#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jbp s HIS 47 N 0.00 3.49 0.46 -5.13 3.76 -1.26 -5.08 115.29 111.53 2jbp s HIS 47 Ca 0.00 -2.66 0.02 0.00 -0.15 0.00 0.00 55.06 52.28 2jbp s HIS 47 Cb 0.00 -2.42 0.01 0.00 1.11 0.00 0.00 32.58 31.28 2jbp s HIS 47 CO 0.00 -0.91 0.66 0.14 -0.85 0.00 0.00 174.74 173.78 2jbp s VAL 48 N 1.01 3.49 0.33 -0.90 -7.23 -1.26 -5.13 120.40 110.71 2jbp s VAL 48 Ca 0.01 -0.68 0.06 0.00 -1.81 0.00 0.00 61.98 59.57 2jbp s VAL 48 Cb -0.19 -3.27 -0.03 0.00 0.56 0.00 0.00 36.38 33.45 2jbp s VAL 48 CO -0.07 -0.17 0.24 -0.54 -0.31 0.00 0.00 175.10 174.26 2jbp s LYS 49 N -4.54 1.74 0.41 4.82 -0.14 -1.26 -5.13 119.74 115.63 2jbp s LYS 49 Ca 0.51 -2.01 -0.25 0.00 -1.36 0.00 0.00 55.97 52.86 2jbp s LYS 49 Cb -0.10 0.18 -0.08 0.00 -1.68 0.00 0.00 37.83 36.15 2jbp s LYS 49 CO 0.36 -0.60 1.23 0.45 -0.76 0.00 0.00 175.35 176.03 2jbp s SER 50 N -3.39 6.38 0.79 2.83 0.15 -1.26 -5.04 113.70 114.15 2jbp s SER 50 Ca 0.38 2.49 -0.09 0.00 0.70 0.00 0.00 55.95 59.43 2jbp s SER 50 Cb 0.03 -2.62 0.10 0.00 -1.71 0.00 0.00 66.02 61.82 2jbp s SER 50 CO 0.24 -0.79 1.12 -0.83 1.20 0.00 0.00 173.24 174.18 2jbp s GLY 51 N -0.97 1.70 -0.26 9.45 0.00 -1.26 -5.03 107.32 110.95 2jbp s GLY 51 Ca 0.58 -1.02 -0.27 0.00 0.00 0.00 0.00 44.72 44.00 2jbp s GLY 51 CO 0.43 -0.50 0.97 -2.27 0.00 0.00 0.00 173.10 171.73 2jbp s LEU 52 N -5.45 4.06 -0.65 0.66 2.96 -1.26 -5.00 118.68 114.00 2jbp s LEU 52 Ca 0.64 1.15 -0.12 0.00 -0.22 0.00 0.00 54.13 55.58 2jbp s LEU 52 Cb -0.09 -3.41 0.17 0.00 0.50 0.00 0.00 46.19 43.36 2jbp s LEU 52 CO 0.47 -0.67 0.57 -1.58 -1.32 0.00 0.00 176.35 173.82 2jbp s GLN 53 N 3.18 3.08 0.07 1.98 2.00 -1.26 -5.05 119.66 123.67 2jbp s GLN 53 Ca 0.41 -2.12 -0.31 0.00 -2.00 0.00 0.00 55.36 51.34 2jbp s GLN 53 Cb -0.14 -4.20 -0.09 0.00 0.80 0.00 0.00 33.01 29.37 2jbp s GLN 53 CO 0.09 -1.27 1.76 0.42 -0.50 0.00 0.00 175.29 175.79 2jbp s ILE 54 N 0.78 2.89 0.34 -2.34 -1.09 -1.26 -4.66 121.20 115.85 2jbp s ILE 54 Ca 0.11 0.28 -0.26 0.00 -2.23 0.00 0.00 60.65 58.55 2jbp s ILE 54 Cb -0.20 -3.18 -0.10 0.00 -1.58 0.00 0.00 42.46 37.40 2jbp s ILE 54 CO -0.03 -0.01 0.99 -0.54 -1.23 0.00 0.00 174.94 174.12 2jbp s LYS 55 N 3.04 4.47 -0.01 2.79 1.02 0.42 -4.85 119.74 126.61 2jbp s LYS 55 Ca 0.78 1.43 0.13 0.00 0.02 0.00 0.00 55.97 58.33 2jbp s LYS 55 Cb -0.42 -2.77 -0.19 0.00 -0.52 0.00 0.00 37.83 33.94 2jbp s LYS 55 CO 0.35 0.16 0.31 1.63 -0.92 0.00 0.00 175.35 176.87 2jbp n LYS 56 N 0.45 0.72 -1.39 1.68 4.76 -1.26 -0.12 118.16 122.99 2jbp n LYS 56 Ca 0.02 -0.10 -0.34 0.00 -2.87 0.00 0.00 58.31 55.02 2jbp n LYS 56 Cb 0.49 -1.27 0.10 0.00 -1.84 0.00 0.00 35.03 32.51 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 -3.27 4.10 0.26 4.39 4.22 -1.26 -4.71 114.94 118.67 2jbp s ASN 57 Ca -0.03 2.38 -0.28 0.00 -2.14 0.00 0.00 52.86 52.78 2jbp s ASN 57 Cb 0.08 -2.59 -0.15 0.00 1.28 0.00 0.00 41.25 39.87 2jbp s ASN 57 CO 0.52 -2.33 0.92 0.00 -2.04 0.00 0.00 177.10 174.16 2jbp n ALA 58 N -2.78 -0.83 0.27 3.54 0.00 -1.26 -4.82 120.51 114.64 2jbp n ALA 58 Ca 0.14 0.41 0.14 0.00 0.00 0.00 0.00 53.44 54.12 2jbp n ALA 58 Cb 0.50 -1.93 0.40 0.00 0.00 0.00 0.00 19.45 18.42 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 1.82 0.00 0.00 0.00 2.10 -1.95 -3.10 117.51 116.38 2jbp h ILE 59 Ca -0.37 -0.74 -0.01 0.00 1.08 0.00 0.00 64.86 64.82 2jbp h ILE 59 Cb 1.36 1.73 -0.00 0.00 -1.09 0.00 0.00 36.82 38.82 2jbp h ILE 59 CO 0.60 0.00 -0.04 0.16 -1.08 0.00 0.00 178.15 177.79 2jbp h ILE 60 N 0.00 0.09 -0.31 2.19 3.07 -1.88 -1.52 117.51 119.16 2jbp h ILE 60 Ca 0.00 -0.84 0.09 0.00 1.55 0.00 0.00 64.86 65.66 2jbp h ILE 60 Cb 0.76 1.77 -0.01 0.00 -0.27 0.00 0.00 36.82 39.07 2jbp h ILE 60 CO 0.00 0.04 0.60 0.44 -1.05 0.00 0.00 178.15 178.18 2jbp h ASP 61 N 0.00 0.00 0.00 2.16 3.45 -1.91 -3.28 116.42 116.84 2jbp h ASP 61 Ca -0.00 0.00 -0.01 0.00 0.43 0.00 0.00 57.03 57.45 2jbp h ASP 61 Cb 0.77 0.00 -0.00 0.00 -0.56 0.00 0.00 39.33 39.53 2jbp h ASP 61 CO 0.01 0.00 -1.05 0.47 -1.57 0.00 0.00 179.24 177.10 2jbp n ASP 62 N -3.19 4.82 -4.10 6.45 9.92 -0.60 -4.95 116.55 124.90 2jbp n ASP 62 Ca 0.06 0.00 -0.15 0.00 -0.53 0.00 0.00 54.79 54.17 2jbp n ASP 62 Cb 0.72 0.54 -0.12 0.00 -0.64 0.00 0.00 41.12 41.63 2jbp n ASP 62 CO 0.00 0.00 0.00 -0.31 0.13 0.00 0.00 177.20 177.02 2jbp s TYR 63 N -2.02 0.85 -0.40 1.24 2.02 -1.04 -0.58 117.35 117.42 2jbp s TYR 63 Ca -0.00 -0.47 -0.28 0.00 -0.37 0.00 0.00 57.07 55.95 2jbp s TYR 63 Cb 0.00 -0.50 0.02 0.00 -0.40 0.00 0.00 41.96 41.09 2jbp s TYR 63 CO 0.03 -0.03 1.06 0.21 -1.57 0.00 0.00 175.55 175.24 2jbp s LYS 64 N -1.57 3.85 -0.28 -0.62 2.47 0.31 -4.48 119.74 119.42 2jbp s LYS 64 Ca -0.07 0.71 -0.18 0.00 -1.56 0.00 0.00 55.97 54.87 2jbp s LYS 64 Cb -0.10 -3.83 -0.02 0.00 -1.46 0.00 0.00 37.83 32.42 2jbp s LYS 64 CO 0.01 -1.12 0.53 0.08 0.16 0.00 0.00 175.35 175.01 2jbp s VAL 65 N 3.93 5.05 0.58 4.02 1.01 -1.26 -1.62 120.40 132.10 2jbp s VAL 65 Ca 0.44 0.80 0.07 0.00 0.00 0.00 0.00 61.98 63.29 2jbp s VAL 65 Cb -0.10 -3.87 0.08 0.00 0.00 0.00 0.00 36.38 32.49 2jbp s VAL 65 CO 0.23 0.02 0.80 0.42 0.00 0.00 0.00 175.10 176.57 2jbp s THR 66 N 2.36 2.28 -1.48 3.92 -4.23 -1.09 -5.04 115.64 112.35 2jbp s THR 66 Ca 0.21 -0.91 0.13 0.00 -1.18 0.00 0.00 61.69 59.94 2jbp s THR 66 Cb -0.15 -2.37 0.14 0.00 1.34 0.00 0.00 72.50 71.46 2jbp s THR 66 CO 0.10 0.00 0.97 -1.54 -0.54 0.00 0.00 174.62 173.61 2jbp n SER 67 N -2.31 2.23 -4.64 3.99 3.41 -1.26 -4.50 113.62 110.54 2jbp n SER 67 Ca 0.14 -1.61 -0.42 0.00 -0.26 0.00 0.00 58.87 56.72 2jbp n SER 67 Cb 0.61 -0.05 -0.03 0.00 -0.26 0.00 0.00 64.21 64.48 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 -1.04 3.86 0.02 4.33 0.74 -1.26 -4.92 119.66 121.39 2jbp s GLN 68 Ca 0.17 2.31 -0.30 0.00 0.05 0.00 0.00 55.36 57.59 2jbp s GLN 68 Cb 0.11 -4.18 -0.04 0.00 1.10 0.00 0.00 33.01 30.00 2jbp s GLN 68 CO 0.16 -1.27 1.12 0.08 -0.55 0.00 0.00 175.29 174.84 2jbp s VAL 69 N 5.45 4.36 -0.14 1.34 1.01 -1.26 -1.25 120.40 129.91 2jbp s VAL 69 Ca 0.88 1.69 0.18 0.00 0.00 0.00 0.00 61.98 64.73 2jbp s VAL 69 Cb -0.37 -4.08 -0.24 0.00 0.00 0.00 0.00 36.38 31.68 2jbp s VAL 69 CO 0.37 0.11 0.34 -0.11 0.00 0.00 0.00 175.10 175.81 2jbp n LEU 70 N 4.13 0.24 0.00 3.92 7.94 0.48 -4.88 117.00 128.83 2jbp n LEU 70 Ca 0.08 0.11 0.00 0.00 -1.11 0.00 0.00 56.01 55.09 2jbp n LEU 70 Cb 0.48 0.30 0.00 0.00 0.53 0.00 0.00 43.42 44.73 2jbp n LEU 70 CO 0.54 0.34 0.00 0.61 -1.11 0.00 0.00 177.39 177.77 2jbp n GLY 71 N 1.58 0.59 3.06 -3.96 0.00 -0.89 -4.95 105.19 100.63 2jbp n GLY 71 Ca -0.22 -0.76 -0.27 0.00 0.00 0.00 0.00 46.02 44.77 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 1.73 0.00 0.99 1.43 -1.26 1.00 118.68 122.57 2jbp s LEU 72 Ca 0.00 -0.38 0.03 0.00 -1.03 0.00 0.00 54.13 52.75 2jbp s LEU 72 Cb 0.00 -0.99 -0.01 0.00 0.03 0.00 0.00 46.19 45.22 2jbp s LEU 72 CO 0.00 0.05 0.10 0.61 0.23 0.00 0.00 176.35 177.34 2jbp n GLY 73 N 3.88 3.36 0.21 -3.19 0.00 -0.58 -5.00 105.19 103.86 2jbp n GLY 73 Ca -0.21 -2.17 0.15 0.00 0.00 0.00 0.00 46.02 43.79 2jbp n GLY 73 CO 0.00 0.00 0.00 0.16 0.00 0.00 0.00 173.32 173.48 2jbp h ILE 74 N 1.54 0.00 0.00 -0.61 -0.00 -1.96 -3.17 117.51 113.31 2jbp h ILE 74 Ca -0.32 -0.42 0.00 0.00 -0.00 0.00 0.00 64.86 64.12 2jbp h ILE 74 Cb 1.16 1.31 0.00 0.00 -0.00 0.00 0.00 36.82 39.29 2jbp h ILE 74 CO 0.52 0.00 0.00 0.59 -0.00 0.00 0.00 178.15 179.26 2jbp n ASN 75 N -2.71 0.58 -3.34 2.16 3.02 -1.26 -5.10 115.26 108.61 2jbp n ASN 75 Ca 0.02 -1.18 -0.07 0.00 -0.03 0.00 0.00 54.58 53.32 2jbp n ASN 75 Cb 0.29 0.00 0.01 0.00 -0.61 0.00 0.00 39.78 39.47 2jbp n ASN 75 CO 0.00 0.00 0.00 -0.83 -2.62 0.00 0.00 177.26 173.81 2jbp s GLY 76 N -0.18 0.13 0.41 7.41 0.00 -1.20 -4.57 107.32 109.31 2jbp s GLY 76 Ca 0.00 -0.45 0.08 0.00 0.00 0.00 0.00 44.72 44.34 2jbp s GLY 76 CO 0.00 0.27 0.41 0.54 0.00 0.00 0.00 173.10 174.32 2jbp s LYS 77 N -2.80 2.62 -0.22 2.90 1.02 -1.26 -1.53 119.74 120.46 2jbp s LYS 77 Ca 0.15 -1.45 0.01 0.00 0.02 0.00 0.00 55.97 54.70 2jbp s LYS 77 Cb -0.04 -2.47 0.05 0.00 -0.52 0.00 0.00 37.83 34.85 2jbp s LYS 77 CO 0.08 -0.17 -0.08 0.08 -0.92 0.00 0.00 175.35 174.34 2jbp s VAL 78 N -2.43 1.64 0.23 3.17 1.01 0.28 -3.13 120.40 121.17 2jbp s VAL 78 Ca 0.49 -1.19 -0.07 0.00 0.00 0.00 0.00 61.98 61.21 2jbp s VAL 78 Cb -0.05 -1.82 -0.06 0.00 0.00 0.00 0.00 36.38 34.45 2jbp s VAL 78 CO 0.29 0.01 0.52 -0.76 0.00 0.00 0.00 175.10 175.15 2jbp s LEU 79 N 1.36 4.15 0.24 3.92 1.43 0.16 0.18 118.68 130.12 2jbp s LEU 79 Ca -0.05 0.80 -0.30 0.00 -1.03 0.00 0.00 54.13 53.55 2jbp s LEU 79 Cb -0.18 -3.57 -0.09 0.00 0.03 0.00 0.00 46.19 42.38 2jbp s LEU 79 CO -0.07 -0.09 1.07 -1.58 0.23 0.00 0.00 176.35 175.91 2jbp s GLN 80 N -3.01 4.67 0.05 1.70 2.00 -0.38 -0.18 119.66 124.51 2jbp s GLN 80 Ca 0.45 1.71 -0.13 0.00 -2.00 0.00 0.00 55.36 55.39 2jbp s GLN 80 Cb -0.11 -3.24 0.02 0.00 0.80 0.00 0.00 33.01 30.48 2jbp s GLN 80 CO 0.25 0.23 0.30 0.96 -0.50 0.00 0.00 175.29 176.52 2jbp s ILE 81 N -0.86 0.09 0.03 -2.34 -4.36 -0.41 -2.67 121.20 110.68 2jbp s ILE 81 Ca 0.45 -0.72 0.08 0.00 -0.26 0.00 0.00 60.65 60.20 2jbp s ILE 81 Cb -0.30 -1.00 -0.02 0.00 1.25 0.00 0.00 42.46 42.39 2jbp s ILE 81 CO 0.37 -0.40 -0.23 -0.36 0.24 0.00 0.00 174.94 174.56 2jbp s PHE 82 N -2.78 2.03 -0.12 1.37 0.08 -0.64 -0.74 117.98 117.18 2jbp s PHE 82 Ca -0.03 -0.39 -0.30 0.00 0.12 0.00 0.00 56.93 56.33 2jbp s PHE 82 Cb -0.00 -1.24 -0.02 0.00 -0.57 0.00 0.00 43.02 41.19 2jbp s PHE 82 CO -0.05 0.07 1.29 1.21 -0.10 0.00 0.00 175.22 177.65 2jbp s ASN 83 N -1.05 6.94 0.21 1.36 3.04 0.11 0.11 114.94 125.66 2jbp s ASN 83 Ca 0.09 1.80 -0.10 0.00 0.04 0.00 0.00 52.86 54.69 2jbp s ASN 83 Cb -0.09 -2.54 0.31 0.00 -1.54 0.00 0.00 41.25 37.38 2jbp s ASN 83 CO 0.01 -0.73 1.69 0.50 -3.04 0.00 0.00 177.10 175.53 2jbp h LYS 84 N 8.09 0.20 -0.19 0.43 3.64 -1.15 0.26 116.57 127.86 2jbp h LYS 84 Ca -0.30 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.07 2jbp h LYS 84 Cb 1.13 -0.05 0.00 0.00 -0.41 0.00 0.00 32.23 32.90 2jbp h LYS 84 CO 0.94 0.13 0.00 -2.13 -2.27 0.00 0.00 179.45 176.13 2jbp n ARG 85 N -5.18 1.67 0.00 1.90 0.00 -1.26 -3.66 116.66 110.13 2jbp n ARG 85 Ca 0.09 -1.01 0.00 0.00 -0.00 0.00 0.00 57.85 56.93 2jbp n ARG 85 Cb 0.34 -1.35 0.00 0.00 0.00 0.00 0.00 32.46 31.45 2jbp n ARG 85 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.63 177.88 2jbp n THR 86 N 0.25 0.00 -0.79 5.15 -2.24 -1.13 -5.00 114.28 110.52 2jbp n THR 86 Ca 0.15 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.93 2jbp n THR 86 Cb 0.29 0.26 0.00 0.00 -2.10 0.00 0.00 70.33 68.78 2jbp n THR 86 CO 0.00 0.00 0.00 1.67 -0.57 0.00 0.00 175.07 176.17 2jbp n GLN 87 N 0.00 -0.69 -1.74 -0.78 -0.06 0.90 -4.95 117.38 110.06 2jbp n GLN 87 Ca 0.00 0.17 -0.38 0.00 -2.00 0.00 0.00 57.00 54.79 2jbp n GLN 87 Cb 0.24 -4.25 0.05 0.00 -4.06 0.00 0.00 30.24 22.22 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 -1.08 1.53 -3.72 3.69 4.07 -1.26 -4.59 120.64 119.28 2jbp n GLU 88 Ca 0.00 0.57 -0.21 0.00 -0.06 0.00 0.00 57.16 57.46 2jbp n GLU 88 Cb 0.17 -2.56 -0.03 0.00 -0.06 0.00 0.00 31.44 28.96 2jbp n GLU 88 CO 0.00 0.00 0.00 -1.59 -0.06 0.00 0.00 177.13 175.48 2jbp s LYS 89 N -3.02 2.74 0.18 5.31 -2.85 -1.26 0.04 119.74 120.88 2jbp s LYS 89 Ca 0.75 -1.30 -0.23 0.00 -1.00 0.00 0.00 55.97 54.19 2jbp s LYS 89 Cb -0.41 -2.51 0.05 0.00 -2.06 0.00 0.00 37.83 32.91 2jbp s LYS 89 CO 0.47 0.04 0.73 -0.06 0.10 0.00 0.00 175.35 176.63 2jbp s PHE 90 N -2.32 -0.33 -0.06 1.78 0.40 0.08 -4.51 117.98 113.02 2jbp s PHE 90 Ca 0.43 0.02 0.03 0.00 -0.60 0.00 0.00 56.93 56.81 2jbp s PHE 90 Cb -0.06 0.62 -0.02 0.00 0.51 0.00 0.00 43.02 44.07 2jbp s PHE 90 CO 0.27 -0.95 -0.14 0.00 0.70 0.00 0.00 175.22 175.11 2jbp s ALA 91 N -3.66 2.66 -0.12 5.36 0.00 -0.41 -1.28 121.76 124.31 2jbp s ALA 91 Ca 0.07 -0.96 0.03 0.00 0.00 0.00 0.00 51.96 51.09 2jbp s ALA 91 Cb -0.03 -1.02 0.01 0.00 0.00 0.00 0.00 23.12 22.08 2jbp s ALA 91 CO -0.03 0.50 -0.21 -1.17 0.00 0.00 0.00 175.76 174.86 2jbp s LEU 92 N -0.55 2.00 -0.13 0.00 2.96 0.74 -0.74 118.68 122.96 2jbp s LEU 92 Ca 0.08 -0.54 0.00 0.00 -0.22 0.00 0.00 54.13 53.45 2jbp s LEU 92 Cb -0.12 -1.33 -0.01 0.00 0.50 0.00 0.00 46.19 45.24 2jbp s LEU 92 CO 0.01 0.09 -0.14 -0.75 -1.32 0.00 0.00 176.35 174.25 2jbp s LYS 93 N 0.68 3.35 -0.15 1.98 2.20 -0.43 0.36 119.74 127.73 2jbp s LYS 93 Ca -0.11 -0.70 -0.05 0.00 -0.36 0.00 0.00 55.97 54.75 2jbp s LYS 93 Cb -0.16 -2.62 -0.03 0.00 -1.51 0.00 0.00 37.83 33.50 2jbp s LYS 93 CO 0.02 0.18 0.01 -1.64 -0.36 0.00 0.00 175.35 173.56 2jbp s MET 94 N 0.43 3.63 0.01 4.03 -1.94 -1.19 -0.84 119.30 123.44 2jbp s MET 94 Ca -0.10 -0.43 0.02 0.00 -1.71 0.00 0.00 55.69 53.47 2jbp s MET 94 Cb -0.16 -2.99 -0.01 0.00 2.01 0.00 0.00 34.83 33.68 2jbp s MET 94 CO 0.05 0.36 -0.07 -0.51 -0.01 0.00 0.00 175.02 174.83 2jbp s LEU 95 N 0.08 2.10 -0.12 -0.03 1.43 -0.24 -4.30 118.68 117.60 2jbp s LEU 95 Ca 0.02 -0.27 -0.29 0.00 -1.03 0.00 0.00 54.13 52.55 2jbp s LEU 95 Cb -0.13 -0.30 -0.02 0.00 0.03 0.00 0.00 46.19 45.77 2jbp s LEU 95 CO 0.02 -0.01 1.28 -1.58 0.23 0.00 0.00 176.35 176.29 2jbp s GLN 96 N -0.66 4.26 0.27 1.70 0.74 -1.26 -1.04 119.66 123.67 2jbp s GLN 96 Ca -0.01 1.71 -0.30 0.00 0.05 0.00 0.00 55.36 56.81 2jbp s GLN 96 Cb -0.05 -3.71 -0.13 0.00 1.10 0.00 0.00 33.01 30.22 2jbp s GLN 96 CO 0.00 -0.64 1.28 -3.47 -0.55 0.00 0.00 175.29 171.92 2jbp n ASP 97 N 6.18 2.35 0.00 6.67 2.03 -0.93 -4.71 116.55 128.13 2jbp n ASP 97 Ca 0.13 1.16 0.00 0.00 0.52 0.00 0.00 54.79 56.61 2jbp n ASP 97 Cb 0.45 -1.39 0.00 0.00 -0.72 0.00 0.00 41.12 39.46 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 0.84 -0.36 0.00 -0.02 -1.26 -3.95 135.00 130.25 2jbp n PRO 99 Ca 0.00 0.03 0.37 0.00 -2.02 0.00 0.00 63.50 61.88 2jbp n PRO 99 Cb 0.00 -1.14 0.75 0.00 -0.02 0.00 0.00 33.50 33.09 2jbp n PRO 99 CO 0.00 0.00 0.00 0.87 1.98 0.00 0.00 175.50 178.35 2jbp h LYS 100 N 0.00 0.00 0.06 -0.52 1.79 -1.97 0.22 116.57 116.16 2jbp h LYS 100 Ca -0.16 0.00 -0.34 0.00 -2.18 0.00 0.00 60.65 57.97 2jbp h LYS 100 Cb 1.27 0.00 -0.04 0.00 -1.58 0.00 0.00 32.23 31.88 2jbp h LYS 100 CO -0.02 0.00 -1.98 0.00 -1.08 0.00 0.00 179.45 176.37 2jbp n ALA 101 N -2.75 1.18 -0.18 3.86 0.00 -1.26 -2.82 120.51 118.54 2jbp n ALA 101 Ca 0.28 -0.75 0.10 0.00 0.00 0.00 0.00 53.44 53.07 2jbp n ALA 101 Cb 1.36 -0.65 0.42 0.00 0.00 0.00 0.00 19.45 20.58 2jbp n ALA 101 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2jbp h ARG 102 N 0.04 0.59 0.66 0.00 2.47 -0.83 -2.30 114.38 115.01 2jbp h ARG 102 Ca -0.40 -0.04 -0.03 0.00 -1.26 0.00 0.00 59.98 58.25 2jbp h ARG 102 Cb 2.03 -0.13 0.01 0.00 -1.65 0.00 0.00 29.97 30.22 2jbp h ARG 102 CO 0.06 0.39 -0.32 -0.09 0.56 0.00 0.00 179.97 180.58 2jbp h ARG 103 N 0.61 -0.86 -0.28 0.04 2.43 -0.80 0.16 114.38 115.69 2jbp h ARG 103 Ca 0.35 0.06 0.04 0.00 -0.81 0.00 0.00 59.98 59.62 2jbp h ARG 103 Cb 0.53 0.19 -0.07 0.00 -0.42 0.00 0.00 29.97 30.20 2jbp h ARG 103 CO -0.12 -0.53 -0.55 1.49 -1.51 0.00 0.00 179.97 178.74 2jbp h GLU 104 N -1.11 -0.47 -0.52 0.20 4.81 -1.32 0.55 114.58 116.72 2jbp h GLU 104 Ca -0.09 0.03 0.09 0.00 -0.13 0.00 0.00 59.36 59.26 2jbp h GLU 104 Cb 0.72 0.11 -0.10 0.00 0.63 0.00 0.00 28.75 30.10 2jbp h GLU 104 CO 0.15 -0.31 -0.40 0.28 -0.73 0.00 0.00 179.01 178.00 2jbp h VAL 105 N -0.48 0.12 -0.07 0.32 2.07 -1.46 0.30 116.25 117.04 2jbp h VAL 105 Ca 0.05 0.00 0.02 0.00 0.82 0.00 0.00 66.70 67.59 2jbp h VAL 105 Cb 0.63 0.12 -0.04 0.00 -1.52 0.00 0.00 31.29 30.48 2jbp h VAL 105 CO -0.52 0.00 -0.36 -0.08 0.02 0.00 0.00 177.57 176.63 2jbp h GLU 106 N -0.24 -0.39 -0.25 1.57 4.22 0.23 0.34 114.58 120.06 2jbp h GLU 106 Ca 0.18 0.03 0.04 0.00 0.08 0.00 0.00 59.36 59.68 2jbp h GLU 106 Cb 0.56 0.09 -0.03 0.00 0.50 0.00 0.00 28.75 29.87 2jbp h GLU 106 CO -0.64 -0.26 0.03 -0.07 -2.18 0.00 0.00 179.01 175.89 2jbp h LEU 107 N -0.40 -0.02 -0.70 1.64 3.38 0.24 -2.29 115.31 117.16 2jbp h LEU 107 Ca 0.02 0.04 -0.08 0.00 0.09 0.00 0.00 57.88 57.96 2jbp h LEU 107 Cb 0.46 0.07 -0.03 0.00 0.09 0.00 0.00 40.66 41.25 2jbp h LEU 107 CO -0.28 0.02 0.14 -0.74 0.09 0.00 0.00 178.44 177.67 2jbp h HIS 108 N 0.12 1.20 -0.87 1.13 2.76 -0.05 0.01 115.15 119.46 2jbp h HIS 108 Ca 0.11 -0.15 0.13 0.00 -2.20 0.00 0.00 60.37 58.26 2jbp h HIS 108 Cb 0.13 -0.33 -0.09 0.00 1.55 0.00 0.00 27.41 28.66 2jbp h HIS 108 CO -0.17 0.99 0.48 2.35 -1.30 0.00 0.00 177.93 180.28 2jbp h TRP 109 N 1.07 0.86 0.00 5.26 2.91 -0.12 -1.13 115.95 124.80 2jbp h TRP 109 Ca 0.22 0.03 -0.05 0.00 1.13 0.00 0.00 58.89 60.22 2jbp h TRP 109 Cb 0.41 -0.25 -0.01 0.00 -0.51 0.00 0.00 29.16 28.80 2jbp h TRP 109 CO 0.03 0.27 -0.24 -0.09 -1.03 0.00 0.00 178.44 177.38 2jbp h ARG 110 N 0.73 0.00 -0.02 2.65 9.65 -0.46 -2.76 114.38 124.17 2jbp h ARG 110 Ca 0.45 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 59.33 2jbp h ARG 110 Cb 0.56 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 29.14 2jbp h ARG 110 CO -0.32 0.24 -0.24 0.00 2.80 0.00 0.00 179.97 182.45 2jbp n ALA 111 N -2.33 3.01 0.34 2.80 0.00 -0.51 -4.40 120.51 119.41 2jbp n ALA 111 Ca -0.01 -0.67 0.14 0.00 0.00 0.00 0.00 53.44 52.90 2jbp n ALA 111 Cb 0.34 -0.79 0.46 0.00 0.00 0.00 0.00 19.45 19.46 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 3.54 0.00 -0.63 0.00 0.87 -1.01 -2.60 113.55 113.72 2jbp h SER 112 Ca 0.00 0.00 0.06 0.00 -1.23 0.00 0.00 61.79 60.62 2jbp h SER 112 Cb 0.87 0.00 -0.06 0.00 -0.44 0.00 0.00 62.40 62.77 2jbp h SER 112 CO 0.00 0.00 0.33 1.56 -0.53 0.00 0.00 176.83 178.19 2jbp h GLN 113 N 0.00 0.59 -6.92 2.24 4.20 -1.77 -3.43 115.11 110.02 2jbp h GLN 113 Ca 0.00 -0.04 -0.55 0.00 0.06 0.00 0.00 58.65 58.13 2jbp h GLN 113 Cb 0.66 -0.13 0.12 0.00 0.30 0.00 0.00 27.48 28.42 2jbp h GLN 113 CO 0.00 0.39 0.70 0.00 -0.67 0.00 0.00 178.83 179.25 2jbp h PRO 115 N 2.64 0.00 -0.57 0.00 0.11 -1.90 -2.91 132.00 129.37 2jbp h PRO 115 Ca -0.50 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.61 2jbp h PRO 115 Cb 1.26 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.37 2jbp h PRO 115 CO 0.63 0.11 0.00 0.72 -0.21 0.00 0.00 178.00 179.25 2jbp n HIS 116 N -3.57 0.99 -5.10 0.65 8.25 -1.26 -4.86 115.22 110.31 2jbp n HIS 116 Ca -0.02 -0.56 -0.32 0.00 -0.26 0.00 0.00 57.72 56.56 2jbp n HIS 116 Cb 0.25 -0.10 -0.16 0.00 1.12 0.00 0.00 29.99 31.09 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 -1.39 2.33 0.14 1.59 1.01 -1.10 -0.07 121.20 123.70 2jbp s ILE 117 Ca 0.42 -0.92 -0.34 0.00 0.00 0.00 0.00 60.65 59.80 2jbp s ILE 117 Cb 0.25 -1.92 -0.14 0.00 0.01 0.00 0.00 42.46 40.66 2jbp s ILE 117 CO 0.24 0.55 1.58 0.55 0.00 0.00 0.00 174.94 177.86 2jbp n VAL 118 N 3.49 0.04 -2.93 2.92 3.14 -0.63 -4.79 118.33 119.56 2jbp n VAL 118 Ca -0.19 -0.01 -0.40 0.00 -2.96 0.00 0.00 64.34 60.79 2jbp n VAL 118 Cb 0.53 -1.49 -0.05 0.00 -1.06 0.00 0.00 33.84 31.76 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 1.08 4.59 -0.24 1.45 3.52 -1.26 -4.85 118.95 123.25 2jbp s ARG 119 Ca 0.80 1.19 -0.21 0.00 -0.13 0.00 0.00 55.73 57.39 2jbp s ARG 119 Cb -0.71 -3.31 -0.02 0.00 -1.56 0.00 0.00 34.95 29.35 2jbp s ARG 119 CO 0.40 0.42 0.64 0.42 -0.81 0.00 0.00 175.30 176.37 2jbp s ILE 120 N -0.63 4.99 -0.12 4.11 1.01 -1.26 -1.42 121.20 127.88 2jbp s ILE 120 Ca 0.39 1.17 -0.25 0.00 0.00 0.00 0.00 60.65 61.95 2jbp s ILE 120 Cb -0.23 -3.94 -0.27 0.00 0.01 0.00 0.00 42.46 38.03 2jbp s ILE 120 CO 0.26 0.05 0.72 0.58 0.00 0.00 0.00 174.94 176.55 2jbp h VAL 121 N 5.34 1.54 -2.84 2.92 2.07 -0.81 -3.48 116.25 120.98 2jbp h VAL 121 Ca -0.28 -2.39 -0.03 0.00 0.82 0.00 0.00 66.70 64.82 2jbp h VAL 121 Cb 1.13 3.14 -0.13 0.00 -1.52 0.00 0.00 31.29 33.91 2jbp h VAL 121 CO 0.78 0.62 0.19 -1.81 0.02 0.00 0.00 177.57 177.37 2jbp s ASP 122 N -6.59 -0.57 -0.09 0.57 -0.00 -0.90 -5.01 116.67 104.08 2jbp s ASP 122 Ca -0.19 0.11 -0.01 0.00 -0.00 0.00 0.00 52.55 52.47 2jbp s ASP 122 Cb -0.00 0.58 0.03 0.00 -0.00 0.00 0.00 42.92 43.53 2jbp s ASP 122 CO 0.73 -0.90 -0.03 -0.69 -0.00 0.00 0.00 175.17 174.28 2jbp s VAL 123 N -3.29 0.65 -0.07 -1.27 1.01 -1.26 -0.53 120.40 115.64 2jbp s VAL 123 Ca -0.01 -0.05 -0.05 0.00 0.00 0.00 0.00 61.98 61.87 2jbp s VAL 123 Cb -0.01 -0.75 -0.04 0.00 0.00 0.00 0.00 36.38 35.59 2jbp s VAL 123 CO -0.09 0.30 0.14 -0.31 0.00 0.00 0.00 175.10 175.15 2jbp s TYR 124 N 1.83 3.52 -0.28 5.22 1.51 -0.04 -0.44 117.35 128.68 2jbp s TYR 124 Ca 0.05 0.42 -0.07 0.00 -1.01 0.00 0.00 57.07 56.46 2jbp s TYR 124 Cb -0.12 -1.87 0.00 0.00 -0.11 0.00 0.00 41.96 39.85 2jbp s TYR 124 CO -0.06 0.67 0.07 -2.00 -1.11 0.00 0.00 175.55 173.12 2jbp s GLU 125 N -1.39 3.21 0.29 -0.62 2.12 0.83 -0.04 118.70 123.09 2jbp s GLU 125 Ca 0.20 -0.77 0.02 0.00 0.36 0.00 0.00 54.97 54.78 2jbp s GLU 125 Cb -0.12 -3.33 -0.05 0.00 0.26 0.00 0.00 34.13 30.89 2jbp s GLU 125 CO 0.10 -0.38 0.10 -0.80 -0.54 0.00 0.00 175.26 173.74 2jbp s ASN 126 N 1.52 1.55 -0.21 -1.70 0.02 -0.05 -4.40 114.94 111.66 2jbp s ASN 126 Ca 0.03 -1.42 -0.08 0.00 -1.02 0.00 0.00 52.86 50.37 2jbp s ASN 126 Cb -0.17 0.16 -0.04 0.00 0.02 0.00 0.00 41.25 41.23 2jbp s ASN 126 CO 0.02 -0.74 0.10 -0.76 0.02 0.00 0.00 177.10 175.74 2jbp s LEU 127 N -3.37 3.86 -0.32 0.60 1.43 -1.26 0.91 118.68 120.53 2jbp s LEU 127 Ca 0.37 0.05 0.01 0.00 -1.03 0.00 0.00 54.13 53.53 2jbp s LEU 127 Cb 0.07 -2.01 0.10 0.00 0.03 0.00 0.00 46.19 44.38 2jbp s LEU 127 CO 0.15 0.10 0.07 -0.47 0.23 0.00 0.00 176.35 176.43 2jbp s TYR 128 N 0.80 2.64 -0.85 0.29 5.04 0.48 -4.75 117.35 120.99 2jbp s TYR 128 Ca 0.05 -2.27 -0.04 0.00 -2.44 0.00 0.00 57.07 52.37 2jbp s TYR 128 Cb -0.13 -2.22 -0.00 0.00 0.35 0.00 0.00 41.96 39.96 2jbp s TYR 128 CO 0.02 -0.90 0.67 0.00 -1.34 0.00 0.00 175.55 174.00 2jbp n ALA 129 N 4.58 -2.66 -0.98 3.97 0.00 -1.26 -2.89 120.51 121.27 2jbp n ALA 129 Ca -0.00 -0.17 0.00 0.00 0.00 0.00 0.00 53.44 53.26 2jbp n ALA 129 Cb 0.42 -1.51 0.00 0.00 0.00 0.00 0.00 19.45 18.36 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 -1.71 0.03 3.59 0.00 0.00 -1.26 -4.93 105.19 100.92 2jbp n GLY 130 Ca -0.17 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.51 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 -1.84 2.98 0.02 1.61 0.52 -1.14 -5.09 118.95 116.01 2jbp s ARG 131 Ca 0.00 -0.51 -0.30 0.00 -0.52 0.00 0.00 55.73 54.40 2jbp s ARG 131 Cb 0.00 -2.70 -0.04 0.00 0.52 0.00 0.00 34.95 32.73 2jbp s ARG 131 CO 0.00 0.60 1.05 0.21 0.02 0.00 0.00 175.30 177.17 2jbp s LYS 132 N -0.61 4.52 -0.01 3.54 2.20 -1.26 0.18 119.74 128.29 2jbp s LYS 132 Ca 0.09 1.53 0.04 0.00 -0.36 0.00 0.00 55.97 57.27 2jbp s LYS 132 Cb -0.12 -3.42 -0.01 0.00 -1.51 0.00 0.00 37.83 32.77 2jbp s LYS 132 CO 0.02 -0.11 -0.12 0.00 -0.36 0.00 0.00 175.35 174.78 2jbp s LEU 134 N -0.22 4.06 -0.20 0.00 1.02 -0.21 -0.87 118.68 122.25 2jbp s LEU 134 Ca 0.03 0.31 -0.02 0.00 0.02 0.00 0.00 54.13 54.48 2jbp s LEU 134 Cb -0.06 -2.43 0.00 0.00 0.02 0.00 0.00 46.19 43.73 2jbp s LEU 134 CO -0.00 -0.16 -0.11 -0.76 0.02 0.00 0.00 176.35 175.34 2jbp s LEU 135 N 1.93 2.59 -0.22 1.79 1.43 0.94 -1.08 118.68 126.07 2jbp s LEU 135 Ca 0.15 -0.49 -0.07 0.00 -1.03 0.00 0.00 54.13 52.69 2jbp s LEU 135 Cb -0.16 -1.64 -0.03 0.00 0.03 0.00 0.00 46.19 44.40 2jbp s LEU 135 CO 0.09 -0.01 0.06 -0.63 0.23 0.00 0.00 176.35 176.10 2jbp s ILE 136 N 1.37 4.44 -0.30 -0.59 1.01 -0.02 -0.86 121.20 126.25 2jbp s ILE 136 Ca 0.05 -0.14 -0.10 0.00 0.00 0.00 0.00 60.65 60.46 2jbp s ILE 136 Cb -0.14 -3.05 -0.01 0.00 0.01 0.00 0.00 42.46 39.27 2jbp s ILE 136 CO -0.07 0.38 0.15 -0.69 0.00 0.00 0.00 174.94 174.72 2jbp s VAL 137 N 1.16 4.64 0.30 2.92 1.01 0.31 -1.31 120.40 129.42 2jbp s VAL 137 Ca 0.04 -0.35 0.08 0.00 0.00 0.00 0.00 61.98 61.75 2jbp s VAL 137 Cb -0.14 -3.33 -0.06 0.00 0.00 0.00 0.00 36.38 32.84 2jbp s VAL 137 CO 0.03 0.10 -0.09 0.00 0.00 0.00 0.00 175.10 175.15 2jbp s MET 138 N 1.63 1.64 1.27 2.72 0.23 0.08 -0.08 119.30 126.78 2jbp s MET 138 Ca 0.05 -1.82 -0.17 0.00 -1.03 0.00 0.00 55.69 52.72 2jbp s MET 138 Cb -0.17 -1.40 0.30 0.00 -1.53 0.00 0.00 34.83 32.03 2jbp s MET 138 CO 0.06 0.11 0.81 -0.85 -2.03 0.00 0.00 175.02 173.12 2jbp n GLU 139 N -0.65 -3.17 -3.87 3.16 0.28 -0.51 -1.28 120.64 114.60 2jbp n GLU 139 Ca -0.05 -0.92 -0.36 0.00 -0.16 0.00 0.00 57.16 55.67 2jbp n GLU 139 Cb 0.63 -1.99 -0.13 0.00 1.43 0.00 0.00 31.44 31.37 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 1.37 5.62 0.06 0.00 1.43 -1.26 -4.81 118.68 121.08 2jbp s LEU 141 Ca -0.00 -3.16 0.27 0.00 -1.03 0.00 0.00 54.13 50.20 2jbp s LEU 141 Cb -0.18 -2.32 0.87 0.00 0.03 0.00 0.00 46.19 44.59 2jbp s LEU 141 CO -0.01 -0.58 1.70 -0.90 0.23 0.00 0.00 176.35 176.79 2jbp n ASP 142 N 4.50 0.37 0.00 2.29 5.75 -1.22 -3.04 116.55 125.20 2jbp n ASP 142 Ca 0.30 0.30 0.01 0.00 -0.01 0.00 0.00 54.79 55.39 2jbp n ASP 142 Cb 0.42 -0.30 0.04 0.00 -1.03 0.00 0.00 41.12 40.24 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 1.44 -0.55 4.83 6.12 0.00 -0.55 -4.70 105.19 111.78 2jbp n GLY 143 Ca 0.06 -0.01 0.00 0.00 0.00 0.00 0.00 46.02 46.07 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 -1.31 -2.17 3.78 -0.02 0.00 -1.17 -4.45 105.19 99.85 2jbp n GLY 144 Ca 0.00 -1.49 -0.29 0.00 0.00 0.00 0.00 46.02 44.25 2jbp n GLY 144 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2jbp s GLU 145 N -0.28 1.22 -0.07 1.61 2.02 -1.26 0.12 118.70 122.06 2jbp s GLU 145 Ca 0.00 0.38 -0.20 0.00 0.02 0.00 0.00 54.97 55.17 2jbp s GLU 145 Cb 0.00 -1.84 -0.15 0.00 0.10 0.00 0.00 34.13 32.24 2jbp s GLU 145 CO 0.00 -2.16 0.78 1.25 0.02 0.00 0.00 175.26 175.14 2jbp h LEU 146 N -1.48 -0.14 0.00 1.80 5.85 -1.53 -2.95 115.31 116.86 2jbp h LEU 146 Ca -0.50 -0.40 0.00 0.00 0.84 0.00 0.00 57.88 57.82 2jbp h LEU 146 Cb 1.32 0.04 0.00 0.00 0.37 0.00 0.00 40.66 42.39 2jbp h LEU 146 CO 0.61 0.46 0.00 0.49 -0.34 0.00 0.00 178.44 179.66 2jbp n PHE 147 N -4.87 0.00 0.00 1.25 3.01 -1.26 -3.34 117.46 112.25 2jbp n PHE 147 Ca -0.07 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.39 2jbp n PHE 147 Cb 0.26 0.00 0.00 0.00 -0.01 0.00 0.00 39.48 39.73 2jbp n PHE 147 CO 0.00 0.00 0.00 0.43 1.01 0.00 0.00 176.76 178.20 2jbp n SER 148 N -0.71 0.00 -0.09 4.37 7.64 -1.12 -2.42 113.62 121.29 2jbp n SER 148 Ca 0.08 0.05 0.14 0.00 1.01 0.00 0.00 58.87 60.15 2jbp n SER 148 Cb 0.04 0.00 0.22 0.00 -1.01 0.00 0.00 64.21 63.45 2jbp n SER 148 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 2jbp n ARG 149 N -0.31 0.01 -0.09 1.43 5.12 -1.21 0.11 116.66 121.72 2jbp n ARG 149 Ca 0.00 0.57 -0.20 0.00 -1.93 0.00 0.00 57.85 56.29 2jbp n ARG 149 Cb 0.00 -1.43 -0.12 0.00 -1.16 0.00 0.00 32.46 29.75 2jbp n ARG 149 CO 0.00 0.00 0.00 0.82 -1.93 0.00 0.00 177.63 176.52 2jbp h ILE 150 N 0.00 1.08 0.00 0.55 2.04 -1.69 -3.35 117.51 116.14 2jbp h ILE 150 Ca 0.25 -2.23 0.00 0.00 1.00 0.00 0.00 64.86 63.88 2jbp h ILE 150 Cb 1.60 2.49 0.00 0.00 -0.74 0.00 0.00 36.82 40.17 2jbp h ILE 150 CO -0.00 0.41 0.01 1.67 0.00 0.00 0.00 178.15 180.25 2jbp n GLN 151 N -4.40 0.00 -3.95 2.37 7.27 0.30 -3.92 117.38 115.04 2jbp n GLN 151 Ca -0.27 0.32 -0.30 0.00 0.07 0.00 0.00 57.00 56.82 2jbp n GLN 151 Cb 0.67 -1.51 -0.16 0.00 2.41 0.00 0.00 30.24 31.65 2jbp n GLN 151 CO 0.00 0.00 0.00 -0.51 0.07 0.00 0.00 177.06 176.62 2jbp s ASP 152 N -2.63 3.78 0.30 1.69 1.01 -0.99 -4.68 116.67 115.15 2jbp s ASP 152 Ca 0.00 -1.13 0.00 0.00 0.71 0.00 0.00 52.55 52.13 2jbp s ASP 152 Cb 0.00 -1.19 0.00 0.00 1.01 0.00 0.00 42.92 42.74 2jbp s ASP 152 CO 0.00 -0.22 0.00 0.54 0.21 0.00 0.00 175.17 175.70 2jbp n ARG 153 N 4.67 0.00 -1.38 8.23 1.74 -1.25 -4.84 116.66 123.83 2jbp n ARG 153 Ca -0.12 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 56.96 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 0.41 -1.52 0.00 0.00 177.63 176.52 2jbp n GLY 154 N -1.46 0.51 3.64 -0.13 0.00 -1.26 -5.20 105.19 101.30 2jbp n GLY 154 Ca 0.00 -0.87 -0.05 0.00 0.00 0.00 0.00 46.02 45.11 2jbp n GLY 154 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2jbp s ALA 157 N -2.00 -2.14 0.56 4.61 0.00 -1.26 -5.08 121.76 116.45 2jbp s ALA 157 Ca 0.00 2.19 -0.10 0.00 0.00 0.00 0.00 51.96 54.04 2jbp s ALA 157 Cb 0.00 -1.60 -0.05 0.00 0.00 0.00 0.00 23.12 21.48 2jbp s ALA 157 CO 0.00 -0.33 0.95 0.12 0.00 0.00 0.00 175.76 176.49 2jbp s PHE 158 N 1.18 3.58 -0.00 0.00 5.99 -1.26 -4.96 117.98 122.50 2jbp s PHE 158 Ca -0.07 1.18 0.06 0.00 0.00 0.00 0.00 56.93 58.11 2jbp s PHE 158 Cb -0.04 -2.61 -0.02 0.00 0.00 0.00 0.00 43.02 40.35 2jbp s PHE 158 CO -0.14 -0.51 -0.19 0.95 -0.00 0.00 0.00 175.22 175.33 2jbp s THR 159 N -2.95 1.53 0.33 0.12 -4.23 -1.26 -1.96 115.64 107.22 2jbp s THR 159 Ca 0.53 -0.90 0.12 0.00 -1.18 0.00 0.00 61.69 60.26 2jbp s THR 159 Cb -0.11 -1.28 0.33 0.00 1.34 0.00 0.00 72.50 72.78 2jbp s THR 159 CO 0.47 0.37 1.66 -0.08 -0.54 0.00 0.00 174.62 176.50 2jbp h GLU 160 N 5.49 0.28 0.39 3.99 4.81 0.00 0.92 114.58 130.46 2jbp h GLU 160 Ca -0.39 -0.02 -0.01 0.00 -0.13 0.00 0.00 59.36 58.81 2jbp h GLU 160 Cb 1.15 -0.06 -0.00 0.00 0.63 0.00 0.00 28.75 30.46 2jbp h GLU 160 CO 0.47 0.18 -0.24 -0.09 -0.73 0.00 0.00 179.01 178.60 2jbp h ARG 161 N 0.28 -0.58 -1.04 1.92 2.43 -1.60 -0.51 114.38 115.28 2jbp h ARG 161 Ca 0.69 0.04 0.26 0.00 -0.81 0.00 0.00 59.98 60.17 2jbp h ARG 161 Cb 1.55 0.13 -0.10 0.00 -0.42 0.00 0.00 29.97 31.13 2jbp h ARG 161 CO -0.63 -0.39 0.65 0.93 -1.51 0.00 0.00 179.97 179.03 2jbp h GLU 162 N -0.60 0.43 -0.33 0.20 5.08 -1.17 0.37 114.58 118.55 2jbp h GLU 162 Ca -0.04 -0.03 -0.12 0.00 -1.00 0.00 0.00 59.36 58.17 2jbp h GLU 162 Cb 0.50 -0.10 -0.01 0.00 0.50 0.00 0.00 28.75 29.64 2jbp h GLU 162 CO 0.04 0.28 -0.26 0.00 -1.00 0.00 0.00 179.01 178.07 2jbp h ALA 163 N 1.65 0.47 -0.21 3.43 0.00 -0.47 -0.47 119.26 123.67 2jbp h ALA 163 Ca 0.62 -0.39 0.06 0.00 0.00 0.00 0.00 54.91 55.19 2jbp h ALA 163 Cb 1.45 -0.11 -0.06 0.00 0.00 0.00 0.00 17.79 19.08 2jbp h ALA 163 CO -0.35 0.47 -0.19 1.03 0.00 0.00 0.00 179.25 180.21 2jbp h SER 164 N 0.53 -0.62 -0.34 0.00 0.87 0.12 0.10 113.55 114.20 2jbp h SER 164 Ca 0.06 0.12 0.06 0.00 -1.23 0.00 0.00 61.79 60.80 2jbp h SER 164 Cb 0.83 0.30 -0.06 0.00 -0.44 0.00 0.00 62.40 63.03 2jbp h SER 164 CO 0.07 -0.24 -0.00 -0.33 -0.53 0.00 0.00 176.83 175.80 2jbp h GLU 165 N -0.21 0.09 -0.26 2.24 5.08 -0.64 -0.66 114.58 120.23 2jbp h GLU 165 Ca 0.12 -0.01 0.01 0.00 -1.00 0.00 0.00 59.36 58.49 2jbp h GLU 165 Cb 0.40 -0.02 -0.02 0.00 0.50 0.00 0.00 28.75 29.61 2jbp h GLU 165 CO -0.33 0.06 0.14 0.82 -1.00 0.00 0.00 179.01 178.70 2jbp h ILE 166 N 0.09 1.02 -0.53 3.13 2.04 -0.36 -1.89 117.51 121.01 2jbp h ILE 166 Ca 0.17 -0.10 -0.00 0.00 1.00 0.00 0.00 64.86 65.92 2jbp h ILE 166 Cb 0.23 0.69 -0.03 0.00 -0.74 0.00 0.00 36.82 36.98 2jbp h ILE 166 CO -0.28 0.05 0.32 0.24 0.00 0.00 0.00 178.15 178.48 2jbp h MET 167 N 0.30 0.72 -0.32 2.37 2.86 -0.15 -1.09 114.93 119.62 2jbp h MET 167 Ca 0.10 -0.06 -0.04 0.00 -2.06 0.00 0.00 59.70 57.64 2jbp h MET 167 Cb 0.00 -0.15 -0.02 0.00 0.06 0.00 0.00 31.60 31.49 2jbp h MET 167 CO -0.05 0.50 0.00 -0.22 1.06 0.00 0.00 176.91 178.21 2jbp h LYS 168 N 0.73 0.48 0.05 1.72 3.64 -0.32 0.13 116.57 123.00 2jbp h LYS 168 Ca 0.19 -0.10 -0.00 0.00 -1.27 0.00 0.00 60.65 59.47 2jbp h LYS 168 Cb -0.03 -0.07 0.00 0.00 -0.41 0.00 0.00 32.23 31.72 2jbp h LYS 168 CO -0.04 0.51 -0.02 0.66 -2.27 0.00 0.00 179.45 178.29 2jbp h SER 169 N 0.47 -0.05 -0.88 4.20 4.64 -0.93 -0.82 113.55 120.18 2jbp h SER 169 Ca 0.10 -0.50 0.18 0.00 -0.47 0.00 0.00 61.79 61.10 2jbp h SER 169 Cb 0.30 0.01 -0.11 0.00 -0.31 0.00 0.00 62.40 62.30 2jbp h SER 169 CO 0.01 0.50 0.43 0.40 -0.87 0.00 0.00 176.83 177.29 2jbp h ILE 170 N -0.63 0.61 -0.37 0.95 2.04 -1.26 0.35 117.51 119.21 2jbp h ILE 170 Ca -0.01 -0.18 -0.04 0.00 1.00 0.00 0.00 64.86 65.64 2jbp h ILE 170 Cb 0.55 0.04 -0.02 0.00 -0.74 0.00 0.00 36.82 36.65 2jbp h ILE 170 CO 0.01 0.10 0.07 1.23 0.00 0.00 0.00 178.15 179.56 2jbp h GLY 171 N 0.52 0.58 1.16 5.37 0.00 -0.44 -1.79 103.07 108.47 2jbp h GLY 171 Ca 0.51 -0.31 -0.17 0.00 0.00 0.00 0.00 47.33 47.36 2jbp h GLY 171 CO -0.44 0.29 -0.46 0.83 0.00 0.00 0.00 176.54 176.76 2jbp h GLU 172 N 0.53 0.90 0.21 4.80 5.08 0.51 0.60 114.58 127.21 2jbp h GLU 172 Ca 0.12 -0.52 0.00 0.00 -1.00 0.00 0.00 59.36 57.97 2jbp h GLU 172 Cb 0.23 0.04 -0.02 0.00 0.50 0.00 0.00 28.75 29.50 2jbp h GLU 172 CO -0.00 1.16 -0.21 0.00 -1.00 0.00 0.00 179.01 178.96 2jbp h ALA 173 N 0.75 -0.43 -0.88 3.43 0.00 -0.80 -0.78 119.26 120.55 2jbp h ALA 173 Ca 0.04 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.89 2jbp h ALA 173 Cb 1.06 0.31 -0.04 0.00 0.00 0.00 0.00 17.79 19.12 2jbp h ALA 173 CO 0.11 -0.77 0.57 0.82 0.00 0.00 0.00 179.25 179.97 2jbp h ILE 174 N -0.46 1.23 -0.80 0.00 1.08 -1.14 -1.07 117.51 116.36 2jbp h ILE 174 Ca 0.00 -0.45 -0.04 0.00 -0.39 0.00 0.00 64.86 63.99 2jbp h ILE 174 Cb 0.43 -0.05 -0.04 0.00 -3.07 0.00 0.00 36.82 34.10 2jbp h ILE 174 CO -0.06 0.23 0.36 -0.61 -0.69 0.00 0.00 178.15 177.39 2jbp h GLN 175 N 1.20 1.17 -0.48 2.37 4.15 -0.56 0.06 115.11 123.02 2jbp h GLN 175 Ca 0.32 -0.19 -0.06 0.00 0.77 0.00 0.00 58.65 59.50 2jbp h GLN 175 Cb -0.11 -0.20 -0.02 0.00 0.21 0.00 0.00 27.48 27.36 2jbp h GLN 175 CO -0.07 0.92 0.08 -0.92 -1.93 0.00 0.00 178.83 176.92 2jbp h TYR 176 N 1.15 0.84 -0.20 3.99 3.20 0.08 -1.81 116.97 124.22 2jbp h TYR 176 Ca 0.27 -0.11 -0.04 0.00 3.14 0.00 0.00 58.73 61.99 2jbp h TYR 176 Cb 0.15 -0.23 -0.01 0.00 1.54 0.00 0.00 36.73 38.18 2jbp h TYR 176 CO 0.02 0.78 -0.01 -0.07 -1.64 0.00 0.00 178.16 177.23 2jbp h LEU 177 N 0.67 0.36 -1.47 2.82 3.38 -0.52 -2.56 115.31 117.99 2jbp h LEU 177 Ca 0.15 -0.33 -0.06 0.00 0.09 0.00 0.00 57.88 57.73 2jbp h LEU 177 Cb 0.38 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 41.03 2jbp h LEU 177 CO 0.01 0.60 -0.27 0.45 0.09 0.00 0.00 178.44 179.32 2jbp h HIS 178 N 0.11 0.00 0.00 1.13 3.86 -0.94 -0.92 115.15 118.39 2jbp h HIS 178 Ca 0.06 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.27 2jbp h HIS 178 Cb 0.43 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.90 2jbp h HIS 178 CO 0.04 0.27 0.00 0.66 0.86 0.00 0.00 177.93 179.76 2jbp h SER 179 N 0.00 0.00 0.00 2.45 4.64 -0.91 -2.27 113.55 117.47 2jbp h SER 179 Ca -0.00 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2jbp h SER 179 Cb 0.53 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.62 2jbp h SER 179 CO 0.03 0.00 -0.02 2.30 -0.87 0.00 0.00 176.83 178.27 2jbp n ILE 180 N -2.79 1.84 -2.52 0.95 -5.35 -0.66 -5.00 119.36 105.82 2jbp n ILE 180 Ca 0.01 -2.22 -0.03 0.00 -0.27 0.00 0.00 62.75 60.24 2jbp n ILE 180 Cb 0.29 -0.22 0.01 0.00 -1.74 0.00 0.00 39.64 37.99 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 -1.39 -2.46 -3.99 7.28 4.13 -0.46 -4.96 115.26 113.41 2jbp n ASN 181 Ca 0.16 -0.09 -0.28 0.00 1.68 0.00 0.00 54.58 56.05 2jbp n ASN 181 Cb 0.64 -1.21 -0.17 0.00 -1.54 0.00 0.00 39.78 37.50 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 -3.05 1.30 0.04 2.41 1.01 -0.55 -2.03 121.20 120.32 2jbp s ILE 182 Ca 0.06 -0.50 -0.14 0.00 0.00 0.00 0.00 60.65 60.07 2jbp s ILE 182 Cb -0.03 -1.23 -0.06 0.00 0.01 0.00 0.00 42.46 41.15 2jbp s ILE 182 CO 0.11 0.41 0.44 0.00 0.00 0.00 0.00 174.94 175.90 2jbp s ALA 183 N 1.29 3.68 -0.07 9.38 0.00 -0.43 -3.37 121.76 132.24 2jbp s ALA 183 Ca -0.01 -0.21 0.07 0.00 0.00 0.00 0.00 51.96 51.81 2jbp s ALA 183 Cb -0.14 -2.41 -0.24 0.00 0.00 0.00 0.00 23.12 20.33 2jbp s ALA 183 CO -0.05 0.48 0.57 1.58 0.00 0.00 0.00 175.76 178.34 2jbp n HIS 184 N 1.53 1.05 -1.11 0.00 -0.00 -1.26 -1.52 115.22 113.91 2jbp n HIS 184 Ca -0.12 0.33 -0.04 0.00 0.46 0.00 0.00 57.72 58.36 2jbp n HIS 184 Cb 0.52 -1.18 -0.02 0.00 -0.12 0.00 0.00 29.99 29.20 2jbp n HIS 184 CO 0.00 0.00 0.00 0.54 0.46 0.00 0.00 176.34 177.34 2jbp n ARG 185 N -3.16 -1.02 -2.21 1.57 5.12 -1.26 -2.60 116.66 113.10 2jbp n ARG 185 Ca -0.21 0.48 -0.01 0.00 -1.93 0.00 0.00 57.85 56.17 2jbp n ARG 185 Cb 1.05 -4.36 0.08 0.00 -1.16 0.00 0.00 32.46 28.07 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 -0.35 -0.90 -4.60 0.55 2.03 -1.26 -4.92 116.55 107.10 2jbp n ASP 186 Ca -0.04 -1.75 -0.43 0.00 0.52 0.00 0.00 54.79 53.10 2jbp n ASP 186 Cb 0.31 0.42 -0.02 0.00 -0.72 0.00 0.00 41.12 41.11 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 3.73 0.24 5.18 1.01 -1.26 -4.89 120.40 124.49 2jbp s VAL 187 Ca 0.05 0.73 0.01 0.00 0.00 0.00 0.00 61.98 62.77 2jbp s VAL 187 Cb 0.27 -4.03 -0.05 0.00 0.00 0.00 0.00 36.38 32.58 2jbp s VAL 187 CO -0.08 -0.69 0.10 -1.59 0.00 0.00 0.00 175.10 172.85 2jbp s LYS 188 N 5.30 1.34 0.25 2.72 -2.85 -1.26 -4.79 119.74 120.44 2jbp s LYS 188 Ca 0.67 -1.72 -0.06 0.00 -1.00 0.00 0.00 55.97 53.86 2jbp s LYS 188 Cb -0.16 -0.10 0.28 0.00 -2.06 0.00 0.00 37.83 35.79 2jbp s LYS 188 CO 0.32 -0.32 1.92 -1.35 0.10 0.00 0.00 175.35 176.02 2jbp h PRO 189 N 2.46 1.26 0.00 1.78 0.11 -1.96 -0.92 132.00 134.73 2jbp h PRO 189 Ca -0.38 -0.08 0.00 0.00 0.11 0.00 0.00 66.00 65.66 2jbp h PRO 189 Cb 1.25 -0.28 0.00 0.00 0.11 0.00 0.00 31.00 32.07 2jbp h PRO 189 CO 0.58 0.83 0.01 0.93 -0.21 0.00 0.00 178.00 180.15 2jbp h GLU 190 N 1.30 0.00 -0.48 1.05 3.07 -1.97 -1.52 114.58 116.03 2jbp h GLU 190 Ca 0.37 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.23 2jbp h GLU 190 Cb -0.09 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 27.82 2jbp h GLU 190 CO -0.10 0.00 0.00 0.09 -1.40 0.00 0.00 179.01 177.60 2jbp n ASN 191 N -2.39 4.48 -3.95 1.42 5.03 -0.35 -4.81 115.26 114.69 2jbp n ASN 191 Ca -0.02 -2.66 -0.31 0.00 0.87 0.00 0.00 54.58 52.47 2jbp n ASN 191 Cb 0.05 -0.55 -0.15 0.00 -1.02 0.00 0.00 39.78 38.11 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 -2.22 4.24 0.11 3.41 1.43 -0.57 -1.32 118.68 123.75 2jbp s LEU 192 Ca 0.46 -2.28 0.05 0.00 -1.03 0.00 0.00 54.13 51.33 2jbp s LEU 192 Cb 0.32 -1.50 -0.04 0.00 0.03 0.00 0.00 46.19 45.01 2jbp s LEU 192 CO 0.17 -0.35 0.01 -0.76 0.23 0.00 0.00 176.35 175.65 2jbp s LEU 193 N 0.74 3.48 0.31 1.79 1.43 -0.05 -1.70 118.68 124.69 2jbp s LEU 193 Ca 0.12 -0.20 -0.10 0.00 -1.03 0.00 0.00 54.13 52.93 2jbp s LEU 193 Cb -0.20 -2.19 -0.07 0.00 0.03 0.00 0.00 46.19 43.75 2jbp s LEU 193 CO -0.08 0.16 0.65 -0.31 0.23 0.00 0.00 176.35 176.99 2jbp s TYR 194 N -1.40 3.44 0.05 0.29 2.02 0.33 -0.35 117.35 121.73 2jbp s TYR 194 Ca 0.26 0.92 0.00 0.00 -0.37 0.00 0.00 57.07 57.89 2jbp s TYR 194 Cb -0.11 -2.32 -0.26 0.00 -0.40 0.00 0.00 41.96 38.87 2jbp s TYR 194 CO 0.19 0.10 1.04 0.00 -1.57 0.00 0.00 175.55 175.31 2jbp h THR 195 N 1.55 1.39 -3.58 -0.71 1.03 -1.85 -1.45 112.91 109.28 2jbp h THR 195 Ca -0.47 -3.03 -0.20 0.00 -0.01 0.00 0.00 66.41 62.70 2jbp h THR 195 Cb 1.18 2.82 -0.04 0.00 -1.07 0.00 0.00 68.15 71.04 2jbp h THR 195 CO 0.66 0.86 -0.04 -1.54 -0.01 0.00 0.00 175.52 175.45 2jbp n SER 196 N -3.43 -1.41 -0.90 0.00 3.41 -1.26 -3.43 113.62 106.60 2jbp n SER 196 Ca -0.10 -2.62 0.07 0.00 -0.26 0.00 0.00 58.87 55.96 2jbp n SER 196 Cb 1.01 2.53 0.21 0.00 -0.26 0.00 0.00 64.21 67.71 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 -0.51 2.18 -1.92 4.33 5.02 -1.26 -3.73 118.16 122.27 2jbp n LYS 197 Ca -0.01 -1.71 -0.34 0.00 -2.02 0.00 0.00 58.31 54.22 2jbp n LYS 197 Cb 0.52 -1.40 0.03 0.00 -0.02 0.00 0.00 35.03 34.16 2jbp n LYS 197 CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 2jbp s ARG 198 N -1.42 2.94 0.00 1.97 0.52 -1.26 -4.89 118.95 116.81 2jbp s ARG 198 Ca 0.32 1.55 0.07 0.00 -0.52 0.00 0.00 55.73 57.14 2jbp s ARG 198 Cb 0.17 -1.95 0.36 0.00 0.52 0.00 0.00 34.95 34.05 2jbp s ARG 198 CO 0.21 -1.17 1.02 -0.35 0.02 0.00 0.00 175.30 175.03 2jbp n PRO 199 N -1.98 0.13 -2.65 3.54 -0.04 -1.26 -1.18 135.00 131.56 2jbp n PRO 199 Ca 0.11 0.16 -0.03 0.00 -0.04 0.00 0.00 63.50 63.71 2jbp n PRO 199 Cb 0.51 -1.50 0.12 0.00 -0.04 0.00 0.00 33.50 32.60 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 -1.21 -1.53 -2.44 3.54 2.04 -1.26 -5.10 115.26 109.30 2jbp n ASN 200 Ca 0.04 -2.24 0.00 0.00 -0.44 0.00 0.00 54.58 51.94 2jbp n ASN 200 Cb 0.05 0.75 0.00 0.00 -2.53 0.00 0.00 39.78 38.05 2jbp n ASN 200 CO 0.00 0.00 0.00 0.00 -0.44 0.00 0.00 177.26 176.82 2jbp n ALA 201 N -1.30 0.00 -3.68 -2.53 0.00 -0.32 -4.99 120.51 107.69 2jbp n ALA 201 Ca -0.14 0.00 -0.22 0.00 0.00 0.00 0.00 53.44 53.08 2jbp n ALA 201 Cb 0.86 0.00 -0.18 0.00 0.00 0.00 0.00 19.45 20.14 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 -0.03 -0.02 0.10 0.00 1.01 -1.26 -4.86 121.20 116.14 2jbp s ILE 202 Ca 0.00 0.24 -0.31 0.00 0.00 0.00 0.00 60.65 60.58 2jbp s ILE 202 Cb 0.00 -0.31 -0.09 0.00 0.01 0.00 0.00 42.46 42.07 2jbp s ILE 202 CO 0.00 0.09 1.61 -0.22 0.00 0.00 0.00 174.94 176.42 2jbp s LEU 203 N 2.13 4.37 0.07 2.97 2.96 -1.26 -2.94 118.68 126.97 2jbp s LEU 203 Ca 0.04 2.51 0.08 0.00 -0.22 0.00 0.00 54.13 56.54 2jbp s LEU 203 Cb -0.13 -3.57 -0.03 0.00 0.50 0.00 0.00 46.19 42.96 2jbp s LEU 203 CO -0.05 -0.85 -0.22 -0.54 -1.32 0.00 0.00 176.35 173.37 2jbp s LYS 204 N 2.11 1.36 0.18 1.98 1.02 0.52 -4.60 119.74 122.31 2jbp s LYS 204 Ca 0.72 -1.08 -0.12 0.00 0.02 0.00 0.00 55.97 55.51 2jbp s LYS 204 Cb -0.41 -1.58 -0.07 0.00 -0.52 0.00 0.00 37.83 35.25 2jbp s LYS 204 CO 0.32 0.39 0.54 -1.17 -0.92 0.00 0.00 175.35 174.50 2jbp s LEU 205 N -1.53 4.26 0.30 3.17 2.96 0.89 -0.87 118.68 127.87 2jbp s LEU 205 Ca 0.09 0.98 0.03 0.00 -0.22 0.00 0.00 54.13 55.00 2jbp s LEU 205 Cb -0.09 -3.44 -0.04 0.00 0.50 0.00 0.00 46.19 43.12 2jbp s LEU 205 CO 0.03 0.03 0.14 0.42 -1.32 0.00 0.00 176.35 175.65 2jbp s THR 206 N -1.62 0.43 -0.16 3.68 -4.23 -0.44 -1.61 115.64 111.69 2jbp s THR 206 Ca 0.42 -2.00 -0.00 0.00 -1.18 0.00 0.00 61.69 58.93 2jbp s THR 206 Cb -0.13 -2.54 0.00 0.00 1.34 0.00 0.00 72.50 71.16 2jbp s THR 206 CO 0.20 0.00 0.01 -0.67 -0.54 0.00 0.00 174.62 173.62 2jbp n ASP 207 N -0.81 -4.99 -1.94 3.99 2.03 -1.26 -4.89 116.55 108.67 2jbp n ASP 207 Ca 0.00 0.70 -0.14 0.00 0.52 0.00 0.00 54.79 55.87 2jbp n ASP 207 Cb 0.65 -3.16 0.19 0.00 -0.72 0.00 0.00 41.12 38.09 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 0.32 2.38 -0.18 -0.67 3.01 -1.26 -4.42 117.46 116.64 2jbp n PHE 208 Ca 0.00 -1.39 0.12 0.00 1.01 0.00 0.00 57.45 57.19 2jbp n PHE 208 Cb 0.01 -0.75 0.44 0.00 -0.01 0.00 0.00 39.48 39.17 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 2.11 0.86 0.00 1.37 0.00 -1.90 -2.44 103.07 103.07 2jbp h GLY 209 Ca 0.41 -0.24 0.00 0.00 0.00 0.00 0.00 47.33 47.51 2jbp h GLY 209 CO 0.81 0.12 -0.52 0.69 0.00 0.00 0.00 176.54 177.64 2jbp n PHE 210 N -4.50 0.00 -1.39 5.60 3.72 -1.26 -4.94 117.46 114.69 2jbp n PHE 210 Ca 0.13 0.00 -0.47 0.00 -0.05 0.00 0.00 57.45 57.06 2jbp n PHE 210 Cb 0.41 -0.00 -0.03 0.00 -0.94 0.00 0.00 39.48 38.92 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 -1.26 -2.87 -3.32 4.37 0.00 -0.92 -4.72 120.51 111.80 2jbp n ALA 211 Ca 0.02 0.39 -0.13 0.00 0.00 0.00 0.00 53.44 53.72 2jbp n ALA 211 Cb 0.17 -1.59 -0.12 0.00 0.00 0.00 0.00 19.45 17.90 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 -1.01 0.28 0.86 0.00 2.20 -0.57 -4.91 119.74 116.59 2jbp s LYS 212 Ca 0.63 0.42 -0.11 0.00 -0.36 0.00 0.00 55.97 56.55 2jbp s LYS 212 Cb -0.88 0.07 0.11 0.00 -1.51 0.00 0.00 37.83 35.61 2jbp s LYS 212 CO 0.57 -0.07 1.09 -1.21 -0.36 0.00 0.00 175.35 175.37 2jbp s GLU 213 N 0.48 1.57 -0.31 4.03 2.02 -1.26 -1.31 118.70 123.91 2jbp s GLU 213 Ca -0.03 0.97 0.14 0.00 0.02 0.00 0.00 54.97 56.08 2jbp s GLU 213 Cb -0.04 -1.83 0.47 0.00 0.10 0.00 0.00 34.13 32.83 2jbp s GLU 213 CO -0.02 -2.07 1.11 0.25 0.02 0.00 0.00 175.26 174.55 2jbp n THR 214 N -3.78 1.80 0.00 3.63 -2.24 -0.86 -4.83 114.28 108.00 2jbp n THR 214 Ca 0.08 -3.67 0.00 0.00 -2.27 0.00 0.00 64.05 58.19 2jbp n THR 214 Cb 0.54 0.02 0.00 0.00 -2.10 0.00 0.00 70.33 68.79 2jbp n THR 214 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 2jbp n THR 215 N -0.53 0.00 -1.21 4.28 -2.24 -1.26 -4.77 114.28 108.54 2jbp n THR 215 Ca 0.24 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 62.02 2jbp n THR 215 Cb 0.84 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 69.07 2jbp n THR 215 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 2jbp n SER 216 N 0.00 -0.40 0.00 3.42 7.64 -1.26 -4.87 113.62 118.14 2jbp n SER 216 Ca 0.00 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.88 2jbp n SER 216 Cb 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.20 2jbp n SER 216 CO 0.00 0.00 0.00 1.41 -3.01 0.00 0.00 175.04 173.44 2jbp n HIS 217 N 0.00 0.00 -0.97 1.43 8.25 -1.26 -5.05 115.22 117.62 2jbp n HIS 217 Ca 0.00 0.00 -0.30 0.00 -0.26 0.00 0.00 57.72 57.16 2jbp n HIS 217 Cb 0.00 0.00 0.16 0.00 1.12 0.00 0.00 29.99 31.27 2jbp n HIS 217 CO 0.00 0.00 0.00 1.52 0.64 0.00 0.00 176.34 178.50 2jbp s TYR 229 N 0.00 2.00 0.00 4.41 -0.85 -1.26 -5.15 117.35 116.50 2jbp s TYR 229 Ca 0.00 1.41 0.00 0.00 -0.52 0.00 0.00 57.07 57.96 2jbp s TYR 229 Cb 0.00 -3.18 0.00 0.00 0.38 0.00 0.00 41.96 39.16 2jbp s TYR 229 CO 0.00 -2.70 0.00 1.33 -1.52 0.00 0.00 175.55 172.66 2jbp n VAL 230 N -4.12 0.00 -4.30 -3.49 0.24 -1.26 -5.17 118.33 100.23 2jbp n VAL 230 Ca 0.08 0.00 -0.16 0.00 -2.04 0.00 0.00 64.34 62.21 2jbp n VAL 230 Cb 0.54 0.00 -0.10 0.00 -1.47 0.00 0.00 33.84 32.81 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 -1.00 1.72 -0.68 2.33 0.00 -1.26 -5.07 121.76 117.80 2jbp s ALA 231 Ca 0.00 -1.59 0.25 0.00 0.00 0.00 0.00 51.96 50.62 2jbp s ALA 231 Cb 0.00 0.03 0.48 0.00 0.00 0.00 0.00 23.12 23.63 2jbp s ALA 231 CO 0.00 -0.04 1.45 -0.35 0.00 0.00 0.00 175.76 176.82 2jbp n PRO 232 N -0.29 0.27 -0.90 0.00 -0.04 -1.26 -2.50 135.00 130.28 2jbp n PRO 232 Ca -0.09 0.12 -0.08 0.00 -0.04 0.00 0.00 63.50 63.41 2jbp n PRO 232 Cb 0.61 -1.71 0.24 0.00 -0.04 0.00 0.00 33.50 32.60 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 -2.12 3.10 0.00 0.54 0.00 -1.26 -3.98 120.64 116.91 2jbp n GLU 233 Ca 0.04 -2.58 0.00 0.00 0.00 0.00 0.00 57.16 54.62 2jbp n GLU 233 Cb 0.43 -2.06 0.00 0.00 0.00 0.00 0.00 31.44 29.81 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 -0.22 0.00 1.73 3.84 0.31 -1.10 -4.69 118.33 118.20 2jbp n VAL 234 Ca 0.38 0.00 0.11 0.00 -0.01 0.00 0.00 64.34 64.82 2jbp n VAL 234 Cb 1.28 1.11 0.57 0.00 -0.91 0.00 0.00 33.84 35.90 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 0.00 0.63 0.00 7.52 4.77 -1.04 -4.87 117.00 124.01 2jbp n LEU 235 Ca 0.00 -0.25 0.00 0.00 -0.03 0.00 0.00 56.01 55.73 2jbp n LEU 235 Cb 0.06 -0.03 0.00 0.00 -2.33 0.00 0.00 43.42 41.12 2jbp n LEU 235 CO 0.00 0.12 0.00 0.61 -1.33 0.00 0.00 177.39 176.79 2jbp n GLY 236 N 0.97 4.61 0.00 -0.72 0.00 -1.26 -5.08 105.19 103.70 2jbp n GLY 236 Ca 0.17 -1.20 0.00 0.00 0.00 0.00 0.00 46.02 44.99 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 -1.94 -1.51 -3.00 1.61 -0.04 -1.26 -4.67 135.00 124.19 2jbp n PRO 237 Ca 0.00 0.00 0.04 0.00 -0.04 0.00 0.00 63.50 63.50 2jbp n PRO 237 Cb 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.46 2jbp n PRO 237 CO 0.00 0.00 0.00 -2.00 -0.04 0.00 0.00 175.50 173.46 2jbp s GLU 238 N -2.63 0.18 0.38 0.54 2.12 -1.26 -4.91 118.70 113.11 2jbp s GLU 238 Ca 0.00 0.05 -0.06 0.00 0.36 0.00 0.00 54.97 55.32 2jbp s GLU 238 Cb 0.00 0.05 0.10 0.00 0.26 0.00 0.00 34.13 34.54 2jbp s GLU 238 CO 0.00 -0.29 0.27 1.63 -0.54 0.00 0.00 175.26 176.33 2jbp n LYS 239 N 4.52 -2.35 -0.04 4.30 4.76 -1.26 -4.90 118.16 123.19 2jbp n LYS 239 Ca 0.08 -0.44 0.10 0.00 -2.87 0.00 0.00 58.31 55.19 2jbp n LYS 239 Cb 0.60 -0.50 0.48 0.00 -1.84 0.00 0.00 35.03 33.77 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 -3.55 0.10 -0.22 2.13 4.02 -1.26 -4.52 117.16 113.85 2jbp n TYR 240 Ca 0.04 -0.05 -0.01 0.00 -0.01 0.00 0.00 57.90 57.87 2jbp n TYR 240 Cb 0.17 0.00 0.06 0.00 -0.02 0.00 0.00 39.34 39.54 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 1.20 -0.76 -0.18 7.72 5.19 -2.00 0.13 116.42 127.73 2jbp h ASP 241 Ca 0.00 0.21 -0.01 0.00 -0.62 0.00 0.00 57.03 56.61 2jbp h ASP 241 Cb 0.26 0.46 -0.01 0.00 0.18 0.00 0.00 39.33 40.22 2jbp h ASP 241 CO 0.00 -0.24 0.08 0.11 -3.12 0.00 0.00 179.24 176.07 2jbp h LYS 242 N -0.04 0.27 -0.83 3.56 1.57 -1.96 -2.69 116.57 116.44 2jbp h LYS 242 Ca 0.30 -0.04 0.23 0.00 -1.87 0.00 0.00 60.65 59.26 2jbp h LYS 242 Cb 0.51 -0.05 -0.04 0.00 0.08 0.00 0.00 32.23 32.73 2jbp h LYS 242 CO -0.69 0.32 0.58 0.66 -0.57 0.00 0.00 179.45 179.75 2jbp h SER 243 N 0.15 0.09 -0.63 0.86 4.64 -1.31 1.30 113.55 118.65 2jbp h SER 243 Ca 0.06 0.01 0.13 0.00 -0.47 0.00 0.00 61.79 61.52 2jbp h SER 243 Cb 0.14 -0.01 -0.12 0.00 -0.31 0.00 0.00 62.40 62.11 2jbp h SER 243 CO -0.01 0.04 -0.17 0.00 -0.87 0.00 0.00 176.83 175.82 2jbp h ASP 245 N -0.01 0.29 -0.08 0.00 3.32 0.16 -2.60 116.42 117.50 2jbp h ASP 245 Ca 0.30 -0.10 0.01 0.00 0.02 0.00 0.00 57.03 57.26 2jbp h ASP 245 Cb 0.47 -0.07 -0.00 0.00 0.22 0.00 0.00 39.33 39.94 2jbp h ASP 245 CO -0.66 0.31 0.06 0.24 -1.72 0.00 0.00 179.24 177.47 2jbp h MET 246 N 0.26 0.09 0.47 3.56 2.86 -1.01 0.24 114.93 121.39 2jbp h MET 246 Ca 0.08 -0.01 -0.02 0.00 -2.06 0.00 0.00 59.70 57.69 2jbp h MET 246 Cb 0.09 -0.02 0.00 0.00 0.06 0.00 0.00 31.60 31.73 2jbp h MET 246 CO -0.01 0.06 -0.23 2.35 1.06 0.00 0.00 176.91 180.14 2jbp h TRP 247 N 0.09 -0.58 -0.85 -0.22 2.91 -1.01 -1.58 115.95 114.70 2jbp h TRP 247 Ca 0.03 -0.01 0.21 0.00 1.13 0.00 0.00 58.89 60.24 2jbp h TRP 247 Cb 0.02 0.19 -0.15 0.00 -0.51 0.00 0.00 29.16 28.71 2jbp h TRP 247 CO -0.00 -0.26 -0.01 0.77 -1.03 0.00 0.00 178.44 177.91 2jbp h SER 248 N -0.99 -0.44 -0.51 2.65 0.02 -0.94 0.42 113.55 113.76 2jbp h SER 248 Ca -0.06 0.23 0.04 0.00 -0.84 0.00 0.00 61.79 61.16 2jbp h SER 248 Cb 0.58 0.41 -0.04 0.00 0.14 0.00 0.00 62.40 63.50 2jbp h SER 248 CO 0.11 -0.25 0.26 0.25 -1.14 0.00 0.00 176.83 176.06 2jbp h LEU 249 N 0.07 0.38 -1.44 5.07 5.85 -0.86 0.14 115.31 124.51 2jbp h LEU 249 Ca 0.48 0.03 0.05 0.00 0.84 0.00 0.00 57.88 59.28 2jbp h LEU 249 Cb 0.89 -0.05 -0.04 0.00 0.37 0.00 0.00 40.66 41.83 2jbp h LEU 249 CO -0.78 0.26 0.43 1.23 -0.34 0.00 0.00 178.44 179.24 2jbp h GLY 250 N 0.51 0.85 0.73 3.75 0.00 0.81 -1.41 103.07 108.30 2jbp h GLY 250 Ca 0.22 -0.28 -0.09 0.00 0.00 0.00 0.00 47.33 47.19 2jbp h GLY 250 CO -0.15 0.22 -0.27 -2.08 0.00 0.00 0.00 176.54 174.27 2jbp h VAL 251 N 0.70 1.39 -0.73 4.60 2.07 0.75 -1.96 116.25 123.06 2jbp h VAL 251 Ca 0.27 -1.57 0.04 0.00 0.82 0.00 0.00 66.70 66.26 2jbp h VAL 251 Cb 0.20 2.13 -0.05 0.00 -1.52 0.00 0.00 31.29 32.04 2jbp h VAL 251 CO -0.08 0.46 0.44 0.40 0.02 0.00 0.00 177.57 178.81 2jbp h ILE 252 N -0.06 1.05 -0.49 4.57 2.04 -0.91 -1.29 117.51 122.42 2jbp h ILE 252 Ca -0.00 -0.29 -0.04 0.00 1.00 0.00 0.00 64.86 65.53 2jbp h ILE 252 Cb 0.87 0.14 -0.02 0.00 -0.74 0.00 0.00 36.82 37.07 2jbp h ILE 252 CO 0.06 0.15 0.15 -0.03 0.00 0.00 0.00 178.15 178.48 2jbp h MET 253 N 0.84 0.73 0.16 2.37 4.05 -1.17 0.31 114.93 122.22 2jbp h MET 253 Ca 0.31 -0.12 -0.01 0.00 -0.28 0.00 0.00 59.70 59.59 2jbp h MET 253 Cb 0.09 -0.12 0.00 0.00 -0.80 0.00 0.00 31.60 30.77 2jbp h MET 253 CO -0.14 0.64 -0.08 -0.92 0.23 0.00 0.00 176.91 176.64 2jbp h TYR 254 N 0.71 -0.20 -0.59 1.39 5.03 -0.55 -2.51 116.97 120.25 2jbp h TYR 254 Ca 0.17 -0.00 -0.03 0.00 2.58 0.00 0.00 58.73 61.44 2jbp h TYR 254 Cb 0.22 0.07 -0.03 0.00 1.55 0.00 0.00 36.73 38.53 2jbp h TYR 254 CO 0.01 -0.02 0.25 0.82 -1.32 0.00 0.00 178.16 177.90 2jbp h ILE 255 N -0.35 1.22 -0.85 1.81 2.04 -0.71 -1.51 117.51 119.16 2jbp h ILE 255 Ca -0.02 -0.69 0.23 0.00 1.00 0.00 0.00 64.86 65.38 2jbp h ILE 255 Cb 0.27 0.57 -0.04 0.00 -0.74 0.00 0.00 36.82 36.88 2jbp h ILE 255 CO 0.04 0.27 0.60 -0.07 0.00 0.00 0.00 178.15 178.98 2jbp h LEU 256 N 0.82 0.12 0.00 1.44 3.38 -0.16 0.20 115.31 121.11 2jbp h LEU 256 Ca 0.20 0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.18 2jbp h LEU 256 Cb 0.19 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 40.93 2jbp h LEU 256 CO -0.02 0.04 -0.77 -0.07 0.09 0.00 0.00 178.44 177.72 2jbp h LEU 257 N 0.11 0.00 0.00 1.67 3.38 -0.84 -3.41 115.31 116.23 2jbp h LEU 257 Ca 0.42 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.37 2jbp h LEU 257 Cb 1.47 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.22 2jbp h LEU 257 CO -0.06 0.01 0.00 0.00 0.09 0.00 0.00 178.44 178.48 2jbp n GLY 259 N 0.00 0.77 3.10 0.00 0.00 0.62 -4.32 105.19 105.37 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 -2.83 0.43 0.57 1.61 1.13 -1.26 -4.21 117.35 112.79 2jbp s TYR 260 Ca 0.00 -0.94 -0.15 0.00 -1.41 0.00 0.00 57.07 54.57 2jbp s TYR 260 Cb 0.00 -0.32 -0.05 0.00 -1.10 0.00 0.00 41.96 40.49 2jbp s TYR 260 CO 0.00 -0.39 1.03 -1.25 -2.51 0.00 0.00 175.55 172.42 2jbp s PRO 261 N -3.71 3.57 0.32 -3.49 0.04 -1.26 -3.93 135.00 126.54 2jbp s PRO 261 Ca 0.05 1.03 0.18 0.00 0.04 0.00 0.00 61.00 62.30 2jbp s PRO 261 Cb 0.06 -2.08 0.14 0.00 0.04 0.00 0.00 34.50 32.67 2jbp s PRO 261 CO -0.09 -0.59 1.47 -1.00 0.04 0.00 0.00 177.00 176.82 2jbp h PRO 262 N 0.44 0.00 -4.97 0.56 0.13 -1.93 -3.41 132.00 122.82 2jbp h PRO 262 Ca -0.46 0.00 -0.66 0.00 -0.87 0.00 0.00 66.00 64.01 2jbp h PRO 262 Cb 1.20 0.00 -0.26 0.00 0.13 0.00 0.00 31.00 32.07 2jbp h PRO 262 CO 0.59 0.32 -0.69 -0.06 -0.23 0.00 0.00 178.00 177.94 2jbp s PHE 263 N -3.05 3.01 0.00 1.56 0.40 -1.26 -4.65 117.98 113.99 2jbp s PHE 263 Ca 0.05 -0.79 0.00 0.00 -0.60 0.00 0.00 56.93 55.59 2jbp s PHE 263 Cb 0.07 -2.15 0.00 0.00 0.51 0.00 0.00 43.02 41.45 2jbp s PHE 263 CO 0.72 -0.49 0.00 0.66 0.70 0.00 0.00 175.22 176.81 2jbp n TYR 264 N 4.84 0.00 -2.75 0.36 0.53 -1.26 -5.11 117.16 113.77 2jbp n TYR 264 Ca -0.17 0.00 -0.03 0.00 -1.02 0.00 0.00 57.90 56.68 2jbp n TYR 264 Cb 0.51 0.00 -0.02 0.00 -1.03 0.00 0.00 39.34 38.80 2jbp n TYR 264 CO 0.00 0.00 0.00 1.51 -1.02 0.00 0.00 176.86 177.35 2jbp n ILE 271 N 0.00-10.45 0.00 -0.72 3.06 -1.26 -4.49 119.36 105.51 2jbp n ILE 271 Ca 0.00 1.97 0.00 0.00 -2.50 0.00 0.00 62.75 62.22 2jbp n ILE 271 Cb 0.00 -5.97 0.00 0.00 0.54 0.00 0.00 39.64 34.21 2jbp n ILE 271 CO 0.00 0.00 0.00 -0.24 -2.50 0.00 0.00 176.55 173.81 2jbp n SER 272 N 1.40 1.44 0.21 9.51 2.88 -1.26 -3.25 113.62 124.55 2jbp n SER 272 Ca -0.19 -0.03 0.13 0.00 -1.33 0.00 0.00 58.87 57.45 2jbp n SER 272 Cb 0.34 0.35 0.30 0.00 -0.75 0.00 0.00 64.21 64.45 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 -0.01 -1.46 0.11 -2.01 -3.34 132.00 125.29 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 -0.68 0.41 -0.21 0.00 0.00 178.00 177.52 2jbp n GLY 274 N 0.92 -0.72 0.09 -0.55 0.00 -1.26 -3.51 105.19 100.16 2jbp n GLY 274 Ca 0.04 -0.54 -0.16 0.00 0.00 0.00 0.00 46.02 45.35 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 0.80 0.13 -0.97 1.61 -1.53 -1.67 -1.58 114.93 111.72 2jbp h MET 275 Ca 0.00 -0.20 0.16 0.00 -3.44 0.00 0.00 59.70 56.23 2jbp h MET 275 Cb 0.57 0.07 -0.16 0.00 -0.55 0.00 0.00 31.60 31.52 2jbp h MET 275 CO 0.00 1.04 -0.34 1.17 0.14 0.00 0.00 176.91 178.92 2jbp n LYS 276 N -4.45 -0.19 0.08 0.39 4.81 -1.25 -1.10 118.16 116.45 2jbp n LYS 276 Ca -0.11 1.50 -0.10 0.00 -0.87 0.00 0.00 58.31 58.73 2jbp n LYS 276 Cb 0.58 -2.24 -0.02 0.00 0.02 0.00 0.00 35.03 33.37 2jbp n LYS 276 CO 0.00 0.00 0.00 1.15 1.17 0.00 0.00 177.40 179.72 2jbp h THR 277 N 0.00 1.48 0.00 3.15 2.02 -1.59 -1.77 112.91 116.20 2jbp h THR 277 Ca 0.37 -2.61 -0.05 0.00 0.77 0.00 0.00 66.41 64.89 2jbp h THR 277 Cb 0.62 2.48 -0.01 0.00 -1.74 0.00 0.00 68.15 69.50 2jbp h THR 277 CO -0.98 0.76 -0.24 0.03 0.37 0.00 0.00 175.52 175.47 2jbp h ARG 278 N 0.13 0.00 -0.13 6.66 3.08 -0.82 -0.31 114.38 122.99 2jbp h ARG 278 Ca -0.05 0.00 -0.06 0.00 0.07 0.00 0.00 59.98 59.94 2jbp h ARG 278 Cb 1.54 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 31.59 2jbp h ARG 278 CO 0.14 0.24 -0.15 0.82 -1.07 0.00 0.00 179.97 179.95 2jbp h ILE 279 N 0.00 1.36 -0.33 2.04 2.04 -0.84 0.18 117.51 121.96 2jbp h ILE 279 Ca -0.00 -1.33 -0.13 0.00 1.00 0.00 0.00 64.86 64.39 2jbp h ILE 279 Cb 0.69 1.94 -0.01 0.00 -0.74 0.00 0.00 36.82 38.70 2jbp h ILE 279 CO 0.03 0.39 -0.34 0.03 0.00 0.00 0.00 178.15 178.26 2jbp h ARG 280 N -0.06 0.73 0.00 2.37 3.08 -0.92 -2.96 114.38 116.62 2jbp h ARG 280 Ca 0.02 -0.35 -0.03 0.00 0.07 0.00 0.00 59.98 59.69 2jbp h ARG 280 Cb 0.69 -0.01 -0.00 0.00 0.08 0.00 0.00 29.97 30.73 2jbp h ARG 280 CO 0.04 0.96 -0.24 0.52 -1.07 0.00 0.00 179.97 180.18 2jbp h MET 281 N 0.61 0.00 -1.60 0.04 2.86 -1.12 -3.47 114.93 112.25 2jbp h MET 281 Ca 0.06 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.70 2jbp h MET 281 Cb 0.87 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.53 2jbp h MET 281 CO 0.08 0.14 0.00 0.41 1.06 0.00 0.00 176.91 178.60 2jbp n GLY 282 N 1.15 0.61 3.22 8.32 0.00 -0.46 -4.98 105.19 113.04 2jbp n GLY 282 Ca 0.03 -0.51 -0.42 0.00 0.00 0.00 0.00 46.02 45.12 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 -4.06 2.73 0.09 1.61 -0.21 0.51 -5.02 119.66 115.31 2jbp s GLN 283 Ca 0.00 -1.99 -0.01 0.00 0.02 0.00 0.00 55.36 53.38 2jbp s GLN 283 Cb 0.00 -4.02 -0.04 0.00 1.00 0.00 0.00 33.01 29.95 2jbp s GLN 283 CO 0.00 -1.22 0.00 1.52 -2.12 0.00 0.00 175.29 173.47 2jbp s TYR 284 N 0.98 0.69 0.38 0.91 1.13 -1.26 -4.79 117.35 115.39 2jbp s TYR 284 Ca 0.09 -1.13 0.04 0.00 -1.41 0.00 0.00 57.07 54.66 2jbp s TYR 284 Cb -0.23 -0.44 -0.06 0.00 -1.10 0.00 0.00 41.96 40.13 2jbp s TYR 284 CO -0.02 -0.42 0.05 -1.21 -2.51 0.00 0.00 175.55 171.44 2jbp s GLU 285 N -3.97 1.82 -0.78 -3.49 2.02 -1.26 -5.08 118.70 107.97 2jbp s GLU 285 Ca 0.14 -2.05 0.03 0.00 0.02 0.00 0.00 54.97 53.11 2jbp s GLU 285 Cb 0.08 -1.07 0.26 0.00 0.10 0.00 0.00 34.13 33.50 2jbp s GLU 285 CO -0.05 -0.22 0.95 1.19 0.02 0.00 0.00 175.26 177.15 2jbp n PHE 286 N -0.85 3.28 -1.60 1.61 3.01 -1.26 -5.02 117.46 116.63 2jbp n PHE 286 Ca -0.05 -3.71 -0.38 0.00 1.01 0.00 0.00 57.45 54.32 2jbp n PHE 286 Cb 0.66 -0.79 0.05 0.00 -0.01 0.00 0.00 39.48 39.39 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 1.09 0.90 -2.52 -1.08 -0.04 -1.26 -4.61 135.00 127.49 2jbp n PRO 287 Ca 0.28 0.35 -0.22 0.00 -0.04 0.00 0.00 63.50 63.86 2jbp n PRO 287 Cb 0.38 -2.12 0.05 0.00 -0.04 0.00 0.00 33.50 31.77 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 -1.20 5.11 0.47 3.54 -0.87 -1.26 -0.70 114.94 120.03 2jbp s ASN 288 Ca 0.74 0.10 0.27 0.00 -1.57 0.00 0.00 52.86 52.40 2jbp s ASN 288 Cb -0.43 -0.90 0.93 0.00 -0.02 0.00 0.00 41.25 40.83 2jbp s ASN 288 CO 0.48 -1.30 1.82 1.55 -2.57 0.00 0.00 177.10 177.09 2jbp h PRO 289 N -0.14 0.00 -0.03 -0.60 0.13 -2.01 -3.44 132.00 125.92 2jbp h PRO 289 Ca -0.42 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.71 2jbp h PRO 289 Cb 1.30 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.43 2jbp h PRO 289 CO 0.54 0.13 -0.01 0.39 -0.23 0.00 0.00 178.00 178.81 2jbp n GLU 290 N -3.23 -0.01 -0.24 0.86 -0.58 -1.24 0.33 120.64 116.53 2jbp n GLU 290 Ca 0.01 0.05 0.09 0.00 -0.42 0.00 0.00 57.16 56.89 2jbp n GLU 290 Cb 0.42 -0.07 0.22 0.00 -0.57 0.00 0.00 31.44 31.44 2jbp n GLU 290 CO 0.00 0.00 0.00 0.91 -0.48 0.00 0.00 177.13 177.56 2jbp n TRP 291 N -4.05 0.62 -0.13 -0.32 7.02 0.12 -4.58 117.44 116.13 2jbp n TRP 291 Ca 0.00 -0.42 -0.02 0.00 -1.02 0.00 0.00 57.50 56.04 2jbp n TRP 291 Cb 0.01 -0.01 0.21 0.00 -2.42 0.00 0.00 31.31 29.10 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 3.29 0.76 1.74 -0.99 4.64 0.51 -2.72 113.55 120.78 2jbp h SER 292 Ca 0.00 -0.12 0.00 0.00 -0.47 0.00 0.00 61.79 61.20 2jbp h SER 292 Cb 0.85 -0.20 0.00 0.00 -0.31 0.00 0.00 62.40 62.74 2jbp h SER 292 CO 0.00 0.73 0.00 -0.33 -0.87 0.00 0.00 176.83 176.36 2jbp h GLU 293 N 0.80 0.00 -6.30 4.77 4.39 -1.81 -3.47 114.58 112.95 2jbp h GLU 293 Ca 0.18 0.00 -0.55 0.00 0.34 0.00 0.00 59.36 59.34 2jbp h GLU 293 Cb 0.25 0.00 -0.03 0.00 -0.10 0.00 0.00 28.75 28.87 2jbp h GLU 293 CO -0.01 0.00 0.28 0.08 -1.16 0.00 0.00 179.01 178.21 2jbp s VAL 294 N -3.25 4.91 -0.02 3.13 1.01 -1.03 -5.00 120.40 120.14 2jbp s VAL 294 Ca 0.07 1.87 -0.37 0.00 0.00 0.00 0.00 61.98 63.55 2jbp s VAL 294 Cb 0.07 -4.23 -0.16 0.00 0.00 0.00 0.00 36.38 32.05 2jbp s VAL 294 CO 0.63 0.20 1.49 -0.24 0.00 0.00 0.00 175.10 177.18 2jbp n SER 295 N 3.81 2.02 0.18 3.32 2.88 -1.26 -4.87 113.62 119.70 2jbp n SER 295 Ca 0.04 1.10 0.17 0.00 -1.33 0.00 0.00 58.87 58.85 2jbp n SER 295 Cb 0.51 -1.20 0.79 0.00 -0.75 0.00 0.00 64.21 63.57 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 5.60 0.00 -0.42 -1.46 4.57 -1.98 0.12 114.58 121.00 2jbp h GLU 296 Ca -0.47 0.00 -0.04 0.00 -1.18 0.00 0.00 59.36 57.67 2jbp h GLU 296 Cb 1.32 0.00 -0.02 0.00 -0.16 0.00 0.00 28.75 29.90 2jbp h GLU 296 CO 0.84 0.00 0.12 1.49 -1.18 0.00 0.00 179.01 180.28 2jbp h GLU 297 N 0.00 0.67 0.23 1.92 4.81 -2.00 -2.28 114.58 117.93 2jbp h GLU 297 Ca 0.11 -0.15 -0.01 0.00 -0.13 0.00 0.00 59.36 59.17 2jbp h GLU 297 Cb 0.56 -0.09 0.00 0.00 0.63 0.00 0.00 28.75 29.85 2jbp h GLU 297 CO -0.00 0.67 -0.11 0.28 -0.73 0.00 0.00 179.01 179.12 2jbp h VAL 298 N 0.55 0.82 -0.77 0.32 2.07 -1.15 -2.53 116.25 115.55 2jbp h VAL 298 Ca 0.13 -0.23 0.17 0.00 0.82 0.00 0.00 66.70 67.60 2jbp h VAL 298 Cb 0.29 0.95 -0.12 0.00 -1.52 0.00 0.00 31.29 30.90 2jbp h VAL 298 CO -0.00 0.05 0.20 0.11 0.02 0.00 0.00 177.57 177.95 2jbp h LYS 299 N -0.42 0.27 -0.37 1.57 1.57 -1.38 0.39 116.57 118.19 2jbp h LYS 299 Ca -0.03 -0.02 -0.01 0.00 -1.87 0.00 0.00 60.65 58.72 2jbp h LYS 299 Cb 0.32 -0.06 -0.02 0.00 0.08 0.00 0.00 32.23 32.55 2jbp h LYS 299 CO 0.05 0.18 0.17 1.98 -0.57 0.00 0.00 179.45 181.25 2jbp h MET 300 N 0.28 0.51 0.81 3.15 4.05 -1.14 0.80 114.93 123.38 2jbp h MET 300 Ca 0.44 -0.06 -0.04 0.00 -0.28 0.00 0.00 59.70 59.77 2jbp h MET 300 Cb 0.78 -0.10 0.01 0.00 -0.80 0.00 0.00 31.60 31.49 2jbp h MET 300 CO -0.53 0.41 -0.39 1.25 0.23 0.00 0.00 176.91 177.88 2jbp h LEU 301 N 0.51 -0.92 -1.21 3.39 5.85 0.11 -2.18 115.31 120.88 2jbp h LEU 301 Ca 0.13 0.03 0.41 0.00 0.84 0.00 0.00 57.88 59.29 2jbp h LEU 301 Cb 0.08 0.24 -0.15 0.00 0.37 0.00 0.00 40.66 41.20 2jbp h LEU 301 CO -0.02 -0.57 0.71 0.40 -0.34 0.00 0.00 178.44 178.62 2jbp h ILE 302 N -1.26 0.12 -0.12 4.05 1.08 -0.51 0.37 117.51 121.25 2jbp h ILE 302 Ca -0.11 -0.04 -0.16 0.00 -0.39 0.00 0.00 64.86 64.16 2jbp h ILE 302 Cb 0.83 0.00 -0.01 0.00 -3.07 0.00 0.00 36.82 34.58 2jbp h ILE 302 CO 0.18 0.02 -0.60 0.03 -0.69 0.00 0.00 178.15 177.09 2jbp h ARG 303 N 0.11 0.40 0.00 2.37 3.08 -0.42 -1.43 114.38 118.49 2jbp h ARG 303 Ca 0.81 -0.27 0.00 0.00 0.07 0.00 0.00 59.98 60.59 2jbp h ARG 303 Cb 2.30 0.04 0.00 0.00 0.08 0.00 0.00 29.97 32.39 2jbp h ARG 303 CO -0.56 0.88 0.00 0.09 -1.07 0.00 0.00 179.97 179.31 2jbp n ASN 304 N -3.90 0.40 0.02 7.04 4.13 0.13 -3.12 115.26 119.95 2jbp n ASN 304 Ca -0.03 0.54 -0.20 0.00 1.68 0.00 0.00 54.58 56.57 2jbp n ASN 304 Cb 0.63 -0.64 -0.14 0.00 -1.54 0.00 0.00 39.78 38.08 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 0.40 -2.15 3.41 3.38 -1.04 -1.32 115.31 117.99 2jbp h LEU 305 Ca 0.00 -0.78 -0.06 0.00 0.09 0.00 0.00 57.88 57.13 2jbp h LEU 305 Cb 0.62 -0.13 -0.04 0.00 0.09 0.00 0.00 40.66 41.20 2jbp h LEU 305 CO 0.00 1.69 0.08 0.18 0.09 0.00 0.00 178.44 180.47 2jbp n LEU 306 N -3.45 3.19 -4.76 1.67 4.77 -0.57 -4.31 117.00 113.54 2jbp n LEU 306 Ca -0.27 -1.63 -0.41 0.00 -0.03 0.00 0.00 56.01 53.67 2jbp n LEU 306 Cb 1.05 -0.58 -0.02 0.00 -2.33 0.00 0.00 43.42 41.54 2jbp n LEU 306 CO 0.46 0.49 1.03 -0.54 -1.33 0.00 0.00 177.39 177.49 2jbp s LYS 307 N -1.42 4.32 0.17 3.23 -0.14 -1.19 -4.91 119.74 119.80 2jbp s LYS 307 Ca 0.19 2.24 0.01 0.00 -1.36 0.00 0.00 55.97 57.05 2jbp s LYS 307 Cb 0.15 -3.09 0.04 0.00 -1.68 0.00 0.00 37.83 33.24 2jbp s LYS 307 CO 0.05 -0.29 1.41 1.79 -0.76 0.00 0.00 175.35 177.55 2jbp h THR 308 N 3.28 1.45 -3.07 2.17 1.35 -1.91 -3.42 112.91 112.77 2jbp h THR 308 Ca -0.47 -2.42 -0.57 0.00 -0.55 0.00 0.00 66.41 62.39 2jbp h THR 308 Cb 1.22 2.33 -0.05 0.00 -1.73 0.00 0.00 68.15 69.91 2jbp h THR 308 CO 0.71 0.71 0.85 -0.70 -0.25 0.00 0.00 175.52 176.84 2jbp s GLU 309 N -3.37 4.20 0.27 4.72 2.56 -1.26 -4.93 118.70 120.90 2jbp s GLU 309 Ca -0.04 1.40 0.00 0.00 0.00 0.00 0.00 54.97 56.33 2jbp s GLU 309 Cb 0.10 -3.70 0.52 0.00 2.00 0.00 0.00 34.13 33.05 2jbp s GLU 309 CO 0.83 -0.72 1.83 -1.35 -0.56 0.00 0.00 175.26 175.29 2jbp h PRO 310 N 7.87 0.94 0.00 4.30 0.11 -1.98 -2.19 132.00 141.05 2jbp h PRO 310 Ca -0.22 -0.06 -0.19 0.00 0.11 0.00 0.00 66.00 65.65 2jbp h PRO 310 Cb 1.07 -0.21 -0.03 0.00 0.11 0.00 0.00 31.00 31.95 2jbp h PRO 310 CO 0.99 0.62 -0.91 1.79 -0.21 0.00 0.00 178.00 180.28 2jbp h THR 311 N 0.97 1.58 0.00 -1.15 1.35 -1.95 -2.47 112.91 111.24 2jbp h THR 311 Ca 0.48 -3.20 -0.00 0.00 -0.55 0.00 0.00 66.41 63.14 2jbp h THR 311 Cb 0.45 2.76 -0.00 0.00 -1.73 0.00 0.00 68.15 69.63 2jbp h THR 311 CO -0.26 0.89 -0.01 1.56 -0.25 0.00 0.00 175.52 177.46 2jbp h GLN 312 N 0.00 0.00 -6.96 4.72 4.20 -1.80 -3.45 115.11 111.82 2jbp h GLN 312 Ca -0.01 0.00 -0.48 0.00 0.06 0.00 0.00 58.65 58.22 2jbp h GLN 312 Cb 1.69 0.00 0.02 0.00 0.30 0.00 0.00 27.48 29.49 2jbp h GLN 312 CO 0.12 0.01 0.41 0.50 -0.67 0.00 0.00 178.83 179.20 2jbp s ARG 313 N -4.09 4.17 0.65 1.46 3.52 -0.93 -4.99 118.95 118.74 2jbp s ARG 313 Ca -0.04 1.52 -0.18 0.00 -0.13 0.00 0.00 55.73 56.90 2jbp s ARG 313 Cb 0.12 -2.55 -0.02 0.00 -1.56 0.00 0.00 34.95 30.95 2jbp s ARG 313 CO 0.45 -0.14 1.11 -0.12 -0.81 0.00 0.00 175.30 175.80 2jbp n MET 314 N -0.06 0.89 -3.82 5.12 0.00 -0.50 -5.02 117.12 113.74 2jbp n MET 314 Ca 0.05 0.36 -0.24 0.00 -0.00 0.00 0.00 57.70 57.87 2jbp n MET 314 Cb 0.50 -2.34 -0.02 0.00 0.00 0.00 0.00 33.22 31.35 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 -1.53 5.24 0.54 1.12 -4.23 -1.26 -4.89 115.64 110.63 2jbp s THR 315 Ca 0.79 -0.72 0.25 0.00 -1.18 0.00 0.00 61.69 60.82 2jbp s THR 315 Cb -0.38 -3.81 0.38 0.00 1.34 0.00 0.00 72.50 70.02 2jbp s THR 315 CO 0.44 -0.28 2.02 -0.29 -0.54 0.00 0.00 174.62 175.98 2jbp h ILE 316 N 1.28 0.72 0.23 2.99 6.09 -1.97 -1.47 117.51 125.38 2jbp h ILE 316 Ca -0.50 0.00 -0.01 0.00 -1.37 0.00 0.00 64.86 62.98 2jbp h ILE 316 Cb 1.21 0.78 0.00 0.00 0.47 0.00 0.00 36.82 39.28 2jbp h ILE 316 CO 0.64 0.00 -0.11 0.74 -3.07 0.00 0.00 178.15 176.35 2jbp h THR 317 N 0.00 0.75 -0.98 2.19 2.02 -1.98 -1.52 112.91 113.38 2jbp h THR 317 Ca 0.20 -0.89 0.21 0.00 0.77 0.00 0.00 66.41 66.70 2jbp h THR 317 Cb 0.83 1.20 -0.09 0.00 -1.74 0.00 0.00 68.15 68.34 2jbp h THR 317 CO -0.00 0.17 0.62 -0.33 0.37 0.00 0.00 175.52 176.35 2jbp h GLU 318 N -0.83 0.56 -0.29 6.66 5.08 -1.81 -1.02 114.58 122.94 2jbp h GLU 318 Ca -0.03 -0.03 -0.05 0.00 -1.00 0.00 0.00 59.36 58.24 2jbp h GLU 318 Cb 0.51 -0.13 -0.01 0.00 0.50 0.00 0.00 28.75 29.63 2jbp h GLU 318 CO 0.05 0.37 -0.02 0.35 -1.00 0.00 0.00 179.01 178.76 2jbp h PHE 319 N 0.58 0.58 0.00 4.33 3.04 -1.20 0.09 116.94 124.35 2jbp h PHE 319 Ca 0.55 -0.11 0.00 0.00 3.98 0.00 0.00 57.97 62.39 2jbp h PHE 319 Cb 1.12 -0.15 0.00 0.00 2.56 0.00 0.00 35.95 39.48 2jbp h PHE 319 CO -0.00 0.69 0.00 0.52 -2.02 0.00 0.00 178.31 177.49 2jbp h MET 320 N 0.31 0.00 0.00 1.11 2.86 -0.16 -2.87 114.93 116.18 2jbp h MET 320 Ca 0.08 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.72 2jbp h MET 320 Cb 0.47 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.13 2jbp h MET 320 CO 0.02 0.00 -1.33 0.09 1.06 0.00 0.00 176.91 176.75 2jbp n ASN 321 N -2.59 0.51 -4.78 1.22 3.02 -0.52 -4.03 115.26 108.10 2jbp n ASN 321 Ca 0.02 -0.27 -0.41 0.00 -0.03 0.00 0.00 54.58 53.89 2jbp n ASN 321 Cb 0.31 1.20 -0.01 0.00 -0.61 0.00 0.00 39.78 40.67 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 -3.27 2.77 0.28 3.10 2.46 -0.02 -4.70 115.29 115.91 2jbp s HIS 322 Ca 0.01 1.27 -0.01 0.00 0.47 0.00 0.00 55.06 56.79 2jbp s HIS 322 Cb 0.14 -3.88 0.40 0.00 -0.13 0.00 0.00 32.58 29.11 2jbp s HIS 322 CO 0.85 -2.54 1.83 -1.35 -2.47 0.00 0.00 174.74 171.06 2jbp h PRO 323 N 3.13 0.84 -0.08 2.88 0.11 -1.91 -0.25 132.00 136.72 2jbp h PRO 323 Ca -0.50 -0.16 0.02 0.00 0.11 0.00 0.00 66.00 65.47 2jbp h PRO 323 Cb 1.23 -0.13 -0.00 0.00 0.11 0.00 0.00 31.00 32.21 2jbp h PRO 323 CO 0.65 0.75 0.10 2.35 -0.21 0.00 0.00 178.00 181.63 2jbp h TRP 324 N 0.81 0.00 0.00 0.65 7.01 -1.90 -2.23 115.95 120.30 2jbp h TRP 324 Ca 0.18 0.00 -0.20 0.00 2.11 0.00 0.00 58.89 60.98 2jbp h TRP 324 Cb 0.27 0.00 -0.03 0.00 -2.10 0.00 0.00 29.16 27.30 2jbp h TRP 324 CO 0.02 0.00 -1.51 -0.89 -2.79 0.00 0.00 178.44 173.27 2jbp n ILE 325 N -3.71 1.50 0.04 2.65 2.08 -0.39 -4.38 119.36 117.15 2jbp n ILE 325 Ca -0.01 -0.06 0.01 0.00 0.56 0.00 0.00 62.75 63.26 2jbp n ILE 325 Cb 0.20 -2.15 0.35 0.00 -0.75 0.00 0.00 39.64 37.29 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 -1.00 0.43 -3.21 0.38 4.05 -1.01 -3.12 114.93 111.45 2jbp h MET 326 Ca -0.30 -0.08 -0.66 0.00 -0.28 0.00 0.00 59.70 58.38 2jbp h MET 326 Cb 1.19 -0.07 -0.39 0.00 -0.80 0.00 0.00 31.60 31.53 2jbp h MET 326 CO -0.18 0.46 -0.33 -0.65 0.23 0.00 0.00 176.91 176.44 2jbp s GLN 327 N -4.99 2.88 0.33 0.39 -0.21 -0.85 -4.91 119.66 112.29 2jbp s GLN 327 Ca -0.07 -3.31 0.19 0.00 0.02 0.00 0.00 55.36 52.19 2jbp s GLN 327 Cb 0.16 -3.70 0.16 0.00 1.00 0.00 0.00 33.01 30.63 2jbp s GLN 327 CO 0.75 -1.27 1.44 0.66 -2.12 0.00 0.00 175.29 174.75 2jbp h SER 328 N 5.72 0.00 1.14 5.90 4.64 -1.74 -3.15 113.55 126.06 2jbp h SER 328 Ca 0.15 0.00 -0.04 0.00 -0.47 0.00 0.00 61.79 61.43 2jbp h SER 328 Cb 0.79 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.87 2jbp h SER 328 CO 0.79 0.26 -0.89 0.71 -0.87 0.00 0.00 176.83 176.83 2jbp h THR 329 N 0.00 0.15 0.00 2.95 1.35 -1.91 -2.52 112.91 112.93 2jbp h THR 329 Ca -0.01 -1.27 0.00 0.00 -0.55 0.00 0.00 66.41 64.58 2jbp h THR 329 Cb 1.21 1.74 0.00 0.00 -1.73 0.00 0.00 68.15 69.37 2jbp h THR 329 CO 0.03 0.09 0.00 0.29 -0.25 0.00 0.00 175.52 175.68 2jbp n LYS 330 N -2.82 0.60 -3.36 4.72 4.76 -1.19 -4.73 118.16 116.14 2jbp n LYS 330 Ca -0.01 0.00 -0.37 0.00 -2.87 0.00 0.00 58.31 55.06 2jbp n LYS 330 Cb 0.62 -1.17 -0.06 0.00 -1.84 0.00 0.00 35.03 32.57 2jbp n LYS 330 CO 0.00 0.00 0.00 0.08 -1.37 0.00 0.00 177.40 176.11 2jbp s VAL 331 N -2.00 4.85 0.19 -0.18 1.01 -0.95 -5.04 120.40 118.27 2jbp s VAL 331 Ca 0.10 0.98 -0.32 0.00 0.00 0.00 0.00 61.98 62.74 2jbp s VAL 331 Cb 0.05 -3.80 -0.15 0.00 0.00 0.00 0.00 36.38 32.48 2jbp s VAL 331 CO 0.08 0.44 1.24 -2.65 0.00 0.00 0.00 175.10 174.20 2jbp n PRO 332 N 1.39 1.41 -0.03 2.72 -0.02 -1.26 -4.68 135.00 134.54 2jbp n PRO 332 Ca -0.09 0.50 0.01 0.00 -2.02 0.00 0.00 63.50 61.90 2jbp n PRO 332 Cb 0.51 -2.05 0.02 0.00 -0.02 0.00 0.00 33.50 31.97 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 1.85 1.12 -1.62 -0.52 1.13 -1.26 -1.87 117.38 116.21 2jbp n GLN 333 Ca 0.14 -0.17 -0.45 0.00 -1.94 0.00 0.00 57.00 54.59 2jbp n GLN 333 Cb 0.26 -1.10 -0.02 0.00 0.11 0.00 0.00 30.24 29.50 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 -0.32 1.76 -3.04 5.09 5.66 -1.26 -4.52 114.28 117.65 2jbp n THR 334 Ca 0.02 -0.44 -0.35 0.00 -3.05 0.00 0.00 64.05 60.22 2jbp n THR 334 Cb 0.07 -1.13 -0.06 0.00 -1.55 0.00 0.00 70.33 67.66 2jbp n THR 334 CO 0.00 0.00 0.00 -2.16 -3.05 0.00 0.00 175.07 169.86 2jbp s PRO 335 N -1.35 4.24 0.45 1.09 0.05 -1.26 0.60 135.00 138.82 2jbp s PRO 335 Ca 0.61 0.91 0.06 0.00 0.05 0.00 0.00 61.00 62.63 2jbp s PRO 335 Cb -0.69 -2.71 -0.03 0.00 0.05 0.00 0.00 34.50 31.12 2jbp s PRO 335 CO 0.58 0.29 0.18 -0.51 0.05 0.00 0.00 177.00 177.59 2jbp s LEU 336 N -2.31 2.89 0.00 -3.56 2.01 -0.83 -4.82 118.68 112.06 2jbp s LEU 336 Ca 0.48 -1.23 0.28 0.00 0.01 0.00 0.00 54.13 53.68 2jbp s LEU 336 Cb -0.15 -1.24 1.15 0.00 0.01 0.00 0.00 46.19 45.96 2jbp s LEU 336 CO 0.20 -0.69 1.80 1.41 1.01 0.00 0.00 176.35 180.08 2jbp n HIS 337 N -1.32 0.00 -0.34 0.29 8.25 -1.26 -4.21 115.22 116.63 2jbp n HIS 337 Ca -0.04 0.00 -0.01 0.00 -0.26 0.00 0.00 57.72 57.41 2jbp n HIS 337 Cb 0.65 -0.04 0.15 0.00 1.12 0.00 0.00 29.99 31.87 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 1.66 1.23 0.09 1.59 2.02 -1.79 -2.22 112.91 115.48 2jbp h THR 338 Ca 0.00 -0.44 -0.00 0.00 0.77 0.00 0.00 66.41 66.74 2jbp h THR 338 Cb 0.41 -0.15 0.00 0.00 -1.74 0.00 0.00 68.15 66.68 2jbp h THR 338 CO 0.00 0.23 -0.04 -1.28 0.37 0.00 0.00 175.52 174.80 2jbp h SER 339 N 1.27 -0.10 -0.55 4.18 0.87 -1.86 -0.08 113.55 117.29 2jbp h SER 339 Ca 0.35 -0.39 0.11 0.00 -1.23 0.00 0.00 61.79 60.63 2jbp h SER 339 Cb -0.12 0.03 -0.11 0.00 -0.44 0.00 0.00 62.40 61.75 2jbp h SER 339 CO -0.08 0.36 -0.19 -0.09 -0.53 0.00 0.00 176.83 176.31 2jbp h ARG 340 N -0.59 -0.05 -0.05 2.24 2.43 -1.87 -2.43 114.38 114.05 2jbp h ARG 340 Ca -0.01 0.00 -0.18 0.00 -0.81 0.00 0.00 59.98 58.98 2jbp h ARG 340 Cb 0.49 0.01 -0.01 0.00 -0.42 0.00 0.00 29.97 30.04 2jbp h ARG 340 CO 0.02 -0.03 -0.74 0.28 -1.51 0.00 0.00 179.97 177.99 2jbp h VAL 341 N -0.05 1.41 -0.75 0.20 2.07 -1.28 -1.63 116.25 116.21 2jbp h VAL 341 Ca 0.26 -2.23 0.05 0.00 0.82 0.00 0.00 66.70 65.60 2jbp h VAL 341 Cb 0.45 2.18 -0.04 0.00 -1.52 0.00 0.00 31.29 32.36 2jbp h VAL 341 CO -0.59 0.66 0.49 -0.07 0.02 0.00 0.00 177.57 178.08 2jbp h LEU 342 N 0.20 0.74 0.14 2.57 -0.00 -0.82 -3.34 115.31 114.80 2jbp h LEU 342 Ca -0.03 -0.00 -0.01 0.00 -0.00 0.00 0.00 57.88 57.84 2jbp h LEU 342 Cb 1.31 -0.16 0.00 0.00 -0.00 0.00 0.00 40.66 41.81 2jbp h LEU 342 CO 0.12 0.49 -0.07 0.50 -0.00 0.00 0.00 178.44 179.48 2jbp h LYS 343 N 0.85 -0.19 -5.39 1.13 3.64 -0.89 -3.34 116.57 112.38 2jbp h LYS 343 Ca 0.31 0.01 -0.70 0.00 -1.27 0.00 0.00 60.65 59.01 2jbp h LYS 343 Cb 0.16 0.04 -0.12 0.00 -0.41 0.00 0.00 32.23 31.90 2jbp h LYS 343 CO -0.10 -0.06 1.76 -2.00 -2.27 0.00 0.00 179.45 176.77 2jbp s GLU 344 N -2.27 3.99 0.00 1.90 -6.30 -0.68 -3.94 118.70 111.40 2jbp s GLU 344 Ca -0.04 -2.17 0.00 0.00 -2.50 0.00 0.00 54.97 50.26 2jbp s GLU 344 Cb 0.00 -5.31 0.00 0.00 0.00 0.00 0.00 34.13 28.82 2jbp s GLU 344 CO 0.14 -2.04 0.00 -3.47 0.02 0.00 0.00 175.26 169.91 2jbp n ASP 345 N 7.24 0.00 -0.24 -1.70 2.03 -1.26 -4.82 116.55 117.80 2jbp n ASP 345 Ca 0.42 0.00 -0.08 0.00 0.52 0.00 0.00 54.79 55.65 2jbp n ASP 345 Cb 0.45 0.00 -0.07 0.00 -0.72 0.00 0.00 41.12 40.79 2jbp n ASP 345 CO 0.00 0.00 0.00 0.11 -1.92 0.00 0.00 177.20 175.39 2jbp h LYS 346 N 0.00 -0.04 0.00 -0.67 1.57 -1.68 -3.52 116.57 112.22 2jbp h LYS 346 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 2jbp h LYS 346 Cb 0.00 0.01 0.00 0.00 0.08 0.00 0.00 32.23 32.32 2jbp h LYS 346 CO 0.00 -0.03 0.00 -1.91 -0.57 0.00 0.00 179.45 176.94