#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1jzw s ILE 4 N 0.00 1.63 -0.04 -1.44 1.01 -1.26 -3.90 121.20 117.20 1jzw s ILE 4 Ca 0.00 -0.95 0.05 0.00 0.00 0.00 0.00 60.65 59.76 1jzw s ILE 4 Cb 0.00 -1.37 -0.01 0.00 0.01 0.00 0.00 42.46 41.09 1jzw s ILE 4 CO 0.00 0.40 -0.19 -0.89 0.00 0.00 0.00 174.94 174.26 1jzw s THR 5 N -0.55 1.57 -0.09 2.92 2.01 0.27 -0.36 115.64 121.41 1jzw s THR 5 Ca 0.08 -0.81 0.03 0.00 0.31 0.00 0.00 61.69 61.29 1jzw s THR 5 Cb -0.08 -1.33 0.01 0.00 0.01 0.00 0.00 72.50 71.10 1jzw s THR 5 CO -0.00 0.45 -0.18 -0.51 -0.69 0.00 0.00 174.62 173.69 1jzw s ILE 6 N -0.15 1.57 -0.59 1.82 2.07 -0.35 -0.06 121.20 125.51 1jzw s ILE 6 Ca -0.00 -0.73 -0.24 0.00 -1.41 0.00 0.00 60.65 58.27 1jzw s ILE 6 Cb -0.11 -1.39 0.05 0.00 0.13 0.00 0.00 42.46 41.14 1jzw s ILE 6 CO 0.02 0.45 0.96 -0.31 -1.91 0.00 0.00 174.94 174.15 1jzw s TYR 7 N 0.57 2.73 -0.03 3.50 1.51 -0.02 -1.53 117.35 124.09 1jzw s TYR 7 Ca -0.15 -0.17 0.04 0.00 -1.01 0.00 0.00 57.07 55.78 1jzw s TYR 7 Cb -0.17 -4.16 -0.03 0.00 -0.11 0.00 0.00 41.96 37.50 1jzw s TYR 7 CO 0.05 -1.47 -0.14 -1.58 -1.11 0.00 0.00 175.55 171.30 1jzw s HIS 8 N 4.07 2.71 -0.30 2.71 2.46 -0.12 -3.15 115.29 123.67 1jzw s HIS 8 Ca 0.28 -0.15 0.03 0.00 0.47 0.00 0.00 55.06 55.69 1jzw s HIS 8 Cb -0.14 -1.60 0.08 0.00 -0.13 0.00 0.00 32.58 30.79 1jzw s HIS 8 CO 0.16 0.23 -0.01 1.21 -2.47 0.00 0.00 174.74 173.86 1jzw s ASN 9 N -0.92 4.54 0.63 9.88 3.84 -1.26 -3.91 114.94 127.74 1jzw s ASN 9 Ca 0.13 -1.78 0.35 0.00 0.21 0.00 0.00 52.86 51.76 1jzw s ASN 9 Cb -0.11 -1.52 1.93 0.00 -0.55 0.00 0.00 41.25 41.00 1jzw s ASN 9 CO 0.02 -0.30 2.16 -0.65 -2.79 0.00 0.00 177.10 175.54 1jzw h PRO 10 N 7.72 0.00 -2.91 0.43 0.11 -1.98 -3.41 132.00 131.96 1jzw h PRO 10 Ca -0.11 0.00 -0.71 0.00 0.11 0.00 0.00 66.00 65.30 1jzw h PRO 10 Cb 1.03 0.00 -0.04 0.00 0.11 0.00 0.00 31.00 32.10 1jzw h PRO 10 CO 0.49 0.00 3.16 0.00 -0.21 0.00 0.00 178.00 181.44 1jzw n ALA 11 N -2.14 7.08 0.00 -0.75 0.00 -1.26 -4.85 120.51 118.59 1jzw n ALA 11 Ca -0.01 -3.81 0.00 0.00 0.00 0.00 0.00 53.44 49.62 1jzw n ALA 11 Cb 0.24 -3.12 0.00 0.00 0.00 0.00 0.00 19.45 16.57 1jzw n ALA 11 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1jzw n GLY 13 N 2.81 0.00 0.27 0.00 0.00 -1.26 -5.07 105.19 101.93 1jzw n GLY 13 Ca 0.69 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 46.65 1jzw n GLY 13 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 1jzw h THR 14 N 0.00 1.20 -0.50 2.61 2.02 -1.94 0.24 112.91 116.55 1jzw h THR 14 Ca 0.00 -0.49 -0.11 0.00 0.77 0.00 0.00 66.41 66.58 1jzw h THR 14 Cb 0.99 0.35 -0.02 0.00 -1.74 0.00 0.00 68.15 67.74 1jzw h THR 14 CO 0.00 0.22 -0.12 -1.28 0.37 0.00 0.00 175.52 174.70 1jzw h SER 15 N 0.88 0.97 -0.21 4.18 0.87 -1.85 -1.28 113.55 117.12 1jzw h SER 15 Ca 0.23 -0.36 -0.02 0.00 -1.23 0.00 0.00 61.79 60.41 1jzw h SER 15 Cb 0.02 -0.27 -0.01 0.00 -0.44 0.00 0.00 62.40 61.71 1jzw h SER 15 CO -0.04 1.11 0.07 0.03 -0.53 0.00 0.00 176.83 177.47 1jzw h ARG 16 N 0.82 0.32 -0.98 2.24 3.08 -1.64 -1.48 114.38 116.74 1jzw h ARG 16 Ca 0.13 -0.07 0.02 0.00 0.07 0.00 0.00 59.98 60.13 1jzw h ARG 16 Cb 0.68 -0.05 -0.05 0.00 0.08 0.00 0.00 29.97 30.63 1jzw h ARG 16 CO 0.05 0.40 0.65 -0.91 -1.07 0.00 0.00 179.97 179.09 1jzw h ASN 17 N 0.18 1.10 -0.40 7.04 2.35 -0.48 -1.19 115.58 124.17 1jzw h ASN 17 Ca 0.07 -0.02 -0.00 0.00 -0.55 0.00 0.00 56.30 55.80 1jzw h ASN 17 Cb 0.21 -0.26 -0.02 0.00 0.05 0.00 0.00 38.32 38.30 1jzw h ASN 17 CO -0.00 0.77 0.25 0.74 -1.65 0.00 0.00 177.43 177.54 1jzw h THR 18 N 1.29 1.12 -0.65 2.81 2.02 -1.06 -0.55 112.91 117.89 1jzw h THR 18 Ca 0.38 -0.26 0.00 0.00 0.77 0.00 0.00 66.41 67.30 1jzw h THR 18 Cb -0.07 0.57 -0.03 0.00 -1.74 0.00 0.00 68.15 66.88 1jzw h THR 18 CO -0.10 0.12 0.41 0.25 0.37 0.00 0.00 175.52 176.57 1jzw h LEU 19 N 0.53 0.76 -0.86 2.58 5.85 -0.90 -0.21 115.31 123.07 1jzw h LEU 19 Ca 0.14 -0.04 -0.12 0.00 0.84 0.00 0.00 57.88 58.71 1jzw h LEU 19 Cb -0.02 -0.19 -0.01 0.00 0.37 0.00 0.00 40.66 40.81 1jzw h LEU 19 CO -0.03 0.57 -0.45 -0.33 -0.34 0.00 0.00 178.44 177.87 1jzw h GLU 20 N 0.88 0.27 -0.61 1.25 4.39 -0.99 -1.66 114.58 118.11 1jzw h GLU 20 Ca 0.23 -0.14 -0.09 0.00 0.34 0.00 0.00 59.36 59.71 1jzw h GLU 20 Cb -0.06 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 28.56 1jzw h GLU 20 CO -0.05 0.67 0.04 0.52 -1.16 0.00 0.00 179.01 179.04 1jzw h MET 21 N 0.22 1.04 -0.01 2.33 2.86 -0.36 0.10 114.93 121.11 1jzw h MET 21 Ca 0.02 -0.30 0.02 0.00 -2.06 0.00 0.00 59.70 57.38 1jzw h MET 21 Cb 0.88 -0.11 -0.03 0.00 0.06 0.00 0.00 31.60 32.40 1jzw h MET 21 CO 0.07 0.99 -0.15 0.82 1.06 0.00 0.00 176.91 179.70 1jzw h ILE 22 N 0.96 0.64 -0.57 -1.22 2.04 -0.75 -2.02 117.51 116.60 1jzw h ILE 22 Ca 0.18 0.00 0.06 0.00 1.00 0.00 0.00 64.86 66.10 1jzw h ILE 22 Cb 0.49 0.64 -0.03 0.00 -0.74 0.00 0.00 36.82 37.18 1jzw h ILE 22 CO 0.02 0.00 0.38 0.03 0.00 0.00 0.00 178.15 178.58 1jzw h ARG 23 N -0.24 0.52 0.00 2.37 3.08 -1.06 -1.14 114.38 117.91 1jzw h ARG 23 Ca 0.05 -0.03 0.00 0.00 0.07 0.00 0.00 59.98 60.07 1jzw h ARG 23 Cb 0.31 -0.12 0.00 0.00 0.08 0.00 0.00 29.97 30.24 1jzw h ARG 23 CO -0.15 0.35 0.00 -1.71 -1.07 0.00 0.00 179.97 177.39 1jzw n ASN 24 N -4.47 0.34 -0.33 7.04 4.05 0.00 -0.84 115.26 121.04 1jzw n ASN 24 Ca 0.08 0.57 0.14 0.00 0.45 0.00 0.00 54.58 55.82 1jzw n ASN 24 Cb 0.23 -0.65 0.54 0.00 1.23 0.00 0.00 39.78 41.13 1jzw n ASN 24 CO 0.00 0.00 0.00 -1.54 -3.05 0.00 0.00 177.26 172.67 1jzw n SER 25 N -1.86 1.12 0.00 1.20 3.41 -0.43 -0.13 113.62 116.92 1jzw n SER 25 Ca 0.03 -1.19 0.00 0.00 -0.26 0.00 0.00 58.87 57.46 1jzw n SER 25 Cb 0.23 0.03 0.00 0.00 -0.26 0.00 0.00 64.21 64.20 1jzw n SER 25 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1jzw n GLY 26 N 1.21 0.84 3.21 5.00 0.00 -0.02 -4.74 105.19 110.69 1jzw n GLY 26 Ca 0.17 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.97 1jzw n GLY 26 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1jzw s THR 27 N -2.01 1.41 -0.30 2.61 -4.23 -1.23 -5.04 115.64 106.85 1jzw s THR 27 Ca 0.00 -1.19 -0.19 0.00 -1.18 0.00 0.00 61.69 59.13 1jzw s THR 27 Cb 0.00 -1.26 -0.01 0.00 1.34 0.00 0.00 72.50 72.56 1jzw s THR 27 CO 0.00 0.04 0.57 -0.70 -0.54 0.00 0.00 174.62 173.99 1jzw s GLU 28 N -1.35 3.89 0.59 3.99 2.56 -1.26 -3.51 118.70 123.61 1jzw s GLU 28 Ca 0.04 0.20 -0.09 0.00 0.00 0.00 0.00 54.97 55.12 1jzw s GLU 28 Cb -0.09 -3.72 -0.04 0.00 2.00 0.00 0.00 34.13 32.28 1jzw s GLU 28 CO 0.02 -0.52 0.97 -1.25 -0.56 0.00 0.00 175.26 173.92 1jzw s PRO 29 N 2.47 3.54 0.07 4.30 0.04 -1.26 -4.82 135.00 139.33 1jzw s PRO 29 Ca 0.22 0.58 -0.31 0.00 0.04 0.00 0.00 61.00 61.53 1jzw s PRO 29 Cb -0.15 -2.16 -0.07 0.00 0.04 0.00 0.00 34.50 32.16 1jzw s PRO 29 CO 0.11 -0.50 1.37 0.99 0.04 0.00 0.00 177.00 179.02 1jzw s THR 30 N -3.07 3.54 -0.23 1.26 2.01 0.51 -4.92 115.64 114.75 1jzw s THR 30 Ca 0.53 1.06 -0.06 0.00 0.31 0.00 0.00 61.69 63.53 1jzw s THR 30 Cb -0.11 -3.68 -0.02 0.00 0.01 0.00 0.00 72.50 68.70 1jzw s THR 30 CO 0.51 0.05 0.03 -0.63 -0.69 0.00 0.00 174.62 173.90 1jzw s ILE 31 N 1.58 4.08 -0.27 1.82 1.01 -1.26 -1.21 121.20 126.94 1jzw s ILE 31 Ca 0.64 -0.26 -0.05 0.00 0.00 0.00 0.00 60.65 60.98 1jzw s ILE 31 Cb -0.34 -2.88 0.01 0.00 0.01 0.00 0.00 42.46 39.26 1jzw s ILE 31 CO 0.29 0.38 0.03 -0.63 0.00 0.00 0.00 174.94 175.01 1jzw s ILE 32 N 1.35 3.60 -1.10 2.92 1.01 -0.58 -4.99 121.20 123.41 1jzw s ILE 32 Ca 0.05 -0.77 -0.21 0.00 0.00 0.00 0.00 60.65 59.71 1jzw s ILE 32 Cb -0.15 -2.83 0.06 0.00 0.01 0.00 0.00 42.46 39.55 1jzw s ILE 32 CO 0.02 0.14 1.52 -0.76 0.00 0.00 0.00 174.94 175.86 1jzw s LEU 33 N 1.45 3.68 0.59 2.97 1.43 -1.26 -0.94 118.68 126.59 1jzw s LEU 33 Ca 0.02 -1.77 0.35 0.00 -1.03 0.00 0.00 54.13 51.70 1jzw s LEU 33 Cb -0.17 -2.56 1.86 0.00 0.03 0.00 0.00 46.19 45.35 1jzw s LEU 33 CO -0.00 -1.39 2.20 0.10 0.23 0.00 0.00 176.35 177.50 1jzw h TYR 34 N 9.11 0.00 0.00 0.29 -0.00 -1.76 0.23 116.97 124.83 1jzw h TYR 34 Ca 0.27 0.00 -0.07 0.00 0.00 0.00 0.00 58.73 58.93 1jzw h TYR 34 Cb 0.97 0.00 -0.01 0.00 0.00 0.00 0.00 36.73 37.69 1jzw h TYR 34 CO 1.31 0.04 -0.34 -0.07 -0.00 0.00 0.00 178.16 179.11 1jzw h LEU 35 N 0.00 0.00 0.02 0.10 3.38 -1.88 -2.57 115.31 114.37 1jzw h LEU 35 Ca -0.00 0.00 -0.37 0.00 0.09 0.00 0.00 57.88 57.60 1jzw h LEU 35 Cb 0.18 0.00 -0.06 0.00 0.09 0.00 0.00 40.66 40.87 1jzw h LEU 35 CO 0.00 0.34 -2.31 -0.62 0.09 0.00 0.00 178.44 175.94 1jzw n GLU 36 N -4.08 0.68 -3.24 1.13 1.02 -0.54 -4.74 120.64 110.88 1jzw n GLU 36 Ca -0.02 0.15 -0.25 0.00 -0.02 0.00 0.00 57.16 57.02 1jzw n GLU 36 Cb 0.38 -1.58 -0.06 0.00 -0.02 0.00 0.00 31.44 30.16 1jzw n GLU 36 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 1jzw n ASN 37 N -3.18 2.30 -4.74 1.62 3.02 0.69 -5.09 115.26 109.89 1jzw n ASN 37 Ca -0.38 -3.18 -0.31 0.00 -0.03 0.00 0.00 54.58 50.68 1jzw n ASN 37 Cb 1.04 -0.64 0.11 0.00 -0.61 0.00 0.00 39.78 39.68 1jzw n ASN 37 CO 0.00 0.00 0.00 -2.16 -2.62 0.00 0.00 177.26 172.48 1jzw s PRO 38 N -2.21 2.00 0.75 3.52 0.04 -0.97 -4.36 135.00 133.76 1jzw s PRO 38 Ca 0.40 1.32 -0.13 0.00 0.04 0.00 0.00 61.00 62.62 1jzw s PRO 38 Cb 0.20 -1.86 0.05 0.00 0.04 0.00 0.00 34.50 32.94 1jzw s PRO 38 CO -0.07 -1.86 1.15 -1.25 0.04 0.00 0.00 177.00 175.00 1jzw s PRO 39 N -4.70 2.18 1.03 0.56 0.04 -1.26 -5.02 135.00 127.83 1jzw s PRO 39 Ca 0.64 1.50 -0.12 0.00 0.04 0.00 0.00 61.00 63.06 1jzw s PRO 39 Cb -0.19 -1.86 0.20 0.00 0.04 0.00 0.00 34.50 32.69 1jzw s PRO 39 CO 0.54 -1.75 1.08 -1.54 0.04 0.00 0.00 177.00 175.38 1jzw s SER 40 N -2.56 2.34 0.12 6.66 1.04 -1.26 -4.74 113.70 115.30 1jzw s SER 40 Ca 0.68 1.24 -0.21 0.00 0.48 0.00 0.00 55.95 58.14 1jzw s SER 40 Cb -0.23 -1.92 -0.07 0.00 0.10 0.00 0.00 66.02 63.90 1jzw s SER 40 CO 0.48 -3.31 1.72 -0.09 0.98 0.00 0.00 173.24 173.01 1jzw h ARG 41 N -2.02 -0.00 -0.53 4.02 2.43 -1.98 0.95 114.38 117.25 1jzw h ARG 41 Ca -0.56 0.00 0.07 0.00 -0.81 0.00 0.00 59.98 58.68 1jzw h ARG 41 Cb 1.33 0.00 -0.06 0.00 -0.42 0.00 0.00 29.97 30.82 1jzw h ARG 41 CO 0.56 -0.00 0.21 -0.44 -1.51 0.00 0.00 179.97 178.80 1jzw h ASP 42 N -0.00 0.25 -0.66 -3.80 3.32 -2.00 0.48 116.42 114.00 1jzw h ASP 42 Ca 0.07 0.05 -0.07 0.00 0.02 0.00 0.00 57.03 57.10 1jzw h ASP 42 Cb 0.10 0.02 -0.03 0.00 0.22 0.00 0.00 39.33 39.65 1jzw h ASP 42 CO -0.14 0.17 0.13 -0.33 -1.72 0.00 0.00 179.24 177.34 1jzw h GLU 43 N 0.41 1.10 -0.37 3.56 5.08 -1.82 -1.81 114.58 120.73 1jzw h GLU 43 Ca 0.25 -0.28 -0.12 0.00 -1.00 0.00 0.00 59.36 58.21 1jzw h GLU 43 Cb 0.25 -0.14 -0.01 0.00 0.50 0.00 0.00 28.75 29.35 1jzw h GLU 43 CO -0.23 0.99 -0.23 1.25 -1.00 0.00 0.00 179.01 179.78 1jzw h LEU 44 N 1.03 0.85 -1.04 1.33 5.85 -0.05 0.13 115.31 123.41 1jzw h LEU 44 Ca 0.21 -0.43 0.07 0.00 0.84 0.00 0.00 57.88 58.57 1jzw h LEU 44 Cb 0.41 -0.24 -0.07 0.00 0.37 0.00 0.00 40.66 41.14 1jzw h LEU 44 CO 0.01 1.09 0.64 0.58 -0.34 0.00 0.00 178.44 180.42 1jzw h VAL 45 N 0.61 1.07 -0.25 1.05 2.07 -0.76 -0.93 116.25 119.10 1jzw h VAL 45 Ca 0.08 -0.39 -0.07 0.00 0.82 0.00 0.00 66.70 67.14 1jzw h VAL 45 Cb 0.80 -0.16 -0.01 0.00 -1.52 0.00 0.00 31.29 30.40 1jzw h VAL 45 CO 0.07 0.21 -0.10 0.50 0.02 0.00 0.00 177.57 178.27 1jzw h LYS 46 N 1.13 0.51 -0.30 1.57 3.64 -0.87 -0.31 116.57 121.94 1jzw h LYS 46 Ca 0.43 -0.21 0.05 0.00 -1.27 0.00 0.00 60.65 59.64 1jzw h LYS 46 Cb 0.20 -0.02 -0.04 0.00 -0.41 0.00 0.00 32.23 31.96 1jzw h LYS 46 CO -0.17 0.76 0.02 -0.07 -2.27 0.00 0.00 179.45 177.71 1jzw h LEU 47 N 0.25 -0.08 -0.34 5.20 3.38 -0.39 0.15 115.31 123.48 1jzw h LEU 47 Ca 0.06 0.06 0.00 0.00 0.09 0.00 0.00 57.88 58.09 1jzw h LEU 47 Cb 0.59 0.10 -0.02 0.00 0.09 0.00 0.00 40.66 41.42 1jzw h LEU 47 CO 0.03 -0.01 0.22 0.40 0.09 0.00 0.00 178.44 179.17 1jzw h ILE 48 N 0.11 1.10 -0.82 1.22 2.04 -1.02 -0.01 117.51 120.13 1jzw h ILE 48 Ca 0.14 -0.22 -0.03 0.00 1.00 0.00 0.00 64.86 65.75 1jzw h ILE 48 Cb 0.18 0.64 -0.04 0.00 -0.74 0.00 0.00 36.82 36.86 1jzw h ILE 48 CO -0.22 0.10 0.41 0.00 0.00 0.00 0.00 178.15 178.44 1jzw h ALA 49 N 1.10 1.17 0.00 1.87 0.00 -0.30 -2.15 119.26 120.95 1jzw h ALA 49 Ca 0.12 -0.15 -0.07 0.00 0.00 0.00 0.00 54.91 54.82 1jzw h ALA 49 Cb -0.02 -0.33 -0.01 0.00 0.00 0.00 0.00 17.79 17.43 1jzw h ALA 49 CO -0.02 0.64 -0.33 -0.44 0.00 0.00 0.00 179.25 179.10 1jzw h ASP 50 N 1.17 0.00 1.31 0.00 3.45 -0.13 -2.94 116.42 119.27 1jzw h ASP 50 Ca 0.29 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.75 1jzw h ASP 50 Cb 0.09 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 38.86 1jzw h ASP 50 CO -0.04 0.33 0.00 0.24 -1.57 0.00 0.00 179.24 178.20 1jzw h MET 51 N 0.00 0.00 -6.19 3.56 2.86 -0.33 -3.40 114.93 111.43 1jzw h MET 51 Ca -0.00 0.00 -0.46 0.00 -2.06 0.00 0.00 59.70 57.18 1jzw h MET 51 Cb 0.78 0.00 0.01 0.00 0.06 0.00 0.00 31.60 32.45 1jzw h MET 51 CO 0.04 0.00 -0.74 0.41 1.06 0.00 0.00 176.91 177.68 1jzw n GLY 52 N 0.80 -0.50 3.58 8.32 0.00 -1.11 -4.81 105.19 111.47 1jzw n GLY 52 Ca 0.04 0.21 -0.26 0.00 0.00 0.00 0.00 46.02 46.00 1jzw n GLY 52 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1jzw s ILE 53 N -3.32 1.78 0.68 -0.61 -4.36 -1.25 -5.11 121.20 109.01 1jzw s ILE 53 Ca 0.61 -2.00 -0.11 0.00 -0.26 0.00 0.00 60.65 58.89 1jzw s ILE 53 Cb -0.30 -2.93 0.00 0.00 1.25 0.00 0.00 42.46 40.48 1jzw s ILE 53 CO 0.81 0.00 1.06 -0.94 0.24 0.00 0.00 174.94 176.10 1jzw s SER 54 N -3.66 5.53 0.22 4.36 1.04 -1.26 -4.83 113.70 115.10 1jzw s SER 54 Ca 0.35 1.52 -0.08 0.00 0.48 0.00 0.00 55.95 58.22 1jzw s SER 54 Cb 0.10 -2.43 0.27 0.00 0.10 0.00 0.00 66.02 64.06 1jzw s SER 54 CO 0.17 -1.33 1.80 0.58 0.98 0.00 0.00 173.24 175.44 1jzw h VAL 55 N -0.64 0.94 -0.14 5.02 2.07 -1.95 -2.56 116.25 119.00 1jzw h VAL 55 Ca -0.44 -0.24 -0.06 0.00 0.82 0.00 0.00 66.70 66.78 1jzw h VAL 55 Cb 1.21 0.20 -0.01 0.00 -1.52 0.00 0.00 31.29 31.16 1jzw h VAL 55 CO 0.59 0.13 -0.19 -0.09 0.02 0.00 0.00 177.57 178.02 1jzw h ARG 56 N 0.69 0.23 0.00 1.57 2.43 -1.94 -0.77 114.38 116.58 1jzw h ARG 56 Ca 0.32 -0.06 -0.01 0.00 -0.81 0.00 0.00 59.98 59.42 1jzw h ARG 56 Cb 0.23 -0.03 -0.00 0.00 -0.42 0.00 0.00 29.97 29.76 1jzw h ARG 56 CO -0.20 0.42 -0.03 0.00 -1.51 0.00 0.00 179.97 178.65 1jzw h ALA 57 N 1.59 1.10 0.00 2.80 0.00 -1.82 -1.58 119.26 121.35 1jzw h ALA 57 Ca 0.04 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.92 1jzw h ALA 57 Cb 0.47 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.25 1jzw h ALA 57 CO 0.03 0.04 0.00 1.25 0.00 0.00 0.00 179.25 180.57 1jzw h LEU 58 N 0.00 0.00 -9.52 0.00 5.85 -1.10 -3.46 115.31 107.08 1jzw h LEU 58 Ca -0.00 0.00 -0.53 0.00 0.84 0.00 0.00 57.88 58.19 1jzw h LEU 58 Cb 0.22 0.00 0.02 0.00 0.37 0.00 0.00 40.66 41.28 1jzw h LEU 58 CO 0.00 0.00 0.79 -0.76 -0.34 0.00 0.00 178.44 178.14 1jzw s LEU 59 N -4.85 4.36 -0.10 2.25 1.43 -0.60 -0.19 118.68 120.98 1jzw s LEU 59 Ca 0.10 2.35 -0.28 0.00 -1.03 0.00 0.00 54.13 55.27 1jzw s LEU 59 Cb 0.11 -3.58 -0.02 0.00 0.03 0.00 0.00 46.19 42.73 1jzw s LEU 59 CO 0.60 -0.71 0.93 -0.60 0.23 0.00 0.00 176.35 176.80 1jzw s ARG 60 N 1.47 4.42 0.70 1.70 3.52 -0.18 -4.79 118.95 125.79 1jzw s ARG 60 Ca 0.66 1.26 -0.08 0.00 -0.13 0.00 0.00 55.73 57.44 1jzw s ARG 60 Cb -0.37 -3.53 0.04 0.00 -1.56 0.00 0.00 34.95 29.54 1jzw s ARG 60 CO 0.30 -0.23 1.04 0.15 -0.81 0.00 0.00 175.30 175.74 1jzw s LYS 61 N 1.74 2.45 -0.72 5.12 1.02 -1.26 -4.44 119.74 123.65 1jzw s LYS 61 Ca 0.46 0.02 -0.01 0.00 0.02 0.00 0.00 55.97 56.45 1jzw s LYS 61 Cb -0.18 -2.12 0.00 0.00 -0.52 0.00 0.00 37.83 35.01 1jzw s LYS 61 CO 0.18 -1.15 0.14 0.09 -0.92 0.00 0.00 175.35 173.70 1jzw n ASN 62 N -2.94 -3.33 -4.22 2.83 3.02 -1.26 -4.99 115.26 104.36 1jzw n ASN 62 Ca 0.07 -0.07 -0.18 0.00 -0.03 0.00 0.00 54.58 54.37 1jzw n ASN 62 Cb 0.59 -2.42 -0.11 0.00 -0.61 0.00 0.00 39.78 37.23 1jzw n ASN 62 CO 0.00 0.00 0.00 0.68 -2.62 0.00 0.00 177.26 175.32 1jzw s VAL 63 N -2.64 1.25 0.15 2.41 -7.23 -1.26 -5.04 120.40 108.04 1jzw s VAL 63 Ca 0.07 -1.60 -0.22 0.00 -1.81 0.00 0.00 61.98 58.42 1jzw s VAL 63 Cb -0.03 -1.40 0.04 0.00 0.56 0.00 0.00 36.38 35.55 1jzw s VAL 63 CO 0.08 -0.37 1.63 -0.08 -0.31 0.00 0.00 175.10 176.06 1jzw h GLU 64 N 3.74 -0.21 -0.30 4.82 4.81 -1.96 -1.56 114.58 123.92 1jzw h GLU 64 Ca -0.40 0.01 -0.04 0.00 -0.13 0.00 0.00 59.36 58.81 1jzw h GLU 64 Cb 1.19 0.05 -0.02 0.00 0.63 0.00 0.00 28.75 30.60 1jzw h GLU 64 CO 0.48 -0.14 0.02 -1.00 -0.73 0.00 0.00 179.01 177.64 1jzw h PRO 65 N -0.22 0.44 -0.47 0.92 0.13 -1.97 0.22 132.00 131.05 1jzw h PRO 65 Ca 0.15 -0.08 -0.01 0.00 -0.87 0.00 0.00 66.00 65.18 1jzw h PRO 65 Cb 0.44 -0.07 -0.02 0.00 0.13 0.00 0.00 31.00 31.48 1jzw h PRO 65 CO -0.40 0.45 0.24 -0.92 -0.23 0.00 0.00 178.00 177.15 1jzw h TYR 66 N 0.43 0.66 0.46 1.56 5.03 -1.61 -0.24 116.97 123.27 1jzw h TYR 66 Ca 0.10 -0.03 -0.02 0.00 2.58 0.00 0.00 58.73 61.36 1jzw h TYR 66 Cb 0.25 -0.21 0.00 0.00 1.55 0.00 0.00 36.73 38.32 1jzw h TYR 66 CO 0.01 0.52 -0.22 0.93 -1.32 0.00 0.00 178.16 178.08 1jzw h GLU 67 N 0.62 -0.59 0.00 1.82 5.08 -1.20 -1.90 114.58 118.41 1jzw h GLU 67 Ca 0.16 0.04 -0.12 0.00 -1.00 0.00 0.00 59.36 58.45 1jzw h GLU 67 Cb 0.09 0.14 -0.02 0.00 0.50 0.00 0.00 28.75 29.46 1jzw h GLU 67 CO -0.02 -0.34 -0.55 1.96 -1.00 0.00 0.00 179.01 179.06 1jzw h GLN 68 N -0.74 0.00 -0.08 2.33 4.20 -0.91 -2.60 115.11 117.31 1jzw h GLN 68 Ca -0.06 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.65 1jzw h GLN 68 Cb 0.53 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.31 1jzw h GLN 68 CO 0.10 0.55 0.00 1.28 -0.67 0.00 0.00 178.83 180.10 1jzw n LEU 69 N -3.27 0.98 -0.91 1.46 4.77 -0.11 -4.93 117.00 115.00 1jzw n LEU 69 Ca 0.02 -0.40 -0.10 0.00 -0.03 0.00 0.00 56.01 55.50 1jzw n LEU 69 Cb 0.74 -0.05 -0.03 0.00 -2.33 0.00 0.00 43.42 41.75 1jzw n LEU 69 CO 0.41 0.20 -0.11 0.61 -1.33 0.00 0.00 177.39 177.17 1jzw n GLY 70 N 1.01 0.80 0.02 -0.72 0.00 -0.98 -4.89 105.19 100.42 1jzw n GLY 70 Ca 0.16 -0.52 0.08 0.00 0.00 0.00 0.00 46.02 45.74 1jzw n GLY 70 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1jzw n LEU 71 N -1.28 0.09 0.27 0.99 4.77 -0.72 -1.79 117.00 119.33 1jzw n LEU 71 Ca -0.11 0.52 0.14 0.00 -0.03 0.00 0.00 56.01 56.53 1jzw n LEU 71 Cb 0.42 -0.51 0.84 0.00 -2.33 0.00 0.00 43.42 41.84 1jzw n LEU 71 CO 0.15 -0.28 1.12 0.00 -1.33 0.00 0.00 177.39 177.05 1jzw h ALA 72 N 2.49 1.69 -2.32 -1.18 0.00 -1.91 -3.43 119.26 114.60 1jzw h ALA 72 Ca 0.00 -0.00 -0.49 0.00 0.00 0.00 0.00 54.91 54.42 1jzw h ALA 72 Cb 0.28 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 18.04 1jzw h ALA 72 CO 0.00 -0.04 0.16 -1.21 0.00 0.00 0.00 179.25 178.16 1jzw s GLU 73 N -4.75 4.15 -1.41 0.00 2.02 -0.74 -4.94 118.70 113.03 1jzw s GLU 73 Ca -0.05 0.85 -0.11 0.00 0.02 0.00 0.00 54.97 55.68 1jzw s GLU 73 Cb 0.16 -2.51 0.07 0.00 0.10 0.00 0.00 34.13 31.95 1jzw s GLU 73 CO 0.58 0.19 2.21 -3.47 0.02 0.00 0.00 175.26 174.78 1jzw n ASP 74 N -0.10 5.18 -0.77 -0.19 4.64 -1.26 -4.34 116.55 119.71 1jzw n ASP 74 Ca 0.03 -2.92 0.04 0.00 -1.38 0.00 0.00 54.79 50.55 1jzw n ASP 74 Cb 0.53 -1.56 0.05 0.00 -1.04 0.00 0.00 41.12 39.10 1jzw n ASP 74 CO 0.00 0.00 0.00 0.29 -0.82 0.00 0.00 177.20 176.67 1jzw n LYS 75 N 4.69 0.39 -4.60 -0.67 5.02 -1.26 -5.06 118.16 116.67 1jzw n LYS 75 Ca 0.52 -1.85 -0.24 0.00 -2.02 0.00 0.00 58.31 54.72 1jzw n LYS 75 Cb 0.35 -0.63 -0.16 0.00 -0.02 0.00 0.00 35.03 34.57 1jzw n LYS 75 CO 0.00 0.00 0.00 -0.06 -0.52 0.00 0.00 177.40 176.82 1jzw s PHE 76 N -0.84 1.36 0.79 2.13 0.40 -1.26 -5.13 117.98 115.44 1jzw s PHE 76 Ca 0.21 -0.42 -0.11 0.00 -0.60 0.00 0.00 56.93 56.01 1jzw s PHE 76 Cb 0.22 -0.96 0.07 0.00 0.51 0.00 0.00 43.02 42.85 1jzw s PHE 76 CO -0.06 -0.18 1.09 0.95 0.70 0.00 0.00 175.22 177.72 1jzw s THR 77 N 0.31 3.23 0.24 0.64 -4.23 -1.26 -4.84 115.64 109.73 1jzw s THR 77 Ca -0.07 0.40 -0.05 0.00 -1.18 0.00 0.00 61.69 60.79 1jzw s THR 77 Cb -0.12 -3.04 0.20 0.00 1.34 0.00 0.00 72.50 70.88 1jzw s THR 77 CO 0.02 -0.52 1.76 0.44 -0.54 0.00 0.00 174.62 175.78 1jzw h ASP 78 N -1.12 0.40 0.20 3.99 3.45 -2.00 -1.48 116.42 119.85 1jzw h ASP 78 Ca -0.46 0.09 -0.09 0.00 0.43 0.00 0.00 57.03 56.99 1jzw h ASP 78 Cb 1.25 0.03 -0.01 0.00 -0.56 0.00 0.00 39.33 40.04 1jzw h ASP 78 CO 0.56 0.19 -0.33 0.44 -1.57 0.00 0.00 179.24 178.53 1jzw h ASP 79 N 0.54 0.21 -0.63 6.45 5.19 -1.99 -0.70 116.42 125.48 1jzw h ASP 79 Ca 0.39 -0.07 -0.05 0.00 -0.62 0.00 0.00 57.03 56.68 1jzw h ASP 79 Cb 0.52 -0.06 -0.03 0.00 0.18 0.00 0.00 39.33 39.94 1jzw h ASP 79 CO -0.34 0.54 0.19 1.56 -3.12 0.00 0.00 179.24 178.07 1jzw h GLN 80 N 0.18 0.99 -0.69 3.56 4.20 -1.83 -1.40 115.11 120.12 1jzw h GLN 80 Ca 0.02 -0.22 -0.07 0.00 0.06 0.00 0.00 58.65 58.44 1jzw h GLN 80 Cb 0.68 -0.14 -0.03 0.00 0.30 0.00 0.00 27.48 28.30 1jzw h GLN 80 CO 0.05 0.88 0.15 -0.07 -0.67 0.00 0.00 178.83 179.17 1jzw h LEU 81 N 0.92 1.06 -0.56 1.46 3.38 -0.70 -0.66 115.31 120.20 1jzw h LEU 81 Ca 0.20 -0.24 0.05 0.00 0.09 0.00 0.00 57.88 57.98 1jzw h LEU 81 Cb 0.31 -0.28 -0.05 0.00 0.09 0.00 0.00 40.66 40.73 1jzw h LEU 81 CO -0.00 1.03 0.30 0.40 0.09 0.00 0.00 178.44 180.26 1jzw h ILE 82 N 1.05 0.97 -0.23 1.22 2.04 -1.01 -1.03 117.51 120.51 1jzw h ILE 82 Ca 0.22 -0.20 -0.07 0.00 1.00 0.00 0.00 64.86 65.81 1jzw h ILE 82 Cb 0.39 0.35 -0.01 0.00 -0.74 0.00 0.00 36.82 36.81 1jzw h ILE 82 CO 0.01 0.10 -0.18 0.44 0.00 0.00 0.00 178.15 178.52 1jzw h ASP 83 N 0.57 0.40 -0.50 1.72 3.45 -1.02 -0.95 116.42 120.08 1jzw h ASP 83 Ca 0.25 -0.11 -0.05 0.00 0.43 0.00 0.00 57.03 57.55 1jzw h ASP 83 Cb 0.14 -0.11 -0.02 0.00 -0.56 0.00 0.00 39.33 38.78 1jzw h ASP 83 CO -0.16 0.60 0.12 -0.26 -1.57 0.00 0.00 179.24 177.96 1jzw h PHE 84 N 0.37 0.85 -0.61 4.55 0.04 -0.65 -0.75 116.94 120.74 1jzw h PHE 84 Ca 0.07 -0.10 0.03 0.00 2.80 0.00 0.00 57.97 60.76 1jzw h PHE 84 Cb 0.53 -0.24 -0.04 0.00 2.20 0.00 0.00 35.95 38.40 1jzw h PHE 84 CO 0.01 0.76 0.37 0.52 -0.60 0.00 0.00 178.31 179.37 1jzw h MET 85 N 0.69 0.70 -0.18 1.51 2.86 -0.64 0.21 114.93 120.08 1jzw h MET 85 Ca 0.16 -0.04 -0.09 0.00 -2.06 0.00 0.00 59.70 57.66 1jzw h MET 85 Cb 0.34 -0.16 -0.01 0.00 0.06 0.00 0.00 31.60 31.83 1jzw h MET 85 CO 0.00 0.47 -0.29 -0.07 1.06 0.00 0.00 176.91 178.07 1jzw h LEU 86 N 0.72 0.36 0.00 1.22 3.38 -0.99 -2.67 115.31 117.33 1jzw h LEU 86 Ca 0.25 -0.13 0.00 0.00 0.09 0.00 0.00 57.88 58.09 1jzw h LEU 86 Cb 0.04 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 40.69 1jzw h LEU 86 CO -0.11 0.65 -0.28 1.56 0.09 0.00 0.00 178.44 180.35 1jzw h GLN 87 N 0.32 0.00 -2.25 1.13 1.08 -0.36 -3.39 115.11 111.64 1jzw h GLN 87 Ca 0.04 0.00 -0.58 0.00 -1.45 0.00 0.00 58.65 56.66 1jzw h GLN 87 Cb 0.68 0.00 -0.39 0.00 -0.05 0.00 0.00 27.48 27.72 1jzw h GLN 87 CO 0.05 0.00 -0.98 0.72 -0.95 0.00 0.00 178.83 177.67 1jzw n HIS 88 N -2.39 -0.12 0.30 2.96 8.25 0.67 -5.02 115.22 119.88 1jzw n HIS 88 Ca 0.04 -3.53 0.18 0.00 -0.26 0.00 0.00 57.72 54.15 1jzw n HIS 88 Cb 0.46 -0.10 0.96 0.00 1.12 0.00 0.00 29.99 32.43 1jzw n HIS 88 CO 0.00 0.00 0.00 -1.35 0.64 0.00 0.00 176.34 175.63 1jzw h PRO 89 N 4.85 0.00 0.00 -0.41 0.11 -1.68 -1.47 132.00 133.40 1jzw h PRO 89 Ca 0.18 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.29 1jzw h PRO 89 Cb 0.87 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.98 1jzw h PRO 89 CO 0.46 0.00 0.00 1.51 -0.21 0.00 0.00 178.00 179.76 1jzw n ILE 90 N -3.16 1.16 0.39 4.15 3.06 -1.26 -0.98 119.36 122.71 1jzw n ILE 90 Ca -0.01 0.46 0.13 0.00 -2.50 0.00 0.00 62.75 60.84 1jzw n ILE 90 Cb 0.27 -1.41 0.51 0.00 0.54 0.00 0.00 39.64 39.56 1jzw n ILE 90 CO 0.00 0.00 0.00 -0.07 -2.50 0.00 0.00 176.55 173.98 1jzw h LEU 91 N 0.00 0.00 -8.96 9.51 3.38 -1.57 -3.43 115.31 114.25 1jzw h LEU 91 Ca 0.00 0.00 -0.59 0.00 0.09 0.00 0.00 57.88 57.38 1jzw h LEU 91 Cb 0.15 0.00 -0.08 0.00 0.09 0.00 0.00 40.66 40.82 1jzw h LEU 91 CO 0.00 0.00 0.65 -0.63 0.09 0.00 0.00 178.44 178.55 1jzw s ILE 92 N -3.37 4.66 0.98 1.22 1.01 -0.16 -1.01 121.20 124.53 1jzw s ILE 92 Ca 0.04 1.55 -0.12 0.00 0.00 0.00 0.00 60.65 62.12 1jzw s ILE 92 Cb 0.09 -4.28 0.18 0.00 0.01 0.00 0.00 42.46 38.46 1jzw s ILE 92 CO 0.48 -0.34 1.08 0.21 0.00 0.00 0.00 174.94 176.37 1jzw s ASN 93 N 1.57 2.68 0.08 3.58 3.84 0.73 -4.79 114.94 122.63 1jzw s ASN 93 Ca 0.40 1.39 -0.11 0.00 0.21 0.00 0.00 52.86 54.75 1jzw s ASN 93 Cb -0.13 -2.07 0.01 0.00 -0.55 0.00 0.00 41.25 38.50 1jzw s ASN 93 CO 0.13 -3.12 0.25 0.00 -2.79 0.00 0.00 177.10 171.56 1jzw s ARG 94 N -4.86 0.86 0.22 0.43 3.03 -1.26 -4.50 118.95 112.86 1jzw s ARG 94 Ca 0.65 -0.78 -0.17 0.00 2.03 0.00 0.00 55.73 57.46 1jzw s ARG 94 Cb -0.20 0.36 -0.08 0.00 -1.03 0.00 0.00 34.95 34.00 1jzw s ARG 94 CO 0.58 -0.28 0.66 -1.25 -1.13 0.00 0.00 175.30 173.89 1jzw s PRO 95 N -3.43 4.11 -0.06 3.89 0.04 -1.26 -4.73 135.00 133.56 1jzw s PRO 95 Ca 0.01 0.69 -0.16 0.00 0.04 0.00 0.00 61.00 61.58 1jzw s PRO 95 Cb 0.02 -2.81 -0.05 0.00 0.04 0.00 0.00 34.50 31.71 1jzw s PRO 95 CO -0.09 0.38 0.44 0.42 0.04 0.00 0.00 177.00 178.19 1jzw s ILE 96 N -1.60 5.11 -0.06 0.56 1.01 -1.19 -0.93 121.20 124.10 1jzw s ILE 96 Ca 0.43 0.88 0.05 0.00 0.00 0.00 0.00 60.65 62.02 1jzw s ILE 96 Cb -0.15 -3.76 -0.00 0.00 0.01 0.00 0.00 42.46 38.56 1jzw s ILE 96 CO 0.20 0.45 -0.21 -0.69 0.00 0.00 0.00 174.94 174.69 1jzw s VAL 97 N -0.18 1.74 -0.16 2.92 1.01 0.04 -0.84 120.40 124.92 1jzw s VAL 97 Ca 0.24 -0.88 -0.01 0.00 0.00 0.00 0.00 61.98 61.33 1jzw s VAL 97 Cb -0.16 -1.49 -0.01 0.00 0.00 0.00 0.00 36.38 34.72 1jzw s VAL 97 CO 0.11 0.49 -0.11 -0.69 0.00 0.00 0.00 175.10 174.91 1jzw s VAL 98 N 0.04 3.08 0.33 2.92 1.01 0.92 -1.08 120.40 127.61 1jzw s VAL 98 Ca -0.06 -0.63 0.03 0.00 0.00 0.00 0.00 61.98 61.32 1jzw s VAL 98 Cb -0.14 -2.33 -0.05 0.00 0.00 0.00 0.00 36.38 33.86 1jzw s VAL 98 CO 0.04 0.49 0.08 0.42 0.00 0.00 0.00 175.10 176.13 1jzw s THR 99 N 0.81 1.00 0.41 3.92 -4.23 -0.05 -0.57 115.64 116.93 1jzw s THR 99 Ca -0.04 -2.00 0.30 0.00 -1.18 0.00 0.00 61.69 58.78 1jzw s THR 99 Cb -0.15 -2.69 0.30 0.00 1.34 0.00 0.00 72.50 71.30 1jzw s THR 99 CO 0.01 0.00 1.92 -0.65 -0.54 0.00 0.00 174.62 175.36 1jzw h PRO 100 N 2.09 0.00 0.00 3.99 0.11 -1.86 -2.08 132.00 134.26 1jzw h PRO 100 Ca -0.40 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.71 1jzw h PRO 100 Cb 1.25 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.36 1jzw h PRO 100 CO 0.66 0.00 -0.93 1.28 -0.21 0.00 0.00 178.00 178.80 1jzw n LEU 101 N -2.70 0.63 0.00 2.35 4.77 -1.26 -5.06 117.00 115.73 1jzw n LEU 101 Ca -0.02 0.04 0.00 0.00 -0.03 0.00 0.00 56.01 56.00 1jzw n LEU 101 Cb 0.21 -0.12 0.00 0.00 -2.33 0.00 0.00 43.42 41.18 1jzw n LEU 101 CO 0.14 0.02 0.00 0.61 -1.33 0.00 0.00 177.39 176.82 1jzw n GLY 102 N 1.36 -0.57 3.01 -0.72 0.00 -0.78 -5.00 105.19 102.48 1jzw n GLY 102 Ca 0.02 -1.32 -0.22 0.00 0.00 0.00 0.00 46.02 44.51 1jzw n GLY 102 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1jzw s THR 103 N -2.90 0.89 0.03 2.61 2.01 -1.26 -0.87 115.64 116.15 1jzw s THR 103 Ca 0.00 -0.39 0.01 0.00 0.31 0.00 0.00 61.69 61.62 1jzw s THR 103 Cb 0.00 -0.80 -0.02 0.00 0.01 0.00 0.00 72.50 71.69 1jzw s THR 103 CO 0.00 0.28 -0.05 -0.13 -0.69 0.00 0.00 174.62 174.03 1jzw s ARG 104 N 0.34 0.44 -0.48 4.92 1.81 -0.24 -4.15 118.95 121.59 1jzw s ARG 104 Ca -0.06 -0.74 -0.28 0.00 -1.72 0.00 0.00 55.73 52.93 1jzw s ARG 104 Cb -0.11 -0.08 0.03 0.00 -0.45 0.00 0.00 34.95 34.35 1jzw s ARG 104 CO 0.01 -0.01 1.09 -1.17 -0.68 0.00 0.00 175.30 174.55 1jzw s LEU 105 N -1.65 3.71 -1.26 2.53 2.96 -1.26 -0.78 118.68 122.93 1jzw s LEU 105 Ca -0.11 0.38 -0.10 0.00 -0.22 0.00 0.00 54.13 54.08 1jzw s LEU 105 Cb -0.08 -3.47 0.18 0.00 0.50 0.00 0.00 46.19 43.31 1jzw s LEU 105 CO -0.01 -1.22 1.76 0.00 -1.32 0.00 0.00 176.35 175.56 1jzw s ARG 107 N 0.50 1.40 0.91 0.00 0.52 -1.26 -3.22 118.95 117.78 1jzw s ARG 107 Ca 0.40 -0.95 -0.12 0.00 -0.52 0.00 0.00 55.73 54.54 1jzw s ARG 107 Cb 0.06 -2.50 0.13 0.00 0.52 0.00 0.00 34.95 33.17 1jzw s ARG 107 CO 0.01 -0.65 1.13 -1.25 0.02 0.00 0.00 175.30 174.56 1jzw s PRO 108 N 1.46 1.19 0.43 3.54 0.04 -1.26 -4.94 135.00 135.46 1jzw s PRO 108 Ca -0.03 0.34 0.12 0.00 0.04 0.00 0.00 61.00 61.47 1jzw s PRO 108 Cb -0.18 -1.84 0.98 0.00 0.04 0.00 0.00 34.50 33.49 1jzw s PRO 108 CO -0.08 -2.17 2.01 0.66 0.04 0.00 0.00 177.00 177.46 1jzw h SER 109 N -1.48 0.39 0.32 6.66 4.64 -1.82 -1.69 113.55 120.57 1jzw h SER 109 Ca -0.50 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.82 1jzw h SER 109 Cb 1.33 -0.08 0.00 0.00 -0.31 0.00 0.00 62.40 63.33 1jzw h SER 109 CO 0.61 0.26 0.00 -1.84 -0.87 0.00 0.00 176.83 174.99 1jzw n GLU 110 N -4.47 0.12 -0.28 4.77 0.00 -1.26 -1.71 120.64 117.80 1jzw n GLU 110 Ca 0.07 0.21 0.27 0.00 0.00 0.00 0.00 57.16 57.71 1jzw n GLU 110 Cb 0.26 -1.50 0.63 0.00 0.00 0.00 0.00 31.44 30.83 1jzw n GLU 110 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.13 177.41 1jzw h VAL 111 N 0.00 0.52 -0.04 3.84 2.07 -1.63 -0.63 116.25 120.39 1jzw h VAL 111 Ca 0.00 -0.06 0.01 0.00 0.82 0.00 0.00 66.70 67.47 1jzw h VAL 111 Cb 0.16 0.32 -0.00 0.00 -1.52 0.00 0.00 31.29 30.25 1jzw h VAL 111 CO 0.00 0.03 0.05 1.62 0.02 0.00 0.00 177.57 179.29 1jzw h VAL 112 N 0.19 0.45 0.00 2.57 3.04 -1.56 0.16 116.25 121.10 1jzw h VAL 112 Ca 0.53 0.00 -0.00 0.00 -1.01 0.00 0.00 66.70 66.21 1jzw h VAL 112 Cb 1.73 0.96 -0.00 0.00 -2.01 0.00 0.00 31.29 31.97 1jzw h VAL 112 CO -0.13 0.00 -0.02 -0.07 -1.01 0.00 0.00 177.57 176.34 1jzw h LEU 113 N 0.00 0.00 -1.09 3.16 3.38 -1.34 -1.52 115.31 117.90 1jzw h LEU 113 Ca 0.02 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 57.94 1jzw h LEU 113 Cb 0.11 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.83 1jzw h LEU 113 CO -0.00 0.02 0.09 0.44 0.09 0.00 0.00 178.44 179.08 1jzw h ASP 114 N 0.00 0.69 -0.01 -0.43 3.45 -1.13 -3.28 116.42 115.70 1jzw h ASP 114 Ca -0.00 -0.12 0.00 0.00 0.43 0.00 0.00 57.03 57.34 1jzw h ASP 114 Cb 0.10 -0.18 0.00 0.00 -0.56 0.00 0.00 39.33 38.69 1jzw h ASP 114 CO 0.00 0.70 -0.18 2.30 -1.57 0.00 0.00 179.24 180.50 1jzw n ILE 115 N -4.28 0.00 -2.60 0.35 -5.35 -0.61 -4.94 119.36 101.93 1jzw n ILE 115 Ca 0.03 -0.41 -0.42 0.00 -0.27 0.00 0.00 62.75 61.68 1jzw n ILE 115 Cb 0.23 1.24 -0.03 0.00 -1.74 0.00 0.00 39.64 39.34 1jzw n ILE 115 CO 0.00 0.00 0.00 -0.76 -1.76 0.00 0.00 176.55 174.03 1jzw s LEU 116 N -1.67 4.36 0.10 7.28 1.43 -0.97 -4.35 118.68 124.85 1jzw s LEU 116 Ca 0.15 1.78 -0.14 0.00 -1.03 0.00 0.00 54.13 54.89 1jzw s LEU 116 Cb 0.12 -3.57 -0.13 0.00 0.03 0.00 0.00 46.19 42.64 1jzw s LEU 116 CO 0.30 -0.36 1.33 1.56 0.23 0.00 0.00 176.35 179.41 1jzw h GLN 117 N 6.85 0.76 -5.79 1.70 4.20 -1.92 -3.44 115.11 117.47 1jzw h GLN 117 Ca -0.40 -0.54 -0.65 0.00 0.06 0.00 0.00 58.65 57.11 1jzw h GLN 117 Cb 1.21 0.09 -0.06 0.00 0.30 0.00 0.00 27.48 29.02 1jzw h GLN 117 CO 0.78 1.17 -0.50 -0.51 -0.67 0.00 0.00 178.83 179.10 1jzw s ASP 118 N -6.90 6.28 0.55 1.46 1.01 -1.26 -5.07 116.67 112.74 1jzw s ASP 118 Ca -0.11 0.35 -0.22 0.00 0.71 0.00 0.00 52.55 53.28 1jzw s ASP 118 Cb 0.08 -1.97 -0.05 0.00 1.01 0.00 0.00 42.92 42.00 1jzw s ASP 118 CO 0.88 0.30 1.34 0.00 0.21 0.00 0.00 175.17 177.89 1jzw n ALA 119 N 1.24 1.49 -1.55 5.23 0.00 -1.26 -4.76 120.51 120.90 1jzw n ALA 119 Ca -0.13 0.12 -0.45 0.00 0.00 0.00 0.00 53.44 52.98 1jzw n ALA 119 Cb 0.53 -2.34 -0.02 0.00 0.00 0.00 0.00 19.45 17.63 1jzw n ALA 119 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 1jzw n GLN 120 N -1.02 1.08 0.00 0.00 1.13 -1.26 -4.62 117.38 112.69 1jzw n GLN 120 Ca 0.11 0.38 0.13 0.00 -1.94 0.00 0.00 57.00 55.68 1jzw n GLN 120 Cb 0.45 -1.69 0.46 0.00 0.11 0.00 0.00 30.24 29.57 1jzw n GLN 120 CO 0.00 0.00 0.00 1.63 -1.44 0.00 0.00 177.06 177.25 1jzw n LYS 121 N 0.73 0.28 -3.79 -1.09 5.02 0.81 -4.92 118.16 115.22 1jzw n LYS 121 Ca 0.11 -0.12 -0.01 0.00 -2.02 0.00 0.00 58.31 56.28 1jzw n LYS 121 Cb 0.32 -1.50 0.02 0.00 -0.02 0.00 0.00 35.03 33.85 1jzw n LYS 121 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1jzw n GLY 122 N 1.42 0.50 3.65 0.72 0.00 -1.26 -5.12 105.19 105.09 1jzw n GLY 122 Ca 0.09 -1.10 -0.38 0.00 0.00 0.00 0.00 46.02 44.63 1jzw n GLY 122 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1jzw n ALA 123 N -0.95 0.45 -3.57 4.61 0.00 -1.25 -4.85 120.51 114.95 1jzw n ALA 123 Ca -0.12 0.01 -0.23 0.00 0.00 0.00 0.00 53.44 53.10 1jzw n ALA 123 Cb 0.55 -2.17 -0.17 0.00 0.00 0.00 0.00 19.45 17.67 1jzw n ALA 123 CO 0.00 0.00 0.00 0.12 0.00 0.00 0.00 177.50 177.62 1jzw s PHE 124 N -1.47 1.17 -0.10 0.00 2.19 0.29 -4.96 117.98 115.10 1jzw s PHE 124 Ca 0.77 -0.42 0.03 0.00 0.33 0.00 0.00 56.93 57.64 1jzw s PHE 124 Cb -0.41 -0.93 0.01 0.00 -1.31 0.00 0.00 43.02 40.38 1jzw s PHE 124 CO 0.46 -0.27 -0.20 0.99 1.83 0.00 0.00 175.22 178.03 1jzw s THR 125 N 0.88 1.81 1.04 0.12 2.01 -1.26 -0.04 115.64 120.20 1jzw s THR 125 Ca -0.11 -0.86 -0.12 0.00 0.31 0.00 0.00 61.69 60.91 1jzw s THR 125 Cb -0.15 -1.59 0.22 0.00 0.01 0.00 0.00 72.50 70.99 1jzw s THR 125 CO 0.01 0.50 1.08 -0.54 -0.69 0.00 0.00 174.62 174.98 1jzw s LYS 126 N 0.55 0.04 0.56 4.92 1.02 0.13 -4.85 119.74 122.11 1jzw s LYS 126 Ca -0.15 1.07 0.34 0.00 0.02 0.00 0.00 55.97 57.25 1jzw s LYS 126 Cb -0.17 -1.65 1.46 0.00 -0.52 0.00 0.00 37.83 36.95 1jzw s LYS 126 CO 0.05 -3.15 2.02 1.05 -0.92 0.00 0.00 175.35 174.40 1jzw h GLU 127 N -2.22 0.00 -0.21 1.68 4.11 -1.94 -0.56 114.58 115.44 1jzw h GLU 127 Ca -0.54 0.00 0.00 0.00 0.07 0.00 0.00 59.36 58.89 1jzw h GLU 127 Cb 1.30 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.55 1jzw h GLU 127 CO 0.48 0.02 0.00 -0.40 0.07 0.00 0.00 179.01 179.18 1jzw n ASP 128 N -3.13 1.51 0.00 3.06 5.75 -1.26 -4.89 116.55 117.59 1jzw n ASP 128 Ca 0.00 -1.80 0.00 0.00 -0.01 0.00 0.00 54.79 52.98 1jzw n ASP 128 Cb 0.29 -0.14 0.00 0.00 -1.03 0.00 0.00 41.12 40.24 1jzw n ASP 128 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1jzw n GLY 129 N 1.04 0.52 3.66 6.12 0.00 -0.22 -5.05 105.19 111.26 1jzw n GLY 129 Ca 0.14 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.73 1jzw n GLY 129 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1jzw s GLU 130 N -0.99 4.18 0.25 1.61 2.12 -1.26 -4.76 118.70 119.87 1jzw s GLU 130 Ca 0.00 2.10 -0.30 0.00 0.36 0.00 0.00 54.97 57.13 1jzw s GLU 130 Cb 0.00 -3.95 -0.09 0.00 0.26 0.00 0.00 34.13 30.34 1jzw s GLU 130 CO 0.00 -0.84 1.01 0.15 -0.54 0.00 0.00 175.26 175.04 1jzw s LYS 131 N 3.97 4.77 -0.09 4.30 1.02 -1.26 -0.69 119.74 131.76 1jzw s LYS 131 Ca 0.71 1.62 -0.06 0.00 0.02 0.00 0.00 55.97 58.26 1jzw s LYS 131 Cb -0.31 -3.24 -0.04 0.00 -0.52 0.00 0.00 37.83 33.71 1jzw s LYS 131 CO 0.27 0.39 -0.14 0.28 -0.92 0.00 0.00 175.35 175.23 1jzw n VAL 132 N 1.39 0.74 -4.34 3.17 0.31 0.94 -4.73 118.33 115.80 1jzw n VAL 132 Ca -0.02 -0.07 -0.18 0.00 -0.01 0.00 0.00 64.34 64.06 1jzw n VAL 132 Cb 0.46 -1.69 -0.14 0.00 -0.91 0.00 0.00 33.84 31.56 1jzw n VAL 132 CO 0.00 0.00 0.00 0.68 -1.32 0.00 0.00 176.83 176.19 1jzw s VAL 133 N -2.23 0.79 0.78 2.52 -7.23 -0.75 -1.18 120.40 113.09 1jzw s VAL 133 Ca -0.15 -0.58 -0.10 0.00 -1.81 0.00 0.00 61.98 59.34 1jzw s VAL 133 Cb 0.05 -0.69 0.17 0.00 0.56 0.00 0.00 36.38 36.47 1jzw s VAL 133 CO 0.19 0.11 1.06 -0.90 -0.31 0.00 0.00 175.10 175.24 1jzw n ASP 134 N 2.52 0.41 0.21 4.85 3.85 -0.57 -0.55 116.55 127.28 1jzw n ASP 134 Ca -0.15 -1.58 0.05 0.00 -0.71 0.00 0.00 54.79 52.39 1jzw n ASP 134 Cb 0.56 -0.78 0.44 0.00 -1.35 0.00 0.00 41.12 39.99 1jzw n ASP 134 CO 0.00 0.00 0.00 -0.33 -1.01 0.00 0.00 177.20 175.86 1jzw h GLU 135 N 0.00 0.00 0.00 0.11 4.39 -1.91 0.81 114.58 117.98 1jzw h GLU 135 Ca -0.34 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.36 1jzw h GLU 135 Cb 1.03 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.68 1jzw h GLU 135 CO 0.27 0.29 0.00 0.00 -1.16 0.00 0.00 179.01 178.42 1jzw n ALA 136 N -2.44 1.95 -0.01 3.43 0.00 -1.26 -4.57 120.51 117.61 1jzw n ALA 136 Ca -0.02 0.03 0.00 0.00 0.00 0.00 0.00 53.44 53.45 1jzw n ALA 136 Cb 0.35 -1.42 0.00 0.00 0.00 0.00 0.00 19.45 18.38 1jzw n ALA 136 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1jzw n GLY 137 N 0.61 0.62 3.73 0.00 0.00 0.28 -5.07 105.19 105.36 1jzw n GLY 137 Ca 0.04 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.65 1jzw n GLY 137 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1jzw s LYS 138 N -0.99 4.59 0.17 1.61 2.20 -1.26 -4.75 119.74 121.30 1jzw s LYS 138 Ca 0.00 1.64 -0.32 0.00 -0.36 0.00 0.00 55.97 56.94 1jzw s LYS 138 Cb 0.00 -3.33 -0.11 0.00 -1.51 0.00 0.00 37.83 32.89 1jzw s LYS 138 CO 0.00 0.04 1.70 1.03 -0.36 0.00 0.00 175.35 177.76 1jzw s ARG 139 N 0.08 4.16 0.00 4.03 1.81 -1.26 -1.51 118.95 126.25 1jzw s ARG 139 Ca 0.51 2.52 0.21 0.00 -1.72 0.00 0.00 55.73 57.25 1jzw s ARG 139 Cb -0.27 -3.24 0.17 0.00 -0.45 0.00 0.00 34.95 31.16 1jzw s ARG 139 CO 0.32 -0.73 1.18 1.28 -0.68 0.00 0.00 175.30 176.67