#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 3.02 0.00 2.11 0.23 -1.26 -4.16 118.94 118.88 2zw3 s TRP 3 Ca 0.00 -0.02 0.00 0.00 -2.03 0.00 0.00 56.10 54.05 2zw3 s TRP 3 Cb 0.00 -3.52 0.00 0.00 0.03 0.00 0.00 33.47 29.98 2zw3 s TRP 3 CO 0.00 -0.96 0.00 0.41 0.96 0.00 0.00 176.95 177.36 2zw3 n GLY 4 N 5.04 3.14 0.17 0.98 0.00 -1.26 -4.88 105.19 108.37 2zw3 n GLY 4 Ca -0.00 -0.95 0.03 0.00 0.00 0.00 0.00 46.02 45.10 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 1.05 0.00 2.61 1.03 -2.02 -3.27 112.91 112.31 2zw3 h THR 5 Ca 0.00 -1.76 -0.25 0.00 -0.01 0.00 0.00 66.41 64.39 2zw3 h THR 5 Cb 0.00 2.03 -0.04 0.00 -1.07 0.00 0.00 68.15 69.07 2zw3 h THR 5 CO 0.00 0.45 -1.69 0.18 -0.01 0.00 0.00 175.52 174.45 2zw3 n LEU 6 N -3.58 0.74 0.25 0.00 4.77 -1.26 -3.49 117.00 114.42 2zw3 n LEU 6 Ca -0.00 0.34 0.10 0.00 -0.03 0.00 0.00 56.01 56.42 2zw3 n LEU 6 Cb 0.56 0.17 0.65 0.00 -2.33 0.00 0.00 43.42 42.47 2zw3 n LEU 6 CO 0.39 0.30 0.95 1.56 -1.33 0.00 0.00 177.39 179.26 2zw3 h GLN 7 N 0.00 0.00 0.03 3.23 7.50 -1.85 -2.65 115.11 121.37 2zw3 h GLN 7 Ca -0.27 0.00 -0.26 0.00 0.50 0.00 0.00 58.65 58.62 2zw3 h GLN 7 Cb 1.86 0.00 -0.03 0.00 0.05 0.00 0.00 27.48 29.36 2zw3 h GLN 7 CO 0.06 0.14 -1.39 1.15 -1.50 0.00 0.00 178.83 177.29 2zw3 h THR 8 N 0.00 1.26 -0.72 -0.54 2.02 -1.67 0.40 112.91 113.66 2zw3 h THR 8 Ca -0.00 -3.00 0.10 0.00 0.77 0.00 0.00 66.41 64.27 2zw3 h THR 8 Cb 0.32 2.67 -0.05 0.00 -1.74 0.00 0.00 68.15 69.35 2zw3 h THR 8 CO 0.02 0.76 0.47 0.40 0.37 0.00 0.00 175.52 177.55 2zw3 h ILE 9 N 0.02 0.92 0.00 3.11 2.04 -1.51 -0.36 117.51 121.74 2zw3 h ILE 9 Ca -0.17 -0.21 -0.28 0.00 1.00 0.00 0.00 64.86 65.21 2zw3 h ILE 9 Cb 1.92 0.27 -0.05 0.00 -0.74 0.00 0.00 36.82 38.22 2zw3 h ILE 9 CO 0.12 0.11 -2.05 0.18 0.00 0.00 0.00 178.15 176.51 2zw3 n LEU 10 N -4.49 0.78 0.10 1.44 4.77 -1.21 -4.73 117.00 113.65 2zw3 n LEU 10 Ca 0.12 -0.03 -0.13 0.00 -0.03 0.00 0.00 56.01 55.94 2zw3 n LEU 10 Cb 0.35 0.10 -0.08 0.00 -2.33 0.00 0.00 43.42 41.45 2zw3 n LEU 10 CO 0.33 0.49 0.63 1.23 -1.33 0.00 0.00 177.39 178.74 2zw3 h GLY 11 N 2.58 -0.25 -6.54 -0.72 0.00 -0.12 -3.30 103.07 94.72 2zw3 h GLY 11 Ca -0.41 0.09 -0.72 0.00 0.00 0.00 0.00 47.33 46.29 2zw3 h GLY 11 CO -0.00 -0.09 2.63 0.61 0.00 0.00 0.00 176.54 179.68 2zw3 n GLY 12 N -0.35 4.10 2.43 4.60 0.00 -0.15 -4.98 105.19 110.83 2zw3 n GLY 12 Ca -0.09 -1.70 -0.21 0.00 0.00 0.00 0.00 46.02 44.02 2zw3 n GLY 12 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 2zw3 n VAL 13 N 4.93 0.00 0.41 1.61 0.31 -1.25 -4.83 118.33 119.53 2zw3 n VAL 13 Ca 0.48 -0.28 -0.17 0.00 -0.01 0.00 0.00 64.34 64.36 2zw3 n VAL 13 Cb 0.40 -1.08 -0.09 0.00 -0.91 0.00 0.00 33.84 32.16 2zw3 n VAL 13 CO 0.00 0.00 0.00 0.78 -1.32 0.00 0.00 176.83 176.29 2zw3 h ASN 14 N -2.39 -0.89 -0.45 4.52 4.21 -1.94 -3.44 115.58 115.19 2zw3 h ASN 14 Ca -0.29 0.02 -0.18 0.00 1.21 0.00 0.00 56.30 57.06 2zw3 h ASN 14 Cb 0.90 0.23 -0.15 0.00 -1.12 0.00 0.00 38.32 38.18 2zw3 h ASN 14 CO 0.19 -0.56 -0.46 0.29 -1.29 0.00 0.00 177.43 175.59 2zw3 n LYS 15 N -5.50 0.63 -0.10 0.81 4.76 -1.26 -5.07 118.16 112.43 2zw3 n LYS 15 Ca -0.14 -1.80 -0.20 0.00 -2.87 0.00 0.00 58.31 53.30 2zw3 n LYS 15 Cb 0.43 -1.38 -0.11 0.00 -1.84 0.00 0.00 35.03 32.13 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 4.42 0.00 -3.32 2.13 2.07 -2.02 -3.50 115.15 114.93 2zw3 h HIS 16 Ca -0.05 0.00 0.01 0.00 -2.85 0.00 0.00 60.37 57.47 2zw3 h HIS 16 Cb 1.08 0.00 -0.07 0.00 2.57 0.00 0.00 27.41 30.98 2zw3 h HIS 16 CO 0.04 1.32 0.06 -1.54 -3.07 0.00 0.00 177.93 174.74 2zw3 s SER 17 N -6.71 -0.18 -0.61 3.10 1.04 -1.26 -5.13 113.70 103.95 2zw3 s SER 17 Ca -0.27 -0.76 0.04 0.00 0.48 0.00 0.00 55.95 55.45 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 0.55 -1.24 0.41 0.42 0.98 0.00 0.00 173.24 174.36 2zw3 s THR 18 N -3.97 2.32 0.00 2.02 -4.23 -1.26 -4.86 115.64 105.67 2zw3 s THR 18 Ca 0.16 -3.71 0.00 0.00 -1.18 0.00 0.00 61.69 56.96 2zw3 s THR 18 Cb -0.03 -2.55 0.00 0.00 1.34 0.00 0.00 72.50 71.25 2zw3 s THR 18 CO 0.08 -0.99 0.05 -1.54 -0.54 0.00 0.00 174.62 171.67 2zw3 n SER 19 N 2.44 0.10 0.00 3.99 3.41 -1.26 -5.01 113.62 117.29 2zw3 n SER 19 Ca 0.18 -0.68 0.00 0.00 -0.26 0.00 0.00 58.87 58.11 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 0.02 -1.33 5.41 -1.26 -4.71 119.36 117.44 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 -0.51 0.13 0.00 -0.71 0.00 0.00 39.64 38.69 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 -1.62 1.83 0.07 7.39 0.00 -1.26 -4.15 105.19 107.45 2zw3 n GLY 21 Ca 0.00 -0.38 -0.14 0.00 0.00 0.00 0.00 46.02 45.50 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 2.20 0.05 0.06 1.61 1.79 -1.94 -3.14 116.57 117.20 2zw3 h LYS 22 Ca 0.00 -0.06 -0.10 0.00 -2.18 0.00 0.00 60.65 58.30 2zw3 h LYS 22 Cb 0.67 0.02 0.00 0.00 -1.58 0.00 0.00 32.23 31.34 2zw3 h LYS 22 CO 0.00 0.90 -0.49 -0.84 -1.08 0.00 0.00 179.45 177.93 2zw3 h ILE 23 N -0.77 1.57 -1.00 1.86 3.07 -1.99 -3.33 117.51 116.93 2zw3 h ILE 23 Ca -0.01 -2.40 0.20 0.00 1.55 0.00 0.00 64.86 64.20 2zw3 h ILE 23 Cb 0.93 3.18 -0.19 0.00 -0.27 0.00 0.00 36.82 40.48 2zw3 h ILE 23 CO 0.02 0.63 -0.24 0.79 -1.05 0.00 0.00 178.15 178.30 2zw3 n TRP 24 N -4.38 0.37 -0.11 0.16 7.02 -1.26 0.34 117.44 119.59 2zw3 n TRP 24 Ca -0.14 1.22 -0.02 0.00 -1.02 0.00 0.00 57.50 57.54 2zw3 n TRP 24 Cb 0.65 -1.09 0.23 0.00 -2.42 0.00 0.00 31.31 28.68 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 0.72 0.00 -0.99 6.46 -1.70 -2.49 115.31 117.31 2zw3 h LEU 25 Ca 0.49 -0.11 -0.24 0.00 -0.12 0.00 0.00 57.88 57.90 2zw3 h LEU 25 Cb 0.75 -0.19 -0.04 0.00 -0.73 0.00 0.00 40.66 40.46 2zw3 h LEU 25 CO -1.02 0.68 -1.24 0.74 -0.62 0.00 0.00 178.44 176.98 2zw3 h THR 26 N 0.76 1.42 -0.75 1.05 2.02 -0.45 -1.91 112.91 115.06 2zw3 h THR 26 Ca 0.18 -3.17 -0.01 0.00 0.77 0.00 0.00 66.41 64.17 2zw3 h THR 26 Cb 0.22 2.70 -0.04 0.00 -1.74 0.00 0.00 68.15 69.30 2zw3 h THR 26 CO -0.01 0.81 0.41 0.58 0.37 0.00 0.00 175.52 177.67 2zw3 h VAL 27 N 0.00 1.22 0.15 3.16 2.07 -0.00 -1.19 116.25 121.66 2zw3 h VAL 27 Ca -0.10 -0.56 -0.01 0.00 0.82 0.00 0.00 66.70 66.85 2zw3 h VAL 27 Cb 1.85 0.21 0.00 0.00 -1.52 0.00 0.00 31.29 31.84 2zw3 h VAL 27 CO 0.11 0.25 -0.07 -0.07 0.02 0.00 0.00 177.57 177.81 2zw3 h LEU 28 N 1.04 -0.17 -0.98 2.57 3.38 -1.46 -0.29 115.31 119.41 2zw3 h LEU 28 Ca 0.26 -0.27 0.31 0.00 0.09 0.00 0.00 57.88 58.27 2zw3 h LEU 28 Cb 0.03 0.04 -0.17 0.00 0.09 0.00 0.00 40.66 40.65 2zw3 h LEU 28 CO -0.04 0.20 0.25 0.15 0.09 0.00 0.00 178.44 179.09 2zw3 h PHE 29 N -0.56 0.35 0.53 1.13 3.57 -1.01 1.22 116.94 122.18 2zw3 h PHE 29 Ca -0.02 0.06 -0.03 0.00 3.53 0.00 0.00 57.97 61.51 2zw3 h PHE 29 Cb 0.43 0.01 0.01 0.00 2.79 0.00 0.00 35.95 39.19 2zw3 h PHE 29 CO 0.04 -0.40 -0.26 0.82 -2.23 0.00 0.00 178.31 176.28 2zw3 h ILE 30 N 0.06 0.00 -0.96 1.41 2.04 -1.13 -2.69 117.51 116.23 2zw3 h ILE 30 Ca 0.68 -0.41 0.22 0.00 1.00 0.00 0.00 64.86 66.35 2zw3 h ILE 30 Cb 1.55 0.00 -0.18 0.00 -0.74 0.00 0.00 36.82 37.45 2zw3 h ILE 30 CO -0.81 0.00 -0.13 0.33 0.00 0.00 0.00 178.15 177.54 2zw3 n PHE 31 N -5.06 0.46 0.22 1.37 7.35 0.46 -0.07 117.46 122.18 2zw3 n PHE 31 Ca -0.09 1.17 0.08 0.00 -0.76 0.00 0.00 57.45 57.85 2zw3 n PHE 31 Cb 0.28 -1.13 0.52 0.00 0.35 0.00 0.00 39.48 39.50 2zw3 n PHE 31 CO 0.00 0.00 0.00 -0.09 -0.76 0.00 0.00 176.76 175.91 2zw3 h ARG 32 N 0.00 0.00 0.00 -4.13 2.43 0.13 0.30 114.38 113.11 2zw3 h ARG 32 Ca 0.51 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.68 2zw3 h ARG 32 Cb 0.91 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.46 2zw3 h ARG 32 CO -0.95 0.25 -0.48 1.51 -1.51 0.00 0.00 179.97 178.78 2zw3 n ILE 33 N -3.70 0.14 0.00 1.20 0.13 0.89 -3.09 119.36 114.93 2zw3 n ILE 33 Ca -0.01 -0.11 -0.19 0.00 -1.10 0.00 0.00 62.75 61.34 2zw3 n ILE 33 Cb 0.36 0.01 -0.14 0.00 -0.84 0.00 0.00 39.64 39.03 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 0.19 -0.81 9.51 2.86 0.66 -2.53 114.93 124.81 2zw3 h MET 34 Ca 0.00 -0.33 0.01 0.00 -2.06 0.00 0.00 59.70 57.32 2zw3 h MET 34 Cb 0.59 0.12 -0.04 0.00 0.06 0.00 0.00 31.60 32.34 2zw3 h MET 34 CO 0.00 1.16 0.53 0.97 1.06 0.00 0.00 176.91 180.62 2zw3 h ILE 35 N -0.56 1.21 -0.14 -1.22 2.10 -1.14 -2.56 117.51 115.21 2zw3 h ILE 35 Ca -0.15 -0.40 -0.15 0.00 1.08 0.00 0.00 64.86 65.24 2zw3 h ILE 35 Cb 1.48 0.03 -0.01 0.00 -1.09 0.00 0.00 36.82 37.24 2zw3 h ILE 35 CO 0.07 0.21 -0.56 0.25 -1.08 0.00 0.00 178.15 177.04 2zw3 h LEU 36 N 1.10 0.47 0.00 2.19 6.46 -1.67 -1.43 115.31 122.43 2zw3 h LEU 36 Ca 0.29 -0.25 0.00 0.00 -0.12 0.00 0.00 57.88 57.80 2zw3 h LEU 36 Cb -0.11 -0.14 0.00 0.00 -0.73 0.00 0.00 40.66 39.68 2zw3 h LEU 36 CO -0.06 0.93 0.00 0.55 -0.62 0.00 0.00 178.44 179.24 2zw3 n VAL 37 N -3.94 0.00 -0.07 1.05 3.14 -0.95 -1.88 118.33 115.68 2zw3 n VAL 37 Ca -0.03 0.00 -0.13 0.00 -2.96 0.00 0.00 64.34 61.22 2zw3 n VAL 37 Cb 0.60 -0.20 -0.04 0.00 -1.06 0.00 0.00 33.84 33.13 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 -0.64 1.20 -0.04 1.55 0.31 -0.93 -4.79 118.33 114.99 2zw3 n VAL 38 Ca 0.06 -0.03 -0.02 0.00 -0.01 0.00 0.00 64.34 64.35 2zw3 n VAL 38 Cb 0.03 -1.91 -0.01 0.00 -0.91 0.00 0.00 33.84 31.03 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 -0.66 -0.21 -1.43 3.52 0.00 -1.27 -3.25 119.26 115.96 2zw3 h ALA 39 Ca -0.25 0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.67 2zw3 h ALA 39 Cb 1.06 0.92 0.00 0.00 0.00 0.00 0.00 17.79 19.77 2zw3 h ALA 39 CO -0.15 -0.26 0.00 0.00 0.00 0.00 0.00 179.25 178.84 2zw3 n ALA 40 N -2.91 -0.02 0.24 0.00 0.00 -0.79 0.20 120.51 117.23 2zw3 n ALA 40 Ca -0.00 0.00 0.13 0.00 0.00 0.00 0.00 53.44 53.57 2zw3 n ALA 40 Cb 0.04 0.35 0.68 0.00 0.00 0.00 0.00 19.45 20.52 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 -2.94 116.57 113.59 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 -0.80 -1.91 -1.08 0.00 0.00 179.45 175.66 2zw3 n GLU 42 N -2.42 0.42 0.03 3.15 4.07 -0.32 -4.58 120.64 120.99 2zw3 n GLU 42 Ca -0.01 0.17 0.12 0.00 -0.06 0.00 0.00 57.16 57.38 2zw3 n GLU 42 Cb 0.08 -1.24 0.16 0.00 -0.06 0.00 0.00 31.44 30.39 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 -4.11 0.19 -0.04 6.31 0.24 0.13 -4.32 118.33 116.73 2zw3 n VAL 43 Ca -0.11 -0.17 0.04 0.00 -2.04 0.00 0.00 64.34 62.05 2zw3 n VAL 43 Cb 0.41 0.08 -0.16 0.00 -1.47 0.00 0.00 33.84 32.70 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 -1.87 0.02 -0.31 6.34 7.02 -1.11 -4.19 117.44 123.34 2zw3 n TRP 44 Ca 0.04 0.01 0.21 0.00 -1.02 0.00 0.00 57.50 56.73 2zw3 n TRP 44 Cb 0.40 -0.68 0.40 0.00 -2.42 0.00 0.00 31.31 29.01 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 1.43 -1.01 0.26 6.99 0.00 -1.26 0.63 105.19 112.23 2zw3 n GLY 45 Ca -0.14 0.84 0.14 0.00 0.00 0.00 0.00 46.02 46.86 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 -1.00 1.61 3.32 -1.84 -3.36 116.42 115.16 2zw3 h ASP 46 Ca 0.67 0.00 0.10 0.00 0.02 0.00 0.00 57.03 57.82 2zw3 h ASP 46 Cb 1.59 0.00 -0.13 0.00 0.22 0.00 0.00 39.33 41.01 2zw3 h ASP 46 CO -0.81 0.11 -0.56 -1.84 -1.72 0.00 0.00 179.24 174.43 2zw3 n GLU 47 N -3.51 -0.41 -0.06 3.56 0.28 0.21 -1.76 120.64 118.95 2zw3 n GLU 47 Ca -0.01 1.51 -0.17 0.00 -0.16 0.00 0.00 57.16 58.33 2zw3 n GLU 47 Cb 0.26 -2.23 -0.13 0.00 1.43 0.00 0.00 31.44 30.78 2zw3 n GLU 47 CO 0.00 0.00 0.00 0.37 -0.16 0.00 0.00 177.13 177.34 2zw3 h GLN 48 N 0.00 0.04 0.00 3.44 5.75 -1.76 -3.28 115.11 119.30 2zw3 h GLN 48 Ca 0.19 -0.07 0.00 0.00 -0.15 0.00 0.00 58.65 58.62 2zw3 h GLN 48 Cb 0.44 0.02 0.00 0.00 1.07 0.00 0.00 27.48 29.01 2zw3 h GLN 48 CO -0.95 1.03 0.00 0.00 -2.65 0.00 0.00 178.83 176.26 2zw3 n ALA 49 N -2.82 0.00 0.70 3.38 0.00 -0.99 -2.20 120.51 118.57 2zw3 n ALA 49 Ca -0.16 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.28 2zw3 n ALA 49 Cb 0.58 0.16 0.00 0.00 0.00 0.00 0.00 19.45 20.19 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 -0.80 0.89 -4.54 0.00 10.43 -0.72 -4.68 116.55 117.14 2zw3 n ASP 50 Ca 0.00 -1.40 -0.42 0.00 2.57 0.00 0.00 54.79 55.54 2zw3 n ASP 50 Cb 0.00 -0.35 -0.03 0.00 1.84 0.00 0.00 41.12 42.58 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 -0.82 2.59 -0.28 1.24 5.36 -0.94 -4.43 117.98 120.71 2zw3 s PHE 51 Ca 0.00 0.03 -0.10 0.00 -0.96 0.00 0.00 56.93 55.91 2zw3 s PHE 51 Cb 0.00 -4.38 -0.03 0.00 -0.34 0.00 0.00 43.02 38.27 2zw3 s PHE 51 CO 0.00 -1.65 0.14 0.14 -1.46 0.00 0.00 175.22 172.39 2zw3 s VAL 52 N 4.73 4.81 -0.23 3.12 -7.23 -0.51 -4.86 120.40 120.22 2zw3 s VAL 52 Ca 0.34 -0.10 -0.11 0.00 -1.81 0.00 0.00 61.98 60.30 2zw3 s VAL 52 Cb -0.10 -3.32 -0.05 0.00 0.56 0.00 0.00 36.38 33.47 2zw3 s VAL 52 CO 0.19 0.23 0.20 0.00 -0.31 0.00 0.00 175.10 175.41 2zw3 n ASN 54 N 4.29 3.84 -3.53 0.00 2.85 -0.87 -4.86 115.26 116.98 2zw3 n ASN 54 Ca -0.14 -2.80 -0.14 0.00 -0.11 0.00 0.00 54.58 51.39 2zw3 n ASN 54 Cb 0.52 -1.63 -0.04 0.00 1.24 0.00 0.00 39.78 39.86 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 6.16 0.02 -2.54 -0.44 -1.32 -1.26 -4.50 115.64 111.77 2zw3 s THR 55 Ca 0.57 -0.18 0.22 0.00 -1.21 0.00 0.00 61.69 61.09 2zw3 s THR 55 Cb 0.06 -1.00 0.29 0.00 -1.51 0.00 0.00 72.50 70.34 2zw3 s THR 55 CO 0.07 -0.10 1.29 0.18 -2.21 0.00 0.00 174.62 173.85 2zw3 n LEU 56 N 0.21 3.13 -4.58 9.08 4.32 -1.26 -4.93 117.00 122.97 2zw3 n LEU 56 Ca -0.18 -1.27 -0.42 0.00 -0.02 0.00 0.00 56.01 54.12 2zw3 n LEU 56 Cb 0.61 -0.13 -0.02 0.00 -1.62 0.00 0.00 43.42 42.26 2zw3 n LEU 56 CO 0.18 0.61 1.17 -1.58 -1.22 0.00 0.00 177.39 176.55 2zw3 s GLN 57 N -1.63 3.41 0.00 3.23 2.00 -1.26 -4.94 119.66 120.48 2zw3 s GLN 57 Ca 0.32 0.36 0.00 0.00 -2.00 0.00 0.00 55.36 54.04 2zw3 s GLN 57 Cb 0.20 -4.07 0.00 0.00 0.80 0.00 0.00 33.01 29.94 2zw3 s GLN 57 CO 0.29 -1.81 0.65 -2.30 -0.50 0.00 0.00 175.29 171.62 2zw3 n PRO 58 N 8.55 0.00 -0.28 1.67 -0.02 -1.26 -1.87 135.00 141.79 2zw3 n PRO 58 Ca 0.10 0.65 0.05 0.00 -2.02 0.00 0.00 63.50 62.29 2zw3 n PRO 58 Cb 0.49 -1.00 0.15 0.00 -0.02 0.00 0.00 33.50 33.12 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 0.79 -0.24 -1.23 0.00 -1.92 -3.33 103.07 97.13 2zw3 h GLY 59 Ca 0.00 0.19 0.02 0.00 0.00 0.00 0.00 47.33 47.54 2zw3 h GLY 59 CO 0.00 -0.33 -0.14 0.00 0.00 0.00 0.00 176.54 176.06 2zw3 h LYS 61 N 0.00 0.26 -0.42 0.00 3.64 -1.78 0.42 116.57 118.69 2zw3 h LYS 61 Ca 0.04 -0.02 0.02 0.00 -1.27 0.00 0.00 60.65 59.42 2zw3 h LYS 61 Cb 0.10 -0.06 -0.03 0.00 -0.41 0.00 0.00 32.23 31.83 2zw3 h LYS 61 CO -0.23 0.17 0.24 -0.91 -2.27 0.00 0.00 179.45 176.45 2zw3 h ASN 62 N 0.27 0.38 0.02 4.20 4.21 -1.82 0.05 115.58 122.89 2zw3 h ASN 62 Ca 0.26 0.01 -0.08 0.00 1.21 0.00 0.00 56.30 57.69 2zw3 h ASN 62 Cb 0.34 -0.07 -0.01 0.00 -1.12 0.00 0.00 38.32 37.45 2zw3 h ASN 62 CO -0.32 0.27 -0.23 0.58 -1.29 0.00 0.00 177.43 176.45 2zw3 h VAL 63 N 0.48 1.25 0.00 2.81 2.07 -1.30 -2.18 116.25 119.38 2zw3 h VAL 63 Ca 0.17 -1.15 -0.13 0.00 0.82 0.00 0.00 66.70 66.41 2zw3 h VAL 63 Cb 0.02 1.35 -0.02 0.00 -1.52 0.00 0.00 31.29 31.12 2zw3 h VAL 63 CO -0.08 0.36 -0.63 0.00 0.02 0.00 0.00 177.57 177.23 2zw3 h TYR 65 N 0.00 -0.36 0.32 0.00 3.20 -0.80 -3.26 116.97 116.08 2zw3 h TYR 65 Ca -0.01 -0.01 -0.01 0.00 3.14 0.00 0.00 58.73 61.84 2zw3 h TYR 65 Cb 1.23 0.12 -0.00 0.00 1.54 0.00 0.00 36.73 39.61 2zw3 h TYR 65 CO 0.00 0.00 -0.22 0.22 -1.64 0.00 0.00 178.16 176.53 2zw3 h ASP 66 N -0.84 -0.55 0.00 -2.11 -0.00 -1.35 1.52 116.42 113.09 2zw3 h ASP 66 Ca -0.04 0.03 0.00 0.00 -0.00 0.00 0.00 57.03 57.02 2zw3 h ASP 66 Cb 0.52 0.17 0.00 0.00 -0.00 0.00 0.00 39.33 40.01 2zw3 h ASP 66 CO 0.06 -0.32 0.57 1.57 -0.00 0.00 0.00 179.24 181.13 2zw3 n HIS 67 N -3.62 0.17 0.01 0.28 -0.00 -0.46 -1.10 115.22 110.49 2zw3 n HIS 67 Ca -0.06 0.09 0.01 0.00 0.46 0.00 0.00 57.72 58.22 2zw3 n HIS 67 Cb 0.21 -0.25 -0.02 0.00 -0.12 0.00 0.00 29.99 29.81 2zw3 n HIS 67 CO 0.00 0.00 0.00 0.66 0.46 0.00 0.00 176.34 177.46 2zw3 n TYR 68 N -1.84 0.00 -3.28 1.57 4.01 0.24 -4.83 117.16 113.03 2zw3 n TYR 68 Ca -0.00 0.00 -0.25 0.00 -0.16 0.00 0.00 57.90 57.49 2zw3 n TYR 68 Cb 0.58 -0.06 -0.08 0.00 -0.31 0.00 0.00 39.34 39.48 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 0.28 0.32 -0.72 3.01 0.50 -5.01 117.46 114.28 2zw3 n PHE 69 Ca -0.00 -3.64 -0.13 0.00 1.01 0.00 0.00 57.45 54.69 2zw3 n PHE 69 Cb 0.07 -0.30 -0.06 0.00 -0.01 0.00 0.00 39.48 39.18 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 4.31 -0.82 -4.54 -1.08 0.11 -1.78 -3.37 132.00 124.84 2zw3 h PRO 70 Ca 0.12 0.06 -0.69 0.00 0.11 0.00 0.00 66.00 65.60 2zw3 h PRO 70 Cb 0.85 0.19 -0.36 0.00 0.11 0.00 0.00 31.00 31.78 2zw3 h PRO 70 CO 0.51 -0.54 -0.59 0.42 -0.21 0.00 0.00 178.00 177.59 2zw3 s ILE 71 N -4.30 3.03 0.66 4.15 1.01 -1.26 -5.07 121.20 119.42 2zw3 s ILE 71 Ca -0.12 -2.12 -0.17 0.00 0.00 0.00 0.00 60.65 58.24 2zw3 s ILE 71 Cb 0.01 -3.11 -0.04 0.00 0.01 0.00 0.00 42.46 39.33 2zw3 s ILE 71 CO 0.37 -0.66 0.72 -1.54 0.00 0.00 0.00 174.94 173.83 2zw3 n SER 72 N 4.51 -0.37 -0.23 3.58 3.41 -1.26 -4.59 113.62 118.67 2zw3 n SER 72 Ca -0.01 0.69 0.02 0.00 -0.26 0.00 0.00 58.87 59.31 2zw3 n SER 72 Cb 0.42 -1.28 0.11 0.00 -0.26 0.00 0.00 64.21 63.19 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 -0.01 -0.14 0.00 7.33 -0.00 -1.98 -1.47 115.15 118.87 2zw3 h HIS 73 Ca -0.47 0.05 0.00 0.00 -0.00 0.00 0.00 60.37 59.96 2zw3 h HIS 73 Cb 1.36 0.17 0.00 0.00 -0.00 0.00 0.00 27.41 28.94 2zw3 h HIS 73 CO 0.35 -0.23 0.00 1.51 -0.00 0.00 0.00 177.93 179.57 2zw3 n ILE 74 N -5.35 0.85 0.29 2.45 0.13 -1.26 -0.35 119.36 116.12 2zw3 n ILE 74 Ca 0.10 0.22 0.11 0.00 -1.10 0.00 0.00 62.75 62.09 2zw3 n ILE 74 Cb 0.39 -1.12 -0.01 0.00 -0.84 0.00 0.00 39.64 38.06 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 -2.10 0.48 0.04 9.51 1.74 -0.61 -2.66 116.66 123.06 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 0.22 -1.68 -0.01 0.00 -1.02 0.00 0.00 32.46 29.97 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 -0.15 -0.80 0.55 3.38 -0.51 -1.83 115.31 115.96 2zw3 h LEU 76 Ca 0.00 0.01 0.31 0.00 0.09 0.00 0.00 57.88 58.28 2zw3 h LEU 76 Cb 0.88 0.04 -0.14 0.00 0.09 0.00 0.00 40.66 41.53 2zw3 h LEU 76 CO 0.00 0.15 0.33 0.79 0.09 0.00 0.00 178.44 179.80 2zw3 n TRP 77 N -3.90 0.83 0.18 1.13 5.03 0.53 -0.02 117.44 121.22 2zw3 n TRP 77 Ca -0.02 0.94 -0.14 0.00 3.03 0.00 0.00 57.50 61.32 2zw3 n TRP 77 Cb 0.07 -1.30 -0.08 0.00 -1.03 0.00 0.00 31.31 28.97 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 1.59 -0.47 -0.96 6.99 0.00 -1.55 -2.36 119.26 122.50 2zw3 h ALA 78 Ca 0.63 -0.18 0.12 0.00 0.00 0.00 0.00 54.91 55.48 2zw3 h ALA 78 Cb 1.60 0.18 -0.08 0.00 0.00 0.00 0.00 17.79 19.49 2zw3 h ALA 78 CO -0.65 -0.62 0.59 -0.07 0.00 0.00 0.00 179.25 178.50 2zw3 h LEU 79 N -0.76 0.85 0.19 0.00 3.38 0.46 0.39 115.31 119.82 2zw3 h LEU 79 Ca -0.05 0.05 -0.00 0.00 0.09 0.00 0.00 57.88 57.97 2zw3 h LEU 79 Cb 0.51 -0.12 -0.02 0.00 0.09 0.00 0.00 40.66 41.12 2zw3 h LEU 79 CO 0.08 0.45 -0.31 -0.61 0.09 0.00 0.00 178.44 178.14 2zw3 h GLN 80 N 0.93 -0.51 -0.17 1.13 4.15 -0.65 0.15 115.11 120.14 2zw3 h GLN 80 Ca 0.48 0.03 0.05 0.00 0.77 0.00 0.00 58.65 59.98 2zw3 h GLN 80 Cb 0.48 0.12 -0.01 0.00 0.21 0.00 0.00 27.48 28.28 2zw3 h GLN 80 CO -0.27 -0.34 0.23 -0.07 -1.93 0.00 0.00 178.83 176.45 2zw3 h LEU 81 N -0.53 0.00 0.15 -2.39 -0.00 -0.85 -0.85 115.31 110.84 2zw3 h LEU 81 Ca -0.02 0.00 -0.01 0.00 -0.00 0.00 0.00 57.88 57.85 2zw3 h LEU 81 Cb 0.49 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 41.15 2zw3 h LEU 81 CO -0.10 0.00 -0.07 0.40 -0.00 0.00 0.00 178.44 178.66 2zw3 h ILE 82 N 0.00 0.69 0.31 1.22 2.04 0.11 -2.47 117.51 119.40 2zw3 h ILE 82 Ca 0.08 -1.17 -0.02 0.00 1.00 0.00 0.00 64.86 64.76 2zw3 h ILE 82 Cb 0.54 1.20 0.00 0.00 -0.74 0.00 0.00 36.82 37.82 2zw3 h ILE 82 CO -0.00 0.19 -0.15 -0.26 0.00 0.00 0.00 178.15 177.94 2zw3 h PHE 83 N -0.94 -0.38 0.00 1.37 -1.00 -0.07 -0.64 116.94 115.27 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 0.48 0.13 0.00 0.00 3.61 0.00 0.00 35.95 40.16 2zw3 h PHE 83 CO 0.08 -0.20 0.00 0.28 -1.61 0.00 0.00 178.31 176.86 2zw3 h VAL 84 N -0.47 0.00 0.02 -0.55 2.07 -1.37 0.52 116.25 116.47 2zw3 h VAL 84 Ca -0.04 -0.07 -0.21 0.00 0.82 0.00 0.00 66.70 67.19 2zw3 h VAL 84 Cb 0.36 0.78 -0.02 0.00 -1.52 0.00 0.00 31.29 30.89 2zw3 h VAL 84 CO 0.07 0.00 -0.98 -1.28 0.02 0.00 0.00 177.57 175.40 2zw3 h SER 85 N 0.00 0.13 0.18 0.57 0.87 -0.82 -3.39 113.55 111.09 2zw3 h SER 85 Ca 0.00 -0.12 -0.00 0.00 -1.23 0.00 0.00 61.79 60.44 2zw3 h SER 85 Cb 0.09 -0.04 -0.01 0.00 -0.44 0.00 0.00 62.40 62.01 2zw3 h SER 85 CO 0.00 1.03 -0.12 0.74 -0.53 0.00 0.00 176.83 177.94 2zw3 h THR 86 N 0.03 0.74 -0.80 2.23 2.02 0.61 -2.48 112.91 115.26 2zw3 h THR 86 Ca -0.04 0.00 0.07 0.00 0.77 0.00 0.00 66.41 67.22 2zw3 h THR 86 Cb 1.69 0.74 -0.06 0.00 -1.74 0.00 0.00 68.15 68.77 2zw3 h THR 86 CO 0.14 0.00 0.47 -0.65 0.37 0.00 0.00 175.52 175.85 2zw3 h PRO 87 N -0.30 0.80 -0.79 6.66 0.11 -1.76 0.43 132.00 137.15 2zw3 h PRO 87 Ca -0.01 -0.05 0.09 0.00 0.11 0.00 0.00 66.00 66.14 2zw3 h PRO 87 Cb 0.26 -0.18 -0.07 0.00 0.11 0.00 0.00 31.00 31.12 2zw3 h PRO 87 CO 0.01 0.53 0.44 0.00 -0.21 0.00 0.00 178.00 178.77 2zw3 h ALA 88 N 1.41 1.12 0.00 -0.75 0.00 -1.70 -1.59 119.26 117.76 2zw3 h ALA 88 Ca 0.36 0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.31 2zw3 h ALA 88 Cb 0.25 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 17.93 2zw3 h ALA 88 CO -0.20 0.06 -1.11 1.28 0.00 0.00 0.00 179.25 179.27 2zw3 n LEU 89 N -4.78 0.59 0.00 0.00 4.77 -0.90 -2.84 117.00 113.85 2zw3 n LEU 89 Ca 0.13 0.00 -0.18 0.00 -0.03 0.00 0.00 56.01 55.93 2zw3 n LEU 89 Cb 0.28 -0.08 -0.09 0.00 -2.33 0.00 0.00 43.42 41.19 2zw3 n LEU 89 CO 0.26 0.02 0.22 0.25 -1.33 0.00 0.00 177.39 176.81 2zw3 h LEU 90 N 0.00 0.82 0.69 2.23 7.12 0.05 -2.17 115.31 124.05 2zw3 h LEU 90 Ca 0.00 -0.69 -0.03 0.00 0.13 0.00 0.00 57.88 57.29 2zw3 h LEU 90 Cb 0.77 -0.25 0.01 0.00 -0.53 0.00 0.00 40.66 40.66 2zw3 h LEU 90 CO 0.00 1.39 -0.33 0.58 -0.13 0.00 0.00 178.44 179.95 2zw3 h VAL 91 N 0.32 0.00 -1.19 1.05 2.07 -1.43 0.17 116.25 117.24 2zw3 h VAL 91 Ca -0.08 -0.25 0.35 0.00 0.82 0.00 0.00 66.70 67.54 2zw3 h VAL 91 Cb 1.45 0.00 -0.05 0.00 -1.52 0.00 0.00 31.29 31.17 2zw3 h VAL 91 CO 0.16 0.00 0.92 0.00 0.02 0.00 0.00 177.57 178.67 2zw3 h ALA 92 N -1.33 3.10 0.19 1.67 0.00 -1.65 0.72 119.26 121.96 2zw3 h ALA 92 Ca -0.09 -0.04 -0.31 0.00 0.00 0.00 0.00 54.91 54.46 2zw3 h ALA 92 Cb 0.71 0.09 0.03 0.00 0.00 0.00 0.00 17.79 18.61 2zw3 h ALA 92 CO 0.16 -1.53 -1.36 1.98 0.00 0.00 0.00 179.25 178.49 2zw3 h MET 93 N 0.00 0.48 0.00 0.00 -1.53 -1.21 -2.78 114.93 109.90 2zw3 h MET 93 Ca 0.57 -0.77 -0.04 0.00 -3.44 0.00 0.00 59.70 56.01 2zw3 h MET 93 Cb 2.40 0.28 -0.01 0.00 -0.55 0.00 0.00 31.60 33.72 2zw3 h MET 93 CO -0.01 1.36 -0.21 1.25 0.14 0.00 0.00 176.91 179.44 2zw3 h HIS 94 N 0.15 0.00 0.01 1.39 6.17 0.34 -2.90 115.15 120.31 2zw3 h HIS 94 Ca -0.21 0.00 -0.00 0.00 0.71 0.00 0.00 60.37 60.87 2zw3 h HIS 94 Cb 2.05 0.00 0.00 0.00 2.52 0.00 0.00 27.41 31.98 2zw3 h HIS 94 CO 0.11 0.21 -0.00 -0.24 0.71 0.00 0.00 177.93 178.72 2zw3 h VAL 95 N 0.00 0.00 0.00 5.26 3.04 -0.75 -2.67 116.25 121.13 2zw3 h VAL 95 Ca -0.00 -0.70 0.00 0.00 -1.01 0.00 0.00 66.70 64.99 2zw3 h VAL 95 Cb 0.39 0.00 0.00 0.00 -2.01 0.00 0.00 31.29 29.67 2zw3 h VAL 95 CO 0.03 0.00 0.11 0.00 -1.01 0.00 0.00 177.57 176.70 2zw3 h ALA 96 N -1.30 1.08 0.00 3.17 0.00 -1.57 0.20 119.26 120.83 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 0.01 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.80 2zw3 h ALA 96 CO 0.00 -0.08 -0.26 -0.92 0.00 0.00 0.00 179.25 177.98 2zw3 h TYR 97 N 0.00 0.00 -0.50 0.00 3.20 -1.65 -3.28 116.97 114.75 2zw3 h TYR 97 Ca 0.00 0.00 0.03 0.00 3.14 0.00 0.00 58.73 61.90 2zw3 h TYR 97 Cb 0.23 0.00 -0.03 0.00 1.54 0.00 0.00 36.73 38.47 2zw3 h TYR 97 CO 0.00 0.00 0.33 0.00 -1.64 0.00 0.00 178.16 176.85 2zw3 h ARG 98 N -0.64 0.56 -0.09 1.82 3.08 -1.08 0.15 114.38 118.19 2zw3 h ARG 98 Ca 0.00 -0.03 -0.14 0.00 0.07 0.00 0.00 59.98 59.87 2zw3 h ARG 98 Cb 0.26 -0.13 0.01 0.00 0.08 0.00 0.00 29.97 30.19 2zw3 h ARG 98 CO 0.00 0.37 -0.50 -0.09 -1.07 0.00 0.00 179.97 178.69 2zw3 h ARG 99 N 0.58 0.50 -0.25 0.04 2.43 -0.85 -1.83 114.38 115.00 2zw3 h ARG 99 Ca 0.20 -0.42 -0.06 0.00 -0.81 0.00 0.00 59.98 58.89 2zw3 h ARG 99 Cb 0.08 0.09 -0.01 0.00 -0.42 0.00 0.00 29.97 29.70 2zw3 h ARG 99 CO -0.05 1.05 -0.12 1.25 -1.51 0.00 0.00 179.97 180.59 2zw3 h HIS 100 N 0.09 0.44 0.12 2.20 2.76 -1.54 -2.88 115.15 116.34 2zw3 h HIS 100 Ca -0.04 -0.06 -0.01 0.00 -2.20 0.00 0.00 60.37 58.07 2zw3 h HIS 100 Cb 1.15 -0.12 0.00 0.00 1.55 0.00 0.00 27.41 29.99 2zw3 h HIS 100 CO 0.12 0.53 -0.06 1.49 -1.30 0.00 0.00 177.93 178.71 2zw3 h GLU 101 N 0.39 -0.15 -0.98 5.26 4.57 -0.66 -2.99 114.58 120.02 2zw3 h GLU 101 Ca 0.08 0.01 0.23 0.00 -1.18 0.00 0.00 59.36 58.49 2zw3 h GLU 101 Cb 0.45 0.04 -0.09 0.00 -0.16 0.00 0.00 28.75 28.99 2zw3 h GLU 101 CO 0.03 -0.10 0.63 0.87 -1.18 0.00 0.00 179.01 179.26 2zw3 h LYS 102 N -0.27 0.46 0.63 1.92 1.57 -1.45 -2.59 116.57 116.85 2zw3 h LYS 102 Ca -0.02 -0.03 -0.03 0.00 -1.87 0.00 0.00 60.65 58.70 2zw3 h LYS 102 Cb 0.12 -0.10 0.01 0.00 0.08 0.00 0.00 32.23 32.34 2zw3 h LYS 102 CO 0.03 0.30 -0.30 -0.22 -0.57 0.00 0.00 179.45 178.69 2zw3 h LYS 103 N 0.47 -0.82 0.00 3.15 3.64 -1.62 -3.00 116.57 118.39 2zw3 h LYS 103 Ca 0.54 0.06 0.00 0.00 -1.27 0.00 0.00 60.65 59.98 2zw3 h LYS 103 Cb 1.26 0.19 0.00 0.00 -0.41 0.00 0.00 32.23 33.27 2zw3 h LYS 103 CO -0.27 -0.55 0.00 -2.13 -2.27 0.00 0.00 179.45 174.24 2zw3 n ARG 104 N -5.02 0.84 -0.05 1.90 0.63 -1.11 -2.59 116.66 111.25 2zw3 n ARG 104 Ca -0.11 0.00 -0.03 0.00 -0.92 0.00 0.00 57.85 56.80 2zw3 n ARG 104 Cb 0.34 -1.27 -0.12 0.00 0.45 0.00 0.00 32.46 31.86 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 -0.77 1.28 -0.25 -0.14 5.02 -0.99 -4.55 118.16 117.76 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 -1.38 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 -0.02 2.13 3.72 -1.13 -3.34 117.46 116.98 2zw3 n PHE 106 Ca -0.18 -0.64 -0.14 0.00 -0.05 0.00 0.00 57.45 56.44 2zw3 n PHE 106 Cb 0.81 -0.13 -0.14 0.00 -0.94 0.00 0.00 39.48 39.08 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 0.01 1.66 -0.09 4.37 3.06 -1.07 -4.58 119.36 122.73 2zw3 n ILE 107 Ca 0.14 -0.74 -0.14 0.00 -2.50 0.00 0.00 62.75 59.51 2zw3 n ILE 107 Cb 0.57 -1.28 -0.08 0.00 0.54 0.00 0.00 39.64 39.39 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 -3.20 0.43 0.00 9.51 5.02 -1.26 -5.13 118.16 123.52 2zw3 n LYS 108 Ca -0.25 0.12 0.00 0.00 -2.02 0.00 0.00 58.31 56.16 2zw3 n LYS 108 Cb 1.05 -1.31 0.00 0.00 -0.02 0.00 0.00 35.03 34.75 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 2.50 1.27 0.00 0.72 0.00 -1.21 -5.16 105.19 103.31 2zw3 n GLY 109 Ca -0.32 -0.34 0.00 0.00 0.00 0.00 0.00 46.02 45.36 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 0.62 0.19 1.61 5.02 -1.26 -4.65 118.16 119.70 2zw3 n LYS 125 Ca 0.00 -0.73 0.10 0.00 -2.02 0.00 0.00 58.31 55.66 2zw3 n LYS 125 Cb 0.00 -0.82 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 0.71 0.18 0.00 -0.18 2.07 -2.03 -3.10 116.25 113.90 2zw3 h VAL 126 Ca 0.00 -1.27 0.00 0.00 0.82 0.00 0.00 66.70 66.25 2zw3 h VAL 126 Cb 0.42 2.03 0.00 0.00 -1.52 0.00 0.00 31.29 32.23 2zw3 h VAL 126 CO 0.00 0.10 -0.96 -1.14 0.02 0.00 0.00 177.57 175.59 2zw3 n ARG 127 N -3.08 0.71 0.09 1.57 3.00 -1.26 -2.04 116.66 115.65 2zw3 n ARG 127 Ca 0.03 -0.01 -0.15 0.00 -0.00 0.00 0.00 57.85 57.72 2zw3 n ARG 127 Cb 0.58 -1.40 -0.09 0.00 0.00 0.00 0.00 32.46 31.55 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 1.45 0.00 5.15 2.10 -1.99 -0.83 117.51 123.40 2zw3 h ILE 128 Ca 0.00 -2.77 -0.03 0.00 1.08 0.00 0.00 64.86 63.14 2zw3 h ILE 128 Cb 0.48 2.70 -0.00 0.00 -1.09 0.00 0.00 36.82 38.91 2zw3 h ILE 128 CO 0.00 0.82 -1.06 -0.08 -1.08 0.00 0.00 178.15 176.74 2zw3 h GLU 129 N 0.14 0.00 0.00 2.19 4.81 -1.70 -3.23 114.58 116.78 2zw3 h GLU 129 Ca -0.11 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.12 2zw3 h GLU 129 Cb 1.79 0.00 0.00 0.00 0.63 0.00 0.00 28.75 31.17 2zw3 h GLU 129 CO 0.18 0.05 0.00 0.41 -0.73 0.00 0.00 179.01 178.92 2zw3 n GLY 130 N 1.22 0.07 0.11 1.92 0.00 -0.87 -3.44 105.19 104.20 2zw3 n GLY 130 Ca -0.02 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 45.92 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 -0.15 0.14 1.61 0.02 -1.37 -2.28 113.55 111.52 2zw3 h SER 131 Ca 0.00 0.06 -0.28 0.00 -0.84 0.00 0.00 61.79 60.73 2zw3 h SER 131 Cb 0.00 0.12 0.01 0.00 0.14 0.00 0.00 62.40 62.66 2zw3 h SER 131 CO 0.00 -0.05 -1.38 0.25 -1.14 0.00 0.00 176.83 174.51 2zw3 h LEU 132 N 0.03 0.47 -0.62 5.07 7.12 -1.67 -2.29 115.31 123.43 2zw3 h LEU 132 Ca 0.11 -0.89 0.00 0.00 0.13 0.00 0.00 57.88 57.23 2zw3 h LEU 132 Cb 0.15 -0.15 0.00 0.00 -0.53 0.00 0.00 40.66 40.13 2zw3 h LEU 132 CO -0.21 1.62 0.00 0.79 -0.13 0.00 0.00 178.44 180.51 2zw3 n TRP 133 N -3.88 0.65 -0.01 1.25 5.03 -1.22 -1.70 117.44 117.55 2zw3 n TRP 133 Ca -0.23 0.26 -0.21 0.00 3.03 0.00 0.00 57.50 60.35 2zw3 n TRP 133 Cb 0.93 -0.92 -0.13 0.00 -1.03 0.00 0.00 31.31 30.16 2zw3 n TRP 133 CO 0.00 0.00 0.00 2.35 -0.03 0.00 0.00 177.69 180.01 2zw3 h TRP 134 N 0.00 0.35 -0.28 -5.99 -0.00 -1.43 -3.15 115.95 105.46 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 0.31 -0.01 -0.01 0.00 -0.00 0.00 0.00 29.16 29.44 2zw3 h TRP 134 CO 0.00 1.53 -0.22 1.79 -0.00 0.00 0.00 178.44 181.55 2zw3 h THR 135 N -0.42 1.26 -0.65 2.65 1.35 -1.29 -2.38 112.91 113.42 2zw3 h THR 135 Ca -0.31 -1.21 0.00 0.00 -0.55 0.00 0.00 66.41 64.35 2zw3 h THR 135 Cb 1.67 1.28 -0.03 0.00 -1.73 0.00 0.00 68.15 69.34 2zw3 h THR 135 CO 0.01 0.39 0.42 0.22 -0.25 0.00 0.00 175.52 176.32 2zw3 h TYR 136 N 0.46 0.83 -0.51 4.73 3.20 -1.50 0.45 116.97 124.63 2zw3 h TYR 136 Ca 0.07 0.02 -0.09 0.00 3.14 0.00 0.00 58.73 61.87 2zw3 h TYR 136 Cb 0.63 -0.28 -0.02 0.00 1.54 0.00 0.00 36.73 38.60 2zw3 h TYR 136 CO 0.02 0.53 -0.04 0.00 -1.64 0.00 0.00 178.16 177.03 2zw3 h THR 137 N 0.89 1.27 0.00 1.81 1.03 -1.39 -1.21 112.91 115.30 2zw3 h THR 137 Ca 0.24 -1.15 -0.09 0.00 -0.01 0.00 0.00 66.41 65.40 2zw3 h THR 137 Cb -0.09 0.98 -0.01 0.00 -1.07 0.00 0.00 68.15 67.96 2zw3 h THR 137 CO -0.05 0.41 -0.41 0.28 -0.01 0.00 0.00 175.52 175.74 2zw3 h SER 138 N 0.80 0.00 0.78 0.00 0.02 -1.08 -2.42 113.55 111.65 2zw3 h SER 138 Ca 0.14 0.00 -0.04 0.00 -0.84 0.00 0.00 61.79 61.05 2zw3 h SER 138 Cb 0.58 0.00 0.01 0.00 0.14 0.00 0.00 62.40 63.13 2zw3 h SER 138 CO 0.03 0.41 -0.38 -1.28 -1.14 0.00 0.00 176.83 174.48 2zw3 h SER 139 N 0.00 -0.89 -1.03 3.07 0.87 0.10 0.13 113.55 115.81 2zw3 h SER 139 Ca -0.00 0.02 0.26 0.00 -1.23 0.00 0.00 61.79 60.84 2zw3 h SER 139 Cb 1.00 0.23 -0.08 0.00 -0.44 0.00 0.00 62.40 63.10 2zw3 h SER 139 CO 0.05 -0.58 0.68 0.40 -0.53 0.00 0.00 176.83 176.85 2zw3 h ILE 140 N -1.15 0.54 -0.18 2.23 2.04 -1.15 0.76 117.51 120.60 2zw3 h ILE 140 Ca -0.11 -0.12 -0.02 0.00 1.00 0.00 0.00 64.86 65.61 2zw3 h ILE 140 Cb 0.82 0.15 -0.01 0.00 -0.74 0.00 0.00 36.82 37.05 2zw3 h ILE 140 CO 0.18 0.06 0.04 0.15 0.00 0.00 0.00 178.15 178.58 2zw3 h PHE 141 N 0.35 0.31 -0.36 1.37 3.57 -1.19 -2.82 116.94 118.17 2zw3 h PHE 141 Ca 0.57 -0.04 0.02 0.00 3.53 0.00 0.00 57.97 62.05 2zw3 h PHE 141 Cb 1.53 -0.09 -0.03 0.00 2.79 0.00 0.00 35.95 40.16 2zw3 h PHE 141 CO -0.00 0.43 0.19 0.74 -2.23 0.00 0.00 178.31 177.44 2zw3 h PHE 142 N 0.09 0.36 -0.20 0.41 0.04 0.31 -0.49 116.94 117.45 2zw3 h PHE 142 Ca 0.06 0.01 0.06 0.00 2.80 0.00 0.00 57.97 60.89 2zw3 h PHE 142 Cb 0.28 -0.11 -0.07 0.00 2.20 0.00 0.00 35.95 38.25 2zw3 h PHE 142 CO 0.01 0.20 -0.32 0.00 -0.60 0.00 0.00 178.31 177.60 2zw3 h ARG 143 N 0.39 -0.35 0.00 1.51 3.08 0.04 -0.05 114.38 119.01 2zw3 h ARG 143 Ca 0.15 0.02 0.00 0.00 0.07 0.00 0.00 59.98 60.22 2zw3 h ARG 143 Cb 0.04 0.08 0.00 0.00 0.08 0.00 0.00 29.97 30.17 2zw3 h ARG 143 CO -0.09 -0.23 0.00 0.28 -1.07 0.00 0.00 179.97 178.86 2zw3 h VAL 144 N -0.36 0.00 -0.09 2.04 2.07 -1.36 0.13 116.25 118.68 2zw3 h VAL 144 Ca 0.11 -0.49 -0.17 0.00 0.82 0.00 0.00 66.70 66.97 2zw3 h VAL 144 Cb 0.54 1.40 -0.01 0.00 -1.52 0.00 0.00 31.29 31.71 2zw3 h VAL 144 CO -0.40 0.00 -0.69 -0.29 0.02 0.00 0.00 177.57 176.21 2zw3 h ILE 145 N 0.00 1.37 0.00 4.57 2.10 0.34 -3.00 117.51 122.89 2zw3 h ILE 145 Ca 0.00 -2.07 -0.01 0.00 1.08 0.00 0.00 64.86 63.85 2zw3 h ILE 145 Cb 0.59 2.05 -0.00 0.00 -1.09 0.00 0.00 36.82 38.37 2zw3 h ILE 145 CO 0.00 0.62 -0.14 -0.26 -1.08 0.00 0.00 178.15 177.29 2zw3 h PHE 146 N 0.28 0.00 -0.99 2.19 0.05 -0.47 -0.96 116.94 117.03 2zw3 h PHE 146 Ca -0.02 0.00 0.29 0.00 3.82 0.00 0.00 57.97 62.06 2zw3 h PHE 146 Cb 1.25 0.00 -0.04 0.00 2.00 0.00 0.00 35.95 39.16 2zw3 h PHE 146 CO 0.04 0.25 1.04 0.93 -0.18 0.00 0.00 178.31 180.39 2zw3 h GLU 147 N -1.00 0.00 0.00 1.51 4.39 -0.92 0.38 114.58 118.94 2zw3 h GLU 147 Ca -0.02 0.00 -0.03 0.00 0.34 0.00 0.00 59.36 59.66 2zw3 h GLU 147 Cb 0.32 0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 28.97 2zw3 h GLU 147 CO -0.01 0.00 -1.80 0.00 -1.16 0.00 0.00 179.01 176.04 2zw3 n ALA 148 N -2.36 2.54 -0.07 3.43 0.00 -1.13 -3.25 120.51 119.67 2zw3 n ALA 148 Ca 0.22 -0.46 -0.06 0.00 0.00 0.00 0.00 53.44 53.14 2zw3 n ALA 148 Cb 1.35 -0.54 0.13 0.00 0.00 0.00 0.00 19.45 20.40 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 1.49 0.98 0.00 0.00 0.00 0.12 -2.37 119.26 119.48 2zw3 h ALA 149 Ca -0.04 -0.34 -0.09 0.00 0.00 0.00 0.00 54.91 54.44 2zw3 h ALA 149 Cb 0.88 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.51 2zw3 h ALA 149 CO 0.00 0.60 -0.64 0.74 0.00 0.00 0.00 179.25 179.95 2zw3 h PHE 150 N 0.63 0.00 -1.38 0.00 -1.00 -1.56 -3.07 116.94 110.57 2zw3 h PHE 150 Ca 0.10 0.00 0.45 0.00 2.81 0.00 0.00 57.97 61.33 2zw3 h PHE 150 Cb 0.65 0.00 -0.11 0.00 3.61 0.00 0.00 35.95 40.10 2zw3 h PHE 150 CO 0.03 0.81 0.92 -0.12 -1.61 0.00 0.00 178.31 178.34 2zw3 n MET 151 N -4.56 -0.02 0.24 1.51 0.00 -1.20 0.15 117.12 113.23 2zw3 n MET 151 Ca -0.17 1.07 -0.10 0.00 -0.00 0.00 0.00 57.70 58.50 2zw3 n MET 151 Cb 0.44 -2.20 -0.05 0.00 0.00 0.00 0.00 33.22 31.41 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 -0.59 -0.02 1.12 3.20 -1.49 -3.19 116.97 116.00 2zw3 h TYR 152 Ca 0.80 -0.01 0.03 0.00 3.14 0.00 0.00 58.73 62.69 2zw3 h TYR 152 Cb 2.76 0.20 -0.06 0.00 1.54 0.00 0.00 36.73 41.17 2zw3 h TYR 152 CO -0.00 -0.37 -0.43 0.28 -1.64 0.00 0.00 178.16 176.00 2zw3 h VAL 153 N -0.90 0.14 0.00 1.81 2.07 -0.19 0.12 116.25 119.29 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 0.49 0.14 0.00 0.00 -1.52 0.00 0.00 31.29 30.40 2zw3 h VAL 153 CO 0.11 0.00 0.47 0.49 0.02 0.00 0.00 177.57 178.66 2zw3 n PHE 154 N -5.45 0.14 -0.03 1.57 3.01 0.45 0.12 117.46 117.27 2zw3 n PHE 154 Ca -0.06 0.07 -0.03 0.00 1.01 0.00 0.00 57.45 58.45 2zw3 n PHE 154 Cb 0.37 -0.26 -0.04 0.00 -0.01 0.00 0.00 39.48 39.54 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 -0.07 1.38 9.36 -0.40 -4.51 117.16 121.29 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 0.48 -0.25 -0.12 0.00 -0.63 0.00 0.00 39.34 38.81 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 -2.20 1.63 -0.23 2.97 0.31 0.28 -4.33 118.33 116.76 2zw3 n VAL 156 Ca -0.08 -0.46 -0.02 0.00 -0.01 0.00 0.00 64.34 63.76 2zw3 n VAL 156 Cb 0.67 -1.75 0.17 0.00 -0.91 0.00 0.00 33.84 32.01 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 -0.32 1.03 -2.42 5.55 1.85 0.67 -3.38 114.93 117.91 2zw3 h MET 157 Ca -0.48 -0.14 -0.72 0.00 -0.61 0.00 0.00 59.70 57.76 2zw3 h MET 157 Cb 1.79 -0.19 -0.34 0.00 0.43 0.00 0.00 31.60 33.29 2zw3 h MET 157 CO -0.08 0.79 0.27 0.66 -0.40 0.00 0.00 176.91 178.15 2zw3 n TYR 158 N -4.33 3.09 -4.09 1.39 4.02 -1.25 -4.95 117.16 111.04 2zw3 n TYR 158 Ca 0.07 -3.20 -0.42 0.00 -0.01 0.00 0.00 57.90 54.34 2zw3 n TYR 158 Cb 0.13 -0.93 0.00 0.00 -0.02 0.00 0.00 39.34 38.52 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 0.43 -3.06 0.00 7.72 8.00 -1.26 -4.36 116.55 124.03 2zw3 n ASP 159 Ca 0.34 -1.21 0.00 0.00 0.71 0.00 0.00 54.79 54.63 2zw3 n ASP 159 Cb 0.34 -1.46 0.00 0.00 -0.02 0.00 0.00 41.12 39.98 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 -2.09 -1.12 0.72 0.44 0.00 -1.26 -4.59 105.19 97.29 2zw3 n GLY 160 Ca -0.13 -1.70 0.11 0.00 0.00 0.00 0.00 46.02 44.30 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 -2.76 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 0.77 0.00 -4.04 5.98 3.41 -1.26 -4.88 113.62 113.60 2zw3 n SER 162 Ca 0.11 0.00 -0.19 0.00 -0.26 0.00 0.00 58.87 58.53 2zw3 n SER 162 Cb 0.50 0.00 -0.15 0.00 -0.26 0.00 0.00 64.21 64.31 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 0.79 0.80 4.33 0.23 -1.26 -4.80 119.30 120.39 2zw3 s MET 163 Ca 0.00 -0.38 -0.12 0.00 -1.03 0.00 0.00 55.69 54.16 2zw3 s MET 163 Cb 0.00 -0.76 0.07 0.00 -1.53 0.00 0.00 34.83 32.61 2zw3 s MET 163 CO 0.00 0.21 1.14 -0.65 -2.03 0.00 0.00 175.02 173.68 2zw3 s GLN 164 N -0.32 2.07 0.11 3.16 -0.21 -1.26 -4.72 119.66 118.49 2zw3 s GLN 164 Ca 0.03 0.31 -0.14 0.00 0.02 0.00 0.00 55.36 55.59 2zw3 s GLN 164 Cb -0.04 -1.94 -0.08 0.00 1.00 0.00 0.00 33.01 31.95 2zw3 s GLN 164 CO -0.00 -1.56 1.43 0.00 -2.12 0.00 0.00 175.29 173.04 2zw3 h ARG 165 N -1.04 0.78 -5.94 2.91 3.08 -1.96 -3.44 114.38 108.78 2zw3 h ARG 165 Ca -0.47 -0.42 -0.52 0.00 0.07 0.00 0.00 59.98 58.65 2zw3 h ARG 165 Cb 1.30 0.02 -0.20 0.00 0.08 0.00 0.00 29.97 31.17 2zw3 h ARG 165 CO 0.64 1.05 -0.80 -0.48 -1.07 0.00 0.00 179.97 179.30 2zw3 s LEU 166 N -8.93 2.35 0.12 3.04 2.34 -1.26 -1.72 118.68 114.62 2zw3 s LEU 166 Ca -0.12 -0.74 0.11 0.00 0.06 0.00 0.00 54.13 53.44 2zw3 s LEU 166 Cb 0.09 -0.79 -0.04 0.00 -0.56 0.00 0.00 46.19 44.89 2zw3 s LEU 166 CO 0.85 -0.00 -0.26 0.54 -1.06 0.00 0.00 176.35 176.41 2zw3 s VAL 167 N -1.52 2.20 -0.55 1.48 0.11 -0.45 -4.97 120.40 116.70 2zw3 s VAL 167 Ca 0.08 -1.72 -0.18 0.00 -2.93 0.00 0.00 61.98 57.23 2zw3 s VAL 167 Cb -0.08 -1.95 0.10 0.00 -1.53 0.00 0.00 36.38 32.92 2zw3 s VAL 167 CO 0.05 0.09 0.59 -0.54 -3.33 0.00 0.00 175.10 171.96 2zw3 s LYS 168 N -2.01 3.03 -0.20 1.54 3.01 -1.26 -1.42 119.74 122.43 2zw3 s LYS 168 Ca 0.13 -1.40 -0.08 0.00 -1.01 0.00 0.00 55.97 53.61 2zw3 s LYS 168 Cb -0.10 -4.24 -0.04 0.00 -1.01 0.00 0.00 37.83 32.44 2zw3 s LYS 168 CO 0.06 -1.38 0.07 0.00 0.51 0.00 0.00 175.35 174.61 2zw3 n ASN 170 N 3.95 5.49 -4.48 0.00 4.05 -1.26 -3.20 115.26 119.80 2zw3 n ASN 170 Ca -0.16 -3.02 -0.43 0.00 0.45 0.00 0.00 54.58 51.42 2zw3 n ASN 170 Cb 0.52 -0.70 0.00 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 0.39 -1.29 -0.27 5.20 0.00 -1.26 -4.82 120.51 118.46 2zw3 n ALA 171 Ca 0.32 0.23 0.00 0.00 0.00 0.00 0.00 53.44 53.99 2zw3 n ALA 171 Cb 1.26 -1.82 0.00 0.00 0.00 0.00 0.00 19.45 18.88 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 -0.57 0.00 0.91 0.00 -0.00 -1.26 -2.41 117.44 114.11 2zw3 n TRP 172 Ca 0.12 0.00 0.01 0.00 -0.00 0.00 0.00 57.50 57.63 2zw3 n TRP 172 Cb 0.37 -0.27 0.05 0.00 -0.00 0.00 0.00 31.31 31.46 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 -2.18 1.48 -2.95 5.87 -0.04 -1.26 -4.71 135.00 131.21 2zw3 n PRO 173 Ca 0.00 -0.42 -0.33 0.00 -0.04 0.00 0.00 63.50 62.71 2zw3 n PRO 173 Cb 0.00 -1.51 -0.06 0.00 -0.04 0.00 0.00 33.50 31.88 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 -3.15 3.65 3.78 0.00 0.02 -1.26 -4.87 135.00 133.16 2zw3 s PRO 175 Ca 0.58 1.10 0.00 0.00 0.02 0.00 0.00 61.00 62.70 2zw3 s PRO 175 Cb -0.10 -4.01 0.00 0.00 0.02 0.00 0.00 34.50 30.42 2zw3 s PRO 175 CO 0.17 -1.47 0.00 0.09 -0.33 0.00 0.00 177.00 175.45 2zw3 n ASN 176 N 8.65 0.00 -4.55 2.53 3.02 -1.26 -4.31 115.26 119.34 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 -0.10 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 5.21 0.25 3.41 2.01 -1.26 -4.77 115.64 120.49 2zw3 s THR 177 Ca 0.00 0.03 0.08 0.00 0.31 0.00 0.00 61.69 62.11 2zw3 s THR 177 Cb 0.00 -3.76 -0.04 0.00 0.01 0.00 0.00 72.50 68.71 2zw3 s THR 177 CO 0.00 -0.02 0.06 0.68 -0.69 0.00 0.00 174.62 174.65 2zw3 s VAL 178 N 1.92 3.81 0.33 3.82 -7.23 -1.19 -4.97 120.40 116.89 2zw3 s VAL 178 Ca 0.10 -1.70 -0.04 0.00 -1.81 0.00 0.00 61.98 58.54 2zw3 s VAL 178 Cb -0.17 -3.03 -0.04 0.00 0.56 0.00 0.00 36.38 33.70 2zw3 s VAL 178 CO 0.11 -0.34 0.59 -1.81 -0.31 0.00 0.00 175.10 173.34 2zw3 s ASP 179 N -3.66 6.38 0.15 4.85 1.11 -1.26 -1.42 116.67 122.82 2zw3 s ASP 179 Ca 0.31 0.68 -0.11 0.00 0.18 0.00 0.00 52.55 53.61 2zw3 s ASP 179 Cb -0.07 -2.13 0.01 0.00 1.07 0.00 0.00 42.92 41.79 2zw3 s ASP 179 CO 0.21 -0.28 0.32 0.00 1.18 0.00 0.00 175.17 176.61 2zw3 s PHE 181 N -3.90 0.29 0.72 0.00 0.40 0.21 -1.34 117.98 114.36 2zw3 s PHE 181 Ca 0.11 -0.05 -0.01 0.00 -0.60 0.00 0.00 56.93 56.37 2zw3 s PHE 181 Cb 0.03 -0.20 0.13 0.00 0.51 0.00 0.00 43.02 43.49 2zw3 s PHE 181 CO -0.05 -0.01 0.99 0.08 0.70 0.00 0.00 175.22 176.93 2zw3 s VAL 182 N -0.04 2.15 -0.15 -0.44 1.01 -0.70 -1.43 120.40 120.80 2zw3 s VAL 182 Ca 0.01 -0.59 -0.04 0.00 0.00 0.00 0.00 61.98 61.36 2zw3 s VAL 182 Cb -0.02 -2.56 -0.03 0.00 0.00 0.00 0.00 36.38 33.77 2zw3 s VAL 182 CO -0.00 0.00 -0.01 -0.94 0.00 0.00 0.00 175.10 174.14 2zw3 s SER 183 N -4.73 5.01 -1.65 3.32 1.04 -1.26 -4.67 113.70 110.77 2zw3 s SER 183 Ca 0.66 -0.05 -0.07 0.00 0.48 0.00 0.00 55.95 56.97 2zw3 s SER 183 Cb -0.05 -1.75 0.07 0.00 0.10 0.00 0.00 66.02 64.38 2zw3 s SER 183 CO 0.44 0.21 0.19 -2.11 0.98 0.00 0.00 173.24 172.95 2zw3 n ARG 184 N 3.29 -0.91 0.26 4.02 1.85 -1.26 -4.77 116.66 119.13 2zw3 n ARG 184 Ca -0.17 0.11 0.15 0.00 -1.00 0.00 0.00 57.85 56.94 2zw3 n ARG 184 Cb 0.53 -3.94 0.82 0.00 -1.05 0.00 0.00 32.46 28.82 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 -1.52 0.00 0.16 2.89 0.11 -1.86 0.12 132.00 131.89 2zw3 h PRO 185 Ca -0.64 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 65.46 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 0.77 0.00 -0.08 1.79 -0.21 0.00 0.00 178.00 180.27 2zw3 h THR 186 N 0.00 0.54 -0.92 -1.15 1.35 -1.86 -2.10 112.91 108.77 2zw3 h THR 186 Ca 0.00 -1.12 0.21 0.00 -0.55 0.00 0.00 66.41 64.96 2zw3 h THR 186 Cb 0.23 0.95 -0.07 0.00 -1.73 0.00 0.00 68.15 67.54 2zw3 h THR 186 CO 0.00 0.16 0.61 -0.08 -0.25 0.00 0.00 175.52 175.95 2zw3 h GLU 187 N -0.98 0.38 -0.38 4.72 4.81 -1.62 0.82 114.58 122.33 2zw3 h GLU 187 Ca -0.02 -0.02 -0.12 0.00 -0.13 0.00 0.00 59.36 59.07 2zw3 h GLU 187 Cb 0.42 -0.09 -0.01 0.00 0.63 0.00 0.00 28.75 29.70 2zw3 h GLU 187 CO 0.04 0.25 -0.25 0.87 -0.73 0.00 0.00 179.01 179.19 2zw3 h LYS 188 N 0.40 0.78 0.12 1.92 1.57 -0.90 -2.85 116.57 117.61 2zw3 h LYS 188 Ca 0.48 -0.33 -0.01 0.00 -1.87 0.00 0.00 60.65 58.93 2zw3 h LYS 188 Cb 1.22 -0.03 0.00 0.00 0.08 0.00 0.00 32.23 33.50 2zw3 h LYS 188 CO -0.18 0.95 -0.06 1.15 -0.57 0.00 0.00 179.45 180.74 2zw3 h THR 189 N 0.68 0.79 -0.39 -0.16 2.02 0.81 -2.55 112.91 114.11 2zw3 h THR 189 Ca 0.09 -1.29 0.05 0.00 0.77 0.00 0.00 66.41 66.03 2zw3 h THR 189 Cb 0.76 1.40 -0.06 0.00 -1.74 0.00 0.00 68.15 68.51 2zw3 h THR 189 CO 0.06 0.23 -0.19 0.52 0.37 0.00 0.00 175.52 176.52 2zw3 n VAL 190 N -4.85 -0.23 0.60 3.16 0.31 0.23 0.30 118.33 117.85 2zw3 n VAL 190 Ca -0.06 0.93 0.12 0.00 -0.01 0.00 0.00 64.34 65.31 2zw3 n VAL 190 Cb 0.25 -1.20 0.46 0.00 -0.91 0.00 0.00 33.84 32.43 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 -4.54 0.52 0.07 3.52 0.99 -1.07 -2.13 117.46 114.82 2zw3 n PHE 191 Ca 0.03 0.18 -0.12 0.00 -0.00 0.00 0.00 57.45 57.54 2zw3 n PHE 191 Cb 0.13 -0.79 -0.13 0.00 -1.00 0.00 0.00 39.48 37.69 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 1.47 0.22 4.37 2.02 0.50 -3.01 112.91 118.49 2zw3 h THR 192 Ca 0.00 -3.14 -0.01 0.00 0.77 0.00 0.00 66.41 64.03 2zw3 h THR 192 Cb 0.48 2.82 0.00 0.00 -1.74 0.00 0.00 68.15 69.71 2zw3 h THR 192 CO 0.00 0.88 -0.12 0.58 0.37 0.00 0.00 175.52 177.23 2zw3 h VAL 193 N 0.03 0.00 -0.49 3.16 2.07 0.11 -0.12 116.25 121.01 2zw3 h VAL 193 Ca -0.12 0.00 0.08 0.00 0.82 0.00 0.00 66.70 67.48 2zw3 h VAL 193 Cb 1.90 0.00 -0.10 0.00 -1.52 0.00 0.00 31.29 31.57 2zw3 h VAL 193 CO 0.15 0.00 -0.42 -0.26 0.02 0.00 0.00 177.57 177.06 2zw3 h PHE 194 N -0.31 -1.22 0.00 1.57 -1.00 -1.60 1.48 116.94 115.86 2zw3 h PHE 194 Ca -0.03 0.07 -0.01 0.00 2.81 0.00 0.00 57.97 60.82 2zw3 h PHE 194 Cb 0.24 0.60 -0.00 0.00 3.61 0.00 0.00 35.95 40.41 2zw3 h PHE 194 CO 0.13 -0.43 -0.04 0.52 -1.61 0.00 0.00 178.31 176.89 2zw3 h MET 195 N -0.27 0.00 0.00 1.51 2.86 -1.62 0.14 114.93 117.56 2zw3 h MET 195 Ca 0.16 0.00 -0.27 0.00 -2.06 0.00 0.00 59.70 57.54 2zw3 h MET 195 Cb 0.57 0.00 -0.05 0.00 0.06 0.00 0.00 31.60 32.18 2zw3 h MET 195 CO -0.63 0.04 -1.66 1.51 1.06 0.00 0.00 176.91 177.23 2zw3 n ILE 196 N -3.29 1.51 0.26 -1.22 0.13 0.12 -2.58 119.36 114.29 2zw3 n ILE 196 Ca -0.02 -0.77 -0.13 0.00 -1.10 0.00 0.00 62.75 60.73 2zw3 n ILE 196 Cb 0.18 -0.96 -0.07 0.00 -0.84 0.00 0.00 39.64 37.96 2zw3 n ILE 196 CO 0.00 0.00 0.00 0.00 2.80 0.00 0.00 176.55 179.35 2zw3 h ALA 197 N 1.09 -0.70 -0.03 1.51 0.00 0.28 -2.20 119.26 119.22 2zw3 h ALA 197 Ca -0.26 -0.18 0.01 0.00 0.00 0.00 0.00 54.91 54.47 2zw3 h ALA 197 Cb 1.93 0.27 -0.00 0.00 0.00 0.00 0.00 17.79 19.98 2zw3 h ALA 197 CO 0.07 -0.69 0.09 0.28 0.00 0.00 0.00 179.25 179.00 2zw3 h VAL 198 N -1.09 0.16 0.00 0.00 2.07 -0.94 0.24 116.25 116.69 2zw3 h VAL 198 Ca -0.07 0.00 -0.08 0.00 0.82 0.00 0.00 66.70 67.37 2zw3 h VAL 198 Cb 0.60 0.92 -0.01 0.00 -1.52 0.00 0.00 31.29 31.27 2zw3 h VAL 198 CO 0.12 0.00 -0.36 -1.28 0.02 0.00 0.00 177.57 176.06 2zw3 h SER 199 N 0.00 0.00 0.00 0.57 0.87 -1.28 -1.75 113.55 111.97 2zw3 h SER 199 Ca 0.01 0.00 -0.10 0.00 -1.23 0.00 0.00 61.79 60.47 2zw3 h SER 199 Cb 0.19 0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 62.14 2zw3 h SER 199 CO -0.00 0.36 -0.56 1.23 -0.53 0.00 0.00 176.83 177.34 2zw3 h GLY 200 N 2.66 0.00 -0.02 5.77 0.00 0.02 -3.15 103.07 108.34 2zw3 h GLY 200 Ca -0.00 0.00 0.06 0.00 0.00 0.00 0.00 47.33 47.38 2zw3 h GLY 200 CO 0.05 0.00 -0.35 -2.22 0.00 0.00 0.00 176.54 174.01 2zw3 h ILE 201 N -1.00 0.22 0.00 2.60 2.04 -1.09 0.39 117.51 120.67 2zw3 h ILE 201 Ca -0.15 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.71 2zw3 h ILE 201 Cb 1.09 0.22 0.00 0.00 -0.74 0.00 0.00 36.82 37.39 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 1.62 -0.15 0.00 2.04 -0.22 -3.26 117.51 117.54 2zw3 h ILE 203 Ca 0.00 -2.41 -0.00 0.00 1.00 0.00 0.00 64.86 63.45 2zw3 h ILE 203 Cb 0.07 3.24 -0.01 0.00 -0.74 0.00 0.00 36.82 39.38 2zw3 h ILE 203 CO 0.00 0.63 0.07 -0.07 0.00 0.00 0.00 178.15 178.79 2zw3 h LEU 204 N -0.76 0.19 -0.81 1.44 3.38 -0.16 0.17 115.31 118.76 2zw3 h LEU 204 Ca -0.08 -0.11 0.08 0.00 0.09 0.00 0.00 57.88 57.86 2zw3 h LEU 204 Cb 1.27 -0.05 -0.07 0.00 0.09 0.00 0.00 40.66 41.90 2zw3 h LEU 204 CO 0.04 0.25 0.48 -0.07 0.09 0.00 0.00 178.44 179.23 2zw3 h LEU 205 N 0.12 0.70 -0.82 1.67 3.38 -1.65 0.80 115.31 119.51 2zw3 h LEU 205 Ca 0.05 0.04 -0.02 0.00 0.09 0.00 0.00 57.88 58.04 2zw3 h LEU 205 Cb 0.11 -0.10 -0.04 0.00 0.09 0.00 0.00 40.66 40.72 2zw3 h LEU 205 CO -0.01 0.42 0.44 0.78 0.09 0.00 0.00 178.44 180.17 2zw3 h ASN 206 N 0.83 1.04 1.22 -0.43 2.35 -1.48 -2.03 115.58 117.08 2zw3 h ASN 206 Ca 0.38 -0.11 -0.12 0.00 -0.55 0.00 0.00 56.30 55.91 2zw3 h ASN 206 Cb 0.29 -0.26 -0.02 0.00 0.05 0.00 0.00 38.32 38.38 2zw3 h ASN 206 CO -0.22 0.85 -0.56 1.62 -1.65 0.00 0.00 177.43 177.46 2zw3 h VAL 207 N 1.15 1.03 -0.46 2.81 3.04 0.53 -2.14 116.25 122.21 2zw3 h VAL 207 Ca 0.29 -2.26 -0.12 0.00 -1.01 0.00 0.00 66.70 63.60 2zw3 h VAL 207 Cb 0.05 2.37 -0.02 0.00 -2.01 0.00 0.00 31.29 31.68 2zw3 h VAL 207 CO -0.04 0.55 -0.17 0.74 -1.01 0.00 0.00 177.57 177.63 2zw3 h THR 208 N 0.00 1.27 0.00 3.17 2.02 0.73 0.29 112.91 120.39 2zw3 h THR 208 Ca -0.01 -1.31 -0.10 0.00 0.77 0.00 0.00 66.41 65.77 2zw3 h THR 208 Cb 1.33 1.10 -0.01 0.00 -1.74 0.00 0.00 68.15 68.82 2zw3 h THR 208 CO 0.07 0.45 -0.48 -0.33 0.37 0.00 0.00 175.52 175.60 2zw3 h GLU 209 N 0.79 0.00 0.00 6.66 3.07 -1.30 0.50 114.58 124.30 2zw3 h GLU 209 Ca 0.11 0.00 -0.05 0.00 -0.50 0.00 0.00 59.36 58.93 2zw3 h GLU 209 Cb 0.71 0.00 -0.01 0.00 -0.84 0.00 0.00 28.75 28.62 2zw3 h GLU 209 CO 0.05 0.48 -0.22 1.25 -1.40 0.00 0.00 179.01 179.17 2zw3 h LEU 210 N 0.00 0.00 -0.02 1.33 5.85 -1.17 -3.08 115.31 118.22 2zw3 h LEU 210 Ca -0.00 0.00 -0.11 0.00 0.84 0.00 0.00 57.88 58.61 2zw3 h LEU 210 Cb 1.00 0.00 0.01 0.00 0.37 0.00 0.00 40.66 42.04 2zw3 h LEU 210 CO 0.06 0.22 -0.42 0.00 -0.34 0.00 0.00 178.44 177.97 2zw3 h TYR 212 N -0.24 0.00 -0.01 0.00 -1.99 -0.98 0.81 116.97 114.56 2zw3 h TYR 212 Ca -0.05 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.68 2zw3 h TYR 212 Cb 1.13 0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.86 2zw3 h TYR 212 CO 0.15 0.09 -0.16 1.28 -0.00 0.00 0.00 178.16 179.53 2zw3 n LEU 213 N -3.47 1.55 -0.01 3.88 4.77 -1.16 -3.56 117.00 119.00 2zw3 n LEU 213 Ca -0.01 -0.50 0.10 0.00 -0.03 0.00 0.00 56.01 55.57 2zw3 n LEU 213 Cb 0.24 -0.05 -0.15 0.00 -2.33 0.00 0.00 43.42 41.13 2zw3 n LEU 213 CO 0.29 0.27 -0.69 0.18 -1.33 0.00 0.00 177.39 176.10 2zw3 n LEU 214 N -0.04 0.06 0.07 2.23 4.77 -0.07 -3.83 117.00 120.19 2zw3 n LEU 214 Ca 0.14 -0.03 -0.06 0.00 -0.03 0.00 0.00 56.01 56.03 2zw3 n LEU 214 Cb 0.39 0.00 -0.04 0.00 -2.33 0.00 0.00 43.42 41.45 2zw3 n LEU 214 CO 0.22 0.01 0.19 0.40 -1.33 0.00 0.00 177.39 176.88 2zw3 h ILE 215 N 0.00 0.26 -0.25 -0.08 2.04 -1.00 -3.34 117.51 115.13 2zw3 h ILE 215 Ca 0.00 -0.92 0.00 0.00 1.00 0.00 0.00 64.86 64.94 2zw3 h ILE 215 Cb 0.88 0.46 0.00 0.00 -0.74 0.00 0.00 36.82 37.42 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 -4.96 1.86 -0.54 2.37 1.85 -1.23 -5.12 116.66 110.89 2zw3 n ARG 216 Ca -0.05 -1.31 0.00 0.00 -1.00 0.00 0.00 57.85 55.49 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