#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jbw h PRO 9 N 0.00 0.61 -0.57 1.97 0.11 -2.03 -1.45 132.00 130.63 2jbw h PRO 9 Ca 0.00 -0.04 -0.09 0.00 0.11 0.00 0.00 66.00 65.99 2jbw h PRO 9 Cb 0.00 -0.14 -0.02 0.00 0.11 0.00 0.00 31.00 30.95 2jbw h PRO 9 CO 0.00 0.41 0.02 1.49 -0.21 0.00 0.00 178.00 179.70 2jbw h GLU 10 N 0.63 0.98 -0.06 1.05 4.57 -2.02 -3.12 114.58 116.61 2jbw h GLU 10 Ca 0.18 -0.29 -0.17 0.00 -1.18 0.00 0.00 59.36 57.91 2jbw h GLU 10 Cb -0.03 -0.10 -0.01 0.00 -0.16 0.00 0.00 28.75 28.45 2jbw h GLU 10 CO -0.04 0.95 -0.71 -0.44 -1.18 0.00 0.00 179.01 177.60 2jbw h ASP 11 N 0.90 0.35 0.00 1.04 3.32 -1.81 -1.10 116.42 119.13 2jbw h ASP 11 Ca 0.17 -0.23 0.00 0.00 0.02 0.00 0.00 57.03 56.99 2jbw h ASP 11 Cb 0.50 -0.10 0.00 0.00 0.22 0.00 0.00 39.33 39.95 2jbw h ASP 11 CO 0.02 0.94 0.00 -0.62 -1.72 0.00 0.00 179.24 177.87 2jbw n GLU 12 N -3.82 0.20 -1.59 3.56 1.02 -0.77 -3.91 120.64 115.33 2jbw n GLU 12 Ca -0.03 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.11 2jbw n GLU 12 Cb 0.69 -1.09 0.00 0.00 -0.02 0.00 0.00 31.44 31.02 2jbw n GLU 12 CO 0.00 0.00 0.00 -0.25 1.18 0.00 0.00 177.13 178.06 2jbw n ASP 14 N 0.29 0.00 -4.41 1.62 8.00 -0.42 -4.99 116.55 116.63 2jbw n ASP 14 Ca 0.00 0.00 -0.44 0.00 0.71 0.00 0.00 54.79 55.06 2jbw n ASP 14 Cb 0.04 0.00 -0.03 0.00 -0.02 0.00 0.00 41.12 41.11 2jbw n ASP 14 CO 0.00 0.00 0.00 0.21 -0.39 0.00 0.00 177.20 177.02 2jbw s ASN 15 N -1.78 6.44 0.09 -2.24 3.84 -1.25 -4.91 114.94 115.13 2jbw s ASN 15 Ca 0.00 -1.78 -0.25 0.00 0.21 0.00 0.00 52.86 51.04 2jbw s ASN 15 Cb 0.00 -2.35 -0.14 0.00 -0.55 0.00 0.00 41.25 38.21 2jbw s ASN 15 CO 0.00 -1.08 1.70 -0.50 -2.79 0.00 0.00 177.10 174.43 2jbw h TRP 16 N 8.92 -0.26 -0.06 0.43 4.06 -1.94 -0.78 115.95 126.31 2jbw h TRP 16 Ca -0.06 -0.00 0.04 0.00 2.06 0.00 0.00 58.89 60.93 2jbw h TRP 16 Cb 1.05 0.10 -0.06 0.00 -1.00 0.00 0.00 29.16 29.25 2jbw h TRP 16 CO 1.02 -0.16 -0.41 0.78 -3.56 0.00 0.00 178.44 176.11 2jbw h GLY 17 N -0.25 -0.73 0.41 1.49 0.00 -1.91 -0.24 103.07 101.84 2jbw h GLY 17 Ca -0.01 0.51 0.01 0.00 0.00 0.00 0.00 47.33 47.84 2jbw h GLY 17 CO -0.00 -0.23 -0.40 -0.09 0.00 0.00 0.00 176.54 175.81 2jbw h ARG 18 N -0.53 -0.68 -0.50 4.80 2.43 -1.71 -1.22 114.38 116.96 2jbw h ARG 18 Ca 0.06 0.05 -0.03 0.00 -0.81 0.00 0.00 59.98 59.25 2jbw h ARG 18 Cb 0.63 0.15 -0.02 0.00 -0.42 0.00 0.00 29.97 30.32 2jbw h ARG 18 CO -0.35 -0.45 0.21 -0.07 -1.51 0.00 0.00 179.97 177.79 2jbw h LEU 19 N -0.71 0.69 -0.20 3.80 4.07 -1.09 -1.64 115.31 120.23 2jbw h LEU 19 Ca 0.00 -0.16 -0.03 0.00 0.08 0.00 0.00 57.88 57.77 2jbw h LEU 19 Cb 0.69 -0.18 -0.01 0.00 1.08 0.00 0.00 40.66 42.24 2jbw h LEU 19 CO -0.17 0.66 -0.00 0.40 -1.08 0.00 0.00 178.44 178.25 2jbw h ILE 20 N 0.67 1.26 -0.06 1.22 1.08 -0.89 -1.32 117.51 119.47 2jbw h ILE 20 Ca 0.17 -0.88 -0.00 0.00 -0.39 0.00 0.00 64.86 63.76 2jbw h ILE 20 Cb 0.18 1.44 -0.00 0.00 -3.07 0.00 0.00 36.82 35.37 2jbw h ILE 20 CO -0.02 0.27 0.01 -0.07 -0.69 0.00 0.00 178.15 177.66 2jbw h LEU 21 N 0.11 0.07 0.00 1.44 3.38 -1.18 -1.42 115.31 117.71 2jbw h LEU 21 Ca 0.06 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.02 2jbw h LEU 21 Cb 0.40 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 41.13 2jbw h LEU 21 CO 0.01 0.08 -0.08 0.44 0.09 0.00 0.00 178.44 178.98 2jbw h ASP 22 N 0.08 0.00 0.00 -0.43 3.32 -0.94 -3.46 116.42 114.98 2jbw h ASP 22 Ca 0.02 -0.02 0.00 0.00 0.02 0.00 0.00 57.03 57.05 2jbw h ASP 22 Cb 0.04 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.59 2jbw h ASP 22 CO -0.00 0.01 0.00 0.61 -1.72 0.00 0.00 179.24 178.14 2jbw n GLY 23 N 1.26 1.16 3.72 2.75 0.00 -0.53 -4.55 105.19 108.98 2jbw n GLY 23 Ca 0.05 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.65 2jbw n GLY 23 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2jbw s VAL 24 N -2.00 2.85 0.19 1.61 1.01 -0.56 -4.95 120.40 118.55 2jbw s VAL 24 Ca 0.00 0.63 -0.32 0.00 0.00 0.00 0.00 61.98 62.29 2jbw s VAL 24 Cb 0.00 -3.40 -0.11 0.00 0.00 0.00 0.00 36.38 32.87 2jbw s VAL 24 CO 0.00 0.06 1.68 -0.55 0.00 0.00 0.00 175.10 176.28 2jbw s SER 25 N 0.98 6.45 0.20 3.32 0.15 -1.26 -4.35 113.70 119.19 2jbw s SER 25 Ca 0.66 2.79 -0.10 0.00 0.70 0.00 0.00 55.95 60.00 2jbw s SER 25 Cb -0.41 -2.60 0.25 0.00 -1.71 0.00 0.00 66.02 61.55 2jbw s SER 25 CO 0.33 -0.93 1.77 0.22 1.20 0.00 0.00 173.24 175.83 2jbw h TYR 26 N 6.82 0.49 -0.82 3.44 3.20 -1.95 -1.31 116.97 126.83 2jbw h TYR 26 Ca -0.43 0.03 0.12 0.00 3.14 0.00 0.00 58.73 61.58 2jbw h TYR 26 Cb 1.20 -0.13 -0.08 0.00 1.54 0.00 0.00 36.73 39.26 2jbw h TYR 26 CO 0.65 0.18 0.45 0.66 -1.64 0.00 0.00 178.16 178.45 2jbw h SER 27 N 0.49 0.59 0.00 -2.11 4.64 -2.03 -1.39 113.55 113.75 2jbw h SER 27 Ca 0.29 0.07 0.00 0.00 -0.47 0.00 0.00 61.79 61.68 2jbw h SER 27 Cb 0.30 -0.04 0.00 0.00 -0.31 0.00 0.00 62.40 62.35 2jbw h SER 27 CO -0.25 0.31 0.00 0.47 -0.87 0.00 0.00 176.83 176.48 2jbw n ASP 28 N -4.81 0.51 0.00 4.97 8.00 -0.50 -2.75 116.55 121.97 2jbw n ASP 28 Ca 0.15 -0.43 0.00 0.00 0.71 0.00 0.00 54.79 55.21 2jbw n ASP 28 Cb 0.34 -0.11 0.00 0.00 -0.02 0.00 0.00 41.12 41.33 2jbw n ASP 28 CO 0.00 0.00 0.00 0.52 -0.39 0.00 0.00 177.20 177.33 2jbw n VAL 30 N 0.73 0.00 0.27 2.53 0.31 -0.52 -1.91 118.33 119.73 2jbw n VAL 30 Ca 0.00 0.00 0.15 0.00 -0.01 0.00 0.00 64.34 64.48 2jbw n VAL 30 Cb 0.09 0.00 0.73 0.00 -0.91 0.00 0.00 33.84 33.75 2jbw n VAL 30 CO 0.00 0.00 0.00 1.23 -1.32 0.00 0.00 176.83 176.74 2jbw h GLY 31 N 0.00 0.00 0.37 2.92 0.00 -1.79 0.11 103.07 104.67 2jbw h GLY 31 Ca 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 47.33 47.33 2jbw h GLY 31 CO 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 176.54 176.50 2jbw h ALA 32 N 1.92 -0.11 -0.70 3.60 0.00 -1.67 -0.60 119.26 121.71 2jbw h ALA 32 Ca -0.00 -0.27 0.06 0.00 0.00 0.00 0.00 54.91 54.70 2jbw h ALA 32 Cb 0.44 0.04 -0.06 0.00 0.00 0.00 0.00 17.79 18.21 2jbw h ALA 32 CO 0.01 -0.24 0.40 -0.09 0.00 0.00 0.00 179.25 179.33 2jbw h ARG 33 N -0.74 0.70 -0.60 0.00 2.43 -1.77 -2.73 114.38 111.67 2jbw h ARG 33 Ca -0.01 -0.04 0.00 0.00 -0.81 0.00 0.00 59.98 59.12 2jbw h ARG 33 Cb 0.58 -0.16 0.00 0.00 -0.42 0.00 0.00 29.97 29.97 2jbw h ARG 33 CO 0.02 0.47 0.00 -0.25 -1.51 0.00 0.00 179.97 178.69 2jbw n ASP 34 N -4.77 3.29 -4.67 -3.80 8.00 0.36 -4.99 116.55 109.97 2jbw n ASP 34 Ca 0.09 -2.27 -0.37 0.00 0.71 0.00 0.00 54.79 52.95 2jbw n ASP 34 Cb 0.18 -0.46 0.06 0.00 -0.02 0.00 0.00 41.12 40.89 2jbw n ASP 34 CO 0.00 0.00 0.00 -2.11 -0.39 0.00 0.00 177.20 174.70 2jbw n ARG 35 N 0.70 0.98 -1.80 -1.24 1.85 -0.23 -4.92 116.66 111.99 2jbw n ARG 35 Ca 0.17 0.39 -0.42 0.00 -1.00 0.00 0.00 57.85 56.99 2jbw n ARG 35 Cb 0.62 -2.36 -0.02 0.00 -1.05 0.00 0.00 32.46 29.64 2jbw n ARG 35 CO 0.00 0.00 0.00 -2.14 -0.01 0.00 0.00 177.63 175.48 2jbw s PRO 36 N -3.12 4.14 0.54 2.89 0.02 -1.26 -4.87 135.00 133.34 2jbw s PRO 36 Ca 0.80 2.54 0.26 0.00 0.02 0.00 0.00 61.00 64.63 2jbw s PRO 36 Cb -0.39 -3.05 1.44 0.00 0.02 0.00 0.00 34.50 32.52 2jbw s PRO 36 CO 0.43 -0.63 1.99 0.87 -0.33 0.00 0.00 177.00 179.33 2jbw h LYS 37 N 5.37 0.00 0.00 5.54 6.56 -1.99 0.63 116.57 132.68 2jbw h LYS 37 Ca -0.46 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.13 2jbw h LYS 37 Cb 1.22 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 32.88 2jbw h LYS 37 CO 0.83 0.00 0.00 -0.85 -2.06 0.00 0.00 179.45 177.37 2jbw n GLU 38 N -4.23 0.20 -3.58 3.15 0.00 -1.26 -4.62 120.64 110.30 2jbw n GLU 38 Ca 0.09 0.33 -0.37 0.00 0.00 0.00 0.00 57.16 57.21 2jbw n GLU 38 Cb 0.60 -1.82 -0.08 0.00 0.00 0.00 0.00 31.44 30.14 2jbw n GLU 38 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.13 177.55 2jbw s ILE 39 N -3.22 5.32 0.44 3.84 1.01 0.21 -5.08 121.20 123.72 2jbw s ILE 39 Ca 0.07 0.39 -0.08 0.00 0.00 0.00 0.00 60.65 61.03 2jbw s ILE 39 Cb 0.11 -3.58 -0.05 0.00 0.01 0.00 0.00 42.46 38.95 2jbw s ILE 39 CO 0.46 0.35 0.77 0.28 0.00 0.00 0.00 174.94 176.80 2jbw s THR 40 N 0.85 4.85 0.15 2.92 -1.32 -1.26 -4.77 115.64 117.07 2jbw s THR 40 Ca 0.12 0.41 -0.19 0.00 -1.21 0.00 0.00 61.69 60.82 2jbw s THR 40 Cb -0.13 -3.79 0.04 0.00 -1.51 0.00 0.00 72.50 67.11 2jbw s THR 40 CO 0.04 -0.67 1.67 -0.25 -2.21 0.00 0.00 174.62 173.20 2jbw h TRP 41 N 0.80 -0.29 -0.09 9.09 2.91 -1.96 0.11 115.95 126.52 2jbw h TRP 41 Ca -0.47 0.03 0.03 0.00 1.13 0.00 0.00 58.89 59.61 2jbw h TRP 41 Cb 1.20 0.18 -0.06 0.00 -0.51 0.00 0.00 29.16 29.96 2jbw h TRP 41 CO 0.60 -0.19 -0.54 0.35 -1.03 0.00 0.00 178.44 177.63 2jbw h PHE 42 N -0.07 -1.59 -0.28 2.65 3.57 -1.93 -2.55 116.94 116.73 2jbw h PHE 42 Ca 0.15 0.06 -0.03 0.00 3.53 0.00 0.00 57.97 61.68 2jbw h PHE 42 Cb 0.30 0.70 -0.02 0.00 2.79 0.00 0.00 35.95 39.73 2jbw h PHE 42 CO -0.32 -0.55 0.06 -0.44 -2.23 0.00 0.00 178.31 174.83 2jbw h ASP 43 N -0.61 0.37 0.41 0.41 3.32 -1.84 -2.52 116.42 115.95 2jbw h ASP 43 Ca 0.02 -0.04 -0.02 0.00 0.02 0.00 0.00 57.03 57.01 2jbw h ASP 43 Cb 0.69 -0.09 0.00 0.00 0.22 0.00 0.00 39.33 40.14 2jbw h ASP 43 CO -0.40 0.38 -0.21 0.22 -1.72 0.00 0.00 179.24 177.51 2jbw h TYR 44 N 0.40 -0.56 0.00 4.55 3.20 -0.45 -1.10 116.97 123.02 2jbw h TYR 44 Ca 0.10 -0.01 0.00 0.00 3.14 0.00 0.00 58.73 61.96 2jbw h TYR 44 Cb 0.17 0.19 0.00 0.00 1.54 0.00 0.00 36.73 38.63 2jbw h TYR 44 CO 0.00 -0.34 0.00 0.91 -1.64 0.00 0.00 178.16 177.09 2jbw n TRP 45 N -5.35 0.00 0.00 -3.82 7.02 -0.95 -2.17 117.44 112.17 2jbw n TRP 45 Ca -0.11 -0.29 0.00 0.00 -1.02 0.00 0.00 57.50 56.09 2jbw n TRP 45 Cb 0.25 -0.18 0.00 0.00 -2.42 0.00 0.00 31.31 28.96 2jbw n TRP 45 CO 0.00 0.00 0.00 0.43 -2.02 0.00 0.00 177.69 176.10 2jbw n SER 47 N 0.64 0.00 -0.04 -0.99 7.64 -0.42 -2.01 113.62 118.45 2jbw n SER 47 Ca 0.00 0.00 -0.10 0.00 1.01 0.00 0.00 58.87 59.78 2jbw n SER 47 Cb 0.30 0.00 0.04 0.00 -1.01 0.00 0.00 64.21 63.54 2jbw n SER 47 CO 0.00 0.00 0.00 -0.07 -3.01 0.00 0.00 175.04 171.96 2jbw h LEU 48 N 0.00 0.74 -1.03 -3.43 3.38 -1.69 -2.81 115.31 110.47 2jbw h LEU 48 Ca 0.00 -0.37 -0.09 0.00 0.09 0.00 0.00 57.88 57.52 2jbw h LEU 48 Cb 0.00 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 40.53 2jbw h LEU 48 CO 0.00 1.10 -0.25 0.00 0.09 0.00 0.00 178.44 179.37 2jbw h ALA 49 N 0.93 1.19 -0.11 1.53 0.00 -1.65 0.89 119.26 122.04 2jbw h ALA 49 Ca 0.03 -0.33 -0.01 0.00 0.00 0.00 0.00 54.91 54.60 2jbw h ALA 49 Cb 1.03 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 18.70 2jbw h ALA 49 CO 0.10 0.52 0.02 -0.91 0.00 0.00 0.00 179.25 178.99 2jbw h ASN 50 N 0.34 0.16 -0.20 0.00 2.35 -1.84 -1.14 115.58 115.25 2jbw h ASN 50 Ca 0.05 -0.24 0.03 0.00 -0.55 0.00 0.00 56.30 55.60 2jbw h ASN 50 Cb 0.63 -0.04 -0.03 0.00 0.05 0.00 0.00 38.32 38.93 2jbw h ASN 50 CO 0.05 0.36 -0.01 -0.08 -1.65 0.00 0.00 177.43 176.10 2jbw h GLU 51 N -0.04 0.05 -0.95 0.81 4.81 -1.21 -0.33 114.58 117.73 2jbw h GLU 51 Ca 0.03 -0.00 0.08 0.00 -0.13 0.00 0.00 59.36 59.34 2jbw h GLU 51 Cb 0.26 -0.01 -0.07 0.00 0.63 0.00 0.00 28.75 29.56 2jbw h GLU 51 CO 0.00 0.04 0.60 1.88 -0.73 0.00 0.00 179.01 180.79 2jbw h TYR 52 N 0.05 1.10 -0.42 0.92 0.05 -0.81 -1.87 116.97 116.00 2jbw h TYR 52 Ca 0.09 0.03 -0.06 0.00 0.05 0.00 0.00 58.73 58.85 2jbw h TYR 52 Cb 0.12 -0.36 -0.02 0.00 1.01 0.00 0.00 36.73 37.49 2jbw h TYR 52 CO -0.18 0.54 0.04 1.49 -1.05 0.00 0.00 178.16 179.00 2jbw h GLU 53 N 1.06 0.71 -0.24 4.88 4.81 -0.63 -2.29 114.58 122.88 2jbw h GLU 53 Ca 0.42 -0.20 0.01 0.00 -0.13 0.00 0.00 59.36 59.46 2jbw h GLU 53 Cb 0.24 -0.08 -0.02 0.00 0.63 0.00 0.00 28.75 29.52 2jbw h GLU 53 CO -0.19 0.77 0.14 1.96 -0.73 0.00 0.00 179.01 180.95 2jbw h GLN 54 N 0.56 0.28 -0.38 1.92 4.20 -0.67 -2.01 115.11 119.01 2jbw h GLN 54 Ca 0.12 -0.02 -0.02 0.00 0.06 0.00 0.00 58.65 58.80 2jbw h GLN 54 Cb 0.42 -0.06 -0.02 0.00 0.30 0.00 0.00 27.48 28.11 2jbw h GLN 54 CO 0.01 0.19 0.17 0.93 -0.67 0.00 0.00 178.83 179.45 2jbw h GLU 55 N 0.29 0.53 -0.02 1.46 4.39 -1.28 -2.12 114.58 117.84 2jbw h GLU 55 Ca 0.09 -0.06 -0.14 0.00 0.34 0.00 0.00 59.36 59.59 2jbw h GLU 55 Cb -0.01 -0.10 -0.02 0.00 -0.10 0.00 0.00 28.75 28.52 2jbw h GLU 55 CO -0.04 0.43 -0.65 0.00 -1.16 0.00 0.00 179.01 177.60 2jbw h ALA 56 N 1.65 0.88 -0.48 3.43 0.00 -1.03 -2.02 119.26 121.70 2jbw h ALA 56 Ca 0.13 -0.58 -0.12 0.00 0.00 0.00 0.00 54.91 54.34 2jbw h ALA 56 Cb 0.09 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 17.77 2jbw h ALA 56 CO -0.02 0.79 -0.18 0.93 0.00 0.00 0.00 179.25 180.77 2jbw h GLU 57 N 0.06 0.94 -0.64 0.00 5.08 -0.72 -1.83 114.58 117.47 2jbw h GLU 57 Ca -0.01 -0.37 -0.03 0.00 -1.00 0.00 0.00 59.36 57.95 2jbw h GLU 57 Cb 1.15 -0.05 -0.03 0.00 0.50 0.00 0.00 28.75 30.33 2jbw h GLU 57 CO 0.09 1.03 0.28 0.00 -1.00 0.00 0.00 179.01 179.41 2jbw h ARG 58 N 0.82 0.92 -0.18 2.33 3.08 -1.23 -1.97 114.38 118.14 2jbw h ARG 58 Ca 0.12 -0.13 -0.11 0.00 0.07 0.00 0.00 59.98 59.92 2jbw h ARG 58 Cb 0.73 -0.17 -0.00 0.00 0.08 0.00 0.00 29.97 30.62 2jbw h ARG 58 CO 0.06 0.73 -0.32 0.87 -1.07 0.00 0.00 179.97 180.24 2jbw h LYS 59 N 0.91 0.54 -0.67 0.04 1.79 -1.09 -2.51 116.57 115.58 2jbw h LYS 59 Ca 0.22 -0.33 0.05 0.00 -2.18 0.00 0.00 60.65 58.41 2jbw h LYS 59 Cb 0.14 0.04 -0.05 0.00 -1.58 0.00 0.00 32.23 30.77 2jbw h LYS 59 CO -0.02 0.94 0.39 0.28 -1.08 0.00 0.00 179.45 179.95 2jbw h VAL 60 N 0.20 1.01 0.00 0.50 2.07 -1.31 0.19 116.25 118.90 2jbw h VAL 60 Ca 0.01 -0.25 -0.00 0.00 0.82 0.00 0.00 66.70 67.28 2jbw h VAL 60 Cb 0.90 0.21 -0.00 0.00 -1.52 0.00 0.00 31.29 30.89 2jbw h VAL 60 CO 0.07 0.13 -0.02 0.00 0.02 0.00 0.00 177.57 177.78 2jbw h ALA 61 N 1.33 1.54 -0.38 1.67 0.00 -1.24 -2.73 119.26 119.45 2jbw h ALA 61 Ca 0.29 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.18 2jbw h ALA 61 Cb 0.14 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.92 2jbw h ALA 61 CO -0.16 0.02 0.00 1.28 0.00 0.00 0.00 179.25 180.39 2jbw n LEU 62 N -3.89 3.13 0.00 0.00 4.32 -0.68 -4.96 117.00 114.92 2jbw n LEU 62 Ca -0.03 -1.69 0.00 0.00 -0.02 0.00 0.00 56.01 54.27 2jbw n LEU 62 Cb 0.10 -0.25 0.00 0.00 -1.62 0.00 0.00 43.42 41.65 2jbw n LEU 62 CO 0.28 0.73 0.00 0.61 -1.22 0.00 0.00 177.39 177.79 2jbw n GLY 63 N 1.05 0.62 2.65 -0.72 0.00 -0.82 -4.95 105.19 103.02 2jbw n GLY 63 Ca 0.16 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.76 2jbw n GLY 63 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 2jbw n HIS 64 N -2.75 2.79 -0.30 1.61 8.25 0.58 -4.77 115.22 120.62 2jbw n HIS 64 Ca 0.00 -2.84 0.01 0.00 -0.26 0.00 0.00 57.72 54.63 2jbw n HIS 64 Cb 0.00 -1.99 0.20 0.00 1.12 0.00 0.00 29.99 29.33 2jbw n HIS 64 CO 0.00 0.00 0.00 -0.44 0.64 0.00 0.00 176.34 176.54 2jbw h ASP 65 N 5.24 0.97 -0.41 0.41 3.32 -1.90 -1.83 116.42 122.22 2jbw h ASP 65 Ca 0.57 -0.01 -0.14 0.00 0.02 0.00 0.00 57.03 57.46 2jbw h ASP 65 Cb 0.47 -0.23 -0.01 0.00 0.22 0.00 0.00 39.33 39.78 2jbw h ASP 65 CO 1.60 0.67 -0.29 0.25 -1.72 0.00 0.00 179.24 179.75 2jbw h LEU 66 N 1.13 0.99 -0.80 1.55 5.85 -1.86 -2.20 115.31 119.97 2jbw h LEU 66 Ca 0.35 -0.41 -0.13 0.00 0.84 0.00 0.00 57.88 58.53 2jbw h LEU 66 Cb -0.01 -0.27 -0.01 0.00 0.37 0.00 0.00 40.66 40.73 2jbw h LEU 66 CO -0.10 1.20 -0.50 0.28 -0.34 0.00 0.00 178.44 178.98 2jbw h SER 67 N 0.80 0.27 -0.77 1.25 0.02 -1.92 -3.10 113.55 110.10 2jbw h SER 67 Ca 0.09 -0.13 -0.01 0.00 -0.84 0.00 0.00 61.79 60.90 2jbw h SER 67 Cb 0.87 -0.08 -0.04 0.00 0.14 0.00 0.00 62.40 63.30 2jbw h SER 67 CO 0.08 0.73 0.45 0.00 -1.14 0.00 0.00 176.83 176.95 2jbw h ALA 68 N 1.28 0.98 -0.25 3.77 0.00 -0.86 -0.84 119.26 123.33 2jbw h ALA 68 Ca 0.01 -0.10 -0.03 0.00 0.00 0.00 0.00 54.91 54.79 2jbw h ALA 68 Cb 0.96 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 18.43 2jbw h ALA 68 CO 0.08 0.46 0.03 0.78 0.00 0.00 0.00 179.25 180.60 2jbw h GLY 69 N 1.05 0.46 1.46 0.00 0.00 -1.45 -1.69 103.07 102.90 2jbw h GLY 69 Ca 0.27 -0.31 -0.04 0.00 0.00 0.00 0.00 47.33 47.25 2jbw h GLY 69 CO -0.05 0.29 0.12 0.83 0.00 0.00 0.00 176.54 177.73 2jbw h GLU 70 N 0.22 0.68 0.03 4.80 4.39 -1.42 -2.88 114.58 120.41 2jbw h GLU 70 Ca 0.08 -0.12 -0.22 0.00 0.34 0.00 0.00 59.36 59.44 2jbw h GLU 70 Cb 0.35 -0.11 -0.01 0.00 -0.10 0.00 0.00 28.75 28.88 2jbw h GLU 70 CO 0.01 0.62 -0.99 -0.07 -1.16 0.00 0.00 179.01 177.42 2jbw h LEU 71 N 0.67 0.22 -1.98 1.33 3.38 -1.10 -0.63 115.31 117.20 2jbw h LEU 71 Ca 0.15 -0.21 0.00 0.00 0.09 0.00 0.00 57.88 57.91 2jbw h LEU 71 Cb 0.24 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 40.92 2jbw h LEU 71 CO -0.00 1.08 0.00 0.18 0.09 0.00 0.00 178.44 179.78 2jbw n LEU 72 N -3.56 1.53 0.00 1.67 4.32 -0.64 -1.19 117.00 119.13 2jbw n LEU 72 Ca -0.04 -0.76 0.00 0.00 -0.02 0.00 0.00 56.01 55.19 2jbw n LEU 72 Cb 0.89 -0.26 0.00 0.00 -1.62 0.00 0.00 43.42 42.43 2jbw n LEU 72 CO 0.49 0.26 0.00 -1.20 -1.22 0.00 0.00 177.39 175.71 2jbw n SER 74 N 0.73 0.00 0.15 -1.43 7.64 -0.24 -1.23 113.62 119.24 2jbw n SER 74 Ca 0.00 0.00 -0.14 0.00 1.01 0.00 0.00 58.87 59.74 2jbw n SER 74 Cb 0.26 0.00 -0.08 0.00 -1.01 0.00 0.00 64.21 63.38 2jbw n SER 74 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2jbw h ALA 75 N 0.00 -0.30 -0.48 -0.43 0.00 -1.43 -2.11 119.26 114.52 2jbw h ALA 75 Ca 0.00 -0.07 0.09 0.00 0.00 0.00 0.00 54.91 54.93 2jbw h ALA 75 Cb 0.00 0.12 -0.08 0.00 0.00 0.00 0.00 17.79 17.83 2jbw h ALA 75 CO 0.00 -0.66 -0.01 0.00 0.00 0.00 0.00 179.25 178.58 2jbw h ALA 76 N 0.46 0.44 -0.40 0.00 0.00 -1.45 -1.11 119.26 117.20 2jbw h ALA 76 Ca -0.03 0.14 -0.09 0.00 0.00 0.00 0.00 54.91 54.94 2jbw h ALA 76 Cb 0.24 0.25 -0.02 0.00 0.00 0.00 0.00 17.79 18.27 2jbw h ALA 76 CO 0.05 -0.39 -0.11 -0.07 0.00 0.00 0.00 179.25 178.72 2jbw h LEU 77 N 0.10 0.69 -1.03 0.00 3.38 -1.80 0.24 115.31 116.89 2jbw h LEU 77 Ca 0.24 -0.20 -0.05 0.00 0.09 0.00 0.00 57.88 57.96 2jbw h LEU 77 Cb 0.36 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 40.90 2jbw h LEU 77 CO -0.40 0.83 0.13 0.00 0.09 0.00 0.00 178.44 179.08 2jbw h ALA 79 N 1.34 -0.08 -0.61 0.00 0.00 -0.25 -1.25 119.26 118.42 2jbw h ALA 79 Ca 0.18 -0.21 0.13 0.00 0.00 0.00 0.00 54.91 55.00 2jbw h ALA 79 Cb 0.29 0.03 -0.11 0.00 0.00 0.00 0.00 17.79 18.00 2jbw h ALA 79 CO -0.00 -0.32 -0.05 0.37 0.00 0.00 0.00 179.25 179.24 2jbw h GLN 80 N -0.52 0.07 0.00 0.00 5.75 -0.46 -2.62 115.11 117.33 2jbw h GLN 80 Ca -0.01 -0.00 0.00 0.00 -0.15 0.00 0.00 58.65 58.49 2jbw h GLN 80 Cb 0.45 -0.02 0.00 0.00 1.07 0.00 0.00 27.48 28.99 2jbw h GLN 80 CO 0.01 0.05 -0.29 1.88 -2.65 0.00 0.00 178.83 177.83 2jbw h TYR 81 N 0.07 0.00 -0.54 3.99 0.05 -0.88 -0.27 116.97 119.38 2jbw h TYR 81 Ca 0.31 0.00 0.02 0.00 0.05 0.00 0.00 58.73 59.11 2jbw h TYR 81 Cb 0.50 0.00 -0.03 0.00 1.01 0.00 0.00 36.73 38.21 2jbw h TYR 81 CO -0.41 0.00 0.34 0.00 -1.05 0.00 0.00 178.16 177.04 2jbw h ALA 82 N 2.24 0.70 0.00 3.88 0.00 -1.01 -3.37 119.26 121.70 2jbw h ALA 82 Ca 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.89 2jbw h ALA 82 Cb 0.88 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 18.48 2jbw h ALA 82 CO 0.00 0.09 -0.77 0.00 0.00 0.00 0.00 179.25 178.57 2jbw n GLN 83 N -4.74 1.82 0.25 0.00 -0.00 -1.01 -4.41 117.38 109.29 2jbw n GLN 83 Ca 0.04 -0.01 0.09 0.00 -0.00 0.00 0.00 57.00 57.12 2jbw n GLN 83 Cb 0.05 -1.24 0.64 0.00 -0.00 0.00 0.00 30.24 29.69 2jbw n GLN 83 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.06 177.33 2jbw h PHE 84 N 0.00 0.00 -0.45 2.61 -0.00 -1.21 -2.61 116.94 115.27 2jbw h PHE 84 Ca 0.00 0.00 -0.33 0.00 -0.00 0.00 0.00 57.97 57.64 2jbw h PHE 84 Cb 0.38 0.00 -0.34 0.00 -0.00 0.00 0.00 35.95 35.99 2jbw h PHE 84 CO 0.00 0.08 -0.87 1.28 -0.00 0.00 0.00 178.31 178.80 2jbw n LEU 85 N -4.25 3.22 -4.60 2.10 4.77 -1.26 -4.85 117.00 112.12 2jbw n LEU 85 Ca -0.03 -3.85 -0.33 0.00 -0.03 0.00 0.00 56.01 51.77 2jbw n LEU 85 Cb 0.16 -0.11 -0.11 0.00 -2.33 0.00 0.00 43.42 41.03 2jbw n LEU 85 CO 0.33 1.53 -0.37 0.86 -1.33 0.00 0.00 177.39 178.41 2jbw s TRP 86 N -3.22 2.96 0.00 -1.77 -0.11 -0.99 -5.04 118.94 110.77 2jbw s TRP 86 Ca 0.40 0.03 0.00 0.00 1.22 0.00 0.00 56.10 57.75 2jbw s TRP 86 Cb 0.38 -1.69 0.00 0.00 -1.50 0.00 0.00 33.47 30.66 2jbw s TRP 86 CO -0.02 0.37 0.16 1.19 -4.62 0.00 0.00 176.95 174.03 2jbw n PHE 87 N 1.96 0.00 -0.57 5.86 3.72 -1.26 -4.75 117.46 122.41 2jbw n PHE 87 Ca -0.17 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.23 2jbw n PHE 87 Cb 0.53 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 39.07 2jbw n PHE 87 CO 0.00 0.00 0.00 -0.40 -0.05 0.00 0.00 176.76 176.31 2jbw n ASP 88 N -0.15 0.00 0.27 4.37 5.68 -1.26 -4.89 116.55 120.57 2jbw n ASP 88 Ca 0.00 -0.44 0.16 0.00 -0.50 0.00 0.00 54.79 54.00 2jbw n ASP 88 Cb 0.09 0.00 0.70 0.00 -1.14 0.00 0.00 41.12 40.77 2jbw n ASP 88 CO 0.00 0.00 0.00 1.05 -1.33 0.00 0.00 177.20 176.92 2jbw h GLU 89 N 0.00 0.00 0.00 0.11 9.09 -2.05 -2.29 114.58 119.44 2jbw h GLU 89 Ca 0.00 0.00 -0.03 0.00 0.05 0.00 0.00 59.36 59.38 2jbw h GLU 89 Cb 0.00 0.00 -0.00 0.00 -1.65 0.00 0.00 28.75 27.10 2jbw h GLU 89 CO 0.00 0.07 -0.13 0.00 0.05 0.00 0.00 179.01 179.00 2jbw h ARG 90 N 0.00 0.00 -0.69 1.06 -0.00 -1.98 -3.31 114.38 109.46 2jbw h ARG 90 Ca -0.00 0.00 0.15 0.00 -0.50 0.00 0.00 59.98 59.62 2jbw h ARG 90 Cb 0.49 0.00 -0.13 0.00 0.00 0.00 0.00 29.97 30.33 2jbw h ARG 90 CO 0.01 0.13 -0.11 -0.09 0.00 0.00 0.00 179.97 179.91 2jbw h ARG 91 N 0.00 0.03 -0.60 0.04 9.65 -1.70 0.41 114.38 122.21 2jbw h ARG 91 Ca -0.00 -0.00 -0.04 0.00 -1.10 0.00 0.00 59.98 58.84 2jbw h ARG 91 Cb 0.75 -0.01 -0.03 0.00 -1.39 0.00 0.00 29.97 29.29 2jbw h ARG 91 CO 0.02 0.02 0.21 -0.56 2.80 0.00 0.00 179.97 182.46 2jbw h GLN 92 N 0.03 0.88 -0.47 0.20 3.07 -1.79 -1.02 115.11 116.02 2jbw h GLN 92 Ca 0.35 -0.15 -0.09 0.00 0.09 0.00 0.00 58.65 58.85 2jbw h GLN 92 Cb 0.56 -0.15 -0.02 0.00 0.08 0.00 0.00 27.48 27.96 2jbw h GLN 92 CO -0.68 0.75 -0.05 0.87 0.09 0.00 0.00 178.83 179.81 2jbw h LYS 93 N 0.86 0.87 -0.36 0.06 6.56 -1.20 -0.81 116.57 122.55 2jbw h LYS 93 Ca 0.20 -0.30 0.04 0.00 -1.06 0.00 0.00 60.65 59.53 2jbw h LYS 93 Cb 0.21 -0.06 -0.04 0.00 -0.57 0.00 0.00 32.23 31.77 2jbw h LYS 93 CO -0.01 0.94 0.13 0.78 -2.06 0.00 0.00 179.45 179.22 2jbw h GLY 94 N 0.72 0.46 0.95 3.86 0.00 -0.68 -0.38 103.07 108.00 2jbw h GLY 94 Ca 0.13 -0.07 -0.01 0.00 0.00 0.00 0.00 47.33 47.38 2jbw h GLY 94 CO 0.03 0.03 0.14 -1.61 0.00 0.00 0.00 176.54 175.14 2jbw h GLN 95 N 0.28 0.37 -0.61 4.80 5.75 -0.97 -2.11 115.11 122.62 2jbw h GLN 95 Ca 0.16 -0.05 0.03 0.00 -0.15 0.00 0.00 58.65 58.65 2jbw h GLN 95 Cb 0.14 -0.07 -0.04 0.00 1.07 0.00 0.00 27.48 28.57 2jbw h GLN 95 CO -0.17 0.33 0.37 0.00 -2.65 0.00 0.00 178.83 176.72 2jbw h ALA 96 N 1.02 0.79 -0.23 3.38 0.00 -0.96 -1.75 119.26 121.52 2jbw h ALA 96 Ca 0.09 -0.01 0.03 0.00 0.00 0.00 0.00 54.91 55.02 2jbw h ALA 96 Cb 0.07 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 17.65 2jbw h ALA 96 CO -0.01 0.10 0.03 0.00 0.00 0.00 0.00 179.25 179.36 2jbw h ARG 97 N 0.73 0.10 -0.36 0.00 2.47 -0.78 -1.41 114.38 115.12 2jbw h ARG 97 Ca 0.25 -0.01 0.06 0.00 -1.26 0.00 0.00 59.98 59.02 2jbw h ARG 97 Cb 0.04 -0.02 -0.05 0.00 -1.65 0.00 0.00 29.97 28.28 2jbw h ARG 97 CO -0.11 0.07 0.04 -0.22 0.56 0.00 0.00 179.97 180.31 2jbw h LYS 98 N 0.11 0.14 -0.08 0.04 3.64 -1.14 -1.20 116.57 118.08 2jbw h LYS 98 Ca 0.10 -0.01 0.04 0.00 -1.27 0.00 0.00 60.65 59.51 2jbw h LYS 98 Cb 0.12 -0.03 -0.05 0.00 -0.41 0.00 0.00 32.23 31.86 2jbw h LYS 98 CO -0.16 0.09 -0.19 0.28 -2.27 0.00 0.00 179.45 177.21 2jbw h VAL 99 N 0.15 0.52 0.00 2.00 2.07 -0.90 -1.48 116.25 118.60 2jbw h VAL 99 Ca 0.18 0.00 -0.11 0.00 0.82 0.00 0.00 66.70 67.59 2jbw h VAL 99 Cb 0.23 0.52 -0.02 0.00 -1.52 0.00 0.00 31.29 30.50 2jbw h VAL 99 CO -0.26 0.00 -0.53 1.05 0.02 0.00 0.00 177.57 177.85 2jbw h GLU 100 N -0.27 0.00 -0.17 1.57 4.11 -1.10 -2.34 114.58 116.37 2jbw h GLU 100 Ca 0.08 0.00 -0.07 0.00 0.07 0.00 0.00 59.36 59.45 2jbw h GLU 100 Cb 0.39 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.63 2jbw h GLU 100 CO -0.24 0.53 -0.15 -0.07 0.07 0.00 0.00 179.01 179.15 2jbw h LEU 101 N 0.00 0.43 -1.06 3.06 3.38 -0.99 -3.13 115.31 117.00 2jbw h LEU 101 Ca -0.01 -0.47 -0.08 0.00 0.09 0.00 0.00 57.88 57.41 2jbw h LEU 101 Cb 1.01 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 41.62 2jbw h LEU 101 CO 0.07 0.81 -0.21 0.22 0.09 0.00 0.00 178.44 179.42 2jbw h TYR 102 N 0.06 0.46 -0.70 1.13 3.20 -1.16 -2.27 116.97 117.69 2jbw h TYR 102 Ca 0.03 -0.08 0.01 0.00 3.14 0.00 0.00 58.73 61.83 2jbw h TYR 102 Cb 0.68 -0.12 -0.04 0.00 1.54 0.00 0.00 36.73 38.80 2jbw h TYR 102 CO 0.08 0.60 0.46 1.96 -1.64 0.00 0.00 178.16 179.63 2jbw h GLN 103 N 0.38 0.89 -0.19 1.82 4.20 -1.42 -0.16 115.11 120.62 2jbw h GLN 103 Ca 0.06 -0.05 -0.21 0.00 0.06 0.00 0.00 58.65 58.51 2jbw h GLN 103 Cb 0.58 -0.20 0.01 0.00 0.30 0.00 0.00 27.48 28.17 2jbw h GLN 103 CO 0.04 0.59 -0.69 0.87 -0.67 0.00 0.00 178.83 178.97 2jbw h LYS 104 N 0.92 0.81 -0.69 1.46 1.57 -1.42 -3.32 116.57 115.89 2jbw h LYS 104 Ca 0.26 -0.61 -0.04 0.00 -1.87 0.00 0.00 60.65 58.39 2jbw h LYS 104 Cb -0.06 0.11 -0.03 0.00 0.08 0.00 0.00 32.23 32.33 2jbw h LYS 104 CO -0.06 1.23 0.27 0.00 -0.57 0.00 0.00 179.45 180.32 2jbw h ALA 105 N 0.58 0.89 -0.70 3.86 0.00 -0.81 -3.35 119.26 119.73 2jbw h ALA 105 Ca -0.03 -0.18 0.10 0.00 0.00 0.00 0.00 54.91 54.80 2jbw h ALA 105 Cb 1.31 -0.27 -0.07 0.00 0.00 0.00 0.00 17.79 18.76 2jbw h ALA 105 CO 0.15 0.51 0.33 0.00 0.00 0.00 0.00 179.25 180.24 2jbw h ALA 106 N 1.12 0.96 0.00 0.00 0.00 -1.15 0.24 119.26 120.43 2jbw h ALA 106 Ca 0.23 0.06 0.00 0.00 0.00 0.00 0.00 54.91 55.20 2jbw h ALA 106 Cb 0.21 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.98 2jbw h ALA 106 CO -0.02 -0.08 0.00 -1.00 0.00 0.00 0.00 179.25 178.15 2jbw h PRO 107 N 0.56 0.00 0.00 0.00 0.13 -1.73 0.12 132.00 131.08 2jbw h PRO 107 Ca 0.35 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.48 2jbw h PRO 107 Cb 0.39 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.52 2jbw h PRO 107 CO -0.28 0.00 -0.44 1.28 -0.23 0.00 0.00 178.00 178.32 2jbw n LEU 108 N -2.60 0.46 -4.73 1.56 4.77 0.04 -4.70 117.00 111.80 2jbw n LEU 108 Ca 0.02 0.12 -0.32 0.00 -0.03 0.00 0.00 56.01 55.81 2jbw n LEU 108 Cb 0.32 -0.28 0.11 0.00 -2.33 0.00 0.00 43.42 41.24 2jbw n LEU 108 CO 0.25 0.07 0.72 -0.76 -1.33 0.00 0.00 177.39 176.35 2jbw s LEU 109 N -3.24 3.09 -0.33 2.23 1.02 -1.00 -4.55 118.68 115.90 2jbw s LEU 109 Ca 0.11 2.10 0.02 0.00 0.02 0.00 0.00 54.13 56.37 2jbw s LEU 109 Cb 0.17 -4.56 0.10 0.00 0.02 0.00 0.00 46.19 41.92 2jbw s LEU 109 CO 0.68 -2.39 0.08 -0.55 0.02 0.00 0.00 176.35 174.19 2jbw s SER 110 N -2.72 4.41 0.57 2.29 0.15 -1.26 -1.57 113.70 115.57 2jbw s SER 110 Ca 0.67 -1.95 -0.15 0.00 0.70 0.00 0.00 55.95 55.23 2jbw s SER 110 Cb -0.22 -1.27 -0.05 0.00 -1.71 0.00 0.00 66.02 62.76 2jbw s SER 110 CO 0.52 -0.39 1.02 -2.16 1.20 0.00 0.00 173.24 173.43 2jbw s PRO 111 N 1.19 3.65 0.52 5.44 0.04 -1.26 -5.09 135.00 139.50 2jbw s PRO 111 Ca 0.11 0.96 -0.22 0.00 0.04 0.00 0.00 61.00 61.88 2jbw s PRO 111 Cb -0.18 -2.09 -0.06 0.00 0.04 0.00 0.00 34.50 32.21 2jbw s PRO 111 CO -0.16 -0.52 1.26 -0.35 0.04 0.00 0.00 177.00 177.27 2jbw n PRO 112 N -2.08 1.62 -3.26 0.56 -0.04 -0.61 -4.82 135.00 126.38 2jbw n PRO 112 Ca 0.07 0.59 -0.41 0.00 -0.04 0.00 0.00 63.50 63.72 2jbw n PRO 112 Cb 0.54 -2.45 -0.08 0.00 -0.04 0.00 0.00 33.50 31.47 2jbw n PRO 112 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2jbw s ALA 113 N -1.30 3.52 -0.14 0.55 0.00 0.41 -4.17 121.76 120.63 2jbw s ALA 113 Ca 0.69 -0.85 -0.10 0.00 0.00 0.00 0.00 51.96 51.70 2jbw s ALA 113 Cb -0.44 -2.94 -0.05 0.00 0.00 0.00 0.00 23.12 19.69 2jbw s ALA 113 CO 0.51 -0.99 0.19 -1.21 0.00 0.00 0.00 175.76 174.26 2jbw s GLU 114 N 2.33 3.90 -0.20 0.00 2.02 0.20 -4.21 118.70 122.74 2jbw s GLU 114 Ca 0.19 -0.07 -0.24 0.00 0.02 0.00 0.00 54.97 54.87 2jbw s GLU 114 Cb -0.16 -3.32 -0.01 0.00 0.10 0.00 0.00 34.13 30.75 2jbw s GLU 114 CO 0.12 0.50 0.80 0.50 0.02 0.00 0.00 175.26 177.20 2jbw s ARG 115 N -0.27 4.24 -0.18 1.61 3.52 -1.26 -0.39 118.95 126.22 2jbw s ARG 115 Ca 0.14 0.92 -0.01 0.00 -0.13 0.00 0.00 55.73 56.65 2jbw s ARG 115 Cb -0.12 -3.60 0.00 0.00 -1.56 0.00 0.00 34.95 29.67 2jbw s ARG 115 CO 0.03 -0.38 -0.14 -1.01 -0.81 0.00 0.00 175.30 172.98 2jbw s HIS 116 N 2.36 2.82 -0.64 5.12 3.76 0.16 -4.99 115.29 123.88 2jbw s HIS 116 Ca 0.35 -1.20 -0.15 0.00 -0.15 0.00 0.00 55.06 53.91 2jbw s HIS 116 Cb -0.16 -1.95 0.16 0.00 1.11 0.00 0.00 32.58 31.74 2jbw s HIS 116 CO 0.10 -0.59 0.59 -1.21 -0.85 0.00 0.00 174.74 172.78 2jbw s GLU 117 N 1.12 3.19 0.34 1.40 2.02 -1.26 -0.67 118.70 124.84 2jbw s GLU 117 Ca 0.01 -1.95 -0.03 0.00 0.02 0.00 0.00 54.97 53.01 2jbw s GLU 117 Cb -0.14 -4.34 -0.04 0.00 0.10 0.00 0.00 34.13 29.70 2jbw s GLU 117 CO -0.05 -1.32 0.59 -0.51 0.02 0.00 0.00 175.26 174.00 2jbw s LEU 118 N 1.14 3.97 -0.09 1.80 1.02 -1.26 -4.98 118.68 120.28 2jbw s LEU 118 Ca 0.08 0.67 -0.01 0.00 0.02 0.00 0.00 54.13 54.89 2jbw s LEU 118 Cb -0.23 -3.53 0.03 0.00 0.02 0.00 0.00 46.19 42.48 2jbw s LEU 118 CO -0.01 -0.30 -0.03 -0.69 0.02 0.00 0.00 176.35 175.35 2jbw s VAL 119 N -2.28 0.62 -0.37 -1.59 1.01 -1.26 -4.35 120.40 112.18 2jbw s VAL 119 Ca 0.43 -0.04 -0.04 0.00 0.00 0.00 0.00 61.98 62.34 2jbw s VAL 119 Cb -0.10 -0.73 0.08 0.00 0.00 0.00 0.00 36.38 35.63 2jbw s VAL 119 CO 0.34 0.29 0.15 -0.69 0.00 0.00 0.00 175.10 175.19 2jbw s VAL 120 N 1.87 3.38 -1.12 2.92 1.01 0.11 -4.72 120.40 123.86 2jbw s VAL 120 Ca 0.05 -1.70 -0.15 0.00 0.00 0.00 0.00 61.98 60.18 2jbw s VAL 120 Cb -0.12 -3.15 -0.03 0.00 0.00 0.00 0.00 36.38 33.08 2jbw s VAL 120 CO -0.06 -0.46 0.83 -0.67 0.00 0.00 0.00 175.10 174.74 2jbw n ASP 121 N 4.67 -5.58 0.00 3.32 -0.08 -1.26 -2.50 116.55 115.11 2jbw n ASP 121 Ca -0.07 -0.91 0.00 0.00 -1.51 0.00 0.00 54.79 52.30 2jbw n ASP 121 Cb 0.42 -4.03 0.00 0.00 2.34 0.00 0.00 41.12 39.86 2jbw n ASP 121 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 2jbw n GLY 122 N -1.53 2.72 3.40 0.27 0.00 -1.26 -4.99 105.19 103.81 2jbw n GLY 122 Ca -0.09 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.54 2jbw n GLY 122 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2jbw s ILE 123 N -3.05 4.41 0.81 -0.61 1.01 -1.04 -5.08 121.20 117.65 2jbw s ILE 123 Ca 0.00 -0.55 -0.12 0.00 0.00 0.00 0.00 60.65 59.98 2jbw s ILE 123 Cb 0.00 -3.28 0.19 0.00 0.01 0.00 0.00 42.46 39.37 2jbw s ILE 123 CO 0.00 0.04 0.42 -0.81 0.00 0.00 0.00 174.94 174.59 2jbw n PRO 124 N 4.95 -2.29 -3.69 2.79 -0.04 -1.26 0.09 135.00 135.55 2jbw n PRO 124 Ca -0.14 -0.70 -0.12 0.00 -0.04 0.00 0.00 63.50 62.50 2jbw n PRO 124 Cb 0.48 -1.11 -0.12 0.00 -0.04 0.00 0.00 33.50 32.71 2jbw n PRO 124 CO 0.00 0.00 0.00 -2.14 -0.04 0.00 0.00 175.50 173.32 2jbw s PRO 126 N -3.53 0.24 -0.10 0.54 0.02 -1.26 -4.81 135.00 126.09 2jbw s PRO 126 Ca 0.32 0.71 0.04 0.00 0.02 0.00 0.00 61.00 62.09 2jbw s PRO 126 Cb -0.06 -0.02 -0.00 0.00 0.02 0.00 0.00 34.50 34.44 2jbw s PRO 126 CO 0.27 -0.21 -0.22 0.08 -0.33 0.00 0.00 177.00 176.59 2jbw s VAL 127 N 1.80 2.22 -0.18 3.83 1.01 0.15 -4.37 120.40 124.87 2jbw s VAL 127 Ca -0.05 -0.97 -0.05 0.00 0.00 0.00 0.00 61.98 60.91 2jbw s VAL 127 Cb -0.11 -1.86 -0.03 0.00 0.00 0.00 0.00 36.38 34.39 2jbw s VAL 127 CO -0.10 0.56 -0.00 -0.31 0.00 0.00 0.00 175.10 175.24 2jbw s TYR 128 N 0.30 3.08 -0.08 5.22 2.02 -0.53 0.35 117.35 127.70 2jbw s TYR 128 Ca -0.16 -0.27 0.03 0.00 -0.37 0.00 0.00 57.07 56.29 2jbw s TYR 128 Cb -0.17 -2.03 0.01 0.00 -0.40 0.00 0.00 41.96 39.36 2jbw s TYR 128 CO 0.08 -0.07 -0.18 0.08 -1.57 0.00 0.00 175.55 173.89 2jbw s VAL 129 N 0.59 1.60 -0.10 0.71 1.01 0.48 -1.33 120.40 123.37 2jbw s VAL 129 Ca -0.01 -0.76 0.03 0.00 0.00 0.00 0.00 61.98 61.24 2jbw s VAL 129 Cb -0.14 -1.41 -0.01 0.00 0.00 0.00 0.00 36.38 34.82 2jbw s VAL 129 CO 0.02 0.46 -0.20 -0.13 0.00 0.00 0.00 175.10 175.25 2jbw s ARG 130 N 0.45 3.03 -0.12 2.72 0.52 -0.36 0.61 118.95 125.79 2jbw s ARG 130 Ca -0.15 -0.82 -0.01 0.00 -0.52 0.00 0.00 55.73 54.23 2jbw s ARG 130 Cb -0.16 -2.38 -0.02 0.00 0.52 0.00 0.00 34.95 32.91 2jbw s ARG 130 CO 0.06 0.25 -0.09 0.42 0.02 0.00 0.00 175.30 175.96 2jbw s ILE 131 N 0.19 3.44 1.28 1.52 -1.09 -1.26 -1.98 121.20 123.30 2jbw s ILE 131 Ca -0.12 -0.53 -0.16 0.00 -2.23 0.00 0.00 60.65 57.60 2jbw s ILE 131 Cb -0.16 -2.46 0.33 0.00 -1.58 0.00 0.00 42.46 38.59 2jbw s ILE 131 CO 0.07 0.53 0.98 -2.84 -1.23 0.00 0.00 174.94 172.44 2jbw s PRO 132 N 0.12 -1.82 0.69 2.79 0.02 -1.26 -4.70 135.00 130.84 2jbw s PRO 132 Ca -0.04 0.62 -0.11 0.00 0.02 0.00 0.00 61.00 61.49 2jbw s PRO 132 Cb -0.14 -1.47 0.00 0.00 0.02 0.00 0.00 34.50 32.92 2jbw s PRO 132 CO 0.04 -4.26 1.07 -2.00 -0.33 0.00 0.00 177.00 171.52 2jbw s GLU 133 N -4.59 2.98 2.34 5.54 2.12 -1.26 -4.93 118.70 120.90 2jbw s GLU 133 Ca 0.69 0.61 0.00 0.00 0.36 0.00 0.00 54.97 56.63 2jbw s GLU 133 Cb -0.22 -2.02 0.00 0.00 0.26 0.00 0.00 34.13 32.15 2jbw s GLU 133 CO 0.63 -0.98 0.00 0.41 -0.54 0.00 0.00 175.26 174.78 2jbw n GLY 134 N -2.73 -0.32 3.68 -1.50 0.00 -1.26 -4.90 105.19 98.16 2jbw n GLY 134 Ca 0.07 -1.02 -0.29 0.00 0.00 0.00 0.00 46.02 44.77 2jbw n GLY 134 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 2jbw s PRO 135 N 0.00 -0.26 0.00 1.61 0.02 -1.26 -5.11 135.00 130.00 2jbw s PRO 135 Ca 0.00 0.11 0.00 0.00 0.02 0.00 0.00 61.00 61.13 2jbw s PRO 135 Cb 0.00 -1.69 0.00 0.00 0.02 0.00 0.00 34.50 32.83 2jbw s PRO 135 CO 0.00 -3.11 0.00 0.41 -0.33 0.00 0.00 177.00 173.97 2jbw n GLY 136 N -1.45 5.35 3.65 0.52 0.00 -1.26 -4.92 105.19 107.09 2jbw n GLY 136 Ca 0.10 -1.42 -0.28 0.00 0.00 0.00 0.00 46.02 44.41 2jbw n GLY 136 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2jbw s PRO 137 N 1.94 0.13 -0.03 1.61 0.04 -1.26 -5.14 135.00 132.30 2jbw s PRO 137 Ca 0.00 0.50 0.05 0.00 0.04 0.00 0.00 61.00 61.60 2jbw s PRO 137 Cb 0.00 -1.70 -0.01 0.00 0.04 0.00 0.00 34.50 32.83 2jbw s PRO 137 CO 0.00 -2.93 -0.19 -1.01 0.04 0.00 0.00 177.00 172.92 2jbw s HIS 138 N -2.91 1.74 0.88 0.56 3.76 0.51 -4.78 115.29 115.05 2jbw s HIS 138 Ca 0.66 -0.41 -0.12 0.00 -0.15 0.00 0.00 55.06 55.04 2jbw s HIS 138 Cb -0.19 -1.14 0.09 0.00 1.11 0.00 0.00 32.58 32.44 2jbw s HIS 138 CO 0.58 -0.09 0.96 -2.30 -0.85 0.00 0.00 174.74 173.04 2jbw n PRO 139 N 2.84 -0.16 -4.12 8.40 -0.02 -1.26 0.08 135.00 140.76 2jbw n PRO 139 Ca -0.16 0.02 -0.15 0.00 -2.02 0.00 0.00 63.50 61.19 2jbw n PRO 139 Cb 0.53 -2.24 -0.13 0.00 -0.02 0.00 0.00 33.50 31.64 2jbw n PRO 139 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2jbw s ALA 140 N -2.36 0.53 -0.24 3.55 0.00 -0.60 0.93 121.76 123.58 2jbw s ALA 140 Ca 0.67 -0.52 -0.02 0.00 0.00 0.00 0.00 51.96 52.08 2jbw s ALA 140 Cb -0.25 -0.03 0.01 0.00 0.00 0.00 0.00 23.12 22.85 2jbw s ALA 140 CO 0.58 0.05 -0.06 0.08 0.00 0.00 0.00 175.76 176.40 2jbw s VAL 141 N -0.80 3.01 0.81 0.00 1.01 0.13 -1.82 120.40 122.75 2jbw s VAL 141 Ca -0.04 -0.83 -0.14 0.00 0.00 0.00 0.00 61.98 60.97 2jbw s VAL 141 Cb -0.06 -2.46 0.19 0.00 0.00 0.00 0.00 36.38 34.05 2jbw s VAL 141 CO 0.00 0.29 0.99 -0.38 0.00 0.00 0.00 175.10 176.01 2jbw n ILE 142 N 4.72 0.00 -3.64 2.22 5.41 -0.73 -0.60 119.36 126.73 2jbw n ILE 142 Ca -0.17 -0.67 -0.03 0.00 1.00 0.00 0.00 62.75 62.88 2jbw n ILE 142 Cb 0.49 -1.52 -0.07 0.00 -0.71 0.00 0.00 39.64 37.83 2jbw n ILE 142 CO 0.00 0.00 0.00 -0.76 0.00 0.00 0.00 176.55 175.79 2jbw s LEU 144 N 0.00 -0.52 0.00 1.39 1.43 0.20 -0.29 118.68 120.89 2jbw s LEU 144 Ca 0.58 0.84 -0.16 0.00 -1.03 0.00 0.00 54.13 54.36 2jbw s LEU 144 Cb -0.02 1.77 0.23 0.00 0.03 0.00 0.00 46.19 48.19 2jbw s LEU 144 CO 0.41 -0.13 1.13 0.61 0.23 0.00 0.00 176.35 178.60 2jbw n GLY 145 N 3.73 -1.87 0.00 -3.19 0.00 -1.26 -1.72 105.19 100.88 2jbw n GLY 145 Ca -0.19 -1.64 0.00 0.00 0.00 0.00 0.00 46.02 44.20 2jbw n GLY 145 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2jbw n GLY 146 N -3.21 5.15 0.15 -0.02 0.00 -0.74 -2.53 105.19 103.98 2jbw n GLY 146 Ca 0.15 -1.67 -0.09 0.00 0.00 0.00 0.00 46.02 44.41 2jbw n GLY 146 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 2jbw h LEU 147 N 0.00 -0.31 0.00 0.99 5.85 -1.92 -3.37 115.31 116.54 2jbw h LEU 147 Ca 0.00 0.07 0.00 0.00 0.84 0.00 0.00 57.88 58.79 2jbw h LEU 147 Cb 0.00 0.17 0.00 0.00 0.37 0.00 0.00 40.66 41.20 2jbw h LEU 147 CO 0.00 -0.13 -0.99 -0.62 -0.34 0.00 0.00 178.44 176.37 2jbw n GLU 148 N -5.25 1.96 -1.69 1.25 4.71 -1.26 -4.89 120.64 115.47 2jbw n GLU 148 Ca -0.03 0.00 -0.44 0.00 -0.01 0.00 0.00 57.16 56.68 2jbw n GLU 148 Cb 0.17 -0.99 -0.04 0.00 -1.01 0.00 0.00 31.44 29.57 2jbw n GLU 148 CO 0.00 0.00 0.00 0.43 0.09 0.00 0.00 177.13 177.65 2jbw n SER 149 N -1.72 3.53 -4.08 1.62 7.64 -1.26 -4.94 113.62 114.41 2jbw n SER 149 Ca 0.00 1.07 -0.27 0.00 1.01 0.00 0.00 58.87 60.68 2jbw n SER 149 Cb 0.24 -1.49 -0.07 0.00 -1.01 0.00 0.00 64.21 61.88 2jbw n SER 149 CO 0.00 0.00 0.00 0.35 -3.01 0.00 0.00 175.04 172.38 2jbw n THR 150 N 3.75 0.00 0.22 0.44 -2.24 -1.26 -1.79 114.28 113.40 2jbw n THR 150 Ca 0.17 -2.35 0.11 0.00 -2.27 0.00 0.00 64.05 59.71 2jbw n THR 150 Cb 0.32 0.73 0.69 0.00 -2.10 0.00 0.00 70.33 69.97 2jbw n THR 150 CO 0.00 0.00 0.00 0.07 -0.57 0.00 0.00 175.07 174.57 2jbw h LYS 151 N 0.00 0.00 0.00 -0.78 2.10 -1.95 -0.66 116.57 115.28 2jbw h LYS 151 Ca -0.34 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.31 2jbw h LYS 151 Cb 1.22 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.55 2jbw h LYS 151 CO 0.55 0.00 0.00 0.93 -2.00 0.00 0.00 179.45 178.93 2jbw h GLU 152 N 0.00 0.00 0.00 0.07 3.07 -1.96 -3.32 114.58 112.44 2jbw h GLU 152 Ca 0.05 0.00 -0.22 0.00 -0.50 0.00 0.00 59.36 58.69 2jbw h GLU 152 Cb 0.20 0.00 -0.04 0.00 -0.84 0.00 0.00 28.75 28.08 2jbw h GLU 152 CO -0.00 0.00 -1.28 1.49 -1.40 0.00 0.00 179.01 177.82 2jbw h GLU 153 N 0.00 0.00 -0.19 2.33 4.81 -1.51 -3.39 114.58 116.63 2jbw h GLU 153 Ca 0.00 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 2jbw h GLU 153 Cb 0.37 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.75 2jbw h GLU 153 CO 0.00 0.60 0.00 -1.13 -0.73 0.00 0.00 179.01 177.75 2jbw n SER 154 N -3.12 0.99 -0.33 1.04 3.41 -1.25 -4.47 113.62 109.89 2jbw n SER 154 Ca -0.08 -2.00 0.22 0.00 -0.26 0.00 0.00 58.87 56.75 2jbw n SER 154 Cb 0.93 -0.12 0.42 0.00 -0.26 0.00 0.00 64.21 65.18 2jbw n SER 154 CO 0.00 0.00 0.00 0.15 -0.16 0.00 0.00 175.04 175.03 2jbw h PHE 155 N 1.09 0.46 0.00 7.33 3.57 -1.85 0.14 116.94 127.68 2jbw h PHE 155 Ca 0.00 0.05 0.00 0.00 3.53 0.00 0.00 57.97 61.55 2jbw h PHE 155 Cb 0.25 -0.04 0.00 0.00 2.79 0.00 0.00 35.95 38.95 2jbw h PHE 155 CO 0.12 -0.38 0.00 1.04 -2.23 0.00 0.00 178.31 176.86 2jbw n GLN 156 N -5.31 0.51 0.00 1.11 1.13 -1.26 -1.79 117.38 111.78 2jbw n GLN 156 Ca 0.29 0.00 0.00 0.00 -1.94 0.00 0.00 57.00 55.35 2jbw n GLN 156 Cb 0.97 -1.25 0.00 0.00 0.11 0.00 0.00 30.24 30.07 2jbw n GLN 156 CO 0.00 0.00 0.00 0.39 -1.44 0.00 0.00 177.06 176.01 2jbw n GLU 158 N 0.34 0.00 -0.26 -1.09 1.02 0.04 -2.88 120.64 117.81 2jbw n GLU 158 Ca 0.00 0.00 0.08 0.00 -0.02 0.00 0.00 57.16 57.22 2jbw n GLU 158 Cb 0.15 0.00 0.33 0.00 -0.02 0.00 0.00 31.44 31.90 2jbw n GLU 158 CO 0.00 0.00 0.00 -0.91 1.18 0.00 0.00 177.13 177.40 2jbw h ASN 159 N 0.00 0.73 -0.48 1.62 2.35 -1.61 0.14 115.58 118.33 2jbw h ASN 159 Ca 0.00 0.02 0.03 0.00 -0.55 0.00 0.00 56.30 55.81 2jbw h ASN 159 Cb 0.00 -0.13 -0.04 0.00 0.05 0.00 0.00 38.32 38.20 2jbw h ASN 159 CO 0.00 0.43 0.25 -0.07 -1.65 0.00 0.00 177.43 176.39 2jbw h LEU 160 N 0.81 0.38 0.05 1.61 3.38 -1.82 -0.10 115.31 119.62 2jbw h LEU 160 Ca 0.40 0.02 -0.28 0.00 0.09 0.00 0.00 57.88 58.11 2jbw h LEU 160 Cb 0.44 -0.06 0.02 0.00 0.09 0.00 0.00 40.66 41.16 2jbw h LEU 160 CO -0.16 0.27 -1.18 -0.37 0.09 0.00 0.00 178.44 177.09 2jbw h VAL 161 N 0.50 1.35 -0.25 1.22 -1.51 -1.43 -2.91 116.25 113.22 2jbw h VAL 161 Ca 0.20 -2.56 -0.03 0.00 -1.23 0.00 0.00 66.70 63.09 2jbw h VAL 161 Cb 0.08 2.67 -0.01 0.00 -2.13 0.00 0.00 31.29 31.90 2jbw h VAL 161 CO -0.13 0.77 0.03 -0.07 -1.23 0.00 0.00 177.57 176.95 2jbw h LEU 162 N 0.24 0.33 -1.71 4.19 3.38 -0.82 -0.60 115.31 120.31 2jbw h LEU 162 Ca -0.15 -0.04 -0.04 0.00 0.09 0.00 0.00 57.88 57.74 2jbw h LEU 162 Cb 1.85 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 42.51 2jbw h LEU 162 CO 0.22 0.36 -0.17 0.44 0.09 0.00 0.00 178.44 179.38 2jbw h ASP 163 N 0.36 0.00 -0.54 -0.43 3.32 -1.00 -3.10 116.42 115.03 2jbw h ASP 163 Ca 0.09 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.14 2jbw h ASP 163 Cb 0.19 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.74 2jbw h ASP 163 CO 0.00 0.17 0.00 0.54 -1.72 0.00 0.00 179.24 178.23 2jbw n ARG 164 N -4.14 4.24 -1.35 3.56 1.74 -0.27 -5.09 116.66 115.34 2jbw n ARG 164 Ca -0.02 -3.02 0.00 0.00 -0.77 0.00 0.00 57.85 54.04 2jbw n ARG 164 Cb 0.25 -2.08 0.00 0.00 -1.02 0.00 0.00 32.46 29.61 2jbw n ARG 164 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2jbw n GLY 165 N 0.58 -0.42 3.63 -0.13 0.00 -0.98 -4.92 105.19 102.95 2jbw n GLY 165 Ca 0.26 -0.20 -0.23 0.00 0.00 0.00 0.00 46.02 45.85 2jbw n GLY 165 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2jbw s ALA 167 N -1.63 3.17 0.04 4.61 0.00 0.27 -4.32 121.76 123.88 2jbw s ALA 167 Ca 0.00 -1.77 0.03 0.00 0.00 0.00 0.00 51.96 50.22 2jbw s ALA 167 Cb 0.00 -0.62 -0.02 0.00 0.00 0.00 0.00 23.12 22.48 2jbw s ALA 167 CO 0.00 0.19 -0.10 0.95 0.00 0.00 0.00 175.76 176.80 2jbw s THR 168 N -2.40 0.78 -0.03 0.00 -4.23 -0.84 0.20 115.64 109.12 2jbw s THR 168 Ca 0.33 -0.91 0.01 0.00 -1.18 0.00 0.00 61.69 59.93 2jbw s THR 168 Cb -0.04 -0.75 0.02 0.00 1.34 0.00 0.00 72.50 73.07 2jbw s THR 168 CO 0.20 -0.14 -0.01 0.00 -0.54 0.00 0.00 174.62 174.13 2jbw s ALA 169 N -0.95 0.35 0.09 3.99 0.00 0.23 -1.23 121.76 124.24 2jbw s ALA 169 Ca -0.03 0.11 0.06 0.00 0.00 0.00 0.00 51.96 52.10 2jbw s ALA 169 Cb -0.08 -0.30 -0.03 0.00 0.00 0.00 0.00 23.12 22.71 2jbw s ALA 169 CO 0.01 -0.04 -0.15 0.95 0.00 0.00 0.00 175.76 176.52 2jbw s THR 170 N 0.86 1.29 0.10 0.00 -4.23 -0.44 -4.33 115.64 108.90 2jbw s THR 170 Ca -0.09 -1.49 -0.26 0.00 -1.18 0.00 0.00 61.69 58.67 2jbw s THR 170 Cb -0.12 -1.32 0.08 0.00 1.34 0.00 0.00 72.50 72.47 2jbw s THR 170 CO -0.01 -0.27 0.90 0.72 -0.54 0.00 0.00 174.62 175.42 2jbw s PHE 171 N -1.56 -0.24 -0.23 3.99 -0.71 -1.26 -1.46 117.98 116.52 2jbw s PHE 171 Ca 0.03 -0.01 -0.03 0.00 -1.04 0.00 0.00 56.93 55.88 2jbw s PHE 171 Cb -0.08 0.60 0.00 0.00 -1.21 0.00 0.00 43.02 42.33 2jbw s PHE 171 CO 0.03 -0.75 -0.05 -0.51 -1.34 0.00 0.00 175.22 172.60 2jbw s ASP 172 N -2.76 4.26 0.20 1.98 1.01 -1.26 -4.40 116.67 115.69 2jbw s ASP 172 Ca 0.09 -0.52 0.00 0.00 0.71 0.00 0.00 52.55 52.83 2jbw s ASP 172 Cb -0.01 -1.71 0.00 0.00 1.01 0.00 0.00 42.92 42.20 2jbw s ASP 172 CO -0.03 -0.05 0.01 0.61 0.21 0.00 0.00 175.17 175.93 2jbw n GLY 173 N 4.77 1.34 3.63 0.21 0.00 -1.26 -4.84 105.19 109.03 2jbw n GLY 173 Ca -0.18 -2.04 -0.49 0.00 0.00 0.00 0.00 46.02 43.31 2jbw n GLY 173 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 2jbw n PRO 174 N -1.02 1.66 -0.85 1.61 -0.02 -1.26 -1.19 135.00 133.92 2jbw n PRO 174 Ca 0.00 0.60 0.00 0.00 -2.02 0.00 0.00 63.50 62.08 2jbw n PRO 174 Cb 0.01 -2.30 0.00 0.00 -0.02 0.00 0.00 33.50 31.19 2jbw n PRO 174 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2jbw n GLY 175 N 2.94 0.96 3.43 -1.23 0.00 0.14 -4.33 105.19 107.09 2jbw n GLY 175 Ca 0.17 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.88 2jbw n GLY 175 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2jbw s GLN 176 N -0.14 2.31 2.79 1.61 -0.21 -0.33 -4.70 119.66 120.99 2jbw s GLN 176 Ca 0.00 -0.81 0.00 0.00 0.02 0.00 0.00 55.36 54.57 2jbw s GLN 176 Cb 0.00 -2.25 0.00 0.00 1.00 0.00 0.00 33.01 31.76 2jbw s GLN 176 CO 0.00 0.59 0.00 0.41 -2.12 0.00 0.00 175.29 174.17 2jbw n GLY 177 N 2.20 2.82 1.35 3.09 0.00 -1.26 -1.83 105.19 111.56 2jbw n GLY 177 Ca -0.17 0.29 0.00 0.00 0.00 0.00 0.00 46.02 46.14 2jbw n GLY 177 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2jbw n GLU 178 N 12.94 0.71 0.00 1.61 1.02 -1.26 -4.49 120.64 131.17 2jbw n GLU 178 Ca 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.14 2jbw n GLU 178 Cb 0.00 -1.15 0.00 0.00 -0.02 0.00 0.00 31.44 30.27 2jbw n GLU 178 CO 0.00 0.00 0.00 0.34 1.18 0.00 0.00 177.13 178.65 2jbw n PHE 180 N 1.19 0.00 -0.31 -0.32 7.35 -0.76 -4.64 117.46 119.96 2jbw n PHE 180 Ca 0.00 0.00 0.12 0.00 -0.76 0.00 0.00 57.45 56.81 2jbw n PHE 180 Cb 0.35 0.00 0.29 0.00 0.35 0.00 0.00 39.48 40.48 2jbw n PHE 180 CO 0.00 0.00 0.00 1.49 -0.76 0.00 0.00 176.76 177.49 2jbw h GLU 181 N 0.00 0.51 0.00 -4.13 4.81 -1.89 -3.11 114.58 110.78 2jbw h GLU 181 Ca 0.00 -0.03 -0.08 0.00 -0.13 0.00 0.00 59.36 59.11 2jbw h GLU 181 Cb 0.00 -0.12 -0.02 0.00 0.63 0.00 0.00 28.75 29.25 2jbw h GLU 181 CO 0.00 0.34 -1.81 0.66 -0.73 0.00 0.00 179.01 177.47 2jbw n TYR 182 N -4.94 0.31 -3.39 0.92 4.01 -1.26 -4.93 117.16 107.86 2jbw n TYR 182 Ca 0.21 0.09 -0.01 0.00 -0.16 0.00 0.00 57.90 58.03 2jbw n TYR 182 Cb 0.59 -0.75 -0.04 0.00 -0.31 0.00 0.00 39.34 38.83 2jbw n TYR 182 CO 0.00 0.00 0.00 0.21 -0.46 0.00 0.00 176.86 176.61 2jbw s LYS 183 N -3.24 0.50 1.09 -0.72 2.20 -1.17 -5.09 119.74 113.30 2jbw s LYS 183 Ca -0.06 1.06 -0.13 0.00 -0.36 0.00 0.00 55.97 56.47 2jbw s LYS 183 Cb 0.11 0.44 0.24 0.00 -1.51 0.00 0.00 37.83 37.11 2jbw s LYS 183 CO 0.86 -0.46 1.06 -0.98 -0.36 0.00 0.00 175.35 175.48 2jbw s ARG 184 N 2.78 -0.31 0.37 4.03 1.70 -1.26 0.26 118.95 126.52 2jbw s ARG 184 Ca 0.09 0.56 -0.25 0.00 -0.47 0.00 0.00 55.73 55.66 2jbw s ARG 184 Cb -0.14 -1.65 -0.12 0.00 -0.57 0.00 0.00 34.95 32.47 2jbw s ARG 184 CO -0.18 -3.24 0.90 1.51 -1.08 0.00 0.00 175.30 173.20 2jbw n ILE 185 N -4.54 2.14 -4.23 4.99 3.06 0.02 -3.46 119.36 117.34 2jbw n ILE 185 Ca 0.04 -0.50 -0.13 0.00 -2.50 0.00 0.00 62.75 59.66 2jbw n ILE 185 Cb 0.56 -0.94 -0.10 0.00 0.54 0.00 0.00 39.64 39.71 2jbw n ILE 185 CO 0.00 0.00 0.00 0.00 -2.50 0.00 0.00 176.55 174.05 2jbw s ALA 186 N -1.24 1.30 -2.57 1.51 0.00 -1.26 -4.88 121.76 114.62 2jbw s ALA 186 Ca 0.62 -1.65 0.25 0.00 0.00 0.00 0.00 51.96 51.17 2jbw s ALA 186 Cb -0.63 0.89 0.69 0.00 0.00 0.00 0.00 23.12 24.07 2jbw s ALA 186 CO 0.58 -0.44 1.54 0.41 0.00 0.00 0.00 175.76 177.85 2jbw n GLY 187 N -0.27 0.53 2.57 0.00 0.00 -1.26 -4.36 105.19 102.41 2jbw n GLY 187 Ca -0.03 -0.54 -0.17 0.00 0.00 0.00 0.00 46.02 45.28 2jbw n GLY 187 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2jbw n ASP 188 N 0.67 2.97 0.24 1.61 5.75 -1.26 -4.86 116.55 121.66 2jbw n ASP 188 Ca 0.17 -3.16 0.07 0.00 -0.01 0.00 0.00 54.79 51.86 2jbw n ASP 188 Cb 0.44 -0.49 0.56 0.00 -1.03 0.00 0.00 41.12 40.60 2jbw n ASP 188 CO 0.00 0.00 0.00 0.22 -0.11 0.00 0.00 177.20 177.31 2jbw h TYR 189 N 2.78 0.00 -0.70 2.11 5.03 -1.93 -2.17 116.97 122.10 2jbw h TYR 189 Ca 0.09 0.00 0.20 0.00 2.58 0.00 0.00 58.73 61.60 2jbw h TYR 189 Cb 1.08 0.00 -0.03 0.00 1.55 0.00 0.00 36.73 39.33 2jbw h TYR 189 CO 0.65 0.14 0.53 1.05 -1.32 0.00 0.00 178.16 179.21 2jbw h GLU 190 N 0.00 0.00 -0.25 1.82 9.09 -1.89 -0.05 114.58 123.30 2jbw h GLU 190 Ca -0.00 0.00 -0.00 0.00 0.05 0.00 0.00 59.36 59.41 2jbw h GLU 190 Cb 0.25 0.00 -0.01 0.00 -1.65 0.00 0.00 28.75 27.34 2jbw h GLU 190 CO 0.02 0.00 0.15 -0.22 0.05 0.00 0.00 179.01 179.01 2jbw h LYS 191 N 0.00 0.34 -0.05 1.06 3.64 -1.80 -1.93 116.57 117.83 2jbw h LYS 191 Ca 0.33 -0.03 -0.22 0.00 -1.27 0.00 0.00 60.65 59.46 2jbw h LYS 191 Cb 1.39 -0.07 0.00 0.00 -0.41 0.00 0.00 32.23 33.14 2jbw h LYS 191 CO -0.00 0.27 -0.87 1.88 -2.27 0.00 0.00 179.45 178.46 2jbw h TYR 192 N 0.32 0.73 0.06 1.91 -1.99 -1.18 -2.53 116.97 114.29 2jbw h TYR 192 Ca 0.09 -0.36 0.02 0.00 2.00 0.00 0.00 58.73 60.48 2jbw h TYR 192 Cb 0.01 -0.10 -0.03 0.00 2.00 0.00 0.00 36.73 38.62 2jbw h TYR 192 CO -0.05 1.17 -0.17 1.15 -0.00 0.00 0.00 178.16 180.26 2jbw h THR 193 N 0.32 0.60 -0.02 -2.88 2.02 -1.46 -1.74 112.91 109.75 2jbw h THR 193 Ca -0.07 0.00 0.01 0.00 0.77 0.00 0.00 66.41 67.12 2jbw h THR 193 Cb 1.49 0.60 -0.00 0.00 -1.74 0.00 0.00 68.15 68.50 2jbw h THR 193 CO 0.16 0.00 0.02 0.28 0.37 0.00 0.00 175.52 176.35 2jbw h SER 194 N -0.31 0.00 0.04 4.18 0.02 -1.28 0.21 113.55 116.40 2jbw h SER 194 Ca 0.03 0.00 -0.22 0.00 -0.84 0.00 0.00 61.79 60.76 2jbw h SER 194 Cb 0.35 0.00 0.01 0.00 0.14 0.00 0.00 62.40 62.90 2jbw h SER 194 CO -0.12 0.00 -0.82 0.00 -1.14 0.00 0.00 176.83 174.75 2jbw h ALA 195 N 1.97 0.37 -0.39 3.77 0.00 -1.05 0.27 119.26 124.20 2jbw h ALA 195 Ca 0.01 -0.63 -0.04 0.00 0.00 0.00 0.00 54.91 54.26 2jbw h ALA 195 Cb 0.06 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 17.82 2jbw h ALA 195 CO -0.00 0.72 0.10 0.28 0.00 0.00 0.00 179.25 180.35 2jbw h VAL 196 N 0.42 1.22 -0.68 0.00 2.07 0.19 -1.91 116.25 117.57 2jbw h VAL 196 Ca -0.06 -0.76 0.13 0.00 0.82 0.00 0.00 66.70 66.83 2jbw h VAL 196 Cb 1.44 0.97 -0.09 0.00 -1.52 0.00 0.00 31.29 32.09 2jbw h VAL 196 CO 0.16 0.26 0.21 0.58 0.02 0.00 0.00 177.57 178.80 2jbw h VAL 197 N 0.49 0.64 -0.30 2.57 2.07 -0.92 -2.26 116.25 118.54 2jbw h VAL 197 Ca 0.12 -0.12 0.07 0.00 0.82 0.00 0.00 66.70 67.59 2jbw h VAL 197 Cb 0.29 0.27 -0.08 0.00 -1.52 0.00 0.00 31.29 30.25 2jbw h VAL 197 CO -0.00 0.06 -0.36 0.44 0.02 0.00 0.00 177.57 177.73 2jbw h ASP 198 N 0.34 -1.18 -0.81 0.57 3.32 0.33 0.22 116.42 119.21 2jbw h ASP 198 Ca 0.36 0.19 0.07 0.00 0.02 0.00 0.00 57.03 57.67 2jbw h ASP 198 Cb 0.55 0.52 -0.06 0.00 0.22 0.00 0.00 39.33 40.56 2jbw h ASP 198 CO -0.41 -0.36 0.49 0.25 -1.72 0.00 0.00 179.24 177.49 2jbw h LEU 199 N -0.34 0.74 -0.77 1.55 5.85 -1.19 -1.37 115.31 119.79 2jbw h LEU 199 Ca 0.13 0.03 -0.09 0.00 0.84 0.00 0.00 57.88 58.79 2jbw h LEU 199 Cb 0.56 -0.12 -0.02 0.00 0.37 0.00 0.00 40.66 41.45 2jbw h LEU 199 CO -0.49 0.46 -0.05 -0.07 -0.34 0.00 0.00 178.44 177.96 2jbw h LEU 200 N 0.87 0.87 -1.45 2.25 3.38 -0.70 0.33 115.31 120.86 2jbw h LEU 200 Ca 0.37 -0.24 -0.03 0.00 0.09 0.00 0.00 57.88 58.06 2jbw h LEU 200 Cb 0.22 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 40.73 2jbw h LEU 200 CO -0.19 0.96 0.03 0.74 0.09 0.00 0.00 178.44 180.06 2jbw h THR 201 N 0.81 1.15 0.26 0.22 2.02 0.00 -3.09 112.91 114.28 2jbw h THR 201 Ca 0.14 -0.55 -0.34 0.00 0.77 0.00 0.00 66.41 66.43 2jbw h THR 201 Cb 0.55 0.92 0.04 0.00 -1.74 0.00 0.00 68.15 67.91 2jbw h THR 201 CO 0.03 0.19 -1.49 0.50 0.37 0.00 0.00 175.52 175.13 2jbw h LYS 202 N 0.38 0.54 -6.44 6.66 3.64 -0.59 -3.46 116.57 117.31 2jbw h LYS 202 Ca 0.09 -0.93 -0.54 0.00 -1.27 0.00 0.00 60.65 58.00 2jbw h LYS 202 Cb 0.21 0.35 0.00 0.00 -0.41 0.00 0.00 32.23 32.38 2jbw h LYS 202 CO 0.00 1.44 0.74 -0.51 -2.27 0.00 0.00 179.45 178.86 2jbw s LEU 203 N -7.59 4.34 0.44 5.20 1.43 0.04 -4.92 118.68 117.63 2jbw s LEU 203 Ca -0.09 2.13 0.26 0.00 -1.03 0.00 0.00 54.13 55.40 2jbw s LEU 203 Cb 0.04 -3.57 0.71 0.00 0.03 0.00 0.00 46.19 43.40 2jbw s LEU 203 CO 0.95 -0.64 1.74 1.05 0.23 0.00 0.00 176.35 179.67 2jbw h GLU 204 N 7.34 0.00 0.00 1.70 9.09 -1.88 -3.06 114.58 127.77 2jbw h GLU 204 Ca -0.39 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.02 2jbw h GLU 204 Cb 1.19 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 28.29 2jbw h GLU 204 CO 0.87 0.00 0.00 0.00 0.05 0.00 0.00 179.01 179.93 2jbw n ALA 205 N -2.06 2.47 -2.33 1.06 0.00 -1.26 -4.71 120.51 113.68 2jbw n ALA 205 Ca 0.03 -0.16 -0.30 0.00 0.00 0.00 0.00 53.44 53.00 2jbw n ALA 205 Cb 0.44 -1.43 -0.15 0.00 0.00 0.00 0.00 19.45 18.31 2jbw n ALA 205 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 2jbw s ILE 206 N -2.04 2.06 -0.44 0.00 1.01 -1.16 -0.36 121.20 120.28 2jbw s ILE 206 Ca 0.39 -1.22 -0.29 0.00 0.00 0.00 0.00 60.65 59.52 2jbw s ILE 206 Cb 0.18 -1.74 0.02 0.00 0.01 0.00 0.00 42.46 40.94 2jbw s ILE 206 CO 0.31 0.48 1.19 -0.13 0.00 0.00 0.00 174.94 176.79 2jbw s ARG 207 N -0.89 3.75 0.52 2.79 0.52 0.11 -4.74 118.95 121.01 2jbw s ARG 207 Ca 0.11 0.73 0.18 0.00 -0.52 0.00 0.00 55.73 56.23 2jbw s ARG 207 Cb -0.10 -3.91 1.30 0.00 0.52 0.00 0.00 34.95 32.76 2jbw s ARG 207 CO 0.00 -1.34 2.11 -0.91 0.02 0.00 0.00 175.30 175.18 2jbw h ASN 208 N 9.35 0.01 -0.62 0.23 2.35 -1.90 0.34 115.58 125.34 2jbw h ASN 208 Ca -0.24 -0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.51 2jbw h ASN 208 Cb 1.07 -0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.44 2jbw h ASN 208 CO 1.10 0.00 0.00 -0.90 -1.65 0.00 0.00 177.43 175.99 2jbw n ASP 209 N -4.50 5.33 -2.63 5.81 5.75 -1.26 -4.39 116.55 120.65 2jbw n ASP 209 Ca 0.00 -2.71 -0.17 0.00 -0.01 0.00 0.00 54.79 51.90 2jbw n ASP 209 Cb 0.22 -0.64 0.01 0.00 -1.03 0.00 0.00 41.12 39.68 2jbw n ASP 209 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2jbw n ALA 210 N 0.88 4.02 -3.94 2.12 0.00 0.12 -4.77 120.51 118.94 2jbw n ALA 210 Ca 0.27 -3.66 -0.33 0.00 0.00 0.00 0.00 53.44 49.71 2jbw n ALA 210 Cb 1.06 -0.78 -0.15 0.00 0.00 0.00 0.00 19.45 19.59 2jbw n ALA 210 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 2jbw s ILE 211 N -4.06 2.43 0.45 0.00 1.01 -1.25 -1.55 121.20 118.23 2jbw s ILE 211 Ca 0.37 -1.31 0.08 0.00 0.00 0.00 0.00 60.65 59.79 2jbw s ILE 211 Cb 0.42 -2.29 0.02 0.00 0.01 0.00 0.00 42.46 40.62 2jbw s ILE 211 CO -0.06 0.13 0.55 -0.83 0.00 0.00 0.00 174.94 174.73 2jbw s GLY 212 N 1.21 1.99 -0.07 6.18 0.00 -0.75 -0.25 107.32 115.63 2jbw s GLY 212 Ca -0.03 -1.79 0.04 0.00 0.00 0.00 0.00 44.72 42.93 2jbw s GLY 212 CO -0.06 -1.61 -0.18 0.54 0.00 0.00 0.00 173.10 171.79 2jbw s VAL 213 N -2.47 1.56 -0.26 1.40 0.11 -0.60 -1.77 120.40 118.36 2jbw s VAL 213 Ca 0.53 -0.75 0.02 0.00 -2.93 0.00 0.00 61.98 58.85 2jbw s VAL 213 Cb -0.07 -1.37 0.06 0.00 -1.53 0.00 0.00 36.38 33.47 2jbw s VAL 213 CO 0.32 0.45 -0.10 -0.22 -3.33 0.00 0.00 175.10 172.22 2jbw s LEU 214 N 0.36 3.46 -0.20 2.54 0.20 0.61 -0.47 118.68 125.18 2jbw s LEU 214 Ca -0.13 -1.34 -0.08 0.00 0.69 0.00 0.00 54.13 53.27 2jbw s LEU 214 Cb -0.15 -1.57 -0.04 0.00 -0.43 0.00 0.00 46.19 43.99 2jbw s LEU 214 CO 0.05 -0.19 0.08 -0.83 -0.29 0.00 0.00 176.35 175.17 2jbw s GLY 215 N 1.14 1.90 -0.26 7.98 0.00 -0.49 -0.62 107.32 116.97 2jbw s GLY 215 Ca -0.08 -0.84 -0.11 0.00 0.00 0.00 0.00 44.72 43.69 2jbw s GLY 215 CO -0.05 0.20 0.21 -1.60 0.00 0.00 0.00 173.10 171.86 2jbw s ARG 216 N 0.71 4.02 7.95 2.90 3.52 -0.70 -1.03 118.95 136.32 2jbw s ARG 216 Ca 0.04 -0.23 0.00 0.00 -0.13 0.00 0.00 55.73 55.41 2jbw s ARG 216 Cb -0.13 -3.60 0.00 0.00 -1.56 0.00 0.00 34.95 29.66 2jbw s ARG 216 CO 0.02 -0.08 0.00 -1.13 -0.81 0.00 0.00 175.30 173.30 2jbw n SER 217 N 4.71 0.00 -0.17 -2.12 3.41 0.17 -0.22 113.62 119.40 2jbw n SER 217 Ca -0.14 0.00 0.24 0.00 -0.26 0.00 0.00 58.87 58.71 2jbw n SER 217 Cb 0.52 0.00 0.64 0.00 -0.26 0.00 0.00 64.21 65.11 2jbw n SER 217 CO 0.00 0.00 0.00 0.25 -0.16 0.00 0.00 175.04 175.13 2jbw h LEU 218 N 0.00 0.14 -1.93 1.04 5.85 -1.86 0.26 115.31 118.81 2jbw h LEU 218 Ca 0.00 0.01 0.12 0.00 0.84 0.00 0.00 57.88 58.85 2jbw h LEU 218 Cb 0.00 -0.01 -0.02 0.00 0.37 0.00 0.00 40.66 41.00 2jbw h LEU 218 CO 0.00 0.06 0.32 1.23 -0.34 0.00 0.00 178.44 179.71 2jbw h GLY 219 N 0.14 0.11 1.04 3.75 0.00 -0.31 -1.82 103.07 105.99 2jbw h GLY 219 Ca 0.41 -0.03 -0.08 0.00 0.00 0.00 0.00 47.33 47.63 2jbw h GLY 219 CO -0.06 0.02 0.08 -1.33 0.00 0.00 0.00 176.54 175.24 2jbw h GLY 220 N 0.07 1.09 0.93 4.60 0.00 -0.29 0.11 103.07 109.59 2jbw h GLY 220 Ca 0.21 -0.74 0.02 0.00 0.00 0.00 0.00 47.33 46.82 2jbw h GLY 220 CO -0.02 0.68 0.33 -0.57 0.00 0.00 0.00 176.54 176.96 2jbw h ASN 221 N 0.91 0.54 -0.94 0.19 -0.73 -1.40 -1.46 115.58 112.70 2jbw h ASN 221 Ca 0.18 -0.00 -0.01 0.00 1.87 0.00 0.00 56.30 58.34 2jbw h ASN 221 Cb 0.45 -0.12 -0.05 0.00 0.27 0.00 0.00 38.32 38.87 2jbw h ASN 221 CO 0.02 0.39 0.56 1.88 -0.37 0.00 0.00 177.43 179.90 2jbw h TYR 222 N 0.66 1.25 -0.64 0.67 0.05 -1.22 -1.43 116.97 116.31 2jbw h TYR 222 Ca 0.20 -0.01 -0.05 0.00 0.05 0.00 0.00 58.73 58.92 2jbw h TYR 222 Cb -0.02 -0.41 -0.03 0.00 1.01 0.00 0.00 36.73 37.28 2jbw h TYR 222 CO -0.05 0.84 0.18 0.00 -1.05 0.00 0.00 178.16 178.08 2jbw h ALA 223 N 1.31 1.11 -0.21 3.88 0.00 -0.42 -0.36 119.26 124.57 2jbw h ALA 223 Ca 0.34 -0.21 -0.19 0.00 0.00 0.00 0.00 54.91 54.85 2jbw h ALA 223 Cb -0.04 -0.25 -0.00 0.00 0.00 0.00 0.00 17.79 17.50 2jbw h ALA 223 CO -0.06 0.60 -0.62 -0.07 0.00 0.00 0.00 179.25 179.11 2jbw h LEU 224 N 0.95 0.80 -0.49 0.00 3.38 -1.10 -2.31 115.31 116.55 2jbw h LEU 224 Ca 0.21 -0.46 -0.02 0.00 0.09 0.00 0.00 57.88 57.70 2jbw h LEU 224 Cb 0.30 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 40.79 2jbw h LEU 224 CO -0.00 1.23 0.24 0.50 0.09 0.00 0.00 178.44 180.49 2jbw h LYS 225 N 0.53 0.70 -0.08 1.13 1.63 -1.06 -2.72 116.57 116.70 2jbw h LYS 225 Ca -0.01 -0.10 -0.02 0.00 -0.85 0.00 0.00 60.65 59.67 2jbw h LYS 225 Cb 1.21 -0.13 -0.00 0.00 -0.60 0.00 0.00 32.23 32.70 2jbw h LYS 225 CO 0.12 0.58 -0.02 0.77 -3.45 0.00 0.00 179.45 177.46 2jbw h SER 226 N 0.65 0.16 -0.66 4.20 0.02 -1.04 -2.49 113.55 114.39 2jbw h SER 226 Ca 0.17 -0.37 0.09 0.00 -0.84 0.00 0.00 61.79 60.84 2jbw h SER 226 Cb 0.11 -0.04 -0.04 0.00 0.14 0.00 0.00 62.40 62.56 2jbw h SER 226 CO -0.02 0.50 0.44 0.00 -1.14 0.00 0.00 176.83 176.60 2jbw h ALA 227 N 0.67 1.90 0.00 3.77 0.00 -1.44 0.43 119.26 124.59 2jbw h ALA 227 Ca 0.02 -0.01 -0.04 0.00 0.00 0.00 0.00 54.91 54.88 2jbw h ALA 227 Cb 0.43 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.09 2jbw h ALA 227 CO 0.01 -0.04 -0.19 0.00 0.00 0.00 0.00 179.25 179.03 2jbw h ALA 228 N 1.66 0.90 -0.01 0.00 0.00 -1.34 -3.22 119.26 117.25 2jbw h ALA 228 Ca 0.30 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 55.04 2jbw h ALA 228 Cb 0.47 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.22 2jbw h ALA 228 CO -0.09 0.24 -0.18 0.00 0.00 0.00 0.00 179.25 179.21 2jbw s GLU 230 N -1.53 1.00 0.41 0.00 2.56 0.14 -4.99 118.70 116.29 2jbw s GLU 230 Ca 0.13 -1.45 0.29 0.00 0.00 0.00 0.00 54.97 53.95 2jbw s GLU 230 Cb 0.11 -2.33 1.36 0.00 2.00 0.00 0.00 34.13 35.28 2jbw s GLU 230 CO 0.29 -1.01 1.87 -1.35 -0.56 0.00 0.00 175.26 174.49 2jbw h PRO 231 N 7.70 0.00 0.00 4.30 0.11 -1.87 -2.60 132.00 139.64 2jbw h PRO 231 Ca -0.09 0.00 -0.06 0.00 0.11 0.00 0.00 66.00 65.96 2jbw h PRO 231 Cb 1.00 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.10 2jbw h PRO 231 CO 0.49 0.00 -0.26 0.00 -0.21 0.00 0.00 178.00 178.02 2jbw h ARG 232 N 0.00 0.00 -6.36 1.05 3.08 -1.94 -3.45 114.38 106.76 2jbw h ARG 232 Ca 0.00 0.00 -0.55 0.00 0.07 0.00 0.00 59.98 59.50 2jbw h ARG 232 Cb 0.24 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.28 2jbw h ARG 232 CO 0.00 0.26 0.78 -0.51 -1.07 0.00 0.00 179.97 179.43 2jbw s LEU 233 N -7.10 4.30 0.00 3.04 1.43 -0.98 -4.68 118.68 114.69 2jbw s LEU 233 Ca -0.01 2.01 0.26 0.00 -1.03 0.00 0.00 54.13 55.36 2jbw s LEU 233 Cb 0.11 -3.56 0.61 0.00 0.03 0.00 0.00 46.19 43.39 2jbw s LEU 233 CO 0.65 -0.67 1.48 0.00 0.23 0.00 0.00 176.35 178.04 2jbw n ALA 234 N 5.27 3.36 -3.40 4.21 0.00 0.66 -4.57 120.51 126.03 2jbw n ALA 234 Ca 0.12 -0.37 -0.11 0.00 0.00 0.00 0.00 53.44 53.09 2jbw n ALA 234 Cb 0.45 -1.13 -0.03 0.00 0.00 0.00 0.00 19.45 18.74 2jbw n ALA 234 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2jbw s ALA 235 N -2.81 -1.40 -0.25 0.00 0.00 -1.25 -4.12 121.76 111.92 2jbw s ALA 235 Ca 0.16 0.26 -0.12 0.00 0.00 0.00 0.00 51.96 52.26 2jbw s ALA 235 Cb 0.18 0.86 0.09 0.00 0.00 0.00 0.00 23.12 24.25 2jbw s ALA 235 CO 0.63 -0.79 0.59 0.00 0.00 0.00 0.00 175.76 176.19 2jbw s ILE 237 N 2.02 1.65 -0.41 0.00 1.01 0.38 0.17 121.20 126.02 2jbw s ILE 237 Ca -0.08 -0.76 -0.11 0.00 0.00 0.00 0.00 60.65 59.70 2jbw s ILE 237 Cb -0.08 -1.46 0.05 0.00 0.01 0.00 0.00 42.46 40.98 2jbw s ILE 237 CO -0.17 0.47 0.26 -0.55 0.00 0.00 0.00 174.94 174.95 2jbw s SER 238 N 0.66 5.79 -0.52 3.58 0.15 0.43 -1.39 113.70 122.39 2jbw s SER 238 Ca -0.13 -1.23 -0.05 0.00 0.70 0.00 0.00 55.95 55.24 2jbw s SER 238 Cb -0.16 -2.04 0.14 0.00 -1.71 0.00 0.00 66.02 62.24 2jbw s SER 238 CO 0.03 -0.49 0.35 0.86 1.20 0.00 0.00 173.24 175.20 2jbw s TRP 239 N 1.53 3.50 -0.81 3.44 -0.00 -0.20 -1.63 118.94 124.77 2jbw s TRP 239 Ca 0.03 -2.38 0.00 0.00 -0.00 0.00 0.00 56.10 53.75 2jbw s TRP 239 Cb -0.21 -3.31 0.00 0.00 -0.00 0.00 0.00 33.47 29.94 2jbw s TRP 239 CO 0.05 -0.93 0.00 0.41 -0.00 0.00 0.00 176.95 176.48 2jbw n GLY 240 N 4.23 0.22 0.00 5.86 0.00 -1.01 0.46 105.19 114.96 2jbw n GLY 240 Ca 0.01 -0.53 0.00 0.00 0.00 0.00 0.00 46.02 45.50 2jbw n GLY 240 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2jbw n GLY 241 N -1.19 -0.13 3.59 -0.02 0.00 -1.22 -3.89 105.19 102.32 2jbw n GLY 241 Ca -0.10 -1.80 -0.09 0.00 0.00 0.00 0.00 46.02 44.02 2jbw n GLY 241 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 2jbw s PHE 242 N -0.20 -0.36 -0.05 1.61 -0.12 -1.26 -4.87 117.98 112.74 2jbw s PHE 242 Ca 0.00 0.09 0.17 0.00 -0.05 0.00 0.00 56.93 57.14 2jbw s PHE 242 Cb 0.00 0.60 -0.26 0.00 -0.63 0.00 0.00 43.02 42.73 2jbw s PHE 242 CO 0.00 -0.88 0.33 -1.13 -0.05 0.00 0.00 175.22 173.49 2jbw n SER 243 N -0.38 0.94 -2.46 1.98 3.41 -1.26 -4.10 113.62 111.74 2jbw n SER 243 Ca -0.11 0.00 -0.07 0.00 -0.26 0.00 0.00 58.87 58.44 2jbw n SER 243 Cb 0.62 1.65 0.02 0.00 -0.26 0.00 0.00 64.21 66.25 2jbw n SER 243 CO 0.00 0.00 0.00 -0.90 -0.16 0.00 0.00 175.04 173.98 2jbw n ASP 244 N -2.21 -1.82 -1.05 4.04 5.75 -1.26 -1.97 116.55 118.04 2jbw n ASP 244 Ca -0.07 -2.24 -0.02 0.00 -0.01 0.00 0.00 54.79 52.44 2jbw n ASP 244 Cb 0.57 3.02 0.20 0.00 -1.03 0.00 0.00 41.12 43.87 2jbw n ASP 244 CO 0.00 0.00 0.00 0.18 -0.11 0.00 0.00 177.20 177.27 2jbw n LEU 245 N 0.00 3.79 -0.03 -2.12 7.99 -1.26 -4.70 117.00 120.67 2jbw n LEU 245 Ca -0.07 -3.87 0.23 0.00 -0.01 0.00 0.00 56.01 52.29 2jbw n LEU 245 Cb 0.48 -0.60 0.72 0.00 -0.11 0.00 0.00 43.42 43.90 2jbw n LEU 245 CO 0.22 1.35 1.21 0.44 -1.51 0.00 0.00 177.39 179.09 2jbw h ASP 246 N 1.05 0.00 -0.26 -1.43 5.19 -1.98 -2.60 116.42 116.39 2jbw h ASP 246 Ca 0.17 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.58 2jbw h ASP 246 Cb 1.46 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.97 2jbw h ASP 246 CO 0.30 0.00 0.00 0.00 -3.12 0.00 0.00 179.24 176.42 2jbw n TYR 247 N -4.19 0.54 -0.39 4.55 4.11 -1.26 -4.67 117.16 115.85 2jbw n TYR 247 Ca 0.12 -0.22 -0.09 0.00 -0.00 0.00 0.00 57.90 57.70 2jbw n TYR 247 Cb 0.71 -0.10 -0.07 0.00 -0.00 0.00 0.00 39.34 39.88 2jbw n TYR 247 CO 0.00 0.00 0.00 1.87 -0.00 0.00 0.00 176.86 178.73 2jbw n TRP 248 N 0.30 -0.35 -0.41 -3.48 -0.00 -0.98 -0.93 117.44 111.59 2jbw n TRP 248 Ca 0.10 1.18 0.38 0.00 -0.00 0.00 0.00 57.50 59.16 2jbw n TRP 248 Cb 0.38 -0.62 0.73 0.00 -0.00 0.00 0.00 31.31 31.81 2jbw n TRP 248 CO 0.00 0.00 0.00 -0.44 -0.00 0.00 0.00 177.69 177.25 2jbw h ASP 249 N 0.00 0.07 0.81 5.87 3.32 -1.89 0.17 116.42 124.77 2jbw h ASP 249 Ca 0.18 0.02 0.00 0.00 0.02 0.00 0.00 57.03 57.25 2jbw h ASP 249 Cb 0.42 0.01 0.00 0.00 0.22 0.00 0.00 39.33 39.98 2jbw h ASP 249 CO -0.90 -0.01 0.00 0.18 -1.72 0.00 0.00 179.24 176.80 2jbw n LEU 250 N -4.22 0.35 -4.77 1.55 7.99 -0.10 -4.85 117.00 112.96 2jbw n LEU 250 Ca 0.30 0.57 -0.39 0.00 -0.01 0.00 0.00 56.01 56.48 2jbw n LEU 250 Cb 1.39 -0.50 -0.02 0.00 -0.11 0.00 0.00 43.42 44.18 2jbw n LEU 250 CO 0.38 -0.30 0.89 -1.61 -1.51 0.00 0.00 177.39 175.24 2jbw s GLU 251 N -3.12 4.19 0.83 3.23 0.41 0.05 -4.89 118.70 119.39 2jbw s GLU 251 Ca 0.08 1.97 -0.14 0.00 -0.41 0.00 0.00 54.97 56.47 2jbw s GLU 251 Cb 0.11 -2.85 0.05 0.00 -1.78 0.00 0.00 34.13 29.67 2jbw s GLU 251 CO 0.40 -0.25 0.89 0.25 -0.49 0.00 0.00 175.26 176.06 2jbw n THR 252 N 0.40 1.41 -0.29 3.63 -2.24 -1.26 -4.75 114.28 111.18 2jbw n THR 252 Ca 0.02 -0.23 0.09 0.00 -2.27 0.00 0.00 64.05 61.67 2jbw n THR 252 Cb 0.45 -0.96 0.25 0.00 -2.10 0.00 0.00 70.33 67.96 2jbw n THR 252 CO 0.00 0.00 0.00 -0.65 -0.57 0.00 0.00 175.07 173.85 2jbw h PRO 253 N -1.00 0.41 0.00 -0.78 0.11 -1.97 -2.15 132.00 126.62 2jbw h PRO 253 Ca -0.45 -0.02 -0.07 0.00 0.11 0.00 0.00 66.00 65.56 2jbw h PRO 253 Cb 1.30 -0.09 -0.01 0.00 0.11 0.00 0.00 31.00 32.31 2jbw h PRO 253 CO 0.42 0.27 -0.33 -0.07 -0.21 0.00 0.00 178.00 178.08 2jbw h LEU 254 N 0.42 0.00 -0.18 2.35 4.07 -1.98 -2.44 115.31 117.55 2jbw h LEU 254 Ca 0.49 0.00 -0.13 0.00 0.08 0.00 0.00 57.88 58.32 2jbw h LEU 254 Cb 0.85 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.59 2jbw h LEU 254 CO -0.48 0.33 -0.39 0.74 -1.08 0.00 0.00 178.44 177.57 2jbw h THR 255 N 0.00 1.34 -0.58 0.22 2.02 -1.75 -1.90 112.91 112.25 2jbw h THR 255 Ca -0.00 -1.63 -0.01 0.00 0.77 0.00 0.00 66.41 65.53 2jbw h THR 255 Cb 1.00 1.92 -0.03 0.00 -1.74 0.00 0.00 68.15 69.31 2jbw h THR 255 CO 0.04 0.50 0.32 0.11 0.37 0.00 0.00 175.52 176.87 2jbw h LYS 256 N 0.24 0.80 -0.41 6.66 1.57 -1.30 0.15 116.57 124.27 2jbw h LYS 256 Ca 0.00 -0.08 -0.10 0.00 -1.87 0.00 0.00 60.65 58.61 2jbw h LYS 256 Cb 0.99 -0.16 -0.02 0.00 0.08 0.00 0.00 32.23 33.12 2jbw h LYS 256 CO 0.09 0.59 -0.14 0.93 -0.57 0.00 0.00 179.45 180.35 2jbw h GLU 257 N 0.81 0.75 -0.28 3.15 4.39 -1.40 -1.34 114.58 120.66 2jbw h GLU 257 Ca 0.21 -0.26 -0.11 0.00 0.34 0.00 0.00 59.36 59.54 2jbw h GLU 257 Cb 0.02 -0.06 -0.01 0.00 -0.10 0.00 0.00 28.75 28.60 2jbw h GLU 257 CO -0.03 0.85 -0.24 0.77 -1.16 0.00 0.00 179.01 179.20 2jbw h SER 258 N 0.68 0.70 -0.11 1.42 0.02 -0.57 -1.31 113.55 114.38 2jbw h SER 258 Ca 0.11 -0.46 0.04 0.00 -0.84 0.00 0.00 61.79 60.65 2jbw h SER 258 Cb 0.61 -0.19 -0.05 0.00 0.14 0.00 0.00 62.40 62.91 2jbw h SER 258 CO 0.04 1.01 -0.20 -0.50 -1.14 0.00 0.00 176.83 176.04 2jbw h TRP 259 N 0.39 -0.52 -0.73 3.45 -0.00 -0.58 -0.28 115.95 117.69 2jbw h TRP 259 Ca 0.05 0.03 0.16 0.00 -0.00 0.00 0.00 58.89 59.13 2jbw h TRP 259 Cb 0.79 0.25 -0.11 0.00 -0.00 0.00 0.00 29.16 30.09 2jbw h TRP 259 CO 0.07 -0.28 0.14 -0.22 -0.00 0.00 0.00 178.44 178.15 2jbw h LYS 260 N -0.26 0.22 -0.17 0.49 3.64 -1.21 -1.75 116.57 117.53 2jbw h LYS 260 Ca 0.09 -0.01 -0.06 0.00 -1.27 0.00 0.00 60.65 59.40 2jbw h LYS 260 Cb 0.40 -0.05 -0.00 0.00 -0.41 0.00 0.00 32.23 32.16 2jbw h LYS 260 CO -0.27 0.14 -0.13 -0.92 -2.27 0.00 0.00 179.45 176.00 2jbw h TYR 261 N 0.23 0.45 0.00 1.91 3.20 -0.35 -2.57 116.97 119.84 2jbw h TYR 261 Ca 0.41 -0.13 0.00 0.00 3.14 0.00 0.00 58.73 62.15 2jbw h TYR 261 Cb 0.70 -0.10 0.00 0.00 1.54 0.00 0.00 36.73 38.87 2jbw h TYR 261 CO -0.29 0.74 0.00 -0.39 -1.64 0.00 0.00 178.16 176.58 2jbw h VAL 262 N 0.04 0.00 -0.01 1.81 -1.51 -0.88 -2.35 116.25 113.35 2jbw h VAL 262 Ca 0.03 -0.46 0.00 0.00 -1.23 0.00 0.00 66.70 65.04 2jbw h VAL 262 Cb 0.65 1.37 0.00 0.00 -2.13 0.00 0.00 31.29 31.18 2jbw h VAL 262 CO 0.04 0.00 -0.31 -1.20 -1.23 0.00 0.00 177.57 174.87 2jbw n SER 263 N -2.45 1.34 -4.05 4.19 7.64 -0.68 -0.80 113.62 118.81 2jbw n SER 263 Ca 0.04 -1.10 -0.29 0.00 1.01 0.00 0.00 58.87 58.53 2jbw n SER 263 Cb 0.36 0.23 -0.03 0.00 -1.01 0.00 0.00 64.21 63.76 2jbw n SER 263 CO 0.00 0.00 0.00 0.29 -3.01 0.00 0.00 175.04 172.32 2jbw n LYS 264 N -0.43 -3.18 -4.54 1.43 5.02 -0.89 -4.90 118.16 110.67 2jbw n LYS 264 Ca 0.12 0.38 -0.25 0.00 -2.02 0.00 0.00 58.31 56.53 2jbw n LYS 264 Cb 0.38 -4.65 -0.11 0.00 -0.02 0.00 0.00 35.03 30.64 2jbw n LYS 264 CO 0.00 0.00 0.00 0.14 -0.52 0.00 0.00 177.40 177.02 2jbw s VAL 265 N -3.79 1.99 -0.30 -0.18 -7.23 -1.12 -5.07 120.40 104.71 2jbw s VAL 265 Ca 0.22 -2.12 0.23 0.00 -1.81 0.00 0.00 61.98 58.49 2jbw s VAL 265 Cb -0.12 -2.71 -0.12 0.00 0.56 0.00 0.00 36.38 33.99 2jbw s VAL 265 CO 0.90 -0.15 0.90 0.47 -0.31 0.00 0.00 175.10 176.91 2jbw n ASP 266 N -0.79 0.56 -4.36 4.85 8.00 -1.26 -4.69 116.55 118.86 2jbw n ASP 266 Ca -0.05 0.08 -0.19 0.00 0.71 0.00 0.00 54.79 55.35 2jbw n ASP 266 Cb 0.65 0.93 -0.10 0.00 -0.02 0.00 0.00 41.12 42.58 2jbw n ASP 266 CO 0.00 0.00 0.00 0.42 -0.39 0.00 0.00 177.20 177.23 2jbw s THR 267 N -3.35 1.48 0.05 -3.53 -4.23 -1.26 -5.07 115.64 99.74 2jbw s THR 267 Ca -0.01 -2.12 -0.18 0.00 -1.18 0.00 0.00 61.69 58.19 2jbw s THR 267 Cb 0.12 -2.22 -0.14 0.00 1.34 0.00 0.00 72.50 71.60 2jbw s THR 267 CO 0.82 -0.45 1.33 -0.07 -0.54 0.00 0.00 174.62 175.70 2jbw h LEU 268 N 2.47 0.54 -1.00 4.79 4.07 -1.94 -2.44 115.31 121.79 2jbw h LEU 268 Ca -0.39 -0.53 -0.07 0.00 0.08 0.00 0.00 57.88 56.97 2jbw h LEU 268 Cb 1.22 -0.15 -0.02 0.00 1.08 0.00 0.00 40.66 42.79 2jbw h LEU 268 CO 0.65 0.96 -0.08 -0.08 -1.08 0.00 0.00 178.44 178.81 2jbw h GLU 269 N 0.13 0.63 -0.49 1.13 4.57 -1.98 0.26 114.58 118.82 2jbw h GLU 269 Ca 0.01 -0.18 -0.00 0.00 -1.18 0.00 0.00 59.36 58.01 2jbw h GLU 269 Cb 0.85 -0.07 -0.02 0.00 -0.16 0.00 0.00 28.75 29.35 2jbw h GLU 269 CO 0.06 0.70 0.30 0.93 -1.18 0.00 0.00 179.01 179.82 2jbw h GLU 270 N 0.58 0.67 -0.11 1.92 5.08 -1.99 -0.79 114.58 119.95 2jbw h GLU 270 Ca 0.11 -0.06 -0.01 0.00 -1.00 0.00 0.00 59.36 58.40 2jbw h GLU 270 Cb 0.49 -0.14 -0.00 0.00 0.50 0.00 0.00 28.75 29.59 2jbw h GLU 270 CO 0.03 0.49 0.04 0.00 -1.00 0.00 0.00 179.01 178.57 2jbw h ALA 271 N 1.14 0.14 0.35 3.43 0.00 -0.89 -2.62 119.26 120.81 2jbw h ALA 271 Ca 0.18 -0.10 -0.01 0.00 0.00 0.00 0.00 54.91 54.98 2jbw h ALA 271 Cb -0.01 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 17.73 2jbw h ALA 271 CO -0.03 -0.27 -0.25 -0.09 0.00 0.00 0.00 179.25 178.60 2jbw h ARG 272 N 0.01 -0.58 -0.54 0.00 2.43 -0.44 -1.56 114.38 113.70 2jbw h ARG 272 Ca 0.04 0.04 0.10 0.00 -0.81 0.00 0.00 59.98 59.35 2jbw h ARG 272 Cb 0.17 0.13 -0.08 0.00 -0.42 0.00 0.00 29.97 29.77 2jbw h ARG 272 CO -0.00 -0.38 0.05 1.25 -1.51 0.00 0.00 179.97 179.37 2jbw h LEU 273 N -0.60 -0.13 -0.44 3.80 5.85 -1.17 -1.17 115.31 121.45 2jbw h LEU 273 Ca -0.03 0.12 -0.08 0.00 0.84 0.00 0.00 57.88 58.73 2jbw h LEU 273 Cb 0.51 0.19 -0.02 0.00 0.37 0.00 0.00 40.66 41.72 2jbw h LEU 273 CO 0.01 -0.04 -0.03 -0.74 -0.34 0.00 0.00 178.44 177.29 2jbw h HIS 274 N 0.17 0.89 0.18 1.25 2.76 -1.21 -2.98 115.15 116.21 2jbw h HIS 274 Ca 0.28 -0.17 -0.30 0.00 -2.20 0.00 0.00 60.37 57.98 2jbw h HIS 274 Cb 0.42 -0.23 0.02 0.00 1.55 0.00 0.00 27.41 29.17 2jbw h HIS 274 CO -0.29 0.87 -1.37 0.28 -1.30 0.00 0.00 177.93 176.12 2jbw h VAL 275 N 0.64 1.37 -0.69 5.26 2.07 -0.98 -1.45 116.25 122.48 2jbw h VAL 275 Ca 0.12 -2.90 0.02 0.00 0.82 0.00 0.00 66.70 64.77 2jbw h VAL 275 Cb 0.55 2.96 -0.04 0.00 -1.52 0.00 0.00 31.29 33.24 2jbw h VAL 275 CO 0.03 0.86 0.44 -0.74 0.02 0.00 0.00 177.57 178.17 2jbw h HIS 276 N 0.10 0.82 0.41 1.57 6.17 -1.27 -0.31 115.15 122.64 2jbw h HIS 276 Ca -0.19 0.02 -0.02 0.00 0.71 0.00 0.00 60.37 60.89 2jbw h HIS 276 Cb 2.05 -0.27 0.00 0.00 2.52 0.00 0.00 27.41 31.72 2jbw h HIS 276 CO 0.09 0.48 -0.20 0.00 0.71 0.00 0.00 177.93 179.01 2jbw h ALA 277 N 1.29 -0.55 -0.54 5.26 0.00 -1.53 -3.20 119.26 119.99 2jbw h ALA 277 Ca 0.27 -0.19 0.10 0.00 0.00 0.00 0.00 54.91 55.09 2jbw h ALA 277 Cb -0.01 0.21 -0.03 0.00 0.00 0.00 0.00 17.79 17.96 2jbw h ALA 277 CO -0.10 -0.63 0.36 0.00 0.00 0.00 0.00 179.25 178.89 2jbw h ALA 278 N -0.52 2.11 -0.48 0.00 0.00 -1.14 -3.10 119.26 116.13 2jbw h ALA 278 Ca -0.06 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.84 2jbw h ALA 278 Cb 0.55 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.29 2jbw h ALA 278 CO 0.09 -0.23 0.00 1.28 0.00 0.00 0.00 179.25 180.39 2jbw n LEU 279 N -4.46 3.49 -4.77 0.00 4.77 -0.14 -4.15 117.00 111.74 2jbw n LEU 279 Ca 0.09 -2.13 -0.41 0.00 -0.03 0.00 0.00 56.01 53.53 2jbw n LEU 279 Cb 0.39 -0.37 -0.02 0.00 -2.33 0.00 0.00 43.42 41.10 2jbw n LEU 279 CO 0.35 0.80 0.99 -0.70 -1.33 0.00 0.00 177.39 177.50 2jbw s GLU 280 N -1.25 4.34 0.00 3.23 2.56 -1.17 -4.48 118.70 121.94 2jbw s GLU 280 Ca 0.35 2.23 0.00 0.00 0.00 0.00 0.00 54.97 57.55 2jbw s GLU 280 Cb 0.20 -3.07 0.00 0.00 2.00 0.00 0.00 34.13 33.26 2jbw s GLU 280 CO 0.21 -0.21 0.00 0.25 -0.56 0.00 0.00 175.26 174.95 2jbw n THR 281 N 0.86 0.00 0.23 -1.70 -2.24 -0.83 -4.88 114.28 105.72 2jbw n THR 281 Ca 0.00 -0.07 0.12 0.00 -2.27 0.00 0.00 64.05 61.83 2jbw n THR 281 Cb 0.42 0.48 0.73 0.00 -2.10 0.00 0.00 70.33 69.86 2jbw n THR 281 CO 0.00 0.00 0.00 0.03 -0.57 0.00 0.00 175.07 174.53 2jbw h ARG 282 N 0.00 0.00 0.00 -0.78 3.08 -1.92 0.48 114.38 115.24 2jbw h ARG 282 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 2jbw h ARG 282 Cb 0.00 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.05 2jbw h ARG 282 CO 0.00 0.00 0.00 -0.40 -1.07 0.00 0.00 179.97 178.50 2jbw n ASP 283 N -4.27 0.00 0.00 7.04 5.75 -1.26 -4.06 116.55 119.74 2jbw n ASP 283 Ca -0.01 -0.05 0.00 0.00 -0.01 0.00 0.00 54.79 54.72 2jbw n ASP 283 Cb 0.18 -0.28 0.00 0.00 -1.03 0.00 0.00 41.12 39.99 2jbw n ASP 283 CO 0.00 0.00 0.00 0.55 -0.11 0.00 0.00 177.20 177.64 2jbw n VAL 284 N -1.28 0.00 0.21 2.12 3.14 0.16 -4.85 118.33 117.83 2jbw n VAL 284 Ca 0.11 -0.19 0.05 0.00 -2.96 0.00 0.00 64.34 61.35 2jbw n VAL 284 Cb 0.19 1.03 0.48 0.00 -1.06 0.00 0.00 33.84 34.48 2jbw n VAL 284 CO 0.00 0.00 0.00 -0.07 -6.46 0.00 0.00 176.83 170.30 2jbw h LEU 285 N 0.00 0.04 0.00 6.55 3.38 -1.52 -2.24 115.31 121.51 2jbw h LEU 285 Ca 0.00 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.96 2jbw h LEU 285 Cb 0.01 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 40.75 2jbw h LEU 285 CO 0.00 0.22 0.00 -1.54 0.09 0.00 0.00 178.44 177.21 2jbw n SER 286 N -4.31 0.00 0.00 -0.43 3.41 -1.17 -2.95 113.62 108.18 2jbw n SER 286 Ca -0.02 0.47 0.13 0.00 -0.26 0.00 0.00 58.87 59.18 2jbw n SER 286 Cb 0.25 -0.48 0.34 0.00 -0.26 0.00 0.00 64.21 64.06 2jbw n SER 286 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2jbw n GLN 287 N -1.48 0.02 -2.03 4.33 6.02 -0.84 -4.78 117.38 118.60 2jbw n GLN 287 Ca 0.04 0.01 -0.43 0.00 -0.01 0.00 0.00 57.00 56.61 2jbw n GLN 287 Cb 0.19 -1.51 -0.03 0.00 1.02 0.00 0.00 30.24 29.91 2jbw n GLN 287 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 177.06 176.47 2jbw s ILE 288 N -3.01 3.60 -0.49 5.09 1.01 -1.15 -4.82 121.20 121.43 2jbw s ILE 288 Ca 0.12 0.69 0.04 0.00 0.00 0.00 0.00 60.65 61.50 2jbw s ILE 288 Cb 0.18 -3.55 0.42 0.00 0.01 0.00 0.00 42.46 39.51 2jbw s ILE 288 CO 0.66 -0.18 1.36 0.00 0.00 0.00 0.00 174.94 176.78 2jbw n ALA 289 N 8.10 5.40 -2.96 9.38 0.00 -1.26 -4.74 120.51 134.43 2jbw n ALA 289 Ca 0.19 -4.10 -0.11 0.00 0.00 0.00 0.00 53.44 49.42 2jbw n ALA 289 Cb 0.44 -0.83 -0.09 0.00 0.00 0.00 0.00 19.45 18.97 2jbw n ALA 289 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2jbw n PRO 291 N 1.12 0.00 -4.34 0.00 -0.02 -1.26 -4.82 135.00 125.68 2jbw n PRO 291 Ca -0.21 0.00 -0.26 0.00 -2.02 0.00 0.00 63.50 61.01 2jbw n PRO 291 Cb 0.57 -1.44 -0.17 0.00 -0.02 0.00 0.00 33.50 32.44 2jbw n PRO 291 CO 0.00 0.00 0.00 0.99 1.98 0.00 0.00 175.50 178.47 2jbw s THR 292 N 1.39 1.21 -0.23 3.45 2.01 0.31 -0.78 115.64 123.00 2jbw s THR 292 Ca 0.94 -0.47 -0.04 0.00 0.31 0.00 0.00 61.69 62.43 2jbw s THR 292 Cb -1.33 -1.14 -0.00 0.00 0.01 0.00 0.00 72.50 70.04 2jbw s THR 292 CO 0.66 0.38 -0.03 -0.47 -0.69 0.00 0.00 174.62 174.48 2jbw s TYR 293 N 1.07 2.99 -0.19 4.92 6.14 0.13 0.38 117.35 132.78 2jbw s TYR 293 Ca -0.06 -0.99 -0.02 0.00 0.64 0.00 0.00 57.07 56.64 2jbw s TYR 293 Cb -0.15 -2.12 -0.00 0.00 0.42 0.00 0.00 41.96 40.11 2jbw s TYR 293 CO -0.02 -0.56 -0.10 0.42 0.64 0.00 0.00 175.55 175.93 2jbw s ILE 294 N 1.47 2.98 -0.26 3.14 1.01 -0.47 -0.43 121.20 128.63 2jbw s ILE 294 Ca 0.05 -0.64 -0.03 0.00 0.00 0.00 0.00 60.65 60.03 2jbw s ILE 294 Cb -0.15 -2.31 0.02 0.00 0.01 0.00 0.00 42.46 40.03 2jbw s ILE 294 CO -0.03 0.47 -0.02 -0.22 0.00 0.00 0.00 174.94 175.14 2jbw s LEU 295 N 1.20 3.32 -0.06 2.97 2.96 -0.64 -0.18 118.68 128.24 2jbw s LEU 295 Ca 0.02 -0.78 0.04 0.00 -0.22 0.00 0.00 54.13 53.19 2jbw s LEU 295 Cb -0.14 -1.72 0.00 0.00 0.50 0.00 0.00 46.19 44.82 2jbw s LEU 295 CO -0.04 -0.13 -0.18 -2.28 -1.32 0.00 0.00 176.35 172.40 2jbw s HIS 296 N 1.38 1.87 -0.20 5.38 5.65 -0.66 -2.41 115.29 126.30 2jbw s HIS 296 Ca 0.01 -0.64 -0.14 0.00 0.25 0.00 0.00 55.06 54.55 2jbw s HIS 296 Cb -0.16 -1.28 -0.04 0.00 -1.18 0.00 0.00 32.58 29.91 2jbw s HIS 296 CO -0.03 -0.25 0.29 0.20 -0.65 0.00 0.00 174.74 174.30 2jbw s GLY 297 N 0.27 2.10 0.35 1.59 0.00 -1.26 -1.48 107.32 108.89 2jbw s GLY 297 Ca -0.10 -0.60 0.09 0.00 0.00 0.00 0.00 44.72 44.11 2jbw s GLY 297 CO 0.04 0.54 1.85 -2.08 0.00 0.00 0.00 173.10 173.46 2jbw h VAL 298 N 4.89 0.81 -0.33 1.40 2.07 -1.01 -0.25 116.25 123.82 2jbw h VAL 298 Ca -0.39 -0.24 0.00 0.00 0.82 0.00 0.00 66.70 66.90 2jbw h VAL 298 Cb 1.16 0.06 0.00 0.00 -1.52 0.00 0.00 31.29 30.99 2jbw h VAL 298 CO 0.72 0.13 0.00 1.41 0.02 0.00 0.00 177.57 179.85 2jbw n HIS 299 N -4.58 1.10 -1.91 1.57 8.25 -0.22 -4.86 115.22 114.57 2jbw n HIS 299 Ca 0.18 -0.39 -0.35 0.00 -0.26 0.00 0.00 57.72 56.90 2jbw n HIS 299 Cb 0.50 -0.30 0.04 0.00 1.12 0.00 0.00 29.99 31.36 2jbw n HIS 299 CO 0.00 0.00 0.00 0.34 0.64 0.00 0.00 176.34 177.32 2jbw s ASP 300 N -0.49 5.07 0.55 0.41 -1.08 -0.11 -4.41 116.67 116.61 2jbw s ASP 300 Ca 0.30 2.30 0.36 0.00 -0.52 0.00 0.00 52.55 54.99 2jbw s ASP 300 Cb 0.22 -2.59 1.70 0.00 -1.46 0.00 0.00 42.92 40.79 2jbw s ASP 300 CO 0.10 -1.67 2.08 -0.33 0.52 0.00 0.00 175.17 175.87 2jbw h GLU 301 N 0.60 0.00 -6.18 4.34 3.07 -1.90 -3.40 114.58 111.12 2jbw h GLU 301 Ca -0.49 0.00 -0.56 0.00 -0.50 0.00 0.00 59.36 57.80 2jbw h GLU 301 Cb 1.29 0.00 -0.03 0.00 -0.84 0.00 0.00 28.75 29.16 2jbw h GLU 301 CO 0.54 0.00 0.96 0.08 -1.40 0.00 0.00 179.01 179.19 2jbw s VAL 302 N -3.80 4.09 0.81 3.13 1.01 -1.26 -4.79 120.40 119.58 2jbw s VAL 302 Ca -0.01 1.31 -0.12 0.00 0.00 0.00 0.00 61.98 63.16 2jbw s VAL 302 Cb 0.10 -3.85 0.08 0.00 0.00 0.00 0.00 36.38 32.70 2jbw s VAL 302 CO 0.46 -0.12 1.12 -2.16 0.00 0.00 0.00 175.10 174.40 2jbw s PRO 303 N 3.67 2.00 0.00 2.72 0.04 -1.26 -4.92 135.00 137.24 2jbw s PRO 303 Ca 0.60 0.40 0.22 0.00 0.04 0.00 0.00 61.00 62.26 2jbw s PRO 303 Cb -0.25 -1.93 1.32 0.00 0.04 0.00 0.00 34.50 33.68 2jbw s PRO 303 CO 0.19 -1.62 1.72 1.28 0.04 0.00 0.00 177.00 178.60 2jbw n LEU 304 N -3.39 0.00 -0.19 -3.56 4.77 -1.26 -2.44 117.00 110.93 2jbw n LEU 304 Ca 0.07 0.03 0.02 0.00 -0.03 0.00 0.00 56.01 56.11 2jbw n LEU 304 Cb 0.58 -0.03 0.29 0.00 -2.33 0.00 0.00 43.42 41.93 2jbw n LEU 304 CO 0.57 -0.01 1.23 0.28 -1.33 0.00 0.00 177.39 178.13 2jbw h SER 305 N 0.00 0.77 -0.61 -1.43 0.02 -2.00 -2.38 113.55 107.92 2jbw h SER 305 Ca 0.00 -0.01 0.11 0.00 -0.84 0.00 0.00 61.79 61.05 2jbw h SER 305 Cb 0.02 -0.19 -0.08 0.00 0.14 0.00 0.00 62.40 62.29 2jbw h SER 305 CO 0.00 0.55 0.16 0.15 -1.14 0.00 0.00 176.83 176.55 2jbw h PHE 306 N 0.91 0.27 -0.99 3.45 3.57 -1.86 0.63 116.94 122.91 2jbw h PHE 306 Ca 0.27 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.81 2jbw h PHE 306 Cb -0.02 -0.03 -0.05 0.00 2.79 0.00 0.00 35.95 38.65 2jbw h PHE 306 CO -0.00 0.00 0.63 0.28 -2.23 0.00 0.00 178.31 177.00 2jbw h VAL 307 N 0.30 1.26 -0.39 1.41 2.07 -1.65 -0.34 116.25 118.91 2jbw h VAL 307 Ca 0.32 -0.50 -0.01 0.00 0.82 0.00 0.00 66.70 67.33 2jbw h VAL 307 Cb 0.46 -0.18 -0.02 0.00 -1.52 0.00 0.00 31.29 30.04 2jbw h VAL 307 CO -0.38 0.26 0.21 0.44 0.02 0.00 0.00 177.57 178.12 2jbw h ASP 308 N 1.35 0.50 0.62 0.57 5.19 -1.00 -1.98 116.42 121.66 2jbw h ASP 308 Ca 0.36 -0.10 -0.02 0.00 -0.62 0.00 0.00 57.03 56.65 2jbw h ASP 308 Cb -0.12 -0.13 -0.01 0.00 0.18 0.00 0.00 39.33 39.25 2jbw h ASP 308 CO -0.07 0.45 -0.39 0.74 -3.12 0.00 0.00 179.24 176.85 2jbw h THR 309 N 0.50 0.22 -0.66 0.35 2.02 -0.40 -2.03 112.91 112.90 2jbw h THR 309 Ca 0.14 0.00 -0.01 0.00 0.77 0.00 0.00 66.41 67.31 2jbw h THR 309 Cb 0.07 0.22 -0.03 0.00 -1.74 0.00 0.00 68.15 66.67 2jbw h THR 309 CO -0.02 0.00 0.39 -0.37 0.37 0.00 0.00 175.52 175.89 2jbw h VAL 310 N -0.95 1.19 -0.04 3.16 -1.51 -1.08 0.22 116.25 117.24 2jbw h VAL 310 Ca -0.08 -0.44 -0.11 0.00 -1.23 0.00 0.00 66.70 64.84 2jbw h VAL 310 Cb 0.77 0.27 -0.01 0.00 -2.13 0.00 0.00 31.29 30.19 2jbw h VAL 310 CO 0.07 0.20 -0.50 -0.07 -1.23 0.00 0.00 177.57 176.04 2jbw h LEU 311 N 0.92 0.11 -0.03 4.19 3.38 -1.30 0.18 115.31 122.75 2jbw h LEU 311 Ca 0.24 -0.05 -0.04 0.00 0.09 0.00 0.00 57.88 58.12 2jbw h LEU 311 Cb -0.02 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 40.70 2jbw h LEU 311 CO -0.04 0.60 -0.13 -0.08 0.09 0.00 0.00 178.44 178.88 2jbw h GLU 312 N 0.08 0.14 0.00 1.13 4.81 -0.63 -3.42 114.58 116.69 2jbw h GLU 312 Ca 0.00 -0.11 -0.34 0.00 -0.13 0.00 0.00 59.36 58.78 2jbw h GLU 312 Cb 0.92 0.02 -0.06 0.00 0.63 0.00 0.00 28.75 30.26 2jbw h GLU 312 CO 0.07 0.76 -2.28 1.28 -0.73 0.00 0.00 179.01 178.10 2jbw n LEU 313 N -4.63 1.37 -4.69 1.64 4.77 0.72 -4.84 117.00 111.34 2jbw n LEU 313 Ca -0.09 -0.06 -0.42 0.00 -0.03 0.00 0.00 56.01 55.41 2jbw n LEU 313 Cb 0.39 -0.13 -0.03 0.00 -2.33 0.00 0.00 43.42 41.32 2jbw n LEU 313 CO 0.37 0.65 1.03 -0.69 -1.33 0.00 0.00 177.39 177.43 2jbw s VAL 314 N -2.45 3.99 0.48 4.08 1.01 0.63 -3.04 120.40 125.09 2jbw s VAL 314 Ca -0.19 1.34 -0.24 0.00 0.00 0.00 0.00 61.98 62.89 2jbw s VAL 314 Cb 0.07 -3.86 -0.07 0.00 0.00 0.00 0.00 36.38 32.51 2jbw s VAL 314 CO 0.65 -0.00 1.42 -0.81 0.00 0.00 0.00 175.10 176.35 2jbw n PRO 315 N 5.29 2.11 -0.21 2.72 -0.04 -1.26 -4.74 135.00 138.86 2jbw n PRO 315 Ca 0.12 0.76 -0.05 0.00 -0.04 0.00 0.00 63.50 64.29 2jbw n PRO 315 Cb 0.45 -2.62 0.05 0.00 -0.04 0.00 0.00 33.50 31.34 2jbw n PRO 315 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2jbw h ALA 316 N 2.07 0.78 0.00 0.55 0.00 -1.93 -2.69 119.26 118.04 2jbw h ALA 316 Ca -0.51 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.38 2jbw h ALA 316 Cb 1.28 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 18.87 2jbw h ALA 316 CO 0.60 0.14 0.00 -0.85 0.00 0.00 0.00 179.25 179.13 2jbw n GLU 317 N -4.71 0.02 -0.00 0.00 0.00 -1.26 -2.54 120.64 112.14 2jbw n GLU 317 Ca 0.05 0.47 0.05 0.00 0.00 0.00 0.00 57.16 57.73 2jbw n GLU 317 Cb 0.06 -1.56 -0.08 0.00 0.00 0.00 0.00 31.44 29.87 2jbw n GLU 317 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.13 177.85 2jbw n HIS 318 N -1.60 0.00 -2.68 -1.84 8.25 -1.02 -4.43 115.22 111.90 2jbw n HIS 318 Ca 0.01 0.00 -0.43 0.00 -0.26 0.00 0.00 57.72 57.04 2jbw n HIS 318 Cb 0.04 -0.19 -0.03 0.00 1.12 0.00 0.00 29.99 30.93 2jbw n HIS 318 CO 0.00 0.00 0.00 -1.17 0.64 0.00 0.00 176.34 175.81 2jbw s LEU 319 N -3.48 3.88 -0.49 2.41 2.96 -1.05 -0.53 118.68 122.37 2jbw s LEU 319 Ca -0.02 0.77 -0.11 0.00 -0.22 0.00 0.00 54.13 54.54 2jbw s LEU 319 Cb 0.07 -3.46 0.12 0.00 0.50 0.00 0.00 46.19 43.42 2jbw s LEU 319 CO 0.43 -0.97 0.39 0.20 -1.32 0.00 0.00 176.35 175.08 2jbw s ASN 320 N 1.92 5.84 -0.15 3.68 0.01 0.16 -3.32 114.94 123.08 2jbw s ASN 320 Ca 0.44 -1.86 -0.18 0.00 -0.71 0.00 0.00 52.86 50.55 2jbw s ASN 320 Cb -0.11 -2.07 -0.04 0.00 0.41 0.00 0.00 41.25 39.45 2jbw s ASN 320 CO 0.20 -0.73 0.47 -0.22 -1.51 0.00 0.00 177.10 175.31 2jbw s LEU 321 N 1.43 4.22 -0.25 0.60 2.96 -0.91 -1.37 118.68 125.36 2jbw s LEU 321 Ca 0.05 0.72 0.01 0.00 -0.22 0.00 0.00 54.13 54.69 2jbw s LEU 321 Cb -0.27 -2.66 0.07 0.00 0.50 0.00 0.00 46.19 43.82 2jbw s LEU 321 CO 0.00 -0.06 -0.04 -0.69 -1.32 0.00 0.00 176.35 174.25 2jbw s VAL 322 N 0.99 1.63 -0.26 1.68 1.01 0.75 -0.23 120.40 125.96 2jbw s VAL 322 Ca 0.24 -1.38 -0.09 0.00 0.00 0.00 0.00 61.98 60.76 2jbw s VAL 322 Cb -0.15 -1.92 -0.04 0.00 0.00 0.00 0.00 36.38 34.28 2jbw s VAL 322 CO 0.09 -0.17 0.12 -0.69 0.00 0.00 0.00 175.10 174.45 2jbw s VAL 323 N 1.33 4.69 -0.38 2.92 1.01 0.11 -1.65 120.40 128.43 2jbw s VAL 323 Ca -0.04 -0.06 -0.14 0.00 0.00 0.00 0.00 61.98 61.75 2jbw s VAL 323 Cb -0.19 -3.22 0.01 0.00 0.00 0.00 0.00 36.38 32.98 2jbw s VAL 323 CO -0.07 0.29 0.27 -1.61 0.00 0.00 0.00 175.10 173.98 2jbw s GLU 324 N 1.67 3.14 0.51 2.72 0.41 -0.55 -4.19 118.70 122.41 2jbw s GLU 324 Ca 0.07 -0.89 0.30 0.00 -0.41 0.00 0.00 54.97 54.03 2jbw s GLU 324 Cb -0.16 -3.89 1.24 0.00 -1.78 0.00 0.00 34.13 29.54 2jbw s GLU 324 CO 0.06 -0.64 1.94 1.57 -0.49 0.00 0.00 175.26 177.71 2jbw h LYS 325 N 8.56 0.00 0.00 1.61 2.10 -1.91 -0.74 116.57 126.19 2jbw h LYS 325 Ca -0.28 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.37 2jbw h LYS 325 Cb 1.13 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.46 2jbw h LYS 325 CO 0.69 0.10 -0.92 -0.25 -2.00 0.00 0.00 179.45 177.07 2jbw n ASP 326 N -3.26 0.82 -4.77 7.07 8.00 -1.26 -4.57 116.55 118.59 2jbw n ASP 326 Ca 0.00 -0.74 -0.39 0.00 0.71 0.00 0.00 54.79 54.37 2jbw n ASP 326 Cb 0.34 0.84 -0.02 0.00 -0.02 0.00 0.00 41.12 42.26 2jbw n ASP 326 CO 0.00 0.00 0.00 -0.83 -0.39 0.00 0.00 177.20 175.98 2jbw s GLY 327 N -3.09 2.93 0.00 0.44 0.00 -0.94 -4.83 107.32 101.83 2jbw s GLY 327 Ca 0.08 1.07 0.00 0.00 0.00 0.00 0.00 44.72 45.87 2jbw s GLY 327 CO 0.83 1.64 0.00 2.09 0.00 0.00 0.00 173.10 177.65 2jbw n ASP 328 N 0.38 0.00 -4.68 1.64 5.75 -1.26 -1.05 116.55 117.33 2jbw n ASP 328 Ca 0.03 0.00 -0.46 0.00 -0.01 0.00 0.00 54.79 54.34 2jbw n ASP 328 Cb 0.45 0.00 -0.04 0.00 -1.03 0.00 0.00 41.12 40.49 2jbw n ASP 328 CO 0.00 0.00 0.00 1.57 -0.11 0.00 0.00 177.20 178.66 2jbw n HIS 329 N 0.00 2.37 -1.14 2.11 -0.00 -1.26 -0.80 115.22 116.50 2jbw n HIS 329 Ca 0.00 0.04 -0.05 0.00 -0.00 0.00 0.00 57.72 57.71 2jbw n HIS 329 Cb 0.00 -2.65 -0.02 0.00 -0.00 0.00 0.00 29.99 27.32 2jbw n HIS 329 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.34 176.34 2jbw h HIS 332 N -0.93 0.00 0.00 0.00 3.86 -1.78 -2.63 115.15 113.67 2jbw h HIS 332 Ca -0.44 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 58.77 2jbw h HIS 332 Cb 1.31 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.78 2jbw h HIS 332 CO 0.62 0.26 0.00 0.27 0.86 0.00 0.00 177.93 179.94 2jbw n ASN 333 N -3.72 0.00 -1.11 2.45 6.94 -1.26 -3.43 115.26 115.12 2jbw n ASN 333 Ca -0.01 -0.65 0.10 0.00 -0.02 0.00 0.00 54.58 54.00 2jbw n ASN 333 Cb 0.37 -0.09 0.25 0.00 -2.36 0.00 0.00 39.78 37.94 2jbw n ASN 333 CO 0.00 0.00 0.00 0.18 -1.03 0.00 0.00 177.26 176.41 2jbw n LEU 334 N -1.09 3.52 0.00 -4.53 4.77 -0.99 -5.02 117.00 113.66 2jbw n LEU 334 Ca 0.19 -1.81 0.00 0.00 -0.03 0.00 0.00 56.01 54.36 2jbw n LEU 334 Cb 0.14 -0.35 0.00 0.00 -2.33 0.00 0.00 43.42 40.88 2jbw n LEU 334 CO 0.18 0.84 0.00 0.61 -1.33 0.00 0.00 177.39 177.69 2jbw n GLY 335 N 1.34 -0.47 0.14 -0.72 0.00 -1.22 -4.23 105.19 100.02 2jbw n GLY 335 Ca 0.20 -1.10 0.13 0.00 0.00 0.00 0.00 46.02 45.25 2jbw n GLY 335 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 2jbw h ILE 336 N 0.00 0.00 0.05 -0.61 2.10 -1.93 -3.38 117.51 113.74 2jbw h ILE 336 Ca 0.00 -0.55 -0.00 0.00 1.08 0.00 0.00 64.86 65.39 2jbw h ILE 336 Cb 0.00 1.50 -0.00 0.00 -1.09 0.00 0.00 36.82 37.23 2jbw h ILE 336 CO 0.00 0.00 -0.04 -0.09 -1.08 0.00 0.00 178.15 176.94 2jbw h ARG 337 N 0.00 -0.09 -0.55 2.19 2.43 -1.97 -0.42 114.38 115.97 2jbw h ARG 337 Ca 0.00 0.01 0.08 0.00 -0.81 0.00 0.00 59.98 59.25 2jbw h ARG 337 Cb 0.72 0.02 -0.03 0.00 -0.42 0.00 0.00 29.97 30.26 2jbw h ARG 337 CO 0.00 -0.06 0.37 -1.35 -1.51 0.00 0.00 179.97 177.41 2jbw h PRO 338 N -0.10 0.42 -0.31 0.20 0.11 -1.84 -0.94 132.00 129.54 2jbw h PRO 338 Ca -0.00 -0.03 -0.07 0.00 0.11 0.00 0.00 66.00 66.02 2jbw h PRO 338 Cb 0.08 -0.09 -0.01 0.00 0.11 0.00 0.00 31.00 31.09 2jbw h PRO 338 CO -0.00 0.28 -0.07 0.00 -0.21 0.00 0.00 178.00 178.00 2jbw h ARG 339 N 0.43 0.59 -0.72 1.05 3.08 -1.50 -2.66 114.38 114.66 2jbw h ARG 339 Ca 0.24 -0.22 0.06 0.00 0.07 0.00 0.00 59.98 60.13 2jbw h ARG 339 Cb 0.40 -0.04 -0.04 0.00 0.08 0.00 0.00 29.97 30.37 2jbw h ARG 339 CO -0.07 0.78 0.48 -0.07 -1.07 0.00 0.00 179.97 180.02 2jbw h LEU 340 N 0.37 0.67 -1.47 3.04 3.38 -0.53 -2.06 115.31 118.71 2jbw h LEU 340 Ca 0.08 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.05 2jbw h LEU 340 Cb 0.55 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 41.16 2jbw h LEU 340 CO 0.03 0.43 0.00 -0.62 0.09 0.00 0.00 178.44 178.37 2jbw n GLU 341 N -4.48 0.32 0.00 1.13 -0.58 -0.41 -1.87 120.64 114.76 2jbw n GLU 341 Ca 0.11 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.85 2jbw n GLU 341 Cb 0.22 -1.24 0.00 0.00 -0.57 0.00 0.00 31.44 29.85 2jbw n GLU 341 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2jbw n ALA 343 N 0.57 0.00 0.14 0.62 0.00 -0.78 -2.07 120.51 118.99 2jbw n ALA 343 Ca 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 53.44 53.43 2jbw n ALA 343 Cb 0.12 0.00 0.22 0.00 0.00 0.00 0.00 19.45 19.79 2jbw n ALA 343 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.50 177.06 2jbw h ASP 344 N 0.00 0.06 -0.13 0.00 3.32 -1.64 -1.72 116.42 116.31 2jbw h ASP 344 Ca 0.00 -0.03 -0.15 0.00 0.02 0.00 0.00 57.03 56.87 2jbw h ASP 344 Cb 0.00 -0.02 0.01 0.00 0.22 0.00 0.00 39.33 39.54 2jbw h ASP 344 CO 0.00 0.58 -0.51 -0.25 -1.72 0.00 0.00 179.24 177.35 2jbw h TRP 345 N 0.05 0.76 -0.74 4.55 7.01 -1.67 -1.70 115.95 124.21 2jbw h TRP 345 Ca -0.00 -0.32 0.05 0.00 2.11 0.00 0.00 58.89 60.73 2jbw h TRP 345 Cb 0.95 -0.12 -0.04 0.00 -2.10 0.00 0.00 29.16 27.85 2jbw h TRP 345 CO 0.00 1.10 0.49 -0.07 -2.79 0.00 0.00 178.44 177.17 2jbw h LEU 346 N 0.20 0.73 -0.47 0.65 3.38 -1.83 -1.35 115.31 116.61 2jbw h LEU 346 Ca -0.03 -0.00 -0.03 0.00 0.09 0.00 0.00 57.88 57.91 2jbw h LEU 346 Cb 1.14 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 41.71 2jbw h LEU 346 CO 0.11 0.48 0.19 0.22 0.09 0.00 0.00 178.44 179.53 2jbw h TYR 347 N 0.83 0.72 -0.30 1.13 3.20 -1.15 0.59 116.97 122.00 2jbw h TYR 347 Ca 0.31 -0.06 -0.00 0.00 3.14 0.00 0.00 58.73 62.12 2jbw h TYR 347 Cb 0.16 -0.22 -0.01 0.00 1.54 0.00 0.00 36.73 38.20 2jbw h TYR 347 CO -0.00 0.61 0.17 -0.44 -1.64 0.00 0.00 178.16 176.87 2jbw h ASP 348 N 0.62 0.37 -0.11 -2.11 3.32 -0.83 -0.03 116.42 117.65 2jbw h ASP 348 Ca 0.16 -0.07 -0.22 0.00 0.02 0.00 0.00 57.03 56.91 2jbw h ASP 348 Cb 0.20 -0.09 0.01 0.00 0.22 0.00 0.00 39.33 39.67 2jbw h ASP 348 CO -0.01 0.34 -0.80 -0.37 -1.72 0.00 0.00 179.24 176.68 2jbw h VAL 349 N 0.38 1.29 0.00 -1.35 -1.51 -1.18 -3.25 116.25 110.63 2jbw h VAL 349 Ca 0.11 -2.01 -0.26 0.00 -1.23 0.00 0.00 66.70 63.31 2jbw h VAL 349 Cb 0.04 2.10 -0.05 0.00 -2.13 0.00 0.00 31.29 31.25 2jbw h VAL 349 CO -0.02 0.63 -2.26 0.18 -1.23 0.00 0.00 177.57 174.88 2jbw n LEU 350 N -3.96 0.00 -0.11 4.19 4.77 0.19 -4.69 117.00 117.39 2jbw n LEU 350 Ca -0.08 0.00 -0.19 0.00 -0.03 0.00 0.00 56.01 55.71 2jbw n LEU 350 Cb 0.76 0.35 -0.06 0.00 -2.33 0.00 0.00 43.42 42.14 2jbw n LEU 350 CO 0.53 0.35 -1.05 0.52 -1.33 0.00 0.00 177.39 176.41 2jbw n VAL 351 N -2.60 1.43 -2.42 4.08 0.31 -0.15 -4.78 118.33 114.21 2jbw n VAL 351 Ca -0.24 -0.13 -0.40 0.00 -0.01 0.00 0.00 64.34 63.56 2jbw n VAL 351 Cb 0.98 -2.04 -0.04 0.00 -0.91 0.00 0.00 33.84 31.84 2jbw n VAL 351 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2jbw s ALA 352 N -2.62 3.35 -0.69 3.52 0.00 -0.49 -4.88 121.76 119.95 2jbw s ALA 352 Ca -0.32 0.93 -0.05 0.00 0.00 0.00 0.00 51.96 52.53 2jbw s ALA 352 Cb 0.09 -3.35 -0.06 0.00 0.00 0.00 0.00 23.12 19.80 2jbw s ALA 352 CO 0.42 -0.27 2.04 0.41 0.00 0.00 0.00 175.76 178.37 2jbw n GLY 353 N 0.98 2.83 3.07 0.00 0.00 -1.26 -4.60 105.19 106.21 2jbw n GLY 353 Ca 0.00 -0.75 -0.32 0.00 0.00 0.00 0.00 46.02 44.95 2jbw n GLY 353 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2jbw s LYS 354 N 3.23 2.52 -0.55 1.61 2.20 -1.25 -5.07 119.74 122.43 2jbw s LYS 354 Ca 0.36 -0.94 -0.21 0.00 -0.36 0.00 0.00 55.97 54.82 2jbw s LYS 354 Cb 0.11 -2.57 0.06 0.00 -1.51 0.00 0.00 37.83 33.91 2jbw s LYS 354 CO -0.03 -0.35 0.78 0.21 -0.36 0.00 0.00 175.35 175.60 2jbw s LYS 355 N 1.28 3.17 0.00 4.03 2.47 -1.26 -4.46 119.74 124.98 2jbw s LYS 355 Ca 0.00 -0.74 -0.23 0.00 -1.56 0.00 0.00 55.97 53.43 2jbw s LYS 355 Cb -0.15 -4.12 -0.05 0.00 -1.46 0.00 0.00 37.83 32.04 2jbw s LYS 355 CO -0.10 -1.43 0.71 0.08 0.16 0.00 0.00 175.35 174.77 2jbw s VAL 356 N 3.25 4.86 0.34 4.02 1.01 -1.26 -5.06 120.40 127.56 2jbw s VAL 356 Ca 0.20 1.49 -0.12 0.00 0.00 0.00 0.00 61.98 63.55 2jbw s VAL 356 Cb -0.17 -4.05 -0.07 0.00 0.00 0.00 0.00 36.38 32.08 2jbw s VAL 356 CO 0.13 0.34 0.71 0.00 0.00 0.00 0.00 175.10 176.29 2jbw s ALA 357 N 0.15 3.39 -0.49 5.51 0.00 -1.26 -4.96 121.76 124.10 2jbw s ALA 357 Ca 0.37 -0.14 -0.27 0.00 0.00 0.00 0.00 51.96 51.92 2jbw s ALA 357 Cb -0.19 -2.66 -0.08 0.00 0.00 0.00 0.00 23.12 20.19 2jbw s ALA 357 CO 0.20 0.22 2.41 -0.35 0.00 0.00 0.00 175.76 178.25 2jbw n PRO 358 N -0.73 1.08 -1.36 0.00 -0.04 -1.26 -4.92 135.00 127.77 2jbw n PRO 358 Ca 0.02 0.05 0.00 0.00 -0.04 0.00 0.00 63.50 63.54 2jbw n PRO 358 Cb 0.53 -3.32 0.00 0.00 -0.04 0.00 0.00 33.50 30.68 2jbw n PRO 358 CO 0.00 0.00 0.00 -2.37 -0.04 0.00 0.00 175.50 173.09 2jbw n THR 359 N 7.95 0.00 0.00 0.52 5.66 -1.21 -5.00 114.28 122.20 2jbw n THR 359 Ca 0.38 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.38 2jbw n THR 359 Cb 0.51 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 69.29 2jbw n THR 359 CO 0.00 0.00 0.00 1.17 -3.05 0.00 0.00 175.07 173.19 2jbw n LYS 361 N 0.00 0.00 -0.65 1.09 4.81 0.68 -2.15 118.16 121.95 2jbw n LYS 361 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.44 2jbw n LYS 361 Cb 0.00 0.00 0.00 0.00 0.02 0.00 0.00 35.03 35.05 2jbw n LYS 361 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2jbw n GLY 362 N 0.00 0.66 3.04 3.14 0.00 -1.26 0.05 105.19 110.82 2jbw n GLY 362 Ca 0.00 -0.11 -0.13 0.00 0.00 0.00 0.00 46.02 45.78 2jbw n GLY 362 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 2jbw s TRP 363 N -2.00 -0.21 0.91 1.61 -0.11 -1.26 -4.32 118.94 113.56 2jbw s TRP 363 Ca 0.00 0.53 -0.11 0.00 1.22 0.00 0.00 56.10 57.74 2jbw s TRP 363 Cb 0.00 0.04 0.14 0.00 -1.50 0.00 0.00 33.47 32.15 2jbw s TRP 363 CO 0.00 -0.13 1.11 -1.25 -4.62 0.00 0.00 176.95 172.06 2jbw s PRO 364 N 0.46 1.11 1.26 5.86 0.04 -1.26 -5.10 135.00 137.37 2jbw s PRO 364 Ca -0.03 1.25 -0.17 0.00 0.04 0.00 0.00 61.00 62.09 2jbw s PRO 364 Cb -0.04 -1.76 0.31 0.00 0.04 0.00 0.00 34.50 33.05 2jbw s PRO 364 CO -0.02 -2.47 1.00 -0.48 0.04 0.00 0.00 177.00 175.06 2jbw s LEU 365 N -6.46 0.11 0.08 -3.56 2.34 -1.26 -4.97 118.68 104.96 2jbw s LEU 365 Ca 0.65 1.18 0.25 0.00 0.06 0.00 0.00 54.13 56.27 2jbw s LEU 365 Cb -0.21 -2.91 0.47 0.00 -0.56 0.00 0.00 46.19 42.98 2jbw s LEU 365 CO 0.58 -4.59 1.41 -0.62 -1.06 0.00 0.00 176.35 172.07 2jbw n GLU 366 N -5.15 0.19 0.00 1.48 -0.58 -1.26 -5.19 120.64 110.13 2jbw n GLU 366 Ca 0.07 0.06 0.00 0.00 -0.42 0.00 0.00 57.16 56.87 2jbw n GLU 366 Cb 0.57 -1.63 0.00 0.00 -0.57 0.00 0.00 31.44 29.81 2jbw n GLU 366 CO 0.00 0.00 0.00 1.58 -0.48 0.00 0.00 177.13 178.23