#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jbp n HIS 47 N 0.00 3.17 -4.52 -5.13 8.25 -1.26 -5.02 115.22 110.71 2jbp n HIS 47 Ca 0.00 -4.23 -0.34 0.00 -0.26 0.00 0.00 57.72 52.90 2jbp n HIS 47 Cb 0.00 -0.57 -0.12 0.00 1.12 0.00 0.00 29.99 30.42 2jbp n HIS 47 CO 0.00 0.00 0.00 0.54 0.64 0.00 0.00 176.34 177.52 2jbp s VAL 48 N -1.70 3.73 0.31 1.59 0.11 -1.26 -5.13 120.40 118.06 2jbp s VAL 48 Ca 0.30 -0.43 0.08 0.00 -2.93 0.00 0.00 61.98 58.99 2jbp s VAL 48 Cb 0.02 -2.59 -0.06 0.00 -1.53 0.00 0.00 36.38 32.22 2jbp s VAL 48 CO -0.13 0.53 -0.08 -0.54 -3.33 0.00 0.00 175.10 171.56 2jbp s LYS 49 N -0.04 1.69 0.67 1.54 -0.14 -1.26 -5.13 119.74 117.06 2jbp s LYS 49 Ca 0.00 -1.86 -0.17 0.00 -1.36 0.00 0.00 55.97 52.58 2jbp s LYS 49 Cb -0.13 -1.43 0.00 0.00 -1.68 0.00 0.00 37.83 34.59 2jbp s LYS 49 CO 0.03 0.09 1.27 0.45 -0.76 0.00 0.00 175.35 176.42 2jbp s SER 50 N -3.53 4.50 0.88 2.83 0.15 -1.26 -5.06 113.70 112.21 2jbp s SER 50 Ca 0.31 2.54 -0.12 0.00 0.70 0.00 0.00 55.95 59.39 2jbp s SER 50 Cb 0.03 -2.61 0.17 0.00 -1.71 0.00 0.00 66.02 61.90 2jbp s SER 50 CO 0.14 -2.07 1.22 -0.83 1.20 0.00 0.00 173.24 172.90 2jbp s GLY 51 N -1.57 1.76 -0.33 9.45 0.00 -1.26 -5.02 107.32 110.35 2jbp s GLY 51 Ca 0.80 -1.26 -0.22 0.00 0.00 0.00 0.00 44.72 44.05 2jbp s GLY 51 CO 0.41 -0.58 0.71 -2.27 0.00 0.00 0.00 173.10 171.37 2jbp s LEU 52 N -5.66 4.15 -0.64 0.66 2.96 -1.26 -5.00 118.68 113.88 2jbp s LEU 52 Ca 0.71 0.42 -0.16 0.00 -0.22 0.00 0.00 54.13 54.88 2jbp s LEU 52 Cb -0.05 -2.92 0.15 0.00 0.50 0.00 0.00 46.19 43.87 2jbp s LEU 52 CO 0.50 -0.59 0.62 -1.58 -1.32 0.00 0.00 176.35 173.98 2jbp s GLN 53 N 2.83 3.18 0.02 1.98 2.00 -1.26 -5.04 119.66 123.37 2jbp s GLN 53 Ca 0.28 -1.88 -0.30 0.00 -2.00 0.00 0.00 55.36 51.46 2jbp s GLN 53 Cb -0.14 -4.35 -0.07 0.00 0.80 0.00 0.00 33.01 29.25 2jbp s GLN 53 CO 0.14 -1.36 1.61 0.42 -0.50 0.00 0.00 175.29 175.60 2jbp s ILE 54 N 1.36 3.33 0.33 -2.34 -1.09 -1.26 -4.64 121.20 116.88 2jbp s ILE 54 Ca 0.09 0.66 -0.27 0.00 -2.23 0.00 0.00 60.65 58.90 2jbp s ILE 54 Cb -0.23 -3.42 -0.09 0.00 -1.58 0.00 0.00 42.46 37.13 2jbp s ILE 54 CO -0.00 -0.02 1.02 -0.54 -1.23 0.00 0.00 174.94 174.17 2jbp s LYS 55 N 3.07 4.49 -0.01 2.79 1.02 0.02 -4.87 119.74 126.25 2jbp s LYS 55 Ca 0.72 1.55 0.15 0.00 0.02 0.00 0.00 55.97 58.41 2jbp s LYS 55 Cb -0.36 -2.88 -0.20 0.00 -0.52 0.00 0.00 37.83 33.87 2jbp s LYS 55 CO 0.31 0.14 0.44 1.63 -0.92 0.00 0.00 175.35 176.95 2jbp n LYS 56 N 0.64 1.20 -1.94 1.68 4.76 -1.26 -0.47 118.16 122.76 2jbp n LYS 56 Ca 0.02 -0.08 -0.38 0.00 -2.87 0.00 0.00 58.31 55.00 2jbp n LYS 56 Cb 0.48 -1.28 0.03 0.00 -1.84 0.00 0.00 35.03 32.42 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 -3.15 5.45 0.20 4.39 4.22 -1.26 -4.73 114.94 120.06 2jbp s ASN 57 Ca -0.01 2.57 -0.28 0.00 -2.14 0.00 0.00 52.86 53.00 2jbp s ASN 57 Cb 0.10 -2.62 -0.17 0.00 1.28 0.00 0.00 41.25 39.84 2jbp s ASN 57 CO 0.60 -1.43 0.58 0.00 -2.04 0.00 0.00 177.10 174.81 2jbp n ALA 58 N -1.04 -2.68 0.20 3.54 0.00 -1.26 -4.80 120.51 114.47 2jbp n ALA 58 Ca 0.10 0.44 0.09 0.00 0.00 0.00 0.00 53.44 54.08 2jbp n ALA 58 Cb 0.47 -1.65 0.22 0.00 0.00 0.00 0.00 19.45 18.49 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 1.15 0.35 0.00 0.00 2.10 -1.95 -3.13 117.51 116.03 2jbp h ILE 59 Ca -0.30 -1.36 -0.10 0.00 1.08 0.00 0.00 64.86 64.19 2jbp h ILE 59 Cb 1.43 2.05 -0.01 0.00 -1.09 0.00 0.00 36.82 39.20 2jbp h ILE 59 CO 0.58 0.19 -0.47 0.16 -1.08 0.00 0.00 178.15 177.52 2jbp h ILE 60 N 0.00 1.28 -0.80 2.19 3.07 -1.87 -0.55 117.51 120.83 2jbp h ILE 60 Ca -0.00 -1.64 0.33 0.00 1.55 0.00 0.00 64.86 65.10 2jbp h ILE 60 Cb 1.04 1.90 -0.14 0.00 -0.27 0.00 0.00 36.82 39.34 2jbp h ILE 60 CO 0.02 0.46 0.43 0.47 -1.05 0.00 0.00 178.15 178.48 2jbp n ASP 61 N -3.90 0.28 -0.00 2.16 10.43 -1.18 -3.00 116.55 121.34 2jbp n ASP 61 Ca -0.01 1.33 0.04 0.00 2.57 0.00 0.00 54.79 58.71 2jbp n ASP 61 Cb 0.50 -0.65 -0.06 0.00 1.84 0.00 0.00 41.12 42.76 2jbp n ASP 61 CO 0.00 0.00 0.00 0.47 -1.07 0.00 0.00 177.20 176.60 2jbp n ASP 62 N -4.81 2.15 -3.93 -2.24 8.00 -0.26 -4.93 116.55 110.53 2jbp n ASP 62 Ca 0.30 -0.24 -0.11 0.00 0.71 0.00 0.00 54.79 55.45 2jbp n ASP 62 Cb 1.03 1.24 -0.13 0.00 -0.02 0.00 0.00 41.12 43.24 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 -2.28 0.15 -0.18 1.24 2.02 -0.92 -0.80 117.35 116.57 2jbp s TYR 63 Ca -0.01 -0.25 -0.25 0.00 -0.37 0.00 0.00 57.07 56.19 2jbp s TYR 63 Cb 0.06 -0.10 -0.01 0.00 -0.40 0.00 0.00 41.96 41.50 2jbp s TYR 63 CO 0.34 -0.09 0.84 0.21 -1.57 0.00 0.00 175.55 175.28 2jbp s LYS 64 N -0.69 4.28 -0.40 -0.62 2.47 0.13 -4.44 119.74 120.48 2jbp s LYS 64 Ca -0.07 1.02 -0.13 0.00 -1.56 0.00 0.00 55.97 55.23 2jbp s LYS 64 Cb -0.05 -3.58 0.03 0.00 -1.46 0.00 0.00 37.83 32.77 2jbp s LYS 64 CO -0.00 -0.36 0.25 0.08 0.16 0.00 0.00 175.35 175.48 2jbp s VAL 65 N 2.25 4.87 0.72 4.02 1.01 -1.26 -1.33 120.40 130.68 2jbp s VAL 65 Ca 0.38 -0.81 -0.06 0.00 0.00 0.00 0.00 61.98 61.49 2jbp s VAL 65 Cb -0.16 -3.74 0.15 0.00 0.00 0.00 0.00 36.38 32.63 2jbp s VAL 65 CO 0.12 -0.29 0.99 0.35 0.00 0.00 0.00 175.10 176.26 2jbp n THR 66 N 5.07 0.00 0.22 3.92 -2.24 -1.15 -5.04 114.28 115.06 2jbp n THR 66 Ca -0.11 -1.18 0.03 0.00 -2.27 0.00 0.00 64.05 60.52 2jbp n THR 66 Cb 0.46 -1.19 0.03 0.00 -2.10 0.00 0.00 70.33 67.53 2jbp n THR 66 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 2jbp n SER 67 N -3.24 1.62 -4.56 3.42 3.41 -1.26 -4.68 113.62 108.32 2jbp n SER 67 Ca 0.14 -1.33 -0.41 0.00 -0.26 0.00 0.00 58.87 57.01 2jbp n SER 67 Cb 0.51 -0.01 -0.04 0.00 -0.26 0.00 0.00 64.21 64.41 2jbp n SER 67 CO 0.00 0.00 0.00 1.67 -0.16 0.00 0.00 175.04 176.55 2jbp n GLN 68 N 0.32 1.43 -2.54 4.33 7.27 -1.26 -4.92 117.38 122.02 2jbp n GLN 68 Ca 0.04 0.28 -0.43 0.00 0.07 0.00 0.00 57.00 56.96 2jbp n GLN 68 Cb 0.17 -3.18 -0.02 0.00 2.41 0.00 0.00 30.24 29.63 2jbp n GLN 68 CO 0.00 0.00 0.00 0.54 0.07 0.00 0.00 177.06 177.67 2jbp s VAL 69 N 9.79 4.39 -0.42 1.69 0.11 -1.26 -1.98 120.40 132.72 2jbp s VAL 69 Ca 1.02 1.62 0.05 0.00 -2.93 0.00 0.00 61.98 61.75 2jbp s VAL 69 Cb -0.36 -4.25 0.69 0.00 -1.53 0.00 0.00 36.38 30.93 2jbp s VAL 69 CO 0.34 -0.37 1.90 0.00 -3.33 0.00 0.00 175.10 173.64 2jbp n LEU 70 N 6.95 6.62 0.00 2.54 -0.00 -0.50 -4.97 117.00 127.64 2jbp n LEU 70 Ca 0.13 -3.53 0.00 0.00 -0.00 0.00 0.00 56.01 52.61 2jbp n LEU 70 Cb 0.46 -0.82 0.00 0.00 -0.00 0.00 0.00 43.42 43.06 2jbp n LEU 70 CO 0.59 1.00 0.00 0.61 -0.00 0.00 0.00 177.39 179.58 2jbp n GLY 71 N -0.93 4.03 3.59 1.47 0.00 -1.23 -4.94 105.19 107.18 2jbp n GLY 71 Ca 0.56 -1.04 -0.34 0.00 0.00 0.00 0.00 46.02 45.20 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 3.18 0.47 0.99 1.02 -1.26 -0.59 118.68 122.49 2jbp s LEU 72 Ca 0.00 -0.03 0.07 0.00 0.02 0.00 0.00 54.13 54.19 2jbp s LEU 72 Cb 0.00 -1.71 -0.00 0.00 0.02 0.00 0.00 46.19 44.50 2jbp s LEU 72 CO 0.00 0.36 0.36 -0.83 0.02 0.00 0.00 176.35 176.26 2jbp s GLY 73 N -0.87 2.26 0.57 -3.19 0.00 -0.98 -4.97 107.32 100.15 2jbp s GLY 73 Ca 0.13 -1.69 0.27 0.00 0.00 0.00 0.00 44.72 43.43 2jbp s GLY 73 CO 0.02 -1.83 2.02 0.16 0.00 0.00 0.00 173.10 173.47 2jbp h ILE 74 N 0.97 0.52 -2.89 0.90 -0.00 -1.98 -3.32 117.51 111.71 2jbp h ILE 74 Ca -0.39 0.00 -0.54 0.00 -0.00 0.00 0.00 64.86 63.93 2jbp h ILE 74 Cb 1.28 0.76 -0.40 0.00 -0.00 0.00 0.00 36.82 38.46 2jbp h ILE 74 CO 0.59 0.00 -0.77 0.54 -0.00 0.00 0.00 178.15 178.51 2jbp s ASN 75 N -5.78 3.55 0.47 2.16 6.03 -1.26 -5.10 114.94 115.01 2jbp s ASN 75 Ca -0.05 -1.30 0.00 0.00 -1.03 0.00 0.00 52.86 50.48 2jbp s ASN 75 Cb 0.16 -0.45 0.00 0.00 -3.03 0.00 0.00 41.25 37.93 2jbp s ASN 75 CO 0.60 -0.43 0.00 0.61 -2.03 0.00 0.00 177.10 175.85 2jbp n GLY 76 N 5.17 -3.41 0.00 0.45 0.00 -1.25 -4.84 105.19 101.32 2jbp n GLY 76 Ca -0.05 -1.08 0.00 0.00 0.00 0.00 0.00 46.02 44.89 2jbp n GLY 76 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 2jbp n LYS 77 N -3.33 2.79 -4.38 1.61 0.00 -1.26 -2.31 118.16 111.28 2jbp n LYS 77 Ca -0.05 0.00 -0.21 0.00 -0.00 0.00 0.00 58.31 58.05 2jbp n LYS 77 Cb 0.48 0.00 -0.16 0.00 -0.00 0.00 0.00 35.03 35.35 2jbp n LYS 77 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.40 177.48 2jbp s VAL 78 N 1.89 0.80 0.21 0.58 1.01 0.24 -3.47 120.40 121.66 2jbp s VAL 78 Ca 0.00 -0.33 0.10 0.00 0.00 0.00 0.00 61.98 61.74 2jbp s VAL 78 Cb 0.00 -0.73 -0.04 0.00 0.00 0.00 0.00 36.38 35.61 2jbp s VAL 78 CO 0.00 0.26 -0.10 -0.76 0.00 0.00 0.00 175.10 174.51 2jbp s LEU 79 N 0.42 2.95 0.15 3.92 1.43 0.53 -1.41 118.68 126.68 2jbp s LEU 79 Ca -0.07 -0.66 -0.30 0.00 -1.03 0.00 0.00 54.13 52.07 2jbp s LEU 79 Cb -0.11 -1.58 -0.07 0.00 0.03 0.00 0.00 46.19 44.46 2jbp s LEU 79 CO 0.01 0.07 1.03 -1.58 0.23 0.00 0.00 176.35 176.12 2jbp s GLN 80 N -3.08 4.65 0.07 1.70 2.00 -0.84 0.65 119.66 124.81 2jbp s GLN 80 Ca 0.27 1.60 -0.05 0.00 -2.00 0.00 0.00 55.36 55.17 2jbp s GLN 80 Cb -0.08 -3.32 -0.02 0.00 0.80 0.00 0.00 33.01 30.40 2jbp s GLN 80 CO 0.16 0.16 0.08 0.96 -0.50 0.00 0.00 175.29 176.15 2jbp s ILE 81 N -0.20 0.17 -0.03 -2.34 -4.36 0.23 -2.94 121.20 111.73 2jbp s ILE 81 Ca 0.48 -1.43 0.07 0.00 -0.26 0.00 0.00 60.65 59.50 2jbp s ILE 81 Cb -0.27 -1.35 -0.02 0.00 1.25 0.00 0.00 42.46 42.07 2jbp s ILE 81 CO 0.33 -0.79 -0.23 -0.36 0.24 0.00 0.00 174.94 174.12 2jbp s PHE 82 N -3.72 2.15 -0.08 1.37 0.08 -0.44 -0.70 117.98 116.64 2jbp s PHE 82 Ca 0.04 -0.47 -0.30 0.00 0.12 0.00 0.00 56.93 56.33 2jbp s PHE 82 Cb 0.05 -1.39 -0.05 0.00 -0.57 0.00 0.00 43.02 41.06 2jbp s PHE 82 CO -0.10 -0.08 1.60 1.21 -0.10 0.00 0.00 175.22 177.75 2jbp s ASN 83 N -0.43 6.68 0.43 1.36 3.04 0.08 0.21 114.94 126.32 2jbp s ASN 83 Ca 0.06 2.12 0.12 0.00 0.04 0.00 0.00 52.86 55.20 2jbp s ASN 83 Cb -0.10 -2.53 1.00 0.00 -1.54 0.00 0.00 41.25 38.08 2jbp s ASN 83 CO 0.00 -0.93 2.01 0.11 -3.04 0.00 0.00 177.10 175.26 2jbp h LYS 84 N 9.46 0.40 0.00 0.43 1.57 -1.28 -0.99 116.57 126.16 2jbp h LYS 84 Ca -0.37 -0.02 -0.13 0.00 -1.87 0.00 0.00 60.65 58.25 2jbp h LYS 84 Cb 1.17 -0.09 -0.02 0.00 0.08 0.00 0.00 32.23 33.37 2jbp h LYS 84 CO 0.96 0.27 -0.74 -0.09 -0.57 0.00 0.00 179.45 179.28 2jbp h ARG 85 N 0.42 0.00 -0.63 3.15 1.12 -1.89 -3.38 114.38 113.17 2jbp h ARG 85 Ca 0.22 0.00 0.00 0.00 -1.11 0.00 0.00 59.98 59.09 2jbp h ARG 85 Cb 0.35 0.00 0.00 0.00 -0.01 0.00 0.00 29.97 30.31 2jbp h ARG 85 CO -0.06 0.96 0.00 -2.37 -3.11 0.00 0.00 179.97 175.39 2jbp n THR 86 N -4.51 2.25 0.00 0.20 5.66 -1.16 -4.90 114.28 111.82 2jbp n THR 86 Ca -0.23 -1.22 0.00 0.00 -3.05 0.00 0.00 64.05 59.55 2jbp n THR 86 Cb 0.58 -0.16 0.00 0.00 -1.55 0.00 0.00 70.33 69.20 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 0.75 0.00 -0.61 1.09 -0.06 -0.38 -4.89 117.38 113.26 2jbp n GLN 87 Ca 0.25 0.00 -0.31 0.00 -2.00 0.00 0.00 57.00 54.94 2jbp n GLN 87 Cb 1.03 -3.57 0.20 0.00 -4.06 0.00 0.00 30.24 23.84 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 -1.33 -1.84 -4.24 3.69 2.13 -1.24 -4.38 120.64 113.42 2jbp n GLU 88 Ca 0.00 -0.52 -0.29 0.00 0.66 0.00 0.00 57.16 57.01 2jbp n GLU 88 Cb 0.00 -1.85 -0.10 0.00 0.27 0.00 0.00 31.44 29.76 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 -3.74 2.06 0.21 5.31 1.02 -1.26 -0.74 119.74 122.61 2jbp s LYS 89 Ca 0.60 -1.08 -0.21 0.00 0.02 0.00 0.00 55.97 55.30 2jbp s LYS 89 Cb -0.16 -2.26 0.04 0.00 -0.52 0.00 0.00 37.83 34.93 2jbp s LYS 89 CO 0.66 0.49 0.62 -0.06 -0.92 0.00 0.00 175.35 176.15 2jbp s PHE 90 N -1.25 -0.31 -0.07 3.18 0.40 0.12 -4.44 117.98 115.61 2jbp s PHE 90 Ca 0.21 -0.03 0.00 0.00 -0.60 0.00 0.00 56.93 56.52 2jbp s PHE 90 Cb -0.11 0.57 -0.03 0.00 0.51 0.00 0.00 43.02 43.96 2jbp s PHE 90 CO 0.13 -1.00 -0.06 0.00 0.70 0.00 0.00 175.22 174.99 2jbp s ALA 91 N -3.84 3.01 -0.08 5.36 0.00 -0.35 -0.60 121.76 125.24 2jbp s ALA 91 Ca 0.07 -0.88 0.04 0.00 0.00 0.00 0.00 51.96 51.19 2jbp s ALA 91 Cb -0.03 -1.26 -0.00 0.00 0.00 0.00 0.00 23.12 21.83 2jbp s ALA 91 CO -0.03 0.56 -0.23 -1.17 0.00 0.00 0.00 175.76 174.89 2jbp s LEU 92 N -0.77 2.05 -0.12 0.00 2.96 0.21 -0.97 118.68 122.03 2jbp s LEU 92 Ca 0.12 -0.52 0.01 0.00 -0.22 0.00 0.00 54.13 53.52 2jbp s LEU 92 Cb -0.11 -1.34 -0.01 0.00 0.50 0.00 0.00 46.19 45.23 2jbp s LEU 92 CO 0.02 0.17 -0.16 -0.75 -1.32 0.00 0.00 176.35 174.31 2jbp s LYS 93 N 0.21 3.29 -0.10 1.98 2.20 -0.36 -0.35 119.74 126.62 2jbp s LYS 93 Ca -0.14 -0.73 -0.00 0.00 -0.36 0.00 0.00 55.97 54.74 2jbp s LYS 93 Cb -0.16 -2.55 -0.03 0.00 -1.51 0.00 0.00 37.83 33.58 2jbp s LYS 93 CO 0.07 0.22 -0.08 -1.64 -0.36 0.00 0.00 175.35 173.55 2jbp s MET 94 N 0.32 3.12 0.04 4.03 -1.94 -1.23 -0.93 119.30 122.71 2jbp s MET 94 Ca -0.12 -0.58 0.03 0.00 -1.71 0.00 0.00 55.69 53.30 2jbp s MET 94 Cb -0.16 -2.67 -0.02 0.00 2.01 0.00 0.00 34.83 33.99 2jbp s MET 94 CO 0.06 0.45 -0.09 -0.51 -0.01 0.00 0.00 175.02 174.92 2jbp s LEU 95 N -0.23 2.19 -0.21 -0.03 1.43 -0.17 -4.66 118.68 117.01 2jbp s LEU 95 Ca 0.03 -0.44 -0.26 0.00 -1.03 0.00 0.00 54.13 52.43 2jbp s LEU 95 Cb -0.13 -0.33 -0.01 0.00 0.03 0.00 0.00 46.19 45.76 2jbp s LEU 95 CO 0.03 -0.08 0.86 -1.58 0.23 0.00 0.00 176.35 175.81 2jbp s GLN 96 N -1.20 4.25 0.14 1.70 0.74 -1.26 -1.07 119.66 122.96 2jbp s GLN 96 Ca -0.04 1.04 -0.35 0.00 0.05 0.00 0.00 55.36 56.06 2jbp s GLN 96 Cb -0.08 -3.61 -0.15 0.00 1.10 0.00 0.00 33.01 30.27 2jbp s GLN 96 CO 0.01 -0.45 1.52 -3.47 -0.55 0.00 0.00 175.29 172.35 2jbp n ASP 97 N 5.71 2.74 0.00 6.67 2.03 -0.44 -4.71 116.55 128.54 2jbp n ASP 97 Ca 0.06 1.09 0.00 0.00 0.52 0.00 0.00 54.79 56.46 2jbp n ASP 97 Cb 0.48 -1.37 0.00 0.00 -0.72 0.00 0.00 41.12 39.51 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 0.27 0.00 -0.04 -1.26 -2.74 135.00 131.91 2jbp n PRO 99 Ca 0.00 0.05 0.14 0.00 -0.04 0.00 0.00 63.50 63.65 2jbp n PRO 99 Cb 0.00 -1.58 0.78 0.00 -0.04 0.00 0.00 33.50 32.66 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 0.00 0.00 0.07 0.54 1.79 -1.97 -1.83 116.57 115.18 2jbp h LYS 100 Ca -0.46 0.00 -0.35 0.00 -2.18 0.00 0.00 60.65 57.66 2jbp h LYS 100 Cb 2.13 0.00 -0.04 0.00 -1.58 0.00 0.00 32.23 32.74 2jbp h LYS 100 CO 0.04 0.09 -2.01 0.00 -1.08 0.00 0.00 179.45 176.49 2jbp n ALA 101 N -2.25 1.15 -0.28 3.86 0.00 -1.26 -3.22 120.51 118.51 2jbp n ALA 101 Ca -0.02 -0.74 0.17 0.00 0.00 0.00 0.00 53.44 52.85 2jbp n ALA 101 Cb 0.22 -0.62 0.45 0.00 0.00 0.00 0.00 19.45 19.49 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 0.52 0.13 0.00 2.47 -1.31 -1.68 114.38 114.55 2jbp h ARG 102 Ca -0.41 -0.03 -0.01 0.00 -1.26 0.00 0.00 59.98 58.27 2jbp h ARG 102 Cb 2.03 -0.12 0.00 0.00 -1.65 0.00 0.00 29.97 30.23 2jbp h ARG 102 CO 0.06 0.34 -0.06 -0.09 0.56 0.00 0.00 179.97 180.78 2jbp h ARG 103 N 0.53 -0.17 -0.22 0.04 2.43 -1.45 0.30 114.38 115.85 2jbp h ARG 103 Ca 0.50 0.01 0.06 0.00 -0.81 0.00 0.00 59.98 59.74 2jbp h ARG 103 Cb 1.06 0.04 -0.07 0.00 -0.42 0.00 0.00 29.97 30.58 2jbp h ARG 103 CO -0.23 0.16 -0.32 1.49 -1.51 0.00 0.00 179.97 179.56 2jbp h GLU 104 N -0.51 -0.33 -0.21 0.20 4.81 -1.31 0.47 114.58 117.70 2jbp h GLU 104 Ca -0.02 0.02 0.05 0.00 -0.13 0.00 0.00 59.36 59.28 2jbp h GLU 104 Cb 0.41 0.08 -0.05 0.00 0.63 0.00 0.00 28.75 29.81 2jbp h GLU 104 CO 0.03 -0.22 -0.09 0.28 -0.73 0.00 0.00 179.01 178.28 2jbp h VAL 105 N -0.34 0.71 0.23 0.32 2.07 -1.31 0.11 116.25 118.03 2jbp h VAL 105 Ca 0.12 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.64 2jbp h VAL 105 Cb 0.54 0.71 -0.03 0.00 -1.52 0.00 0.00 31.29 30.99 2jbp h VAL 105 CO -0.41 0.00 -0.41 -0.08 0.02 0.00 0.00 177.57 176.69 2jbp h GLU 106 N -0.05 -0.66 -0.29 1.57 4.22 0.92 0.11 114.58 120.40 2jbp h GLU 106 Ca 0.11 0.04 0.03 0.00 0.08 0.00 0.00 59.36 59.62 2jbp h GLU 106 Cb 0.22 0.15 -0.03 0.00 0.50 0.00 0.00 28.75 29.59 2jbp h GLU 106 CO -0.25 -0.44 0.11 -0.07 -2.18 0.00 0.00 179.01 176.19 2jbp h LEU 107 N -0.68 0.15 -0.56 1.64 3.38 0.03 -2.18 115.31 117.08 2jbp h LEU 107 Ca -0.02 0.02 -0.03 0.00 0.09 0.00 0.00 57.88 57.94 2jbp h LEU 107 Cb 0.64 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.37 2jbp h LEU 107 CO -0.15 0.12 0.24 -0.74 0.09 0.00 0.00 178.44 178.00 2jbp h HIS 108 N 0.25 0.85 -0.78 1.13 2.76 -0.61 -0.92 115.15 117.83 2jbp h HIS 108 Ca 0.12 -0.06 0.13 0.00 -2.20 0.00 0.00 60.37 58.37 2jbp h HIS 108 Cb 0.08 -0.26 -0.09 0.00 1.55 0.00 0.00 27.41 28.69 2jbp h HIS 108 CO -0.12 0.68 0.35 2.35 -1.30 0.00 0.00 177.93 179.89 2jbp h TRP 109 N 0.77 0.61 0.00 5.26 2.91 -0.56 -0.36 115.95 124.58 2jbp h TRP 109 Ca 0.19 0.03 -0.04 0.00 1.13 0.00 0.00 58.89 60.20 2jbp h TRP 109 Cb 0.18 -0.15 -0.01 0.00 -0.51 0.00 0.00 29.16 28.67 2jbp h TRP 109 CO 0.01 0.13 -0.19 -0.09 -1.03 0.00 0.00 178.44 177.26 2jbp h ARG 110 N 0.53 0.00 -0.03 2.65 2.43 -0.54 -2.34 114.38 117.08 2jbp h ARG 110 Ca 0.42 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.59 2jbp h ARG 110 Cb 0.59 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.14 2jbp h ARG 110 CO -0.37 0.19 0.00 0.00 -1.51 0.00 0.00 179.97 178.28 2jbp n ALA 111 N -2.31 2.47 0.24 2.80 0.00 -0.27 -4.36 120.51 119.07 2jbp n ALA 111 Ca -0.01 -0.66 0.13 0.00 0.00 0.00 0.00 53.44 52.89 2jbp n ALA 111 Cb 0.31 -0.68 0.37 0.00 0.00 0.00 0.00 19.45 19.45 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 3.94 0.00 -0.65 0.00 0.87 -0.65 -2.94 113.55 114.12 2jbp h SER 112 Ca 0.00 0.00 0.10 0.00 -1.23 0.00 0.00 61.79 60.66 2jbp h SER 112 Cb 0.84 0.00 -0.08 0.00 -0.44 0.00 0.00 62.40 62.72 2jbp h SER 112 CO 0.00 0.06 0.26 1.56 -0.53 0.00 0.00 176.83 178.18 2jbp h GLN 113 N 0.00 0.44 -6.74 2.24 4.20 -1.76 -3.43 115.11 110.06 2jbp h GLN 113 Ca -0.00 -0.03 -0.56 0.00 0.06 0.00 0.00 58.65 58.12 2jbp h GLN 113 Cb 0.83 -0.10 0.10 0.00 0.30 0.00 0.00 27.48 28.60 2jbp h GLN 113 CO 0.01 0.29 0.67 0.00 -0.67 0.00 0.00 178.83 179.13 2jbp h PRO 115 N 3.63 0.00 -0.40 0.00 0.11 -1.91 -2.77 132.00 130.65 2jbp h PRO 115 Ca -0.47 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.64 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 0.71 0.02 0.00 0.72 -0.21 0.00 0.00 178.00 179.23 2jbp n HIS 116 N -3.17 0.85 -5.19 0.65 8.25 -1.26 -4.86 115.22 110.49 2jbp n HIS 116 Ca -0.01 -0.64 -0.32 0.00 -0.26 0.00 0.00 57.72 56.49 2jbp n HIS 116 Cb 0.19 -0.16 -0.16 0.00 1.12 0.00 0.00 29.99 30.98 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 -1.73 2.17 0.11 1.59 1.01 -1.05 -1.15 121.20 122.16 2jbp s ILE 117 Ca 0.36 -1.00 -0.33 0.00 0.00 0.00 0.00 60.65 59.69 2jbp s ILE 117 Cb 0.24 -1.82 -0.12 0.00 0.01 0.00 0.00 42.46 40.77 2jbp s ILE 117 CO 0.16 0.56 1.76 0.55 0.00 0.00 0.00 174.94 177.97 2jbp n VAL 118 N 3.26 0.24 -2.54 2.92 3.14 -0.74 -4.78 118.33 119.83 2jbp n VAL 118 Ca -0.18 -0.04 -0.41 0.00 -2.96 0.00 0.00 64.34 60.74 2jbp n VAL 118 Cb 0.53 -1.90 -0.04 0.00 -1.06 0.00 0.00 33.84 31.36 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 2.20 4.60 -0.24 1.45 3.52 -1.26 -4.86 118.95 124.36 2jbp s ARG 119 Ca 0.82 1.67 -0.18 0.00 -0.13 0.00 0.00 55.73 57.91 2jbp s ARG 119 Cb -0.57 -3.30 -0.03 0.00 -1.56 0.00 0.00 34.95 29.49 2jbp s ARG 119 CO 0.39 0.06 0.52 0.42 -0.81 0.00 0.00 175.30 175.88 2jbp s ILE 120 N -0.06 5.08 -0.16 4.11 1.01 -1.26 -1.43 121.20 128.50 2jbp s ILE 120 Ca 0.50 0.92 -0.21 0.00 0.00 0.00 0.00 60.65 61.86 2jbp s ILE 120 Cb -0.28 -3.84 -0.23 0.00 0.01 0.00 0.00 42.46 38.12 2jbp s ILE 120 CO 0.33 0.12 0.44 0.58 0.00 0.00 0.00 174.94 176.41 2jbp h VAL 121 N 5.29 1.11 -3.01 2.92 2.07 -0.70 -3.48 116.25 120.45 2jbp h VAL 121 Ca -0.31 -2.29 -0.06 0.00 0.82 0.00 0.00 66.70 64.87 2jbp h VAL 121 Cb 1.14 2.61 -0.15 0.00 -1.52 0.00 0.00 31.29 33.38 2jbp h VAL 121 CO 0.73 0.52 0.01 -1.81 0.02 0.00 0.00 177.57 177.03 2jbp s ASP 122 N -6.80 -0.38 -0.12 0.57 -0.00 -0.86 -5.02 116.67 104.08 2jbp s ASP 122 Ca -0.24 -0.01 0.00 0.00 -0.00 0.00 0.00 52.55 52.31 2jbp s ASP 122 Cb 0.04 0.49 0.02 0.00 -0.00 0.00 0.00 42.92 43.47 2jbp s ASP 122 CO 0.67 -0.78 -0.10 -0.69 -0.00 0.00 0.00 175.17 174.28 2jbp s VAL 123 N -2.97 1.17 -0.03 -1.27 1.01 -1.26 -0.78 120.40 116.27 2jbp s VAL 123 Ca -0.02 -0.40 -0.01 0.00 0.00 0.00 0.00 61.98 61.55 2jbp s VAL 123 Cb -0.00 -1.15 -0.04 0.00 0.00 0.00 0.00 36.38 35.19 2jbp s VAL 123 CO -0.06 0.39 0.06 -0.31 0.00 0.00 0.00 175.10 175.18 2jbp s TYR 124 N 1.53 3.26 -0.26 5.22 1.51 0.16 -0.80 117.35 127.97 2jbp s TYR 124 Ca 0.03 0.22 -0.04 0.00 -1.01 0.00 0.00 57.07 56.26 2jbp s TYR 124 Cb -0.13 -1.76 0.01 0.00 -0.11 0.00 0.00 41.96 39.97 2jbp s TYR 124 CO -0.07 0.54 -0.01 -2.00 -1.11 0.00 0.00 175.55 172.90 2jbp s GLU 125 N -1.47 3.08 0.36 -0.62 2.12 0.38 0.27 118.70 122.83 2jbp s GLU 125 Ca 0.20 -0.83 0.04 0.00 0.36 0.00 0.00 54.97 54.74 2jbp s GLU 125 Cb -0.12 -3.12 -0.03 0.00 0.26 0.00 0.00 34.13 31.12 2jbp s GLU 125 CO 0.10 -0.35 0.16 -0.80 -0.54 0.00 0.00 175.26 173.82 2jbp s ASN 126 N 1.43 2.25 -0.18 -1.70 0.02 -0.47 -4.48 114.94 111.81 2jbp s ASN 126 Ca 0.03 -1.64 -0.06 0.00 -1.02 0.00 0.00 52.86 50.16 2jbp s ASN 126 Cb -0.16 0.46 -0.03 0.00 0.02 0.00 0.00 41.25 41.53 2jbp s ASN 126 CO -0.02 -0.93 0.02 -0.76 0.02 0.00 0.00 177.10 175.44 2jbp s LEU 127 N -3.50 3.52 -0.27 0.60 1.43 -1.26 0.30 118.68 119.51 2jbp s LEU 127 Ca 0.30 -0.05 -0.03 0.00 -1.03 0.00 0.00 54.13 53.32 2jbp s LEU 127 Cb 0.03 -1.88 0.09 0.00 0.03 0.00 0.00 46.19 44.46 2jbp s LEU 127 CO 0.17 0.14 0.10 -0.47 0.23 0.00 0.00 176.35 176.53 2jbp s TYR 128 N 0.54 0.81 -0.87 0.29 5.04 -0.23 -4.74 117.35 118.19 2jbp s TYR 128 Ca 0.01 -1.07 -0.01 0.00 -2.44 0.00 0.00 57.07 53.56 2jbp s TYR 128 Cb -0.13 -1.13 -0.01 0.00 0.35 0.00 0.00 41.96 41.03 2jbp s TYR 128 CO 0.02 -0.78 0.73 0.00 -1.34 0.00 0.00 175.55 174.18 2jbp n ALA 129 N 5.11 -1.64 -0.41 3.97 0.00 -1.26 -3.55 120.51 122.72 2jbp n ALA 129 Ca -0.05 -0.01 0.00 0.00 0.00 0.00 0.00 53.44 53.38 2jbp n ALA 129 Cb 0.43 -2.62 0.00 0.00 0.00 0.00 0.00 19.45 17.26 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 -1.15 0.00 3.92 0.00 0.00 -1.26 -4.86 105.19 101.84 2jbp n GLY 130 Ca -0.17 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.56 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 -0.82 3.52 -0.17 1.61 0.52 -1.23 -5.10 118.95 117.28 2jbp s ARG 131 Ca 0.00 -0.32 -0.18 0.00 -0.52 0.00 0.00 55.73 54.71 2jbp s ARG 131 Cb 0.00 -2.88 -0.04 0.00 0.52 0.00 0.00 34.95 32.56 2jbp s ARG 131 CO 0.00 0.45 0.48 0.21 0.02 0.00 0.00 175.30 176.46 2jbp s LYS 132 N -3.06 4.24 -0.02 3.54 2.20 -1.26 -1.07 119.74 124.31 2jbp s LYS 132 Ca 0.38 0.38 0.06 0.00 -0.36 0.00 0.00 55.97 56.43 2jbp s LYS 132 Cb -0.12 -3.51 -0.02 0.00 -1.51 0.00 0.00 37.83 32.67 2jbp s LYS 132 CO 0.28 -0.02 -0.20 0.00 -0.36 0.00 0.00 175.35 175.05 2jbp s LEU 134 N -0.82 4.05 -0.22 0.00 1.02 -0.23 -1.37 118.68 121.10 2jbp s LEU 134 Ca 0.11 0.07 -0.03 0.00 0.02 0.00 0.00 54.13 54.30 2jbp s LEU 134 Cb -0.10 -2.16 0.00 0.00 0.02 0.00 0.00 46.19 43.95 2jbp s LEU 134 CO 0.01 -0.03 -0.05 -0.76 0.02 0.00 0.00 176.35 175.54 2jbp s LEU 135 N 1.57 2.92 -0.21 1.79 1.43 0.14 -1.00 118.68 125.32 2jbp s LEU 135 Ca 0.08 -0.50 -0.09 0.00 -1.03 0.00 0.00 54.13 52.59 2jbp s LEU 135 Cb -0.15 -1.71 -0.04 0.00 0.03 0.00 0.00 46.19 44.31 2jbp s LEU 135 CO 0.09 -0.04 0.10 -0.63 0.23 0.00 0.00 176.35 176.09 2jbp s ILE 136 N 1.44 4.96 -0.25 -0.59 1.01 -0.11 -0.66 121.20 127.00 2jbp s ILE 136 Ca 0.05 0.03 -0.07 0.00 0.00 0.00 0.00 60.65 60.67 2jbp s ILE 136 Cb -0.15 -3.27 -0.02 0.00 0.01 0.00 0.00 42.46 39.03 2jbp s ILE 136 CO -0.04 0.41 0.05 -0.69 0.00 0.00 0.00 174.94 174.67 2jbp s VAL 137 N 0.70 4.07 0.21 2.92 1.01 0.04 -1.22 120.40 128.13 2jbp s VAL 137 Ca 0.05 -0.29 0.09 0.00 0.00 0.00 0.00 61.98 61.83 2jbp s VAL 137 Cb -0.13 -2.91 -0.05 0.00 0.00 0.00 0.00 36.38 33.29 2jbp s VAL 137 CO 0.02 0.34 -0.16 0.00 0.00 0.00 0.00 175.10 175.29 2jbp s MET 138 N 1.58 1.37 1.10 2.72 0.23 -0.14 0.06 119.30 126.21 2jbp s MET 138 Ca 0.06 -1.59 -0.17 0.00 -1.03 0.00 0.00 55.69 52.96 2jbp s MET 138 Cb -0.15 -1.26 0.11 0.00 -1.53 0.00 0.00 34.83 32.00 2jbp s MET 138 CO 0.02 0.22 0.14 -0.85 -2.03 0.00 0.00 175.02 172.52 2jbp n GLU 139 N -0.30 -1.46 -4.07 3.16 0.28 -0.51 -1.22 120.64 116.53 2jbp n GLU 139 Ca -0.08 -0.40 -0.35 0.00 -0.16 0.00 0.00 57.16 56.16 2jbp n GLU 139 Cb 0.60 -1.76 -0.13 0.00 1.43 0.00 0.00 31.44 31.58 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 1.06 6.26 0.37 0.00 1.43 -1.26 -4.84 118.68 121.70 2jbp s LEU 141 Ca 0.02 -3.28 0.20 0.00 -1.03 0.00 0.00 54.13 50.04 2jbp s LEU 141 Cb -0.14 -2.13 0.23 0.00 0.03 0.00 0.00 46.19 44.18 2jbp s LEU 141 CO 0.01 -0.36 1.53 -2.24 0.23 0.00 0.00 176.35 175.51 2jbp h ASP 142 N 6.93 0.00 0.00 2.29 2.03 -0.95 -3.36 116.42 123.35 2jbp h ASP 142 Ca 0.14 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.44 2jbp h ASP 142 Cb 0.92 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.42 2jbp h ASP 142 CO 0.88 0.17 0.00 0.61 -1.03 0.00 0.00 179.24 179.87 2jbp n GLY 143 N 1.15 -0.25 0.00 7.15 0.00 -0.51 -4.86 105.19 107.87 2jbp n GLY 143 Ca 0.03 -0.02 0.00 0.00 0.00 0.00 0.00 46.02 46.03 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 -0.37 -0.47 3.75 -0.02 0.00 -1.25 -4.44 105.19 102.39 2jbp n GLY 144 Ca 0.03 -1.56 -0.38 0.00 0.00 0.00 0.00 46.02 44.10 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 -3.60 3.28 0.21 1.61 2.02 -1.26 0.18 118.70 121.14 2jbp s GLU 145 Ca 0.00 2.21 -0.10 0.00 0.02 0.00 0.00 54.97 57.10 2jbp s GLU 145 Cb 0.00 -2.33 0.16 0.00 0.10 0.00 0.00 34.13 32.06 2jbp s GLU 145 CO 0.00 -1.07 1.87 1.25 0.02 0.00 0.00 175.26 177.33 2jbp h LEU 146 N 1.64 0.89 -1.34 1.80 5.85 -1.25 -2.09 115.31 120.81 2jbp h LEU 146 Ca -0.51 -0.03 -0.06 0.00 0.84 0.00 0.00 57.88 58.12 2jbp h LEU 146 Cb 1.29 -0.22 -0.01 0.00 0.37 0.00 0.00 40.66 42.09 2jbp h LEU 146 CO 0.58 0.65 -0.29 -0.26 -0.34 0.00 0.00 178.44 178.79 2jbp h PHE 147 N 1.04 0.00 0.00 1.25 0.05 -1.85 -2.47 116.94 114.96 2jbp h PHE 147 Ca 0.28 0.00 -0.02 0.00 3.82 0.00 0.00 57.97 62.05 2jbp h PHE 147 Cb -0.10 0.00 -0.00 0.00 2.00 0.00 0.00 35.95 37.85 2jbp h PHE 147 CO -0.02 0.29 -0.09 0.77 -0.18 0.00 0.00 178.31 179.08 2jbp h SER 148 N 0.00 0.00 -0.40 2.17 0.02 -1.78 -2.53 113.55 111.04 2jbp h SER 148 Ca -0.00 -0.72 0.11 0.00 -0.84 0.00 0.00 61.79 60.35 2jbp h SER 148 Cb 0.65 0.00 -0.02 0.00 0.14 0.00 0.00 62.40 63.17 2jbp h SER 148 CO 0.04 0.91 0.62 -0.09 -1.14 0.00 0.00 176.83 177.17 2jbp h ARG 149 N -1.00 0.00 0.27 3.45 1.12 -1.43 -0.11 114.38 116.69 2jbp h ARG 149 Ca -0.02 0.00 -0.01 0.00 -1.11 0.00 0.00 59.98 58.83 2jbp h ARG 149 Cb 0.78 0.00 0.00 0.00 -0.01 0.00 0.00 29.97 30.74 2jbp h ARG 149 CO -0.01 0.00 -0.13 0.82 -3.11 0.00 0.00 179.97 177.54 2jbp h ILE 150 N 0.00 0.00 0.00 1.20 2.04 -1.43 -3.34 117.51 115.98 2jbp h ILE 150 Ca 0.19 -0.66 0.00 0.00 1.00 0.00 0.00 64.86 65.39 2jbp h ILE 150 Cb 1.43 0.00 0.00 0.00 -0.74 0.00 0.00 36.82 37.51 2jbp h ILE 150 CO -0.00 0.00 0.00 0.00 0.00 0.00 0.00 178.15 178.15 2jbp n GLN 151 N -4.81 0.27 -2.84 2.37 10.64 -0.06 -3.18 117.38 119.77 2jbp n GLN 151 Ca -0.04 0.00 -0.11 0.00 -1.83 0.00 0.00 57.00 55.01 2jbp n GLN 151 Cb 0.14 -1.36 0.03 0.00 -0.86 0.00 0.00 30.24 28.19 2jbp n GLN 151 CO 0.00 0.00 0.00 -0.25 -1.83 0.00 0.00 177.06 174.98 2jbp n ASP 152 N 0.87 0.34 0.00 2.61 9.92 -1.18 -4.76 116.55 124.35 2jbp n ASP 152 Ca 0.00 -2.87 0.00 0.00 -0.53 0.00 0.00 54.79 51.39 2jbp n ASP 152 Cb 0.14 -0.06 0.00 0.00 -0.64 0.00 0.00 41.12 40.56 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 0.01 0.00 -0.41 -1.24 1.74 -1.19 -4.99 116.66 110.59 2jbp n ARG 153 Ca 0.12 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.20 2jbp n ARG 153 Cb 0.76 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 32.20 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 4.19 0.72 2.91 -0.13 0.00 -1.26 -5.03 105.19 106.59 2jbp n GLY 154 Ca 0.00 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.74 2jbp n GLY 154 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2jbp s ASP 155 N -3.00 2.44 0.21 1.61 2.15 -1.26 -4.94 116.67 113.88 2jbp s ASP 155 Ca 0.00 -0.44 0.00 0.00 0.43 0.00 0.00 52.55 52.54 2jbp s ASP 155 Cb 0.00 -0.90 0.00 0.00 -0.30 0.00 0.00 42.92 41.72 2jbp s ASP 155 CO 0.00 -0.13 0.00 0.00 -0.17 0.00 0.00 175.17 174.87 2jbp n GLN 156 N 4.91 -1.59 -2.58 4.34 3.00 -1.26 -4.95 117.38 119.23 2jbp n GLN 156 Ca -0.13 1.22 -0.23 0.00 -0.01 0.00 0.00 57.00 57.85 2jbp n GLN 156 Cb 0.49 -1.78 0.09 0.00 0.00 0.00 0.00 30.24 29.05 2jbp n GLN 156 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 2jbp s ALA 157 N -3.97 3.73 0.03 -1.58 0.00 -1.26 -4.96 121.76 113.74 2jbp s ALA 157 Ca 0.00 -1.63 -0.30 0.00 0.00 0.00 0.00 51.96 50.02 2jbp s ALA 157 Cb 0.00 -2.04 -0.06 0.00 0.00 0.00 0.00 23.12 21.03 2jbp s ALA 157 CO 0.00 -1.32 1.36 0.12 0.00 0.00 0.00 175.76 175.92 2jbp s PHE 158 N -3.08 3.02 0.10 0.00 5.99 -1.26 -4.96 117.98 117.79 2jbp s PHE 158 Ca 0.64 0.93 0.04 0.00 0.00 0.00 0.00 56.93 58.54 2jbp s PHE 158 Cb -0.06 -3.62 -0.04 0.00 0.00 0.00 0.00 43.02 39.29 2jbp s PHE 158 CO 0.43 -2.22 0.06 0.95 -0.00 0.00 0.00 175.22 174.44 2jbp s THR 159 N 1.98 4.34 0.27 0.12 -4.23 -1.26 -0.00 115.64 116.86 2jbp s THR 159 Ca 0.63 -0.90 -0.01 0.00 -1.18 0.00 0.00 61.69 60.23 2jbp s THR 159 Cb -0.32 -3.10 0.31 0.00 1.34 0.00 0.00 72.50 70.73 2jbp s THR 159 CO 0.27 0.09 1.64 -0.08 -0.54 0.00 0.00 174.62 176.00 2jbp h GLU 160 N 3.22 0.15 0.26 3.99 4.81 -0.01 0.25 114.58 127.24 2jbp h GLU 160 Ca -0.47 -0.01 -0.01 0.00 -0.13 0.00 0.00 59.36 58.74 2jbp h GLU 160 Cb 1.17 -0.03 0.00 0.00 0.63 0.00 0.00 28.75 30.52 2jbp h GLU 160 CO 0.63 0.10 -0.13 -0.09 -0.73 0.00 0.00 179.01 178.80 2jbp h ARG 161 N 0.16 -0.34 -0.95 1.92 2.43 -1.68 -0.77 114.38 115.16 2jbp h ARG 161 Ca 0.51 0.02 0.21 0.00 -0.81 0.00 0.00 59.98 59.91 2jbp h ARG 161 Cb 0.98 0.08 -0.12 0.00 -0.42 0.00 0.00 29.97 30.49 2jbp h ARG 161 CO -0.68 -0.23 0.51 0.93 -1.51 0.00 0.00 179.97 178.99 2jbp h GLU 162 N -0.35 0.55 -0.18 0.20 5.08 -1.33 0.70 114.58 119.24 2jbp h GLU 162 Ca -0.03 -0.03 -0.01 0.00 -1.00 0.00 0.00 59.36 58.29 2jbp h GLU 162 Cb 0.28 -0.12 -0.01 0.00 0.50 0.00 0.00 28.75 29.39 2jbp h GLU 162 CO 0.05 0.36 0.08 0.00 -1.00 0.00 0.00 179.01 178.51 2jbp h ALA 163 N 1.68 0.23 -0.42 3.43 0.00 -0.25 -0.27 119.26 123.67 2jbp h ALA 163 Ca 0.58 -0.09 0.09 0.00 0.00 0.00 0.00 54.91 55.48 2jbp h ALA 163 Cb 1.03 -0.07 -0.08 0.00 0.00 0.00 0.00 17.79 18.66 2jbp h ALA 163 CO -0.46 -0.19 -0.13 1.03 0.00 0.00 0.00 179.25 179.49 2jbp h SER 164 N 0.16 -0.48 -0.48 0.00 0.87 0.35 0.27 113.55 114.24 2jbp h SER 164 Ca 0.06 0.14 0.06 0.00 -1.23 0.00 0.00 61.79 60.82 2jbp h SER 164 Cb 0.14 0.29 -0.05 0.00 -0.44 0.00 0.00 62.40 62.34 2jbp h SER 164 CO -0.01 -0.17 0.17 -0.33 -0.53 0.00 0.00 176.83 175.97 2jbp h GLU 165 N -0.04 0.34 -0.29 2.24 5.08 -0.24 -0.95 114.58 120.71 2jbp h GLU 165 Ca 0.20 -0.02 -0.03 0.00 -1.00 0.00 0.00 59.36 58.52 2jbp h GLU 165 Cb 0.35 -0.08 -0.01 0.00 0.50 0.00 0.00 28.75 29.51 2jbp h GLU 165 CO -0.45 0.23 0.08 0.82 -1.00 0.00 0.00 179.01 178.69 2jbp h ILE 166 N 0.35 1.21 -0.98 3.13 2.04 0.22 -2.16 117.51 121.31 2jbp h ILE 166 Ca 0.23 -0.68 0.10 0.00 1.00 0.00 0.00 64.86 65.51 2jbp h ILE 166 Cb 0.23 1.10 -0.08 0.00 -0.74 0.00 0.00 36.82 37.33 2jbp h ILE 166 CO -0.23 0.23 0.62 0.24 0.00 0.00 0.00 178.15 179.01 2jbp h MET 167 N 0.31 1.00 -0.69 2.37 2.86 -0.10 -2.04 114.93 118.64 2jbp h MET 167 Ca 0.09 -0.06 -0.02 0.00 -2.06 0.00 0.00 59.70 57.66 2jbp h MET 167 Cb 0.26 -0.23 -0.03 0.00 0.06 0.00 0.00 31.60 31.66 2jbp h MET 167 CO -0.00 0.66 0.37 -0.22 1.06 0.00 0.00 176.91 178.78 2jbp h LYS 168 N 1.03 0.96 -0.04 1.72 3.64 -0.54 0.15 116.57 123.50 2jbp h LYS 168 Ca 0.46 -0.11 -0.08 0.00 -1.27 0.00 0.00 60.65 59.66 2jbp h LYS 168 Cb 0.37 -0.19 0.00 0.00 -0.41 0.00 0.00 32.23 32.00 2jbp h LYS 168 CO -0.23 0.71 -0.30 0.66 -2.27 0.00 0.00 179.45 178.02 2jbp h SER 169 N 0.97 0.33 -1.00 4.20 4.64 -1.08 -0.49 113.55 121.12 2jbp h SER 169 Ca 0.24 -0.70 0.19 0.00 -0.47 0.00 0.00 61.79 61.06 2jbp h SER 169 Cb 0.04 -0.10 -0.10 0.00 -0.31 0.00 0.00 62.40 61.93 2jbp h SER 169 CO -0.04 0.97 0.61 0.40 -0.87 0.00 0.00 176.83 177.91 2jbp h ILE 170 N -0.29 0.70 -0.66 0.95 2.04 -1.22 -0.71 117.51 118.32 2jbp h ILE 170 Ca -0.03 -0.25 -0.04 0.00 1.00 0.00 0.00 64.86 65.54 2jbp h ILE 170 Cb 0.99 -0.10 -0.03 0.00 -0.74 0.00 0.00 36.82 36.94 2jbp h ILE 170 CO 0.06 0.13 0.24 1.23 0.00 0.00 0.00 178.15 179.82 2jbp h GLY 171 N 0.73 1.06 1.47 5.37 0.00 -0.10 -1.65 103.07 109.96 2jbp h GLY 171 Ca 0.57 -0.57 -0.09 0.00 0.00 0.00 0.00 47.33 47.24 2jbp h GLY 171 CO -0.36 0.54 -0.15 0.83 0.00 0.00 0.00 176.54 177.39 2jbp h GLU 172 N 0.97 0.63 -0.03 4.80 5.08 0.38 0.26 114.58 126.66 2jbp h GLU 172 Ca 0.22 -0.21 -0.00 0.00 -1.00 0.00 0.00 59.36 58.37 2jbp h GLU 172 Cb 0.22 -0.05 -0.00 0.00 0.50 0.00 0.00 28.75 29.41 2jbp h GLU 172 CO -0.02 0.76 0.01 0.00 -1.00 0.00 0.00 179.01 178.76 2jbp h ALA 173 N 1.27 0.03 -0.43 3.43 0.00 -0.65 -1.59 119.26 121.32 2jbp h ALA 173 Ca 0.10 -0.08 -0.08 0.00 0.00 0.00 0.00 54.91 54.84 2jbp h ALA 173 Cb 0.59 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.35 2jbp h ALA 173 CO 0.04 -0.38 -0.06 0.82 0.00 0.00 0.00 179.25 179.67 2jbp h ILE 174 N -0.12 1.24 -0.51 0.00 1.08 -0.81 -1.70 117.51 116.70 2jbp h ILE 174 Ca 0.01 -1.06 -0.03 0.00 -0.39 0.00 0.00 64.86 63.39 2jbp h ILE 174 Cb 0.16 0.98 -0.02 0.00 -3.07 0.00 0.00 36.82 34.87 2jbp h ILE 174 CO -0.00 0.36 0.21 -0.61 -0.69 0.00 0.00 178.15 177.42 2jbp h GLN 175 N 0.68 0.76 -0.39 2.37 4.15 -0.30 0.15 115.11 122.52 2jbp h GLN 175 Ca 0.13 -0.14 -0.01 0.00 0.77 0.00 0.00 58.65 59.39 2jbp h GLN 175 Cb 0.50 -0.12 -0.02 0.00 0.21 0.00 0.00 27.48 28.05 2jbp h GLN 175 CO 0.03 0.67 0.18 -0.92 -1.93 0.00 0.00 178.83 176.86 2jbp h TYR 176 N 0.68 0.56 -0.62 3.99 3.20 -1.00 0.14 116.97 123.92 2jbp h TYR 176 Ca 0.17 -0.03 -0.04 0.00 3.14 0.00 0.00 58.73 61.97 2jbp h TYR 176 Cb 0.19 -0.17 -0.03 0.00 1.54 0.00 0.00 36.73 38.26 2jbp h TYR 176 CO 0.00 0.47 0.23 -0.07 -1.64 0.00 0.00 178.16 177.16 2jbp h LEU 177 N 0.49 0.87 -0.70 2.82 3.38 -0.96 -2.61 115.31 118.59 2jbp h LEU 177 Ca 0.13 -0.18 -0.10 0.00 0.09 0.00 0.00 57.88 57.82 2jbp h LEU 177 Cb 0.12 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 40.63 2jbp h LEU 177 CO -0.02 0.81 -0.47 0.45 0.09 0.00 0.00 178.44 179.31 2jbp h HIS 178 N 0.87 0.00 0.00 1.13 3.86 -0.50 0.90 115.15 121.42 2jbp h HIS 178 Ca 0.20 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.41 2jbp h HIS 178 Cb 0.23 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.70 2jbp h HIS 178 CO 0.01 0.47 0.00 0.66 0.86 0.00 0.00 177.93 179.93 2jbp h SER 179 N 0.00 0.00 -0.08 2.45 4.64 -0.34 -2.32 113.55 117.89 2jbp h SER 179 Ca -0.00 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 61.30 2jbp h SER 179 Cb 1.06 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.14 2jbp h SER 179 CO 0.06 0.00 -0.14 2.30 -0.87 0.00 0.00 176.83 178.19 2jbp n ILE 180 N -2.98 2.10 -3.16 0.95 -5.35 -1.09 -4.99 119.36 104.84 2jbp n ILE 180 Ca 0.00 -2.51 -0.15 0.00 -0.27 0.00 0.00 62.75 59.82 2jbp n ILE 180 Cb 0.26 -0.25 0.05 0.00 -1.74 0.00 0.00 39.64 37.96 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 -1.19 -4.31 -4.10 7.28 4.13 -0.87 -4.92 115.26 111.28 2jbp n ASN 181 Ca 0.19 -0.36 -0.32 0.00 1.68 0.00 0.00 54.58 55.77 2jbp n ASN 181 Cb 0.73 -3.48 -0.16 0.00 -1.54 0.00 0.00 39.78 35.33 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 -3.21 1.97 0.08 2.41 1.01 0.27 -0.83 121.20 122.88 2jbp s ILE 182 Ca 0.31 -0.88 -0.17 0.00 0.00 0.00 0.00 60.65 59.90 2jbp s ILE 182 Cb -0.14 -1.78 -0.07 0.00 0.01 0.00 0.00 42.46 40.49 2jbp s ILE 182 CO 0.48 0.52 0.53 0.00 0.00 0.00 0.00 174.94 176.47 2jbp s ALA 183 N 1.29 3.61 -0.02 9.38 0.00 -0.71 -3.42 121.76 131.87 2jbp s ALA 183 Ca 0.04 -0.06 -0.02 0.00 0.00 0.00 0.00 51.96 51.91 2jbp s ALA 183 Cb -0.13 -2.55 -0.27 0.00 0.00 0.00 0.00 23.12 20.17 2jbp s ALA 183 CO -0.12 0.43 0.75 1.25 0.00 0.00 0.00 175.76 178.08 2jbp h HIS 184 N 4.28 0.43 0.00 0.00 2.76 -1.88 -2.43 115.15 118.31 2jbp h HIS 184 Ca -0.50 -0.31 0.00 0.00 -2.20 0.00 0.00 60.37 57.36 2jbp h HIS 184 Cb 1.21 -0.02 0.00 0.00 1.55 0.00 0.00 27.41 30.15 2jbp h HIS 184 CO 0.68 1.42 0.00 0.54 -1.30 0.00 0.00 177.93 179.27 2jbp n ARG 185 N -3.42 -0.77 -2.14 5.26 5.12 -1.26 -2.66 116.66 116.78 2jbp n ARG 185 Ca -0.19 0.19 -0.03 0.00 -1.93 0.00 0.00 57.85 55.89 2jbp n ARG 185 Cb 1.05 -3.95 0.07 0.00 -1.16 0.00 0.00 32.46 28.46 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 -0.39 -1.27 -4.59 0.55 2.03 -1.26 -4.92 116.55 106.70 2jbp n ASP 186 Ca 0.00 -2.09 -0.43 0.00 0.52 0.00 0.00 54.79 52.79 2jbp n ASP 186 Cb 0.19 0.55 -0.03 0.00 -0.72 0.00 0.00 41.12 41.12 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 0.09 3.51 0.33 5.18 1.01 -1.26 -4.91 120.40 124.35 2jbp s VAL 187 Ca 0.06 0.51 0.04 0.00 0.00 0.00 0.00 61.98 62.59 2jbp s VAL 187 Cb 0.30 -3.73 -0.03 0.00 0.00 0.00 0.00 36.38 32.92 2jbp s VAL 187 CO -0.09 -0.49 0.17 -1.59 0.00 0.00 0.00 175.10 173.10 2jbp s LYS 188 N 5.70 1.70 0.21 2.72 -2.85 -1.26 -4.79 119.74 121.17 2jbp s LYS 188 Ca 0.77 -1.99 -0.08 0.00 -1.00 0.00 0.00 55.97 53.67 2jbp s LYS 188 Cb -0.21 -0.16 0.14 0.00 -2.06 0.00 0.00 37.83 35.54 2jbp s LYS 188 CO 0.32 -0.48 1.75 -1.35 0.10 0.00 0.00 175.35 175.69 2jbp h PRO 189 N 2.10 1.17 0.00 1.78 0.11 -1.96 -2.12 132.00 133.08 2jbp h PRO 189 Ca -0.33 -0.24 0.00 0.00 0.11 0.00 0.00 66.00 65.54 2jbp h PRO 189 Cb 1.25 -0.18 0.00 0.00 0.11 0.00 0.00 31.00 32.19 2jbp h PRO 189 CO 0.51 0.98 0.00 0.39 -0.21 0.00 0.00 178.00 179.67 2jbp n GLU 190 N -4.26 0.00 -0.33 1.05 4.71 -1.26 -1.64 120.64 118.92 2jbp n GLU 190 Ca 0.06 0.42 0.09 0.00 -0.01 0.00 0.00 57.16 57.73 2jbp n GLU 190 Cb 0.22 -1.50 0.25 0.00 -1.01 0.00 0.00 31.44 29.40 2jbp n GLU 190 CO 0.00 0.00 0.00 0.09 0.09 0.00 0.00 177.13 177.31 2jbp n ASN 191 N -1.48 3.64 -4.05 1.62 5.03 -0.80 -4.81 115.26 114.41 2jbp n ASN 191 Ca 0.01 -2.11 -0.33 0.00 0.87 0.00 0.00 54.58 53.02 2jbp n ASN 191 Cb 0.04 -0.40 -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 -1.21 4.88 0.17 3.41 1.43 -0.65 -1.05 118.68 125.66 2jbp s LEU 192 Ca 0.38 -2.10 0.08 0.00 -1.03 0.00 0.00 54.13 51.46 2jbp s LEU 192 Cb 0.21 -1.69 -0.04 0.00 0.03 0.00 0.00 46.19 44.71 2jbp s LEU 192 CO 0.24 -0.42 -0.08 -0.76 0.23 0.00 0.00 176.35 175.56 2jbp s LEU 193 N 0.97 3.05 0.07 1.79 1.43 0.03 -0.91 118.68 125.11 2jbp s LEU 193 Ca 0.10 -0.51 -0.12 0.00 -1.03 0.00 0.00 54.13 52.57 2jbp s LEU 193 Cb -0.20 -1.75 -0.06 0.00 0.03 0.00 0.00 46.19 44.21 2jbp s LEU 193 CO -0.07 0.11 0.42 -0.31 0.23 0.00 0.00 176.35 176.74 2jbp s TYR 194 N -1.63 3.63 0.01 0.29 2.02 0.13 0.75 117.35 122.55 2jbp s TYR 194 Ca 0.25 0.89 -0.27 0.00 -0.37 0.00 0.00 57.07 57.57 2jbp s TYR 194 Cb -0.09 -2.23 -0.15 0.00 -0.40 0.00 0.00 41.96 39.09 2jbp s TYR 194 CO 0.16 0.54 1.12 1.79 -1.57 0.00 0.00 175.55 177.59 2jbp h THR 195 N 3.10 0.00 -3.35 -0.71 1.35 -1.38 -1.34 112.91 110.57 2jbp h THR 195 Ca -0.50 -0.28 0.00 0.00 -0.55 0.00 0.00 66.41 65.09 2jbp h THR 195 Cb 1.20 0.00 0.00 0.00 -1.73 0.00 0.00 68.15 67.62 2jbp h THR 195 CO 0.65 0.00 0.00 -1.54 -0.25 0.00 0.00 175.52 174.38 2jbp n SER 196 N -5.36 1.79 -0.01 5.36 3.41 -1.26 -0.62 113.62 116.93 2jbp n SER 196 Ca -0.12 -0.57 0.11 0.00 -0.26 0.00 0.00 58.87 58.03 2jbp n SER 196 Cb 0.38 0.00 -0.16 0.00 -0.26 0.00 0.00 64.21 64.17 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 0.00 0.57 -1.57 4.33 4.01 -1.26 -3.69 118.16 120.54 2jbp n LYS 197 Ca 0.00 -0.17 -0.50 0.00 -0.51 0.00 0.00 58.31 57.13 2jbp n LYS 197 Cb 0.00 -1.52 -0.05 0.00 -0.51 0.00 0.00 35.03 32.95 2jbp n LYS 197 CO 0.00 0.00 0.00 0.54 -1.11 0.00 0.00 177.40 176.83 2jbp n ARG 198 N -2.16 1.09 0.00 1.97 1.74 -1.26 -4.78 116.66 113.26 2jbp n ARG 198 Ca -0.03 0.39 0.07 0.00 -0.77 0.00 0.00 57.85 57.51 2jbp n ARG 198 Cb 0.54 -1.91 0.33 0.00 -1.02 0.00 0.00 32.46 30.39 2jbp n ARG 198 CO 0.00 0.00 0.00 -0.35 -1.52 0.00 0.00 177.63 175.76 2jbp n PRO 199 N 1.93 0.01 -0.27 5.56 -0.04 -1.26 -0.27 135.00 140.66 2jbp n PRO 199 Ca 0.16 0.23 0.05 0.00 -0.04 0.00 0.00 63.50 63.90 2jbp n PRO 199 Cb 0.22 -1.50 0.17 0.00 -0.04 0.00 0.00 33.50 32.35 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 -1.49 2.39 -4.57 3.54 0.23 -1.26 -4.97 115.26 109.14 2jbp n ASN 200 Ca 0.04 -2.17 -0.34 0.00 -0.53 0.00 0.00 54.58 51.58 2jbp n ASN 200 Cb 0.18 -0.37 0.11 0.00 -2.08 0.00 0.00 39.78 37.61 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 0.44 -0.98 -2.72 -2.53 0.00 0.63 -5.04 120.51 110.31 2jbp n ALA 201 Ca 0.12 -0.35 -0.33 0.00 0.00 0.00 0.00 53.44 52.88 2jbp n ALA 201 Cb 0.45 -2.04 -0.08 0.00 0.00 0.00 0.00 19.45 17.78 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 -2.10 4.36 -0.24 0.00 -1.09 -1.26 -4.82 121.20 116.04 2jbp s ILE 202 Ca 0.68 -0.53 -0.19 0.00 -2.23 0.00 0.00 60.65 58.38 2jbp s ILE 202 Cb -0.29 -2.96 -0.02 0.00 -1.58 0.00 0.00 42.46 37.60 2jbp s ILE 202 CO 0.56 0.37 0.57 -0.22 -1.23 0.00 0.00 174.94 175.00 2jbp s LEU 203 N -1.61 4.08 0.14 2.97 2.96 -1.26 -0.99 118.68 124.97 2jbp s LEU 203 Ca 0.20 0.65 0.11 0.00 -0.22 0.00 0.00 54.13 54.87 2jbp s LEU 203 Cb -0.12 -2.77 -0.04 0.00 0.50 0.00 0.00 46.19 43.76 2jbp s LEU 203 CO 0.11 -0.30 -0.25 -0.54 -1.32 0.00 0.00 176.35 174.05 2jbp s LYS 204 N 2.25 1.48 0.02 1.98 1.02 0.23 -4.62 119.74 122.10 2jbp s LYS 204 Ca 0.24 -1.35 -0.05 0.00 0.02 0.00 0.00 55.97 54.83 2jbp s LYS 204 Cb -0.16 -1.93 -0.05 0.00 -0.52 0.00 0.00 37.83 35.18 2jbp s LYS 204 CO 0.09 0.45 0.26 -1.17 -0.92 0.00 0.00 175.35 174.06 2jbp s LEU 205 N -2.17 4.36 0.28 3.17 2.96 -0.30 -0.79 118.68 126.19 2jbp s LEU 205 Ca 0.16 0.51 0.03 0.00 -0.22 0.00 0.00 54.13 54.61 2jbp s LEU 205 Cb -0.10 -2.73 -0.04 0.00 0.50 0.00 0.00 46.19 43.82 2jbp s LEU 205 CO 0.07 0.23 0.19 0.42 -1.32 0.00 0.00 176.35 175.94 2jbp s THR 206 N -1.35 0.13 -0.11 3.68 -4.23 -0.21 -1.79 115.64 111.76 2jbp s THR 206 Ca 0.29 -2.00 -0.03 0.00 -1.18 0.00 0.00 61.69 58.77 2jbp s THR 206 Cb -0.13 -2.50 0.00 0.00 1.34 0.00 0.00 72.50 71.21 2jbp s THR 206 CO 0.18 0.00 0.10 -0.67 -0.54 0.00 0.00 174.62 173.68 2jbp n ASP 207 N -0.91 -3.85 -1.55 3.99 2.03 -1.26 -4.91 116.55 110.09 2jbp n ASP 207 Ca 0.03 0.30 -0.11 0.00 0.52 0.00 0.00 54.79 55.54 2jbp n ASP 207 Cb 0.64 -2.35 0.08 0.00 -0.72 0.00 0.00 41.12 38.77 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 -0.12 1.36 0.25 -0.67 3.01 -1.26 -4.37 117.46 115.65 2jbp n PHE 208 Ca 0.02 -1.11 0.10 0.00 1.01 0.00 0.00 57.45 57.47 2jbp n PHE 208 Cb 0.07 -0.57 0.63 0.00 -0.01 0.00 0.00 39.48 39.61 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 2.67 0.00 0.00 1.37 0.00 -1.91 -2.82 103.07 102.38 2jbp h GLY 209 Ca 0.28 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.61 2jbp h GLY 209 CO 0.49 0.00 -0.74 0.69 0.00 0.00 0.00 176.54 176.98 2jbp n PHE 210 N -3.90 0.00 -0.80 5.60 0.99 -1.26 -4.97 117.46 113.11 2jbp n PHE 210 Ca -0.02 0.00 -0.29 0.00 -0.00 0.00 0.00 57.45 57.14 2jbp n PHE 210 Cb 0.25 -0.06 -0.03 0.00 -1.00 0.00 0.00 39.48 38.64 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 -1.40 -2.13 -3.72 4.37 0.00 -1.07 -4.76 120.51 111.80 2jbp n ALA 211 Ca 0.00 0.28 -0.14 0.00 0.00 0.00 0.00 53.44 53.58 2jbp n ALA 211 Cb 0.12 -0.93 -0.14 0.00 0.00 0.00 0.00 19.45 18.49 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 -0.33 0.11 0.98 0.00 2.20 -0.91 -4.90 119.74 116.88 2jbp s LYS 212 Ca 0.42 0.49 -0.11 0.00 -0.36 0.00 0.00 55.97 56.41 2jbp s LYS 212 Cb -0.60 -0.18 0.18 0.00 -1.51 0.00 0.00 37.83 35.73 2jbp s LYS 212 CO 0.31 -0.21 1.10 -2.00 -0.36 0.00 0.00 175.35 174.19 2jbp s GLU 213 N 1.59 0.51 -0.20 4.03 2.12 -1.26 -1.75 118.70 123.73 2jbp s GLU 213 Ca -0.05 1.24 0.19 0.00 0.36 0.00 0.00 54.97 56.71 2jbp s GLU 213 Cb -0.11 -1.69 0.47 0.00 0.26 0.00 0.00 34.13 33.06 2jbp s GLU 213 CO -0.07 -2.88 1.15 -2.37 -0.54 0.00 0.00 175.26 170.55 2jbp n THR 214 N -4.38 1.35 -4.17 -1.70 5.66 -0.01 -4.78 114.28 106.26 2jbp n THR 214 Ca 0.08 -2.79 -0.10 0.00 -3.05 0.00 0.00 64.05 58.19 2jbp n THR 214 Cb 0.53 0.53 -0.04 0.00 -1.55 0.00 0.00 70.33 69.80 2jbp n THR 214 CO 0.00 0.00 0.00 0.35 -3.05 0.00 0.00 175.07 172.37 2jbp n THR 215 N -0.43 0.00 -1.86 1.09 -2.24 -1.26 -4.62 114.28 104.96 2jbp n THR 215 Ca 0.16 -1.16 0.00 0.00 -2.27 0.00 0.00 64.05 60.78 2jbp n THR 215 Cb 0.91 0.53 0.00 0.00 -2.10 0.00 0.00 70.33 69.66 2jbp n THR 215 CO 0.00 0.00 0.00 -0.81 -0.57 0.00 0.00 175.07 173.69 2jbp n PRO 227 N -0.35 -4.94 -0.68 -0.78 -0.04 -1.26 -4.92 135.00 122.02 2jbp n PRO 227 Ca 0.02 3.56 0.52 0.00 -0.04 0.00 0.00 63.50 67.55 2jbp n PRO 227 Cb 0.29 -3.78 0.81 0.00 -0.04 0.00 0.00 33.50 30.78 2jbp n PRO 227 CO 0.00 0.00 0.00 0.10 -0.04 0.00 0.00 175.50 175.56 2jbp h TYR 228 N 3.68 0.00 -0.01 0.54 -0.00 -2.11 -0.84 116.97 118.23 2jbp h TYR 228 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58.73 58.73 2jbp h TYR 228 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36.73 36.73 2jbp h TYR 228 CO 0.00 0.00 -0.08 2.48 -0.00 0.00 0.00 178.16 180.56 2jbp n TYR 229 N -3.91 0.00 -0.50 0.10 0.18 -1.26 -5.04 117.16 106.73 2jbp n TYR 229 Ca 0.43 0.00 -0.29 0.00 1.88 0.00 0.00 57.90 59.93 2jbp n TYR 229 Cb 1.99 0.00 0.25 0.00 -0.38 0.00 0.00 39.34 41.20 2jbp n TYR 229 CO 0.00 0.00 0.00 1.55 -2.08 0.00 0.00 176.86 176.33 2jbp n VAL 230 N 0.12 0.00 -4.94 -3.48 3.14 -0.32 -5.00 118.33 107.84 2jbp n VAL 230 Ca 0.04 -0.42 -0.33 0.00 -2.96 0.00 0.00 64.34 60.68 2jbp n VAL 230 Cb 0.20 -0.96 -0.15 0.00 -1.06 0.00 0.00 33.84 31.87 2jbp n VAL 230 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 2jbp s ALA 231 N -2.40 2.49 0.21 1.55 0.00 -1.26 -5.03 121.76 117.32 2jbp s ALA 231 Ca 0.68 -0.94 -0.10 0.00 0.00 0.00 0.00 51.96 51.60 2jbp s ALA 231 Cb -0.24 -1.02 0.31 0.00 0.00 0.00 0.00 23.12 22.16 2jbp s ALA 231 CO 0.65 0.34 1.70 -1.00 0.00 0.00 0.00 175.76 177.45 2jbp h PRO 232 N 6.35 0.23 -2.03 0.00 0.13 -1.94 0.71 132.00 135.44 2jbp h PRO 232 Ca -0.29 -0.01 -0.00 0.00 -0.87 0.00 0.00 66.00 64.82 2jbp h PRO 232 Cb 1.20 -0.05 -0.00 0.00 0.13 0.00 0.00 31.00 32.28 2jbp h PRO 232 CO 0.52 0.15 0.01 -0.85 -0.23 0.00 0.00 178.00 177.60 2jbp n GLU 233 N -5.15 0.41 0.05 0.86 -0.00 -1.26 -2.71 120.64 112.83 2jbp n GLU 233 Ca 0.09 -0.02 0.00 0.00 -0.00 0.00 0.00 57.16 57.23 2jbp n GLU 233 Cb 0.34 -1.33 0.00 0.00 -0.00 0.00 0.00 31.44 30.45 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 1.86 0.13 -0.55 3.84 0.31 0.24 -4.71 118.33 119.45 2jbp n VAL 234 Ca 0.01 0.04 -0.19 0.00 -0.01 0.00 0.00 64.34 64.19 2jbp n VAL 234 Cb 0.20 -0.75 -0.05 0.00 -0.91 0.00 0.00 33.84 32.33 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 -3.00 0.14 -2.01 7.52 4.77 -1.10 -4.58 117.00 118.73 2jbp n LEU 235 Ca 0.00 -1.01 0.00 0.00 -0.03 0.00 0.00 56.01 54.97 2jbp n LEU 235 Cb 0.07 -0.30 0.00 0.00 -2.33 0.00 0.00 43.42 40.86 2jbp n LEU 235 CO 0.00 -1.41 -0.48 0.61 -1.33 0.00 0.00 177.39 174.78 2jbp n GLY 236 N 4.10 -5.31 0.23 -0.72 0.00 -1.26 -4.89 105.19 97.35 2jbp n GLY 236 Ca 0.20 -0.28 -0.09 0.00 0.00 0.00 0.00 46.02 45.85 2jbp n GLY 236 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2jbp h PRO 237 N 3.97 -0.53 0.00 1.61 0.13 -1.84 -3.42 132.00 131.92 2jbp h PRO 237 Ca 0.00 0.04 0.00 0.00 -0.87 0.00 0.00 66.00 65.17 2jbp h PRO 237 Cb 0.00 0.12 0.00 0.00 0.13 0.00 0.00 31.00 31.25 2jbp h PRO 237 CO 0.00 -0.35 0.00 -1.91 -0.23 0.00 0.00 178.00 175.51 2jbp n GLU 238 N -3.65 0.00 -2.99 0.86 2.13 -1.26 -4.77 120.64 110.95 2jbp n GLU 238 Ca -0.07 0.00 -0.25 0.00 0.66 0.00 0.00 57.16 57.50 2jbp n GLU 238 Cb 0.23 0.00 -0.00 0.00 0.27 0.00 0.00 31.44 31.93 2jbp n GLU 238 CO 0.00 0.00 0.00 0.15 -0.41 0.00 0.00 177.13 176.87 2jbp s LYS 239 N -4.87 3.42 -1.37 5.31 -0.14 -1.26 -4.98 119.74 115.85 2jbp s LYS 239 Ca 0.00 -0.13 -0.16 0.00 -1.36 0.00 0.00 55.97 54.32 2jbp s LYS 239 Cb 0.00 -2.52 0.02 0.00 -1.68 0.00 0.00 37.83 33.65 2jbp s LYS 239 CO 0.00 -0.08 2.12 2.48 -0.76 0.00 0.00 175.35 179.10 2jbp n TYR 240 N -2.05 3.55 -0.06 3.18 0.18 -1.26 -4.22 117.16 116.49 2jbp n TYR 240 Ca -0.01 -2.82 -0.11 0.00 1.88 0.00 0.00 57.90 56.83 2jbp n TYR 240 Cb 0.56 -2.50 -0.15 0.00 -0.38 0.00 0.00 39.34 36.88 2jbp n TYR 240 CO 0.00 0.00 0.00 -0.25 -2.08 0.00 0.00 176.86 174.53 2jbp n ASP 241 N 6.75 0.71 -0.21 9.48 9.92 -1.26 -4.33 116.55 137.61 2jbp n ASP 241 Ca 0.51 0.18 -0.07 0.00 -0.53 0.00 0.00 54.79 54.88 2jbp n ASP 241 Cb 0.40 0.28 0.03 0.00 -0.64 0.00 0.00 41.12 41.19 2jbp n ASP 241 CO 0.00 0.00 0.00 0.11 0.13 0.00 0.00 177.20 177.44 2jbp h LYS 242 N 0.01 0.87 -0.43 -1.24 1.57 -1.96 -2.19 116.57 113.19 2jbp h LYS 242 Ca -0.43 -0.15 0.13 0.00 -1.87 0.00 0.00 60.65 58.33 2jbp h LYS 242 Cb 2.10 -0.15 -0.02 0.00 0.08 0.00 0.00 32.23 34.25 2jbp h LYS 242 CO 0.05 0.73 0.36 0.66 -0.57 0.00 0.00 179.45 180.68 2jbp h SER 243 N 0.81 0.00 -0.37 0.86 4.64 -1.91 0.57 113.55 118.16 2jbp h SER 243 Ca 0.20 0.00 0.08 0.00 -0.47 0.00 0.00 61.79 61.60 2jbp h SER 243 Cb 0.17 0.00 -0.08 0.00 -0.31 0.00 0.00 62.40 62.18 2jbp h SER 243 CO -0.02 0.00 -0.13 0.00 -0.87 0.00 0.00 176.83 175.81 2jbp h ASP 245 N -0.05 1.10 -0.28 0.00 3.32 0.07 -2.54 116.42 118.03 2jbp h ASP 245 Ca 0.18 -0.18 -0.03 0.00 0.02 0.00 0.00 57.03 57.02 2jbp h ASP 245 Cb 0.33 -0.29 -0.02 0.00 0.22 0.00 0.00 39.33 39.58 2jbp h ASP 245 CO -0.41 0.98 0.09 0.24 -1.72 0.00 0.00 179.24 178.42 2jbp h MET 246 N 1.15 0.52 0.60 3.56 2.86 -1.06 0.24 114.93 122.80 2jbp h MET 246 Ca 0.26 -0.08 -0.03 0.00 -2.06 0.00 0.00 59.70 57.79 2jbp h MET 246 Cb 0.24 -0.09 0.01 0.00 0.06 0.00 0.00 31.60 31.81 2jbp h MET 246 CO -0.02 0.48 -0.29 2.35 1.06 0.00 0.00 176.91 180.49 2jbp h TRP 247 N 0.51 -0.75 -0.83 -0.22 2.91 -0.93 -0.92 115.95 115.73 2jbp h TRP 247 Ca 0.12 -0.02 0.13 0.00 1.13 0.00 0.00 58.89 60.26 2jbp h TRP 247 Cb 0.20 0.25 -0.14 0.00 -0.51 0.00 0.00 29.16 28.96 2jbp h TRP 247 CO 0.01 -0.42 -0.30 0.43 -1.03 0.00 0.00 178.44 177.13 2jbp n SER 248 N -5.37 -0.50 -0.37 2.65 7.64 -0.86 0.32 113.62 117.13 2jbp n SER 248 Ca -0.12 1.44 0.00 0.00 1.01 0.00 0.00 58.87 61.20 2jbp n SER 248 Cb 0.35 -0.35 0.14 0.00 -1.01 0.00 0.00 64.21 63.35 2jbp n SER 248 CO 0.00 0.00 0.00 0.25 -3.01 0.00 0.00 175.04 172.28 2jbp h LEU 249 N 0.00 1.10 -1.23 -3.43 5.85 -0.02 0.29 115.31 117.87 2jbp h LEU 249 Ca 0.30 -0.01 -0.06 0.00 0.84 0.00 0.00 57.88 58.95 2jbp h LEU 249 Cb 0.51 -0.25 -0.01 0.00 0.37 0.00 0.00 40.66 41.28 2jbp h LEU 249 CO -0.82 0.75 -0.16 1.23 -0.34 0.00 0.00 178.44 179.09 2jbp h GLY 250 N 1.27 0.36 0.93 3.75 0.00 0.13 -1.75 103.07 107.76 2jbp h GLY 250 Ca 0.40 -0.24 -0.18 0.00 0.00 0.00 0.00 47.33 47.30 2jbp h GLY 250 CO -0.12 0.22 -0.70 -2.08 0.00 0.00 0.00 176.54 173.86 2jbp h VAL 251 N 0.31 1.37 -0.71 4.60 2.07 0.98 -2.06 116.25 122.80 2jbp h VAL 251 Ca 0.06 -2.06 0.03 0.00 0.82 0.00 0.00 66.70 65.55 2jbp h VAL 251 Cb 0.48 2.42 -0.04 0.00 -1.52 0.00 0.00 31.29 32.62 2jbp h VAL 251 CO 0.03 0.62 0.45 0.40 0.02 0.00 0.00 177.57 179.08 2jbp h ILE 252 N 0.11 1.10 -0.11 4.57 2.04 -1.03 -0.22 117.51 123.97 2jbp h ILE 252 Ca -0.08 -0.30 -0.05 0.00 1.00 0.00 0.00 64.86 65.43 2jbp h ILE 252 Cb 1.38 0.15 -0.01 0.00 -0.74 0.00 0.00 36.82 37.60 2jbp h ILE 252 CO 0.14 0.16 -0.16 -0.03 0.00 0.00 0.00 178.15 178.26 2jbp h MET 253 N 0.88 0.17 0.06 2.37 4.05 -1.22 0.31 114.93 121.54 2jbp h MET 253 Ca 0.28 -0.04 -0.00 0.00 -0.28 0.00 0.00 59.70 59.66 2jbp h MET 253 Cb 0.01 -0.02 0.00 0.00 -0.80 0.00 0.00 31.60 30.79 2jbp h MET 253 CO -0.11 0.34 -0.03 -0.92 0.23 0.00 0.00 176.91 176.42 2jbp h TYR 254 N 0.16 -0.07 -0.49 1.39 5.03 -0.49 -2.94 116.97 119.56 2jbp h TYR 254 Ca 0.03 -0.00 -0.02 0.00 2.58 0.00 0.00 58.73 61.32 2jbp h TYR 254 Cb 0.39 0.02 -0.02 0.00 1.55 0.00 0.00 36.73 38.67 2jbp h TYR 254 CO 0.00 0.33 0.21 0.82 -1.32 0.00 0.00 178.16 178.21 2jbp h ILE 255 N -0.49 1.20 -1.26 1.81 2.04 -0.51 -1.77 117.51 118.53 2jbp h ILE 255 Ca -0.01 -0.60 0.38 0.00 1.00 0.00 0.00 64.86 65.63 2jbp h ILE 255 Cb 0.44 0.69 -0.10 0.00 -0.74 0.00 0.00 36.82 37.11 2jbp h ILE 255 CO 0.01 0.23 0.84 -0.07 0.00 0.00 0.00 178.15 179.16 2jbp h LEU 256 N 0.64 0.25 0.00 1.44 3.38 -0.37 0.39 115.31 121.04 2jbp h LEU 256 Ca 0.16 0.09 0.00 0.00 0.09 0.00 0.00 57.88 58.22 2jbp h LEU 256 Cb 0.16 0.06 0.00 0.00 0.09 0.00 0.00 40.66 40.97 2jbp h LEU 256 CO -0.02 -0.05 -0.86 0.18 0.09 0.00 0.00 178.44 177.78 2jbp n LEU 257 N -4.53 0.63 0.00 1.67 4.77 -0.67 -4.58 117.00 114.29 2jbp n LEU 257 Ca 0.32 0.01 0.00 0.00 -0.03 0.00 0.00 56.01 56.31 2jbp n LEU 257 Cb 1.27 -0.13 0.00 0.00 -2.33 0.00 0.00 43.42 42.22 2jbp n LEU 257 CO 0.27 0.05 0.00 0.00 -1.33 0.00 0.00 177.39 176.38 2jbp n GLY 259 N 0.00 0.86 3.13 0.00 0.00 0.13 -4.44 105.19 104.88 2jbp n GLY 259 Ca 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 45.94 2jbp n GLY 259 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 2jbp s TYR 260 N -3.40 0.57 0.41 1.61 1.13 -1.26 -4.29 117.35 112.12 2jbp s TYR 260 Ca 0.00 -1.05 -0.18 0.00 -1.41 0.00 0.00 57.07 54.44 2jbp s TYR 260 Cb 0.00 -0.36 -0.10 0.00 -1.10 0.00 0.00 41.96 40.40 2jbp s TYR 260 CO 0.00 -0.45 0.88 -1.25 -2.51 0.00 0.00 175.55 172.21 2jbp s PRO 261 N -3.95 4.08 0.32 -3.49 0.04 -1.26 -4.03 135.00 126.71 2jbp s PRO 261 Ca 0.12 0.91 0.17 0.00 0.04 0.00 0.00 61.00 62.23 2jbp s PRO 261 Cb 0.07 -2.27 0.31 0.00 0.04 0.00 0.00 34.50 32.66 2jbp s PRO 261 CO -0.06 -0.01 1.56 -1.00 0.04 0.00 0.00 177.00 177.52 2jbp h PRO 262 N 1.81 0.00 -4.63 0.56 0.13 -1.93 -3.39 132.00 124.54 2jbp h PRO 262 Ca -0.48 0.00 -0.70 0.00 -0.87 0.00 0.00 66.00 63.95 2jbp h PRO 262 Cb 1.18 0.00 -0.30 0.00 0.13 0.00 0.00 31.00 32.01 2jbp h PRO 262 CO 0.63 0.45 -0.59 -0.06 -0.23 0.00 0.00 178.00 178.19 2jbp s PHE 263 N -3.20 3.31 0.74 1.56 0.40 -1.26 -4.73 117.98 114.80 2jbp s PHE 263 Ca 0.03 -1.61 -0.11 0.00 -0.60 0.00 0.00 56.93 54.63 2jbp s PHE 263 Cb 0.09 -2.47 0.03 0.00 0.51 0.00 0.00 43.02 41.18 2jbp s PHE 263 CO 0.72 -0.79 1.08 0.71 0.70 0.00 0.00 175.22 177.64 2jbp s TYR 264 N 1.36 3.04 -0.13 0.36 4.12 -1.26 -5.06 117.35 119.78 2jbp s TYR 264 Ca -0.00 1.24 -0.14 0.00 0.02 0.00 0.00 57.07 58.19 2jbp s TYR 264 Cb -0.20 -3.00 -0.05 0.00 -1.52 0.00 0.00 41.96 37.19 2jbp s TYR 264 CO 0.01 -1.44 -0.27 0.45 0.02 0.00 0.00 175.55 174.33 2jbp n SER 265 N -3.23 1.56 0.00 2.29 2.88 -1.26 -4.58 113.62 111.29 2jbp n SER 265 Ca 0.07 0.26 0.00 0.00 -1.33 0.00 0.00 58.87 57.87 2jbp n SER 265 Cb 0.55 -0.67 0.00 0.00 -0.75 0.00 0.00 64.21 63.34 2jbp n SER 265 CO 0.00 0.00 0.00 -3.20 -1.23 0.00 0.00 175.04 170.61 2jbp n ASN 266 N -4.07 0.00 -4.57 -3.46 4.05 -1.26 -3.43 115.26 102.52 2jbp n ASN 266 Ca -0.11 0.00 -0.51 0.00 0.45 0.00 0.00 54.58 54.41 2jbp n ASN 266 Cb 0.40 0.00 -0.05 0.00 1.23 0.00 0.00 39.78 41.36 2jbp n ASN 266 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 2jbp n ILE 271 N 0.00 0.49 0.12 -1.44 3.06 -1.26 -5.20 119.36 115.13 2jbp n ILE 271 Ca 0.00 -0.12 0.02 0.00 -2.50 0.00 0.00 62.75 60.15 2jbp n ILE 271 Cb 0.00 -0.71 -0.03 0.00 0.54 0.00 0.00 39.64 39.44 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 2.15 1.52 0.26 9.51 2.88 -1.22 -3.68 113.62 125.05 2jbp n SER 272 Ca 0.17 -0.39 0.17 0.00 -1.33 0.00 0.00 58.87 57.49 2jbp n SER 272 Cb 0.21 1.07 0.68 0.00 -0.75 0.00 0.00 64.21 65.41 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 -3.08 132.00 125.57 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 0.13 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.24 2jbp h PRO 273 CO 0.00 0.00 -0.64 0.41 -0.21 0.00 0.00 178.00 177.56 2jbp n GLY 274 N 0.00 -1.28 0.11 -0.55 0.00 -1.26 -3.60 105.19 98.62 2jbp n GLY 274 Ca 0.01 -0.34 -0.16 0.00 0.00 0.00 0.00 46.02 45.53 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 0.23 -0.50 1.61 -1.53 -1.61 0.39 114.93 113.52 2jbp h MET 275 Ca 0.00 -0.39 0.10 0.00 -3.44 0.00 0.00 59.70 55.97 2jbp h MET 275 Cb 0.60 0.14 -0.10 0.00 -0.55 0.00 0.00 31.60 31.70 2jbp h MET 275 CO 0.00 1.09 -0.14 -0.22 0.14 0.00 0.00 176.91 177.78 2jbp h LYS 276 N 0.06 -0.02 0.04 0.39 3.64 -1.71 -2.33 116.57 116.64 2jbp h LYS 276 Ca -0.22 0.00 -0.24 0.00 -1.27 0.00 0.00 60.65 58.92 2jbp h LYS 276 Cb 2.00 0.00 0.01 0.00 -0.41 0.00 0.00 32.23 33.83 2jbp h LYS 276 CO 0.16 -0.01 -1.04 1.15 -2.27 0.00 0.00 179.45 177.44 2jbp h THR 277 N -0.02 1.41 0.00 1.00 2.02 -1.55 0.71 112.91 116.49 2jbp h THR 277 Ca 0.24 -2.58 -0.02 0.00 0.77 0.00 0.00 66.41 64.82 2jbp h THR 277 Cb 0.38 2.56 -0.00 0.00 -1.74 0.00 0.00 68.15 69.35 2jbp h THR 277 CO -0.52 0.77 -0.09 0.03 0.37 0.00 0.00 175.52 176.08 2jbp h ARG 278 N 0.20 0.00 -0.21 6.66 3.08 -1.01 0.55 114.38 123.65 2jbp h ARG 278 Ca -0.10 0.00 -0.08 0.00 0.07 0.00 0.00 59.98 59.87 2jbp h ARG 278 Cb 1.70 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 31.74 2jbp h ARG 278 CO 0.18 0.09 -0.17 0.82 -1.07 0.00 0.00 179.97 179.81 2jbp h ILE 279 N 0.00 1.32 -0.01 2.04 2.04 -1.12 0.87 117.51 122.65 2jbp h ILE 279 Ca -0.00 -1.30 -0.13 0.00 1.00 0.00 0.00 64.86 64.43 2jbp h ILE 279 Cb 0.73 1.70 -0.02 0.00 -0.74 0.00 0.00 36.82 38.50 2jbp h ILE 279 CO 0.01 0.40 -0.59 0.03 0.00 0.00 0.00 178.15 178.00 2jbp h ARG 280 N 0.18 0.02 0.00 2.37 3.08 -0.78 -3.27 114.38 115.97 2jbp h ARG 280 Ca 0.04 -0.01 0.00 0.00 0.07 0.00 0.00 59.98 60.08 2jbp h ARG 280 Cb 0.70 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.75 2jbp h ARG 280 CO 0.04 0.61 -0.72 0.52 -1.07 0.00 0.00 179.97 179.35 2jbp h MET 281 N 0.01 0.00 -0.34 0.04 2.86 -0.87 -3.48 114.93 113.15 2jbp h MET 281 Ca -0.01 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.63 2jbp h MET 281 Cb 1.06 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.72 2jbp h MET 281 CO 0.08 0.00 0.00 0.41 1.06 0.00 0.00 176.91 178.46 2jbp n GLY 282 N 1.21 0.67 3.40 8.32 0.00 -0.31 -5.00 105.19 113.49 2jbp n GLY 282 Ca 0.02 -0.74 -0.45 0.00 0.00 0.00 0.00 46.02 44.84 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 -4.05 3.50 0.05 1.61 -0.21 0.15 -5.01 119.66 115.69 2jbp s GLN 283 Ca 0.00 -1.90 -0.07 0.00 0.02 0.00 0.00 55.36 53.41 2jbp s GLN 283 Cb 0.00 -4.63 -0.01 0.00 1.00 0.00 0.00 33.01 29.38 2jbp s GLN 283 CO 0.00 -1.58 0.14 1.52 -2.12 0.00 0.00 175.29 173.26 2jbp s TYR 284 N 1.89 0.15 0.33 0.91 1.13 -1.26 -4.78 117.35 115.71 2jbp s TYR 284 Ca 0.24 -0.45 0.07 0.00 -1.41 0.00 0.00 57.07 55.52 2jbp s TYR 284 Cb -0.10 -0.10 -0.06 0.00 -1.10 0.00 0.00 41.96 40.60 2jbp s TYR 284 CO -0.06 -0.42 -0.04 -1.21 -2.51 0.00 0.00 175.55 171.31 2jbp s GLU 285 N -2.85 1.72 -0.83 -3.49 2.02 -1.26 -5.08 118.70 108.92 2jbp s GLU 285 Ca -0.03 -1.91 0.01 0.00 0.02 0.00 0.00 54.97 53.06 2jbp s GLU 285 Cb 0.00 -1.36 0.25 0.00 0.10 0.00 0.00 34.13 33.12 2jbp s GLU 285 CO -0.06 0.02 0.91 1.19 0.02 0.00 0.00 175.26 177.34 2jbp n PHE 286 N -0.73 3.50 -1.69 1.61 3.01 -1.26 -5.03 117.46 116.88 2jbp n PHE 286 Ca -0.05 -3.80 -0.44 0.00 1.01 0.00 0.00 57.45 54.17 2jbp n PHE 286 Cb 0.65 -0.92 -0.02 0.00 -0.01 0.00 0.00 39.48 39.18 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 1.52 2.13 -2.54 -1.08 -0.04 -1.26 -4.68 135.00 129.05 2jbp n PRO 287 Ca 0.26 0.76 -0.34 0.00 -0.04 0.00 0.00 63.50 64.13 2jbp n PRO 287 Cb 0.37 -2.41 -0.04 0.00 -0.04 0.00 0.00 33.50 31.39 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 0.16 6.37 0.01 3.54 0.01 -1.26 -2.89 114.94 120.88 2jbp s ASN 288 Ca 0.64 1.90 -0.22 0.00 -0.71 0.00 0.00 52.86 54.47 2jbp s ASN 288 Cb -0.61 -2.56 -0.17 0.00 0.41 0.00 0.00 41.25 38.32 2jbp s ASN 288 CO 0.53 -0.76 1.29 1.55 -1.51 0.00 0.00 177.10 178.20 2jbp h PRO 289 N 1.52 0.24 -0.96 -0.60 0.13 -2.03 -3.47 132.00 126.83 2jbp h PRO 289 Ca -0.49 -0.13 0.29 0.00 -0.87 0.00 0.00 66.00 64.79 2jbp h PRO 289 Cb 1.22 0.01 -0.17 0.00 0.13 0.00 0.00 31.00 32.18 2jbp h PRO 289 CO 0.59 0.68 0.15 0.93 -0.23 0.00 0.00 178.00 180.12 2jbp h GLU 290 N -0.19 0.05 -0.00 0.86 3.07 -1.95 0.22 114.58 116.63 2jbp h GLU 290 Ca 0.01 -0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.87 2jbp h GLU 290 Cb 0.65 -0.01 0.00 0.00 -0.84 0.00 0.00 28.75 28.55 2jbp h GLU 290 CO 0.03 0.03 -0.34 0.91 -1.40 0.00 0.00 179.01 178.24 2jbp n TRP 291 N -5.40 0.00 -0.32 4.33 7.02 -1.14 -4.34 117.44 117.59 2jbp n TRP 291 Ca 0.25 0.00 0.04 0.00 -1.02 0.00 0.00 57.50 56.77 2jbp n TRP 291 Cb 0.83 -0.20 0.19 0.00 -2.42 0.00 0.00 31.31 29.70 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 0.54 0.81 1.04 -0.99 4.64 -0.80 -0.67 113.55 118.12 2jbp h SER 292 Ca 0.00 0.04 0.00 0.00 -0.47 0.00 0.00 61.79 61.36 2jbp h SER 292 Cb 0.49 -0.12 0.00 0.00 -0.31 0.00 0.00 62.40 62.46 2jbp h SER 292 CO 0.00 0.46 0.00 -0.62 -0.87 0.00 0.00 176.83 175.80 2jbp n GLU 293 N -4.67 0.08 -2.48 4.77 -0.58 -1.26 -4.79 120.64 111.71 2jbp n GLU 293 Ca 0.15 0.12 -0.42 0.00 -0.42 0.00 0.00 57.16 56.59 2jbp n GLU 293 Cb 0.28 -1.60 -0.03 0.00 -0.57 0.00 0.00 31.44 29.52 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 -3.05 4.32 0.96 2.62 1.01 -0.26 -5.02 120.40 120.98 2jbp s VAL 294 Ca 0.12 1.64 -0.11 0.00 0.00 0.00 0.00 61.98 63.62 2jbp s VAL 294 Cb 0.15 -4.05 0.12 0.00 0.00 0.00 0.00 36.38 32.60 2jbp s VAL 294 CO 0.50 -0.01 0.85 -1.54 0.00 0.00 0.00 175.10 174.90 2jbp n SER 295 N 5.30 -0.71 0.22 3.32 3.41 -1.26 -4.88 113.62 119.01 2jbp n SER 295 Ca 0.11 0.32 0.12 0.00 -0.26 0.00 0.00 58.87 59.16 2jbp n SER 295 Cb 0.46 -1.35 0.18 0.00 -0.26 0.00 0.00 64.21 63.24 2jbp n SER 295 CO 0.00 0.00 0.00 -0.33 -0.16 0.00 0.00 175.04 174.55 2jbp h GLU 296 N -1.87 0.00 -0.54 4.33 4.39 -1.98 -2.78 114.58 116.14 2jbp h GLU 296 Ca -0.45 0.00 -0.03 0.00 0.34 0.00 0.00 59.36 59.22 2jbp h GLU 296 Cb 1.28 0.00 -0.03 0.00 -0.10 0.00 0.00 28.75 29.91 2jbp h GLU 296 CO 0.39 0.00 0.23 1.49 -1.16 0.00 0.00 179.01 179.96 2jbp h GLU 297 N 0.00 0.77 -0.02 2.33 4.81 -1.98 0.74 114.58 121.22 2jbp h GLU 297 Ca 0.00 -0.11 -0.04 0.00 -0.13 0.00 0.00 59.36 59.08 2jbp h GLU 297 Cb 0.99 -0.14 0.00 0.00 0.63 0.00 0.00 28.75 30.23 2jbp h GLU 297 CO 0.00 0.62 -0.15 0.28 -0.73 0.00 0.00 179.01 179.03 2jbp h VAL 298 N 0.76 1.51 -0.97 0.32 2.07 -1.87 -2.18 116.25 115.89 2jbp h VAL 298 Ca 0.18 -1.71 0.03 0.00 0.82 0.00 0.00 66.70 66.03 2jbp h VAL 298 Cb 0.13 2.56 -0.05 0.00 -1.52 0.00 0.00 31.29 32.41 2jbp h VAL 298 CO -0.02 0.46 0.64 0.11 0.02 0.00 0.00 177.57 178.78 2jbp h LYS 299 N -0.48 1.20 -0.86 1.57 1.57 -1.42 0.84 116.57 119.00 2jbp h LYS 299 Ca -0.01 -0.07 -0.00 0.00 -1.87 0.00 0.00 60.65 58.69 2jbp h LYS 299 Cb 0.84 -0.27 -0.04 0.00 0.08 0.00 0.00 32.23 32.84 2jbp h LYS 299 CO 0.03 0.80 0.53 1.98 -0.57 0.00 0.00 179.45 182.22 2jbp h MET 300 N 1.24 1.16 -0.05 3.15 4.05 -0.87 0.18 114.93 123.79 2jbp h MET 300 Ca 0.38 -0.10 -0.00 0.00 -0.28 0.00 0.00 59.70 59.70 2jbp h MET 300 Cb -0.03 -0.25 -0.00 0.00 -0.80 0.00 0.00 31.60 30.53 2jbp h MET 300 CO -0.11 0.80 0.02 1.25 0.23 0.00 0.00 176.91 179.10 2jbp h LEU 301 N 1.17 0.06 -1.11 3.39 5.85 -0.24 -2.04 115.31 122.40 2jbp h LEU 301 Ca 0.31 -0.14 0.17 0.00 0.84 0.00 0.00 57.88 59.06 2jbp h LEU 301 Cb -0.07 -0.02 -0.09 0.00 0.37 0.00 0.00 40.66 40.85 2jbp h LEU 301 CO -0.06 0.19 0.61 0.40 -0.34 0.00 0.00 178.44 179.24 2jbp h ILE 302 N -0.06 0.76 -0.24 4.05 1.08 -0.70 -1.56 117.51 120.84 2jbp h ILE 302 Ca 0.02 -0.26 -0.10 0.00 -0.39 0.00 0.00 64.86 64.13 2jbp h ILE 302 Cb 0.14 -0.06 -0.01 0.00 -3.07 0.00 0.00 36.82 33.81 2jbp h ILE 302 CO -0.00 0.14 -0.27 0.03 -0.69 0.00 0.00 178.15 177.36 2jbp h ARG 303 N 0.76 0.46 -0.00 2.37 3.08 0.03 -1.44 114.38 119.64 2jbp h ARG 303 Ca 0.53 -0.18 0.00 0.00 0.07 0.00 0.00 59.98 60.40 2jbp h ARG 303 Cb 0.83 -0.03 0.00 0.00 0.08 0.00 0.00 29.97 30.86 2jbp h ARG 303 CO -0.31 0.69 -0.04 0.09 -1.07 0.00 0.00 179.97 179.33 2jbp n ASN 304 N -4.11 0.14 -0.06 7.04 4.13 -0.61 -3.01 115.26 118.77 2jbp n ASN 304 Ca -0.01 -0.21 -0.15 0.00 1.68 0.00 0.00 54.58 55.90 2jbp n ASN 304 Cb 0.41 -0.23 -0.14 0.00 -1.54 0.00 0.00 39.78 38.28 2jbp n ASN 304 CO 0.00 0.00 0.00 0.18 0.28 0.00 0.00 177.26 177.72 2jbp n LEU 305 N -1.22 1.71 -1.00 3.41 4.77 -0.84 -1.29 117.00 122.53 2jbp n LEU 305 Ca 0.14 0.11 0.05 0.00 -0.03 0.00 0.00 56.01 56.27 2jbp n LEU 305 Cb 0.26 -0.39 0.19 0.00 -2.33 0.00 0.00 43.42 41.15 2jbp n LEU 305 CO 0.24 0.69 0.60 0.18 -1.33 0.00 0.00 177.39 177.77 2jbp n LEU 306 N -3.15 2.85 -4.67 2.23 4.77 -0.60 -4.16 117.00 114.26 2jbp n LEU 306 Ca -0.33 -1.44 -0.43 0.00 -0.03 0.00 0.00 56.01 53.79 2jbp n LEU 306 Cb 1.06 -0.45 -0.01 0.00 -2.33 0.00 0.00 43.42 41.69 2jbp n LEU 306 CO 0.39 0.47 0.82 0.29 -1.33 0.00 0.00 177.39 178.02 2jbp n LYS 307 N 0.44 1.93 0.12 3.23 4.76 -1.16 -4.89 118.16 122.59 2jbp n LYS 307 Ca 0.14 0.68 0.00 0.00 -2.87 0.00 0.00 58.31 56.25 2jbp n LYS 307 Cb 0.56 -2.20 -0.01 0.00 -1.84 0.00 0.00 35.03 31.54 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 2.41 1.06 -3.64 -0.18 1.35 -1.91 -3.42 112.91 108.57 2jbp h THR 308 Ca -0.44 -2.51 -0.59 0.00 -0.55 0.00 0.00 66.41 62.32 2jbp h THR 308 Cb 1.30 2.52 -0.09 0.00 -1.73 0.00 0.00 68.15 70.15 2jbp h THR 308 CO 0.62 0.61 0.68 -0.70 -0.25 0.00 0.00 175.52 176.47 2jbp s GLU 309 N -2.90 3.65 0.33 4.72 2.56 -1.26 -4.92 118.70 120.88 2jbp s GLU 309 Ca 0.03 0.35 0.11 0.00 0.00 0.00 0.00 54.97 55.46 2jbp s GLU 309 Cb 0.08 -3.90 0.91 0.00 2.00 0.00 0.00 34.13 33.23 2jbp s GLU 309 CO 0.76 -1.21 1.74 -1.35 -0.56 0.00 0.00 175.26 174.64 2jbp h PRO 310 N 8.99 0.54 0.00 4.30 0.11 -1.97 -0.08 132.00 143.89 2jbp h PRO 310 Ca -0.24 -0.03 -0.19 0.00 0.11 0.00 0.00 66.00 65.65 2jbp h PRO 310 Cb 1.07 -0.12 -0.03 0.00 0.11 0.00 0.00 31.00 32.03 2jbp h PRO 310 CO 1.04 0.36 -0.92 0.00 -0.21 0.00 0.00 178.00 178.27 2jbp h THR 311 N 0.56 1.47 0.00 -1.15 1.03 -1.96 -2.50 112.91 110.36 2jbp h THR 311 Ca 0.64 -3.10 0.00 0.00 -0.01 0.00 0.00 66.41 63.94 2jbp h THR 311 Cb 1.26 2.72 0.00 0.00 -1.07 0.00 0.00 68.15 71.06 2jbp h THR 311 CO -0.45 0.84 0.00 1.56 -0.01 0.00 0.00 175.52 177.46 2jbp h GLN 312 N 0.00 0.00 -6.79 0.00 4.20 -1.42 -3.45 115.11 107.65 2jbp h GLN 312 Ca -0.02 0.00 -0.50 0.00 0.06 0.00 0.00 58.65 58.19 2jbp h GLN 312 Cb 1.69 0.00 0.00 0.00 0.30 0.00 0.00 27.48 29.47 2jbp h GLN 312 CO 0.11 0.00 0.43 0.50 -0.67 0.00 0.00 178.83 179.20 2jbp s ARG 313 N -3.89 4.71 0.54 1.46 3.52 -0.94 -4.98 118.95 119.37 2jbp s ARG 313 Ca -0.02 1.70 -0.19 0.00 -0.13 0.00 0.00 55.73 57.09 2jbp s ARG 313 Cb 0.11 -3.22 -0.10 0.00 -1.56 0.00 0.00 34.95 30.18 2jbp s ARG 313 CO 0.42 0.31 0.49 -0.12 -0.81 0.00 0.00 175.30 175.59 2jbp n MET 314 N 1.31 0.50 -4.06 5.12 0.00 -0.41 -5.02 117.12 114.56 2jbp n MET 314 Ca -0.01 0.19 -0.25 0.00 -0.00 0.00 0.00 57.70 57.63 2jbp n MET 314 Cb 0.46 -1.63 -0.05 0.00 0.00 0.00 0.00 33.22 32.00 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 -1.70 4.64 0.59 1.12 -4.23 -1.26 -4.89 115.64 109.91 2jbp s THR 315 Ca 0.67 -1.10 0.29 0.00 -1.18 0.00 0.00 61.69 60.37 2jbp s THR 315 Cb -0.47 -3.42 0.38 0.00 1.34 0.00 0.00 72.50 70.33 2jbp s THR 315 CO 0.56 -0.18 1.92 -0.29 -0.54 0.00 0.00 174.62 176.08 2jbp h ILE 316 N 1.79 0.38 0.20 2.99 6.09 -1.96 -0.20 117.51 126.81 2jbp h ILE 316 Ca -0.48 0.00 -0.27 0.00 -1.37 0.00 0.00 64.86 62.74 2jbp h ILE 316 Cb 1.21 0.64 0.03 0.00 0.47 0.00 0.00 36.82 39.17 2jbp h ILE 316 CO 0.63 0.00 -1.16 0.74 -3.07 0.00 0.00 178.15 175.29 2jbp h THR 317 N 0.00 1.39 -0.75 2.19 2.02 -1.98 -2.00 112.91 113.78 2jbp h THR 317 Ca 0.20 -2.62 0.11 0.00 0.77 0.00 0.00 66.41 64.87 2jbp h THR 317 Cb 1.11 3.12 -0.08 0.00 -1.74 0.00 0.00 68.15 70.55 2jbp h THR 317 CO -0.00 0.77 0.37 -0.33 0.37 0.00 0.00 175.52 176.69 2jbp h GLU 318 N -0.10 0.58 -0.24 6.66 5.08 -1.47 -1.95 114.58 123.13 2jbp h GLU 318 Ca -0.20 -0.03 -0.02 0.00 -1.00 0.00 0.00 59.36 58.11 2jbp h GLU 318 Cb 1.92 -0.13 -0.01 0.00 0.50 0.00 0.00 28.75 31.03 2jbp h GLU 318 CO 0.22 0.38 0.08 0.35 -1.00 0.00 0.00 179.01 179.05 2jbp h PHE 319 N 0.60 0.38 0.00 4.33 3.04 -1.29 -0.48 116.94 123.52 2jbp h PHE 319 Ca 0.39 -0.04 0.00 0.00 3.98 0.00 0.00 57.97 62.30 2jbp h PHE 319 Cb 0.46 -0.11 0.00 0.00 2.56 0.00 0.00 35.95 38.86 2jbp h PHE 319 CO -0.11 0.42 0.00 -1.33 -2.02 0.00 0.00 178.31 175.27 2jbp n MET 320 N -4.77 0.10 -0.00 1.11 2.81 -0.75 -2.25 117.12 113.36 2jbp n MET 320 Ca -0.03 0.41 0.07 0.00 -1.81 0.00 0.00 57.70 56.34 2jbp n MET 320 Cb 0.15 -1.72 -0.09 0.00 -0.71 0.00 0.00 33.22 30.85 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 -1.91 0.93 -4.77 7.83 3.02 -0.77 -4.04 115.26 115.55 2jbp n ASN 321 Ca 0.02 -0.61 -0.41 0.00 -0.03 0.00 0.00 54.58 53.54 2jbp n ASN 321 Cb 0.15 1.17 -0.00 0.00 -0.61 0.00 0.00 39.78 40.48 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 -1.49 2.98 -0.25 3.10 -0.00 -0.26 -4.68 115.22 114.62 2jbp n HIS 322 Ca 0.01 0.43 -0.04 0.00 0.46 0.00 0.00 57.72 58.59 2jbp n HIS 322 Cb 0.25 -2.54 0.13 0.00 -0.12 0.00 0.00 29.99 27.71 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 3.08 1.10 -0.07 1.57 0.11 -1.91 0.38 132.00 136.27 2jbp h PRO 323 Ca -0.50 -0.17 0.02 0.00 0.11 0.00 0.00 66.00 65.46 2jbp h PRO 323 Cb 1.24 -0.19 -0.00 0.00 0.11 0.00 0.00 31.00 32.16 2jbp h PRO 323 CO 0.65 0.87 0.10 2.35 -0.21 0.00 0.00 178.00 181.75 2jbp h TRP 324 N 1.08 0.00 0.00 0.65 7.01 -1.90 -2.29 115.95 120.51 2jbp h TRP 324 Ca 0.26 0.00 -0.42 0.00 2.11 0.00 0.00 58.89 60.84 2jbp h TRP 324 Cb 0.15 0.00 -0.06 0.00 -2.10 0.00 0.00 29.16 27.15 2jbp h TRP 324 CO 0.01 0.00 -2.33 -0.89 -2.79 0.00 0.00 178.44 172.45 2jbp n ILE 325 N -3.63 1.53 0.00 2.65 2.08 -0.86 -4.58 119.36 116.56 2jbp n ILE 325 Ca -0.01 -0.32 0.00 0.00 0.56 0.00 0.00 62.75 62.98 2jbp n ILE 325 Cb 0.19 -1.92 0.00 0.00 -0.75 0.00 0.00 39.64 37.16 2jbp n ILE 325 CO 0.00 0.00 0.00 0.23 0.56 0.00 0.00 176.55 177.34 2jbp n MET 326 N -4.28 0.00 -3.10 0.38 2.81 0.13 -3.21 117.12 109.84 2jbp n MET 326 Ca -0.50 0.71 -0.45 0.00 -1.81 0.00 0.00 57.70 55.65 2jbp n MET 326 Cb 0.85 -1.27 -0.04 0.00 -0.71 0.00 0.00 33.22 32.05 2jbp n MET 326 CO 0.00 0.00 0.00 1.14 1.51 0.00 0.00 175.97 178.62 2jbp s GLN 327 N -2.07 3.24 0.23 0.03 -2.07 -0.90 -4.87 119.66 113.25 2jbp s GLN 327 Ca 0.00 -1.57 0.15 0.00 -1.82 0.00 0.00 55.36 52.13 2jbp s GLN 327 Cb 0.00 -4.41 0.02 0.00 -1.09 0.00 0.00 33.01 27.52 2jbp s GLN 327 CO 0.00 -1.56 1.31 1.03 -1.32 0.00 0.00 175.29 174.75 2jbp h SER 328 N 8.91 0.00 -0.60 12.60 0.87 -1.77 -3.29 113.55 130.27 2jbp h SER 328 Ca -0.15 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.41 2jbp h SER 328 Cb 1.07 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.03 2jbp h SER 328 CO 1.05 0.51 0.00 0.41 -0.53 0.00 0.00 176.83 178.27 2jbp n THR 329 N -3.15 1.53 -1.30 2.23 -1.04 -1.26 -3.02 114.28 108.27 2jbp n THR 329 Ca -0.00 -1.03 -0.04 0.00 -2.04 0.00 0.00 64.05 60.93 2jbp n THR 329 Cb 0.76 0.14 0.22 0.00 -1.82 0.00 0.00 70.33 69.62 2jbp n THR 329 CO 0.00 0.00 0.00 0.29 -0.64 0.00 0.00 175.07 174.72 2jbp n LYS 330 N 1.08 2.26 -4.50 -2.82 4.76 -1.24 -4.99 118.16 112.71 2jbp n LYS 330 Ca 0.23 -3.08 -0.34 0.00 -2.87 0.00 0.00 58.31 52.25 2jbp n LYS 330 Cb 0.78 -1.90 -0.12 0.00 -1.84 0.00 0.00 35.03 31.95 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 -3.15 3.84 0.23 -0.18 1.01 -1.17 -5.08 120.40 115.91 2jbp s VAL 331 Ca 0.47 -0.40 -0.27 0.00 0.00 0.00 0.00 61.98 61.77 2jbp s VAL 331 Cb 0.41 -2.63 -0.16 0.00 0.00 0.00 0.00 36.38 33.99 2jbp s VAL 331 CO 0.04 0.55 0.55 -2.65 0.00 0.00 0.00 175.10 173.59 2jbp n PRO 332 N 2.86 0.18 -0.51 2.72 -0.02 -1.26 -4.61 135.00 134.37 2jbp n PRO 332 Ca -0.18 0.06 0.02 0.00 -2.02 0.00 0.00 63.50 61.39 2jbp n PRO 332 Cb 0.53 -1.12 0.21 0.00 -0.02 0.00 0.00 33.50 33.10 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 0.98 2.99 -1.50 -0.52 6.02 -1.26 -2.28 117.38 121.81 2jbp n GLN 333 Ca 0.16 -1.72 -0.48 0.00 -0.01 0.00 0.00 57.00 54.95 2jbp n GLN 333 Cb 0.27 -1.89 -0.03 0.00 1.02 0.00 0.00 30.24 29.61 2jbp n GLN 333 CO 0.00 0.00 0.00 -2.37 -1.01 0.00 0.00 177.06 173.68 2jbp n THR 334 N 0.26 1.70 -3.34 5.09 5.66 -1.26 -4.51 114.28 117.88 2jbp n THR 334 Ca 0.17 -0.43 -0.34 0.00 -3.05 0.00 0.00 64.05 60.41 2jbp n THR 334 Cb 0.81 -0.45 -0.06 0.00 -1.55 0.00 0.00 70.33 69.08 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 -1.03 3.93 0.32 1.09 0.02 -1.26 0.61 135.00 138.69 2jbp s PRO 335 Ca 0.65 0.45 0.09 0.00 0.02 0.00 0.00 61.00 62.21 2jbp s PRO 335 Cb -0.87 -2.78 -0.05 0.00 0.02 0.00 0.00 34.50 30.83 2jbp s PRO 335 CO 0.57 0.39 0.07 -0.51 -0.33 0.00 0.00 177.00 177.19 2jbp s LEU 336 N -2.36 3.16 0.00 -5.54 2.01 1.00 -4.84 118.68 112.11 2jbp s LEU 336 Ca 0.43 -0.81 0.16 0.00 0.01 0.00 0.00 54.13 53.92 2jbp s LEU 336 Cb -0.13 -1.62 0.96 0.00 0.01 0.00 0.00 46.19 45.41 2jbp s LEU 336 CO 0.20 -0.22 1.55 1.41 1.01 0.00 0.00 176.35 180.30 2jbp n HIS 337 N -1.04 0.00 -0.15 0.29 8.25 -1.26 -4.49 115.22 116.82 2jbp n HIS 337 Ca -0.04 0.00 -0.03 0.00 -0.26 0.00 0.00 57.72 57.39 2jbp n HIS 337 Cb 0.61 0.00 0.06 0.00 1.12 0.00 0.00 29.99 31.78 2jbp n HIS 337 CO 0.00 0.00 0.00 1.15 0.64 0.00 0.00 176.34 178.13 2jbp h THR 338 N 0.00 0.77 -0.11 1.59 2.02 -1.79 0.06 112.91 115.45 2jbp h THR 338 Ca 0.00 -0.09 -0.24 0.00 0.77 0.00 0.00 66.41 66.85 2jbp h THR 338 Cb 0.00 0.48 0.01 0.00 -1.74 0.00 0.00 68.15 66.90 2jbp h THR 338 CO 0.00 0.05 -0.85 -1.28 0.37 0.00 0.00 175.52 173.81 2jbp h SER 339 N 0.27 0.93 0.36 4.18 0.87 -1.91 0.38 113.55 118.63 2jbp h SER 339 Ca 0.24 -0.65 -0.00 0.00 -1.23 0.00 0.00 61.79 60.14 2jbp h SER 339 Cb 0.29 -0.28 -0.03 0.00 -0.44 0.00 0.00 62.40 61.94 2jbp h SER 339 CO -0.29 1.45 -0.51 -0.09 -0.53 0.00 0.00 176.83 176.86 2jbp h ARG 340 N 0.50 -0.88 -0.61 2.24 2.43 -1.79 -3.02 114.38 113.25 2jbp h ARG 340 Ca -0.07 0.06 -0.03 0.00 -0.81 0.00 0.00 59.98 59.13 2jbp h ARG 340 Cb 1.49 0.20 -0.03 0.00 -0.42 0.00 0.00 29.97 31.21 2jbp h ARG 340 CO 0.17 -0.59 0.27 0.28 -1.51 0.00 0.00 179.97 178.60 2jbp h VAL 341 N -0.91 1.21 -0.29 0.20 2.07 -0.56 -2.65 116.25 115.32 2jbp h VAL 341 Ca -0.04 -0.62 -0.02 0.00 0.82 0.00 0.00 66.70 66.84 2jbp h VAL 341 Cb 0.83 0.45 -0.01 0.00 -1.52 0.00 0.00 31.29 31.04 2jbp h VAL 341 CO -0.15 0.25 0.10 0.25 0.02 0.00 0.00 177.57 178.05 2jbp h LEU 342 N 0.87 0.42 -9.17 2.57 5.85 -0.20 -3.15 115.31 112.50 2jbp h LEU 342 Ca 0.21 -0.19 -0.61 0.00 0.84 0.00 0.00 57.88 58.13 2jbp h LEU 342 Cb 0.13 -0.11 -0.13 0.00 0.37 0.00 0.00 40.66 40.92 2jbp h LEU 342 CO -0.02 0.49 -0.49 -1.59 -0.34 0.00 0.00 178.44 176.49 2jbp s LYS 343 N -5.46 4.13 0.00 1.25 -2.85 -1.00 -3.05 119.74 112.76 2jbp s LYS 343 Ca -0.13 -0.23 0.00 0.00 -1.00 0.00 0.00 55.97 54.61 2jbp s LYS 343 Cb 0.09 -3.48 0.00 0.00 -2.06 0.00 0.00 37.83 32.37 2jbp s LYS 343 CO 0.73 0.17 0.00 -1.91 0.10 0.00 0.00 175.35 174.44 2jbp n GLU 344 N 3.94 0.00 0.00 1.78 0.00 -1.26 -4.67 120.64 120.43 2jbp n GLU 344 Ca -0.15 0.00 0.00 0.00 0.00 0.00 0.00 57.16 57.01 2jbp n GLU 344 Cb 0.52 0.00 0.00 0.00 0.00 0.00 0.00 31.44 31.96 2jbp n GLU 344 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.13 176.88 2jbp n ASP 345 N 0.00 0.71 0.19 4.31 9.92 -1.19 -4.91 116.55 125.58 2jbp n ASP 345 Ca 0.00 -1.35 0.18 0.00 -0.53 0.00 0.00 54.79 53.10 2jbp n ASP 345 Cb 0.00 0.00 0.81 0.00 -0.64 0.00 0.00 41.12 41.29 2jbp n ASP 345 CO 0.00 0.00 0.00 0.50 0.13 0.00 0.00 177.20 177.83 2jbp h LYS 346 N 0.00 0.00 0.00 -1.24 3.64 -1.81 -2.74 116.57 114.43 2jbp h LYS 346 Ca 0.00 0.00 -0.00 0.00 -1.27 0.00 0.00 60.65 59.38 2jbp h LYS 346 Cb 0.80 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.62 2jbp h LYS 346 CO 0.00 0.00 -0.00 1.49 -2.27 0.00 0.00 179.45 178.67 2jbp h GLU 347 N 0.00 -0.00 -0.04 1.90 4.81 -1.91 -3.36 114.58 115.98 2jbp h GLU 347 Ca 0.11 0.00 0.01 0.00 -0.13 0.00 0.00 59.36 59.36 2jbp h GLU 347 Cb 0.76 0.00 -0.00 0.00 0.63 0.00 0.00 28.75 30.14 2jbp h GLU 347 CO -0.00 -0.00 0.27 0.07 -0.73 0.00 0.00 179.01 178.62 2jbp h ARG 348 N -0.24 0.00 -2.41 1.92 0.11 -1.91 -3.25 114.38 108.59 2jbp h ARG 348 Ca -0.00 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.08 2jbp h ARG 348 Cb 0.00 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.08 2jbp h ARG 348 CO 0.00 0.00 0.11 1.87 0.10 0.00 0.00 179.97 182.05 2jbp n TRP 349 N -3.05 0.00 -0.23 4.08 -0.00 -1.10 -5.19 117.44 111.94 2jbp n TRP 349 Ca -0.01 0.00 0.00 0.00 -0.00 0.00 0.00 57.50 57.49 2jbp n TRP 349 Cb 0.34 -0.21 0.00 0.00 -0.00 0.00 0.00 31.31 31.44 2jbp n TRP 349 CO 0.00 0.00 0.00 0.39 -0.00 0.00 0.00 177.69 178.08