#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jbp s PHE 46 N 0.00 -0.99 -0.54 2.61 2.19 -1.26 -5.11 117.98 114.88 2jbp s PHE 46 Ca 0.00 0.64 -0.04 0.00 0.33 0.00 0.00 56.93 57.87 2jbp s PHE 46 Cb 0.00 -0.02 0.14 0.00 -1.31 0.00 0.00 43.02 41.83 2jbp s PHE 46 CO 0.00 -0.87 0.35 -1.01 1.83 0.00 0.00 175.22 175.52 2jbp s HIS 47 N 2.57 3.49 -0.07 10.12 3.76 -1.26 -5.05 115.29 128.84 2jbp s HIS 47 Ca 0.12 -2.53 0.02 0.00 -0.15 0.00 0.00 55.06 52.52 2jbp s HIS 47 Cb -0.14 -3.25 -0.02 0.00 1.11 0.00 0.00 32.58 30.28 2jbp s HIS 47 CO -0.23 -0.91 -0.13 0.14 -0.85 0.00 0.00 174.74 172.76 2jbp s VAL 48 N 0.50 3.14 0.34 -0.90 -7.23 -1.26 -5.12 120.40 109.86 2jbp s VAL 48 Ca 0.13 -0.68 0.08 0.00 -1.81 0.00 0.00 61.98 59.70 2jbp s VAL 48 Cb -0.21 -2.26 -0.03 0.00 0.56 0.00 0.00 36.38 34.43 2jbp s VAL 48 CO -0.04 0.57 0.24 -0.54 -0.31 0.00 0.00 175.10 175.03 2jbp s LYS 49 N -0.43 2.61 0.82 4.82 -0.14 -1.26 -5.10 119.74 121.06 2jbp s LYS 49 Ca 0.05 -1.38 -0.12 0.00 -1.36 0.00 0.00 55.97 53.17 2jbp s LYS 49 Cb -0.12 -2.38 0.08 0.00 -1.68 0.00 0.00 37.83 33.74 2jbp s LYS 49 CO 0.02 0.10 1.17 -1.54 -0.76 0.00 0.00 175.35 174.34 2jbp s SER 50 N -3.94 4.41 0.31 2.83 1.04 -1.26 -5.07 113.70 112.01 2jbp s SER 50 Ca 0.40 0.82 0.04 0.00 0.48 0.00 0.00 55.95 57.69 2jbp s SER 50 Cb -0.05 -1.34 0.05 0.00 0.10 0.00 0.00 66.02 64.78 2jbp s SER 50 CO 0.25 -1.97 0.38 0.61 0.98 0.00 0.00 173.24 173.49 2jbp n GLY 51 N -3.15 1.74 3.70 7.32 0.00 -1.26 -5.05 105.19 108.50 2jbp n GLY 51 Ca 0.08 -2.14 -0.38 0.00 0.00 0.00 0.00 46.02 43.57 2jbp n GLY 51 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2jbp s LEU 52 N 0.00 4.24 -0.42 0.99 2.96 -1.26 -5.03 118.68 120.15 2jbp s LEU 52 Ca 0.28 0.80 -0.04 0.00 -0.22 0.00 0.00 54.13 54.96 2jbp s LEU 52 Cb -0.02 -2.73 0.11 0.00 0.50 0.00 0.00 46.19 44.05 2jbp s LEU 52 CO 0.18 -0.07 0.23 -1.58 -1.32 0.00 0.00 176.35 173.80 2jbp s GLN 53 N 0.96 2.09 0.07 1.98 2.00 -1.26 -5.07 119.66 120.42 2jbp s GLN 53 Ca 0.26 -1.83 -0.31 0.00 -2.00 0.00 0.00 55.36 51.48 2jbp s GLN 53 Cb -0.15 -3.64 -0.07 0.00 0.80 0.00 0.00 33.01 29.94 2jbp s GLN 53 CO 0.11 -1.10 1.49 0.42 -0.50 0.00 0.00 175.29 175.71 2jbp s ILE 54 N 1.14 3.28 0.19 -2.34 -1.09 -1.26 -4.65 121.20 116.47 2jbp s ILE 54 Ca 0.08 0.80 -0.22 0.00 -2.23 0.00 0.00 60.65 59.07 2jbp s ILE 54 Cb -0.23 -3.51 -0.08 0.00 -1.58 0.00 0.00 42.46 37.06 2jbp s ILE 54 CO -0.04 0.02 0.74 -0.54 -1.23 0.00 0.00 174.94 173.90 2jbp s LYS 55 N 2.01 4.40 -0.00 2.79 1.02 0.67 -4.86 119.74 125.77 2jbp s LYS 55 Ca 0.68 1.00 0.08 0.00 0.02 0.00 0.00 55.97 57.75 2jbp s LYS 55 Cb -0.37 -3.07 -0.10 0.00 -0.52 0.00 0.00 37.83 33.77 2jbp s LYS 55 CO 0.30 0.49 0.31 1.63 -0.92 0.00 0.00 175.35 177.15 2jbp n LYS 56 N 1.18 3.32 -0.86 1.68 4.76 -1.26 -0.18 118.16 126.80 2jbp n LYS 56 Ca -0.04 -0.02 -0.32 0.00 -2.87 0.00 0.00 58.31 55.06 2jbp n LYS 56 Cb 0.50 -0.96 0.15 0.00 -1.84 0.00 0.00 35.03 32.87 2jbp n LYS 56 CO 0.00 0.00 0.00 0.27 -1.37 0.00 0.00 177.40 176.30 2jbp n ASN 57 N -1.34 0.31 -4.72 4.39 6.94 -1.26 -4.72 115.26 114.85 2jbp n ASN 57 Ca 0.01 0.48 -0.42 0.00 -0.02 0.00 0.00 54.58 54.62 2jbp n ASN 57 Cb 0.15 -1.46 -0.01 0.00 -2.36 0.00 0.00 39.78 36.11 2jbp n ASN 57 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 2jbp n ALA 58 N -3.79 1.67 0.20 -2.53 0.00 -1.26 -4.83 120.51 109.98 2jbp n ALA 58 Ca 0.12 0.36 0.09 0.00 0.00 0.00 0.00 53.44 54.01 2jbp n ALA 58 Cb 0.51 -2.31 0.28 0.00 0.00 0.00 0.00 19.45 17.93 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 2.73 0.46 0.00 0.00 2.10 -1.95 -2.05 117.51 118.81 2jbp h ILE 59 Ca -0.47 -1.37 0.00 0.00 1.08 0.00 0.00 64.86 64.09 2jbp h ILE 59 Cb 1.27 2.00 0.00 0.00 -1.09 0.00 0.00 36.82 39.00 2jbp h ILE 59 CO 0.64 0.23 0.00 0.16 -1.08 0.00 0.00 178.15 178.10 2jbp h ILE 60 N 0.00 0.00 -0.93 2.19 3.07 -1.88 -0.23 117.51 119.73 2jbp h ILE 60 Ca -0.00 -0.42 0.22 0.00 1.55 0.00 0.00 64.86 66.21 2jbp h ILE 60 Cb 0.98 1.34 -0.07 0.00 -0.27 0.00 0.00 36.82 38.80 2jbp h ILE 60 CO 0.03 0.00 0.62 0.44 -1.05 0.00 0.00 178.15 178.19 2jbp h ASP 61 N 0.00 0.39 0.00 2.16 3.45 -1.73 -3.27 116.42 117.42 2jbp h ASP 61 Ca 0.00 0.05 -0.01 0.00 0.43 0.00 0.00 57.03 57.49 2jbp h ASP 61 Cb 0.46 -0.02 -0.00 0.00 -0.56 0.00 0.00 39.33 39.20 2jbp h ASP 61 CO 0.00 0.14 -1.40 0.47 -1.57 0.00 0.00 179.24 176.88 2jbp n ASP 62 N -4.51 3.07 -4.04 6.45 8.00 -0.18 -4.96 116.55 120.39 2jbp n ASP 62 Ca 0.20 0.00 -0.16 0.00 0.71 0.00 0.00 54.79 55.54 2jbp n ASP 62 Cb 0.75 1.31 -0.13 0.00 -0.02 0.00 0.00 41.12 43.02 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 -2.54 0.74 -0.12 1.24 2.02 -0.72 -1.57 117.35 116.40 2jbp s TYR 63 Ca -0.03 -0.27 -0.29 0.00 -0.37 0.00 0.00 57.07 56.11 2jbp s TYR 63 Cb 0.05 -0.46 -0.01 0.00 -0.40 0.00 0.00 41.96 41.14 2jbp s TYR 63 CO 0.35 -0.02 0.96 0.21 -1.57 0.00 0.00 175.55 175.48 2jbp s LYS 64 N -0.77 4.39 -0.25 -0.62 2.20 0.28 -4.29 119.74 120.69 2jbp s LYS 64 Ca -0.01 1.30 -0.06 0.00 -0.36 0.00 0.00 55.97 56.84 2jbp s LYS 64 Cb -0.06 -3.55 -0.01 0.00 -1.51 0.00 0.00 37.83 32.70 2jbp s LYS 64 CO 0.00 -0.32 0.04 0.08 -0.36 0.00 0.00 175.35 174.80 2jbp s VAL 65 N 2.04 3.94 0.50 4.02 1.01 -1.26 -0.90 120.40 129.75 2jbp s VAL 65 Ca 0.46 -0.40 0.08 0.00 0.00 0.00 0.00 61.98 62.11 2jbp s VAL 65 Cb -0.18 -2.88 0.08 0.00 0.00 0.00 0.00 36.38 33.39 2jbp s VAL 65 CO 0.16 0.30 0.62 0.35 0.00 0.00 0.00 175.10 176.53 2jbp n THR 66 N 4.87 0.00 0.45 3.92 -2.24 -1.20 -5.03 114.28 115.05 2jbp n THR 66 Ca -0.16 -1.74 0.05 0.00 -2.27 0.00 0.00 64.05 59.93 2jbp n THR 66 Cb 0.50 -0.47 0.01 0.00 -2.10 0.00 0.00 70.33 68.28 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 -2.29 1.44 -4.73 3.42 3.41 -1.26 -4.61 113.62 109.00 2jbp n SER 67 Ca 0.11 -1.22 -0.42 0.00 -0.26 0.00 0.00 58.87 57.08 2jbp n SER 67 Cb 0.53 0.32 -0.01 0.00 -0.26 0.00 0.00 64.21 64.79 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 0.02 2.38 -4.24 4.33 7.27 -1.26 -4.89 117.38 120.99 2jbp n GLN 68 Ca 0.05 0.84 -0.35 0.00 0.07 0.00 0.00 57.00 57.61 2jbp n GLN 68 Cb 0.23 -2.50 -0.10 0.00 2.41 0.00 0.00 30.24 30.28 2jbp n GLN 68 CO 0.00 0.00 0.00 0.08 0.07 0.00 0.00 177.06 177.21 2jbp s VAL 69 N -0.88 4.49 -0.19 1.69 1.01 -1.26 -1.00 120.40 124.27 2jbp s VAL 69 Ca 0.57 -0.16 0.14 0.00 0.00 0.00 0.00 61.98 62.53 2jbp s VAL 69 Cb -0.53 -2.94 0.41 0.00 0.00 0.00 0.00 36.38 33.31 2jbp s VAL 69 CO 0.60 0.56 1.27 0.18 0.00 0.00 0.00 175.10 177.71 2jbp n LEU 70 N 2.67 3.01 0.00 3.92 4.77 0.31 -4.83 117.00 126.85 2jbp n LEU 70 Ca -0.18 -3.46 0.00 0.00 -0.03 0.00 0.00 56.01 52.34 2jbp n LEU 70 Cb 0.53 -0.52 0.00 0.00 -2.33 0.00 0.00 43.42 41.11 2jbp n LEU 70 CO 0.31 1.02 0.00 0.61 -1.33 0.00 0.00 177.39 178.00 2jbp n GLY 71 N -1.15 4.43 3.86 -0.72 0.00 -1.23 -4.90 105.19 105.48 2jbp n GLY 71 Ca 0.21 -1.45 -0.37 0.00 0.00 0.00 0.00 46.02 44.41 2jbp n GLY 71 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2jbp s LEU 72 N 0.00 4.43 0.42 0.99 2.96 -1.26 -1.21 118.68 125.01 2jbp s LEU 72 Ca 0.00 0.72 0.05 0.00 -0.22 0.00 0.00 54.13 54.67 2jbp s LEU 72 Cb 0.00 -2.35 -0.05 0.00 0.50 0.00 0.00 46.19 44.28 2jbp s LEU 72 CO 0.00 0.36 0.03 -0.83 -1.32 0.00 0.00 176.35 174.59 2jbp s GLY 73 N -1.09 2.59 0.03 7.98 0.00 0.47 -4.96 107.32 112.35 2jbp s GLY 73 Ca 0.20 -1.66 -0.23 0.00 0.00 0.00 0.00 44.72 43.04 2jbp s GLY 73 CO 0.09 -2.06 1.44 1.19 0.00 0.00 0.00 173.10 173.76 2jbp h ILE 74 N 1.71 1.27 -0.12 0.90 6.09 -1.97 -3.24 117.51 122.15 2jbp h ILE 74 Ca -0.43 -0.86 0.00 0.00 -1.37 0.00 0.00 64.86 62.20 2jbp h ILE 74 Cb 1.26 1.69 0.00 0.00 0.47 0.00 0.00 36.82 40.24 2jbp h ILE 74 CO 0.75 0.24 0.00 0.59 -3.07 0.00 0.00 178.15 176.66 2jbp n ASN 75 N -4.82 2.51 0.00 2.19 3.02 -1.26 -5.00 115.26 111.90 2jbp n ASN 75 Ca -0.07 -1.83 0.00 0.00 -0.03 0.00 0.00 54.58 52.66 2jbp n ASN 75 Cb 0.21 -0.07 0.00 0.00 -0.61 0.00 0.00 39.78 39.31 2jbp n ASN 75 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2jbp n GLY 76 N 1.30 -0.14 3.99 7.41 0.00 -1.23 -4.70 105.19 111.83 2jbp n GLY 76 Ca 0.17 -0.98 -0.23 0.00 0.00 0.00 0.00 46.02 44.98 2jbp n GLY 76 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2jbp s LYS 77 N -2.00 1.77 -0.30 1.61 1.02 -1.26 -0.40 119.74 120.19 2jbp s LYS 77 Ca 0.00 -1.08 -0.01 0.00 0.02 0.00 0.00 55.97 54.91 2jbp s LYS 77 Cb 0.00 -2.34 0.09 0.00 -0.52 0.00 0.00 37.83 35.06 2jbp s LYS 77 CO 0.00 -1.37 0.09 0.08 -0.92 0.00 0.00 175.35 173.22 2jbp s VAL 78 N -3.11 0.86 0.39 3.17 1.01 -0.35 -3.45 120.40 118.92 2jbp s VAL 78 Ca 0.65 -1.30 -0.11 0.00 0.00 0.00 0.00 61.98 61.22 2jbp s VAL 78 Cb -0.06 -1.60 -0.07 0.00 0.00 0.00 0.00 36.38 34.65 2jbp s VAL 78 CO 0.44 -0.61 0.75 -0.76 0.00 0.00 0.00 175.10 174.92 2jbp s LEU 79 N 1.64 3.87 0.32 3.92 1.43 -0.07 0.11 118.68 129.90 2jbp s LEU 79 Ca 0.08 1.13 -0.27 0.00 -1.03 0.00 0.00 54.13 54.04 2jbp s LEU 79 Cb -0.17 -4.00 -0.09 0.00 0.03 0.00 0.00 46.19 41.95 2jbp s LEU 79 CO -0.23 -0.36 1.03 -1.58 0.23 0.00 0.00 176.35 175.44 2jbp s GLN 80 N -3.71 4.53 0.10 1.70 2.00 -0.17 -0.28 119.66 123.83 2jbp s GLN 80 Ca 0.51 1.58 -0.13 0.00 -2.00 0.00 0.00 55.36 55.32 2jbp s GLN 80 Cb -0.10 -2.95 0.02 0.00 0.80 0.00 0.00 33.01 30.78 2jbp s GLN 80 CO 0.29 0.17 0.32 0.96 -0.50 0.00 0.00 175.29 176.53 2jbp s ILE 81 N -1.39 0.10 -0.02 -2.34 -4.36 -0.11 -3.21 121.20 109.87 2jbp s ILE 81 Ca 0.49 -0.79 0.07 0.00 -0.26 0.00 0.00 60.65 60.16 2jbp s ILE 81 Cb -0.26 -1.19 -0.02 0.00 1.25 0.00 0.00 42.46 42.25 2jbp s ILE 81 CO 0.33 -0.44 -0.23 -0.36 0.24 0.00 0.00 174.94 174.48 2jbp s PHE 82 N -3.62 2.09 0.02 1.37 0.08 -0.08 -0.03 117.98 117.81 2jbp s PHE 82 Ca 0.02 -0.40 -0.30 0.00 0.12 0.00 0.00 56.93 56.37 2jbp s PHE 82 Cb 0.02 -1.34 -0.07 0.00 -0.57 0.00 0.00 43.02 41.06 2jbp s PHE 82 CO -0.10 -0.04 1.65 1.21 -0.10 0.00 0.00 175.22 177.83 2jbp s ASN 83 N -0.54 6.64 0.15 1.36 3.04 -0.26 0.10 114.94 125.43 2jbp s ASN 83 Ca 0.09 2.38 -0.22 0.00 0.04 0.00 0.00 52.86 55.15 2jbp s ASN 83 Cb -0.09 -2.55 0.04 0.00 -1.54 0.00 0.00 41.25 37.11 2jbp s ASN 83 CO -0.01 -0.89 1.63 0.50 -3.04 0.00 0.00 177.10 175.29 2jbp h LYS 84 N 8.80 -0.22 0.05 0.43 3.64 -1.59 0.42 116.57 128.09 2jbp h LYS 84 Ca -0.41 0.01 -0.00 0.00 -1.27 0.00 0.00 60.65 58.98 2jbp h LYS 84 Cb 1.19 0.05 0.00 0.00 -0.41 0.00 0.00 32.23 33.06 2jbp h LYS 84 CO 0.94 -0.14 -0.02 -0.09 -2.27 0.00 0.00 179.45 177.86 2jbp h ARG 85 N -0.23 -0.06 -0.80 1.90 2.43 -1.92 -3.37 114.38 112.34 2jbp h ARG 85 Ca 0.15 0.00 0.15 0.00 -0.81 0.00 0.00 59.98 59.47 2jbp h ARG 85 Cb 0.45 0.01 -0.10 0.00 -0.42 0.00 0.00 29.97 29.92 2jbp h ARG 85 CO -0.40 -0.04 0.36 1.15 -1.51 0.00 0.00 179.97 179.53 2jbp h THR 86 N -0.36 0.67 0.00 0.20 2.02 -1.95 -3.46 112.91 110.03 2jbp h THR 86 Ca -0.01 -0.18 0.00 0.00 0.77 0.00 0.00 66.41 67.00 2jbp h THR 86 Cb 0.05 0.12 0.00 0.00 -1.74 0.00 0.00 68.15 66.57 2jbp h THR 86 CO 0.01 0.09 0.00 1.67 0.37 0.00 0.00 175.52 177.66 2jbp n GLN 87 N -4.95 0.00 -1.40 6.66 -0.06 0.15 -5.01 117.38 112.77 2jbp n GLN 87 Ca 0.16 0.00 -0.43 0.00 -2.00 0.00 0.00 57.00 54.72 2jbp n GLN 87 Cb 0.44 -0.61 -0.01 0.00 -4.06 0.00 0.00 30.24 26.00 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 -2.00 0.30 -2.52 3.69 2.13 -1.26 -4.33 120.64 116.65 2jbp n GLU 88 Ca 0.00 0.11 -0.32 0.00 0.66 0.00 0.00 57.16 57.61 2jbp n GLU 88 Cb 0.00 -1.24 -0.04 0.00 0.27 0.00 0.00 31.44 30.43 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 -1.25 4.01 0.19 5.31 1.02 -1.26 -1.11 119.74 126.66 2jbp s LYS 89 Ca 0.62 0.97 -0.13 0.00 0.02 0.00 0.00 55.97 57.44 2jbp s LYS 89 Cb -0.70 -2.16 0.01 0.00 -0.52 0.00 0.00 37.83 34.46 2jbp s LYS 89 CO 0.59 -0.20 0.43 -0.06 -0.92 0.00 0.00 175.35 175.19 2jbp s PHE 90 N -2.51 0.17 -0.10 3.18 0.40 0.96 -4.52 117.98 115.57 2jbp s PHE 90 Ca 0.59 -0.53 -0.01 0.00 -0.60 0.00 0.00 56.93 56.38 2jbp s PHE 90 Cb -0.10 0.19 -0.03 0.00 0.51 0.00 0.00 43.02 43.59 2jbp s PHE 90 CO 0.27 -0.86 -0.03 0.00 0.70 0.00 0.00 175.22 175.29 2jbp s ALA 91 N -3.94 3.11 -0.08 5.36 0.00 -0.40 -0.93 121.76 124.87 2jbp s ALA 91 Ca 0.15 -0.84 0.03 0.00 0.00 0.00 0.00 51.96 51.30 2jbp s ALA 91 Cb 0.01 -1.42 0.00 0.00 0.00 0.00 0.00 23.12 21.71 2jbp s ALA 91 CO 0.01 0.48 -0.18 -1.17 0.00 0.00 0.00 175.76 174.90 2jbp s LEU 92 N -0.52 1.88 -0.10 0.00 0.20 0.61 -0.85 118.68 119.91 2jbp s LEU 92 Ca 0.08 -0.43 0.02 0.00 0.69 0.00 0.00 54.13 54.50 2jbp s LEU 92 Cb -0.12 -1.12 -0.01 0.00 -0.43 0.00 0.00 46.19 44.51 2jbp s LEU 92 CO 0.02 0.11 -0.18 -0.75 -0.29 0.00 0.00 176.35 175.26 2jbp s LYS 93 N 0.43 3.03 -0.11 1.98 2.20 -0.01 -0.89 119.74 126.36 2jbp s LYS 93 Ca -0.15 -0.77 -0.02 0.00 -0.36 0.00 0.00 55.97 54.67 2jbp s LYS 93 Cb -0.16 -2.44 -0.03 0.00 -1.51 0.00 0.00 37.83 33.69 2jbp s LYS 93 CO 0.06 0.30 -0.04 -1.64 -0.36 0.00 0.00 175.35 173.67 2jbp s MET 94 N 0.09 3.21 0.03 4.03 -1.94 -1.22 -0.51 119.30 122.98 2jbp s MET 94 Ca -0.08 -0.50 0.02 0.00 -1.71 0.00 0.00 55.69 53.41 2jbp s MET 94 Cb -0.15 -2.78 -0.02 0.00 2.01 0.00 0.00 34.83 33.89 2jbp s MET 94 CO 0.05 0.49 -0.07 -0.51 -0.01 0.00 0.00 175.02 174.98 2jbp s LEU 95 N -0.32 2.24 -0.18 -0.03 1.43 -0.24 -4.31 118.68 117.26 2jbp s LEU 95 Ca 0.05 -0.51 -0.28 0.00 -1.03 0.00 0.00 54.13 52.36 2jbp s LEU 95 Cb -0.12 -0.11 -0.00 0.00 0.03 0.00 0.00 46.19 45.98 2jbp s LEU 95 CO 0.02 -0.21 0.97 -1.58 0.23 0.00 0.00 176.35 175.79 2jbp s GLN 96 N -1.46 4.32 0.37 1.70 0.74 -1.26 -0.66 119.66 123.41 2jbp s GLN 96 Ca -0.10 1.27 -0.28 0.00 0.05 0.00 0.00 55.36 56.30 2jbp s GLN 96 Cb -0.09 -3.60 -0.11 0.00 1.10 0.00 0.00 33.01 30.31 2jbp s GLN 96 CO 0.00 -0.46 1.41 -3.47 -0.55 0.00 0.00 175.29 172.23 2jbp n ASP 97 N 5.65 3.41 0.00 6.67 2.03 -0.76 -4.74 116.55 128.81 2jbp n ASP 97 Ca 0.09 1.22 0.00 0.00 0.52 0.00 0.00 54.79 56.62 2jbp n ASP 97 Cb 0.48 -1.57 0.00 0.00 -0.72 0.00 0.00 41.12 39.30 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 3.73 -0.28 0.00 -0.05 -1.26 -3.82 135.00 133.32 2jbp n PRO 99 Ca 0.00 0.00 0.08 0.00 -0.05 0.00 0.00 63.50 63.53 2jbp n PRO 99 Cb 0.00 -0.99 0.20 0.00 -0.05 0.00 0.00 33.50 32.66 2jbp n PRO 99 CO 0.00 0.00 0.00 -0.22 -0.05 0.00 0.00 175.50 175.23 2jbp h LYS 100 N 0.00 0.10 0.06 0.54 1.63 -1.97 0.49 116.57 117.41 2jbp h LYS 100 Ca 0.00 -0.01 -0.25 0.00 -0.85 0.00 0.00 60.65 59.55 2jbp h LYS 100 Cb 0.98 -0.02 0.00 0.00 -0.60 0.00 0.00 32.23 32.59 2jbp h LYS 100 CO 0.00 0.07 -1.07 0.00 -3.45 0.00 0.00 179.45 175.00 2jbp h ALA 101 N 1.77 0.25 -0.49 5.00 0.00 -1.85 -2.37 119.26 121.58 2jbp h ALA 101 Ca 0.47 -0.78 0.10 0.00 0.00 0.00 0.00 54.91 54.70 2jbp h ALA 101 Cb 0.86 -0.00 -0.03 0.00 0.00 0.00 0.00 17.79 18.63 2jbp h ALA 101 CO -0.71 0.87 0.33 0.00 0.00 0.00 0.00 179.25 179.74 2jbp h ARG 102 N 0.17 0.21 -0.01 0.00 2.47 -1.20 -1.88 114.38 114.14 2jbp h ARG 102 Ca -0.11 -0.01 -0.00 0.00 -1.26 0.00 0.00 59.98 58.60 2jbp h ARG 102 Cb 1.74 -0.05 -0.00 0.00 -1.65 0.00 0.00 29.97 30.01 2jbp h ARG 102 CO 0.18 0.14 -0.01 -0.09 0.56 0.00 0.00 179.97 180.75 2jbp h ARG 103 N 0.21 0.02 0.02 0.04 2.43 -0.62 0.79 114.38 117.27 2jbp h ARG 103 Ca 0.23 -0.01 0.02 0.00 -0.81 0.00 0.00 59.98 59.41 2jbp h ARG 103 Cb 0.61 0.00 -0.05 0.00 -0.42 0.00 0.00 29.97 30.11 2jbp h ARG 103 CO -0.04 0.48 -0.51 1.49 -1.51 0.00 0.00 179.97 179.88 2jbp h GLU 104 N -0.45 -0.63 -0.41 0.20 4.81 -0.86 0.40 114.58 117.64 2jbp h GLU 104 Ca 0.00 0.04 0.09 0.00 -0.13 0.00 0.00 59.36 59.36 2jbp h GLU 104 Cb 0.48 0.14 -0.09 0.00 0.63 0.00 0.00 28.75 29.91 2jbp h GLU 104 CO 0.00 -0.42 -0.23 0.28 -0.73 0.00 0.00 179.01 177.91 2jbp h VAL 105 N -0.65 0.36 0.09 0.32 2.07 -1.42 0.16 116.25 117.18 2jbp h VAL 105 Ca 0.01 0.00 0.02 0.00 0.82 0.00 0.00 66.70 67.55 2jbp h VAL 105 Cb 0.69 0.36 -0.05 0.00 -1.52 0.00 0.00 31.29 30.77 2jbp h VAL 105 CO -0.33 0.00 -0.43 -0.08 0.02 0.00 0.00 177.57 176.76 2jbp h GLU 106 N -0.16 -0.62 -0.59 1.57 4.22 0.18 0.28 114.58 119.46 2jbp h GLU 106 Ca 0.20 0.04 -0.07 0.00 0.08 0.00 0.00 59.36 59.61 2jbp h GLU 106 Cb 0.46 0.14 -0.02 0.00 0.50 0.00 0.00 28.75 29.83 2jbp h GLU 106 CO -0.51 -0.41 0.09 -0.07 -2.18 0.00 0.00 179.01 175.93 2jbp h LEU 107 N -0.64 0.95 -0.35 1.64 3.38 0.15 -2.58 115.31 117.85 2jbp h LEU 107 Ca 0.03 -0.26 -0.10 0.00 0.09 0.00 0.00 57.88 57.63 2jbp h LEU 107 Cb 0.68 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 41.17 2jbp h LEU 107 CO -0.26 0.97 -0.16 -0.74 0.09 0.00 0.00 178.44 178.33 2jbp h HIS 108 N 0.89 0.84 -0.82 1.13 2.76 -0.32 -2.16 115.15 117.46 2jbp h HIS 108 Ca 0.18 -0.21 0.08 0.00 -2.20 0.00 0.00 60.37 58.22 2jbp h HIS 108 Cb 0.43 -0.19 -0.05 0.00 1.55 0.00 0.00 27.41 29.14 2jbp h HIS 108 CO 0.03 0.93 0.53 2.35 -1.30 0.00 0.00 177.93 180.47 2jbp h TRP 109 N 0.51 0.87 -0.12 5.26 2.91 -0.39 -1.23 115.95 123.76 2jbp h TRP 109 Ca 0.08 0.02 -0.06 0.00 1.13 0.00 0.00 58.89 60.06 2jbp h TRP 109 Cb 0.70 -0.28 -0.01 0.00 -0.51 0.00 0.00 29.16 29.06 2jbp h TRP 109 CO 0.06 0.43 -0.21 -0.09 -1.03 0.00 0.00 178.44 177.60 2jbp h ARG 110 N 0.83 0.19 -0.28 2.65 9.65 -1.00 -2.97 114.38 123.46 2jbp h ARG 110 Ca 0.36 -0.05 0.00 0.00 -1.10 0.00 0.00 59.98 59.19 2jbp h ARG 110 Cb 0.33 -0.02 0.00 0.00 -1.39 0.00 0.00 29.97 28.89 2jbp h ARG 110 CO -0.14 0.40 0.00 0.00 2.80 0.00 0.00 179.97 183.03 2jbp n ALA 111 N -2.49 2.45 0.23 2.80 0.00 -0.54 -4.34 120.51 118.63 2jbp n ALA 111 Ca -0.01 -0.84 0.12 0.00 0.00 0.00 0.00 53.44 52.71 2jbp n ALA 111 Cb 0.32 -0.91 0.17 0.00 0.00 0.00 0.00 19.45 19.03 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 4.07 0.00 -0.41 0.00 0.87 -1.20 -2.99 113.55 113.88 2jbp h SER 112 Ca 0.00 -0.00 0.03 0.00 -1.23 0.00 0.00 61.79 60.59 2jbp h SER 112 Cb 0.89 0.00 -0.04 0.00 -0.44 0.00 0.00 62.40 62.81 2jbp h SER 112 CO 0.00 0.00 0.20 1.56 -0.53 0.00 0.00 176.83 178.06 2jbp h GLN 113 N 0.00 0.40 -6.58 2.24 4.20 -1.78 -3.43 115.11 110.16 2jbp h GLN 113 Ca 0.00 -0.02 -0.59 0.00 0.06 0.00 0.00 58.65 58.10 2jbp h GLN 113 Cb 0.99 -0.09 0.09 0.00 0.30 0.00 0.00 27.48 28.77 2jbp h GLN 113 CO 0.00 0.26 0.54 0.00 -0.67 0.00 0.00 178.83 178.96 2jbp h PRO 115 N 3.77 0.00 -0.47 0.00 0.11 -1.91 -2.74 132.00 130.77 2jbp h PRO 115 Ca -0.45 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.66 2jbp h PRO 115 Cb 1.29 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.40 2jbp h PRO 115 CO 0.72 0.03 0.00 0.72 -0.21 0.00 0.00 178.00 179.26 2jbp n HIS 116 N -3.26 1.00 -5.23 0.65 8.25 -1.26 -4.88 115.22 110.50 2jbp n HIS 116 Ca -0.02 -0.63 -0.31 0.00 -0.26 0.00 0.00 57.72 56.50 2jbp n HIS 116 Cb 0.17 -0.18 -0.17 0.00 1.12 0.00 0.00 29.99 30.94 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 -1.75 2.02 0.23 1.59 1.01 -1.03 -0.04 121.20 123.23 2jbp s ILE 117 Ca 0.40 -1.03 -0.31 0.00 0.00 0.00 0.00 60.65 59.71 2jbp s ILE 117 Cb 0.26 -1.72 -0.10 0.00 0.01 0.00 0.00 42.46 40.91 2jbp s ILE 117 CO 0.19 0.56 1.53 0.54 0.00 0.00 0.00 174.94 177.75 2jbp s VAL 118 N -0.01 2.47 0.15 2.92 0.11 -0.85 -4.79 120.40 120.40 2jbp s VAL 118 Ca -0.08 0.38 -0.26 0.00 -2.93 0.00 0.00 61.98 59.09 2jbp s VAL 118 Cb -0.15 -3.24 -0.07 0.00 -1.53 0.00 0.00 36.38 31.39 2jbp s VAL 118 CO 0.05 0.05 0.80 -0.60 -3.33 0.00 0.00 175.10 172.07 2jbp s ARG 119 N 0.09 4.59 -0.24 1.54 3.52 -1.26 -4.86 118.95 122.32 2jbp s ARG 119 Ca 0.64 1.19 -0.17 0.00 -0.13 0.00 0.00 55.73 57.26 2jbp s ARG 119 Cb -0.44 -3.29 -0.03 0.00 -1.56 0.00 0.00 34.95 29.63 2jbp s ARG 119 CO 0.40 0.49 0.45 0.42 -0.81 0.00 0.00 175.30 176.26 2jbp s ILE 120 N -0.88 5.13 -0.08 4.11 1.01 -1.26 -1.35 121.20 127.89 2jbp s ILE 120 Ca 0.37 0.76 -0.17 0.00 0.00 0.00 0.00 60.65 61.62 2jbp s ILE 120 Cb -0.23 -3.77 -0.29 0.00 0.01 0.00 0.00 42.46 38.18 2jbp s ILE 120 CO 0.26 0.15 0.67 0.58 0.00 0.00 0.00 174.94 176.60 2jbp h VAL 121 N 5.29 1.15 -2.27 2.92 2.07 -0.35 -3.48 116.25 121.58 2jbp h VAL 121 Ca -0.32 -2.46 -0.01 0.00 0.82 0.00 0.00 66.70 64.74 2jbp h VAL 121 Cb 1.15 2.85 -0.17 0.00 -1.52 0.00 0.00 31.29 33.60 2jbp h VAL 121 CO 0.70 0.73 0.29 -1.81 0.02 0.00 0.00 177.57 177.49 2jbp s ASP 122 N -7.08 -0.55 -0.07 0.57 -0.00 -1.01 -5.02 116.67 103.51 2jbp s ASP 122 Ca -0.17 0.37 0.01 0.00 -0.00 0.00 0.00 52.55 52.75 2jbp s ASP 122 Cb 0.04 0.50 0.02 0.00 -0.00 0.00 0.00 42.92 43.48 2jbp s ASP 122 CO 0.80 -0.68 -0.08 -0.69 -0.00 0.00 0.00 175.17 174.52 2jbp s VAL 123 N -2.18 0.88 -0.04 -1.27 1.01 -1.26 -1.08 120.40 116.45 2jbp s VAL 123 Ca -0.04 -0.28 0.00 0.00 0.00 0.00 0.00 61.98 61.66 2jbp s VAL 123 Cb -0.00 -0.87 -0.03 0.00 0.00 0.00 0.00 36.38 35.47 2jbp s VAL 123 CO -0.00 0.32 -0.01 -0.31 0.00 0.00 0.00 175.10 175.10 2jbp s TYR 124 N 1.12 3.10 -0.21 5.22 1.51 -0.16 -0.24 117.35 127.69 2jbp s TYR 124 Ca -0.07 0.12 -0.03 0.00 -1.01 0.00 0.00 57.07 56.08 2jbp s TYR 124 Cb -0.14 -1.72 -0.01 0.00 -0.11 0.00 0.00 41.96 39.98 2jbp s TYR 124 CO -0.01 0.45 -0.05 -2.00 -1.11 0.00 0.00 175.55 172.83 2jbp s GLU 125 N -1.21 3.39 0.17 -0.62 2.12 0.75 0.15 118.70 123.46 2jbp s GLU 125 Ca 0.16 -0.63 -0.02 0.00 0.36 0.00 0.00 54.97 54.84 2jbp s GLU 125 Cb -0.11 -2.97 -0.03 0.00 0.26 0.00 0.00 34.13 31.27 2jbp s GLU 125 CO 0.06 -0.13 0.13 -0.80 -0.54 0.00 0.00 175.26 173.98 2jbp s ASN 126 N 1.31 0.19 -0.16 -1.70 0.02 -0.19 -4.41 114.94 110.00 2jbp s ASN 126 Ca 0.04 -1.23 -0.08 0.00 -1.02 0.00 0.00 52.86 50.57 2jbp s ASN 126 Cb -0.14 0.36 -0.04 0.00 0.02 0.00 0.00 41.25 41.45 2jbp s ASN 126 CO -0.02 -0.82 0.09 -0.76 0.02 0.00 0.00 177.10 175.62 2jbp s LEU 127 N -3.09 4.04 -0.38 0.60 1.43 -1.26 0.11 118.68 120.13 2jbp s LEU 127 Ca 0.30 0.22 0.01 0.00 -1.03 0.00 0.00 54.13 53.62 2jbp s LEU 127 Cb 0.06 -2.01 0.14 0.00 0.03 0.00 0.00 46.19 44.41 2jbp s LEU 127 CO 0.06 0.25 0.22 -0.47 0.23 0.00 0.00 176.35 176.64 2jbp s TYR 128 N -0.08 1.14 -0.53 0.29 5.04 0.12 -4.86 117.35 118.47 2jbp s TYR 128 Ca 0.08 -1.88 -0.07 0.00 -2.44 0.00 0.00 57.07 52.76 2jbp s TYR 128 Cb -0.12 -1.24 0.01 0.00 0.35 0.00 0.00 41.96 40.96 2jbp s TYR 128 CO 0.01 -0.81 0.58 0.00 -1.34 0.00 0.00 175.55 173.99 2jbp n ALA 129 N 3.89 -2.69 -0.08 3.97 0.00 -1.26 -3.53 120.51 120.81 2jbp n ALA 129 Ca 0.11 0.50 0.00 0.00 0.00 0.00 0.00 53.44 54.05 2jbp n ALA 129 Cb 0.36 -2.32 0.00 0.00 0.00 0.00 0.00 19.45 17.49 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 -1.05 0.00 3.78 0.00 0.00 -1.26 -4.84 105.19 101.83 2jbp n GLY 130 Ca 0.05 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.78 2jbp n GLY 130 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2jbp s ARG 131 N -0.16 2.89 0.26 1.61 0.52 -1.23 -5.11 118.95 117.72 2jbp s ARG 131 Ca 0.00 -0.76 -0.30 0.00 -0.52 0.00 0.00 55.73 54.16 2jbp s ARG 131 Cb 0.00 -2.70 -0.09 0.00 0.52 0.00 0.00 34.95 32.68 2jbp s ARG 131 CO 0.00 0.54 1.14 0.15 0.02 0.00 0.00 175.30 177.15 2jbp s LYS 132 N -2.66 4.58 -0.01 3.54 -0.14 -1.26 0.12 119.74 123.91 2jbp s LYS 132 Ca 0.30 1.85 0.04 0.00 -1.36 0.00 0.00 55.97 56.80 2jbp s LYS 132 Cb -0.11 -3.19 -0.01 0.00 -1.68 0.00 0.00 37.83 32.83 2jbp s LYS 132 CO 0.23 0.10 -0.12 0.00 -0.76 0.00 0.00 175.35 174.79 2jbp s LEU 134 N -0.25 4.48 -0.23 0.00 1.02 0.17 -1.03 118.68 122.85 2jbp s LEU 134 Ca 0.04 -0.39 -0.05 0.00 0.02 0.00 0.00 54.13 53.75 2jbp s LEU 134 Cb -0.05 -2.14 -0.01 0.00 0.02 0.00 0.00 46.19 44.01 2jbp s LEU 134 CO -0.00 -0.22 -0.02 -0.76 0.02 0.00 0.00 176.35 175.37 2jbp s LEU 135 N 1.73 3.03 -0.22 1.79 1.43 0.12 -1.08 118.68 125.48 2jbp s LEU 135 Ca 0.06 -0.34 -0.10 0.00 -1.03 0.00 0.00 54.13 52.72 2jbp s LEU 135 Cb -0.17 -1.78 -0.05 0.00 0.03 0.00 0.00 46.19 44.21 2jbp s LEU 135 CO 0.11 -0.02 0.13 -0.63 0.23 0.00 0.00 176.35 176.17 2jbp s ILE 136 N 1.50 5.31 -0.27 -0.59 1.01 0.33 -0.99 121.20 127.50 2jbp s ILE 136 Ca 0.06 0.16 -0.06 0.00 0.00 0.00 0.00 60.65 60.80 2jbp s ILE 136 Cb -0.14 -3.44 -0.00 0.00 0.01 0.00 0.00 42.46 38.88 2jbp s ILE 136 CO -0.02 0.40 0.05 -0.69 0.00 0.00 0.00 174.94 174.69 2jbp s VAL 137 N 0.67 3.93 0.31 2.92 1.01 -0.24 -0.83 120.40 128.17 2jbp s VAL 137 Ca 0.07 -0.51 0.08 0.00 0.00 0.00 0.00 61.98 61.62 2jbp s VAL 137 Cb -0.12 -2.93 -0.06 0.00 0.00 0.00 0.00 36.38 33.27 2jbp s VAL 137 CO 0.01 0.22 -0.08 0.00 0.00 0.00 0.00 175.10 175.25 2jbp s MET 138 N 1.53 1.69 1.00 2.72 0.23 -0.03 0.42 119.30 126.86 2jbp s MET 138 Ca 0.04 -1.86 -0.13 0.00 -1.03 0.00 0.00 55.69 52.71 2jbp s MET 138 Cb -0.16 -1.45 0.12 0.00 -1.53 0.00 0.00 34.83 31.81 2jbp s MET 138 CO 0.02 0.10 0.67 -0.85 -2.03 0.00 0.00 175.02 172.92 2jbp n GLU 139 N -0.69 -0.86 -3.61 3.16 0.28 -0.45 -1.28 120.64 117.18 2jbp n GLU 139 Ca -0.05 -0.21 -0.40 0.00 -0.16 0.00 0.00 57.16 56.34 2jbp n GLU 139 Cb 0.63 -2.04 -0.11 0.00 1.43 0.00 0.00 31.44 31.35 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 1.54 4.71 0.06 0.00 1.02 -1.26 -4.84 118.68 119.91 2jbp s LEU 141 Ca 0.02 -1.64 0.23 0.00 0.02 0.00 0.00 54.13 52.76 2jbp s LEU 141 Cb -0.19 -2.42 -0.04 0.00 0.02 0.00 0.00 46.19 43.56 2jbp s LEU 141 CO 0.06 -1.23 0.93 -0.90 0.02 0.00 0.00 176.35 175.24 2jbp n ASP 142 N 7.12 0.56 0.03 2.29 3.85 -1.12 -4.11 116.55 125.18 2jbp n ASP 142 Ca 0.15 -0.13 0.04 0.00 -0.71 0.00 0.00 54.79 54.14 2jbp n ASP 142 Cb 0.48 0.96 0.19 0.00 -1.35 0.00 0.00 41.12 41.40 2jbp n ASP 142 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 2jbp n GLY 143 N 1.33 -0.71 0.16 6.12 0.00 0.38 -4.73 105.19 107.74 2jbp n GLY 143 Ca 0.01 0.03 0.00 0.00 0.00 0.00 0.00 46.02 46.05 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 -1.06 -3.21 3.82 -0.02 0.00 -1.22 -4.58 105.19 98.91 2jbp n GLY 144 Ca 0.01 -1.81 -0.33 0.00 0.00 0.00 0.00 46.02 43.89 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 -0.96 3.96 -0.02 1.61 2.02 -1.26 0.37 118.70 124.41 2jbp s GLU 145 Ca 0.00 1.13 -0.26 0.00 0.02 0.00 0.00 54.97 55.87 2jbp s GLU 145 Cb 0.00 -2.13 -0.20 0.00 0.10 0.00 0.00 34.13 31.90 2jbp s GLU 145 CO 0.00 -0.27 1.26 1.25 0.02 0.00 0.00 175.26 177.51 2jbp h LEU 146 N 1.38 -0.02 -1.81 1.80 5.85 -1.42 -0.58 115.31 120.51 2jbp h LEU 146 Ca -0.48 -0.46 0.00 0.00 0.84 0.00 0.00 57.88 57.77 2jbp h LEU 146 Cb 1.19 0.01 0.00 0.00 0.37 0.00 0.00 40.66 42.23 2jbp h LEU 146 CO 0.60 0.46 0.00 -0.26 -0.34 0.00 0.00 178.44 178.90 2jbp h PHE 147 N -0.51 0.00 0.21 1.25 -1.00 -1.86 -2.79 116.94 112.25 2jbp h PHE 147 Ca -0.00 0.00 -0.31 0.00 2.81 0.00 0.00 57.97 60.46 2jbp h PHE 147 Cb 0.48 0.00 0.02 0.00 3.61 0.00 0.00 35.95 40.07 2jbp h PHE 147 CO 0.09 0.00 -1.45 0.77 -1.61 0.00 0.00 178.31 176.11 2jbp h SER 148 N 0.00 0.69 -0.06 2.17 0.02 -1.66 -2.92 113.55 111.79 2jbp h SER 148 Ca 0.00 -0.92 0.02 0.00 -0.84 0.00 0.00 61.79 60.04 2jbp h SER 148 Cb 0.29 -0.22 -0.04 0.00 0.14 0.00 0.00 62.40 62.56 2jbp h SER 148 CO 0.00 1.68 -0.36 0.03 -1.14 0.00 0.00 176.83 177.04 2jbp h ARG 149 N 0.01 -0.39 -1.02 3.45 2.47 -0.91 -1.42 114.38 116.57 2jbp h ARG 149 Ca -0.27 0.03 0.36 0.00 -1.26 0.00 0.00 59.98 58.84 2jbp h ARG 149 Cb 2.03 0.09 -0.16 0.00 -1.65 0.00 0.00 29.97 30.28 2jbp h ARG 149 CO 0.21 -0.26 0.57 0.82 0.56 0.00 0.00 179.97 181.87 2jbp h ILE 150 N -0.41 0.18 0.00 2.04 2.04 -1.57 0.19 117.51 119.99 2jbp h ILE 150 Ca 0.02 -0.07 0.00 0.00 1.00 0.00 0.00 64.86 65.81 2jbp h ILE 150 Cb 0.46 -0.03 0.00 0.00 -0.74 0.00 0.00 36.82 36.51 2jbp h ILE 150 CO -0.28 0.04 0.00 1.67 0.00 0.00 0.00 178.15 179.58 2jbp n GLN 151 N -5.11 0.79 -3.03 2.37 7.27 -0.54 -4.10 117.38 115.04 2jbp n GLN 151 Ca 0.34 0.00 -0.15 0.00 0.07 0.00 0.00 57.00 57.26 2jbp n GLN 151 Cb 1.12 -1.17 0.01 0.00 2.41 0.00 0.00 30.24 32.61 2jbp n GLN 151 CO 0.00 0.00 0.00 -0.25 0.07 0.00 0.00 177.06 176.88 2jbp n ASP 152 N 0.49 -0.28 -3.68 1.69 8.00 0.66 -4.85 116.55 118.58 2jbp n ASP 152 Ca 0.00 -3.25 -0.12 0.00 0.71 0.00 0.00 54.79 52.13 2jbp n ASP 152 Cb 0.35 0.27 -0.12 0.00 -0.02 0.00 0.00 41.12 41.60 2jbp n ASP 152 CO 0.00 0.00 0.00 -0.13 -0.39 0.00 0.00 177.20 176.68 2jbp s ARG 153 N -1.49 0.23 -0.08 -1.24 0.52 -1.26 -5.07 118.95 110.57 2jbp s ARG 153 Ca 0.34 0.76 -0.21 0.00 -0.52 0.00 0.00 55.73 56.10 2jbp s ARG 153 Cb 0.33 0.02 -0.04 0.00 0.52 0.00 0.00 34.95 35.78 2jbp s ARG 153 CO -0.07 -0.23 0.62 0.20 0.02 0.00 0.00 175.30 175.83 2jbp s GLY 154 N 2.06 2.54 0.00 -3.53 0.00 -1.26 -4.90 107.32 102.23 2jbp s GLY 154 Ca -0.03 0.02 0.00 0.00 0.00 0.00 0.00 44.72 44.71 2jbp s GLY 154 CO -0.10 1.01 0.00 1.22 0.00 0.00 0.00 173.10 175.23 2jbp n ASP 155 N 3.66 -2.34 -2.05 1.64 8.00 -1.26 -4.96 116.55 119.24 2jbp n ASP 155 Ca -0.04 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.46 2jbp n ASP 155 Cb 0.51 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.61 2jbp n ASP 155 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2jbp n GLN 156 N -0.31 -5.01 -2.86 -1.24 6.02 -1.26 -4.86 117.38 107.86 2jbp n GLN 156 Ca 0.00 3.62 -0.32 0.00 -0.01 0.00 0.00 57.00 60.29 2jbp n GLN 156 Cb 0.00 -4.09 -0.06 0.00 1.02 0.00 0.00 30.24 27.11 2jbp n GLN 156 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2jbp s ALA 157 N -0.50 3.17 -0.16 -1.58 0.00 -1.26 -5.00 121.76 116.43 2jbp s ALA 157 Ca 0.00 0.17 -0.28 0.00 0.00 0.00 0.00 51.96 51.86 2jbp s ALA 157 Cb 0.00 -2.97 -0.01 0.00 0.00 0.00 0.00 23.12 20.15 2jbp s ALA 157 CO 0.00 0.12 0.94 0.12 0.00 0.00 0.00 175.76 176.93 2jbp s PHE 158 N -2.22 3.43 0.14 0.00 2.19 -1.26 -5.02 117.98 115.24 2jbp s PHE 158 Ca 0.58 1.42 0.06 0.00 0.33 0.00 0.00 56.93 59.31 2jbp s PHE 158 Cb -0.10 -3.13 -0.04 0.00 -1.31 0.00 0.00 43.02 38.44 2jbp s PHE 158 CO 0.20 -0.29 0.03 0.95 1.83 0.00 0.00 175.22 177.94 2jbp s THR 159 N 2.33 4.03 0.32 0.12 -4.23 -1.26 -1.59 115.64 115.36 2jbp s THR 159 Ca 0.43 -1.17 0.08 0.00 -1.18 0.00 0.00 61.69 59.85 2jbp s THR 159 Cb -0.17 -2.99 0.31 0.00 1.34 0.00 0.00 72.50 70.99 2jbp s THR 159 CO 0.13 -0.02 1.76 -0.08 -0.54 0.00 0.00 174.62 175.87 2jbp h GLU 160 N 2.91 0.65 -0.18 3.99 4.81 -1.06 -0.29 114.58 125.40 2jbp h GLU 160 Ca -0.47 -0.04 -0.02 0.00 -0.13 0.00 0.00 59.36 58.70 2jbp h GLU 160 Cb 1.19 -0.15 -0.01 0.00 0.63 0.00 0.00 28.75 30.41 2jbp h GLU 160 CO 0.60 0.43 0.04 -0.09 -0.73 0.00 0.00 179.01 179.26 2jbp h ARG 161 N 0.67 0.30 -1.02 1.92 2.43 -1.79 -0.63 114.38 116.25 2jbp h ARG 161 Ca 0.60 -0.07 0.30 0.00 -0.81 0.00 0.00 59.98 60.00 2jbp h ARG 161 Cb 1.07 -0.04 -0.14 0.00 -0.42 0.00 0.00 29.97 30.44 2jbp h ARG 161 CO -0.41 0.43 0.60 0.93 -1.51 0.00 0.00 179.97 180.01 2jbp h GLU 162 N 0.11 0.39 0.19 0.20 5.08 -1.47 0.20 114.58 119.28 2jbp h GLU 162 Ca 0.06 -0.02 -0.01 0.00 -1.00 0.00 0.00 59.36 58.38 2jbp h GLU 162 Cb 0.27 -0.09 0.00 0.00 0.50 0.00 0.00 28.75 29.43 2jbp h GLU 162 CO 0.00 0.26 -0.09 0.00 -1.00 0.00 0.00 179.01 178.18 2jbp h ALA 163 N 1.79 -0.26 -0.67 3.43 0.00 -0.31 0.61 119.26 123.86 2jbp h ALA 163 Ca 0.70 -0.10 0.13 0.00 0.00 0.00 0.00 54.91 55.64 2jbp h ALA 163 Cb 1.56 0.10 -0.10 0.00 0.00 0.00 0.00 17.79 19.36 2jbp h ALA 163 CO -0.54 -0.59 0.17 1.03 0.00 0.00 0.00 179.25 179.32 2jbp h SER 164 N -0.37 0.04 -0.57 0.00 0.87 0.58 0.12 113.55 114.24 2jbp h SER 164 Ca -0.03 0.12 -0.01 0.00 -1.23 0.00 0.00 61.79 60.65 2jbp h SER 164 Cb 0.28 0.16 -0.03 0.00 -0.44 0.00 0.00 62.40 62.38 2jbp h SER 164 CO 0.04 0.01 0.32 -0.33 -0.53 0.00 0.00 176.83 176.34 2jbp h GLU 165 N 0.29 0.78 -0.00 2.24 5.08 -0.07 0.12 114.58 123.03 2jbp h GLU 165 Ca 0.36 -0.08 -0.00 0.00 -1.00 0.00 0.00 59.36 58.64 2jbp h GLU 165 Cb 0.57 -0.16 -0.00 0.00 0.50 0.00 0.00 28.75 29.66 2jbp h GLU 165 CO -0.44 0.59 0.00 0.82 -1.00 0.00 0.00 179.01 178.98 2jbp h ILE 166 N 0.77 1.08 -0.87 3.13 2.04 0.31 -2.41 117.51 121.55 2jbp h ILE 166 Ca 0.20 -0.24 0.09 0.00 1.00 0.00 0.00 64.86 65.92 2jbp h ILE 166 Cb 0.02 1.24 -0.06 0.00 -0.74 0.00 0.00 36.82 37.28 2jbp h ILE 166 CO -0.03 0.06 0.56 0.24 0.00 0.00 0.00 178.15 178.98 2jbp h MET 167 N -0.10 0.84 0.00 2.37 2.86 -0.20 0.30 114.93 121.00 2jbp h MET 167 Ca 0.00 -0.05 -0.07 0.00 -2.06 0.00 0.00 59.70 57.52 2jbp h MET 167 Cb 0.10 -0.19 -0.01 0.00 0.06 0.00 0.00 31.60 31.56 2jbp h MET 167 CO -0.00 0.55 -0.31 -0.22 1.06 0.00 0.00 176.91 177.99 2jbp h LYS 168 N 0.86 0.00 0.06 1.72 3.64 -0.49 -0.18 116.57 122.17 2jbp h LYS 168 Ca 0.40 0.00 -0.28 0.00 -1.27 0.00 0.00 60.65 59.50 2jbp h LYS 168 Cb 0.40 0.00 0.03 0.00 -0.41 0.00 0.00 32.23 32.25 2jbp h LYS 168 CO -0.17 0.31 -1.12 0.66 -2.27 0.00 0.00 179.45 176.86 2jbp h SER 169 N 0.00 0.88 -1.00 4.20 4.64 -0.15 -0.09 113.55 122.02 2jbp h SER 169 Ca -0.00 -0.78 0.06 0.00 -0.47 0.00 0.00 61.79 60.60 2jbp h SER 169 Cb 0.57 -0.27 -0.07 0.00 -0.31 0.00 0.00 62.40 62.32 2jbp h SER 169 CO 0.04 1.56 0.65 0.40 -0.87 0.00 0.00 176.83 178.61 2jbp h ILE 170 N 0.31 1.10 -0.85 0.95 2.04 -1.36 -2.23 117.51 117.47 2jbp h ILE 170 Ca -0.16 -0.41 -0.01 0.00 1.00 0.00 0.00 64.86 65.29 2jbp h ILE 170 Cb 1.79 -0.19 -0.04 0.00 -0.74 0.00 0.00 36.82 37.63 2jbp h ILE 170 CO 0.22 0.22 0.49 1.23 0.00 0.00 0.00 178.15 180.31 2jbp h GLY 171 N 1.19 1.25 1.33 5.37 0.00 -0.46 -1.77 103.07 109.98 2jbp h GLY 171 Ca 0.43 -0.53 -0.08 0.00 0.00 0.00 0.00 47.33 47.14 2jbp h GLY 171 CO -0.17 0.52 -0.02 0.83 0.00 0.00 0.00 176.54 177.70 2jbp h GLU 172 N 1.18 0.82 0.16 4.80 5.08 -0.44 0.28 114.58 126.46 2jbp h GLU 172 Ca 0.30 -0.23 -0.01 0.00 -1.00 0.00 0.00 59.36 58.42 2jbp h GLU 172 Cb -0.02 -0.09 0.00 0.00 0.50 0.00 0.00 28.75 29.14 2jbp h GLU 172 CO -0.05 0.83 -0.08 0.00 -1.00 0.00 0.00 179.01 178.71 2jbp h ALA 173 N 1.22 -0.21 -0.69 3.43 0.00 -1.02 -1.64 119.26 120.35 2jbp h ALA 173 Ca 0.14 -0.14 0.06 0.00 0.00 0.00 0.00 54.91 54.98 2jbp h ALA 173 Cb 0.49 0.08 -0.06 0.00 0.00 0.00 0.00 17.79 18.30 2jbp h ALA 173 CO 0.02 -0.50 0.38 0.82 0.00 0.00 0.00 179.25 179.98 2jbp h ILE 174 N -0.45 0.96 -0.89 0.00 1.08 -1.11 -0.88 117.51 116.23 2jbp h ILE 174 Ca -0.02 -0.24 0.07 0.00 -0.39 0.00 0.00 64.86 64.27 2jbp h ILE 174 Cb 0.35 0.20 -0.06 0.00 -3.07 0.00 0.00 36.82 34.24 2jbp h ILE 174 CO 0.04 0.13 0.58 -0.61 -0.69 0.00 0.00 178.15 177.59 2jbp h GLN 175 N 0.70 0.97 -0.23 2.37 4.15 -0.22 -0.03 115.11 122.81 2jbp h GLN 175 Ca 0.31 -0.06 -0.18 0.00 0.77 0.00 0.00 58.65 59.49 2jbp h GLN 175 Cb 0.20 -0.22 0.00 0.00 0.21 0.00 0.00 27.48 27.68 2jbp h GLN 175 CO -0.19 0.64 -0.57 -0.92 -1.93 0.00 0.00 178.83 175.86 2jbp h TYR 176 N 1.00 1.02 -0.26 3.99 3.20 -0.23 -1.22 116.97 124.48 2jbp h TYR 176 Ca 0.39 -0.39 -0.01 0.00 3.14 0.00 0.00 58.73 61.86 2jbp h TYR 176 Cb 0.22 -0.18 -0.01 0.00 1.54 0.00 0.00 36.73 38.30 2jbp h TYR 176 CO -0.00 1.21 0.12 -0.07 -1.64 0.00 0.00 178.16 177.77 2jbp h LEU 177 N 0.54 0.34 -0.94 2.82 3.38 -0.54 -2.75 115.31 118.17 2jbp h LEU 177 Ca -0.00 -0.13 -0.10 0.00 0.09 0.00 0.00 57.88 57.73 2jbp h LEU 177 Cb 1.18 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 41.83 2jbp h LEU 177 CO 0.12 0.38 -0.29 0.45 0.09 0.00 0.00 178.44 179.19 2jbp h HIS 178 N 0.28 0.48 0.00 1.13 3.86 -0.95 -0.23 115.15 119.72 2jbp h HIS 178 Ca 0.09 -0.11 0.00 0.00 -1.16 0.00 0.00 60.37 59.19 2jbp h HIS 178 Cb 0.13 -0.12 0.00 0.00 1.06 0.00 0.00 27.41 28.49 2jbp h HIS 178 CO -0.02 0.68 0.00 -1.13 0.86 0.00 0.00 177.93 178.32 2jbp n SER 179 N -4.10 0.61 -0.25 2.45 3.41 -0.47 -1.20 113.62 114.07 2jbp n SER 179 Ca -0.01 0.69 0.09 0.00 -0.26 0.00 0.00 58.87 59.38 2jbp n SER 179 Cb 0.43 -0.80 0.16 0.00 -0.26 0.00 0.00 64.21 63.74 2jbp n SER 179 CO 0.00 0.00 0.00 2.30 -0.16 0.00 0.00 175.04 177.18 2jbp n ILE 180 N -2.21 2.00 -3.14 -1.33 -5.35 -0.54 -4.98 119.36 103.80 2jbp n ILE 180 Ca 0.01 -2.59 -0.14 0.00 -0.27 0.00 0.00 62.75 59.76 2jbp n ILE 180 Cb 0.17 -0.24 0.05 0.00 -1.74 0.00 0.00 39.64 37.87 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 -1.33 -4.53 -4.20 7.28 4.13 -0.34 -4.90 115.26 111.37 2jbp n ASN 181 Ca 0.17 -0.32 -0.33 0.00 1.68 0.00 0.00 54.58 55.78 2jbp n ASN 181 Cb 0.66 -3.19 -0.16 0.00 -1.54 0.00 0.00 39.78 35.55 2jbp n ASN 181 CO 0.00 0.00 0.00 -0.63 0.28 0.00 0.00 177.26 176.91 2jbp s ILE 182 N -3.19 2.19 0.11 2.41 1.01 -0.21 -0.28 121.20 123.24 2jbp s ILE 182 Ca 0.34 -0.94 -0.01 0.00 0.00 0.00 0.00 60.65 60.04 2jbp s ILE 182 Cb -0.15 -1.88 -0.04 0.00 0.01 0.00 0.00 42.46 40.39 2jbp s ILE 182 CO 0.43 0.54 0.28 0.00 0.00 0.00 0.00 174.94 176.20 2jbp s ALA 183 N 0.77 3.93 -0.15 9.38 0.00 -0.76 -3.44 121.76 131.49 2jbp s ALA 183 Ca -0.08 -0.81 -0.03 0.00 0.00 0.00 0.00 51.96 51.05 2jbp s ALA 183 Cb -0.16 -1.91 -0.24 0.00 0.00 0.00 0.00 23.12 20.81 2jbp s ALA 183 CO -0.01 0.69 0.24 1.58 0.00 0.00 0.00 175.76 178.27 2jbp n HIS 184 N -0.02 0.92 -0.98 0.00 -0.00 -1.26 -2.60 115.22 111.28 2jbp n HIS 184 Ca -0.05 0.21 0.00 0.00 0.46 0.00 0.00 57.72 58.34 2jbp n HIS 184 Cb 0.52 -1.12 0.00 0.00 -0.12 0.00 0.00 29.99 29.27 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 -3.38 -0.70 -2.43 1.57 5.12 -1.26 -2.58 116.66 113.00 2jbp n ARG 185 Ca -0.34 0.17 -0.02 0.00 -1.93 0.00 0.00 57.85 55.74 2jbp n ARG 185 Cb 1.04 -3.72 0.10 0.00 -1.16 0.00 0.00 32.46 28.72 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 -1.18 -4.59 0.55 2.03 -1.26 -4.92 116.55 106.83 2jbp n ASP 186 Ca 0.00 -1.97 -0.42 0.00 0.52 0.00 0.00 54.79 52.92 2jbp n ASP 186 Cb 0.17 0.56 -0.03 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 0.10 3.66 0.29 5.18 1.01 -1.26 -4.90 120.40 124.48 2jbp s VAL 187 Ca 0.07 0.62 0.02 0.00 0.00 0.00 0.00 61.98 62.70 2jbp s VAL 187 Cb 0.35 -4.04 -0.04 0.00 0.00 0.00 0.00 36.38 32.65 2jbp s VAL 187 CO -0.10 -0.76 0.12 -1.59 0.00 0.00 0.00 175.10 172.77 2jbp s LYS 188 N 5.60 1.52 0.15 2.72 -2.85 -1.26 -4.79 119.74 120.83 2jbp s LYS 188 Ca 0.66 -1.85 -0.23 0.00 -1.00 0.00 0.00 55.97 53.54 2jbp s LYS 188 Cb -0.16 -0.23 0.03 0.00 -2.06 0.00 0.00 37.83 35.42 2jbp s LYS 188 CO 0.30 -0.37 1.62 -1.35 0.10 0.00 0.00 175.35 175.64 2jbp h PRO 189 N 2.27 -0.27 0.00 1.78 0.11 -1.96 0.19 132.00 134.12 2jbp h PRO 189 Ca -0.36 0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.77 2jbp h PRO 189 Cb 1.25 0.06 0.00 0.00 0.11 0.00 0.00 31.00 32.42 2jbp h PRO 189 CO 0.57 -0.18 0.16 0.39 -0.21 0.00 0.00 178.00 178.73 2jbp n GLU 190 N -5.40 0.00 -0.36 1.05 4.71 -1.26 -1.32 120.64 118.07 2jbp n GLU 190 Ca -0.01 0.35 0.07 0.00 -0.01 0.00 0.00 57.16 57.57 2jbp n GLU 190 Cb 0.31 -1.67 0.23 0.00 -1.01 0.00 0.00 31.44 29.30 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 -1.37 3.59 -3.97 1.62 5.03 0.05 -4.78 115.26 115.43 2jbp n ASN 191 Ca -0.00 -2.59 -0.31 0.00 0.87 0.00 0.00 54.58 52.55 2jbp n ASN 191 Cb 0.16 -0.43 -0.15 0.00 -1.02 0.00 0.00 39.78 38.34 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 -2.07 4.17 0.10 3.41 1.43 -0.43 -0.85 118.68 124.44 2jbp s LEU 192 Ca 0.35 -1.98 0.07 0.00 -1.03 0.00 0.00 54.13 51.54 2jbp s LEU 192 Cb 0.26 -1.48 -0.04 0.00 0.03 0.00 0.00 46.19 44.96 2jbp s LEU 192 CO 0.12 -0.37 -0.09 -0.76 0.23 0.00 0.00 176.35 175.49 2jbp s LEU 193 N 1.05 3.10 0.11 1.79 1.43 -0.36 -1.30 118.68 124.50 2jbp s LEU 193 Ca 0.09 -0.36 -0.22 0.00 -1.03 0.00 0.00 54.13 52.61 2jbp s LEU 193 Cb -0.19 -1.88 -0.07 0.00 0.03 0.00 0.00 46.19 44.08 2jbp s LEU 193 CO -0.11 0.18 0.65 -0.31 0.23 0.00 0.00 176.35 177.00 2jbp s TYR 194 N -1.23 3.85 0.64 0.29 2.02 0.16 0.06 117.35 123.13 2jbp s TYR 194 Ca 0.22 1.42 0.40 0.00 -0.37 0.00 0.00 57.07 58.74 2jbp s TYR 194 Cb -0.11 -2.61 2.23 0.00 -0.40 0.00 0.00 41.96 41.07 2jbp s TYR 194 CO 0.14 0.55 2.33 1.79 -1.57 0.00 0.00 175.55 178.80 2jbp h THR 195 N 3.46 0.18 -1.34 -0.71 1.35 -0.64 0.11 112.91 115.32 2jbp h THR 195 Ca -0.48 -0.01 0.08 0.00 -0.55 0.00 0.00 66.41 65.45 2jbp h THR 195 Cb 1.21 1.01 -0.02 0.00 -1.73 0.00 0.00 68.15 68.62 2jbp h THR 195 CO 0.65 0.00 0.21 -1.54 -0.25 0.00 0.00 175.52 174.59 2jbp n SER 196 N -3.33 -0.26 -0.00 5.36 3.41 -1.26 -2.78 113.62 114.75 2jbp n SER 196 Ca -0.03 -1.04 0.08 0.00 -0.26 0.00 0.00 58.87 57.62 2jbp n SER 196 Cb 0.08 0.40 -0.10 0.00 -0.26 0.00 0.00 64.21 64.32 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 -0.21 1.12 -1.60 4.33 4.01 -1.26 -3.75 118.16 120.80 2jbp n LYS 197 Ca 0.01 -0.01 -0.44 0.00 -0.51 0.00 0.00 58.31 57.36 2jbp n LYS 197 Cb 0.13 -1.34 -0.02 0.00 -0.51 0.00 0.00 35.03 33.29 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 -1.45 1.45 0.00 1.97 1.74 -1.26 -4.84 116.66 114.28 2jbp n ARG 198 Ca 0.03 0.51 0.00 0.00 -0.77 0.00 0.00 57.85 57.62 2jbp n ARG 198 Cb 0.28 -1.92 0.00 0.00 -1.02 0.00 0.00 32.46 29.81 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 0.78 0.00 -0.01 5.56 -0.04 -1.26 -1.38 135.00 138.65 2jbp n PRO 199 Ca 0.09 0.00 0.03 0.00 -0.04 0.00 0.00 63.50 63.58 2jbp n PRO 199 Cb 0.32 -1.29 -0.07 0.00 -0.04 0.00 0.00 33.50 32.42 2jbp n PRO 199 CO 0.00 0.00 0.00 0.27 -0.04 0.00 0.00 175.50 175.73 2jbp n ASN 200 N -0.75 3.03 -2.58 3.54 2.04 -1.26 -5.09 115.26 114.20 2jbp n ASN 200 Ca 0.00 0.00 -0.24 0.00 -0.44 0.00 0.00 54.58 53.90 2jbp n ASN 200 Cb 0.00 1.26 0.02 0.00 -2.53 0.00 0.00 39.78 38.54 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 -1.89 -4.31 -2.43 -2.53 0.00 -0.48 -4.98 120.51 103.89 2jbp n ALA 201 Ca -0.04 -0.54 -0.29 0.00 0.00 0.00 0.00 53.44 52.57 2jbp n ALA 201 Cb 0.32 -0.69 -0.12 0.00 0.00 0.00 0.00 19.45 18.96 2jbp n ALA 201 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 2jbp s ILE 202 N -1.29 2.48 -0.18 0.00 1.01 -1.26 -4.86 121.20 117.10 2jbp s ILE 202 Ca 0.25 -1.72 -0.16 0.00 0.00 0.00 0.00 60.65 59.02 2jbp s ILE 202 Cb -0.08 -2.13 -0.04 0.00 0.01 0.00 0.00 42.46 40.22 2jbp s ILE 202 CO 0.51 0.06 0.40 -0.22 0.00 0.00 0.00 174.94 175.68 2jbp s LEU 203 N -2.20 4.20 0.11 2.97 2.96 -1.26 0.13 118.68 125.59 2jbp s LEU 203 Ca 0.17 0.58 0.08 0.00 -0.22 0.00 0.00 54.13 54.74 2jbp s LEU 203 Cb -0.10 -2.53 -0.04 0.00 0.50 0.00 0.00 46.19 44.03 2jbp s LEU 203 CO 0.08 -0.03 -0.21 -0.54 -1.32 0.00 0.00 176.35 174.34 2jbp s LYS 204 N 1.01 1.16 0.03 1.98 1.02 0.11 -4.59 119.74 120.45 2jbp s LYS 204 Ca 0.20 -1.21 -0.12 0.00 0.02 0.00 0.00 55.97 54.86 2jbp s LYS 204 Cb -0.14 -1.40 -0.06 0.00 -0.52 0.00 0.00 37.83 35.71 2jbp s LYS 204 CO 0.08 0.32 0.39 -1.17 -0.92 0.00 0.00 175.35 174.05 2jbp s LEU 205 N -2.03 4.41 0.35 3.17 2.96 0.95 -1.23 118.68 127.26 2jbp s LEU 205 Ca 0.08 0.86 0.04 0.00 -0.22 0.00 0.00 54.13 54.89 2jbp s LEU 205 Cb -0.09 -2.74 -0.04 0.00 0.50 0.00 0.00 46.19 43.82 2jbp s LEU 205 CO 0.05 0.26 0.13 0.42 -1.32 0.00 0.00 176.35 175.89 2jbp s THR 206 N -1.22 0.59 -0.16 3.68 -4.23 -0.03 -2.00 115.64 112.27 2jbp s THR 206 Ca 0.28 -2.00 -0.01 0.00 -1.18 0.00 0.00 61.69 58.77 2jbp s THR 206 Cb -0.15 -2.50 0.00 0.00 1.34 0.00 0.00 72.50 71.19 2jbp s THR 206 CO 0.15 0.00 0.04 -0.67 -0.54 0.00 0.00 174.62 173.60 2jbp n ASP 207 N -1.04 -4.88 -1.53 3.99 2.03 -1.26 -4.92 116.55 108.93 2jbp n ASP 207 Ca -0.02 0.62 -0.04 0.00 0.52 0.00 0.00 54.79 55.87 2jbp n ASP 207 Cb 0.65 -3.08 0.19 0.00 -0.72 0.00 0.00 41.12 38.16 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 0.22 1.55 0.17 -0.67 3.01 -1.26 -4.45 117.46 116.03 2jbp n PHE 208 Ca 0.01 -0.84 0.13 0.00 1.01 0.00 0.00 57.45 57.76 2jbp n PHE 208 Cb 0.03 -0.50 0.67 0.00 -0.01 0.00 0.00 39.48 39.67 2jbp n PHE 208 CO 0.00 0.00 0.00 0.78 1.01 0.00 0.00 176.76 178.55 2jbp h GLY 209 N 3.41 0.00 -0.37 1.37 0.00 -1.91 -2.51 103.07 103.06 2jbp h GLY 209 Ca 0.17 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.50 2jbp h GLY 209 CO 0.47 0.00 -0.17 0.69 0.00 0.00 0.00 176.54 177.53 2jbp n PHE 210 N -4.45 0.00 -1.56 5.60 0.99 -1.26 -4.97 117.46 111.81 2jbp n PHE 210 Ca 0.01 0.00 -0.46 0.00 -0.00 0.00 0.00 57.45 57.01 2jbp n PHE 210 Cb 0.27 0.00 -0.02 0.00 -1.00 0.00 0.00 39.48 38.73 2jbp n PHE 210 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.76 176.76 2jbp n ALA 211 N -0.29 -0.74 -3.65 4.37 0.00 -0.95 -4.69 120.51 114.55 2jbp n ALA 211 Ca 0.03 0.41 -0.11 0.00 0.00 0.00 0.00 53.44 53.77 2jbp n ALA 211 Cb 0.17 -1.95 -0.11 0.00 0.00 0.00 0.00 19.45 17.56 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 -1.33 0.41 0.81 0.00 2.20 -1.07 -4.86 119.74 115.90 2jbp s LYS 212 Ca 0.61 0.77 -0.11 0.00 -0.36 0.00 0.00 55.97 56.89 2jbp s LYS 212 Cb -0.76 0.00 0.08 0.00 -1.51 0.00 0.00 37.83 35.65 2jbp s LYS 212 CO 0.58 -0.15 1.09 -2.00 -0.36 0.00 0.00 175.35 174.52 2jbp s GLU 213 N 1.28 1.95 0.00 4.03 2.12 -1.26 -1.83 118.70 124.99 2jbp s GLU 213 Ca -0.09 1.10 0.00 0.00 0.36 0.00 0.00 54.97 56.35 2jbp s GLU 213 Cb -0.08 -1.87 0.00 0.00 0.26 0.00 0.00 34.13 32.45 2jbp s GLU 213 CO -0.11 -1.84 0.00 0.25 -0.54 0.00 0.00 175.26 173.01 2jbp n THR 214 N -3.65 0.00 -0.90 -1.70 -2.24 0.61 -4.81 114.28 101.60 2jbp n THR 214 Ca 0.09 0.00 -0.35 0.00 -2.27 0.00 0.00 64.05 61.52 2jbp n THR 214 Cb 0.53 -0.13 0.08 0.00 -2.10 0.00 0.00 70.33 68.72 2jbp n THR 214 CO 0.00 0.00 0.00 1.07 -0.57 0.00 0.00 175.07 175.57 2jbp n THR 215 N -1.63 0.00 -1.41 4.28 5.66 -1.26 -4.51 114.28 115.40 2jbp n THR 215 Ca 0.00 -0.33 0.17 0.00 -3.05 0.00 0.00 64.05 60.84 2jbp n THR 215 Cb 0.20 -0.27 -0.08 0.00 -1.55 0.00 0.00 70.33 68.63 2jbp n THR 215 CO 0.00 0.00 0.00 -2.65 -3.05 0.00 0.00 175.07 169.37 2jbp n PRO 227 N 0.64 -3.08 0.00 1.09 -0.02 -1.26 -4.94 135.00 127.42 2jbp n PRO 227 Ca 0.01 2.40 0.00 0.00 -2.02 0.00 0.00 63.50 63.90 2jbp n PRO 227 Cb 0.57 -3.68 0.00 0.00 -0.02 0.00 0.00 33.50 30.37 2jbp n PRO 227 CO 0.00 0.00 0.00 2.48 1.98 0.00 0.00 175.50 179.96 2jbp n TYR 228 N -4.25 0.00 -0.39 6.00 0.18 -1.26 -4.68 117.16 112.76 2jbp n TYR 228 Ca -0.06 -0.10 0.00 0.00 1.88 0.00 0.00 57.90 59.61 2jbp n TYR 228 Cb 0.67 -0.01 0.00 0.00 -0.38 0.00 0.00 39.34 39.62 2jbp n TYR 228 CO 0.00 0.00 0.00 2.48 -2.08 0.00 0.00 176.86 177.26 2jbp n TYR 229 N -0.10 0.00 -2.63 -3.48 0.18 -1.26 -5.07 117.16 104.80 2jbp n TYR 229 Ca 0.00 -0.18 -0.43 0.00 1.88 0.00 0.00 57.90 59.17 2jbp n TYR 229 Cb 0.26 -0.02 -0.02 0.00 -0.38 0.00 0.00 39.34 39.18 2jbp n TYR 229 CO 0.00 0.00 0.00 0.54 -2.08 0.00 0.00 176.86 175.32 2jbp s VAL 230 N -0.36 4.39 0.54 -3.48 0.11 -1.26 -4.98 120.40 115.36 2jbp s VAL 230 Ca 0.00 1.52 -0.18 0.00 -2.93 0.00 0.00 61.98 60.39 2jbp s VAL 230 Cb 0.00 -4.49 -0.13 0.00 -1.53 0.00 0.00 36.38 30.23 2jbp s VAL 230 CO 0.00 -0.69 0.10 0.00 -3.33 0.00 0.00 175.10 171.17 2jbp n ALA 231 N 7.26 -2.43 0.10 1.54 0.00 -1.26 -4.82 120.51 120.90 2jbp n ALA 231 Ca 0.12 -0.06 0.01 0.00 0.00 0.00 0.00 53.44 53.51 2jbp n ALA 231 Cb 0.48 -1.56 0.34 0.00 0.00 0.00 0.00 19.45 18.71 2jbp n ALA 231 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 2jbp h PRO 232 N 0.05 0.26 0.00 0.00 0.13 -2.00 -2.83 132.00 127.61 2jbp h PRO 232 Ca -0.43 -0.07 0.00 0.00 -0.87 0.00 0.00 66.00 64.63 2jbp h PRO 232 Cb 1.43 -0.03 0.00 0.00 0.13 0.00 0.00 31.00 32.53 2jbp h PRO 232 CO 0.43 0.45 0.00 1.05 -0.23 0.00 0.00 178.00 179.71 2jbp h GLU 233 N 0.24 0.00 0.00 0.86 4.11 -1.87 -2.76 114.58 115.16 2jbp h GLU 233 Ca 0.04 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.47 2jbp h GLU 233 Cb 0.49 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.74 2jbp h GLU 233 CO 0.03 0.00 -1.29 0.28 0.07 0.00 0.00 179.01 178.11 2jbp n VAL 234 N -2.33 0.00 1.06 -1.06 0.31 -1.07 -3.03 118.33 112.20 2jbp n VAL 234 Ca -0.00 -0.19 0.09 0.00 -0.01 0.00 0.00 64.34 64.22 2jbp n VAL 234 Cb 0.10 0.65 0.51 0.00 -0.91 0.00 0.00 33.84 34.19 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 -1.73 0.00 0.00 7.52 4.77 -1.04 -4.88 117.00 121.64 2jbp n LEU 235 Ca 0.01 0.04 0.00 0.00 -0.03 0.00 0.00 56.01 56.03 2jbp n LEU 235 Cb 0.39 -0.04 0.00 0.00 -2.33 0.00 0.00 43.42 41.43 2jbp n LEU 235 CO 0.41 -0.02 0.00 0.61 -1.33 0.00 0.00 177.39 177.06 2jbp n GLY 236 N 0.11 4.25 0.00 -0.72 0.00 -1.17 -5.03 105.19 102.63 2jbp n GLY 236 Ca 0.12 -1.07 0.00 0.00 0.00 0.00 0.00 46.02 45.07 2jbp n GLY 236 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2jbp n PRO 237 N -0.55 0.00 -0.87 1.61 -0.04 -1.23 -4.73 135.00 129.18 2jbp n PRO 237 Ca 0.00 0.74 0.00 0.00 -0.04 0.00 0.00 63.50 64.20 2jbp n PRO 237 Cb 0.00 -1.31 0.00 0.00 -0.04 0.00 0.00 33.50 32.15 2jbp n PRO 237 CO 0.00 0.00 0.00 -1.91 -0.04 0.00 0.00 175.50 173.55 2jbp n GLU 238 N -2.12 -2.28 -2.14 0.54 2.13 -1.26 -4.95 120.64 110.56 2jbp n GLU 238 Ca 0.00 1.69 -0.29 0.00 0.66 0.00 0.00 57.16 59.22 2jbp n GLU 238 Cb 0.00 -1.79 0.03 0.00 0.27 0.00 0.00 31.44 29.95 2jbp n GLU 238 CO 0.00 0.00 0.00 0.15 -0.41 0.00 0.00 177.13 176.87 2jbp s LYS 239 N -2.97 3.10 0.00 5.31 -0.14 -1.26 -4.90 119.74 118.88 2jbp s LYS 239 Ca 0.00 0.33 0.00 0.00 -1.36 0.00 0.00 55.97 54.94 2jbp s LYS 239 Cb 0.00 -2.16 0.00 0.00 -1.68 0.00 0.00 37.83 33.99 2jbp s LYS 239 CO 0.00 -0.74 0.10 0.66 -0.76 0.00 0.00 175.35 174.61 2jbp n TYR 240 N -2.73 0.00 0.11 3.18 0.53 -1.26 -3.79 117.16 113.20 2jbp n TYR 240 Ca 0.05 -0.03 -0.23 0.00 -1.02 0.00 0.00 57.90 56.67 2jbp n TYR 240 Cb 0.56 -0.07 -0.15 0.00 -1.03 0.00 0.00 39.34 38.66 2jbp n TYR 240 CO 0.00 0.00 0.00 -0.44 -1.02 0.00 0.00 176.86 175.40 2jbp h ASP 241 N 1.32 0.77 -0.28 7.72 3.32 -2.00 -3.24 116.42 124.04 2jbp h ASP 241 Ca 0.00 -0.90 -0.04 0.00 0.02 0.00 0.00 57.03 56.12 2jbp h ASP 241 Cb 0.10 -0.25 -0.01 0.00 0.22 0.00 0.00 39.33 39.39 2jbp h ASP 241 CO 0.00 1.61 0.04 0.11 -1.72 0.00 0.00 179.24 179.27 2jbp h LYS 242 N 0.06 0.47 -0.81 3.56 1.57 -1.96 -2.45 116.57 117.01 2jbp h LYS 242 Ca -0.21 -0.13 0.24 0.00 -1.87 0.00 0.00 60.65 58.67 2jbp h LYS 242 Cb 1.97 -0.05 -0.03 0.00 0.08 0.00 0.00 32.23 34.20 2jbp h LYS 242 CO 0.24 0.59 0.67 0.66 -0.57 0.00 0.00 179.45 181.03 2jbp h SER 243 N 0.27 0.00 -0.39 0.86 4.64 -1.86 0.26 113.55 117.33 2jbp h SER 243 Ca 0.08 0.00 0.08 0.00 -0.47 0.00 0.00 61.79 61.48 2jbp h SER 243 Cb 0.36 0.00 -0.07 0.00 -0.31 0.00 0.00 62.40 62.38 2jbp h SER 243 CO 0.01 0.00 -0.06 0.00 -0.87 0.00 0.00 176.83 175.90 2jbp h ASP 245 N 0.03 -0.23 -0.51 0.00 3.32 -0.58 -2.36 116.42 116.08 2jbp h ASP 245 Ca 0.19 0.02 0.15 0.00 0.02 0.00 0.00 57.03 57.41 2jbp h ASP 245 Cb 0.28 0.08 -0.02 0.00 0.22 0.00 0.00 39.33 39.90 2jbp h ASP 245 CO -0.38 -0.14 0.39 0.24 -1.72 0.00 0.00 179.24 177.64 2jbp h MET 246 N -0.20 0.00 -0.01 3.56 2.86 -1.24 0.35 114.93 120.25 2jbp h MET 246 Ca 0.00 0.00 -0.00 0.00 -2.06 0.00 0.00 59.70 57.64 2jbp h MET 246 Cb 0.19 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.85 2jbp h MET 246 CO -0.02 0.00 -0.01 2.35 1.06 0.00 0.00 176.91 180.29 2jbp h TRP 247 N 0.00 0.03 -0.71 -0.22 2.91 -0.93 -2.05 115.95 114.98 2jbp h TRP 247 Ca 0.24 -0.01 0.15 0.00 1.13 0.00 0.00 58.89 60.40 2jbp h TRP 247 Cb 1.02 -0.00 -0.10 0.00 -0.51 0.00 0.00 29.16 29.57 2jbp h TRP 247 CO 0.00 0.58 0.19 0.77 -1.03 0.00 0.00 178.44 178.94 2jbp h SER 248 N -0.53 0.05 -0.47 2.65 0.02 0.02 0.26 113.55 115.55 2jbp h SER 248 Ca 0.00 0.13 0.03 0.00 -0.84 0.00 0.00 61.79 61.12 2jbp h SER 248 Cb 0.57 0.17 -0.04 0.00 0.14 0.00 0.00 62.40 63.25 2jbp h SER 248 CO 0.00 -0.01 0.25 0.25 -1.14 0.00 0.00 176.83 176.19 2jbp h LEU 249 N 0.29 0.39 -1.46 5.07 5.85 -0.46 0.11 115.31 125.10 2jbp h LEU 249 Ca 0.39 0.02 0.02 0.00 0.84 0.00 0.00 57.88 59.15 2jbp h LEU 249 Cb 0.65 -0.06 -0.03 0.00 0.37 0.00 0.00 40.66 41.58 2jbp h LEU 249 CO -0.47 0.27 0.39 1.23 -0.34 0.00 0.00 178.44 179.52 2jbp h GLY 250 N 0.51 0.79 1.02 3.75 0.00 0.19 -0.85 103.07 108.47 2jbp h GLY 250 Ca 0.20 -0.28 -0.18 0.00 0.00 0.00 0.00 47.33 47.06 2jbp h GLY 250 CO -0.12 0.26 -0.64 -2.08 0.00 0.00 0.00 176.54 173.96 2jbp h VAL 251 N 0.72 1.32 -0.14 4.60 2.07 0.62 -2.17 116.25 123.28 2jbp h VAL 251 Ca 0.23 -1.91 0.02 0.00 0.82 0.00 0.00 66.70 65.86 2jbp h VAL 251 Cb 0.02 2.11 -0.02 0.00 -1.52 0.00 0.00 31.29 31.88 2jbp h VAL 251 CO -0.06 0.59 -0.00 0.40 0.02 0.00 0.00 177.57 178.52 2jbp h ILE 252 N 0.32 0.90 -0.83 4.57 2.04 -0.82 -1.43 117.51 122.25 2jbp h ILE 252 Ca -0.05 -0.01 0.14 0.00 1.00 0.00 0.00 64.86 65.94 2jbp h ILE 252 Cb 1.28 0.86 -0.06 0.00 -0.74 0.00 0.00 36.82 38.16 2jbp h ILE 252 CO 0.13 0.01 0.54 -0.03 0.00 0.00 0.00 178.15 178.80 2jbp h MET 253 N 0.04 0.60 -0.02 2.37 4.05 -1.10 0.22 114.93 121.09 2jbp h MET 253 Ca 0.06 -0.04 -0.01 0.00 -0.28 0.00 0.00 59.70 59.44 2jbp h MET 253 Cb 0.08 -0.14 -0.00 0.00 -0.80 0.00 0.00 31.60 30.74 2jbp h MET 253 CO -0.11 0.40 -0.03 -0.92 0.23 0.00 0.00 176.91 176.47 2jbp h TYR 254 N 0.62 0.07 -0.54 1.39 5.03 -0.96 -2.29 116.97 120.29 2jbp h TYR 254 Ca 0.41 -0.02 -0.03 0.00 2.58 0.00 0.00 58.73 61.67 2jbp h TYR 254 Cb 0.70 -0.01 -0.02 0.00 1.55 0.00 0.00 36.73 38.95 2jbp h TYR 254 CO -0.00 0.59 0.23 0.82 -1.32 0.00 0.00 178.16 178.48 2jbp h ILE 255 N -0.47 1.21 -1.04 1.81 2.04 -0.48 -1.12 117.51 119.46 2jbp h ILE 255 Ca 0.00 -0.65 0.27 0.00 1.00 0.00 0.00 64.86 65.48 2jbp h ILE 255 Cb 0.58 0.63 -0.10 0.00 -0.74 0.00 0.00 36.82 37.19 2jbp h ILE 255 CO 0.01 0.25 0.66 -0.07 0.00 0.00 0.00 178.15 179.00 2jbp h LEU 256 N 0.74 0.48 0.00 1.44 3.38 -0.55 0.20 115.31 120.99 2jbp h LEU 256 Ca 0.18 0.09 0.00 0.00 0.09 0.00 0.00 57.88 58.25 2jbp h LEU 256 Cb 0.18 0.02 0.00 0.00 0.09 0.00 0.00 40.66 40.95 2jbp h LEU 256 CO -0.02 0.08 -0.16 0.18 0.09 0.00 0.00 178.44 178.61 2jbp n LEU 257 N -4.68 0.50 0.00 1.67 4.77 -0.44 -4.52 117.00 114.31 2jbp n LEU 257 Ca 0.26 0.43 0.00 0.00 -0.03 0.00 0.00 56.01 56.67 2jbp n LEU 257 Cb 0.87 -0.34 0.00 0.00 -2.33 0.00 0.00 43.42 41.62 2jbp n LEU 257 CO 0.24 -0.07 0.01 0.00 -1.33 0.00 0.00 177.39 176.24 2jbp n GLY 259 N 0.00 1.47 3.10 0.00 0.00 0.63 -3.79 105.19 106.61 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 0.43 0.58 1.61 1.13 -1.26 -4.37 117.35 112.07 2jbp s TYR 260 Ca 0.00 -0.93 -0.16 0.00 -1.41 0.00 0.00 57.07 54.56 2jbp s TYR 260 Cb 0.00 -0.32 -0.04 0.00 -1.10 0.00 0.00 41.96 40.50 2jbp s TYR 260 CO 0.00 -0.39 1.05 -1.25 -2.51 0.00 0.00 175.55 172.45 2jbp s PRO 261 N -3.67 3.40 0.37 -3.49 0.04 -1.26 -4.14 135.00 126.26 2jbp s PRO 261 Ca 0.04 1.21 0.20 0.00 0.04 0.00 0.00 61.00 62.49 2jbp s PRO 261 Cb 0.06 -2.04 0.31 0.00 0.04 0.00 0.00 34.50 32.86 2jbp s PRO 261 CO -0.09 -0.74 1.57 -1.00 0.04 0.00 0.00 177.00 176.77 2jbp h PRO 262 N 0.58 0.00 -4.92 0.56 0.13 -1.94 -3.42 132.00 122.99 2jbp h PRO 262 Ca -0.47 0.00 -0.67 0.00 -0.87 0.00 0.00 66.00 63.99 2jbp h PRO 262 Cb 1.22 0.00 -0.31 0.00 0.13 0.00 0.00 31.00 32.04 2jbp h PRO 262 CO 0.58 0.24 -0.73 -0.06 -0.23 0.00 0.00 178.00 177.79 2jbp s PHE 263 N -3.15 3.03 0.07 1.56 2.99 -1.26 -4.64 117.98 116.58 2jbp s PHE 263 Ca 0.05 -1.36 0.01 0.00 0.00 0.00 0.00 56.93 55.63 2jbp s PHE 263 Cb 0.07 -2.08 0.01 0.00 0.00 0.00 0.00 43.02 41.02 2jbp s PHE 263 CO 0.70 -0.68 0.10 0.66 -0.00 0.00 0.00 175.22 176.00 2jbp n TYR 264 N 4.72 -3.04 -4.03 0.36 0.53 -1.26 -5.09 117.16 109.33 2jbp n TYR 264 Ca -0.17 -0.23 -0.10 0.00 -1.02 0.00 0.00 57.90 56.38 2jbp n TYR 264 Cb 0.48 -0.07 -0.11 0.00 -1.03 0.00 0.00 39.34 38.61 2jbp n TYR 264 CO 0.00 0.00 0.00 0.45 -1.02 0.00 0.00 176.86 176.29 2jbp s SER 265 N -1.43 0.51 0.10 7.72 0.15 -1.26 -4.52 113.70 114.97 2jbp s SER 265 Ca 0.07 -0.62 0.00 0.00 0.70 0.00 0.00 55.95 56.10 2jbp s SER 265 Cb -0.01 0.10 0.01 0.00 -1.71 0.00 0.00 66.02 64.41 2jbp s SER 265 CO 0.05 -0.33 0.16 -2.65 1.20 0.00 0.00 173.24 171.67 2jbp n PRO 273 N 1.23 0.00 0.11 5.44 -0.02 -1.26 -4.87 135.00 135.63 2jbp n PRO 273 Ca -0.21 0.15 0.13 0.00 -2.02 0.00 0.00 63.50 61.54 2jbp n PRO 273 Cb 0.56 -0.40 0.41 0.00 -0.02 0.00 0.00 33.50 34.05 2jbp n PRO 273 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2jbp n GLY 274 N -0.68 -1.68 0.16 -1.23 0.00 -1.26 -3.18 105.19 97.32 2jbp n GLY 274 Ca 0.00 -0.01 -0.15 0.00 0.00 0.00 0.00 46.02 45.86 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 0.46 -0.61 1.61 -1.53 -1.90 0.28 114.93 113.25 2jbp h MET 275 Ca 0.00 -0.35 0.12 0.00 -3.44 0.00 0.00 59.70 56.03 2jbp h MET 275 Cb 0.71 0.06 -0.09 0.00 -0.55 0.00 0.00 31.60 31.73 2jbp h MET 275 CO 0.00 0.97 0.07 -0.22 0.14 0.00 0.00 176.91 177.88 2jbp h LYS 276 N 0.04 0.19 -0.56 0.39 3.64 -1.89 -1.75 116.57 116.62 2jbp h LYS 276 Ca -0.02 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.35 2jbp h LYS 276 Cb 1.02 -0.04 -0.03 0.00 -0.41 0.00 0.00 32.23 32.77 2jbp h LYS 276 CO 0.08 0.12 0.35 1.15 -2.27 0.00 0.00 179.45 178.89 2jbp h THR 277 N 0.19 1.16 0.00 1.00 2.02 -1.43 -0.13 112.91 115.71 2jbp h THR 277 Ca 0.32 -0.32 -0.01 0.00 0.77 0.00 0.00 66.41 67.17 2jbp h THR 277 Cb 0.50 0.37 -0.00 0.00 -1.74 0.00 0.00 68.15 67.28 2jbp h THR 277 CO -0.46 0.16 -0.02 0.03 0.37 0.00 0.00 175.52 175.59 2jbp h ARG 278 N 0.75 0.00 0.02 6.66 3.08 -0.50 -0.37 114.38 124.03 2jbp h ARG 278 Ca 0.20 0.00 -0.26 0.00 0.07 0.00 0.00 59.98 59.99 2jbp h ARG 278 Cb -0.05 0.00 -0.03 0.00 0.08 0.00 0.00 29.97 29.97 2jbp h ARG 278 CO -0.04 0.02 -1.36 0.82 -1.07 0.00 0.00 179.97 178.35 2jbp h ILE 279 N 0.00 1.29 -0.45 2.04 2.04 -0.64 -1.36 117.51 120.43 2jbp h ILE 279 Ca -0.00 -3.04 -0.10 0.00 1.00 0.00 0.00 64.86 62.71 2jbp h ILE 279 Cb 0.50 2.68 -0.01 0.00 -0.74 0.00 0.00 36.82 39.25 2jbp h ILE 279 CO 0.00 0.77 -0.12 0.03 0.00 0.00 0.00 178.15 178.83 2jbp h ARG 280 N 0.01 0.88 0.00 2.37 3.08 -0.41 -3.30 114.38 117.01 2jbp h ARG 280 Ca -0.15 -0.34 0.00 0.00 0.07 0.00 0.00 59.98 59.55 2jbp h ARG 280 Cb 1.91 -0.05 0.00 0.00 0.08 0.00 0.00 29.97 31.91 2jbp h ARG 280 CO 0.12 0.98 -1.27 -1.33 -1.07 0.00 0.00 179.97 177.40 2jbp n MET 281 N -4.25 0.58 -2.13 0.04 2.81 -0.21 -4.94 117.12 109.02 2jbp n MET 281 Ca -0.00 0.02 0.00 0.00 -1.81 0.00 0.00 57.70 55.91 2jbp n MET 281 Cb 0.39 -1.72 0.00 0.00 -0.71 0.00 0.00 33.22 31.18 2jbp n MET 281 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2jbp n GLY 282 N 1.23 0.96 3.43 3.03 0.00 -0.61 -4.96 105.19 108.26 2jbp n GLY 282 Ca -0.01 -0.59 -0.39 0.00 0.00 0.00 0.00 46.02 45.04 2jbp n GLY 282 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 2jbp s GLN 283 N -4.25 3.24 0.14 1.61 -2.07 -0.65 -5.01 119.66 112.66 2jbp s GLN 283 Ca 0.00 -0.79 -0.16 0.00 -1.82 0.00 0.00 55.36 52.59 2jbp s GLN 283 Cb 0.00 -3.60 0.03 0.00 -1.09 0.00 0.00 33.01 28.36 2jbp s GLN 283 CO 0.00 -0.47 0.43 1.52 -1.32 0.00 0.00 175.29 175.45 2jbp s TYR 284 N 1.60 -0.18 0.43 9.60 1.13 -1.26 -4.83 117.35 123.85 2jbp s TYR 284 Ca 0.04 -0.14 0.03 0.00 -1.41 0.00 0.00 57.07 55.59 2jbp s TYR 284 Cb -0.17 0.28 -0.02 0.00 -1.10 0.00 0.00 41.96 40.95 2jbp s TYR 284 CO 0.06 -0.75 0.09 -1.21 -2.51 0.00 0.00 175.55 171.24 2jbp s GLU 285 N -3.82 1.99 -0.78 -3.49 2.02 -1.26 -5.07 118.70 108.30 2jbp s GLU 285 Ca 0.04 -2.23 0.03 0.00 0.02 0.00 0.00 54.97 52.83 2jbp s GLU 285 Cb 0.01 -0.89 0.24 0.00 0.10 0.00 0.00 34.13 33.59 2jbp s GLU 285 CO -0.10 -0.43 0.82 1.19 0.02 0.00 0.00 175.26 176.76 2jbp n PHE 286 N -1.00 3.51 -1.63 1.61 3.01 -1.26 -5.03 117.46 116.66 2jbp n PHE 286 Ca -0.09 -3.95 -0.51 0.00 1.01 0.00 0.00 57.45 53.90 2jbp n PHE 286 Cb 0.66 -0.81 -0.06 0.00 -0.01 0.00 0.00 39.48 39.26 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 1.45 1.43 -2.49 -1.08 -0.04 -1.26 -4.56 135.00 128.44 2jbp n PRO 287 Ca 0.26 0.52 -0.36 0.00 -0.04 0.00 0.00 63.50 63.87 2jbp n PRO 287 Cb 0.38 -2.21 -0.03 0.00 -0.04 0.00 0.00 33.50 31.60 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 1.34 6.54 -0.07 3.54 -0.87 -1.26 0.20 114.94 124.36 2jbp s ASN 288 Ca 0.86 2.05 -0.25 0.00 -1.57 0.00 0.00 52.86 53.96 2jbp s ASN 288 Cb -0.90 -2.58 -0.28 0.00 -0.02 0.00 0.00 41.25 37.47 2jbp s ASN 288 CO 0.48 -0.65 0.90 1.55 -2.57 0.00 0.00 177.10 176.82 2jbp h PRO 289 N 2.16 0.18 -0.85 -0.60 0.13 -2.02 -3.45 132.00 127.55 2jbp h PRO 289 Ca -0.49 -0.28 0.12 0.00 -0.87 0.00 0.00 66.00 64.48 2jbp h PRO 289 Cb 1.22 0.10 -0.13 0.00 0.13 0.00 0.00 31.00 32.32 2jbp h PRO 289 CO 0.61 1.09 -0.37 0.39 -0.23 0.00 0.00 178.00 179.48 2jbp n GLU 290 N -4.37 -0.24 0.00 0.86 4.71 -1.21 0.83 120.64 121.22 2jbp n GLU 290 Ca -0.12 1.30 0.13 0.00 -0.01 0.00 0.00 57.16 58.47 2jbp n GLU 290 Cb 0.64 -1.93 0.68 0.00 -1.01 0.00 0.00 31.44 29.81 2jbp n GLU 290 CO 0.00 0.00 0.00 0.91 0.09 0.00 0.00 177.13 178.13 2jbp n TRP 291 N -5.21 0.00 -0.18 -0.32 7.02 0.13 -4.09 117.44 114.80 2jbp n TRP 291 Ca 0.07 0.00 0.13 0.00 -1.02 0.00 0.00 57.50 56.67 2jbp n TRP 291 Cb 0.31 -0.30 0.45 0.00 -2.42 0.00 0.00 31.31 29.36 2jbp n TRP 291 CO 0.00 0.00 0.00 0.66 -2.02 0.00 0.00 177.69 176.33 2jbp h SER 292 N 0.00 0.49 -0.61 -0.99 4.64 0.24 -2.97 113.55 114.34 2jbp h SER 292 Ca 0.00 0.02 0.00 0.00 -0.47 0.00 0.00 61.79 61.34 2jbp h SER 292 Cb 0.26 -0.08 0.00 0.00 -0.31 0.00 0.00 62.40 62.28 2jbp h SER 292 CO 0.00 0.27 0.00 -0.62 -0.87 0.00 0.00 176.83 175.61 2jbp n GLU 293 N -4.50 4.33 -4.33 4.77 -0.58 -1.26 -4.95 120.64 114.12 2jbp n GLU 293 Ca 0.14 -3.04 -0.34 0.00 -0.42 0.00 0.00 57.16 53.50 2jbp n GLU 293 Cb 0.44 -2.09 -0.12 0.00 -0.57 0.00 0.00 31.44 29.10 2jbp n GLU 293 CO 0.00 0.00 0.00 0.08 -0.48 0.00 0.00 177.13 176.73 2jbp s VAL 294 N -2.32 3.95 0.28 2.62 1.01 -1.13 -5.00 120.40 119.81 2jbp s VAL 294 Ca 0.53 -0.33 -0.30 0.00 0.00 0.00 0.00 61.98 61.88 2jbp s VAL 294 Cb 0.38 -2.74 -0.13 0.00 0.00 0.00 0.00 36.38 33.88 2jbp s VAL 294 CO 0.20 0.48 1.35 -0.24 0.00 0.00 0.00 175.10 176.89 2jbp n SER 295 N 3.62 2.69 0.01 3.32 2.88 -1.26 -4.81 113.62 120.07 2jbp n SER 295 Ca -0.17 1.17 0.07 0.00 -1.33 0.00 0.00 58.87 58.60 2jbp n SER 295 Cb 0.52 -1.44 0.47 0.00 -0.75 0.00 0.00 64.21 63.01 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 3.54 0.44 -0.55 -1.46 4.57 -1.97 -1.92 114.58 117.23 2jbp h GLU 296 Ca -0.45 -0.03 0.09 0.00 -1.18 0.00 0.00 59.36 57.80 2jbp h GLU 296 Cb 1.28 -0.10 -0.07 0.00 -0.16 0.00 0.00 28.75 29.70 2jbp h GLU 296 CO 0.70 0.29 0.14 1.49 -1.18 0.00 0.00 179.01 180.45 2jbp h GLU 297 N 0.45 0.27 0.12 1.92 4.81 -2.00 -0.71 114.58 119.44 2jbp h GLU 297 Ca 0.17 -0.02 0.01 0.00 -0.13 0.00 0.00 59.36 59.39 2jbp h GLU 297 Cb 0.12 -0.06 -0.02 0.00 0.63 0.00 0.00 28.75 29.41 2jbp h GLU 297 CO -0.04 0.18 -0.18 0.28 -0.73 0.00 0.00 179.01 178.52 2jbp h VAL 298 N 0.28 0.59 -0.88 0.32 2.07 -1.70 -2.19 116.25 114.74 2jbp h VAL 298 Ca 0.28 0.00 0.06 0.00 0.82 0.00 0.00 66.70 67.87 2jbp h VAL 298 Cb 0.38 0.59 -0.06 0.00 -1.52 0.00 0.00 31.29 30.69 2jbp h VAL 298 CO -0.34 0.00 0.57 0.11 0.02 0.00 0.00 177.57 177.93 2jbp h LYS 299 N -0.36 0.96 -0.79 1.57 1.57 -1.23 0.14 116.57 118.44 2jbp h LYS 299 Ca 0.02 -0.06 0.06 0.00 -1.87 0.00 0.00 60.65 58.80 2jbp h LYS 299 Cb 0.37 -0.22 -0.05 0.00 0.08 0.00 0.00 32.23 32.41 2jbp h LYS 299 CO -0.09 0.64 0.52 1.98 -0.57 0.00 0.00 179.45 181.92 2jbp h MET 300 N 0.99 0.84 0.38 3.15 4.05 -0.56 0.10 114.93 123.88 2jbp h MET 300 Ca 0.38 -0.05 -0.02 0.00 -0.28 0.00 0.00 59.70 59.73 2jbp h MET 300 Cb 0.21 -0.19 0.00 0.00 -0.80 0.00 0.00 31.60 30.82 2jbp h MET 300 CO -0.14 0.55 -0.18 1.25 0.23 0.00 0.00 176.91 178.62 2jbp h LEU 301 N 0.86 -0.43 -1.40 3.39 5.85 -0.21 -2.56 115.31 120.81 2jbp h LEU 301 Ca 0.34 -0.14 0.29 0.00 0.84 0.00 0.00 57.88 59.21 2jbp h LEU 301 Cb 0.22 0.11 -0.10 0.00 0.37 0.00 0.00 40.66 41.27 2jbp h LEU 301 CO -0.12 -0.02 0.70 0.40 -0.34 0.00 0.00 178.44 179.06 2jbp h ILE 302 N -0.93 0.46 -0.19 4.05 2.04 -0.65 0.74 117.51 123.05 2jbp h ILE 302 Ca -0.05 -0.11 -0.10 0.00 1.00 0.00 0.00 64.86 65.59 2jbp h ILE 302 Cb 0.54 0.11 -0.01 0.00 -0.74 0.00 0.00 36.82 36.71 2jbp h ILE 302 CO 0.09 0.06 -0.33 0.03 0.00 0.00 0.00 178.15 177.99 2jbp h ARG 303 N 0.33 0.38 -0.00 2.37 3.08 -0.53 -0.75 114.38 119.27 2jbp h ARG 303 Ca 0.62 -0.16 0.00 0.00 0.07 0.00 0.00 59.98 60.51 2jbp h ARG 303 Cb 1.69 -0.01 0.00 0.00 0.08 0.00 0.00 29.97 31.72 2jbp h ARG 303 CO -0.30 0.68 -0.15 0.09 -1.07 0.00 0.00 179.97 179.21 2jbp n ASN 304 N -4.08 0.27 -0.01 7.04 4.13 0.21 -3.15 115.26 119.68 2jbp n ASN 304 Ca -0.01 -0.08 -0.22 0.00 1.68 0.00 0.00 54.58 55.96 2jbp n ASN 304 Cb 0.45 -0.17 -0.14 0.00 -1.54 0.00 0.00 39.78 38.38 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 0.19 0.35 -2.31 3.41 3.38 -0.89 -1.42 115.31 118.01 2jbp h LEU 305 Ca 0.00 -0.85 -0.07 0.00 0.09 0.00 0.00 57.88 57.05 2jbp h LEU 305 Cb 0.44 -0.11 -0.04 0.00 0.09 0.00 0.00 40.66 41.03 2jbp h LEU 305 CO 0.00 1.73 0.09 0.18 0.09 0.00 0.00 178.44 180.53 2jbp n LEU 306 N -3.78 3.48 -4.74 1.67 4.77 -0.34 -4.32 117.00 113.75 2jbp n LEU 306 Ca -0.30 -1.79 -0.42 0.00 -0.03 0.00 0.00 56.01 53.48 2jbp n LEU 306 Cb 0.95 -0.60 -0.02 0.00 -2.33 0.00 0.00 43.42 41.42 2jbp n LEU 306 CO 0.39 0.51 1.23 -0.54 -1.33 0.00 0.00 177.39 177.65 2jbp s LYS 307 N -1.62 4.16 0.29 3.23 -0.14 -1.19 -4.90 119.74 119.58 2jbp s LYS 307 Ca 0.23 2.50 0.13 0.00 -1.36 0.00 0.00 55.97 57.48 2jbp s LYS 307 Cb 0.18 -3.06 0.39 0.00 -1.68 0.00 0.00 37.83 33.66 2jbp s LYS 307 CO 0.06 -0.60 1.61 1.79 -0.76 0.00 0.00 175.35 177.44 2jbp h THR 308 N 3.54 1.24 -3.66 2.17 1.35 -1.92 -3.41 112.91 112.22 2jbp h THR 308 Ca -0.46 -2.06 -0.59 0.00 -0.55 0.00 0.00 66.41 62.75 2jbp h THR 308 Cb 1.22 2.16 -0.10 0.00 -1.73 0.00 0.00 68.15 69.70 2jbp h THR 308 CO 0.83 0.55 0.66 -0.70 -0.25 0.00 0.00 175.52 176.61 2jbp s GLU 309 N -3.47 3.60 0.33 4.72 2.56 -1.26 -4.92 118.70 120.27 2jbp s GLU 309 Ca -0.00 0.29 0.11 0.00 0.00 0.00 0.00 54.97 55.37 2jbp s GLU 309 Cb 0.11 -3.91 0.95 0.00 2.00 0.00 0.00 34.13 33.29 2jbp s GLU 309 CO 0.74 -1.23 1.71 -1.35 -0.56 0.00 0.00 175.26 174.57 2jbp h PRO 310 N 9.05 0.49 0.00 4.30 0.11 -1.98 0.41 132.00 144.38 2jbp h PRO 310 Ca -0.24 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.84 2jbp h PRO 310 Cb 1.07 -0.11 0.00 0.00 0.11 0.00 0.00 31.00 32.07 2jbp h PRO 310 CO 1.04 0.32 0.00 0.00 -0.21 0.00 0.00 178.00 179.16 2jbp h THR 311 N 0.50 0.00 0.00 -1.15 1.03 -1.94 -2.37 112.91 108.98 2jbp h THR 311 Ca 0.67 -0.77 -0.06 0.00 -0.01 0.00 0.00 66.41 66.25 2jbp h THR 311 Cb 1.37 1.76 -0.01 0.00 -1.07 0.00 0.00 68.15 70.20 2jbp h THR 311 CO -0.51 0.00 -0.27 -0.61 -0.01 0.00 0.00 175.52 174.13 2jbp h GLN 312 N 0.00 0.00 -6.90 0.00 4.15 -0.57 -3.46 115.11 108.32 2jbp h GLN 312 Ca 0.00 0.00 -0.52 0.00 0.77 0.00 0.00 58.65 58.90 2jbp h GLN 312 Cb 0.88 0.00 0.06 0.00 0.21 0.00 0.00 27.48 28.63 2jbp h GLN 312 CO 0.00 0.27 0.60 0.50 -1.93 0.00 0.00 178.83 178.26 2jbp s ARG 313 N -3.26 4.21 0.72 1.69 3.52 -0.89 -4.98 118.95 119.95 2jbp s ARG 313 Ca 0.04 2.10 -0.16 0.00 -0.13 0.00 0.00 55.73 57.58 2jbp s ARG 313 Cb 0.08 -2.92 -0.00 0.00 -1.56 0.00 0.00 34.95 30.54 2jbp s ARG 313 CO 0.68 -0.27 0.89 -0.12 -0.81 0.00 0.00 175.30 175.67 2jbp n MET 314 N 0.51 0.48 -4.02 5.12 0.00 -0.53 -5.01 117.12 113.67 2jbp n MET 314 Ca 0.02 0.22 -0.27 0.00 -0.00 0.00 0.00 57.70 57.66 2jbp n MET 314 Cb 0.43 -2.15 -0.05 0.00 0.00 0.00 0.00 33.22 31.46 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 -1.82 4.84 0.53 1.12 -4.23 -1.26 -4.89 115.64 109.92 2jbp s THR 315 Ca 0.72 -0.84 0.30 0.00 -1.18 0.00 0.00 61.69 60.69 2jbp s THR 315 Cb -0.35 -3.44 0.46 0.00 1.34 0.00 0.00 72.50 70.51 2jbp s THR 315 CO 0.52 -0.04 1.90 -0.29 -0.54 0.00 0.00 174.62 176.17 2jbp h ILE 316 N 2.02 0.59 -0.17 2.99 6.09 -1.96 -0.66 117.51 126.41 2jbp h ILE 316 Ca -0.47 -0.01 -0.16 0.00 -1.37 0.00 0.00 64.86 62.85 2jbp h ILE 316 Cb 1.19 0.56 0.00 0.00 0.47 0.00 0.00 36.82 39.04 2jbp h ILE 316 CO 0.67 0.00 -0.52 0.74 -3.07 0.00 0.00 178.15 175.97 2jbp h THR 317 N 0.03 1.32 -0.19 2.19 2.02 -1.98 -1.92 112.91 114.39 2jbp h THR 317 Ca 0.40 -1.77 -0.01 0.00 0.77 0.00 0.00 66.41 65.79 2jbp h THR 317 Cb 1.57 1.97 -0.01 0.00 -1.74 0.00 0.00 68.15 69.94 2jbp h THR 317 CO -0.02 0.55 0.05 -0.33 0.37 0.00 0.00 175.52 176.14 2jbp h GLU 318 N 0.33 0.26 -0.15 6.66 5.08 -1.54 -2.45 114.58 122.76 2jbp h GLU 318 Ca -0.02 -0.03 -0.04 0.00 -1.00 0.00 0.00 59.36 58.27 2jbp h GLU 318 Cb 1.15 -0.05 -0.00 0.00 0.50 0.00 0.00 28.75 30.34 2jbp h GLU 318 CO 0.11 0.24 -0.08 0.35 -1.00 0.00 0.00 179.01 178.63 2jbp h PHE 319 N 0.26 0.36 0.00 4.33 3.04 -1.25 0.39 116.94 124.06 2jbp h PHE 319 Ca 0.07 -0.09 0.00 0.00 3.98 0.00 0.00 57.97 61.92 2jbp h PHE 319 Cb 0.10 -0.08 0.00 0.00 2.56 0.00 0.00 35.95 38.52 2jbp h PHE 319 CO 0.00 0.64 0.00 -1.33 -2.02 0.00 0.00 178.31 175.60 2jbp n MET 320 N -4.64 0.19 -0.00 1.11 2.81 -0.73 -2.26 117.12 113.60 2jbp n MET 320 Ca -0.06 0.41 0.09 0.00 -1.81 0.00 0.00 57.70 56.33 2jbp n MET 320 Cb 0.30 -1.85 -0.12 0.00 -0.71 0.00 0.00 33.22 30.84 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 -2.21 0.80 -4.70 7.83 3.02 -0.92 -4.35 115.26 114.74 2jbp n ASN 321 Ca 0.02 -0.71 -0.41 0.00 -0.03 0.00 0.00 54.58 53.45 2jbp n ASN 321 Cb 0.23 1.22 0.01 0.00 -0.61 0.00 0.00 39.78 40.63 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 -1.63 2.17 -0.22 3.10 -0.00 0.08 -4.68 115.22 114.04 2jbp n HIS 322 Ca 0.02 0.51 -0.08 0.00 0.46 0.00 0.00 57.72 58.63 2jbp n HIS 322 Cb 0.35 -2.39 0.03 0.00 -0.12 0.00 0.00 29.99 27.86 2jbp n HIS 322 CO 0.00 0.00 0.00 -1.35 0.46 0.00 0.00 176.34 175.45 2jbp h PRO 323 N 2.21 0.99 -0.91 1.57 0.11 -1.91 0.11 132.00 134.18 2jbp h PRO 323 Ca -0.47 -0.25 0.26 0.00 0.11 0.00 0.00 66.00 65.65 2jbp h PRO 323 Cb 1.29 -0.12 -0.04 0.00 0.11 0.00 0.00 31.00 32.24 2jbp h PRO 323 CO 0.61 0.92 0.69 2.35 -0.21 0.00 0.00 178.00 182.35 2jbp h TRP 324 N 0.90 0.00 0.09 0.65 7.01 -1.90 -0.78 115.95 121.93 2jbp h TRP 324 Ca 0.19 0.00 -0.34 0.00 2.11 0.00 0.00 58.89 60.85 2jbp h TRP 324 Cb 0.39 0.00 -0.02 0.00 -2.10 0.00 0.00 29.16 27.43 2jbp h TRP 324 CO 0.03 0.00 -1.84 -0.89 -2.79 0.00 0.00 178.44 172.95 2jbp n ILE 325 N -4.15 1.72 0.00 2.65 2.08 -0.80 -4.50 119.36 116.35 2jbp n ILE 325 Ca 0.19 -0.50 0.00 0.00 0.56 0.00 0.00 62.75 63.00 2jbp n ILE 325 Cb 1.01 -1.81 0.00 0.00 -0.75 0.00 0.00 39.64 38.09 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 -3.72 0.00 -3.01 0.38 2.81 0.31 -3.92 117.12 109.97 2jbp n MET 326 Ca -0.33 0.13 -0.44 0.00 -1.81 0.00 0.00 57.70 55.25 2jbp n MET 326 Cb 0.96 -1.10 -0.03 0.00 -0.71 0.00 0.00 33.22 32.33 2jbp n MET 326 CO 0.00 0.00 0.00 -0.65 1.51 0.00 0.00 175.97 176.83 2jbp s GLN 327 N -1.41 3.38 0.00 0.03 1.11 -0.99 -4.80 119.66 116.98 2jbp s GLN 327 Ca 0.00 -1.59 0.29 0.00 0.01 0.00 0.00 55.36 54.07 2jbp s GLN 327 Cb 0.00 -4.57 1.28 0.00 -1.01 0.00 0.00 33.01 28.71 2jbp s GLN 327 CO 0.00 -1.66 1.94 -1.13 0.01 0.00 0.00 175.29 174.45 2jbp n SER 328 N 6.35 0.00 -0.04 5.90 3.41 -1.25 -3.21 113.62 124.77 2jbp n SER 328 Ca 0.09 0.35 0.03 0.00 -0.26 0.00 0.00 58.87 59.08 2jbp n SER 328 Cb 0.46 -0.45 0.38 0.00 -0.26 0.00 0.00 64.21 64.34 2jbp n SER 328 CO 0.00 0.00 0.00 0.71 -0.16 0.00 0.00 175.04 175.59 2jbp h THR 329 N 0.00 1.13 0.00 6.66 1.35 -1.93 -1.47 112.91 118.66 2jbp h THR 329 Ca 0.00 -0.30 0.00 0.00 -0.55 0.00 0.00 66.41 65.56 2jbp h THR 329 Cb 0.44 0.49 0.00 0.00 -1.73 0.00 0.00 68.15 67.35 2jbp h THR 329 CO 0.00 0.14 0.00 0.29 -0.25 0.00 0.00 175.52 175.70 2jbp n LYS 330 N -4.44 0.39 -2.91 4.72 5.02 -1.20 -4.78 118.16 114.96 2jbp n LYS 330 Ca 0.04 0.03 -0.41 0.00 -2.02 0.00 0.00 58.31 55.95 2jbp n LYS 330 Cb 0.08 -1.50 -0.04 0.00 -0.02 0.00 0.00 35.03 33.55 2jbp n LYS 330 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 2jbp s VAL 331 N -2.57 4.95 -0.12 -0.18 1.01 -0.55 -4.96 120.40 117.98 2jbp s VAL 331 Ca 0.26 1.67 -0.39 0.00 0.00 0.00 0.00 61.98 63.52 2jbp s VAL 331 Cb 0.18 -4.14 -0.16 0.00 0.00 0.00 0.00 36.38 32.26 2jbp s VAL 331 CO 0.42 0.16 1.55 -2.65 0.00 0.00 0.00 175.10 174.58 2jbp n PRO 332 N 4.26 1.10 -0.15 2.72 -0.02 -1.26 -4.60 135.00 137.06 2jbp n PRO 332 Ca 0.02 0.40 -0.02 0.00 -2.02 0.00 0.00 63.50 61.88 2jbp n PRO 332 Cb 0.50 -2.06 0.03 0.00 -0.02 0.00 0.00 33.50 31.95 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 4.05 1.21 -1.53 -0.52 1.13 -1.26 -3.15 117.38 117.30 2jbp n GLN 333 Ca 0.23 -0.37 -0.43 0.00 -1.94 0.00 0.00 57.00 54.49 2jbp n GLN 333 Cb 0.15 -1.22 0.00 0.00 0.11 0.00 0.00 30.24 29.29 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 0.26 2.06 -3.34 5.09 5.66 -1.26 -4.56 114.28 118.20 2jbp n THR 334 Ca 0.07 -0.50 -0.34 0.00 -3.05 0.00 0.00 64.05 60.23 2jbp n THR 334 Cb 0.60 -0.80 -0.06 0.00 -1.55 0.00 0.00 70.33 68.52 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 -1.68 3.95 0.34 1.09 0.02 -1.26 -0.68 135.00 136.78 2jbp s PRO 335 Ca 0.62 0.47 0.08 0.00 0.02 0.00 0.00 61.00 62.19 2jbp s PRO 335 Cb -0.63 -2.81 -0.07 0.00 0.02 0.00 0.00 34.50 31.01 2jbp s PRO 335 CO 0.58 0.40 -0.06 -0.51 -0.33 0.00 0.00 177.00 177.08 2jbp s LEU 336 N -2.29 2.67 -0.18 -5.54 1.43 -0.62 -4.87 118.68 109.29 2jbp s LEU 336 Ca 0.42 -1.23 -0.25 0.00 -1.03 0.00 0.00 54.13 52.04 2jbp s LEU 336 Cb -0.14 -0.87 -0.22 0.00 0.03 0.00 0.00 46.19 44.99 2jbp s LEU 336 CO 0.20 -0.30 0.46 0.45 0.23 0.00 0.00 176.35 177.39 2jbp h HIS 337 N 2.04 0.00 0.00 0.29 3.86 -1.87 -3.41 115.15 116.06 2jbp h HIS 337 Ca -0.42 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 58.79 2jbp h HIS 337 Cb 1.24 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.71 2jbp h HIS 337 CO 0.73 1.25 0.00 2.41 0.86 0.00 0.00 177.93 183.19 2jbp n THR 338 N -4.52 0.00 0.30 2.45 -1.04 -1.25 -0.28 114.28 109.95 2jbp n THR 338 Ca -0.22 0.00 -0.14 0.00 -2.04 0.00 0.00 64.05 61.66 2jbp n THR 338 Cb 0.58 0.00 -0.07 0.00 -1.82 0.00 0.00 70.33 69.03 2jbp n THR 338 CO 0.00 0.00 0.00 -1.28 -0.64 0.00 0.00 175.07 173.15 2jbp h SER 339 N 0.00 -0.67 -0.74 8.00 0.87 -1.88 -0.10 113.55 119.03 2jbp h SER 339 Ca 0.00 -0.02 0.14 0.00 -1.23 0.00 0.00 61.79 60.68 2jbp h SER 339 Cb 0.00 0.17 -0.14 0.00 -0.44 0.00 0.00 62.40 61.99 2jbp h SER 339 CO 0.00 -0.29 -0.25 0.03 -0.53 0.00 0.00 176.83 175.79 2jbp h ARG 340 N -1.13 -0.04 -0.23 2.24 -0.00 -0.98 -1.43 114.38 112.80 2jbp h ARG 340 Ca -0.08 0.00 -0.10 0.00 -0.50 0.00 0.00 59.98 59.30 2jbp h ARG 340 Cb 0.65 0.01 -0.01 0.00 0.00 0.00 0.00 29.97 30.62 2jbp h ARG 340 CO 0.13 -0.03 -0.28 0.28 0.00 0.00 0.00 179.97 180.07 2jbp h VAL 341 N -0.05 1.27 -0.25 2.04 2.07 -1.54 -2.14 116.25 117.65 2jbp h VAL 341 Ca 0.33 -1.31 -0.04 0.00 0.82 0.00 0.00 66.70 66.50 2jbp h VAL 341 Cb 0.56 1.41 -0.01 0.00 -1.52 0.00 0.00 31.29 31.73 2jbp h VAL 341 CO -0.78 0.41 0.00 -0.07 0.02 0.00 0.00 177.57 177.16 2jbp h LEU 342 N 0.39 0.43 0.00 2.57 4.07 0.01 -3.39 115.31 119.39 2jbp h LEU 342 Ca 0.05 -0.30 0.00 0.00 0.08 0.00 0.00 57.88 57.71 2jbp h LEU 342 Cb 0.70 -0.12 0.00 0.00 1.08 0.00 0.00 40.66 42.32 2jbp h LEU 342 CO 0.05 0.63 0.00 0.29 -1.08 0.00 0.00 178.44 178.33 2jbp n LYS 343 N -4.64 0.00 -2.24 1.13 5.02 -0.75 -2.72 118.16 113.96 2jbp n LYS 343 Ca -0.03 0.15 -0.41 0.00 -2.02 0.00 0.00 58.31 56.00 2jbp n LYS 343 Cb 0.24 -1.13 -0.03 0.00 -0.02 0.00 0.00 35.03 34.09 2jbp n LYS 343 CO 0.00 0.00 0.00 -1.83 -0.52 0.00 0.00 177.40 175.05 2jbp s GLU 344 N -1.56 3.06 0.00 1.97 -1.05 -0.89 -0.11 118.70 120.12 2jbp s GLU 344 Ca 0.00 0.55 0.00 0.00 -0.15 0.00 0.00 54.97 55.37 2jbp s GLU 344 Cb 0.00 -4.23 0.00 0.00 -0.44 0.00 0.00 34.13 29.46 2jbp s GLU 344 CO 0.00 -2.23 0.00 -3.47 0.95 0.00 0.00 175.26 170.51 2jbp n ASP 345 N 10.74 0.00 0.00 0.83 -0.08 -1.26 -4.66 116.55 122.12 2jbp n ASP 345 Ca 0.15 0.00 0.03 0.00 -1.51 0.00 0.00 54.79 53.47 2jbp n ASP 345 Cb 0.50 0.00 0.16 0.00 2.34 0.00 0.00 41.12 44.12 2jbp n ASP 345 CO 0.00 0.00 0.00 1.17 0.12 0.00 0.00 177.20 178.49 2jbp n LYS 346 N 0.00 0.08 -0.11 -0.67 3.00 0.84 -2.41 118.16 118.89 2jbp n LYS 346 Ca 0.00 0.24 -0.24 0.00 -0.00 0.00 0.00 58.31 58.31 2jbp n LYS 346 Cb 0.00 -1.50 -0.11 0.00 0.00 0.00 0.00 35.03 33.42 2jbp n LYS 346 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.40 177.79 2jbp n GLU 347 N -1.31 0.57 0.00 1.64 -0.58 -1.26 -4.24 120.64 115.46 2jbp n GLU 347 Ca 0.03 0.50 0.00 0.00 -0.42 0.00 0.00 57.16 57.27 2jbp n GLU 347 Cb 0.05 -1.69 0.00 0.00 -0.57 0.00 0.00 31.44 29.23 2jbp n GLU 347 CO 0.00 0.00 0.00 0.54 -0.48 0.00 0.00 177.13 177.19 2jbp n ARG 348 N -4.38 0.00 -2.19 3.49 1.74 -1.01 -2.80 116.66 111.50 2jbp n ARG 348 Ca -0.37 0.00 -0.31 0.00 -0.77 0.00 0.00 57.85 56.40 2jbp n ARG 348 Cb 0.73 -0.97 0.02 0.00 -1.02 0.00 0.00 32.46 31.22 2jbp n ARG 348 CO 0.00 0.00 0.00 1.87 -1.52 0.00 0.00 177.63 177.98 2jbp n TRP 349 N 0.17 3.21 0.00 -1.55 -0.00 -1.25 -5.11 117.44 112.91 2jbp n TRP 349 Ca 0.00 -2.78 0.00 0.00 -0.00 0.00 0.00 57.50 54.72 2jbp n TRP 349 Cb 0.00 -0.52 0.00 0.00 -0.00 0.00 0.00 31.31 30.79 2jbp n TRP 349 CO 0.00 0.00 0.00 -1.91 -0.00 0.00 0.00 177.69 175.78