#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2zw3 s TRP 3 N 0.00 3.08 0.00 2.11 0.23 -1.26 -4.24 118.94 118.86 2zw3 s TRP 3 Ca 0.00 -0.39 0.00 0.00 -2.03 0.00 0.00 56.10 53.68 2zw3 s TRP 3 Cb 0.00 -3.36 0.00 0.00 0.03 0.00 0.00 33.47 30.14 2zw3 s TRP 3 CO 0.00 -0.93 0.00 0.41 0.96 0.00 0.00 176.95 177.39 2zw3 n GLY 4 N 5.13 3.06 0.29 0.98 0.00 -1.26 -4.90 105.19 108.49 2zw3 n GLY 4 Ca -0.06 -0.86 0.04 0.00 0.00 0.00 0.00 46.02 45.15 2zw3 n GLY 4 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2zw3 h THR 5 N 0.00 1.09 0.03 2.61 1.03 -2.02 -3.21 112.91 112.44 2zw3 h THR 5 Ca 0.00 -0.23 -0.28 0.00 -0.01 0.00 0.00 66.41 65.89 2zw3 h THR 5 Cb 0.00 0.69 -0.03 0.00 -1.07 0.00 0.00 68.15 67.74 2zw3 h THR 5 CO 0.00 0.10 -1.51 -0.07 -0.01 0.00 0.00 175.52 174.03 2zw3 h LEU 6 N 0.40 0.11 -1.97 0.00 3.38 -1.91 -3.20 115.31 112.11 2zw3 h LEU 6 Ca 0.11 -0.17 0.00 0.00 0.09 0.00 0.00 57.88 57.90 2zw3 h LEU 6 Cb 0.01 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 40.72 2zw3 h LEU 6 CO -0.02 1.15 0.00 1.56 0.09 0.00 0.00 178.44 181.22 2zw3 h GLN 7 N 0.02 0.00 0.00 1.13 7.50 -1.85 -2.23 115.11 119.68 2zw3 h GLN 7 Ca -0.22 0.00 -0.22 0.00 0.50 0.00 0.00 58.65 58.72 2zw3 h GLN 7 Cb 1.95 0.00 -0.04 0.00 0.05 0.00 0.00 27.48 29.45 2zw3 h GLN 7 CO 0.11 0.00 -1.76 2.41 -1.50 0.00 0.00 178.83 178.09 2zw3 n THR 8 N -2.92 1.17 -0.17 -0.54 -1.04 -1.24 -0.64 114.28 108.90 2zw3 n THR 8 Ca -0.01 -0.73 0.05 0.00 -2.04 0.00 0.00 64.05 61.33 2zw3 n THR 8 Cb 0.18 -0.64 0.34 0.00 -1.82 0.00 0.00 70.33 68.40 2zw3 n THR 8 CO 0.00 0.00 0.00 0.40 -0.64 0.00 0.00 175.07 174.83 2zw3 h ILE 9 N 0.00 1.06 0.00 12.58 2.04 -1.39 0.15 117.51 131.95 2zw3 h ILE 9 Ca -0.26 -0.27 -0.23 0.00 1.00 0.00 0.00 64.86 65.10 2zw3 h ILE 9 Cb 1.74 0.21 -0.04 0.00 -0.74 0.00 0.00 36.82 37.99 2zw3 h ILE 9 CO 0.04 0.14 -1.98 0.18 0.00 0.00 0.00 178.15 176.53 2zw3 n LEU 10 N -4.47 0.00 -0.03 1.44 4.77 -1.21 -4.68 117.00 112.81 2zw3 n LEU 10 Ca 0.09 0.00 -0.16 0.00 -0.03 0.00 0.00 56.01 55.92 2zw3 n LEU 10 Cb 0.17 0.32 -0.05 0.00 -2.33 0.00 0.00 43.42 41.53 2zw3 n LEU 10 CO 0.34 0.32 0.33 1.23 -1.33 0.00 0.00 177.39 178.28 2zw3 h GLY 11 N 2.95 0.87 -6.58 -0.72 0.00 -0.81 -3.31 103.07 95.47 2zw3 h GLY 11 Ca -0.35 -1.15 -0.76 0.00 0.00 0.00 0.00 47.33 45.07 2zw3 h GLY 11 CO 0.02 1.03 1.91 0.61 0.00 0.00 0.00 176.54 180.11 2zw3 n GLY 12 N 0.58 4.66 3.60 4.60 0.00 0.51 -4.97 105.19 114.17 2zw3 n GLY 12 Ca -0.06 -2.11 -0.29 0.00 0.00 0.00 0.00 46.02 43.56 2zw3 n GLY 12 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2zw3 s VAL 13 N 0.35 2.14 0.08 1.61 1.01 -1.25 -4.84 120.40 119.51 2zw3 s VAL 13 Ca 0.39 0.05 -0.32 0.00 0.00 0.00 0.00 61.98 62.10 2zw3 s VAL 13 Cb 0.08 -2.30 -0.15 0.00 0.00 0.00 0.00 36.38 34.01 2zw3 s VAL 13 CO 0.01 -0.06 1.50 0.78 0.00 0.00 0.00 175.10 177.33 2zw3 h ASN 14 N -2.18 -1.32 -0.56 3.32 4.21 -1.94 -3.43 115.58 113.68 2zw3 h ASN 14 Ca -0.56 0.12 -0.22 0.00 1.21 0.00 0.00 56.30 56.85 2zw3 h ASN 14 Cb 1.32 0.45 -0.17 0.00 -1.12 0.00 0.00 38.32 38.81 2zw3 h ASN 14 CO 0.53 -0.58 -0.53 0.29 -1.29 0.00 0.00 177.43 175.84 2zw3 n LYS 15 N -5.22 0.66 -0.10 0.81 4.76 -1.26 -5.07 118.16 112.74 2zw3 n LYS 15 Ca -0.10 -1.96 -0.21 0.00 -2.87 0.00 0.00 58.31 53.17 2zw3 n LYS 15 Cb 0.41 -1.47 -0.11 0.00 -1.84 0.00 0.00 35.03 32.02 2zw3 n LYS 15 CO 0.00 0.00 0.00 1.12 -1.37 0.00 0.00 177.40 177.15 2zw3 h HIS 16 N 4.46 0.00 -3.34 2.13 2.07 -2.02 -3.50 115.15 114.94 2zw3 h HIS 16 Ca -0.04 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.48 2zw3 h HIS 16 Cb 1.05 0.00 -0.07 0.00 2.57 0.00 0.00 27.41 30.96 2zw3 h HIS 16 CO 0.07 1.39 0.05 -1.54 -3.07 0.00 0.00 177.93 174.83 2zw3 s SER 17 N -6.78 -0.16 -0.60 3.10 1.04 -1.26 -5.13 113.70 103.92 2zw3 s SER 17 Ca -0.28 -0.79 0.04 0.00 0.48 0.00 0.00 55.95 55.40 2zw3 s SER 17 Cb 0.05 0.66 0.16 0.00 0.10 0.00 0.00 66.02 66.99 2zw3 s SER 17 CO 0.57 -1.25 0.40 0.42 0.98 0.00 0.00 173.24 174.36 2zw3 s THR 18 N -3.93 2.28 0.00 2.02 -4.23 -1.26 -4.86 115.64 105.66 2zw3 s THR 18 Ca 0.17 -3.67 0.00 0.00 -1.18 0.00 0.00 61.69 57.01 2zw3 s THR 18 Cb -0.03 -2.53 0.00 0.00 1.34 0.00 0.00 72.50 71.28 2zw3 s THR 18 CO 0.08 -0.99 0.04 -1.54 -0.54 0.00 0.00 174.62 171.67 2zw3 n SER 19 N 2.48 0.09 0.00 3.99 3.41 -1.26 -5.01 113.62 117.31 2zw3 n SER 19 Ca 0.17 -0.66 0.00 0.00 -0.26 0.00 0.00 58.87 58.13 2zw3 n SER 19 Cb 0.36 0.05 0.00 0.00 -0.26 0.00 0.00 64.21 64.36 2zw3 n SER 19 CO 0.00 0.00 0.00 -0.38 -0.16 0.00 0.00 175.04 174.50 2zw3 n ILE 20 N -0.05 0.00 0.07 -1.33 5.41 -1.26 -4.71 119.36 117.49 2zw3 n ILE 20 Ca 0.00 0.00 0.06 0.00 1.00 0.00 0.00 62.75 63.81 2zw3 n ILE 20 Cb 0.14 -0.52 0.12 0.00 -0.71 0.00 0.00 39.64 38.67 2zw3 n ILE 20 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 2zw3 n GLY 21 N -1.59 1.62 0.07 7.39 0.00 -1.26 -4.17 105.19 107.25 2zw3 n GLY 21 Ca 0.00 -0.37 -0.14 0.00 0.00 0.00 0.00 46.02 45.51 2zw3 n GLY 21 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2zw3 h LYS 22 N 2.16 0.06 0.04 1.61 1.79 -1.94 -3.15 116.57 117.14 2zw3 h LYS 22 Ca 0.00 -0.06 -0.09 0.00 -2.18 0.00 0.00 60.65 58.32 2zw3 h LYS 22 Cb 0.64 0.02 0.00 0.00 -1.58 0.00 0.00 32.23 31.31 2zw3 h LYS 22 CO 0.00 0.86 -0.42 -0.84 -1.08 0.00 0.00 179.45 177.97 2zw3 h ILE 23 N -0.72 1.59 -0.99 1.86 3.07 -1.99 -3.33 117.51 117.00 2zw3 h ILE 23 Ca -0.01 -2.39 0.20 0.00 1.55 0.00 0.00 64.86 64.22 2zw3 h ILE 23 Cb 0.89 3.19 -0.19 0.00 -0.27 0.00 0.00 36.82 40.45 2zw3 h ILE 23 CO 0.02 0.61 -0.22 0.79 -1.05 0.00 0.00 178.15 178.30 2zw3 n TRP 24 N -4.42 0.38 -0.17 0.16 7.02 -1.26 0.38 117.44 119.53 2zw3 n TRP 24 Ca -0.14 1.21 -0.01 0.00 -1.02 0.00 0.00 57.50 57.53 2zw3 n TRP 24 Cb 0.61 -1.09 0.22 0.00 -2.42 0.00 0.00 31.31 28.63 2zw3 n TRP 24 CO 0.00 0.00 0.00 1.25 -2.02 0.00 0.00 177.69 176.92 2zw3 h LEU 25 N 0.00 0.81 0.00 -0.99 6.46 -1.70 -2.47 115.31 117.42 2zw3 h LEU 25 Ca 0.49 -0.09 -0.21 0.00 -0.12 0.00 0.00 57.88 57.94 2zw3 h LEU 25 Cb 0.77 -0.21 -0.03 0.00 -0.73 0.00 0.00 40.66 40.46 2zw3 h LEU 25 CO -1.01 0.70 -1.15 0.74 -0.62 0.00 0.00 178.44 177.10 2zw3 h THR 26 N 0.89 1.26 -0.70 1.05 2.02 -0.38 -1.79 112.91 115.28 2zw3 h THR 26 Ca 0.22 -2.95 -0.03 0.00 0.77 0.00 0.00 66.41 64.43 2zw3 h THR 26 Cb 0.11 2.61 -0.03 0.00 -1.74 0.00 0.00 68.15 69.10 2zw3 h THR 26 CO -0.03 0.72 0.33 0.58 0.37 0.00 0.00 175.52 177.49 2zw3 h VAL 27 N 0.00 1.22 0.11 3.16 2.07 0.02 -1.41 116.25 121.43 2zw3 h VAL 27 Ca -0.09 -0.64 -0.01 0.00 0.82 0.00 0.00 66.70 66.78 2zw3 h VAL 27 Cb 1.76 0.34 0.00 0.00 -1.52 0.00 0.00 31.29 31.88 2zw3 h VAL 27 CO 0.10 0.27 -0.05 -0.07 0.02 0.00 0.00 177.57 177.84 2zw3 h LEU 28 N 0.99 -0.13 -0.97 2.57 3.38 -1.45 -0.13 115.31 119.57 2zw3 h LEU 28 Ca 0.24 -0.31 0.30 0.00 0.09 0.00 0.00 57.88 58.20 2zw3 h LEU 28 Cb 0.11 0.03 -0.17 0.00 0.09 0.00 0.00 40.66 40.72 2zw3 h LEU 28 CO -0.03 0.26 0.22 0.15 0.09 0.00 0.00 178.44 179.13 2zw3 h PHE 29 N -0.53 0.29 0.52 1.13 3.57 -1.06 1.18 116.94 122.04 2zw3 h PHE 29 Ca -0.02 0.06 -0.03 0.00 3.53 0.00 0.00 57.97 61.52 2zw3 h PHE 29 Cb 0.43 0.03 0.01 0.00 2.79 0.00 0.00 35.95 39.21 2zw3 h PHE 29 CO 0.05 -0.39 -0.25 0.82 -2.23 0.00 0.00 178.31 176.31 2zw3 h ILE 30 N 0.06 0.13 -0.97 1.41 2.04 -1.19 -2.76 117.51 116.24 2zw3 h ILE 30 Ca 0.66 -0.49 0.21 0.00 1.00 0.00 0.00 64.86 66.24 2zw3 h ILE 30 Cb 1.49 0.20 -0.18 0.00 -0.74 0.00 0.00 36.82 37.59 2zw3 h ILE 30 CO -0.82 0.03 -0.17 0.15 0.00 0.00 0.00 178.15 177.34 2zw3 h PHE 31 N -1.13 -0.39 0.00 1.37 3.57 0.12 0.12 116.94 120.60 2zw3 h PHE 31 Ca -0.07 0.08 -0.05 0.00 3.53 0.00 0.00 57.97 61.46 2zw3 h PHE 31 Cb 0.58 0.32 -0.01 0.00 2.79 0.00 0.00 35.95 39.63 2zw3 h PHE 31 CO 0.01 -0.42 -0.25 -0.09 -2.23 0.00 0.00 178.31 175.33 2zw3 h ARG 32 N 0.00 0.00 0.00 1.11 2.43 0.12 0.31 114.38 118.36 2zw3 h ARG 32 Ca 0.50 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.67 2zw3 h ARG 32 Cb 0.84 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.39 2zw3 h ARG 32 CO -0.97 0.25 -0.40 1.51 -1.51 0.00 0.00 179.97 178.85 2zw3 n ILE 33 N -4.16 0.31 -0.03 1.20 0.13 0.00 -2.98 119.36 113.85 2zw3 n ILE 33 Ca -0.02 -0.20 -0.16 0.00 -1.10 0.00 0.00 62.75 61.27 2zw3 n ILE 33 Cb 0.31 -0.21 -0.13 0.00 -0.84 0.00 0.00 39.64 38.78 2zw3 n ILE 33 CO 0.00 0.00 0.00 0.24 2.80 0.00 0.00 176.55 179.59 2zw3 h MET 34 N 0.00 0.13 -0.81 9.51 2.86 0.63 -2.43 114.93 124.82 2zw3 h MET 34 Ca 0.00 -0.18 -0.02 0.00 -2.06 0.00 0.00 59.70 57.44 2zw3 h MET 34 Cb 0.68 0.06 -0.04 0.00 0.06 0.00 0.00 31.60 32.36 2zw3 h MET 34 CO 0.00 1.01 0.43 0.97 1.06 0.00 0.00 176.91 180.38 2zw3 h ILE 35 N -0.66 1.24 -0.19 -1.22 2.10 -1.12 -2.71 117.51 114.95 2zw3 h ILE 35 Ca -0.04 -0.63 -0.16 0.00 1.08 0.00 0.00 64.86 65.11 2zw3 h ILE 35 Cb 1.13 0.17 -0.01 0.00 -1.09 0.00 0.00 36.82 37.02 2zw3 h ILE 35 CO 0.05 0.28 -0.54 0.25 -1.08 0.00 0.00 178.15 177.11 2zw3 h LEU 36 N 1.14 0.63 0.00 2.19 6.46 -1.66 -1.47 115.31 122.60 2zw3 h LEU 36 Ca 0.28 -0.33 0.00 0.00 -0.12 0.00 0.00 57.88 57.71 2zw3 h LEU 36 Cb 0.06 -0.18 0.00 0.00 -0.73 0.00 0.00 40.66 39.81 2zw3 h LEU 36 CO -0.04 1.04 0.00 0.55 -0.62 0.00 0.00 178.44 179.37 2zw3 n VAL 37 N -3.96 0.00 -0.05 1.05 3.14 -0.91 -1.82 118.33 115.77 2zw3 n VAL 37 Ca -0.03 0.00 -0.11 0.00 -2.96 0.00 0.00 64.34 61.24 2zw3 n VAL 37 Cb 0.60 -0.20 -0.04 0.00 -1.06 0.00 0.00 33.84 33.15 2zw3 n VAL 37 CO 0.00 0.00 0.00 0.52 -6.46 0.00 0.00 176.83 170.89 2zw3 n VAL 38 N -0.59 1.12 -0.07 1.55 0.31 -0.96 -4.79 118.33 114.90 2zw3 n VAL 38 Ca 0.03 0.02 -0.03 0.00 -0.01 0.00 0.00 64.34 64.35 2zw3 n VAL 38 Cb 0.02 -1.86 -0.02 0.00 -0.91 0.00 0.00 33.84 31.06 2zw3 n VAL 38 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2zw3 h ALA 39 N -0.56 -0.25 -1.67 3.52 0.00 -1.24 -3.24 119.26 115.82 2zw3 h ALA 39 Ca -0.20 0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.73 2zw3 h ALA 39 Cb 0.95 0.97 0.00 0.00 0.00 0.00 0.00 17.79 19.71 2zw3 h ALA 39 CO -0.12 -0.33 0.00 0.00 0.00 0.00 0.00 179.25 178.80 2zw3 n ALA 40 N -2.95 -0.02 0.26 0.00 0.00 -0.75 0.28 120.51 117.33 2zw3 n ALA 40 Ca -0.00 0.00 0.17 0.00 0.00 0.00 0.00 53.44 53.60 2zw3 n ALA 40 Cb 0.07 0.33 0.87 0.00 0.00 0.00 0.00 19.45 20.72 2zw3 n ALA 40 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.50 178.37 2zw3 h LYS 41 N 0.00 0.00 0.00 0.00 1.79 -1.83 -2.85 116.57 113.68 2zw3 h LYS 41 Ca 0.00 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.47 2zw3 h LYS 41 Cb 0.00 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.65 2zw3 h LYS 41 CO 0.00 0.00 -0.84 -1.91 -1.08 0.00 0.00 179.45 175.62 2zw3 n GLU 42 N -2.65 0.45 0.02 3.15 4.07 -0.46 -4.58 120.64 120.64 2zw3 n GLU 42 Ca -0.02 0.18 0.12 0.00 -0.06 0.00 0.00 57.16 57.37 2zw3 n GLU 42 Cb 0.07 -1.28 0.14 0.00 -0.06 0.00 0.00 31.44 30.31 2zw3 n GLU 42 CO 0.00 0.00 0.00 1.33 -0.06 0.00 0.00 177.13 178.40 2zw3 n VAL 43 N -4.16 0.11 -0.04 6.31 0.24 0.14 -4.36 118.33 116.58 2zw3 n VAL 43 Ca -0.12 -0.12 0.02 0.00 -2.04 0.00 0.00 64.34 62.08 2zw3 n VAL 43 Cb 0.44 0.24 -0.16 0.00 -1.47 0.00 0.00 33.84 32.90 2zw3 n VAL 43 CO 0.00 0.00 0.00 0.79 -2.14 0.00 0.00 176.83 175.48 2zw3 n TRP 44 N -1.74 0.10 -0.29 6.34 7.02 -1.08 -4.18 117.44 123.62 2zw3 n TRP 44 Ca 0.04 0.03 0.18 0.00 -1.02 0.00 0.00 57.50 56.73 2zw3 n TRP 44 Cb 0.38 -0.76 0.34 0.00 -2.42 0.00 0.00 31.31 28.85 2zw3 n TRP 44 CO 0.00 0.00 0.00 0.41 -2.02 0.00 0.00 177.69 176.08 2zw3 n GLY 45 N 1.47 -0.97 0.26 6.99 0.00 -1.25 0.53 105.19 112.22 2zw3 n GLY 45 Ca -0.16 0.78 0.13 0.00 0.00 0.00 0.00 46.02 46.77 2zw3 n GLY 45 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 2zw3 h ASP 46 N 0.00 0.00 -0.97 1.61 3.32 -1.84 -3.35 116.42 115.18 2zw3 h ASP 46 Ca 0.59 0.00 0.10 0.00 0.02 0.00 0.00 57.03 57.73 2zw3 h ASP 46 Cb 1.37 0.00 -0.12 0.00 0.22 0.00 0.00 39.33 40.80 2zw3 h ASP 46 CO -0.75 0.13 -0.57 1.05 -1.72 0.00 0.00 179.24 177.39 2zw3 h GLU 47 N 0.00 -0.02 0.03 3.56 4.11 -0.11 -1.23 114.58 120.92 2zw3 h GLU 47 Ca -0.00 0.00 -0.08 0.00 0.07 0.00 0.00 59.36 59.35 2zw3 h GLU 47 Cb 0.39 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.64 2zw3 h GLU 47 CO 0.02 -0.01 -0.40 0.37 0.07 0.00 0.00 179.01 179.05 2zw3 h GLN 48 N -0.02 0.05 0.00 1.06 5.75 -1.76 -3.29 115.11 116.91 2zw3 h GLN 48 Ca 0.18 -0.09 0.00 0.00 -0.15 0.00 0.00 58.65 58.59 2zw3 h GLN 48 Cb 0.44 0.03 0.00 0.00 1.07 0.00 0.00 27.48 29.02 2zw3 h GLN 48 CO -0.93 1.04 0.00 0.00 -2.65 0.00 0.00 178.83 176.29 2zw3 n ALA 49 N -2.77 -0.01 0.71 3.38 0.00 -0.91 -2.09 120.51 118.82 2zw3 n ALA 49 Ca -0.15 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.29 2zw3 n ALA 49 Cb 0.58 0.17 0.00 0.00 0.00 0.00 0.00 19.45 20.20 2zw3 n ALA 49 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 2zw3 n ASP 50 N -0.94 0.91 -4.52 0.00 10.43 -0.51 -4.68 116.55 117.24 2zw3 n ASP 50 Ca 0.00 -1.43 -0.42 0.00 2.57 0.00 0.00 54.79 55.51 2zw3 n ASP 50 Cb 0.00 -0.36 -0.03 0.00 1.84 0.00 0.00 41.12 42.57 2zw3 n ASP 50 CO 0.00 0.00 0.00 0.12 -1.07 0.00 0.00 177.20 176.25 2zw3 s PHE 51 N -0.83 2.58 -0.28 1.24 5.36 -0.89 -4.41 117.98 120.75 2zw3 s PHE 51 Ca 0.00 -0.11 -0.10 0.00 -0.96 0.00 0.00 56.93 55.76 2zw3 s PHE 51 Cb 0.00 -4.37 -0.03 0.00 -0.34 0.00 0.00 43.02 38.28 2zw3 s PHE 51 CO 0.00 -1.69 0.15 0.14 -1.46 0.00 0.00 175.22 172.37 2zw3 s VAL 52 N 4.66 4.86 -0.24 3.12 -7.23 -0.52 -4.86 120.40 120.20 2zw3 s VAL 52 Ca 0.31 -0.09 -0.10 0.00 -1.81 0.00 0.00 61.98 60.29 2zw3 s VAL 52 Cb -0.12 -3.36 -0.05 0.00 0.56 0.00 0.00 36.38 33.42 2zw3 s VAL 52 CO 0.16 0.21 0.16 0.00 -0.31 0.00 0.00 175.10 175.32 2zw3 n ASN 54 N 4.24 3.91 -3.53 0.00 2.85 -0.93 -4.84 115.26 116.96 2zw3 n ASN 54 Ca -0.15 -2.81 -0.15 0.00 -0.11 0.00 0.00 54.58 51.35 2zw3 n ASN 54 Cb 0.52 -1.64 -0.05 0.00 1.24 0.00 0.00 39.78 39.84 2zw3 n ASN 54 CO 0.00 0.00 0.00 0.28 -2.11 0.00 0.00 177.26 175.43 2zw3 s THR 55 N 6.01 0.01 -2.88 -0.44 -1.32 -1.26 -4.50 115.64 111.26 2zw3 s THR 55 Ca 0.57 -0.10 0.24 0.00 -1.21 0.00 0.00 61.69 61.20 2zw3 s THR 55 Cb 0.06 -0.98 0.25 0.00 -1.51 0.00 0.00 72.50 70.33 2zw3 s THR 55 CO 0.07 -0.05 1.31 0.18 -2.21 0.00 0.00 174.62 173.92 2zw3 n LEU 56 N 0.51 3.01 -4.57 9.08 4.32 -1.26 -4.92 117.00 123.15 2zw3 n LEU 56 Ca -0.18 -1.07 -0.42 0.00 -0.02 0.00 0.00 56.01 54.32 2zw3 n LEU 56 Cb 0.60 -0.05 -0.03 0.00 -1.62 0.00 0.00 43.42 42.32 2zw3 n LEU 56 CO 0.20 0.53 1.20 -1.58 -1.22 0.00 0.00 177.39 176.52 2zw3 s GLN 57 N -1.91 3.34 0.00 3.23 2.00 -1.26 -4.94 119.66 120.12 2zw3 s GLN 57 Ca 0.31 0.30 0.00 0.00 -2.00 0.00 0.00 55.36 53.96 2zw3 s GLN 57 Cb 0.21 -4.10 0.00 0.00 0.80 0.00 0.00 33.01 29.91 2zw3 s GLN 57 CO 0.30 -1.91 0.56 -2.30 -0.50 0.00 0.00 175.29 171.44 2zw3 n PRO 58 N 8.71 0.00 -0.31 1.67 -0.02 -1.26 -1.61 135.00 142.18 2zw3 n PRO 58 Ca 0.10 0.56 0.13 0.00 -2.02 0.00 0.00 63.50 62.27 2zw3 n PRO 58 Cb 0.49 -0.86 0.28 0.00 -0.02 0.00 0.00 33.50 33.39 2zw3 n PRO 58 CO 0.00 0.00 0.00 0.78 1.98 0.00 0.00 175.50 178.26 2zw3 h GLY 59 N 0.00 1.27 -0.20 -1.23 0.00 -1.92 -3.34 103.07 97.65 2zw3 h GLY 59 Ca 0.00 0.05 0.02 0.00 0.00 0.00 0.00 47.33 47.40 2zw3 h GLY 59 CO 0.00 -0.42 -0.12 0.00 0.00 0.00 0.00 176.54 176.00 2zw3 h LYS 61 N 0.00 0.36 -0.34 0.00 3.64 -1.79 0.64 116.57 119.09 2zw3 h LYS 61 Ca 0.03 -0.02 0.01 0.00 -1.27 0.00 0.00 60.65 59.40 2zw3 h LYS 61 Cb 0.08 -0.08 -0.02 0.00 -0.41 0.00 0.00 32.23 31.80 2zw3 h LYS 61 CO -0.19 0.24 0.19 -0.91 -2.27 0.00 0.00 179.45 176.52 2zw3 h ASN 62 N 0.37 0.31 -0.26 4.20 4.21 -1.82 -0.61 115.58 121.99 2zw3 h ASN 62 Ca 0.29 0.00 -0.08 0.00 1.21 0.00 0.00 56.30 57.73 2zw3 h ASN 62 Cb 0.37 -0.06 -0.02 0.00 -1.12 0.00 0.00 38.32 37.49 2zw3 h ASN 62 CO -0.31 0.23 -0.09 0.58 -1.29 0.00 0.00 177.43 176.55 2zw3 h VAL 63 N 0.40 1.24 0.00 2.81 2.07 -1.17 -1.82 116.25 119.78 2zw3 h VAL 63 Ca 0.13 -1.07 -0.09 0.00 0.82 0.00 0.00 66.70 66.50 2zw3 h VAL 63 Cb 0.00 1.05 -0.01 0.00 -1.52 0.00 0.00 31.29 30.82 2zw3 h VAL 63 CO -0.06 0.36 -0.41 0.00 0.02 0.00 0.00 177.57 177.47 2zw3 h TYR 65 N 0.00 -0.19 0.33 0.00 3.20 -0.84 -3.28 116.97 116.19 2zw3 h TYR 65 Ca -0.00 -0.00 -0.01 0.00 3.14 0.00 0.00 58.73 61.85 2zw3 h TYR 65 Cb 0.90 0.06 -0.00 0.00 1.54 0.00 0.00 36.73 39.23 2zw3 h TYR 65 CO 0.00 0.26 -0.23 0.22 -1.64 0.00 0.00 178.16 176.77 2zw3 h ASP 66 N -0.81 -0.59 0.00 -2.11 -0.00 -1.26 1.75 116.42 113.40 2zw3 h ASP 66 Ca -0.02 0.04 0.00 0.00 -0.00 0.00 0.00 57.03 57.05 2zw3 h ASP 66 Cb 0.53 0.18 0.00 0.00 -0.00 0.00 0.00 39.33 40.04 2zw3 h ASP 66 CO 0.03 -0.34 0.60 -0.74 -0.00 0.00 0.00 179.24 178.80 2zw3 h HIS 67 N -0.53 0.00 0.00 0.28 2.76 -1.36 -1.39 115.15 114.91 2zw3 h HIS 67 Ca -0.04 0.00 0.00 0.00 -2.20 0.00 0.00 60.37 58.13 2zw3 h HIS 67 Cb 0.43 0.00 0.00 0.00 1.55 0.00 0.00 27.41 29.39 2zw3 h HIS 67 CO -0.03 0.00 -1.04 0.66 -1.30 0.00 0.00 177.93 176.22 2zw3 n TYR 68 N -2.06 0.00 -3.28 5.26 4.01 -0.09 -4.82 117.16 116.17 2zw3 n TYR 68 Ca -0.00 0.00 -0.25 0.00 -0.16 0.00 0.00 57.90 57.48 2zw3 n TYR 68 Cb 0.62 -0.07 -0.08 0.00 -0.31 0.00 0.00 39.34 39.50 2zw3 n TYR 68 CO 0.00 0.00 0.00 1.19 -0.46 0.00 0.00 176.86 177.59 2zw3 n PHE 69 N -1.55 0.52 0.29 -0.72 3.01 0.58 -5.01 117.46 114.58 2zw3 n PHE 69 Ca -0.00 -3.68 -0.13 0.00 1.01 0.00 0.00 57.45 54.64 2zw3 n PHE 69 Cb 0.08 -0.34 -0.06 0.00 -0.01 0.00 0.00 39.48 39.15 2zw3 n PHE 69 CO 0.00 0.00 0.00 -1.35 1.01 0.00 0.00 176.76 176.42 2zw3 h PRO 70 N 4.25 -0.76 -4.57 -1.08 0.11 -1.78 -3.36 132.00 124.81 2zw3 h PRO 70 Ca 0.12 0.05 -0.68 0.00 0.11 0.00 0.00 66.00 65.60 2zw3 h PRO 70 Cb 0.83 0.17 -0.36 0.00 0.11 0.00 0.00 31.00 31.75 2zw3 h PRO 70 CO 0.54 -0.49 -0.61 0.42 -0.21 0.00 0.00 178.00 177.65 2zw3 s ILE 71 N -4.30 2.93 0.66 4.15 1.01 -1.26 -5.07 121.20 119.33 2zw3 s ILE 71 Ca -0.12 -2.12 -0.17 0.00 0.00 0.00 0.00 60.65 58.23 2zw3 s ILE 71 Cb 0.01 -3.04 -0.04 0.00 0.01 0.00 0.00 42.46 39.40 2zw3 s ILE 71 CO 0.39 -0.63 0.71 -1.54 0.00 0.00 0.00 174.94 173.87 2zw3 n SER 72 N 4.48 -0.39 -0.21 3.58 3.41 -1.26 -4.60 113.62 118.62 2zw3 n SER 72 Ca -0.01 0.68 0.02 0.00 -0.26 0.00 0.00 58.87 59.31 2zw3 n SER 72 Cb 0.42 -1.28 0.13 0.00 -0.26 0.00 0.00 64.21 63.21 2zw3 n SER 72 CO 0.00 0.00 0.00 0.45 -0.16 0.00 0.00 175.04 175.33 2zw3 h HIS 73 N -0.03 0.16 0.00 7.33 -0.00 -1.98 -1.21 115.15 119.41 2zw3 h HIS 73 Ca -0.47 0.04 0.00 0.00 -0.00 0.00 0.00 60.37 59.94 2zw3 h HIS 73 Cb 1.36 0.03 0.00 0.00 -0.00 0.00 0.00 27.41 28.80 2zw3 h HIS 73 CO 0.35 -0.08 0.00 1.51 -0.00 0.00 0.00 177.93 179.71 2zw3 n ILE 74 N -5.18 0.87 0.12 2.45 0.13 -1.26 -0.33 119.36 116.15 2zw3 n ILE 74 Ca 0.10 0.25 0.11 0.00 -1.10 0.00 0.00 62.75 62.11 2zw3 n ILE 74 Cb 0.37 -1.15 -0.04 0.00 -0.84 0.00 0.00 39.64 37.97 2zw3 n ILE 74 CO 0.00 0.00 0.00 0.54 2.80 0.00 0.00 176.55 179.89 2zw3 n ARG 75 N -2.12 0.59 0.06 9.51 1.74 -0.52 -2.64 116.66 123.29 2zw3 n ARG 75 Ca 0.02 0.02 -0.03 0.00 -0.77 0.00 0.00 57.85 57.09 2zw3 n ARG 75 Cb 0.21 -1.72 -0.02 0.00 -1.02 0.00 0.00 32.46 29.92 2zw3 n ARG 75 CO 0.00 0.00 0.00 -0.07 -1.52 0.00 0.00 177.63 176.04 2zw3 h LEU 76 N 0.00 -0.19 -0.85 0.55 3.38 -0.66 -1.85 115.31 115.69 2zw3 h LEU 76 Ca 0.00 0.01 0.33 0.00 0.09 0.00 0.00 57.88 58.31 2zw3 h LEU 76 Cb 0.97 0.05 -0.15 0.00 0.09 0.00 0.00 40.66 41.62 2zw3 h LEU 76 CO 0.00 0.10 0.37 0.79 0.09 0.00 0.00 178.44 179.79 2zw3 n TRP 77 N -3.88 0.91 0.28 1.13 5.03 0.55 0.20 117.44 121.66 2zw3 n TRP 77 Ca -0.03 1.01 -0.15 0.00 3.03 0.00 0.00 57.50 61.36 2zw3 n TRP 77 Cb 0.09 -1.37 -0.08 0.00 -1.03 0.00 0.00 31.31 28.92 2zw3 n TRP 77 CO 0.00 0.00 0.00 0.00 -0.03 0.00 0.00 177.69 177.66 2zw3 h ALA 78 N 1.71 -0.72 -0.95 6.99 0.00 -1.55 -2.22 119.26 122.51 2zw3 h ALA 78 Ca 0.68 -0.19 0.12 0.00 0.00 0.00 0.00 54.91 55.52 2zw3 h ALA 78 Cb 1.75 0.28 -0.08 0.00 0.00 0.00 0.00 17.79 19.74 2zw3 h ALA 78 CO -0.69 -0.80 0.61 -0.07 0.00 0.00 0.00 179.25 178.30 2zw3 h LEU 79 N -0.94 0.84 0.30 0.00 3.38 0.64 0.38 115.31 119.90 2zw3 h LEU 79 Ca -0.07 0.04 -0.01 0.00 0.09 0.00 0.00 57.88 57.93 2zw3 h LEU 79 Cb 0.63 -0.13 -0.02 0.00 0.09 0.00 0.00 40.66 41.22 2zw3 h LEU 79 CO 0.12 0.46 -0.38 -0.61 0.09 0.00 0.00 178.44 178.12 2zw3 h GLN 80 N 0.91 -0.67 -0.11 1.13 4.15 -0.57 0.17 115.11 120.11 2zw3 h GLN 80 Ca 0.46 0.05 0.03 0.00 0.77 0.00 0.00 58.65 59.96 2zw3 h GLN 80 Cb 0.51 0.15 -0.00 0.00 0.21 0.00 0.00 27.48 28.35 2zw3 h GLN 80 CO -0.23 -0.45 0.16 -0.07 -1.93 0.00 0.00 178.83 176.31 2zw3 h LEU 81 N -0.70 0.00 0.14 -2.39 -0.00 -0.66 -0.63 115.31 111.07 2zw3 h LEU 81 Ca -0.04 0.00 -0.01 0.00 -0.00 0.00 0.00 57.88 57.84 2zw3 h LEU 81 Cb 0.62 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 41.29 2zw3 h LEU 81 CO -0.09 0.00 -0.07 0.40 -0.00 0.00 0.00 178.44 178.69 2zw3 h ILE 82 N 0.00 0.74 0.22 1.22 2.04 -0.13 -2.54 117.51 119.06 2zw3 h ILE 82 Ca 0.05 -1.22 -0.01 0.00 1.00 0.00 0.00 64.86 64.68 2zw3 h ILE 82 Cb 0.37 1.29 0.00 0.00 -0.74 0.00 0.00 36.82 37.75 2zw3 h ILE 82 CO -0.00 0.21 -0.11 -0.26 0.00 0.00 0.00 178.15 177.99 2zw3 h PHE 83 N -0.94 -0.28 0.00 1.37 -1.00 0.16 -0.76 116.94 115.49 2zw3 h PHE 83 Ca -0.02 -0.01 0.00 0.00 2.81 0.00 0.00 57.97 60.75 2zw3 h PHE 83 Cb 0.49 0.09 0.00 0.00 3.61 0.00 0.00 35.95 40.14 2zw3 h PHE 83 CO 0.09 -0.09 0.00 0.28 -1.61 0.00 0.00 178.31 176.97 2zw3 h VAL 84 N -0.40 0.00 0.02 -0.55 2.07 -1.34 0.89 116.25 116.94 2zw3 h VAL 84 Ca -0.03 -0.12 -0.20 0.00 0.82 0.00 0.00 66.70 67.16 2zw3 h VAL 84 Cb 0.30 0.84 -0.02 0.00 -1.52 0.00 0.00 31.29 30.90 2zw3 h VAL 84 CO 0.05 0.00 -0.94 -1.28 0.02 0.00 0.00 177.57 175.42 2zw3 h SER 85 N 0.00 0.11 0.20 0.57 0.87 -0.88 -3.39 113.55 111.02 2zw3 h SER 85 Ca 0.00 -0.10 -0.01 0.00 -1.23 0.00 0.00 61.79 60.45 2zw3 h SER 85 Cb 0.16 -0.03 -0.00 0.00 -0.44 0.00 0.00 62.40 62.08 2zw3 h SER 85 CO 0.00 0.98 -0.12 0.74 -0.53 0.00 0.00 176.83 177.90 2zw3 h THR 86 N 0.03 0.75 -0.66 2.23 2.02 0.61 -2.43 112.91 115.46 2zw3 h THR 86 Ca -0.03 0.00 0.07 0.00 0.77 0.00 0.00 66.41 67.22 2zw3 h THR 86 Cb 1.63 0.75 -0.06 0.00 -1.74 0.00 0.00 68.15 68.72 2zw3 h THR 86 CO 0.13 0.00 0.35 -0.65 0.37 0.00 0.00 175.52 175.72 2zw3 h PRO 87 N -0.31 0.61 -0.72 6.66 0.11 -1.76 0.44 132.00 137.02 2zw3 h PRO 87 Ca -0.02 -0.04 0.12 0.00 0.11 0.00 0.00 66.00 66.17 2zw3 h PRO 87 Cb 0.25 -0.14 -0.08 0.00 0.11 0.00 0.00 31.00 31.15 2zw3 h PRO 87 CO 0.02 0.40 0.32 0.00 -0.21 0.00 0.00 178.00 178.53 2zw3 h ALA 88 N 1.37 1.00 0.00 -0.75 0.00 -1.70 -1.32 119.26 117.86 2zw3 h ALA 88 Ca 0.31 0.08 0.00 0.00 0.00 0.00 0.00 54.91 55.30 2zw3 h ALA 88 Cb 0.24 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.05 2zw3 h ALA 88 CO -0.21 -0.13 -1.08 1.28 0.00 0.00 0.00 179.25 179.11 2zw3 n LEU 89 N -4.93 0.62 -0.01 0.00 4.77 -0.93 -2.81 117.00 113.71 2zw3 n LEU 89 Ca 0.12 0.11 -0.18 0.00 -0.03 0.00 0.00 56.01 56.04 2zw3 n LEU 89 Cb 0.34 -0.09 -0.08 0.00 -2.33 0.00 0.00 43.42 41.26 2zw3 n LEU 89 CO 0.22 -0.04 0.25 0.25 -1.33 0.00 0.00 177.39 176.74 2zw3 h LEU 90 N 0.00 0.86 0.73 2.23 7.12 0.14 -1.90 115.31 124.50 2zw3 h LEU 90 Ca 0.00 -0.66 -0.04 0.00 0.13 0.00 0.00 57.88 57.31 2zw3 h LEU 90 Cb 0.84 -0.26 0.01 0.00 -0.53 0.00 0.00 40.66 40.72 2zw3 h LEU 90 CO 0.00 1.39 -0.35 0.58 -0.13 0.00 0.00 178.44 179.92 2zw3 h VAL 91 N 0.40 0.01 -0.99 1.05 2.07 -1.38 0.20 116.25 117.61 2zw3 h VAL 91 Ca -0.07 -0.28 0.29 0.00 0.82 0.00 0.00 66.70 67.46 2zw3 h VAL 91 Cb 1.41 0.01 -0.04 0.00 -1.52 0.00 0.00 31.29 31.16 2zw3 h VAL 91 CO 0.16 0.00 0.78 0.00 0.02 0.00 0.00 177.57 178.53 2zw3 h ALA 92 N -1.25 2.89 0.18 1.67 0.00 -1.63 0.81 119.26 121.92 2zw3 h ALA 92 Ca -0.10 -0.03 -0.31 0.00 0.00 0.00 0.00 54.91 54.47 2zw3 h ALA 92 Cb 0.76 0.07 0.03 0.00 0.00 0.00 0.00 17.79 18.65 2zw3 h ALA 92 CO 0.17 -1.29 -1.34 1.98 0.00 0.00 0.00 179.25 178.76 2zw3 h MET 93 N 0.00 0.50 -0.03 0.00 -1.53 -1.15 -2.76 114.93 109.96 2zw3 h MET 93 Ca 0.47 -0.78 -0.04 0.00 -3.44 0.00 0.00 59.70 55.91 2zw3 h MET 93 Cb 2.02 0.28 -0.01 0.00 -0.55 0.00 0.00 31.60 33.35 2zw3 h MET 93 CO -0.00 1.36 -0.17 1.25 0.14 0.00 0.00 176.91 179.49 2zw3 h HIS 94 N 0.17 0.05 0.03 1.39 6.17 0.37 -2.89 115.15 120.45 2zw3 h HIS 94 Ca -0.20 -0.01 -0.00 0.00 0.71 0.00 0.00 60.37 60.87 2zw3 h HIS 94 Cb 2.03 -0.02 0.00 0.00 2.52 0.00 0.00 27.41 31.95 2zw3 h HIS 94 CO 0.11 0.23 -0.01 -0.24 0.71 0.00 0.00 177.93 178.72 2zw3 h VAL 95 N 0.05 0.00 0.00 5.26 3.04 -0.69 -2.57 116.25 121.33 2zw3 h VAL 95 Ca 0.01 -0.77 0.00 0.00 -1.01 0.00 0.00 66.70 64.93 2zw3 h VAL 95 Cb 0.34 0.00 0.00 0.00 -2.01 0.00 0.00 31.29 29.62 2zw3 h VAL 95 CO 0.02 0.00 0.11 0.00 -1.01 0.00 0.00 177.57 176.69 2zw3 h ALA 96 N -1.21 1.08 0.00 3.17 0.00 -1.57 0.22 119.26 120.95 2zw3 h ALA 96 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2zw3 h ALA 96 Cb 0.03 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.82 2zw3 h ALA 96 CO 0.01 -0.08 -0.27 -0.92 0.00 0.00 0.00 179.25 177.98 2zw3 h TYR 97 N 0.00 0.00 -0.45 0.00 3.20 -1.64 -3.28 116.97 114.80 2zw3 h TYR 97 Ca 0.00 0.00 0.02 0.00 3.14 0.00 0.00 58.73 61.89 2zw3 h TYR 97 Cb 0.21 0.00 -0.02 0.00 1.54 0.00 0.00 36.73 38.46 2zw3 h TYR 97 CO 0.00 0.00 0.30 0.00 -1.64 0.00 0.00 178.16 176.82 2zw3 h ARG 98 N -0.67 0.54 -0.10 1.82 3.08 -1.02 0.13 114.38 118.16 2zw3 h ARG 98 Ca 0.00 -0.03 -0.17 0.00 0.07 0.00 0.00 59.98 59.85 2zw3 h ARG 98 Cb 0.27 -0.12 0.01 0.00 0.08 0.00 0.00 29.97 30.21 2zw3 h ARG 98 CO 0.00 0.36 -0.60 -0.09 -1.07 0.00 0.00 179.97 178.57 2zw3 h ARG 99 N 0.56 0.58 -0.27 0.04 2.43 -0.81 -1.89 114.38 115.02 2zw3 h ARG 99 Ca 0.17 -0.49 -0.08 0.00 -0.81 0.00 0.00 59.98 58.78 2zw3 h ARG 99 Cb 0.01 0.11 -0.01 0.00 -0.42 0.00 0.00 29.97 29.66 2zw3 h ARG 99 CO -0.04 1.12 -0.16 1.25 -1.51 0.00 0.00 179.97 180.63 2zw3 h HIS 100 N 0.20 0.50 0.11 2.20 2.76 -1.54 -2.91 115.15 116.46 2zw3 h HIS 100 Ca -0.05 -0.08 -0.01 0.00 -2.20 0.00 0.00 60.37 58.04 2zw3 h HIS 100 Cb 1.25 -0.13 0.00 0.00 1.55 0.00 0.00 27.41 30.08 2zw3 h HIS 100 CO 0.11 0.60 -0.05 1.49 -1.30 0.00 0.00 177.93 178.78 2zw3 h GLU 101 N 0.42 -0.14 -1.00 5.26 4.57 -0.71 -2.97 114.58 120.01 2zw3 h GLU 101 Ca 0.08 0.01 0.23 0.00 -1.18 0.00 0.00 59.36 58.50 2zw3 h GLU 101 Cb 0.53 0.03 -0.09 0.00 -0.16 0.00 0.00 28.75 29.06 2zw3 h GLU 101 CO 0.03 -0.09 0.64 0.87 -1.18 0.00 0.00 179.01 179.28 2zw3 h LYS 102 N -0.23 0.47 0.68 1.92 1.57 -1.47 -2.56 116.57 116.95 2zw3 h LYS 102 Ca -0.01 -0.03 -0.03 0.00 -1.87 0.00 0.00 60.65 58.70 2zw3 h LYS 102 Cb 0.11 -0.11 0.01 0.00 0.08 0.00 0.00 32.23 32.32 2zw3 h LYS 102 CO 0.02 0.31 -0.33 -0.22 -0.57 0.00 0.00 179.45 178.67 2zw3 h LYS 103 N 0.48 -0.88 0.00 3.15 3.64 -1.62 -2.99 116.57 118.35 2zw3 h LYS 103 Ca 0.56 0.06 0.00 0.00 -1.27 0.00 0.00 60.65 60.00 2zw3 h LYS 103 Cb 1.28 0.20 0.00 0.00 -0.41 0.00 0.00 32.23 33.30 2zw3 h LYS 103 CO -0.29 -0.59 0.00 -2.13 -2.27 0.00 0.00 179.45 174.17 2zw3 n ARG 104 N -5.25 0.86 -0.05 1.90 0.63 -1.11 -2.61 116.66 111.02 2zw3 n ARG 104 Ca -0.11 0.00 -0.03 0.00 -0.92 0.00 0.00 57.85 56.79 2zw3 n ARG 104 Cb 0.36 -1.26 -0.12 0.00 0.45 0.00 0.00 32.46 31.89 2zw3 n ARG 104 CO 0.00 0.00 0.00 1.63 -2.51 0.00 0.00 177.63 176.75 2zw3 n LYS 105 N -0.76 1.29 -0.24 -0.14 5.02 -0.98 -4.55 118.16 117.80 2zw3 n LYS 105 Ca 0.11 -0.05 0.06 0.00 -2.02 0.00 0.00 58.31 56.41 2zw3 n LYS 105 Cb 0.05 -1.37 0.17 0.00 -0.02 0.00 0.00 35.03 33.86 2zw3 n LYS 105 CO 0.00 0.00 0.00 1.19 -0.52 0.00 0.00 177.40 178.07 2zw3 n PHE 106 N -2.40 0.56 -0.01 2.13 3.72 -1.13 -3.37 117.46 116.96 2zw3 n PHE 106 Ca -0.18 -0.63 -0.15 0.00 -0.05 0.00 0.00 57.45 56.45 2zw3 n PHE 106 Cb 0.81 -0.12 -0.14 0.00 -0.94 0.00 0.00 39.48 39.10 2zw3 n PHE 106 CO 0.00 0.00 0.00 1.51 -0.05 0.00 0.00 176.76 178.22 2zw3 n ILE 107 N 0.08 1.70 -0.09 4.37 3.06 -1.07 -4.57 119.36 122.83 2zw3 n ILE 107 Ca 0.14 -0.73 -0.14 0.00 -2.50 0.00 0.00 62.75 59.52 2zw3 n ILE 107 Cb 0.56 -1.38 -0.08 0.00 0.54 0.00 0.00 39.64 39.28 2zw3 n ILE 107 CO 0.00 0.00 0.00 0.29 -2.50 0.00 0.00 176.55 174.34 2zw3 n LYS 108 N -3.26 0.44 0.00 9.51 5.02 -1.26 -5.13 118.16 123.48 2zw3 n LYS 108 Ca -0.24 0.12 0.00 0.00 -2.02 0.00 0.00 58.31 56.16 2zw3 n LYS 108 Cb 1.05 -1.33 0.00 0.00 -0.02 0.00 0.00 35.03 34.73 2zw3 n LYS 108 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2zw3 n GLY 109 N 2.52 1.25 0.00 0.72 0.00 -1.22 -5.16 105.19 103.31 2zw3 n GLY 109 Ca -0.33 -0.36 0.00 0.00 0.00 0.00 0.00 46.02 45.34 2zw3 n GLY 109 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2zw3 n LYS 125 N 0.00 0.52 0.19 1.61 5.02 -1.26 -4.64 118.16 119.60 2zw3 n LYS 125 Ca 0.00 -0.70 0.10 0.00 -2.02 0.00 0.00 58.31 55.69 2zw3 n LYS 125 Cb 0.00 -0.83 0.12 0.00 -0.02 0.00 0.00 35.03 34.31 2zw3 n LYS 125 CO 0.00 0.00 0.00 0.28 -0.52 0.00 0.00 177.40 177.16 2zw3 h VAL 126 N 0.66 0.16 0.00 -0.18 2.07 -2.03 -3.07 116.25 113.85 2zw3 h VAL 126 Ca 0.00 -1.24 0.00 0.00 0.82 0.00 0.00 66.70 66.28 2zw3 h VAL 126 Cb 0.40 2.03 0.00 0.00 -1.52 0.00 0.00 31.29 32.20 2zw3 h VAL 126 CO 0.00 0.09 -0.93 -1.14 0.02 0.00 0.00 177.57 175.62 2zw3 n ARG 127 N -3.08 0.65 0.10 1.57 3.00 -1.26 -2.13 116.66 115.51 2zw3 n ARG 127 Ca 0.03 -0.00 -0.15 0.00 -0.00 0.00 0.00 57.85 57.72 2zw3 n ARG 127 Cb 0.57 -1.41 -0.12 0.00 0.00 0.00 0.00 32.46 31.51 2zw3 n ARG 127 CO 0.00 0.00 0.00 0.97 0.00 0.00 0.00 177.63 178.60 2zw3 h ILE 128 N 0.00 1.47 0.00 5.15 2.10 -1.98 -0.90 117.51 123.35 2zw3 h ILE 128 Ca 0.00 -2.91 -0.02 0.00 1.08 0.00 0.00 64.86 63.01 2zw3 h ILE 128 Cb 0.46 2.83 -0.00 0.00 -1.09 0.00 0.00 36.82 39.01 2zw3 h ILE 128 CO 0.00 0.85 -0.99 -0.08 -1.08 0.00 0.00 178.15 176.85 2zw3 h GLU 129 N 0.11 0.00 0.00 2.19 4.81 -1.70 -3.24 114.58 116.75 2zw3 h GLU 129 Ca -0.12 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.11 2zw3 h GLU 129 Cb 1.88 0.00 0.00 0.00 0.63 0.00 0.00 28.75 31.26 2zw3 h GLU 129 CO 0.20 0.05 0.00 0.41 -0.73 0.00 0.00 179.01 178.93 2zw3 n GLY 130 N 1.20 0.18 0.13 1.92 0.00 -0.91 -3.43 105.19 104.30 2zw3 n GLY 130 Ca -0.01 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 45.94 2zw3 n GLY 130 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 2zw3 h SER 131 N 0.00 -0.14 0.14 1.61 0.02 -1.39 -2.28 113.55 111.51 2zw3 h SER 131 Ca 0.00 0.07 -0.30 0.00 -0.84 0.00 0.00 61.79 60.71 2zw3 h SER 131 Cb 0.00 0.12 0.00 0.00 0.14 0.00 0.00 62.40 62.67 2zw3 h SER 131 CO 0.00 -0.04 -1.54 0.25 -1.14 0.00 0.00 176.83 174.36 2zw3 h LEU 132 N 0.06 0.46 -0.86 5.07 7.12 -1.67 -2.38 115.31 123.11 2zw3 h LEU 132 Ca 0.13 -0.89 0.00 0.00 0.13 0.00 0.00 57.88 57.26 2zw3 h LEU 132 Cb 0.18 -0.15 0.00 0.00 -0.53 0.00 0.00 40.66 40.16 2zw3 h LEU 132 CO -0.24 1.68 0.00 -0.50 -0.13 0.00 0.00 178.44 179.25 2zw3 h TRP 133 N -0.15 0.00 0.09 1.25 -0.00 -1.58 -1.68 115.95 113.87 2zw3 h TRP 133 Ca -0.32 0.00 -0.24 0.00 -0.00 0.00 0.00 58.89 58.33 2zw3 h TRP 133 Cb 1.88 0.00 -0.00 0.00 -0.00 0.00 0.00 29.16 31.04 2zw3 h TRP 133 CO 0.12 0.00 -1.22 2.35 -0.00 0.00 0.00 178.44 179.69 2zw3 h TRP 134 N 0.00 0.36 -0.23 0.49 -0.00 -1.43 -3.12 115.95 112.01 2zw3 h TRP 134 Ca 0.00 -0.26 -0.09 0.00 -0.00 0.00 0.00 58.89 58.54 2zw3 h TRP 134 Cb 0.32 -0.01 -0.01 0.00 -0.00 0.00 0.00 29.16 29.46 2zw3 h TRP 134 CO 0.00 1.48 -0.23 1.79 -0.00 0.00 0.00 178.44 181.47 2zw3 h THR 135 N -0.46 1.26 -0.63 2.65 1.35 -1.31 -2.35 112.91 113.43 2zw3 h THR 135 Ca -0.27 -1.20 -0.00 0.00 -0.55 0.00 0.00 66.41 64.39 2zw3 h THR 135 Cb 1.63 1.34 -0.03 0.00 -1.73 0.00 0.00 68.15 69.35 2zw3 h THR 135 CO 0.03 0.38 0.39 0.22 -0.25 0.00 0.00 175.52 176.29 2zw3 h TYR 136 N 0.39 0.81 -0.45 4.73 3.20 -1.47 0.46 116.97 124.63 2zw3 h TYR 136 Ca 0.06 0.01 -0.10 0.00 3.14 0.00 0.00 58.73 61.84 2zw3 h TYR 136 Cb 0.62 -0.27 -0.01 0.00 1.54 0.00 0.00 36.73 38.61 2zw3 h TYR 136 CO 0.02 0.53 -0.12 0.00 -1.64 0.00 0.00 178.16 176.95 2zw3 h THR 137 N 0.86 1.27 0.00 1.81 1.03 -1.36 -1.11 112.91 115.41 2zw3 h THR 137 Ca 0.23 -1.24 -0.09 0.00 -0.01 0.00 0.00 66.41 65.30 2zw3 h THR 137 Cb -0.05 1.14 -0.01 0.00 -1.07 0.00 0.00 68.15 68.15 2zw3 h THR 137 CO -0.04 0.42 -0.44 0.28 -0.01 0.00 0.00 175.52 175.73 2zw3 h SER 138 N 0.72 0.00 0.91 0.00 0.02 -1.08 -2.33 113.55 111.78 2zw3 h SER 138 Ca 0.11 0.00 -0.04 0.00 -0.84 0.00 0.00 61.79 61.02 2zw3 h SER 138 Cb 0.66 0.00 0.01 0.00 0.14 0.00 0.00 62.40 63.21 2zw3 h SER 138 CO 0.05 0.44 -0.44 -1.28 -1.14 0.00 0.00 176.83 174.46 2zw3 h SER 139 N 0.00 -1.03 -1.05 3.07 0.87 0.10 0.16 113.55 115.66 2zw3 h SER 139 Ca -0.00 0.03 0.28 0.00 -1.23 0.00 0.00 61.79 60.86 2zw3 h SER 139 Cb 1.01 0.27 -0.10 0.00 -0.44 0.00 0.00 62.40 63.14 2zw3 h SER 139 CO 0.06 -0.71 0.68 0.40 -0.53 0.00 0.00 176.83 176.72 2zw3 h ILE 140 N -1.26 0.50 -0.21 2.23 2.04 -1.11 0.88 117.51 120.57 2zw3 h ILE 140 Ca -0.12 -0.13 -0.02 0.00 1.00 0.00 0.00 64.86 65.59 2zw3 h ILE 140 Cb 0.94 0.09 -0.01 0.00 -0.74 0.00 0.00 36.82 37.10 2zw3 h ILE 140 CO 0.20 0.07 0.05 0.15 0.00 0.00 0.00 178.15 178.63 2zw3 h PHE 141 N 0.38 0.36 -0.39 1.37 3.57 -1.19 -2.75 116.94 118.29 2zw3 h PHE 141 Ca 0.61 -0.04 0.02 0.00 3.53 0.00 0.00 57.97 62.09 2zw3 h PHE 141 Cb 1.57 -0.10 -0.03 0.00 2.79 0.00 0.00 35.95 40.18 2zw3 h PHE 141 CO -0.00 0.45 0.22 0.74 -2.23 0.00 0.00 178.31 177.49 2zw3 h PHE 142 N 0.17 0.41 -0.19 0.41 0.04 0.34 -0.56 116.94 117.55 2zw3 h PHE 142 Ca 0.07 0.01 0.05 0.00 2.80 0.00 0.00 57.97 60.91 2zw3 h PHE 142 Cb 0.27 -0.13 -0.07 0.00 2.20 0.00 0.00 35.95 38.23 2zw3 h PHE 142 CO 0.01 0.24 -0.31 0.00 -0.60 0.00 0.00 178.31 177.64 2zw3 h ARG 143 N 0.45 -0.34 0.00 1.51 3.08 0.37 0.27 114.38 119.72 2zw3 h ARG 143 Ca 0.16 0.02 0.00 0.00 0.07 0.00 0.00 59.98 60.23 2zw3 h ARG 143 Cb 0.02 0.08 0.00 0.00 0.08 0.00 0.00 29.97 30.15 2zw3 h ARG 143 CO -0.08 -0.23 0.00 0.28 -1.07 0.00 0.00 179.97 178.87 2zw3 h VAL 144 N -0.35 0.00 -0.12 2.04 2.07 -1.38 0.17 116.25 118.68 2zw3 h VAL 144 Ca 0.11 -0.53 -0.17 0.00 0.82 0.00 0.00 66.70 66.93 2zw3 h VAL 144 Cb 0.53 1.45 -0.00 0.00 -1.52 0.00 0.00 31.29 31.75 2zw3 h VAL 144 CO -0.39 0.00 -0.65 -0.29 0.02 0.00 0.00 177.57 176.26 2zw3 h ILE 145 N 0.00 1.35 0.00 4.57 2.10 0.26 -2.91 117.51 122.87 2zw3 h ILE 145 Ca 0.00 -1.98 -0.00 0.00 1.08 0.00 0.00 64.86 63.96 2zw3 h ILE 145 Cb 0.61 1.96 -0.00 0.00 -1.09 0.00 0.00 36.82 38.30 2zw3 h ILE 145 CO 0.00 0.60 -0.01 -0.26 -1.08 0.00 0.00 178.15 177.40 2zw3 h PHE 146 N 0.34 0.00 -0.76 2.19 0.05 -0.49 -0.92 116.94 117.35 2zw3 h PHE 146 Ca -0.01 0.00 0.22 0.00 3.82 0.00 0.00 57.97 62.00 2zw3 h PHE 146 Cb 1.21 0.00 -0.03 0.00 2.00 0.00 0.00 35.95 39.13 2zw3 h PHE 146 CO 0.05 0.21 0.91 0.93 -0.18 0.00 0.00 178.31 180.23 2zw3 h GLU 147 N -1.00 0.00 0.00 1.51 4.39 -0.83 0.30 114.58 118.95 2zw3 h GLU 147 Ca -0.00 0.00 -0.07 0.00 0.34 0.00 0.00 59.36 59.63 2zw3 h GLU 147 Cb 0.22 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 28.86 2zw3 h GLU 147 CO -0.00 0.00 -1.89 0.00 -1.16 0.00 0.00 179.01 175.96 2zw3 n ALA 148 N -2.25 2.42 -0.13 3.43 0.00 -1.10 -3.27 120.51 119.61 2zw3 n ALA 148 Ca 0.16 -0.58 -0.06 0.00 0.00 0.00 0.00 53.44 52.97 2zw3 n ALA 148 Cb 1.16 -0.50 0.12 0.00 0.00 0.00 0.00 19.45 20.24 2zw3 n ALA 148 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2zw3 h ALA 149 N 1.45 1.01 0.00 0.00 0.00 0.10 -2.21 119.26 119.61 2zw3 h ALA 149 Ca -0.10 -0.29 -0.07 0.00 0.00 0.00 0.00 54.91 54.45 2zw3 h ALA 149 Cb 1.09 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 18.68 2zw3 h ALA 149 CO 0.01 0.61 -0.50 0.74 0.00 0.00 0.00 179.25 180.10 2zw3 h PHE 150 N 0.78 0.00 -1.20 0.00 -1.00 -1.58 -3.02 116.94 110.92 2zw3 h PHE 150 Ca 0.14 0.00 0.40 0.00 2.81 0.00 0.00 57.97 61.33 2zw3 h PHE 150 Cb 0.52 0.00 -0.11 0.00 3.61 0.00 0.00 35.95 39.98 2zw3 h PHE 150 CO 0.03 0.65 0.79 -0.12 -1.61 0.00 0.00 178.31 178.05 2zw3 n MET 151 N -4.60 -0.03 0.25 1.51 0.00 -1.20 0.15 117.12 113.21 2zw3 n MET 151 Ca -0.13 1.01 -0.10 0.00 -0.00 0.00 0.00 57.70 58.48 2zw3 n MET 151 Cb 0.37 -2.04 -0.05 0.00 0.00 0.00 0.00 33.22 31.51 2zw3 n MET 151 CO 0.00 0.00 0.00 -0.92 0.00 0.00 0.00 175.97 175.05 2zw3 h TYR 152 N 0.00 -0.62 0.00 1.12 3.20 -1.46 -3.19 116.97 116.02 2zw3 h TYR 152 Ca 0.73 -0.01 0.03 0.00 3.14 0.00 0.00 58.73 62.62 2zw3 h TYR 152 Cb 2.44 0.21 -0.05 0.00 1.54 0.00 0.00 36.73 40.87 2zw3 h TYR 152 CO -0.00 -0.39 -0.42 0.28 -1.64 0.00 0.00 178.16 175.99 2zw3 h VAL 153 N -0.91 0.15 0.00 1.81 2.07 -0.15 0.91 116.25 120.13 2zw3 h VAL 153 Ca -0.07 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.45 2zw3 h VAL 153 Cb 0.51 0.15 0.00 0.00 -1.52 0.00 0.00 31.29 30.43 2zw3 h VAL 153 CO 0.11 0.00 0.49 0.49 0.02 0.00 0.00 177.57 178.69 2zw3 n PHE 154 N -5.45 0.13 -0.02 1.57 3.01 0.94 0.11 117.46 117.75 2zw3 n PHE 154 Ca -0.06 0.07 -0.01 0.00 1.01 0.00 0.00 57.45 58.46 2zw3 n PHE 154 Cb 0.37 -0.24 -0.03 0.00 -0.01 0.00 0.00 39.48 39.56 2zw3 n PHE 154 CO 0.00 0.00 0.00 0.98 1.01 0.00 0.00 176.76 178.75 2zw3 n TYR 155 N -1.64 0.00 -0.08 1.38 9.36 -0.41 -4.51 117.16 121.26 2zw3 n TYR 155 Ca -0.00 0.00 -0.22 0.00 3.32 0.00 0.00 57.90 61.00 2zw3 n TYR 155 Cb 0.50 -0.20 -0.12 0.00 -0.63 0.00 0.00 39.34 38.89 2zw3 n TYR 155 CO 0.00 0.00 0.00 0.28 0.22 0.00 0.00 176.86 177.36 2zw3 n VAL 156 N -2.09 1.61 -0.29 2.97 0.31 0.38 -4.33 118.33 116.90 2zw3 n VAL 156 Ca -0.06 -0.44 -0.03 0.00 -0.01 0.00 0.00 64.34 63.80 2zw3 n VAL 156 Cb 0.56 -1.76 0.14 0.00 -0.91 0.00 0.00 33.84 31.87 2zw3 n VAL 156 CO 0.00 0.00 0.00 -0.03 -1.32 0.00 0.00 176.83 175.48 2zw3 h MET 157 N -0.38 1.16 -2.42 5.55 1.85 0.53 -3.38 114.93 117.84 2zw3 h MET 157 Ca -0.49 -0.13 -0.72 0.00 -0.61 0.00 0.00 59.70 57.75 2zw3 h MET 157 Cb 1.76 -0.23 -0.33 0.00 0.43 0.00 0.00 31.60 33.22 2zw3 h MET 157 CO -0.11 0.84 0.29 0.66 -0.40 0.00 0.00 176.91 178.19 2zw3 n TYR 158 N -4.35 3.09 -4.06 1.39 4.02 -1.25 -4.95 117.16 111.05 2zw3 n TYR 158 Ca 0.09 -3.18 -0.42 0.00 -0.01 0.00 0.00 57.90 54.38 2zw3 n TYR 158 Cb 0.09 -0.93 0.01 0.00 -0.02 0.00 0.00 39.34 38.49 2zw3 n TYR 158 CO 0.00 0.00 0.00 -0.25 -1.01 0.00 0.00 176.86 175.60 2zw3 n ASP 159 N 0.41 -3.34 0.00 7.72 8.00 -1.26 -4.36 116.55 123.72 2zw3 n ASP 159 Ca 0.35 -1.17 0.00 0.00 0.71 0.00 0.00 54.79 54.68 2zw3 n ASP 159 Cb 0.34 -1.41 0.00 0.00 -0.02 0.00 0.00 41.12 40.03 2zw3 n ASP 159 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2zw3 n GLY 160 N -2.02 -1.13 0.74 0.44 0.00 -1.26 -4.59 105.19 97.37 2zw3 n GLY 160 Ca -0.11 -1.68 0.10 0.00 0.00 0.00 0.00 46.02 44.33 2zw3 n GLY 160 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 173.32 175.29 2zw3 n PHE 161 N 0.00 0.00 -2.75 1.61 1.16 -1.26 -4.74 117.46 111.47 2zw3 n PHE 161 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 57.45 55.58 2zw3 n PHE 161 Cb 0.00 0.00 0.00 0.00 -1.61 0.00 0.00 39.48 37.87 2zw3 n PHE 161 CO 0.00 0.00 0.00 -1.13 -1.87 0.00 0.00 176.76 173.76 2zw3 n SER 162 N 0.86 0.00 -4.06 5.98 3.41 -1.26 -4.87 113.62 113.68 2zw3 n SER 162 Ca 0.11 0.00 -0.20 0.00 -0.26 0.00 0.00 58.87 58.52 2zw3 n SER 162 Cb 0.49 0.00 -0.15 0.00 -0.26 0.00 0.00 64.21 64.30 2zw3 n SER 162 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2zw3 s MET 163 N 1.01 0.86 0.83 4.33 0.23 -1.26 -4.81 119.30 120.49 2zw3 s MET 163 Ca 0.00 -0.41 -0.12 0.00 -1.03 0.00 0.00 55.69 54.13 2zw3 s MET 163 Cb 0.00 -0.83 0.09 0.00 -1.53 0.00 0.00 34.83 32.56 2zw3 s MET 163 CO 0.00 0.23 1.13 -0.65 -2.03 0.00 0.00 175.02 173.70 2zw3 s GLN 164 N -0.32 1.83 0.10 3.16 -0.21 -1.26 -4.71 119.66 118.24 2zw3 s GLN 164 Ca 0.04 0.35 -0.15 0.00 0.02 0.00 0.00 55.36 55.62 2zw3 s GLN 164 Cb -0.04 -1.91 -0.09 0.00 1.00 0.00 0.00 33.01 31.97 2zw3 s GLN 164 CO -0.00 -1.74 1.42 0.00 -2.12 0.00 0.00 175.29 172.85 2zw3 h ARG 165 N -1.17 0.70 -5.98 2.91 3.08 -1.96 -3.44 114.38 108.53 2zw3 h ARG 165 Ca -0.48 -0.37 -0.53 0.00 0.07 0.00 0.00 59.98 58.67 2zw3 h ARG 165 Cb 1.30 0.01 -0.20 0.00 0.08 0.00 0.00 29.97 31.17 2zw3 h ARG 165 CO 0.63 0.99 -0.80 -0.48 -1.07 0.00 0.00 179.97 179.23 2zw3 s LEU 166 N -8.97 2.36 0.12 3.04 2.34 -1.26 -1.70 118.68 114.61 2zw3 s LEU 166 Ca -0.12 -0.76 0.10 0.00 0.06 0.00 0.00 54.13 53.41 2zw3 s LEU 166 Cb 0.09 -0.82 -0.04 0.00 -0.56 0.00 0.00 46.19 44.86 2zw3 s LEU 166 CO 0.83 0.00 -0.26 0.54 -1.06 0.00 0.00 176.35 176.40 2zw3 s VAL 167 N -1.58 2.17 -0.56 1.48 0.11 -0.43 -4.97 120.40 116.61 2zw3 s VAL 167 Ca 0.10 -1.70 -0.18 0.00 -2.93 0.00 0.00 61.98 57.27 2zw3 s VAL 167 Cb -0.08 -1.92 0.11 0.00 -1.53 0.00 0.00 36.38 32.96 2zw3 s VAL 167 CO 0.05 0.08 0.61 -0.54 -3.33 0.00 0.00 175.10 171.98 2zw3 s LYS 168 N -1.98 3.03 -0.20 1.54 3.01 -1.26 -1.37 119.74 122.50 2zw3 s LYS 168 Ca 0.13 -1.42 -0.08 0.00 -1.01 0.00 0.00 55.97 53.58 2zw3 s LYS 168 Cb -0.10 -4.26 -0.04 0.00 -1.01 0.00 0.00 37.83 32.42 2zw3 s LYS 168 CO 0.05 -1.42 0.08 0.00 0.51 0.00 0.00 175.35 174.58 2zw3 n ASN 170 N 3.84 5.58 -4.46 0.00 4.05 -1.26 -3.18 115.26 119.83 2zw3 n ASN 170 Ca -0.16 -2.92 -0.45 0.00 0.45 0.00 0.00 54.58 51.50 2zw3 n ASN 170 Cb 0.52 -0.69 -0.01 0.00 1.23 0.00 0.00 39.78 40.83 2zw3 n ASN 170 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 2zw3 n ALA 171 N 0.57 -1.72 -0.31 5.20 0.00 -1.26 -4.82 120.51 118.17 2zw3 n ALA 171 Ca 0.28 0.33 0.00 0.00 0.00 0.00 0.00 53.44 54.05 2zw3 n ALA 171 Cb 1.18 -1.77 0.00 0.00 0.00 0.00 0.00 19.45 18.87 2zw3 n ALA 171 CO 0.00 0.00 0.00 1.87 0.00 0.00 0.00 177.50 179.37 2zw3 n TRP 172 N -0.23 0.00 0.95 0.00 -0.00 -1.26 -2.25 117.44 114.65 2zw3 n TRP 172 Ca 0.13 0.00 0.01 0.00 -0.00 0.00 0.00 57.50 57.64 2zw3 n TRP 172 Cb 0.32 -0.21 0.06 0.00 -0.00 0.00 0.00 31.31 31.48 2zw3 n TRP 172 CO 0.00 0.00 0.00 -0.35 -0.00 0.00 0.00 177.69 177.34 2zw3 n PRO 173 N -1.95 1.51 -2.81 5.87 -0.04 -1.26 -4.72 135.00 131.60 2zw3 n PRO 173 Ca 0.00 -0.46 -0.33 0.00 -0.04 0.00 0.00 63.50 62.67 2zw3 n PRO 173 Cb 0.00 -1.48 -0.07 0.00 -0.04 0.00 0.00 33.50 31.91 2zw3 n PRO 173 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2zw3 s PRO 175 N -3.23 3.61 3.75 0.00 0.02 -1.26 -4.87 135.00 133.02 2zw3 s PRO 175 Ca 0.61 1.11 0.00 0.00 0.02 0.00 0.00 61.00 62.74 2zw3 s PRO 175 Cb -0.09 -4.03 0.00 0.00 0.02 0.00 0.00 34.50 30.40 2zw3 s PRO 175 CO 0.14 -1.51 0.00 0.09 -0.33 0.00 0.00 177.00 175.39 2zw3 n ASN 176 N 8.80 0.00 -4.56 2.53 3.02 -1.26 -4.34 115.26 119.45 2zw3 n ASN 176 Ca 0.17 0.00 -0.40 0.00 -0.03 0.00 0.00 54.58 54.32 2zw3 n ASN 176 Cb 0.47 0.00 -0.09 0.00 -0.61 0.00 0.00 39.78 39.55 2zw3 n ASN 176 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 2zw3 s THR 177 N 0.00 5.17 0.22 3.41 2.01 -1.26 -4.78 115.64 120.41 2zw3 s THR 177 Ca 0.00 0.21 0.08 0.00 0.31 0.00 0.00 61.69 62.29 2zw3 s THR 177 Cb 0.00 -3.78 -0.04 0.00 0.01 0.00 0.00 72.50 68.69 2zw3 s THR 177 CO 0.00 -0.01 0.02 0.68 -0.69 0.00 0.00 174.62 174.62 2zw3 s VAL 178 N 2.04 3.69 0.41 3.82 -7.23 -1.19 -4.97 120.40 116.96 2zw3 s VAL 178 Ca 0.13 -1.64 -0.04 0.00 -1.81 0.00 0.00 61.98 58.62 2zw3 s VAL 178 Cb -0.16 -2.92 -0.04 0.00 0.56 0.00 0.00 36.38 33.82 2zw3 s VAL 178 CO 0.11 -0.25 0.68 -1.81 -0.31 0.00 0.00 175.10 173.52 2zw3 s ASP 179 N -3.37 6.32 0.16 4.85 1.11 -1.26 -1.30 116.67 123.18 2zw3 s ASP 179 Ca 0.30 0.77 -0.12 0.00 0.18 0.00 0.00 52.55 53.68 2zw3 s ASP 179 Cb -0.08 -2.17 0.01 0.00 1.07 0.00 0.00 42.92 41.74 2zw3 s ASP 179 CO 0.20 -0.43 0.36 0.00 1.18 0.00 0.00 175.17 176.48 2zw3 s PHE 181 N -3.91 0.41 0.69 0.00 0.40 0.19 -1.32 117.98 114.44 2zw3 s PHE 181 Ca 0.12 -0.10 -0.01 0.00 -0.60 0.00 0.00 56.93 56.34 2zw3 s PHE 181 Cb 0.02 -0.26 0.11 0.00 0.51 0.00 0.00 43.02 43.40 2zw3 s PHE 181 CO -0.03 -0.01 0.96 0.08 0.70 0.00 0.00 175.22 176.91 2zw3 s VAL 182 N -0.18 2.24 -0.17 -0.44 1.01 -0.69 -1.44 120.40 120.74 2zw3 s VAL 182 Ca 0.01 -0.57 -0.06 0.00 0.00 0.00 0.00 61.98 61.35 2zw3 s VAL 182 Cb -0.02 -2.67 -0.04 0.00 0.00 0.00 0.00 36.38 33.65 2zw3 s VAL 182 CO -0.00 0.00 0.03 -0.94 0.00 0.00 0.00 175.10 174.19 2zw3 s SER 183 N -4.67 5.40 -1.60 3.32 1.04 -1.26 -4.66 113.70 111.27 2zw3 s SER 183 Ca 0.64 0.03 -0.03 0.00 0.48 0.00 0.00 55.95 57.07 2zw3 s SER 183 Cb -0.07 -1.89 0.03 0.00 0.10 0.00 0.00 66.02 64.19 2zw3 s SER 183 CO 0.43 0.19 0.08 -2.11 0.98 0.00 0.00 173.24 172.82 2zw3 n ARG 184 N 3.43 -0.91 0.32 4.02 1.85 -1.26 -4.78 116.66 119.34 2zw3 n ARG 184 Ca -0.17 0.10 0.17 0.00 -1.00 0.00 0.00 57.85 56.95 2zw3 n ARG 184 Cb 0.52 -3.74 0.93 0.00 -1.05 0.00 0.00 32.46 29.13 2zw3 n ARG 184 CO 0.00 0.00 0.00 -1.35 -0.01 0.00 0.00 177.63 176.27 2zw3 h PRO 185 N -1.66 0.00 0.22 2.89 0.11 -1.86 0.84 132.00 132.54 2zw3 h PRO 185 Ca -0.65 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 65.45 2zw3 h PRO 185 Cb 1.40 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.51 2zw3 h PRO 185 CO 0.74 0.00 -0.11 1.79 -0.21 0.00 0.00 178.00 180.21 2zw3 h THR 186 N 0.00 0.24 -0.99 -1.15 1.35 -1.87 -1.89 112.91 108.61 2zw3 h THR 186 Ca 0.00 -0.89 0.23 0.00 -0.55 0.00 0.00 66.41 65.20 2zw3 h THR 186 Cb 0.37 0.42 -0.09 0.00 -1.73 0.00 0.00 68.15 67.12 2zw3 h THR 186 CO 0.00 0.07 0.64 -0.08 -0.25 0.00 0.00 175.52 175.89 2zw3 h GLU 187 N -1.04 0.45 -0.51 4.72 4.81 -1.76 0.79 114.58 122.04 2zw3 h GLU 187 Ca -0.03 -0.03 -0.09 0.00 -0.13 0.00 0.00 59.36 59.08 2zw3 h GLU 187 Cb 0.34 -0.10 -0.02 0.00 0.63 0.00 0.00 28.75 29.60 2zw3 h GLU 187 CO 0.05 0.30 -0.04 0.87 -0.73 0.00 0.00 179.01 179.46 2zw3 h LYS 188 N 0.46 0.89 0.16 1.92 1.57 -0.94 -2.74 116.57 117.89 2zw3 h LYS 188 Ca 0.55 -0.27 -0.01 0.00 -1.87 0.00 0.00 60.65 59.05 2zw3 h LYS 188 Cb 1.29 -0.08 0.00 0.00 0.08 0.00 0.00 32.23 33.52 2zw3 h LYS 188 CO -0.27 0.91 -0.08 1.15 -0.57 0.00 0.00 179.45 180.59 2zw3 h THR 189 N 0.81 0.61 -0.32 -0.16 2.02 0.89 -2.60 112.91 114.16 2zw3 h THR 189 Ca 0.15 -1.13 0.04 0.00 0.77 0.00 0.00 66.41 66.23 2zw3 h THR 189 Cb 0.54 1.06 -0.04 0.00 -1.74 0.00 0.00 68.15 67.97 2zw3 h THR 189 CO 0.03 0.17 -0.17 0.52 0.37 0.00 0.00 175.52 176.45 2zw3 n VAL 190 N -4.90 -0.20 0.68 3.16 0.31 0.22 0.35 118.33 117.96 2zw3 n VAL 190 Ca -0.06 0.76 0.11 0.00 -0.01 0.00 0.00 64.34 65.14 2zw3 n VAL 190 Cb 0.22 -0.96 0.46 0.00 -0.91 0.00 0.00 33.84 32.65 2zw3 n VAL 190 CO 0.00 0.00 0.00 0.49 -1.32 0.00 0.00 176.83 176.00 2zw3 n PHE 191 N -4.42 0.23 0.06 3.52 0.99 -1.03 -2.09 117.46 114.71 2zw3 n PHE 191 Ca 0.02 0.08 -0.13 0.00 -0.00 0.00 0.00 57.45 57.42 2zw3 n PHE 191 Cb 0.10 -0.62 -0.13 0.00 -1.00 0.00 0.00 39.48 37.82 2zw3 n PHE 191 CO 0.00 0.00 0.00 1.15 -0.00 0.00 0.00 176.76 177.91 2zw3 h THR 192 N 0.00 1.37 0.00 4.37 2.02 0.65 -3.05 112.91 118.27 2zw3 h THR 192 Ca 0.00 -3.04 0.00 0.00 0.77 0.00 0.00 66.41 64.14 2zw3 h THR 192 Cb 0.42 2.79 0.00 0.00 -1.74 0.00 0.00 68.15 69.61 2zw3 h THR 192 CO 0.00 0.84 0.00 0.52 0.37 0.00 0.00 175.52 177.25 2zw3 n VAL 193 N -3.39 0.00 -0.31 3.16 0.31 0.12 -0.90 118.33 117.32 2zw3 n VAL 193 Ca -0.10 1.42 -0.09 0.00 -0.01 0.00 0.00 64.34 65.56 2zw3 n VAL 193 Cb 1.01 -2.35 -0.06 0.00 -0.91 0.00 0.00 33.84 31.53 2zw3 n VAL 193 CO 0.00 0.00 0.00 -0.26 -1.32 0.00 0.00 176.83 175.25 2zw3 h PHE 194 N 0.00 -1.60 0.00 3.52 -1.00 -1.64 1.60 116.94 117.82 2zw3 h PHE 194 Ca 0.00 0.11 -0.01 0.00 2.81 0.00 0.00 57.97 60.88 2zw3 h PHE 194 Cb 0.00 0.81 -0.00 0.00 3.61 0.00 0.00 35.95 40.36 2zw3 h PHE 194 CO 0.04 -0.41 -0.04 0.52 -1.61 0.00 0.00 178.31 176.81 2zw3 h MET 195 N -0.13 0.00 0.01 1.51 2.86 -1.63 0.21 114.93 117.76 2zw3 h MET 195 Ca 0.18 0.00 -0.29 0.00 -2.06 0.00 0.00 59.70 57.53 2zw3 h MET 195 Cb 0.51 0.00 -0.05 0.00 0.06 0.00 0.00 31.60 32.12 2zw3 h MET 195 CO -0.83 0.04 -1.68 0.97 1.06 0.00 0.00 176.91 176.47 2zw3 h ILE 196 N 0.00 0.88 0.56 -1.22 6.09 0.19 -2.74 117.51 121.26 2zw3 h ILE 196 Ca -0.00 -2.72 -0.03 0.00 -1.37 0.00 0.00 64.86 60.74 2zw3 h ILE 196 Cb 0.17 2.44 0.01 0.00 0.47 0.00 0.00 36.82 39.91 2zw3 h ILE 196 CO 0.01 0.53 -0.27 0.00 -3.07 0.00 0.00 178.15 175.34 2zw3 h ALA 197 N 0.96 -0.75 -0.03 0.18 0.00 0.30 -2.15 119.26 117.78 2zw3 h ALA 197 Ca -0.28 -0.19 0.01 0.00 0.00 0.00 0.00 54.91 54.45 2zw3 h ALA 197 Cb 2.00 0.29 -0.00 0.00 0.00 0.00 0.00 17.79 20.08 2zw3 h ALA 197 CO 0.08 -0.75 0.09 0.28 0.00 0.00 0.00 179.25 178.96 2zw3 h VAL 198 N -1.09 0.14 0.00 0.00 2.07 -0.81 0.17 116.25 116.72 2zw3 h VAL 198 Ca -0.08 0.00 -0.08 0.00 0.82 0.00 0.00 66.70 67.36 2zw3 h VAL 198 Cb 0.63 0.91 -0.01 0.00 -1.52 0.00 0.00 31.29 31.30 2zw3 h VAL 198 CO 0.13 0.00 -0.38 -1.28 0.02 0.00 0.00 177.57 176.05 2zw3 h SER 199 N 0.00 0.00 0.01 0.57 0.87 -1.23 -1.88 113.55 111.88 2zw3 h SER 199 Ca 0.01 0.00 -0.11 0.00 -1.23 0.00 0.00 61.79 60.46 2zw3 h SER 199 Cb 0.20 0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 62.15 2zw3 h SER 199 CO -0.00 0.38 -0.60 1.23 -0.53 0.00 0.00 176.83 177.32 2zw3 h GLY 200 N 2.55 0.01 0.13 5.77 0.00 -0.10 -3.16 103.07 108.28 2zw3 h GLY 200 Ca -0.00 -0.04 0.05 0.00 0.00 0.00 0.00 47.33 47.34 2zw3 h GLY 200 CO 0.05 0.03 -0.34 -2.22 0.00 0.00 0.00 176.54 174.07 2zw3 h ILE 201 N -0.97 0.26 0.00 2.60 2.04 -1.07 0.29 117.51 120.67 2zw3 h ILE 201 Ca -0.16 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.70 2zw3 h ILE 201 Cb 1.17 0.26 0.00 0.00 -0.74 0.00 0.00 36.82 37.51 2zw3 h ILE 201 CO -0.09 0.00 0.00 0.00 0.00 0.00 0.00 178.15 178.06 2zw3 h ILE 203 N 0.00 1.63 -0.08 0.00 2.04 -0.42 -3.22 117.51 117.47 2zw3 h ILE 203 Ca 0.00 -2.28 -0.00 0.00 1.00 0.00 0.00 64.86 63.57 2zw3 h ILE 203 Cb 0.06 3.15 -0.00 0.00 -0.74 0.00 0.00 36.82 39.28 2zw3 h ILE 203 CO 0.00 0.62 0.04 -0.07 0.00 0.00 0.00 178.15 178.74 2zw3 h LEU 204 N -0.65 0.10 -0.80 1.44 3.38 -0.30 0.21 115.31 118.69 2zw3 h LEU 204 Ca -0.05 -0.13 0.09 0.00 0.09 0.00 0.00 57.88 57.87 2zw3 h LEU 204 Cb 1.20 -0.03 -0.07 0.00 0.09 0.00 0.00 40.66 41.85 2zw3 h LEU 204 CO 0.06 0.21 0.45 -0.07 0.09 0.00 0.00 178.44 179.18 2zw3 h LEU 205 N -0.01 0.65 -0.72 1.67 3.38 -1.65 0.83 115.31 119.46 2zw3 h LEU 205 Ca 0.03 0.05 -0.00 0.00 0.09 0.00 0.00 57.88 58.04 2zw3 h LEU 205 Cb 0.13 -0.08 -0.04 0.00 0.09 0.00 0.00 40.66 40.77 2zw3 h LEU 205 CO -0.00 0.38 0.45 0.78 0.09 0.00 0.00 178.44 180.13 2zw3 h ASN 206 N 0.77 0.86 1.27 -0.43 2.35 -1.46 -2.13 115.58 116.81 2zw3 h ASN 206 Ca 0.38 -0.05 -0.10 0.00 -0.55 0.00 0.00 56.30 55.98 2zw3 h ASN 206 Cb 0.33 -0.22 -0.01 0.00 0.05 0.00 0.00 38.32 38.47 2zw3 h ASN 206 CO -0.24 0.66 -0.47 1.62 -1.65 0.00 0.00 177.43 177.34 2zw3 h VAL 207 N 0.99 0.89 -0.46 2.81 3.04 0.65 -2.06 116.25 122.10 2zw3 h VAL 207 Ca 0.26 -2.02 -0.12 0.00 -1.01 0.00 0.00 66.70 63.80 2zw3 h VAL 207 Cb -0.06 2.27 -0.01 0.00 -2.01 0.00 0.00 31.29 31.49 2zw3 h VAL 207 CO -0.05 0.47 -0.21 0.74 -1.01 0.00 0.00 177.57 177.51 2zw3 h THR 208 N 0.00 1.27 0.00 3.17 2.02 0.77 0.33 112.91 120.47 2zw3 h THR 208 Ca -0.00 -1.35 -0.12 0.00 0.77 0.00 0.00 66.41 65.71 2zw3 h THR 208 Cb 1.24 1.13 -0.02 0.00 -1.74 0.00 0.00 68.15 68.76 2zw3 h THR 208 CO 0.06 0.46 -0.55 -0.33 0.37 0.00 0.00 175.52 175.53 2zw3 h GLU 209 N 0.80 0.00 0.00 6.66 3.07 -1.30 0.63 114.58 124.44 2zw3 h GLU 209 Ca 0.11 0.00 -0.04 0.00 -0.50 0.00 0.00 59.36 58.93 2zw3 h GLU 209 Cb 0.76 0.00 -0.01 0.00 -0.84 0.00 0.00 28.75 28.66 2zw3 h GLU 209 CO 0.06 0.55 -0.20 1.25 -1.40 0.00 0.00 179.01 179.27 2zw3 h LEU 210 N 0.00 0.00 -0.02 1.33 5.85 -1.17 -3.06 115.31 118.24 2zw3 h LEU 210 Ca -0.01 0.00 -0.10 0.00 0.84 0.00 0.00 57.88 58.62 2zw3 h LEU 210 Cb 1.06 0.00 0.01 0.00 0.37 0.00 0.00 40.66 42.09 2zw3 h LEU 210 CO 0.07 0.20 -0.36 0.00 -0.34 0.00 0.00 178.44 178.02 2zw3 h TYR 212 N -0.29 0.00 -0.02 0.00 -1.99 -0.95 0.11 116.97 113.84 2zw3 h TYR 212 Ca -0.04 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.69 2zw3 h TYR 212 Cb 1.07 0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.80 2zw3 h TYR 212 CO 0.15 0.09 -0.14 1.28 -0.00 0.00 0.00 178.16 179.55 2zw3 n LEU 213 N -3.50 1.68 -0.01 3.88 4.77 -1.16 -3.55 117.00 119.11 2zw3 n LEU 213 Ca -0.02 -0.54 0.10 0.00 -0.03 0.00 0.00 56.01 55.52 2zw3 n LEU 213 Cb 0.22 -0.04 -0.15 0.00 -2.33 0.00 0.00 43.42 41.13 2zw3 n LEU 213 CO 0.28 0.29 -0.66 0.18 -1.33 0.00 0.00 177.39 176.15 2zw3 n LEU 214 N 0.10 0.09 0.08 2.23 4.77 0.04 -3.86 117.00 120.45 2zw3 n LEU 214 Ca 0.15 -0.05 -0.07 0.00 -0.03 0.00 0.00 56.01 56.01 2zw3 n LEU 214 Cb 0.41 0.00 -0.04 0.00 -2.33 0.00 0.00 43.42 41.46 2zw3 n LEU 214 CO 0.20 0.02 0.20 0.40 -1.33 0.00 0.00 177.39 176.88 2zw3 h ILE 215 N 0.00 0.24 -0.24 -0.08 2.04 -0.95 -3.35 117.51 115.18 2zw3 h ILE 215 Ca 0.00 -0.90 0.00 0.00 1.00 0.00 0.00 64.86 64.96 2zw3 h ILE 215 Cb 0.84 0.43 0.00 0.00 -0.74 0.00 0.00 36.82 37.35 2zw3 h ILE 215 CO 0.00 0.07 0.00 -2.11 0.00 0.00 0.00 178.15 176.11 2zw3 n ARG 216 N -4.97 1.84 -0.54 2.37 1.85 -1.23 -5.12 116.66 110.87 2zw3 n ARG 216 Ca -0.05 -1.28 0.00 0.00 -1.00 0.00 0.00 57.85 55.52 2zw3 n ARG 216 Cb 0.17 -1.38 0.00 0.00 -1.05 0.00 0.00 32.46 30.20 2zw3 n ARG 216 CO 0.00 0.00 0.00 0.98 -0.01 0.00 0.00 177.63 178.60