.81 117.35 116.33 2jbp s TYR 284 Ca 0.30 -0.42 0.09 0.00 -1.41 0.00 0.00 57.07 55.63 2jbp s TYR 284 Cb -0.06 -0.19 -0.05 0.00 -1.10 0.00 0.00 41.96 40.56 2jbp s TYR 284 CO -0.09 -0.14 0.05 -1.21 -2.51 0.00 0.00 175.55 171.65 2jbp s GLU 285 N -1.17 2.13 -0.90 -3.49 2.02 -1.26 -5.07 118.70 110.96 2jbp s GLU 285 Ca -0.12 -1.74 -0.00 0.00 0.02 0.00 0.00 54.97 53.13 2jbp s GLU 285 Cb -0.08 -1.96 0.28 0.00 0.10 0.00 0.00 34.13 32.47 2jbp s GLU 285 CO -0.01 0.10 1.15 1.19 0.02 0.00 0.00 175.26 177.71 2jbp n PHE 286 N -1.01 2.96 -1.66 1.61 3.01 -1.26 -5.01 117.46 116.10 2jbp n PHE 286 Ca -0.04 -3.31 -0.47 0.00 1.01 0.00 0.00 57.45 54.65 2jbp n PHE 286 Cb 0.63 -0.98 -0.04 0.00 -0.01 0.00 0.00 39.48 39.07 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 1.21 2.05 -1.95 -1.08 -0.04 -1.26 -4.69 135.00 129.23 2jbp n PRO 287 Ca 0.27 0.74 -0.38 0.00 -0.04 0.00 0.00 63.50 64.09 2jbp n PRO 287 Cb 0.36 -2.50 0.02 0.00 -0.04 0.00 0.00 33.50 31.34 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 1.12 5.76 -0.03 3.54 0.01 -1.26 -2.82 114.94 121.26 2jbp s ASN 288 Ca 0.80 2.65 -0.19 0.00 -0.71 0.00 0.00 52.86 55.41 2jbp s ASN 288 Cb -0.71 -2.63 -0.12 0.00 0.41 0.00 0.00 41.25 38.20 2jbp s ASN 288 CO 0.40 -1.23 0.82 1.55 -1.51 0.00 0.00 177.10 177.13 2jbp h PRO 289 N 1.93 -0.43 0.00 -0.60 0.13 -2.03 -3.46 132.00 127.53 2jbp h PRO 289 Ca -0.50 0.03 0.00 0.00 -0.87 0.00 0.00 66.00 64.66 2jbp h PRO 289 Cb 1.27 0.10 0.00 0.00 0.13 0.00 0.00 31.00 32.50 2jbp h PRO 289 CO 0.59 -0.15 0.54 0.39 -0.23 0.00 0.00 178.00 179.15 2jbp n GLU 290 N -5.09 0.02 -0.00 0.86 4.71 -1.24 0.23 120.64 120.13 2jbp n GLU 290 Ca -0.08 0.27 0.10 0.00 -0.01 0.00 0.00 57.16 57.45 2jbp n GLU 290 Cb 0.25 -2.09 -0.14 0.00 -1.01 0.00 0.00 31.44 28.46 2jbp n GLU 290 CO 0.00 0.00 0.00 0.91 0.09 0.00 0.00 177.13 178.13 2jbp n TRP 291 N -1.43 0.00 -0.06 -0.32 7.02 -1.13 -4.65 117.44 116.87 2jbp n TRP 291 Ca -0.00 0.00 -0.04 0.00 -1.02 0.00 0.00 57.50 56.44 2jbp n TRP 291 Cb 0.54 -0.19 0.19 0.00 -2.42 0.00 0.00 31.31 29.43 2jbp n TRP 291 CO 0.00 0.00 0.00 0.66 -2.02 0.00 0.00 177.69 176.33 2jbp h SER 292 N 0.00 0.66 0.00 -0.99 4.64 0.27 -2.25 113.55 115.88 2jbp h SER 292 Ca 0.00 -0.17 0.00 0.00 -0.47 0.00 0.00 61.79 61.15 2jbp h SER 292 Cb 0.67 -0.18 0.00 0.00 -0.31 0.00 0.00 62.40 62.59 2jbp h SER 292 CO 0.00 0.78 0.00 -0.62 -0.87 0.00 0.00 176.83 176.12 2jbp n GLU 293 N -4.20 0.78 -3.98 4.77 -0.58 -1.26 -4.76 120.64 111.42 2jbp n GLU 293 Ca 0.01 0.00 -0.35 0.00 -0.42 0.00 0.00 57.16 56.40 2jbp n GLU 293 Cb 0.33 -1.26 -0.12 0.00 -0.57 0.00 0.00 31.44 29.82 2jbp n GLU 293 CO 0.00 0.00 0.00 0.08 -0.48 0.00 0.00 177.13 176.73 2jbp s VAL 294 N -2.00 4.36 0.58 2.62 1.01 -0.85 -5.03 120.40 121.09 2jbp s VAL 294 Ca 0.19 -0.17 -0.18 0.00 0.00 0.00 0.00 61.98 61.82 2jbp s VAL 294 Cb 0.09 -2.99 -0.15 0.00 0.00 0.00 0.00 36.38 33.33 2jbp s VAL 294 CO 0.15 0.41 -0.19 -1.54 0.00 0.00 0.00 175.10 173.93 2jbp n SER 295 N 4.20 -3.87 0.23 3.32 3.41 -1.26 -4.83 113.62 114.81 2jbp n SER 295 Ca -0.17 0.59 0.11 0.00 -0.26 0.00 0.00 58.87 59.15 2jbp n SER 295 Cb 0.52 -0.85 0.43 0.00 -0.26 0.00 0.00 64.21 64.04 2jbp n SER 295 CO 0.00 0.00 0.00 -0.08 -0.16 0.00 0.00 175.04 174.80 2jbp h GLU 296 N -0.14 0.00 -0.57 4.33 4.57 -1.97 -2.69 114.58 118.10 2jbp h GLU 296 Ca -0.42 0.00 0.11 0.00 -1.18 0.00 0.00 59.36 57.88 2jbp h GLU 296 Cb 1.43 0.00 -0.11 0.00 -0.16 0.00 0.00 28.75 29.90 2jbp h GLU 296 CO 0.39 0.17 -0.20 1.49 -1.18 0.00 0.00 179.01 179.69 2jbp h GLU 297 N 0.00 -0.05 0.00 1.92 4.81 -1.99 -1.03 114.58 118.24 2jbp h GLU 297 Ca -0.00 0.00 -0.00 0.00 -0.13 0.00 0.00 59.36 59.23 2jbp h GLU 297 Cb 0.79 0.01 0.00 0.00 0.63 0.00 0.00 28.75 30.19 2jbp h GLU 297 CO 0.02 -0.04 -0.00 0.28 -0.73 0.00 0.00 179.01 178.54 2jbp h VAL 298 N -0.06 1.69 -0.77 0.32 2.07 -1.83 -2.39 116.25 115.28 2jbp h VAL 298 Ca 0.27 -2.17 0.17 0.00 0.82 0.00 0.00 66.70 65.78 2jbp h VAL 298 Cb 0.47 3.15 -0.14 0.00 -1.52 0.00 0.00 31.29 33.24 2jbp h VAL 298 CO -0.61 0.56 -0.12 0.11 0.02 0.00 0.00 177.57 177.52 2jbp h LYS 299 N -0.95 0.03 -0.65 1.57 1.57 -1.55 -0.45 116.57 116.14 2jbp h LYS 299 Ca -0.00 -0.00 0.05 0.00 -1.87 0.00 0.00 60.65 58.83 2jbp h LYS 299 Cb 0.91 -0.01 -0.05 0.00 0.08 0.00 0.00 32.23 33.16 2jbp h LYS 299 CO 0.00 0.02 0.36 1.98 -0.57 0.00 0.00 179.45 181.24 2jbp h MET 300 N 0.03 0.66 0.51 3.15 4.05 -1.09 0.40 114.93 122.63 2jbp h MET 300 Ca 0.39 -0.04 -0.02 0.00 -0.28 0.00 0.00 59.70 59.75 2jbp h MET 300 Cb 0.65 -0.15 0.00 0.00 -0.80 0.00 0.00 31.60 31.30 2jbp h MET 300 CO -0.76 0.44 -0.24 1.25 0.23 0.00 0.00 176.91 177.83 2jbp h LEU 301 N 0.68 -0.58 -1.46 3.39 5.85 -0.61 -1.20 115.31 121.38 2jbp h LEU 301 Ca 0.29 0.01 0.35 0.00 0.84 0.00 0.00 57.88 59.37 2jbp h LEU 301 Cb 0.16 0.15 -0.10 0.00 0.37 0.00 0.00 40.66 41.24 2jbp h LEU 301 CO -0.17 -0.40 0.78 0.40 -0.34 0.00 0.00 178.44 178.71 2jbp h ILE 302 N -0.70 0.33 -0.05 4.05 1.08 -0.73 -0.88 117.51 120.62 2jbp h ILE 302 Ca -0.07 -0.07 -0.17 0.00 -0.39 0.00 0.00 64.86 64.16 2jbp h ILE 302 Cb 0.53 0.10 -0.01 0.00 -3.07 0.00 0.00 36.82 34.37 2jbp h ILE 302 CO 0.11 0.04 -0.71 0.03 -0.69 0.00 0.00 178.15 176.93 2jbp h ARG 303 N 0.22 0.26 0.00 2.37 3.08 0.29 -1.67 114.38 118.92 2jbp h ARG 303 Ca 0.69 -0.21 0.00 0.00 0.07 0.00 0.00 59.98 60.53 2jbp h ARG 303 Cb 2.08 0.04 0.00 0.00 0.08 0.00 0.00 29.97 32.17 2jbp h ARG 303 CO -0.31 0.86 -0.07 0.09 -1.07 0.00 0.00 179.97 179.47 2jbp n ASN 304 N -3.80 0.61 0.06 7.04 4.13 -0.37 -2.80 115.26 120.13 2jbp n ASN 304 Ca -0.03 0.49 -0.22 0.00 1.68 0.00 0.00 54.58 56.50 2jbp n ASN 304 Cb 0.69 -0.61 -0.15 0.00 -1.54 0.00 0.00 39.78 38.17 2jbp n ASN 304 CO 0.00 0.00 0.00 -0.07 0.28 0.00 0.00 177.26 177.47 2jbp h LEU 305 N 0.00 0.56 -2.21 3.41 3.38 -1.10 -2.22 115.31 117.14 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 0.68 -0.18 0.00 0.00 0.09 0.00 0.00 40.66 41.24 2jbp h LEU 305 CO 0.00 1.78 0.00 0.18 0.09 0.00 0.00 178.44 180.49 2jbp n LEU 306 N -3.55 3.24 -4.74 1.67 4.77 -0.67 -4.22 117.00 113.50 2jbp n LEU 306 Ca -0.26 -1.64 -0.42 0.00 -0.03 0.00 0.00 56.01 53.66 2jbp n LEU 306 Cb 1.07 -0.58 -0.01 0.00 -2.33 0.00 0.00 43.42 41.56 2jbp n LEU 306 CO 0.49 0.43 1.11 0.29 -1.33 0.00 0.00 177.39 178.38 2jbp n LYS 307 N 0.30 2.50 0.11 3.23 4.76 -1.12 -4.90 118.16 123.04 2jbp n LYS 307 Ca 0.13 0.88 -0.03 0.00 -2.87 0.00 0.00 58.31 56.42 2jbp n LYS 307 Cb 0.70 -2.59 0.07 0.00 -1.84 0.00 0.00 35.03 31.37 2jbp n LYS 307 CO 0.00 0.00 0.00 1.79 -1.37 0.00 0.00 177.40 177.82 2jbp h THR 308 N 3.01 1.50 -3.44 -0.18 1.35 -1.90 -3.42 112.91 109.82 2jbp h THR 308 Ca -0.48 -2.55 -0.61 0.00 -0.55 0.00 0.00 66.41 62.22 2jbp h THR 308 Cb 1.25 2.39 -0.12 0.00 -1.73 0.00 0.00 68.15 69.94 2jbp h THR 308 CO 0.70 0.72 0.55 -0.70 -0.25 0.00 0.00 175.52 176.54 2jbp s GLU 309 N -3.28 3.42 0.41 4.72 2.56 -1.26 -4.93 118.70 120.34 2jbp s GLU 309 Ca -0.00 -0.07 0.19 0.00 0.00 0.00 0.00 54.97 55.09 2jbp s GLU 309 Cb 0.12 -3.99 1.11 0.00 2.00 0.00 0.00 34.13 33.37 2jbp s GLU 309 CO 0.78 -1.33 1.80 -1.35 -0.56 0.00 0.00 175.26 174.59 2jbp h PRO 310 N 9.18 0.38 0.00 4.30 0.11 -1.97 1.08 132.00 145.07 2jbp h PRO 310 Ca -0.25 -0.02 -0.09 0.00 0.11 0.00 0.00 66.00 65.75 2jbp h PRO 310 Cb 1.08 -0.08 -0.01 0.00 0.11 0.00 0.00 31.00 32.09 2jbp h PRO 310 CO 1.05 0.25 -0.43 1.79 -0.21 0.00 0.00 178.00 180.45 2jbp h THR 311 N 0.39 0.76 0.00 -1.15 1.35 -1.95 -2.58 112.91 109.73 2jbp h THR 311 Ca 0.55 -1.98 0.00 0.00 -0.55 0.00 0.00 66.41 64.43 2jbp h THR 311 Cb 1.43 2.31 0.00 0.00 -1.73 0.00 0.00 68.15 70.15 2jbp h THR 311 CO -0.25 0.42 0.00 1.56 -0.25 0.00 0.00 175.52 177.00 2jbp h GLN 312 N 0.00 0.00 -6.96 4.72 4.20 0.81 -3.46 115.11 114.43 2jbp h GLN 312 Ca -0.00 0.00 -0.50 0.00 0.06 0.00 0.00 58.65 58.21 2jbp h GLN 312 Cb 1.27 0.00 0.04 0.00 0.30 0.00 0.00 27.48 29.09 2jbp h GLN 312 CO 0.06 0.00 0.47 0.50 -0.67 0.00 0.00 178.83 179.18 2jbp s ARG 313 N -3.53 4.02 0.57 1.46 3.52 -0.97 -4.99 118.95 119.02 2jbp s ARG 313 Ca 0.03 1.71 -0.19 0.00 -0.13 0.00 0.00 55.73 57.14 2jbp s ARG 313 Cb 0.08 -2.56 -0.06 0.00 -1.56 0.00 0.00 34.95 30.85 2jbp s ARG 313 CO 0.56 -0.31 0.96 -0.12 -0.81 0.00 0.00 175.30 175.57 2jbp n MET 314 N -0.11 0.98 -3.99 5.12 0.00 -0.83 -5.02 117.12 113.26 2jbp n MET 314 Ca 0.05 0.37 -0.25 0.00 -0.00 0.00 0.00 57.70 57.88 2jbp n MET 314 Cb 0.48 -2.13 -0.03 0.00 0.00 0.00 0.00 33.22 31.53 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 -1.48 5.06 0.60 1.12 -4.23 -1.26 -4.87 115.64 110.57 2jbp s THR 315 Ca 0.73 -0.88 0.29 0.00 -1.18 0.00 0.00 61.69 60.64 2jbp s THR 315 Cb -0.44 -3.64 0.37 0.00 1.34 0.00 0.00 72.50 70.14 2jbp s THR 315 CO 0.49 -0.16 1.84 -0.29 -0.54 0.00 0.00 174.62 175.96 2jbp h ILE 316 N 1.63 0.30 0.25 2.99 6.09 -1.96 0.34 117.51 127.16 2jbp h ILE 316 Ca -0.49 0.00 -0.34 0.00 -1.37 0.00 0.00 64.86 62.66 2jbp h ILE 316 Cb 1.21 0.56 0.04 0.00 0.47 0.00 0.00 36.82 39.09 2jbp h ILE 316 CO 0.65 0.00 -1.47 0.74 -3.07 0.00 0.00 178.15 175.00 2jbp h THR 317 N 0.00 1.29 -0.90 2.19 2.02 -1.98 -2.49 112.91 113.03 2jbp h THR 317 Ca 0.22 -2.72 -0.01 0.00 0.77 0.00 0.00 66.41 64.68 2jbp h THR 317 Cb 1.31 3.04 -0.04 0.00 -1.74 0.00 0.00 68.15 70.71 2jbp h THR 317 CO -0.00 0.81 0.54 -0.33 0.37 0.00 0.00 175.52 176.91 2jbp h GLU 318 N 0.15 1.23 -0.66 6.66 5.08 -1.36 -2.34 114.58 123.34 2jbp h GLU 318 Ca -0.25 -0.12 -0.08 0.00 -1.00 0.00 0.00 59.36 57.92 2jbp h GLU 318 Cb 2.17 -0.26 -0.03 0.00 0.50 0.00 0.00 28.75 31.13 2jbp h GLU 318 CO 0.28 0.86 0.11 0.35 -1.00 0.00 0.00 179.01 179.61 2jbp h PHE 319 N 1.25 1.15 0.00 4.33 3.04 -1.33 -0.09 116.94 125.29 2jbp h PHE 319 Ca 0.32 -0.16 0.00 0.00 3.98 0.00 0.00 57.97 62.12 2jbp h PHE 319 Cb -0.04 -0.32 0.00 0.00 2.56 0.00 0.00 35.95 38.15 2jbp h PHE 319 CO 0.01 0.97 0.00 -1.33 -2.02 0.00 0.00 178.31 175.93 2jbp n MET 320 N -4.24 0.11 -0.00 1.11 2.81 -0.94 -2.91 117.12 113.06 2jbp n MET 320 Ca 0.04 0.09 0.07 0.00 -1.81 0.00 0.00 57.70 56.09 2jbp n MET 320 Cb 0.29 -1.50 -0.10 0.00 -0.71 0.00 0.00 33.22 31.19 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 -1.43 1.27 -4.63 7.83 3.02 -0.86 -4.38 115.26 116.08 2jbp n ASN 321 Ca 0.08 -0.32 -0.43 0.00 -0.03 0.00 0.00 54.58 53.88 2jbp n ASN 321 Cb 0.25 1.42 -0.00 0.00 -0.61 0.00 0.00 39.78 40.83 2jbp n ASN 321 CO 0.00 0.00 0.00 1.57 -2.62 0.00 0.00 177.26 176.21 2jbp n HIS 322 N -1.75 1.60 -0.22 3.10 -0.00 -0.10 -4.68 115.22 113.16 2jbp n HIS 322 Ca -0.01 0.61 -0.08 0.00 0.46 0.00 0.00 57.72 58.70 2jbp n HIS 322 Cb 0.32 -2.30 0.03 0.00 -0.12 0.00 0.00 29.99 27.92 2jbp n HIS 322 CO 0.00 0.00 0.00 -1.35 0.46 0.00 0.00 176.34 175.45 2jbp h PRO 323 N 2.05 1.01 -0.75 1.57 0.11 -1.91 0.89 132.00 134.96 2jbp h PRO 323 Ca -0.43 -0.25 0.22 0.00 0.11 0.00 0.00 66.00 65.64 2jbp h PRO 323 Cb 1.32 -0.13 -0.03 0.00 0.11 0.00 0.00 31.00 32.27 2jbp h PRO 323 CO 0.60 0.93 0.63 2.35 -0.21 0.00 0.00 178.00 182.29 2jbp h TRP 324 N 0.92 0.00 0.02 0.65 7.01 -1.89 0.68 115.95 123.33 2jbp h TRP 324 Ca 0.19 0.00 -0.38 0.00 2.11 0.00 0.00 58.89 60.82 2jbp h TRP 324 Cb 0.39 0.00 -0.06 0.00 -2.10 0.00 0.00 29.16 27.39 2jbp h TRP 324 CO 0.03 0.00 -2.33 -0.89 -2.79 0.00 0.00 178.44 172.46 2jbp n ILE 325 N -4.00 1.53 -0.00 2.65 2.08 -0.81 -4.14 119.36 116.67 2jbp n ILE 325 Ca 0.15 -0.66 -0.13 0.00 0.56 0.00 0.00 62.75 62.68 2jbp n ILE 325 Cb 0.90 -1.27 -0.10 0.00 -0.75 0.00 0.00 39.64 38.42 2jbp n ILE 325 CO 0.00 0.00 0.00 0.24 0.56 0.00 0.00 176.55 177.35 2jbp h MET 326 N 0.01 -0.05 -2.48 0.38 2.86 0.29 -2.98 114.93 112.97 2jbp h MET 326 Ca -0.53 0.00 -0.78 0.00 -2.06 0.00 0.00 59.70 56.33 2jbp h MET 326 Cb 2.00 0.01 -0.21 0.00 0.06 0.00 0.00 31.60 33.46 2jbp h MET 326 CO -0.02 0.49 1.56 1.04 1.06 0.00 0.00 176.91 181.03 2jbp n GLN 327 N -4.85 5.01 -0.07 1.72 6.02 0.12 -4.77 117.38 120.55 2jbp n GLN 327 Ca -0.09 -4.18 0.22 0.00 -0.01 0.00 0.00 57.00 52.94 2jbp n GLN 327 Cb 0.28 -2.55 0.68 0.00 1.02 0.00 0.00 30.24 29.67 2jbp n GLN 327 CO 0.00 0.00 0.00 0.66 -1.01 0.00 0.00 177.06 176.71 2jbp h SER 328 N 4.50 0.05 -0.46 1.08 4.64 -1.68 -1.68 113.55 119.99 2jbp h SER 328 Ca 0.57 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.89 2jbp h SER 328 Cb 0.35 -0.01 0.00 0.00 -0.31 0.00 0.00 62.40 62.43 2jbp h SER 328 CO 1.32 0.02 0.00 0.35 -0.87 0.00 0.00 176.83 177.65 2jbp n THR 329 N -4.36 2.54 -0.58 2.95 -2.24 -1.26 -2.37 114.28 108.96 2jbp n THR 329 Ca 0.13 -1.57 0.07 0.00 -2.27 0.00 0.00 64.05 60.41 2jbp n THR 329 Cb 0.71 -0.24 0.21 0.00 -2.10 0.00 0.00 70.33 68.90 2jbp n THR 329 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 2jbp n LYS 330 N 0.23 2.91 -2.83 -0.78 5.02 -0.64 -5.00 118.16 117.07 2jbp n LYS 330 Ca 0.25 -2.44 -0.41 0.00 -2.02 0.00 0.00 58.31 53.69 2jbp n LYS 330 Cb 1.07 -1.56 -0.04 0.00 -0.02 0.00 0.00 35.03 34.48 2jbp n LYS 330 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 2jbp s VAL 331 N -1.92 4.70 0.35 -0.18 1.01 -1.00 -4.99 120.40 118.37 2jbp s VAL 331 Ca 0.32 1.88 -0.27 0.00 0.00 0.00 0.00 61.98 63.92 2jbp s VAL 331 Cb 0.23 -4.24 -0.12 0.00 0.00 0.00 0.00 36.38 32.25 2jbp s VAL 331 CO 0.12 0.29 1.12 -2.65 0.00 0.00 0.00 175.10 173.98 2jbp n PRO 332 N 3.12 1.65 0.00 2.72 -0.02 -1.26 -4.65 135.00 136.57 2jbp n PRO 332 Ca 0.01 0.58 0.00 0.00 -2.02 0.00 0.00 63.50 62.08 2jbp n PRO 332 Cb 0.50 -2.10 0.00 0.00 -0.02 0.00 0.00 33.50 31.88 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 0.45 0.79 -1.65 -0.52 1.13 -1.26 -2.91 117.38 113.41 2jbp n GLN 333 Ca 0.08 0.00 -0.38 0.00 -1.94 0.00 0.00 57.00 54.75 2jbp n GLN 333 Cb 0.36 -1.34 0.04 0.00 0.11 0.00 0.00 30.24 29.41 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 0.20 3.57 -3.42 5.09 5.66 -1.26 -4.51 114.28 119.61 2jbp n THR 334 Ca 0.00 -0.50 -0.31 0.00 -3.05 0.00 0.00 64.05 60.19 2jbp n THR 334 Cb 0.23 -1.29 -0.05 0.00 -1.55 0.00 0.00 70.33 67.67 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 -2.69 3.75 0.34 1.09 0.02 -1.26 0.23 135.00 136.48 2jbp s PRO 335 Ca 0.73 0.19 0.08 0.00 0.02 0.00 0.00 61.00 62.02 2jbp s PRO 335 Cb -0.44 -2.66 -0.07 0.00 0.02 0.00 0.00 34.50 31.35 2jbp s PRO 335 CO 0.49 0.31 -0.06 -0.51 -0.33 0.00 0.00 177.00 176.90 2jbp s LEU 336 N -2.95 2.68 0.00 -5.54 2.01 0.17 -4.80 118.68 110.25 2jbp s LEU 336 Ca 0.46 -1.24 0.17 0.00 0.01 0.00 0.00 54.13 53.53 2jbp s LEU 336 Cb -0.11 -0.88 1.02 0.00 0.01 0.00 0.00 46.19 46.23 2jbp s LEU 336 CO 0.23 -0.30 1.61 1.41 1.01 0.00 0.00 176.35 180.32 2jbp n HIS 337 N -0.78 0.00 -0.12 0.29 8.25 -1.26 -4.39 115.22 117.20 2jbp n HIS 337 Ca -0.05 0.00 -0.04 0.00 -0.26 0.00 0.00 57.72 57.37 2jbp n HIS 337 Cb 0.64 0.00 0.03 0.00 1.12 0.00 0.00 29.99 31.79 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 0.77 -0.58 1.59 2.02 -1.81 0.81 112.91 115.71 2jbp h THR 338 Ca 0.00 -0.07 -0.09 0.00 0.77 0.00 0.00 66.41 67.03 2jbp h THR 338 Cb 0.00 0.56 -0.02 0.00 -1.74 0.00 0.00 68.15 66.95 2jbp h THR 338 CO 0.00 0.03 0.02 -1.28 0.37 0.00 0.00 175.52 174.66 2jbp h SER 339 N 0.19 0.96 0.56 4.18 0.87 -1.84 0.29 113.55 118.76 2jbp h SER 339 Ca 0.20 -0.25 -0.03 0.00 -1.23 0.00 0.00 61.79 60.48 2jbp h SER 339 Cb 0.25 -0.26 0.01 0.00 -0.44 0.00 0.00 62.40 61.96 2jbp h SER 339 CO -0.27 1.00 -0.27 -0.09 -0.53 0.00 0.00 176.83 176.67 2jbp h ARG 340 N 0.91 -0.72 -1.00 2.24 2.43 -1.68 -1.10 114.38 115.45 2jbp h ARG 340 Ca 0.17 0.05 0.11 0.00 -0.81 0.00 0.00 59.98 59.49 2jbp h ARG 340 Cb 0.51 0.16 -0.08 0.00 -0.42 0.00 0.00 29.97 30.14 2jbp h ARG 340 CO 0.02 -0.48 0.64 0.28 -1.51 0.00 0.00 179.97 178.92 2jbp h VAL 341 N -1.02 0.97 0.38 0.20 2.07 -0.65 0.94 116.25 119.14 2jbp h VAL 341 Ca -0.08 -0.36 -0.01 0.00 0.82 0.00 0.00 66.70 67.07 2jbp h VAL 341 Cb 0.57 -0.17 -0.01 0.00 -1.52 0.00 0.00 31.29 30.17 2jbp h VAL 341 CO 0.13 0.19 -0.24 -0.07 0.02 0.00 0.00 177.57 177.60 2jbp h LEU 342 N 1.04 -0.60 -1.00 2.57 4.07 -0.42 -2.30 115.31 118.68 2jbp h LEU 342 Ca 0.48 0.04 0.20 0.00 0.08 0.00 0.00 57.88 58.68 2jbp h LEU 342 Cb 0.40 0.18 -0.11 0.00 1.08 0.00 0.00 40.66 42.21 2jbp h LEU 342 CO -0.24 -0.38 0.61 0.11 -1.08 0.00 0.00 178.44 177.46 2jbp h LYS 343 N -0.60 0.69 -2.26 1.13 1.57 0.27 -2.36 116.57 115.01 2jbp h LYS 343 Ca -0.04 -0.04 -0.77 0.00 -1.87 0.00 0.00 60.65 57.93 2jbp h LYS 343 Cb 0.49 -0.16 -0.23 0.00 0.08 0.00 0.00 32.23 32.41 2jbp h LYS 343 CO 0.04 0.46 1.28 0.39 -0.57 0.00 0.00 179.45 181.05 2jbp n GLU 344 N -4.80 4.56 0.00 3.15 1.02 0.15 -2.60 120.64 122.12 2jbp n GLU 344 Ca 0.24 -4.03 0.00 0.00 -0.02 0.00 0.00 57.16 53.35 2jbp n GLU 344 Cb 0.62 -2.44 0.00 0.00 -0.02 0.00 0.00 31.44 29.60 2jbp n GLU 344 CO 0.00 0.00 0.00 -0.25 1.18 0.00 0.00 177.13 178.06 2jbp n ASP 345 N 0.29 0.00 0.25 1.62 9.92 -0.92 -4.86 116.55 122.85 2jbp n ASP 345 Ca 0.52 0.00 0.00 0.00 -0.53 0.00 0.00 54.79 54.78 2jbp n ASP 345 Cb 0.27 0.00 0.00 0.00 -0.64 0.00 0.00 41.12 40.75 2jbp n ASP 345 CO 0.00 0.00 0.00 1.17 0.13 0.00 0.00 177.20 178.50 2jbp n LYS 346 N 0.00 0.02 -0.07 -1.24 4.81 -1.03 0.34 118.16 120.99 2jbp n LYS 346 Ca 0.00 0.71 -0.07 0.00 -0.87 0.00 0.00 58.31 58.08 2jbp n LYS 346 Cb 0.00 -2.12 -0.03 0.00 0.02 0.00 0.00 35.03 32.89 2jbp n LYS 346 CO 0.00 0.00 0.00 1.05 1.17 0.00 0.00 177.40 179.62 2jbp h GLU 347 N 0.00 0.00 0.00 1.64 4.11 -1.89 -3.35 114.58 115.09 2jbp h GLU 347 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.43 2jbp h GLU 347 Cb 1.59 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.84 2jbp h GLU 347 CO 0.00 0.22 0.24 0.07 0.07 0.00 0.00 179.01 179.61 2jbp h ARG 348 N -1.00 0.00 -4.96 1.06 -0.00 0.53 -3.35 114.38 106.66 2jbp h ARG 348 Ca -0.06 0.00 -0.48 0.00 -0.00 0.00 0.00 59.98 59.44 2jbp h ARG 348 Cb 0.56 0.00 0.02 0.00 -0.00 0.00 0.00 29.97 30.55 2jbp h ARG 348 CO -0.04 0.00 1.59 1.87 -0.00 0.00 0.00 179.97 183.39 2jbp n TRP 349 N -2.75 1.99 -0.51 4.08 -0.00 -0.36 -5.13 117.44 114.76 2jbp n TRP 349 Ca -0.02 -1.46 0.00 0.00 -0.00 0.00 0.00 57.50 56.03 2jbp n TRP 349 Cb 0.28 -2.04 0.00 0.00 -0.00 0.00 0.00 31.31 29.55 2jbp n TRP 349 CO 0.00 0.00 0.00 0.39 -0.00 0.00 0.00 177.69 178.08