#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3mz4 s VAL 15 N 0.00 3.76 0.37 1.96 -7.23 -1.26 -4.47 120.40 113.54 3mz4 s VAL 15 Ca 0.00 0.98 -0.27 0.00 -1.81 0.00 0.00 61.98 60.88 3mz4 s VAL 15 Cb 0.00 -3.41 -0.11 0.00 0.56 0.00 0.00 36.38 33.41 3mz4 s VAL 15 CO 0.00 -0.35 1.32 -2.65 -0.31 0.00 0.00 175.10 173.10 3mz4 n PRO 16 N -1.46 2.16 -3.02 4.82 -0.02 -1.26 -4.61 135.00 131.61 3mz4 n PRO 16 Ca 0.09 0.76 -0.40 0.00 -2.02 0.00 0.00 63.50 61.93 3mz4 n PRO 16 Cb 0.53 -2.40 -0.05 0.00 -0.02 0.00 0.00 33.50 31.56 3mz4 n PRO 16 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 3mz4 s VAL 17 N -1.13 4.83 -0.24 -1.45 1.01 0.10 -1.13 120.40 122.39 3mz4 s VAL 17 Ca 0.57 1.54 0.02 0.00 0.00 0.00 0.00 61.98 64.11 3mz4 s VAL 17 Cb -0.54 -4.08 0.05 0.00 0.00 0.00 0.00 36.38 31.82 3mz4 s VAL 17 CO 0.61 0.34 -0.12 -0.47 0.00 0.00 0.00 175.10 175.47 3mz4 s TYR 18 N 0.14 3.10 -0.19 5.22 6.14 -0.16 -0.30 117.35 131.30 3mz4 s TYR 18 Ca 0.37 -2.17 -0.26 0.00 0.64 0.00 0.00 57.07 55.66 3mz4 s TYR 18 Cb -0.20 -1.89 -0.01 0.00 0.42 0.00 0.00 41.96 40.29 3mz4 s TYR 18 CO 0.21 -0.86 0.89 0.42 0.64 0.00 0.00 175.55 176.85 3mz4 s ILE 19 N 1.16 4.82 -0.28 3.14 -1.09 -0.38 -0.89 121.20 127.69 3mz4 s ILE 19 Ca -0.07 1.73 -0.24 0.00 -2.23 0.00 0.00 60.65 59.85 3mz4 s ILE 19 Cb -0.19 -4.18 0.11 0.00 -1.58 0.00 0.00 42.46 36.62 3mz4 s ILE 19 CO -0.06 -0.04 0.91 -0.47 -1.23 0.00 0.00 174.94 174.05 3mz4 s TYR 20 N 2.50 -0.61 0.07 3.97 5.04 -0.58 -4.85 117.35 122.89 3mz4 s TYR 20 Ca 0.39 1.45 -0.13 0.00 -2.44 0.00 0.00 57.07 56.34 3mz4 s TYR 20 Cb -0.16 0.35 0.02 0.00 0.35 0.00 0.00 41.96 42.51 3mz4 s TYR 20 CO 0.10 -0.29 0.29 -1.54 -1.34 0.00 0.00 175.55 172.77 3mz4 s SER 21 N 0.43 -0.09 0.37 4.32 1.04 -1.26 -3.65 113.70 114.87 3mz4 s SER 21 Ca 0.01 -0.33 0.07 0.00 0.48 0.00 0.00 55.95 56.17 3mz4 s SER 21 Cb -0.05 0.38 0.74 0.00 0.10 0.00 0.00 66.02 67.18 3mz4 s SER 21 CO -0.05 -0.69 1.94 -0.65 0.98 0.00 0.00 173.24 174.77 3mz4 h PRO 22 N 2.94 0.44 -0.36 4.02 0.11 -2.01 -1.77 132.00 135.37 3mz4 h PRO 22 Ca -0.33 -0.07 -0.14 0.00 0.11 0.00 0.00 66.00 65.57 3mz4 h PRO 22 Cb 1.21 -0.08 -0.01 0.00 0.11 0.00 0.00 31.00 32.24 3mz4 h PRO 22 CO 0.49 0.44 -0.34 0.93 -0.21 0.00 0.00 178.00 179.30 3mz4 h GLU 23 N 0.44 0.82 0.11 1.05 3.07 -1.98 -1.64 114.58 116.44 3mz4 h GLU 23 Ca 0.10 -0.40 -0.01 0.00 -0.50 0.00 0.00 59.36 58.55 3mz4 h GLU 23 Cb 0.22 -0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.13 3mz4 h GLU 23 CO 0.00 1.04 -0.05 -0.92 -1.40 0.00 0.00 179.01 177.67 3mz4 h TYR 24 N 0.68 -0.14 -0.99 4.33 -0.00 -1.80 -0.90 116.97 118.15 3mz4 h TYR 24 Ca 0.07 -0.00 0.04 0.00 -0.00 0.00 0.00 58.73 58.83 3mz4 h TYR 24 Cb 0.90 0.05 -0.06 0.00 -0.00 0.00 0.00 36.73 37.62 3mz4 h TYR 24 CO 0.05 -0.01 0.64 0.28 -0.00 0.00 0.00 178.16 179.12 3mz4 h VAL 25 N -0.23 1.16 -0.21 1.81 2.07 -1.27 0.06 116.25 119.64 3mz4 h VAL 25 Ca -0.02 -0.43 -0.11 0.00 0.82 0.00 0.00 66.70 66.97 3mz4 h VAL 25 Cb 0.19 -0.19 -0.01 0.00 -1.52 0.00 0.00 31.29 29.76 3mz4 h VAL 25 CO 0.02 0.23 -0.33 0.28 0.02 0.00 0.00 177.57 177.79 3mz4 h SER 26 N 1.24 0.45 -0.03 0.57 0.02 -1.08 0.29 113.55 115.02 3mz4 h SER 26 Ca 0.40 -0.17 -0.00 0.00 -0.84 0.00 0.00 61.79 61.17 3mz4 h SER 26 Cb 0.01 -0.12 -0.00 0.00 0.14 0.00 0.00 62.40 62.43 3mz4 h SER 26 CO -0.13 0.76 0.01 -0.03 -1.14 0.00 0.00 176.83 176.30 3mz4 h MET 27 N 0.38 0.04 -0.03 3.45 -1.53 -0.62 -3.07 114.93 113.55 3mz4 h MET 27 Ca 0.05 -0.01 -0.05 0.00 -3.44 0.00 0.00 59.70 56.25 3mz4 h MET 27 Cb 0.76 -0.01 -0.01 0.00 -0.55 0.00 0.00 31.60 31.80 3mz4 h MET 27 CO 0.06 0.15 -0.21 0.00 0.14 0.00 0.00 176.91 177.06 3mz4 h ASP 29 N 0.05 0.00 0.76 0.00 3.45 -0.33 -2.14 116.42 118.20 3mz4 h ASP 29 Ca 0.01 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.47 3mz4 h ASP 29 Cb 0.39 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 39.16 3mz4 h ASP 29 CO 0.03 0.00 -0.18 -1.20 -1.57 0.00 0.00 179.24 176.32 3mz4 n SER 30 N -3.68 0.21 -4.68 6.45 7.64 -1.00 -1.26 113.62 117.30 3mz4 n SER 30 Ca -0.01 0.13 -0.45 0.00 1.01 0.00 0.00 58.87 59.54 3mz4 n SER 30 Cb 0.19 -0.20 -0.04 0.00 -1.01 0.00 0.00 64.21 63.15 3mz4 n SER 30 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 3mz4 n LEU 31 N -1.44 3.66 0.18 -3.43 4.32 -0.81 -4.86 117.00 114.62 3mz4 n LEU 31 Ca 0.07 0.98 0.04 0.00 -0.02 0.00 0.00 56.01 57.08 3mz4 n LEU 31 Cb 0.33 -1.45 0.33 0.00 -1.62 0.00 0.00 43.42 41.01 3mz4 n LEU 31 CO 0.29 0.01 0.66 0.00 -1.22 0.00 0.00 177.39 177.13 3mz4 h ALA 32 N 8.81 1.10 0.00 -1.18 0.00 -1.91 -1.95 119.26 124.12 3mz4 h ALA 32 Ca -0.48 -0.38 -0.08 0.00 0.00 0.00 0.00 54.91 53.97 3mz4 h ALA 32 Cb 1.25 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.96 3mz4 h ALA 32 CO 0.94 0.53 -0.40 -0.22 0.00 0.00 0.00 179.25 180.09 3mz4 h LYS 33 N 0.00 0.00 -1.64 0.00 1.63 -1.98 -3.35 116.57 111.23 3mz4 h LYS 33 Ca -0.00 0.00 -0.47 0.00 -0.85 0.00 0.00 60.65 59.33 3mz4 h LYS 33 Cb 0.85 0.00 -0.41 0.00 -0.60 0.00 0.00 32.23 32.08 3mz4 h LYS 33 CO 0.05 0.40 -1.06 0.44 -3.45 0.00 0.00 179.45 175.84 3mz4 n ILE 34 N -3.21 1.02 -1.71 2.00 -5.35 -0.77 -4.99 119.36 106.36 3mz4 n ILE 34 Ca 0.02 -4.26 -0.43 0.00 -0.27 0.00 0.00 62.75 57.81 3mz4 n ILE 34 Cb 0.69 -0.24 -0.02 0.00 -1.74 0.00 0.00 39.64 38.32 3mz4 n ILE 34 CO 0.00 0.00 0.00 -0.81 -1.76 0.00 0.00 176.55 173.98 3mz4 n PRO 35 N -0.01 2.41 -0.61 6.28 -0.04 -0.98 -1.57 135.00 140.47 3mz4 n PRO 35 Ca 0.22 0.86 0.00 0.00 -0.04 0.00 0.00 63.50 64.54 3mz4 n PRO 35 Cb 0.67 -2.61 0.00 0.00 -0.04 0.00 0.00 33.50 31.53 3mz4 n PRO 35 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 3mz4 n LYS 36 N 2.50 0.00 -0.32 0.54 4.76 -0.39 -4.88 118.16 120.38 3mz4 n LYS 36 Ca 0.12 0.00 -0.02 0.00 -2.87 0.00 0.00 58.31 55.53 3mz4 n LYS 36 Cb 0.34 -3.50 0.10 0.00 -1.84 0.00 0.00 35.03 30.12 3mz4 n LYS 36 CO 0.00 0.00 0.00 -0.09 -1.37 0.00 0.00 177.40 175.94 3mz4 h ARG 37 N 1.27 1.10 -0.39 1.97 2.43 -1.55 -0.69 114.38 118.51 3mz4 h ARG 37 Ca 0.00 -0.07 -0.01 0.00 -0.81 0.00 0.00 59.98 59.09 3mz4 h ARG 37 Cb 0.00 -0.25 -0.02 0.00 -0.42 0.00 0.00 29.97 29.28 3mz4 h ARG 37 CO 0.00 0.73 0.20 0.00 -1.51 0.00 0.00 179.97 179.39 3mz4 h ALA 38 N 1.34 0.50 -0.73 2.80 0.00 -1.84 0.05 119.26 121.37 3mz4 h ALA 38 Ca 0.33 -0.09 0.06 0.00 0.00 0.00 0.00 54.91 55.22 3mz4 h ALA 38 Cb -0.06 -0.15 -0.06 0.00 0.00 0.00 0.00 17.79 17.51 3mz4 h ALA 38 CO -0.09 0.04 0.42 0.77 0.00 0.00 0.00 179.25 180.38 3mz4 h SER 39 N 0.49 0.62 -0.54 0.00 0.02 -1.68 -1.56 113.55 110.91 3mz4 h SER 39 Ca 0.13 0.03 -0.05 0.00 -0.84 0.00 0.00 61.79 61.06 3mz4 h SER 39 Cb 0.08 -0.09 -0.02 0.00 0.14 0.00 0.00 62.40 62.51 3mz4 h SER 39 CO -0.02 0.40 0.14 0.24 -1.14 0.00 0.00 176.83 176.44 3mz4 h MET 40 N 0.76 0.85 0.07 3.45 2.07 -0.45 -0.01 114.93 121.67 3mz4 h MET 40 Ca 0.33 -0.20 -0.00 0.00 -2.07 0.00 0.00 59.70 57.75 3mz4 h MET 40 Cb 0.21 -0.11 0.00 0.00 -1.87 0.00 0.00 31.60 29.83 3mz4 h MET 40 CO -0.19 0.80 -0.03 0.28 1.07 0.00 0.00 176.91 178.84 3mz4 h VAL 41 N 0.75 0.94 -0.29 -2.22 2.07 -0.87 -1.90 116.25 114.73 3mz4 h VAL 41 Ca 0.17 -0.02 -0.14 0.00 0.82 0.00 0.00 66.70 67.53 3mz4 h VAL 41 Cb 0.32 0.95 -0.01 0.00 -1.52 0.00 0.00 31.29 31.04 3mz4 h VAL 41 CO 0.00 0.01 -0.39 -0.74 0.02 0.00 0.00 177.57 176.47 3mz4 h HIS 42 N -0.11 0.81 -0.00 1.57 6.17 -1.18 -2.09 115.15 120.32 3mz4 h HIS 42 Ca -0.01 -0.23 -0.16 0.00 0.71 0.00 0.00 60.37 60.68 3mz4 h HIS 42 Cb 0.08 -0.17 -0.02 0.00 2.52 0.00 0.00 27.41 29.82 3mz4 h HIS 42 CO -0.07 0.96 -0.76 0.66 0.71 0.00 0.00 177.93 179.43 3mz4 h SER 43 N 0.56 0.00 -0.10 3.26 4.64 -0.99 -0.64 113.55 120.28 3mz4 h SER 43 Ca 0.05 -0.00 -0.06 0.00 -0.47 0.00 0.00 61.79 61.31 3mz4 h SER 43 Cb 0.92 -0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.01 3mz4 h SER 43 CO 0.08 0.76 -0.16 0.25 -0.87 0.00 0.00 176.83 176.89 3mz4 h LEU 44 N 0.00 0.32 -0.75 5.97 5.85 -1.18 0.11 115.31 125.63 3mz4 h LEU 44 Ca -0.01 -0.54 0.17 0.00 0.84 0.00 0.00 57.88 58.34 3mz4 h LEU 44 Cb 1.34 -0.09 -0.11 0.00 0.37 0.00 0.00 40.66 42.17 3mz4 h LEU 44 CO 0.10 0.79 0.18 0.40 -0.34 0.00 0.00 178.44 179.57 3mz4 h ILE 45 N -0.15 0.49 -0.48 4.05 2.04 -1.33 -0.98 117.51 121.15 3mz4 h ILE 45 Ca 0.01 -0.09 -0.10 0.00 1.00 0.00 0.00 64.86 65.68 3mz4 h ILE 45 Cb 0.73 0.21 -0.02 0.00 -0.74 0.00 0.00 36.82 37.00 3mz4 h ILE 45 CO 0.04 0.05 -0.09 -0.08 0.00 0.00 0.00 178.15 178.06 3mz4 h GLU 46 N 0.26 0.87 -0.21 2.37 4.81 -1.02 -2.12 114.58 119.54 3mz4 h GLU 46 Ca 0.43 -0.29 -0.03 0.00 -0.13 0.00 0.00 59.36 59.34 3mz4 h GLU 46 Cb 0.74 -0.07 -0.01 0.00 0.63 0.00 0.00 28.75 30.03 3mz4 h GLU 46 CO -0.53 0.92 0.02 0.00 -0.73 0.00 0.00 179.01 178.70 3mz4 h ALA 47 N 1.11 1.64 -0.16 2.92 0.00 0.48 0.98 119.26 126.23 3mz4 h ALA 47 Ca 0.13 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.93 3mz4 h ALA 47 Cb 0.60 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.29 3mz4 h ALA 47 CO 0.04 0.27 0.00 0.66 0.00 0.00 0.00 179.25 180.22 3mz4 n TYR 48 N -4.38 0.21 -1.57 0.00 4.01 -0.56 -4.88 117.16 109.99 3mz4 n TYR 48 Ca 0.00 -0.10 -0.15 0.00 -0.16 0.00 0.00 57.90 57.48 3mz4 n TYR 48 Cb 0.17 0.00 -0.06 0.00 -0.31 0.00 0.00 39.34 39.15 3mz4 n TYR 48 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 3mz4 n ALA 49 N 0.20 -0.27 0.22 -0.72 0.00 0.34 -4.87 120.51 115.40 3mz4 n ALA 49 Ca 0.15 0.23 0.11 0.00 0.00 0.00 0.00 53.44 53.93 3mz4 n ALA 49 Cb 0.29 -1.67 0.30 0.00 0.00 0.00 0.00 19.45 18.37 3mz4 n ALA 49 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 3mz4 h LEU 50 N 0.00 0.00 -2.28 0.00 3.38 -1.62 -2.82 115.31 111.97 3mz4 h LEU 50 Ca -0.32 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.64 3mz4 h LEU 50 Cb 1.05 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.79 3mz4 h LEU 50 CO 0.46 0.14 -0.04 1.12 0.09 0.00 0.00 178.44 180.22 3mz4 h HIS 51 N 0.00 0.00 0.00 1.13 2.07 -1.89 -1.26 115.15 115.19 3mz4 h HIS 51 Ca -0.00 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.52 3mz4 h HIS 51 Cb 0.93 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.91 3mz4 h HIS 51 CO 0.00 0.04 0.00 1.63 -3.07 0.00 0.00 177.93 176.53 3mz4 n LYS 52 N -3.86 0.03 -0.14 5.12 5.02 -1.06 -2.59 118.16 120.68 3mz4 n LYS 52 Ca -0.03 0.05 0.09 0.00 -2.02 0.00 0.00 58.31 56.41 3mz4 n LYS 52 Cb 0.12 -1.50 0.16 0.00 -0.02 0.00 0.00 35.03 33.80 3mz4 n LYS 52 CO 0.00 0.00 0.00 1.04 -0.52 0.00 0.00 177.40 177.92 3mz4 n GLN 53 N -1.48 2.15 -4.32 1.97 6.02 -0.48 -4.98 117.38 116.26 3mz4 n GLN 53 Ca 0.07 -1.99 -0.18 0.00 -0.01 0.00 0.00 57.00 54.89 3mz4 n GLN 53 Cb 0.30 -1.40 -0.10 0.00 1.02 0.00 0.00 30.24 30.05 3mz4 n GLN 53 CO 0.00 0.00 0.00 -1.64 -1.01 0.00 0.00 177.06 174.41 3mz4 s MET 54 N -1.30 1.26 -0.39 -1.09 -1.94 -1.07 -4.52 119.30 110.25 3mz4 s MET 54 Ca 0.30 -1.54 -0.23 0.00 -1.71 0.00 0.00 55.69 52.51 3mz4 s MET 54 Cb 0.18 -1.02 0.01 0.00 2.01 0.00 0.00 34.83 36.01 3mz4 s MET 54 CO 0.25 0.17 0.78 0.50 -0.01 0.00 0.00 175.02 176.71 3mz4 s ARG 55 N -3.58 3.65 -0.25 2.03 3.52 -0.28 -4.92 118.95 119.11 3mz4 s ARG 55 Ca 0.20 0.18 -0.29 0.00 -0.13 0.00 0.00 55.73 55.70 3mz4 s ARG 55 Cb -0.01 -3.85 0.01 0.00 -1.56 0.00 0.00 34.95 29.55 3mz4 s ARG 55 CO 0.05 -0.93 1.04 0.42 -0.81 0.00 0.00 175.30 175.07 3mz4 s ILE 56 N 3.16 4.64 -0.14 4.11 1.01 -1.26 -0.99 121.20 131.73 3mz4 s ILE 56 Ca 0.31 1.93 0.01 0.00 0.00 0.00 0.00 60.65 62.91 3mz4 s ILE 56 Cb -0.13 -4.33 0.00 0.00 0.01 0.00 0.00 42.46 38.02 3mz4 s ILE 56 CO 0.19 -0.25 -0.18 -0.69 0.00 0.00 0.00 174.94 174.00 3mz4 s VAL 57 N 3.30 2.41 0.07 2.92 1.01 -0.07 -4.95 120.40 125.10 3mz4 s VAL 57 Ca 0.44 -0.86 -0.31 0.00 0.00 0.00 0.00 61.98 61.25 3mz4 s VAL 57 Cb -0.14 -1.99 -0.07 0.00 0.00 0.00 0.00 36.38 34.18 3mz4 s VAL 57 CO 0.08 0.53 1.39 -0.75 0.00 0.00 0.00 175.10 176.35 3mz4 s LYS 58 N 0.76 4.31 0.39 2.72 2.20 -1.24 -1.53 119.74 127.35 3mz4 s LYS 58 Ca -0.07 2.02 -0.24 0.00 -0.36 0.00 0.00 55.97 57.32 3mz4 s LYS 58 Cb -0.16 -3.38 -0.09 0.00 -1.51 0.00 0.00 37.83 32.69 3mz4 s LYS 58 CO 0.00 -0.48 1.04 -1.25 -0.36 0.00 0.00 175.35 174.30 3mz4 s PRO 59 N 1.59 4.21 0.48 4.03 0.04 -1.26 -4.93 135.00 139.17 3mz4 s PRO 59 Ca 0.64 1.50 -0.13 0.00 0.04 0.00 0.00 61.00 63.05 3mz4 s PRO 59 Cb -0.35 -2.57 -0.07 0.00 0.04 0.00 0.00 34.50 31.55 3mz4 s PRO 59 CO 0.29 -0.09 0.90 0.15 0.04 0.00 0.00 177.00 178.29 3mz4 s LYS 60 N -2.45 3.84 0.05 4.56 1.02 -1.26 -4.92 119.74 120.58 3mz4 s LYS 60 Ca 0.57 0.72 -0.26 0.00 0.02 0.00 0.00 55.97 57.02 3mz4 s LYS 60 Cb -0.22 -2.24 -0.05 0.00 -0.52 0.00 0.00 37.83 34.80 3mz4 s LYS 60 CO 0.27 -0.20 0.80 0.08 -0.92 0.00 0.00 175.35 175.37 3mz4 s VAL 61 N -2.58 4.72 0.19 3.17 1.01 -1.26 -3.32 120.40 122.34 3mz4 s VAL 61 Ca 0.55 1.69 -0.31 0.00 0.00 0.00 0.00 61.98 63.91 3mz4 s VAL 61 Cb -0.10 -4.15 -0.10 0.00 0.00 0.00 0.00 36.38 32.03 3mz4 s VAL 61 CO 0.34 0.34 1.55 0.00 0.00 0.00 0.00 175.10 177.34 3mz4 s ALA 62 N 0.03 3.76 0.72 5.51 0.00 -0.44 -4.83 121.76 126.51 3mz4 s ALA 62 Ca 0.40 1.39 -0.11 0.00 0.00 0.00 0.00 51.96 53.64 3mz4 s ALA 62 Cb -0.21 -3.62 0.03 0.00 0.00 0.00 0.00 23.12 19.32 3mz4 s ALA 62 CO 0.24 -0.79 1.07 -1.54 0.00 0.00 0.00 175.76 174.73 3mz4 s SER 63 N 0.94 5.09 0.23 0.00 1.04 -1.26 -4.87 113.70 114.87 3mz4 s SER 63 Ca 0.68 1.62 -0.08 0.00 0.48 0.00 0.00 55.95 58.65 3mz4 s SER 63 Cb -0.44 -2.44 0.39 0.00 0.10 0.00 0.00 66.02 63.63 3mz4 s SER 63 CO 0.35 -1.63 1.67 -0.03 0.98 0.00 0.00 173.24 174.58 3mz4 h MET 64 N -0.85 0.18 -0.62 4.02 4.05 -1.99 -0.63 114.93 119.09 3mz4 h MET 64 Ca -0.44 -0.01 -0.08 0.00 -0.28 0.00 0.00 59.70 58.88 3mz4 h MET 64 Cb 1.22 -0.04 -0.02 0.00 -0.80 0.00 0.00 31.60 31.96 3mz4 h MET 64 CO 0.56 0.12 0.06 0.93 0.23 0.00 0.00 176.91 178.81 3mz4 h GLU 65 N 0.18 1.05 -0.58 0.39 5.08 -1.97 -0.93 114.58 117.79 3mz4 h GLU 65 Ca 0.38 -0.30 0.01 0.00 -1.00 0.00 0.00 59.36 58.45 3mz4 h GLU 65 Cb 0.63 -0.11 -0.03 0.00 0.50 0.00 0.00 28.75 29.74 3mz4 h GLU 65 CO -0.54 0.99 0.38 0.93 -1.00 0.00 0.00 179.01 179.78 3mz4 h GLU 66 N 0.95 0.75 0.00 2.33 5.08 -1.76 -2.46 114.58 119.47 3mz4 h GLU 66 Ca 0.18 -0.04 -0.08 0.00 -1.00 0.00 0.00 59.36 58.42 3mz4 h GLU 66 Cb 0.48 -0.17 -0.01 0.00 0.50 0.00 0.00 28.75 29.55 3mz4 h GLU 66 CO 0.02 0.49 -0.38 0.52 -1.00 0.00 0.00 179.01 178.66 3mz4 h MET 67 N 0.77 0.00 0.00 2.33 2.86 -0.76 -2.31 114.93 117.81 3mz4 h MET 67 Ca 0.22 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.86 3mz4 h MET 67 Cb -0.06 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.60 3mz4 h MET 67 CO -0.06 0.38 0.00 0.00 1.06 0.00 0.00 176.91 178.29 3mz4 n ALA 68 N -2.46 2.32 0.28 6.32 0.00 -0.39 -0.99 120.51 125.60 3mz4 n ALA 68 Ca -0.02 -0.14 0.15 0.00 0.00 0.00 0.00 53.44 53.43 3mz4 n ALA 68 Cb 0.42 -1.38 0.83 0.00 0.00 0.00 0.00 19.45 19.32 3mz4 n ALA 68 CO 0.00 0.00 0.00 1.79 0.00 0.00 0.00 177.50 179.29 3mz4 h THR 69 N 0.00 0.44 0.00 0.00 1.35 -1.21 -3.36 112.91 110.13 3mz4 h THR 69 Ca 0.00 -0.35 0.00 0.00 -0.55 0.00 0.00 66.41 65.51 3mz4 h THR 69 Cb 0.04 1.24 0.00 0.00 -1.73 0.00 0.00 68.15 67.70 3mz4 h THR 69 CO 0.00 0.07 -0.97 0.33 -0.25 0.00 0.00 175.52 174.70 3mz4 n PHE 70 N -3.57 0.00 -2.97 4.73 7.35 -1.01 -5.08 117.46 116.90 3mz4 n PHE 70 Ca -0.02 0.00 -0.32 0.00 -0.76 0.00 0.00 57.45 56.35 3mz4 n PHE 70 Cb 0.19 0.01 -0.06 0.00 0.35 0.00 0.00 39.48 39.97 3mz4 n PHE 70 CO 0.00 0.00 0.00 -1.01 -0.76 0.00 0.00 176.76 174.99 3mz4 s HIS 71 N -2.00 3.38 0.46 -5.13 3.76 -0.16 -4.71 115.29 110.89 3mz4 s HIS 71 Ca 0.00 1.29 -0.22 0.00 -0.15 0.00 0.00 55.06 55.98 3mz4 s HIS 71 Cb 0.00 -2.61 -0.08 0.00 1.11 0.00 0.00 32.58 31.00 3mz4 s HIS 71 CO 0.00 -0.01 1.08 0.95 -0.85 0.00 0.00 174.74 175.90 3mz4 s THR 72 N -2.13 3.56 0.39 1.30 -4.23 -0.42 -4.21 115.64 109.90 3mz4 s THR 72 Ca 0.56 1.09 0.07 0.00 -1.18 0.00 0.00 61.69 62.22 3mz4 s THR 72 Cb -0.10 -3.51 0.23 0.00 1.34 0.00 0.00 72.50 70.46 3mz4 s THR 72 CO 0.20 -0.10 2.00 0.44 -0.54 0.00 0.00 174.62 176.62 3mz4 h ASP 73 N 1.95 0.45 -0.11 3.99 3.32 -1.92 -1.69 116.42 122.41 3mz4 h ASP 73 Ca -0.49 -0.04 -0.00 0.00 0.02 0.00 0.00 57.03 56.52 3mz4 h ASP 73 Cb 1.23 -0.12 -0.01 0.00 0.22 0.00 0.00 39.33 40.66 3mz4 h ASP 73 CO 0.60 0.40 0.06 0.00 -1.72 0.00 0.00 179.24 178.58 3mz4 h ALA 74 N 1.68 0.15 -0.46 3.45 0.00 -1.98 -0.35 119.26 121.74 3mz4 h ALA 74 Ca 0.13 -0.05 0.02 0.00 0.00 0.00 0.00 54.91 55.01 3mz4 h ALA 74 Cb 0.07 -0.05 -0.03 0.00 0.00 0.00 0.00 17.79 17.79 3mz4 h ALA 74 CO -0.02 -0.32 0.27 -0.92 0.00 0.00 0.00 179.25 178.27 3mz4 h TYR 75 N 0.09 0.51 -0.52 0.00 3.20 -1.80 -1.96 116.97 116.49 3mz4 h TYR 75 Ca 0.04 0.02 -0.12 0.00 3.14 0.00 0.00 58.73 61.80 3mz4 h TYR 75 Cb 0.07 -0.17 -0.02 0.00 1.54 0.00 0.00 36.73 38.16 3mz4 h TYR 75 CO -0.04 0.30 -0.14 -0.07 -1.64 0.00 0.00 178.16 176.56 3mz4 h LEU 76 N 0.55 1.03 -0.52 2.82 3.38 -0.94 0.37 115.31 122.00 3mz4 h LEU 76 Ca 0.18 -0.37 -0.05 0.00 0.09 0.00 0.00 57.88 57.73 3mz4 h LEU 76 Cb 0.00 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 40.45 3mz4 h LEU 76 CO -0.08 1.16 0.13 1.56 0.09 0.00 0.00 178.44 181.30 3mz4 h GLN 77 N 0.89 0.84 -0.11 1.13 4.20 -1.02 0.11 115.11 121.15 3mz4 h GLN 77 Ca 0.13 -0.20 0.01 0.00 0.06 0.00 0.00 58.65 58.65 3mz4 h GLN 77 Cb 0.72 -0.11 -0.01 0.00 0.30 0.00 0.00 27.48 28.37 3mz4 h GLN 77 CO 0.06 0.80 0.02 1.25 -0.67 0.00 0.00 178.83 180.28 3mz4 h HIS 78 N 0.73 0.03 -0.64 2.96 2.76 -0.99 -0.65 115.15 119.35 3mz4 h HIS 78 Ca 0.16 0.01 0.10 0.00 -2.20 0.00 0.00 60.37 58.44 3mz4 h HIS 78 Cb 0.34 0.00 -0.07 0.00 1.55 0.00 0.00 27.41 29.23 3mz4 h HIS 78 CO 0.02 0.01 0.25 1.25 -1.30 0.00 0.00 177.93 178.16 3mz4 h LEU 79 N 0.06 0.26 -0.97 0.26 6.46 -0.64 -0.03 115.31 120.71 3mz4 h LEU 79 Ca 0.05 0.08 -0.07 0.00 -0.12 0.00 0.00 57.88 57.82 3mz4 h LEU 79 Cb 0.05 0.05 -0.02 0.00 -0.73 0.00 0.00 40.66 40.01 3mz4 h LEU 79 CO -0.07 0.15 0.03 -0.61 -0.62 0.00 0.00 178.44 177.31 3mz4 h GLN 80 N 0.44 0.77 0.40 1.25 4.15 -0.65 -2.38 115.11 119.08 3mz4 h GLN 80 Ca 0.33 -0.19 -0.02 0.00 0.77 0.00 0.00 58.65 59.53 3mz4 h GLN 80 Cb 0.41 -0.10 0.00 0.00 0.21 0.00 0.00 27.48 28.00 3mz4 h GLN 80 CO -0.31 0.77 -0.19 -0.22 -1.93 0.00 0.00 178.83 176.94 3mz4 h LYS 81 N 0.73 -0.51 0.00 1.69 3.64 0.55 -2.75 116.57 119.92 3mz4 h LYS 81 Ca 0.15 0.03 -0.04 0.00 -1.27 0.00 0.00 60.65 59.52 3mz4 h LYS 81 Cb 0.41 0.12 -0.01 0.00 -0.41 0.00 0.00 32.23 32.34 3mz4 h LYS 81 CO 0.01 -0.20 -0.19 -0.39 -2.27 0.00 0.00 179.45 176.41 3mz4 h VAL 82 N -0.89 0.68 -0.38 2.00 -1.51 -1.40 -0.76 116.25 114.00 3mz4 h VAL 82 Ca -0.05 -0.84 -0.01 0.00 -1.23 0.00 0.00 66.70 64.57 3mz4 h VAL 82 Cb 0.55 1.53 -0.02 0.00 -2.13 0.00 0.00 31.29 31.22 3mz4 h VAL 82 CO 0.09 0.19 0.18 -1.28 -1.23 0.00 0.00 177.57 175.52 3mz4 h SER 83 N 0.00 0.46 -0.25 4.19 0.87 -1.37 -3.15 113.55 114.30 3mz4 h SER 83 Ca -0.00 -0.04 -0.07 0.00 -1.23 0.00 0.00 61.79 60.46 3mz4 h SER 83 Cb 0.51 -0.12 -0.01 0.00 -0.44 0.00 0.00 62.40 62.35 3mz4 h SER 83 CO 0.03 0.40 -0.10 1.56 -0.53 0.00 0.00 176.83 178.19 3mz4 h GLN 84 N 0.53 0.51 -0.40 2.24 1.08 -0.83 -2.66 115.11 115.58 3mz4 h GLN 84 Ca 0.13 -0.21 -0.06 0.00 -1.45 0.00 0.00 58.65 57.06 3mz4 h GLN 84 Cb 0.06 -0.02 -0.01 0.00 -0.05 0.00 0.00 27.48 27.46 3mz4 h GLN 84 CO -0.02 0.76 0.03 1.05 -0.95 0.00 0.00 178.83 179.70 3mz4 h GLU 85 N 0.24 0.69 -5.10 1.46 4.11 -1.50 -3.48 114.58 110.99 3mz4 h GLU 85 Ca 0.06 -0.20 -0.12 0.00 0.07 0.00 0.00 59.36 59.17 3mz4 h GLU 85 Cb 0.59 -0.07 0.10 0.00 0.50 0.00 0.00 28.75 29.87 3mz4 h GLU 85 CO 0.03 0.76 -0.41 0.41 0.07 0.00 0.00 179.01 179.87 3mz4 n GLY 86 N -0.42 -1.00 2.19 1.06 0.00 -1.22 -5.00 105.19 100.81 3mz4 n GLY 86 Ca -0.01 0.44 -0.08 0.00 0.00 0.00 0.00 46.02 46.36 3mz4 n GLY 86 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 3mz4 n TYR 96 N -2.41 -0.26 -1.00 1.61 4.01 -1.26 -4.79 117.16 113.06 3mz4 n TYR 96 Ca -0.03 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.71 3mz4 n TYR 96 Cb 0.56 -2.03 0.00 0.00 -0.31 0.00 0.00 39.34 37.55 3mz4 n TYR 96 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 3mz4 n GLY 97 N -1.33 0.54 2.30 2.72 0.00 -1.26 -0.99 105.19 107.17 3mz4 n GLY 97 Ca -0.10 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.57 3mz4 n GLY 97 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3mz4 n LEU 98 N 0.00 8.11 0.00 0.99 4.77 -1.26 -4.35 117.00 125.26 3mz4 n LEU 98 Ca 0.00 -4.28 0.00 0.00 -0.03 0.00 0.00 56.01 51.70 3mz4 n LEU 98 Cb 0.02 -1.50 0.00 0.00 -2.33 0.00 0.00 43.42 39.62 3mz4 n LEU 98 CO 0.00 2.01 0.00 0.61 -1.33 0.00 0.00 177.39 178.68 3mz4 n GLY 99 N 3.04 2.77 0.25 -0.72 0.00 -1.16 -4.23 105.19 105.13 3mz4 n GLY 99 Ca 0.70 -1.76 0.01 0.00 0.00 0.00 0.00 46.02 44.97 3mz4 n GLY 99 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 3mz4 h TYR 100 N 0.00 -0.18 0.00 1.61 3.20 -1.99 0.95 116.97 120.55 3mz4 h TYR 100 Ca 0.00 0.05 -0.11 0.00 3.14 0.00 0.00 58.73 61.81 3mz4 h TYR 100 Cb 0.00 0.18 -0.02 0.00 1.54 0.00 0.00 36.73 38.44 3mz4 h TYR 100 CO 0.00 -0.23 -0.59 -0.07 -1.64 0.00 0.00 178.16 175.63 3mz4 h LEU 101 N 0.06 0.00 -5.59 2.82 3.38 -1.94 -3.36 115.31 110.67 3mz4 h LEU 101 Ca 0.33 0.00 -0.56 0.00 0.09 0.00 0.00 57.88 57.75 3mz4 h LEU 101 Cb 0.54 0.00 -0.41 0.00 0.09 0.00 0.00 40.66 40.88 3mz4 h LEU 101 CO -0.62 0.52 -0.83 0.00 0.09 0.00 0.00 178.44 177.61 3mz4 s PRO 103 N -3.01 3.37 -0.85 0.00 0.05 0.14 -3.01 135.00 131.68 3mz4 s PRO 103 Ca 0.45 1.98 -0.25 0.00 0.05 0.00 0.00 61.00 63.23 3mz4 s PRO 103 Cb 0.29 -2.26 0.03 0.00 0.05 0.00 0.00 34.50 32.61 3mz4 s PRO 103 CO -0.11 -0.93 1.43 0.00 0.05 0.00 0.00 177.00 177.43 3mz4 s ALA 104 N -1.45 2.63 0.34 8.56 0.00 -1.26 -4.96 121.76 125.62 3mz4 s ALA 104 Ca 0.69 -1.66 0.07 0.00 0.00 0.00 0.00 51.96 51.06 3mz4 s ALA 104 Cb -0.34 -4.38 -0.01 0.00 0.00 0.00 0.00 23.12 18.38 3mz4 s ALA 104 CO 0.40 -3.55 0.41 0.95 0.00 0.00 0.00 175.76 173.97 3mz4 s THR 105 N 5.95 3.77 0.18 0.00 -4.23 -1.26 -4.85 115.64 115.20 3mz4 s THR 105 Ca 0.44 -1.14 -0.31 0.00 -1.18 0.00 0.00 61.69 59.50 3mz4 s THR 105 Cb -0.05 -3.29 -0.10 0.00 1.34 0.00 0.00 72.50 70.40 3mz4 s THR 105 CO 0.05 -0.15 1.49 -0.70 -0.54 0.00 0.00 174.62 174.78 3mz4 s GLU 106 N -4.12 4.25 0.00 3.99 2.12 -1.26 -2.93 118.70 120.75 3mz4 s GLU 106 Ca 0.44 2.28 0.00 0.00 0.36 0.00 0.00 54.97 58.05 3mz4 s GLU 106 Cb -0.08 -3.16 0.00 0.00 0.26 0.00 0.00 34.13 31.15 3mz4 s GLU 106 CO 0.30 -0.51 0.00 0.41 -0.54 0.00 0.00 175.26 174.91 3mz4 n GLY 107 N 3.24 0.75 0.27 -1.50 0.00 -1.00 -4.95 105.19 102.00 3mz4 n GLY 107 Ca 0.11 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.12 3mz4 n GLY 107 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 3mz4 h ILE 108 N 0.00 1.21 -0.79 -0.61 6.09 -1.79 -1.17 117.51 120.46 3mz4 h ILE 108 Ca 0.00 -0.89 0.05 0.00 -1.37 0.00 0.00 64.86 62.65 3mz4 h ILE 108 Cb 0.00 1.01 -0.05 0.00 0.47 0.00 0.00 36.82 38.24 3mz4 h ILE 108 CO 0.00 0.30 0.49 0.15 -3.07 0.00 0.00 178.15 176.02 3mz4 h PHE 109 N 0.51 0.91 -0.21 2.19 3.57 -1.86 -0.49 116.94 121.56 3mz4 h PHE 109 Ca 0.10 0.03 -0.02 0.00 3.53 0.00 0.00 57.97 61.61 3mz4 h PHE 109 Cb 0.40 -0.30 -0.01 0.00 2.79 0.00 0.00 35.95 38.84 3mz4 h PHE 109 CO 0.01 0.49 0.05 -0.44 -2.23 0.00 0.00 178.31 176.19 3mz4 h ASP 110 N 0.93 0.33 -0.87 0.41 3.45 -1.65 -0.77 116.42 118.25 3mz4 h ASP 110 Ca 0.33 -0.24 -0.02 0.00 0.43 0.00 0.00 57.03 57.53 3mz4 h ASP 110 Cb 0.09 -0.09 -0.04 0.00 -0.56 0.00 0.00 39.33 38.73 3mz4 h ASP 110 CO -0.14 0.49 0.46 1.88 -1.57 0.00 0.00 179.24 180.36 3mz4 h TYR 111 N 0.16 1.21 0.36 4.55 0.05 -1.03 -0.58 116.97 121.69 3mz4 h TYR 111 Ca 0.07 -0.04 -0.02 0.00 0.05 0.00 0.00 58.73 58.79 3mz4 h TYR 111 Cb 0.29 -0.38 0.00 0.00 1.01 0.00 0.00 36.73 37.65 3mz4 h TYR 111 CO 0.01 0.84 -0.17 0.00 -1.05 0.00 0.00 178.16 177.80 3mz4 h ALA 112 N 1.28 -0.48 -1.00 3.88 0.00 -1.07 -1.60 119.26 120.28 3mz4 h ALA 112 Ca 0.31 -0.16 0.21 0.00 0.00 0.00 0.00 54.91 55.27 3mz4 h ALA 112 Cb 0.05 0.19 -0.11 0.00 0.00 0.00 0.00 17.79 17.92 3mz4 h ALA 112 CO -0.05 -0.66 0.61 0.00 0.00 0.00 0.00 179.25 179.16 3mz4 h ALA 113 N -0.14 1.81 -0.57 0.00 0.00 -1.04 0.24 119.26 119.56 3mz4 h ALA 113 Ca -0.05 0.08 -0.04 0.00 0.00 0.00 0.00 54.91 54.91 3mz4 h ALA 113 Cb 0.49 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.21 3mz4 h ALA 113 CO 0.08 -0.21 0.20 0.00 0.00 0.00 0.00 179.25 179.33 3mz4 h ALA 114 N 1.66 0.75 0.10 0.00 0.00 -0.81 0.31 119.26 121.26 3mz4 h ALA 114 Ca 0.59 -0.18 -0.27 0.00 0.00 0.00 0.00 54.91 55.05 3mz4 h ALA 114 Cb 1.08 -0.22 0.03 0.00 0.00 0.00 0.00 17.79 18.67 3mz4 h ALA 114 CO -0.38 0.38 -1.11 0.82 0.00 0.00 0.00 179.25 178.96 3mz4 h ILE 115 N 0.79 1.32 -0.43 0.00 2.04 -0.25 -1.65 117.51 119.34 3mz4 h ILE 115 Ca 0.19 -2.41 0.09 0.00 1.00 0.00 0.00 64.86 63.73 3mz4 h ILE 115 Cb 0.24 2.72 -0.08 0.00 -0.74 0.00 0.00 36.82 38.97 3mz4 h ILE 115 CO -0.01 0.72 -0.07 1.23 0.00 0.00 0.00 178.15 180.03 3mz4 h GLY 116 N 0.17 0.36 1.57 5.37 0.00 -0.61 -2.48 103.07 107.45 3mz4 h GLY 116 Ca -0.17 0.11 -0.04 0.00 0.00 0.00 0.00 47.33 47.24 3mz4 h GLY 116 CO 0.21 -0.15 0.07 -1.33 0.00 0.00 0.00 176.54 175.35 3mz4 h GLY 117 N 0.04 0.58 0.90 4.60 0.00 -0.95 -0.90 103.07 107.34 3mz4 h GLY 117 Ca 0.21 -0.31 -0.01 0.00 0.00 0.00 0.00 47.33 47.22 3mz4 h GLY 117 CO -0.41 0.29 0.09 0.00 0.00 0.00 0.00 176.54 176.50 3mz4 h ALA 118 N 1.55 0.27 -0.43 3.60 0.00 -0.95 0.23 119.26 123.53 3mz4 h ALA 118 Ca 0.12 -0.10 -0.12 0.00 0.00 0.00 0.00 54.91 54.80 3mz4 h ALA 118 Cb 0.23 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.93 3mz4 h ALA 118 CO -0.00 -0.15 -0.23 1.15 0.00 0.00 0.00 179.25 180.02 3mz4 h THR 119 N 0.19 1.27 -0.39 0.00 2.02 -1.23 -0.78 112.91 113.99 3mz4 h THR 119 Ca 0.07 -1.37 0.02 0.00 0.77 0.00 0.00 66.41 65.90 3mz4 h THR 119 Cb 0.16 1.18 -0.03 0.00 -1.74 0.00 0.00 68.15 67.72 3mz4 h THR 119 CO -0.01 0.46 0.23 0.40 0.37 0.00 0.00 175.52 176.97 3mz4 h ILE 120 N 0.76 1.03 -0.11 3.11 2.04 -1.00 -0.23 117.51 123.12 3mz4 h ILE 120 Ca 0.10 -0.16 0.03 0.00 1.00 0.00 0.00 64.86 65.83 3mz4 h ILE 120 Cb 0.77 0.54 -0.03 0.00 -0.74 0.00 0.00 36.82 37.36 3mz4 h ILE 120 CO 0.06 0.08 -0.06 0.74 0.00 0.00 0.00 178.15 178.97 3mz4 h THR 121 N 0.46 0.81 -0.68 -0.27 2.02 -0.33 0.65 112.91 115.57 3mz4 h THR 121 Ca 0.16 0.00 0.07 0.00 0.77 0.00 0.00 66.41 67.40 3mz4 h THR 121 Cb 0.01 0.81 -0.06 0.00 -1.74 0.00 0.00 68.15 67.17 3mz4 h THR 121 CO -0.08 0.00 0.36 0.00 0.37 0.00 0.00 175.52 176.18 3mz4 h ALA 122 N 1.03 0.91 -0.74 6.16 0.00 -0.92 -0.54 119.26 125.17 3mz4 h ALA 122 Ca 0.06 0.03 -0.00 0.00 0.00 0.00 0.00 54.91 55.00 3mz4 h ALA 122 Cb 0.15 -0.10 -0.04 0.00 0.00 0.00 0.00 17.79 17.81 3mz4 h ALA 122 CO -0.14 0.02 0.46 0.00 0.00 0.00 0.00 179.25 179.58 3mz4 h ALA 123 N 1.37 0.94 -0.56 0.00 0.00 -0.56 -2.51 119.26 117.94 3mz4 h ALA 123 Ca 0.31 -0.08 -0.01 0.00 0.00 0.00 0.00 54.91 55.13 3mz4 h ALA 123 Cb 0.24 -0.30 -0.03 0.00 0.00 0.00 0.00 17.79 17.71 3mz4 h ALA 123 CO -0.21 0.40 0.29 0.37 0.00 0.00 0.00 179.25 180.10 3mz4 h GLN 124 N 1.01 0.77 -0.40 0.00 5.75 -0.29 -1.77 115.11 120.17 3mz4 h GLN 124 Ca 0.27 -0.08 -0.04 0.00 -0.15 0.00 0.00 58.65 58.64 3mz4 h GLN 124 Cb -0.06 -0.16 -0.02 0.00 1.07 0.00 0.00 27.48 28.32 3mz4 h GLN 124 CO -0.05 0.58 0.07 0.00 -2.65 0.00 0.00 178.83 176.77 3mz4 h LEU 126 N 0.59 0.71 -0.83 0.00 3.38 -0.94 -2.47 115.31 115.76 3mz4 h LEU 126 Ca 0.13 -0.52 -0.09 0.00 0.09 0.00 0.00 57.88 57.49 3mz4 h LEU 126 Cb 0.27 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 40.79 3mz4 h LEU 126 CO 0.00 1.31 -0.12 0.40 0.09 0.00 0.00 178.44 180.12 3mz4 h ILE 127 N 0.36 1.26 0.00 1.22 2.04 -1.11 -2.40 117.51 118.87 3mz4 h ILE 127 Ca -0.07 -1.16 0.00 0.00 1.00 0.00 0.00 64.86 64.63 3mz4 h ILE 127 Cb 1.50 1.06 0.00 0.00 -0.74 0.00 0.00 36.82 38.64 3mz4 h ILE 127 CO 0.16 0.39 0.00 0.47 0.00 0.00 0.00 178.15 179.18 3mz4 n ASP 128 N -4.16 0.49 -0.01 1.72 8.00 -0.42 -4.87 116.55 117.31 3mz4 n ASP 128 Ca 0.01 0.60 -0.00 0.00 0.71 0.00 0.00 54.79 56.11 3mz4 n ASP 128 Cb 0.36 -0.71 -0.00 0.00 -0.02 0.00 0.00 41.12 40.75 3mz4 n ASP 128 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3mz4 n GLY 129 N 0.30 0.41 0.50 0.44 0.00 -0.90 -4.90 105.19 101.04 3mz4 n GLY 129 Ca 0.03 -0.02 0.34 0.00 0.00 0.00 0.00 46.02 46.37 3mz4 n GLY 129 CO 0.00 0.00 0.00 1.98 0.00 0.00 0.00 173.32 175.30 3mz4 h MET 130 N 0.79 0.14 -2.72 1.61 -1.53 -1.70 -3.45 114.93 108.06 3mz4 h MET 130 Ca -0.00 -0.01 0.07 0.00 -3.44 0.00 0.00 59.70 56.32 3mz4 h MET 130 Cb 0.19 -0.03 -0.10 0.00 -0.55 0.00 0.00 31.60 31.11 3mz4 h MET 130 CO 0.00 0.09 0.33 0.00 0.14 0.00 0.00 176.91 177.47 3mz4 n LYS 132 N -0.39 0.45 -4.13 0.00 4.76 -1.26 -4.68 118.16 112.92 3mz4 n LYS 132 Ca -0.10 -0.11 -0.22 0.00 -2.87 0.00 0.00 58.31 55.01 3mz4 n LYS 132 Cb 0.62 -1.54 -0.17 0.00 -1.84 0.00 0.00 35.03 32.10 3mz4 n LYS 132 CO 0.00 0.00 0.00 0.08 -1.37 0.00 0.00 177.40 176.11 3mz4 s VAL 133 N -3.35 0.65 -0.05 -0.18 1.01 -1.26 -0.51 120.40 116.71 3mz4 s VAL 133 Ca -0.02 -0.15 0.04 0.00 0.00 0.00 0.00 61.98 61.85 3mz4 s VAL 133 Cb 0.14 -0.68 -0.00 0.00 0.00 0.00 0.00 36.38 35.84 3mz4 s VAL 133 CO 0.88 0.27 -0.17 0.00 0.00 0.00 0.00 175.10 176.08 3mz4 s ALA 134 N 1.15 1.55 -0.14 5.51 0.00 -0.66 0.01 121.76 129.17 3mz4 s ALA 134 Ca -0.07 -0.68 0.02 0.00 0.00 0.00 0.00 51.96 51.22 3mz4 s ALA 134 Cb -0.14 -0.54 0.00 0.00 0.00 0.00 0.00 23.12 22.45 3mz4 s ALA 134 CO -0.01 0.26 -0.19 0.42 0.00 0.00 0.00 175.76 176.24 3mz4 s ILE 135 N 0.13 2.36 -0.58 0.00 1.01 0.59 -0.91 121.20 123.80 3mz4 s ILE 135 Ca -0.06 -0.88 0.04 0.00 0.00 0.00 0.00 60.65 59.75 3mz4 s ILE 135 Cb -0.12 -1.97 0.16 0.00 0.01 0.00 0.00 42.46 40.54 3mz4 s ILE 135 CO 0.03 0.53 0.41 0.21 0.00 0.00 0.00 174.94 176.12 3mz4 s ASN 136 N 0.76 3.75 0.52 3.58 2.47 0.30 -1.25 114.94 125.07 3mz4 s ASN 136 Ca -0.07 -3.44 0.24 0.00 0.42 0.00 0.00 52.86 50.00 3mz4 s ASN 136 Cb -0.16 -1.24 1.36 0.00 -1.45 0.00 0.00 41.25 39.76 3mz4 s ASN 136 CO 0.00 -0.14 1.99 -0.50 -3.72 0.00 0.00 177.10 174.73 3mz4 h TRP 137 N 5.70 0.05 0.00 0.43 -0.00 -1.89 -1.30 115.95 118.95 3mz4 h TRP 137 Ca 0.14 0.00 0.00 0.00 -0.00 0.00 0.00 58.89 59.04 3mz4 h TRP 137 Cb 0.82 -0.02 0.00 0.00 -0.00 0.00 0.00 29.16 29.97 3mz4 h TRP 137 CO 0.54 0.02 0.00 0.43 -0.00 0.00 0.00 178.44 179.43 3mz4 n SER 138 N -4.39 0.00 -1.69 -3.49 7.64 -1.26 -2.72 113.62 107.71 3mz4 n SER 138 Ca 0.10 -0.61 0.00 0.00 1.01 0.00 0.00 58.87 59.37 3mz4 n SER 138 Cb 0.59 -0.11 0.00 0.00 -1.01 0.00 0.00 64.21 63.68 3mz4 n SER 138 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3mz4 n GLY 139 N 0.94 0.54 0.52 0.23 0.00 -0.50 -4.87 105.19 102.05 3mz4 n GLY 139 Ca 0.19 -1.87 0.00 0.00 0.00 0.00 0.00 46.02 44.34 3mz4 n GLY 139 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3mz4 n GLY 140 N 5.00 1.38 3.03 -0.02 0.00 -1.26 -2.42 105.19 110.90 3mz4 n GLY 140 Ca 0.00 -0.23 -0.42 0.00 0.00 0.00 0.00 46.02 45.37 3mz4 n GLY 140 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 3mz4 n TRP 141 N -1.50 3.56 0.96 1.61 7.02 -1.26 -4.51 117.44 123.31 3mz4 n TRP 141 Ca 0.00 -2.72 0.13 0.00 -1.02 0.00 0.00 57.50 53.90 3mz4 n TRP 141 Cb 0.14 -2.47 0.59 0.00 -2.42 0.00 0.00 31.31 27.14 3mz4 n TRP 141 CO 0.00 0.00 0.00 -2.39 -2.02 0.00 0.00 177.69 173.28 3mz4 n HIS 142 N 7.27 0.00 0.07 -5.99 1.44 -1.26 -3.64 115.22 113.11 3mz4 n HIS 142 Ca 0.51 0.00 0.03 0.00 -2.01 0.00 0.00 57.72 56.25 3mz4 n HIS 142 Cb 0.41 -0.48 -0.04 0.00 0.12 0.00 0.00 29.99 30.00 3mz4 n HIS 142 CO 0.00 0.00 0.00 0.45 -2.81 0.00 0.00 176.34 173.98 3mz4 h HIS 143 N 0.00 0.00 -3.79 -1.40 3.86 -1.88 -1.41 115.15 110.53 3mz4 h HIS 143 Ca 0.00 0.00 -0.56 0.00 -1.16 0.00 0.00 60.37 58.65 3mz4 h HIS 143 Cb 0.45 0.00 0.14 0.00 1.06 0.00 0.00 27.41 29.06 3mz4 h HIS 143 CO 0.00 0.42 0.50 0.00 0.86 0.00 0.00 177.93 179.72 3mz4 n ALA 144 N -2.31 1.31 -2.38 2.45 0.00 -1.24 -4.12 120.51 114.23 3mz4 n ALA 144 Ca -0.05 0.17 -0.24 0.00 0.00 0.00 0.00 53.44 53.32 3mz4 n ALA 144 Cb 0.75 -2.29 -0.06 0.00 0.00 0.00 0.00 19.45 17.84 3mz4 n ALA 144 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 3mz4 s LYS 145 N -2.60 2.31 0.39 0.00 -0.14 0.06 -4.52 119.74 115.24 3mz4 s LYS 145 Ca 0.68 -1.75 0.17 0.00 -1.36 0.00 0.00 55.97 53.70 3mz4 s LYS 145 Cb -0.45 -2.09 1.06 0.00 -1.68 0.00 0.00 37.83 34.67 3mz4 s LYS 145 CO 0.52 -0.13 1.80 1.57 -0.76 0.00 0.00 175.35 178.35 3mz4 h LYS 146 N 1.32 0.42 0.00 1.68 2.10 -1.93 -3.06 116.57 117.11 3mz4 h LYS 146 Ca -0.42 -0.03 0.00 0.00 -2.00 0.00 0.00 60.65 58.20 3mz4 h LYS 146 Cb 1.26 -0.10 0.00 0.00 -0.90 0.00 0.00 32.23 32.49 3mz4 h LYS 146 CO 0.66 0.28 -0.19 -0.40 -2.00 0.00 0.00 179.45 177.80 3mz4 n ASP 147 N -4.60 0.83 -3.72 7.07 3.85 -1.26 -1.30 116.55 117.41 3mz4 n ASP 147 Ca 0.23 -2.00 -0.13 0.00 -0.71 0.00 0.00 54.79 52.17 3mz4 n ASP 147 Cb 0.79 -0.17 -0.09 0.00 -1.35 0.00 0.00 41.12 40.30 3mz4 n ASP 147 CO 0.00 0.00 0.00 -1.83 -1.01 0.00 0.00 177.20 174.36 3mz4 s GLU 148 N -0.80 0.56 0.63 0.11 -1.05 -1.16 -4.74 118.70 112.24 3mz4 s GLU 148 Ca 0.07 0.51 -0.15 0.00 -0.15 0.00 0.00 54.97 55.25 3mz4 s GLU 148 Cb 0.06 0.27 -0.02 0.00 -0.44 0.00 0.00 34.13 34.00 3mz4 s GLU 148 CO 0.01 -0.09 1.09 0.00 0.95 0.00 0.00 175.26 177.22 3mz4 s ALA 149 N 0.00 2.59 -0.28 -0.84 0.00 -0.16 -0.76 121.76 122.31 3mz4 s ALA 149 Ca -0.02 0.49 -0.22 0.00 0.00 0.00 0.00 51.96 52.21 3mz4 s ALA 149 Cb -0.03 -3.28 0.11 0.00 0.00 0.00 0.00 23.12 19.91 3mz4 s ALA 149 CO 0.01 -1.06 0.89 0.45 0.00 0.00 0.00 175.76 176.05 3mz4 s SER 150 N -2.64 -0.62 -1.33 0.00 0.15 -0.61 -4.45 113.70 104.20 3mz4 s SER 150 Ca 0.66 1.11 -0.05 0.00 0.70 0.00 0.00 55.95 58.37 3mz4 s SER 150 Cb -0.19 1.17 0.02 0.00 -1.71 0.00 0.00 66.02 65.31 3mz4 s SER 150 CO 0.39 -0.19 0.96 0.61 1.20 0.00 0.00 173.24 176.21 3mz4 n GLY 151 N 2.97 -0.41 3.36 9.45 0.00 -1.26 -0.94 105.19 118.36 3mz4 n GLY 151 Ca -0.15 0.16 0.00 0.00 0.00 0.00 0.00 46.02 46.03 3mz4 n GLY 151 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 3mz4 n PHE 152 N -4.48 0.00 -3.54 1.61 0.99 -1.20 -4.88 117.46 105.96 3mz4 n PHE 152 Ca -0.16 0.00 -0.38 0.00 -0.00 0.00 0.00 57.45 56.91 3mz4 n PHE 152 Cb 0.62 -0.34 -0.10 0.00 -1.00 0.00 0.00 39.48 38.66 3mz4 n PHE 152 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.76 176.76 3mz4 n TYR 154 N 5.09 0.00 -3.65 0.00 4.02 -1.26 -1.57 117.16 119.79 3mz4 n TYR 154 Ca -0.13 0.00 -0.14 0.00 -0.01 0.00 0.00 57.90 57.62 3mz4 n TYR 154 Cb 0.52 0.00 -0.08 0.00 -0.02 0.00 0.00 39.34 39.76 3mz4 n TYR 154 CO 0.00 0.00 0.00 -1.17 -1.01 0.00 0.00 176.86 174.68 3mz4 s LEU 155 N -2.29 -0.36 -0.96 7.72 2.96 -1.26 -4.78 118.68 119.71 3mz4 s LEU 155 Ca 0.16 1.14 -0.14 0.00 -0.22 0.00 0.00 54.13 55.06 3mz4 s LEU 155 Cb 0.16 2.15 0.20 0.00 0.50 0.00 0.00 46.19 49.20 3mz4 s LEU 155 CO 0.50 -0.27 1.01 0.21 -1.32 0.00 0.00 176.35 176.48 3mz4 s ASN 156 N 0.07 6.89 0.36 3.68 3.84 -1.26 -4.67 114.94 123.85 3mz4 s ASN 156 Ca -0.02 -2.76 0.05 0.00 0.21 0.00 0.00 52.86 50.34 3mz4 s ASN 156 Cb -0.04 -2.28 0.70 0.00 -0.55 0.00 0.00 41.25 39.08 3mz4 s ASN 156 CO 0.02 -0.66 1.97 -2.24 -2.79 0.00 0.00 177.10 173.40 3mz4 h ASP 157 N 7.73 0.54 -0.42 -4.21 2.03 -1.91 -2.35 116.42 117.84 3mz4 h ASP 157 Ca 0.16 -0.05 0.01 0.00 -0.73 0.00 0.00 57.03 56.42 3mz4 h ASP 157 Cb 0.98 -0.14 -0.02 0.00 -0.83 0.00 0.00 39.33 39.32 3mz4 h ASP 157 CO 0.95 0.48 0.27 0.00 -1.03 0.00 0.00 179.24 179.91 3mz4 h ALA 158 N 1.61 0.53 -0.29 4.15 0.00 -1.90 0.49 119.26 123.85 3mz4 h ALA 158 Ca 0.15 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.04 3mz4 h ALA 158 Cb 0.10 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.72 3mz4 h ALA 158 CO -0.02 -0.04 0.19 0.28 0.00 0.00 0.00 179.25 179.67 3mz4 h VAL 159 N 0.54 1.08 -0.83 0.00 2.07 -1.86 0.83 116.25 118.08 3mz4 h VAL 159 Ca 0.16 -0.14 0.08 0.00 0.82 0.00 0.00 66.70 67.62 3mz4 h VAL 159 Cb -0.04 0.65 -0.07 0.00 -1.52 0.00 0.00 31.29 30.31 3mz4 h VAL 159 CO -0.05 0.07 0.49 -0.07 0.02 0.00 0.00 177.57 178.04 3mz4 h LEU 160 N 0.40 0.74 -0.42 2.57 3.38 -1.04 -0.06 115.31 120.88 3mz4 h LEU 160 Ca 0.11 0.03 -0.09 0.00 0.09 0.00 0.00 57.88 58.02 3mz4 h LEU 160 Cb -0.05 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 40.57 3mz4 h LEU 160 CO -0.02 0.46 -0.09 1.23 0.09 0.00 0.00 178.44 180.10 3mz4 h GLY 161 N 0.87 0.88 0.96 0.83 0.00 -0.51 -2.33 103.07 103.77 3mz4 h GLY 161 Ca 0.38 -0.71 -0.00 0.00 0.00 0.00 0.00 47.33 46.99 3mz4 h GLY 161 CO -0.20 0.65 0.17 -2.22 0.00 0.00 0.00 176.54 174.94 3mz4 h ILE 162 N 0.63 1.12 -0.73 2.60 2.04 0.04 -1.38 117.51 121.83 3mz4 h ILE 162 Ca 0.11 -0.31 0.02 0.00 1.00 0.00 0.00 64.86 65.68 3mz4 h ILE 162 Cb 0.62 0.77 -0.04 0.00 -0.74 0.00 0.00 36.82 37.43 3mz4 h ILE 162 CO 0.04 0.12 0.48 -0.07 0.00 0.00 0.00 178.15 178.73 3mz4 h LEU 163 N 0.38 0.80 -0.10 1.44 3.38 -0.98 -1.54 115.31 118.69 3mz4 h LEU 163 Ca 0.11 -0.02 -0.01 0.00 0.09 0.00 0.00 57.88 58.05 3mz4 h LEU 163 Cb 0.05 -0.19 -0.00 0.00 0.09 0.00 0.00 40.66 40.60 3mz4 h LEU 163 CO -0.02 0.57 0.02 -0.09 0.09 0.00 0.00 178.44 179.01 3mz4 h ARG 164 N 0.94 0.17 -0.26 1.13 9.65 -0.84 -2.91 114.38 122.26 3mz4 h ARG 164 Ca 0.28 -0.05 0.07 0.00 -1.10 0.00 0.00 59.98 59.18 3mz4 h ARG 164 Cb -0.03 -0.02 -0.01 0.00 -1.39 0.00 0.00 29.97 28.52 3mz4 h ARG 164 CO -0.07 0.37 0.18 -0.07 2.80 0.00 0.00 179.97 183.19 3mz4 h LEU 165 N -0.06 0.04 -1.57 3.80 3.38 -0.92 -1.89 115.31 118.10 3mz4 h LEU 165 Ca 0.03 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.00 3mz4 h LEU 165 Cb 0.28 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 41.03 3mz4 h LEU 165 CO 0.00 0.03 0.00 0.03 0.09 0.00 0.00 178.44 178.59 3mz4 h ARG 166 N 0.05 0.00 -0.35 1.13 2.47 -1.07 0.15 114.38 116.76 3mz4 h ARG 166 Ca 0.12 0.00 -0.02 0.00 -1.26 0.00 0.00 59.98 58.82 3mz4 h ARG 166 Cb 0.42 0.00 -0.02 0.00 -1.65 0.00 0.00 29.97 28.72 3mz4 h ARG 166 CO -0.01 0.00 0.14 0.00 0.56 0.00 0.00 179.97 180.66 3mz4 h ARG 167 N 0.00 0.49 0.00 0.04 3.08 -1.42 -3.34 114.38 113.24 3mz4 h ARG 167 Ca 0.00 -0.06 -0.24 0.00 0.07 0.00 0.00 59.98 59.75 3mz4 h ARG 167 Cb 0.15 -0.10 -0.04 0.00 0.08 0.00 0.00 29.97 30.06 3mz4 h ARG 167 CO 0.00 0.41 -1.89 1.17 -1.07 0.00 0.00 179.97 178.59 3mz4 n LYS 168 N -4.39 0.38 -4.40 0.04 3.00 -0.25 -5.00 118.16 107.54 3mz4 n LYS 168 Ca 0.02 0.10 -0.34 0.00 -0.00 0.00 0.00 58.31 58.09 3mz4 n LYS 168 Cb 0.14 -1.28 -0.13 0.00 0.00 0.00 0.00 35.03 33.75 3mz4 n LYS 168 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.40 177.34 3mz4 s PHE 169 N -2.31 2.94 0.17 5.64 0.40 0.37 -5.01 117.98 120.19 3mz4 s PHE 169 Ca -0.21 -0.55 -0.09 0.00 -0.60 0.00 0.00 56.93 55.48 3mz4 s PHE 169 Cb 0.06 -1.96 0.05 0.00 0.51 0.00 0.00 43.02 41.68 3mz4 s PHE 169 CO 0.35 -0.21 1.58 1.49 0.70 0.00 0.00 175.22 179.13 3mz4 h GLU 170 N 7.05 0.96 -4.38 0.44 4.57 -1.86 -3.38 114.58 117.98 3mz4 h GLU 170 Ca -0.32 -0.40 -0.50 0.00 -1.18 0.00 0.00 59.36 56.97 3mz4 h GLU 170 Cb 1.19 -0.04 -0.34 0.00 -0.16 0.00 0.00 28.75 29.40 3mz4 h GLU 170 CO 0.60 1.06 -0.80 1.03 -1.18 0.00 0.00 179.01 179.72 3mz4 s ARG 171 N -4.69 1.50 -0.08 1.92 0.52 -1.26 -4.87 118.95 111.99 3mz4 s ARG 171 Ca -0.11 -0.32 0.03 0.00 -0.52 0.00 0.00 55.73 54.81 3mz4 s ARG 171 Cb 0.13 -1.34 -0.02 0.00 0.52 0.00 0.00 34.95 34.24 3mz4 s ARG 171 CO 0.86 -0.06 -0.16 0.42 0.02 0.00 0.00 175.30 176.39 3mz4 s ILE 172 N 0.94 2.86 -0.21 1.52 -1.09 -0.91 -0.64 121.20 123.66 3mz4 s ILE 172 Ca -0.10 -0.77 -0.09 0.00 -2.23 0.00 0.00 60.65 57.47 3mz4 s ILE 172 Cb -0.15 -2.14 -0.04 0.00 -1.58 0.00 0.00 42.46 38.55 3mz4 s ILE 172 CO 0.01 0.56 0.11 -0.22 -1.23 0.00 0.00 174.94 174.17 3mz4 s LEU 173 N -0.22 3.93 -0.23 2.97 2.96 -0.25 -1.62 118.68 126.22 3mz4 s LEU 173 Ca 0.00 0.07 -0.06 0.00 -0.22 0.00 0.00 54.13 53.92 3mz4 s LEU 173 Cb -0.13 -2.03 -0.02 0.00 0.50 0.00 0.00 46.19 44.51 3mz4 s LEU 173 CO 0.03 0.11 0.04 -0.47 -1.32 0.00 0.00 176.35 174.74 3mz4 s TYR 174 N 0.77 3.06 -0.13 5.38 5.04 0.09 -0.54 117.35 131.03 3mz4 s TYR 174 Ca 0.06 -0.50 0.00 0.00 -2.44 0.00 0.00 57.07 54.19 3mz4 s TYR 174 Cb -0.13 -2.18 -0.01 0.00 0.35 0.00 0.00 41.96 39.98 3mz4 s TYR 174 CO 0.02 -0.36 -0.14 0.08 -1.34 0.00 0.00 175.55 173.81 3mz4 s VAL 175 N 1.45 2.91 -0.27 3.14 1.01 0.69 -1.01 120.40 128.31 3mz4 s VAL 175 Ca 0.05 -0.71 0.02 0.00 0.00 0.00 0.00 61.98 61.34 3mz4 s VAL 175 Cb -0.15 -2.21 0.07 0.00 0.00 0.00 0.00 36.38 34.10 3mz4 s VAL 175 CO 0.02 0.53 -0.02 -0.62 0.00 0.00 0.00 175.10 175.01 3mz4 s ASP 176 N 0.38 4.19 -0.14 3.32 -1.08 0.17 -0.35 116.67 123.15 3mz4 s ASP 176 Ca -0.12 -1.51 0.16 0.00 -0.52 0.00 0.00 52.55 50.57 3mz4 s ASP 176 Cb -0.16 -1.30 0.63 0.00 -1.46 0.00 0.00 42.92 40.63 3mz4 s ASP 176 CO 0.06 -0.29 1.54 0.18 0.52 0.00 0.00 175.17 177.18 3mz4 n LEU 177 N 4.56 4.43 -4.72 -1.34 4.77 -0.36 -2.11 117.00 122.22 3mz4 n LEU 177 Ca -0.07 -2.62 -0.34 0.00 -0.03 0.00 0.00 56.01 52.94 3mz4 n LEU 177 Cb 0.43 -0.54 0.09 0.00 -2.33 0.00 0.00 43.42 41.07 3mz4 n LEU 177 CO 0.18 0.73 0.81 -0.62 -1.33 0.00 0.00 177.39 177.16 3mz4 s ASP 178 N -1.19 4.29 0.42 -1.43 2.15 -1.26 -4.63 116.67 115.03 3mz4 s ASP 178 Ca 0.45 2.37 0.20 0.00 0.43 0.00 0.00 52.55 56.00 3mz4 s ASP 178 Cb 0.32 -2.59 1.16 0.00 -0.30 0.00 0.00 42.92 41.50 3mz4 s ASP 178 CO 0.18 -2.20 1.79 0.25 -0.17 0.00 0.00 175.17 175.02 3mz4 h LEU 179 N -0.18 0.38 -9.85 -1.34 5.85 -1.84 -3.40 115.31 104.93 3mz4 h LEU 179 Ca -0.48 0.07 -0.62 0.00 0.84 0.00 0.00 57.88 57.68 3mz4 h LEU 179 Cb 1.30 0.00 -0.05 0.00 0.37 0.00 0.00 40.66 42.29 3mz4 h LEU 179 CO 0.50 0.09 -0.46 -1.00 -0.34 0.00 0.00 178.44 177.23 3mz4 s HIS 180 N -5.41 3.54 0.08 1.25 3.76 -1.26 -0.53 115.29 116.72 3mz4 s HIS 180 Ca -0.08 0.37 -0.35 0.00 -0.15 0.00 0.00 55.06 54.86 3mz4 s HIS 180 Cb 0.25 -1.85 -0.14 0.00 1.11 0.00 0.00 32.58 31.95 3mz4 s HIS 180 CO 0.80 0.60 1.60 1.58 -0.85 0.00 0.00 174.74 178.47 3mz4 n HIS 181 N 0.65 2.15 -0.99 1.40 -0.00 -1.26 -4.83 115.22 112.34 3mz4 n HIS 181 Ca -0.08 0.29 -0.30 0.00 0.46 0.00 0.00 57.72 58.09 3mz4 n HIS 181 Cb 0.52 -2.53 -0.02 0.00 -0.12 0.00 0.00 29.99 27.84 3mz4 n HIS 181 CO 0.00 0.00 0.00 0.41 0.46 0.00 0.00 176.34 177.21 3mz4 n GLY 182 N 3.49 3.40 0.30 1.57 0.00 -1.26 -4.69 105.19 108.00 3mz4 n GLY 182 Ca 0.19 -1.11 -0.08 0.00 0.00 0.00 0.00 46.02 45.02 3mz4 n GLY 182 CO 0.00 0.00 0.00 1.29 0.00 0.00 0.00 173.32 174.61 3mz4 h ASP 183 N 6.18 1.00 -0.46 1.61 -0.00 -1.90 -1.43 116.42 121.42 3mz4 h ASP 183 Ca 0.58 -0.29 0.00 0.00 -0.00 0.00 0.00 57.03 57.32 3mz4 h ASP 183 Cb 0.29 -0.27 -0.02 0.00 -0.00 0.00 0.00 39.33 39.32 3mz4 h ASP 183 CO 1.62 1.07 0.30 1.23 -0.00 0.00 0.00 179.24 183.46 3mz4 h GLY 184 N 0.98 0.65 0.82 7.15 0.00 -1.41 0.12 103.07 111.38 3mz4 h GLY 184 Ca 0.16 -0.25 -0.15 0.00 0.00 0.00 0.00 47.33 47.09 3mz4 h GLY 184 CO 0.03 0.24 -0.56 -2.08 0.00 0.00 0.00 176.54 174.18 3mz4 h VAL 185 N 0.62 1.40 -0.70 4.60 2.07 -1.42 -2.32 116.25 120.50 3mz4 h VAL 185 Ca 0.17 -1.97 0.06 0.00 0.82 0.00 0.00 66.70 65.78 3mz4 h VAL 185 Cb -0.06 2.43 -0.06 0.00 -1.52 0.00 0.00 31.29 32.09 3mz4 h VAL 185 CO -0.04 0.58 0.40 -0.08 0.02 0.00 0.00 177.57 178.46 3mz4 h GLU 186 N -0.02 0.72 -0.45 1.57 4.81 -1.14 -2.86 114.58 117.21 3mz4 h GLU 186 Ca -0.06 -0.04 -0.13 0.00 -0.13 0.00 0.00 59.36 59.00 3mz4 h GLU 186 Cb 1.24 -0.16 -0.01 0.00 0.63 0.00 0.00 28.75 30.45 3mz4 h GLU 186 CO 0.11 0.47 -0.23 -0.44 -0.73 0.00 0.00 179.01 178.20 3mz4 h ASP 187 N 0.74 0.96 -0.61 1.04 3.32 -0.70 -0.20 116.42 120.98 3mz4 h ASP 187 Ca 0.31 -0.36 0.03 0.00 0.02 0.00 0.00 57.03 57.03 3mz4 h ASP 187 Cb 0.18 -0.26 -0.03 0.00 0.22 0.00 0.00 39.33 39.43 3mz4 h ASP 187 CO -0.18 1.14 0.40 0.00 -1.72 0.00 0.00 179.24 178.88 3mz4 h ALA 188 N 0.93 1.67 -0.43 3.45 0.00 -1.20 -2.78 119.26 120.90 3mz4 h ALA 188 Ca 0.10 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.98 3mz4 h ALA 188 Cb 0.79 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 18.38 3mz4 h ALA 188 CO 0.07 0.26 0.00 1.19 0.00 0.00 0.00 179.25 180.77 3mz4 n PHE 189 N -4.46 0.81 0.23 0.00 3.01 -0.86 -4.75 117.46 111.44 3mz4 n PHE 189 Ca 0.07 -0.60 0.07 0.00 1.01 0.00 0.00 57.45 58.00 3mz4 n PHE 189 Cb 0.13 -0.12 0.58 0.00 -0.01 0.00 0.00 39.48 40.06 3mz4 n PHE 189 CO 0.00 0.00 0.00 1.03 1.01 0.00 0.00 176.76 178.80 3mz4 h SER 190 N 2.61 0.02 -0.45 4.37 0.87 -0.76 -1.79 113.55 118.43 3mz4 h SER 190 Ca 0.00 -0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.56 3mz4 h SER 190 Cb 1.04 -0.01 0.00 0.00 -0.44 0.00 0.00 62.40 62.99 3mz4 h SER 190 CO 0.09 0.09 0.00 0.49 -0.53 0.00 0.00 176.83 176.96 3mz4 n PHE 191 N -4.46 0.58 -4.40 2.24 3.72 -1.26 -2.11 117.46 111.78 3mz4 n PHE 191 Ca -0.03 -0.29 -0.29 0.00 -0.05 0.00 0.00 57.45 56.79 3mz4 n PHE 191 Cb 0.15 0.00 -0.12 0.00 -0.94 0.00 0.00 39.48 38.56 3mz4 n PHE 191 CO 0.00 0.00 0.00 -0.08 -0.05 0.00 0.00 176.76 176.63 3mz4 s THR 192 N -1.42 2.53 -2.28 4.37 -1.32 -0.67 -2.75 115.64 114.10 3mz4 s THR 192 Ca 0.40 -1.60 0.22 0.00 -1.21 0.00 0.00 61.69 59.49 3mz4 s THR 192 Cb 0.22 -2.13 0.41 0.00 -1.51 0.00 0.00 72.50 69.49 3mz4 s THR 192 CO 0.30 0.13 1.36 -1.54 -2.21 0.00 0.00 174.62 172.66 3mz4 n SER 193 N 0.95 3.38 0.10 8.08 3.41 -1.26 -4.30 113.62 123.99 3mz4 n SER 193 Ca -0.17 -1.96 0.12 0.00 -0.26 0.00 0.00 58.87 56.60 3mz4 n SER 193 Cb 0.53 -0.25 0.23 0.00 -0.26 0.00 0.00 64.21 64.46 3mz4 n SER 193 CO 0.00 0.00 0.00 0.11 -0.16 0.00 0.00 175.04 174.99 3mz4 h LYS 194 N 4.18 0.00 -3.95 4.33 1.79 -1.93 -3.43 116.57 117.56 3mz4 h LYS 194 Ca 0.00 0.00 -0.44 0.00 -2.18 0.00 0.00 60.65 58.03 3mz4 h LYS 194 Cb 0.94 0.00 -0.36 0.00 -1.58 0.00 0.00 32.23 31.23 3mz4 h LYS 194 CO 0.00 0.00 -0.78 0.08 -1.08 0.00 0.00 179.45 177.67 3mz4 s VAL 195 N -3.17 0.56 -0.19 0.50 1.01 -1.26 -2.14 120.40 115.71 3mz4 s VAL 195 Ca 0.07 -0.07 -0.08 0.00 0.00 0.00 0.00 61.98 61.90 3mz4 s VAL 195 Cb 0.11 -0.63 -0.04 0.00 0.00 0.00 0.00 36.38 35.82 3mz4 s VAL 195 CO 0.68 0.26 0.08 -0.32 0.00 0.00 0.00 175.10 175.80 3mz4 s MET 196 N 1.41 4.01 -0.10 2.72 1.75 -0.64 -4.87 119.30 123.59 3mz4 s MET 196 Ca -0.03 -0.32 -0.03 0.00 -1.25 0.00 0.00 55.69 54.06 3mz4 s MET 196 Cb -0.13 -3.28 -0.03 0.00 2.84 0.00 0.00 34.83 34.22 3mz4 s MET 196 CO -0.03 0.25 0.01 0.95 -0.65 0.00 0.00 175.02 175.55 3mz4 s THR 197 N 0.46 4.42 -0.10 10.11 -4.23 -0.88 -0.73 115.64 124.68 3mz4 s THR 197 Ca 0.04 -0.20 -0.00 0.00 -1.18 0.00 0.00 61.69 60.35 3mz4 s THR 197 Cb -0.12 -2.87 0.02 0.00 1.34 0.00 0.00 72.50 70.87 3mz4 s THR 197 CO 0.00 0.59 -0.06 -0.69 -0.54 0.00 0.00 174.62 173.93 3mz4 s VAL 198 N -0.76 0.87 -0.10 2.29 1.01 -0.18 0.38 120.40 123.91 3mz4 s VAL 198 Ca 0.12 -0.20 0.03 0.00 0.00 0.00 0.00 61.98 61.93 3mz4 s VAL 198 Cb -0.12 -0.91 0.01 0.00 0.00 0.00 0.00 36.38 35.36 3mz4 s VAL 198 CO 0.02 0.34 -0.18 -0.55 0.00 0.00 0.00 175.10 174.73 3mz4 s SER 199 N 1.69 2.55 -0.15 3.32 0.15 -0.26 -0.65 113.70 120.35 3mz4 s SER 199 Ca 0.04 -0.46 -0.05 0.00 0.70 0.00 0.00 55.95 56.18 3mz4 s SER 199 Cb -0.13 -1.16 -0.04 0.00 -1.71 0.00 0.00 66.02 62.99 3mz4 s SER 199 CO -0.07 0.08 0.03 -0.76 1.20 0.00 0.00 173.24 173.71 3mz4 s LEU 200 N 0.67 3.64 0.03 3.45 1.02 -0.90 -0.33 118.68 126.26 3mz4 s LEU 200 Ca -0.13 0.06 -0.27 0.00 0.02 0.00 0.00 54.13 53.80 3mz4 s LEU 200 Cb -0.16 -1.89 0.09 0.00 0.02 0.00 0.00 46.19 44.25 3mz4 s LEU 200 CO 0.03 0.23 0.80 -1.38 0.02 0.00 0.00 176.35 176.05 3mz4 s HIS 201 N 0.05 -0.42 0.20 0.29 -3.43 -0.91 -4.38 115.29 106.69 3mz4 s HIS 201 Ca 0.04 0.31 -0.31 0.00 -0.80 0.00 0.00 55.06 54.30 3mz4 s HIS 201 Cb -0.13 0.53 -0.10 0.00 -1.43 0.00 0.00 32.58 31.46 3mz4 s HIS 201 CO 0.01 -0.62 1.45 0.21 -2.00 0.00 0.00 174.74 173.79 3mz4 s LYS 202 N -3.10 4.28 -0.20 -0.38 2.20 0.31 -1.20 119.74 121.66 3mz4 s LYS 202 Ca 0.03 2.25 -0.02 0.00 -0.36 0.00 0.00 55.97 57.86 3mz4 s LYS 202 Cb -0.01 -3.16 0.06 0.00 -1.51 0.00 0.00 37.83 33.22 3mz4 s LYS 202 CO -0.09 -0.45 0.03 0.12 -0.36 0.00 0.00 175.35 174.60 3mz4 s PHE 203 N 0.49 1.16 0.04 4.03 2.19 -0.69 -4.64 117.98 120.56 3mz4 s PHE 203 Ca 0.63 -0.96 -0.23 0.00 0.33 0.00 0.00 56.93 56.69 3mz4 s PHE 203 Cb -0.41 -1.10 0.05 0.00 -1.31 0.00 0.00 43.02 40.26 3mz4 s PHE 203 CO 0.37 -0.64 0.54 0.45 1.83 0.00 0.00 175.22 177.78 3mz4 s SER 204 N 1.81 -0.47 0.19 6.13 0.15 -1.26 -4.65 113.70 115.59 3mz4 s SER 204 Ca -0.01 0.24 -0.31 0.00 0.70 0.00 0.00 55.95 56.57 3mz4 s SER 204 Cb -0.17 0.50 -0.09 0.00 -1.71 0.00 0.00 66.02 64.55 3mz4 s SER 204 CO -0.09 -0.71 1.43 -2.84 1.20 0.00 0.00 173.24 172.24 3mz4 s PRO 205 N -2.33 4.29 0.00 5.44 0.02 -1.26 -1.41 135.00 139.75 3mz4 s PRO 205 Ca -0.06 2.21 0.00 0.00 0.02 0.00 0.00 61.00 63.18 3mz4 s PRO 205 Cb -0.01 -3.17 0.00 0.00 0.02 0.00 0.00 34.50 31.34 3mz4 s PRO 205 CO -0.01 -0.44 0.00 0.41 -0.33 0.00 0.00 177.00 176.63 3mz4 n GLY 206 N 2.93 1.11 3.65 0.52 0.00 -1.26 -5.03 105.19 107.11 3mz4 n GLY 206 Ca 0.10 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.74 3mz4 n GLY 206 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 3mz4 s PHE 207 N -3.10 3.31 0.38 1.61 5.36 -0.50 -5.03 117.98 120.01 3mz4 s PHE 207 Ca 0.00 0.41 -0.27 0.00 -0.96 0.00 0.00 56.93 56.11 3mz4 s PHE 207 Cb 0.00 -2.45 -0.11 0.00 -0.34 0.00 0.00 43.02 40.12 3mz4 s PHE 207 CO 0.00 -0.05 1.39 0.34 -1.46 0.00 0.00 175.22 175.44 3mz4 n PHE 208 N 4.66 2.62 1.24 10.12 -0.00 -1.26 -2.11 117.46 132.74 3mz4 n PHE 208 Ca -0.11 0.49 0.13 0.00 -0.00 0.00 0.00 57.45 57.96 3mz4 n PHE 208 Cb 0.51 -2.47 0.32 0.00 -0.00 0.00 0.00 39.48 37.85 3mz4 n PHE 208 CO 0.00 0.00 0.00 -0.35 -0.00 0.00 0.00 176.76 176.41 3mz4 n PRO 209 N 0.36 1.14 0.00 -7.13 -0.04 -1.26 -4.57 135.00 123.50 3mz4 n PRO 209 Ca 0.03 -0.75 0.00 0.00 -0.04 0.00 0.00 63.50 62.74 3mz4 n PRO 209 Cb 0.38 -1.48 0.00 0.00 -0.04 0.00 0.00 33.50 32.36 3mz4 n PRO 209 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 3mz4 n GLY 210 N 1.32 0.42 3.89 0.55 0.00 -0.89 -5.06 105.19 105.41 3mz4 n GLY 210 Ca 0.13 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.91 3mz4 n GLY 210 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3mz4 s THR 211 N -2.00 1.98 0.00 2.61 -4.23 -1.26 -4.83 115.64 107.90 3mz4 s THR 211 Ca 0.00 -1.45 0.00 0.00 -1.18 0.00 0.00 61.69 59.06 3mz4 s THR 211 Cb 0.00 -2.43 0.00 0.00 1.34 0.00 0.00 72.50 71.41 3mz4 s THR 211 CO 0.00 0.00 0.00 0.61 -0.54 0.00 0.00 174.62 174.69 3mz4 n GLY 212 N -1.68 1.02 3.75 3.99 0.00 -1.26 -4.81 105.19 106.19 3mz4 n GLY 212 Ca 0.01 -0.42 -0.31 0.00 0.00 0.00 0.00 46.02 45.30 3mz4 n GLY 212 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3mz4 s ASP 213 N -2.56 4.14 0.57 1.61 3.68 -1.26 -4.26 116.67 118.58 3mz4 s ASP 213 Ca 0.00 1.82 0.27 0.00 2.13 0.00 0.00 52.55 56.77 3mz4 s ASP 213 Cb 0.00 -2.48 1.52 0.00 -1.45 0.00 0.00 42.92 40.51 3mz4 s ASP 213 CO 0.00 -2.27 2.03 1.62 0.13 0.00 0.00 175.17 176.68 3mz4 h VAL 214 N -1.29 0.55 0.00 1.11 3.04 -1.96 -0.08 116.25 117.62 3mz4 h VAL 214 Ca -0.44 0.00 0.00 0.00 -1.01 0.00 0.00 66.70 65.25 3mz4 h VAL 214 Cb 1.24 0.77 0.00 0.00 -2.01 0.00 0.00 31.29 31.29 3mz4 h VAL 214 CO 0.50 0.00 0.00 -1.54 -1.01 0.00 0.00 177.57 175.52 3mz4 n SER 215 N -3.99 0.00 -4.54 3.17 3.41 -1.26 -4.62 113.62 105.79 3mz4 n SER 215 Ca 0.05 0.10 -0.43 0.00 -0.26 0.00 0.00 58.87 58.34 3mz4 n SER 215 Cb 0.47 -0.34 -0.04 0.00 -0.26 0.00 0.00 64.21 64.04 3mz4 n SER 215 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 3mz4 s ASP 216 N -2.68 6.38 0.00 4.04 2.15 -0.05 -4.84 116.67 121.67 3mz4 s ASP 216 Ca 0.18 -0.21 0.00 0.00 0.43 0.00 0.00 52.55 52.95 3mz4 s ASP 216 Cb 0.15 -2.46 0.00 0.00 -0.30 0.00 0.00 42.92 40.31 3mz4 s ASP 216 CO 0.35 -1.26 0.84 1.33 -0.17 0.00 0.00 175.17 176.26 3mz4 n VAL 217 N 6.31 0.70 -0.65 1.11 0.24 -1.26 -4.12 118.33 120.66 3mz4 n VAL 217 Ca 0.04 -0.79 0.00 0.00 -2.04 0.00 0.00 64.34 61.55 3mz4 n VAL 217 Cb 0.48 0.68 0.00 0.00 -1.47 0.00 0.00 33.84 33.53 3mz4 n VAL 217 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3mz4 n GLY 218 N -0.35 -2.87 3.02 7.63 0.00 -1.26 0.03 105.19 111.39 3mz4 n GLY 218 Ca 0.00 -1.80 -0.10 0.00 0.00 0.00 0.00 46.02 44.12 3mz4 n GLY 218 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3mz4 s LEU 219 N 0.00 1.98 0.00 0.99 1.43 -0.90 -4.41 118.68 117.77 3mz4 s LEU 219 Ca 0.00 -0.36 0.00 0.00 -1.03 0.00 0.00 54.13 52.74 3mz4 s LEU 219 Cb 0.00 0.30 0.00 0.00 0.03 0.00 0.00 46.19 46.52 3mz4 s LEU 219 CO 0.00 -0.30 0.00 0.61 0.23 0.00 0.00 176.35 176.89 3mz4 n GLY 220 N 1.65 3.16 0.11 -3.19 0.00 -1.26 -0.17 105.19 105.49 3mz4 n GLY 220 Ca -0.23 -0.15 0.08 0.00 0.00 0.00 0.00 46.02 45.72 3mz4 n GLY 220 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3mz4 n LYS 221 N 14.00 0.10 -0.09 1.61 5.02 -1.25 -1.23 118.16 136.32 3mz4 n LYS 221 Ca 0.00 0.57 0.12 0.00 -2.02 0.00 0.00 58.31 56.98 3mz4 n LYS 221 Cb 0.00 -1.82 0.26 0.00 -0.02 0.00 0.00 35.03 33.45 3mz4 n LYS 221 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3mz4 n GLY 222 N -1.19 0.98 3.73 0.72 0.00 0.76 -4.00 105.19 106.19 3mz4 n GLY 222 Ca -0.01 -0.61 -0.42 0.00 0.00 0.00 0.00 46.02 44.98 3mz4 n GLY 222 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 3mz4 s ARG 223 N -1.76 4.12 0.00 1.61 3.52 -0.37 -1.10 118.95 124.97 3mz4 s ARG 223 Ca 0.34 2.61 0.00 0.00 -0.13 0.00 0.00 55.73 58.56 3mz4 s ARG 223 Cb 0.21 -3.06 0.00 0.00 -1.56 0.00 0.00 34.95 30.54 3mz4 s ARG 223 CO 0.30 -0.73 0.00 0.66 -0.81 0.00 0.00 175.30 174.72 3mz4 n TYR 224 N 3.53 0.00 -0.48 5.12 4.02 0.10 -4.89 117.16 124.57 3mz4 n TYR 224 Ca 0.14 0.00 0.11 0.00 -0.01 0.00 0.00 57.90 58.14 3mz4 n TYR 224 Cb 0.36 -0.09 0.33 0.00 -0.02 0.00 0.00 39.34 39.92 3mz4 n TYR 224 CO 0.00 0.00 0.00 0.66 -1.01 0.00 0.00 176.86 176.51 3mz4 n TYR 225 N -2.00 1.18 -5.17 -0.72 4.02 -0.26 -4.78 117.16 109.42 3mz4 n TYR 225 Ca 0.00 -0.55 -0.30 0.00 -0.01 0.00 0.00 57.90 57.05 3mz4 n TYR 225 Cb 0.00 -0.10 -0.16 0.00 -0.02 0.00 0.00 39.34 39.06 3mz4 n TYR 225 CO 0.00 0.00 0.00 -1.12 -1.01 0.00 0.00 176.86 174.73 3mz4 s SER 226 N -0.97 2.81 -0.06 7.72 0.01 -0.96 -2.08 113.70 120.17 3mz4 s SER 226 Ca 0.49 -0.45 0.03 0.00 1.31 0.00 0.00 55.95 57.33 3mz4 s SER 226 Cb 0.28 -0.50 0.01 0.00 0.21 0.00 0.00 66.02 66.03 3mz4 s SER 226 CO 0.29 0.26 -0.13 -0.69 0.41 0.00 0.00 173.24 173.39 3mz4 s VAL 227 N -0.38 1.15 -0.05 3.43 1.01 0.16 -4.20 120.40 121.53 3mz4 s VAL 227 Ca 0.04 -0.50 0.02 0.00 0.00 0.00 0.00 61.98 61.54 3mz4 s VAL 227 Cb -0.11 -1.04 0.01 0.00 0.00 0.00 0.00 36.38 35.24 3mz4 s VAL 227 CO 0.01 0.36 -0.10 0.20 0.00 0.00 0.00 175.10 175.57 3mz4 s ASN 228 N 0.56 1.44 -0.35 3.32 0.01 -1.26 -1.10 114.94 117.56 3mz4 s ASN 228 Ca -0.13 -0.23 0.02 0.00 -0.71 0.00 0.00 52.86 51.82 3mz4 s ASN 228 Cb -0.15 -0.59 0.10 0.00 0.41 0.00 0.00 41.25 41.02 3mz4 s ASN 228 CO 0.03 0.03 0.07 -0.69 -1.51 0.00 0.00 177.10 175.04 3mz4 s VAL 229 N 0.56 2.49 0.11 1.60 1.01 0.55 -4.15 120.40 122.57 3mz4 s VAL 229 Ca -0.10 -2.24 -0.30 0.00 0.00 0.00 0.00 61.98 59.33 3mz4 s VAL 229 Cb -0.13 -2.79 -0.06 0.00 0.00 0.00 0.00 36.38 33.40 3mz4 s VAL 229 CO 0.02 -0.59 1.00 -2.16 0.00 0.00 0.00 175.10 173.37 3mz4 s PRO 230 N 0.96 4.65 0.04 2.72 0.04 -1.26 -2.14 135.00 140.01 3mz4 s PRO 230 Ca 0.09 1.51 0.03 0.00 0.04 0.00 0.00 61.00 62.67 3mz4 s PRO 230 Cb -0.20 -3.37 -0.02 0.00 0.04 0.00 0.00 34.50 30.95 3mz4 s PRO 230 CO -0.07 0.14 -0.09 0.42 0.04 0.00 0.00 177.00 177.44 3mz4 s ILE 231 N 0.13 0.63 0.40 0.56 1.01 -0.34 -4.88 121.20 118.70 3mz4 s ILE 231 Ca 0.49 -1.01 0.06 0.00 0.00 0.00 0.00 60.65 60.19 3mz4 s ILE 231 Cb -0.24 -0.66 0.00 0.00 0.01 0.00 0.00 42.46 41.57 3mz4 s ILE 231 CO 0.30 -0.28 0.55 -1.10 0.00 0.00 0.00 174.94 174.41 3mz4 s GLN 232 N -1.41 2.95 0.28 2.79 -1.52 -1.26 -1.70 119.66 119.79 3mz4 s GLN 232 Ca -0.07 -1.06 -0.26 0.00 -1.95 0.00 0.00 55.36 52.02 3mz4 s GLN 232 Cb -0.09 -2.75 -0.15 0.00 -0.22 0.00 0.00 33.01 29.80 3mz4 s GLN 232 CO 0.01 -0.16 0.62 -0.25 -0.25 0.00 0.00 175.29 175.26 3mz4 n ASP 233 N -1.81 -0.62 0.00 5.90 8.00 -1.26 -3.54 116.55 123.22 3mz4 n ASP 233 Ca 0.04 1.08 0.00 0.00 0.71 0.00 0.00 54.79 56.62 3mz4 n ASP 233 Cb 0.59 -1.07 0.00 0.00 -0.02 0.00 0.00 41.12 40.62 3mz4 n ASP 233 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3mz4 n GLY 234 N 1.77 0.61 3.73 0.44 0.00 0.32 -1.14 105.19 110.93 3mz4 n GLY 234 Ca 0.14 -0.10 -0.42 0.00 0.00 0.00 0.00 46.02 45.64 3mz4 n GLY 234 CO 0.00 0.00 0.00 4.51 0.00 0.00 0.00 173.32 177.83 3mz4 n ILE 235 N -2.75 1.02 -4.23 -0.61 0.13 -1.23 -4.11 119.36 107.58 3mz4 n ILE 235 Ca 0.00 -0.26 -0.27 0.00 -1.10 0.00 0.00 62.75 61.12 3mz4 n ILE 235 Cb 0.00 -1.88 -0.06 0.00 -0.84 0.00 0.00 39.64 36.86 3mz4 n ILE 235 CO 0.00 0.00 0.00 -1.10 2.80 0.00 0.00 176.55 178.25 3mz4 s GLN 236 N -0.51 2.21 0.23 9.51 -0.21 -1.26 -0.64 119.66 128.99 3mz4 s GLN 236 Ca 0.65 -2.03 -0.06 0.00 0.02 0.00 0.00 55.36 53.93 3mz4 s GLN 236 Cb -0.52 -1.89 0.35 0.00 1.00 0.00 0.00 33.01 31.94 3mz4 s GLN 236 CO 0.49 -0.31 1.79 -0.44 -2.12 0.00 0.00 175.29 174.71 3mz4 h ASP 237 N 1.24 0.55 0.17 5.90 3.32 -1.94 -2.04 116.42 123.62 3mz4 h ASP 237 Ca -0.41 0.05 -0.01 0.00 0.02 0.00 0.00 57.03 56.68 3mz4 h ASP 237 Cb 1.28 -0.05 0.00 0.00 0.22 0.00 0.00 39.33 40.78 3mz4 h ASP 237 CO 0.68 0.32 -0.08 -0.08 -1.72 0.00 0.00 179.24 178.36 3mz4 h GLU 238 N 0.68 -0.22 -0.16 3.56 4.81 -1.97 -1.83 114.58 119.46 3mz4 h GLU 238 Ca 0.36 0.02 -0.13 0.00 -0.13 0.00 0.00 59.36 59.48 3mz4 h GLU 238 Cb 0.34 0.05 -0.01 0.00 0.63 0.00 0.00 28.75 29.76 3mz4 h GLU 238 CO -0.25 0.03 -0.44 -0.22 -0.73 0.00 0.00 179.01 177.39 3mz4 h LYS 239 N -0.45 0.38 -0.03 1.92 3.64 -1.96 -1.79 116.57 118.28 3mz4 h LYS 239 Ca -0.02 -0.20 -0.00 0.00 -1.27 0.00 0.00 60.65 59.16 3mz4 h LYS 239 Cb 0.35 0.01 -0.00 0.00 -0.41 0.00 0.00 32.23 32.17 3mz4 h LYS 239 CO 0.04 0.76 0.01 -0.92 -2.27 0.00 0.00 179.45 177.07 3mz4 h TYR 240 N 0.31 0.04 -0.62 1.91 5.03 -1.33 -0.67 116.97 121.64 3mz4 h TYR 240 Ca 0.02 -0.00 -0.05 0.00 2.58 0.00 0.00 58.73 61.29 3mz4 h TYR 240 Cb 0.91 -0.01 -0.03 0.00 1.55 0.00 0.00 36.73 39.15 3mz4 h TYR 240 CO 0.03 0.14 0.21 -0.92 -1.32 0.00 0.00 178.16 176.30 3mz4 h TYR 241 N -0.07 0.99 -0.38 -3.82 5.03 -1.25 0.62 116.97 118.09 3mz4 h TYR 241 Ca 0.01 -0.09 0.08 0.00 2.58 0.00 0.00 58.73 61.31 3mz4 h TYR 241 Cb 0.11 -0.29 -0.09 0.00 1.55 0.00 0.00 36.73 38.02 3mz4 h TYR 241 CO -0.04 0.80 -0.23 1.96 -1.32 0.00 0.00 178.16 179.33 3mz4 h GLN 242 N 0.89 -0.16 0.23 1.82 4.20 -1.09 0.42 115.11 121.42 3mz4 h GLN 242 Ca 0.20 0.01 0.01 0.00 0.06 0.00 0.00 58.65 58.93 3mz4 h GLN 242 Cb 0.26 0.04 -0.02 0.00 0.30 0.00 0.00 27.48 28.06 3mz4 h GLN 242 CO -0.01 -0.11 -0.26 0.82 -0.67 0.00 0.00 178.83 178.60 3mz4 h ILE 243 N -0.17 0.44 -0.70 2.54 2.04 -0.86 -2.09 117.51 118.70 3mz4 h ILE 243 Ca 0.18 0.00 -0.02 0.00 1.00 0.00 0.00 64.86 66.02 3mz4 h ILE 243 Cb 0.46 0.44 -0.03 0.00 -0.74 0.00 0.00 36.82 36.94 3mz4 h ILE 243 CO -0.48 0.00 0.35 0.00 0.00 0.00 0.00 178.15 178.02 3mz4 h GLU 245 N 0.97 0.35 -0.63 0.00 4.22 -0.16 -0.41 114.58 118.92 3mz4 h GLU 245 Ca 0.24 -0.07 0.05 0.00 0.08 0.00 0.00 59.36 59.66 3mz4 h GLU 245 Cb 0.10 -0.05 -0.05 0.00 0.50 0.00 0.00 28.75 29.25 3mz4 h GLU 245 CO -0.03 0.41 0.35 1.03 -2.18 0.00 0.00 179.01 178.59 3mz4 h SER 246 N 0.22 0.54 -0.09 1.04 0.87 -1.12 -1.00 113.55 114.00 3mz4 h SER 246 Ca 0.08 0.02 -0.06 0.00 -1.23 0.00 0.00 61.79 60.60 3mz4 h SER 246 Cb 0.20 -0.08 0.00 0.00 -0.44 0.00 0.00 62.40 62.07 3mz4 h SER 246 CO -0.00 0.36 -0.18 0.58 -0.53 0.00 0.00 176.83 177.05 3mz4 h VAL 247 N 0.67 1.40 -0.22 2.23 2.07 -1.16 -2.98 116.25 118.25 3mz4 h VAL 247 Ca 0.27 -1.48 -0.10 0.00 0.82 0.00 0.00 66.70 66.21 3mz4 h VAL 247 Cb 0.14 2.14 -0.01 0.00 -1.52 0.00 0.00 31.29 32.04 3mz4 h VAL 247 CO -0.16 0.42 -0.30 -0.07 0.02 0.00 0.00 177.57 177.49 3mz4 h LEU 248 N -0.17 0.45 -0.35 2.57 3.38 -0.97 0.14 115.31 120.36 3mz4 h LEU 248 Ca 0.00 -0.16 0.03 0.00 0.09 0.00 0.00 57.88 57.84 3mz4 h LEU 248 Cb 0.77 -0.12 -0.03 0.00 0.09 0.00 0.00 40.66 41.37 3mz4 h LEU 248 CO 0.04 0.73 0.17 0.50 0.09 0.00 0.00 178.44 179.98 3mz4 h LYS 249 N 0.39 0.34 -0.26 1.13 3.64 -1.18 -0.92 116.57 119.71 3mz4 h LYS 249 Ca 0.05 -0.02 -0.15 0.00 -1.27 0.00 0.00 60.65 59.27 3mz4 h LYS 249 Cb 0.72 -0.08 -0.01 0.00 -0.41 0.00 0.00 32.23 32.45 3mz4 h LYS 249 CO 0.06 0.23 -0.44 0.93 -2.27 0.00 0.00 179.45 177.96 3mz4 h GLU 250 N 0.35 0.64 -0.30 1.90 5.08 -1.28 -2.81 114.58 118.16 3mz4 h GLU 250 Ca 0.15 -0.35 -0.01 0.00 -1.00 0.00 0.00 59.36 58.16 3mz4 h GLU 250 Cb 0.06 0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.31 3mz4 h GLU 250 CO -0.11 0.95 0.17 0.28 -1.00 0.00 0.00 179.01 179.30 3mz4 h VAL 251 N 0.52 1.13 -0.61 3.13 2.07 -0.80 -1.27 116.25 120.41 3mz4 h VAL 251 Ca 0.04 -0.34 -0.06 0.00 0.82 0.00 0.00 66.70 67.16 3mz4 h VAL 251 Cb 0.97 0.80 -0.03 0.00 -1.52 0.00 0.00 31.29 31.51 3mz4 h VAL 251 CO 0.09 0.13 0.16 0.22 0.02 0.00 0.00 177.57 178.19 3mz4 h TYR 252 N 0.37 1.01 -0.32 1.57 3.20 -1.15 0.26 116.97 121.92 3mz4 h TYR 252 Ca 0.11 -0.11 -0.05 0.00 3.14 0.00 0.00 58.73 61.81 3mz4 h TYR 252 Cb 0.06 -0.29 -0.01 0.00 1.54 0.00 0.00 36.73 38.03 3mz4 h TYR 252 CO -0.03 0.85 0.00 0.37 -1.64 0.00 0.00 178.16 177.71 3mz4 h GLN 253 N 0.89 0.56 -0.04 1.82 4.15 -1.43 -1.67 115.11 119.39 3mz4 h GLN 253 Ca 0.19 -0.18 -0.13 0.00 0.77 0.00 0.00 58.65 59.30 3mz4 h GLN 253 Cb 0.33 -0.05 0.01 0.00 0.21 0.00 0.00 27.48 27.98 3mz4 h GLN 253 CO -0.00 0.69 -0.50 0.00 -1.93 0.00 0.00 178.83 177.10 3mz4 h ALA 254 N 0.85 0.12 0.00 3.38 0.00 -0.97 -3.38 119.26 119.25 3mz4 h ALA 254 Ca 0.09 -0.52 -0.17 0.00 0.00 0.00 0.00 54.91 54.31 3mz4 h ALA 254 Cb 0.44 0.01 -0.03 0.00 0.00 0.00 0.00 17.79 18.21 3mz4 h ALA 254 CO 0.02 0.31 -2.02 0.34 0.00 0.00 0.00 179.25 177.89 3mz4 n PHE 255 N -4.28 0.18 -3.66 0.00 7.35 0.89 -4.15 117.46 113.79 3mz4 n PHE 255 Ca -0.09 0.06 -0.26 0.00 -0.76 0.00 0.00 57.45 56.40 3mz4 n PHE 255 Cb 0.61 -0.79 0.04 0.00 0.35 0.00 0.00 39.48 39.68 3mz4 n PHE 255 CO 0.00 0.00 0.00 -1.71 -0.76 0.00 0.00 176.76 174.29 3mz4 n ASN 256 N -2.55 -3.86 -4.75 -2.13 4.05 -0.63 -4.89 115.26 100.50 3mz4 n ASN 256 Ca -0.16 -0.92 -0.36 0.00 0.45 0.00 0.00 54.58 53.59 3mz4 n ASN 256 Cb 0.83 -3.77 0.04 0.00 1.23 0.00 0.00 39.78 38.11 3mz4 n ASN 256 CO 0.00 0.00 0.00 -2.16 -3.05 0.00 0.00 177.26 172.05 3mz4 s PRO 257 N -5.82 2.95 -0.00 1.20 0.04 -1.26 -4.89 135.00 127.21 3mz4 s PRO 257 Ca 0.30 1.88 0.16 0.00 0.04 0.00 0.00 61.00 63.38 3mz4 s PRO 257 Cb -0.09 -1.95 -0.19 0.00 0.04 0.00 0.00 34.50 32.31 3mz4 s PRO 257 CO 0.83 -1.24 0.63 1.63 0.04 0.00 0.00 177.00 178.90 3mz4 n LYS 258 N -1.56 1.48 -3.57 4.56 4.76 0.18 -5.00 118.16 119.01 3mz4 n LYS 258 Ca 0.14 -0.02 -0.11 0.00 -2.87 0.00 0.00 58.31 55.44 3mz4 n LYS 258 Cb 0.49 -1.28 -0.04 0.00 -1.84 0.00 0.00 35.03 32.36 3mz4 n LYS 258 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 3mz4 s ALA 259 N -2.63 -1.16 -0.03 7.82 0.00 -1.08 -4.29 121.76 120.39 3mz4 s ALA 259 Ca 0.04 0.12 0.03 0.00 0.00 0.00 0.00 51.96 52.16 3mz4 s ALA 259 Cb 0.12 0.78 -0.00 0.00 0.00 0.00 0.00 23.12 24.01 3mz4 s ALA 259 CO 0.67 -0.70 -0.12 0.08 0.00 0.00 0.00 175.76 175.68 3mz4 s VAL 260 N -3.79 1.03 -0.15 0.00 1.01 0.80 -1.09 120.40 118.20 3mz4 s VAL 260 Ca 0.03 -0.50 0.01 0.00 0.00 0.00 0.00 61.98 61.51 3mz4 s VAL 260 Cb 0.01 -0.89 -0.00 0.00 0.00 0.00 0.00 36.38 35.49 3mz4 s VAL 260 CO -0.12 0.31 -0.17 -0.69 0.00 0.00 0.00 175.10 174.43 3mz4 s VAL 261 N 0.06 2.56 -0.14 2.92 1.01 0.30 -0.31 120.40 126.81 3mz4 s VAL 261 Ca -0.02 -0.81 0.01 0.00 0.00 0.00 0.00 61.98 61.15 3mz4 s VAL 261 Cb -0.09 -2.06 0.02 0.00 0.00 0.00 0.00 36.38 34.25 3mz4 s VAL 261 CO 0.01 0.52 -0.14 -0.22 0.00 0.00 0.00 175.10 175.27 3mz4 s LEU 262 N 0.75 1.66 -0.22 3.92 2.96 0.30 -0.23 118.68 127.83 3mz4 s LEU 262 Ca -0.07 -0.46 -0.07 0.00 -0.22 0.00 0.00 54.13 53.31 3mz4 s LEU 262 Cb -0.16 -1.13 -0.03 0.00 0.50 0.00 0.00 46.19 45.37 3mz4 s LEU 262 CO 0.01 -0.04 0.06 -1.58 -1.32 0.00 0.00 176.35 173.48 3mz4 s GLN 263 N 1.36 3.77 -0.32 1.98 -0.44 0.52 -0.51 119.66 126.02 3mz4 s GLN 263 Ca 0.02 -0.43 0.09 0.00 -2.50 0.00 0.00 55.36 52.54 3mz4 s GLN 263 Cb -0.13 -3.27 0.46 0.00 -1.64 0.00 0.00 33.01 28.43 3mz4 s GLN 263 CO -0.08 0.00 1.15 1.28 0.50 0.00 0.00 175.29 178.14 3mz4 n LEU 264 N 4.35 4.23 -4.60 3.68 4.77 -0.52 -1.23 117.00 127.69 3mz4 n LEU 264 Ca -0.16 -4.57 -0.58 0.00 -0.03 0.00 0.00 56.01 50.66 3mz4 n LEU 264 Cb 0.52 -0.22 -0.08 0.00 -2.33 0.00 0.00 43.42 41.32 3mz4 n LEU 264 CO 0.33 1.97 0.87 0.61 -1.33 0.00 0.00 177.39 179.83 3mz4 n GLY 265 N -0.60 0.17 1.28 -0.72 0.00 -1.23 -4.69 105.19 99.40 3mz4 n GLY 265 Ca 0.36 0.81 0.05 0.00 0.00 0.00 0.00 46.02 47.23 3mz4 n GLY 265 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3mz4 n ALA 266 N 2.73 3.19 1.75 4.61 0.00 -0.05 -4.17 120.51 128.57 3mz4 n ALA 266 Ca 0.22 -1.12 0.03 0.00 0.00 0.00 0.00 53.44 52.57 3mz4 n ALA 266 Cb 0.10 -1.06 0.17 0.00 0.00 0.00 0.00 19.45 18.66 3mz4 n ALA 266 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 3mz4 n ASP 267 N 0.48 0.00 0.10 0.00 5.68 -1.24 -2.02 116.55 119.55 3mz4 n ASP 267 Ca 0.17 -1.57 0.12 0.00 -0.50 0.00 0.00 54.79 53.01 3mz4 n ASP 267 Cb 0.76 0.00 0.05 0.00 -1.14 0.00 0.00 41.12 40.79 3mz4 n ASP 267 CO 0.00 0.00 0.00 0.71 -1.33 0.00 0.00 177.20 176.58 3mz4 h THR 268 N 0.00 0.00 -3.54 2.12 1.35 -1.89 -3.43 112.91 107.52 3mz4 h THR 268 Ca 0.00 -0.85 -0.52 0.00 -0.55 0.00 0.00 66.41 64.49 3mz4 h THR 268 Cb 0.00 1.38 0.00 0.00 -1.73 0.00 0.00 68.15 67.80 3mz4 h THR 268 CO 0.00 0.00 0.47 -0.63 -0.25 0.00 0.00 175.52 175.11 3mz4 s ILE 269 N -3.30 3.95 0.08 6.82 -1.09 -0.86 -2.25 121.20 124.55 3mz4 s ILE 269 Ca 0.02 1.65 -0.37 0.00 -2.23 0.00 0.00 60.65 59.72 3mz4 s ILE 269 Cb 0.10 -4.05 -0.17 0.00 -1.58 0.00 0.00 42.46 36.76 3mz4 s ILE 269 CO 0.77 0.27 1.22 0.00 -1.23 0.00 0.00 174.94 175.97 3mz4 n ALA 270 N 2.53 -1.69 -0.08 9.38 0.00 0.52 -1.87 120.51 129.30 3mz4 n ALA 270 Ca 0.03 0.53 0.00 0.00 0.00 0.00 0.00 53.44 54.00 3mz4 n ALA 270 Cb 0.46 -1.97 0.00 0.00 0.00 0.00 0.00 19.45 17.94 3mz4 n ALA 270 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3mz4 n GLY 271 N 2.16 0.54 3.76 0.00 0.00 -1.26 -4.95 105.19 105.44 3mz4 n GLY 271 Ca 0.18 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.81 3mz4 n GLY 271 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3mz4 s ASP 272 N -2.99 7.36 0.61 1.61 2.15 -0.78 -4.69 116.67 119.93 3mz4 s ASP 272 Ca 0.00 2.04 0.30 0.00 0.43 0.00 0.00 52.55 55.32 3mz4 s ASP 272 Cb 0.00 -2.61 1.64 0.00 -0.30 0.00 0.00 42.92 41.65 3mz4 s ASP 272 CO 0.00 -0.06 2.02 -0.65 -0.17 0.00 0.00 175.17 176.31 3mz4 h PRO 273 N 3.65 0.00 0.00 4.34 0.11 -1.92 0.12 132.00 138.30 3mz4 h PRO 273 Ca -0.46 0.00 -0.00 0.00 0.11 0.00 0.00 66.00 65.65 3mz4 h PRO 273 Cb 1.20 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.31 3mz4 h PRO 273 CO 0.66 0.00 -0.00 0.52 -0.21 0.00 0.00 178.00 178.97 3mz4 h MET 274 N 0.00 0.00 -6.03 1.05 2.86 -1.91 -3.46 114.93 107.43 3mz4 h MET 274 Ca 0.11 0.00 -0.43 0.00 -2.06 0.00 0.00 59.70 57.32 3mz4 h MET 274 Cb 0.71 0.00 0.07 0.00 0.06 0.00 0.00 31.60 32.44 3mz4 h MET 274 CO -0.00 0.00 -0.72 0.00 1.06 0.00 0.00 176.91 177.25 3mz4 n SER 276 N -2.95 0.23 -4.65 0.00 7.64 -1.26 -4.97 113.62 107.65 3mz4 n SER 276 Ca -0.01 0.03 -0.26 0.00 1.01 0.00 0.00 58.87 59.64 3mz4 n SER 276 Cb 0.56 -0.07 0.11 0.00 -1.01 0.00 0.00 64.21 63.80 3mz4 n SER 276 CO 0.00 0.00 0.00 -0.36 -3.01 0.00 0.00 175.04 171.67 3mz4 s PHE 277 N -1.21 2.14 -0.35 1.43 2.99 -1.26 -0.52 117.98 121.20 3mz4 s PHE 277 Ca 0.00 0.15 0.15 0.00 0.00 0.00 0.00 56.93 57.22 3mz4 s PHE 277 Cb 0.00 -3.34 0.45 0.00 0.00 0.00 0.00 43.02 40.13 3mz4 s PHE 277 CO 0.00 -1.79 1.00 -1.71 -0.00 0.00 0.00 175.22 172.72 3mz4 n ASN 278 N -3.07 2.35 -4.92 1.36 5.15 0.18 -4.34 115.26 111.97 3mz4 n ASN 278 Ca 0.12 -2.95 -0.26 0.00 -0.60 0.00 0.00 54.58 50.89 3mz4 n ASN 278 Cb 0.60 -0.51 -0.02 0.00 -0.53 0.00 0.00 39.78 39.33 3mz4 n ASN 278 CO 0.00 0.00 0.00 -0.04 1.40 0.00 0.00 177.26 178.62 3mz4 s MET 279 N -3.28 3.55 0.36 1.20 -1.94 -0.95 -4.36 119.30 113.89 3mz4 s MET 279 Ca 0.33 -0.12 0.09 0.00 -1.71 0.00 0.00 55.69 54.27 3mz4 s MET 279 Cb 0.44 -2.62 -0.06 0.00 2.01 0.00 0.00 34.83 34.60 3mz4 s MET 279 CO -0.02 0.12 -0.02 0.95 -0.01 0.00 0.00 175.02 176.04 3mz4 s THR 280 N -2.28 2.30 0.58 2.05 -4.23 -1.26 -0.35 115.64 112.44 3mz4 s THR 280 Ca 0.43 -2.06 0.30 0.00 -1.18 0.00 0.00 61.69 59.18 3mz4 s THR 280 Cb -0.10 -2.79 0.35 0.00 1.34 0.00 0.00 72.50 71.31 3mz4 s THR 280 CO 0.35 -0.15 2.25 -0.65 -0.54 0.00 0.00 174.62 175.88 3mz4 h PRO 281 N 1.87 0.00 -0.55 3.99 0.11 -1.93 -1.67 132.00 133.81 3mz4 h PRO 281 Ca -0.43 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.68 3mz4 h PRO 281 Cb 1.25 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 32.33 3mz4 h PRO 281 CO 0.72 0.01 0.35 0.28 -0.21 0.00 0.00 178.00 179.15 3mz4 h VAL 282 N 0.00 1.15 -0.13 3.15 2.07 -1.96 0.27 116.25 120.80 3mz4 h VAL 282 Ca -0.00 -0.31 -0.01 0.00 0.82 0.00 0.00 66.70 67.19 3mz4 h VAL 282 Cb 0.04 0.37 -0.01 0.00 -1.52 0.00 0.00 31.29 30.17 3mz4 h VAL 282 CO 0.00 0.15 0.03 1.23 0.02 0.00 0.00 177.57 179.00 3mz4 h GLY 283 N 0.75 0.22 0.71 2.17 0.00 -1.63 -1.90 103.07 103.39 3mz4 h GLY 283 Ca 0.20 -0.14 0.05 0.00 0.00 0.00 0.00 47.33 47.44 3mz4 h GLY 283 CO -0.04 0.13 0.36 -2.22 0.00 0.00 0.00 176.54 174.77 3mz4 h ILE 284 N -0.01 0.98 -0.30 2.60 1.08 -1.47 -2.76 117.51 117.64 3mz4 h ILE 284 Ca 0.04 -0.23 0.02 0.00 -0.39 0.00 0.00 64.86 64.29 3mz4 h ILE 284 Cb 0.27 0.25 -0.02 0.00 -3.07 0.00 0.00 36.82 34.26 3mz4 h ILE 284 CO 0.00 0.12 0.20 1.23 -0.69 0.00 0.00 178.15 179.01 3mz4 h GLY 285 N 0.68 0.37 1.41 5.37 0.00 -0.02 -0.82 103.07 110.06 3mz4 h GLY 285 Ca 0.28 -0.14 -0.10 0.00 0.00 0.00 0.00 47.33 47.38 3mz4 h GLY 285 CO -0.17 0.13 -0.20 0.50 0.00 0.00 0.00 176.54 176.80 3mz4 h LYS 286 N 0.35 0.68 -0.45 4.80 1.57 -1.07 0.01 116.57 122.46 3mz4 h LYS 286 Ca 0.12 -0.26 -0.09 0.00 -1.87 0.00 0.00 60.65 58.55 3mz4 h LYS 286 Cb 0.04 -0.04 -0.01 0.00 0.08 0.00 0.00 32.23 32.30 3mz4 h LYS 286 CO -0.03 0.83 -0.08 0.00 -0.57 0.00 0.00 179.45 179.61 3mz4 h LEU 288 N 0.67 0.77 -0.77 0.00 5.85 -0.92 -2.72 115.31 118.19 3mz4 h LEU 288 Ca 0.12 -0.09 -0.02 0.00 0.84 0.00 0.00 57.88 58.72 3mz4 h LEU 288 Cb 0.61 -0.19 -0.04 0.00 0.37 0.00 0.00 40.66 41.41 3mz4 h LEU 288 CO 0.04 0.64 0.41 0.11 -0.34 0.00 0.00 178.44 179.30 3mz4 h LYS 289 N 0.83 1.08 -0.89 1.25 1.57 -0.84 0.36 116.57 119.92 3mz4 h LYS 289 Ca 0.22 -0.13 0.07 0.00 -1.87 0.00 0.00 60.65 58.93 3mz4 h LYS 289 Cb 0.04 -0.21 -0.06 0.00 0.08 0.00 0.00 32.23 32.09 3mz4 h LYS 289 CO -0.03 0.81 0.58 -0.92 -0.57 0.00 0.00 179.45 179.32 3mz4 h TYR 290 N 1.07 1.02 0.09 -1.35 3.20 -1.06 -1.05 116.97 118.89 3mz4 h TYR 290 Ca 0.27 0.03 -0.24 0.00 3.14 0.00 0.00 58.73 61.93 3mz4 h TYR 290 Cb 0.06 -0.34 0.02 0.00 1.54 0.00 0.00 36.73 38.01 3mz4 h TYR 290 CO 0.00 0.53 -0.98 0.82 -1.64 0.00 0.00 178.16 176.89 3mz4 h ILE 291 N 1.00 1.37 -0.03 1.81 2.04 -1.08 -3.23 117.51 119.38 3mz4 h ILE 291 Ca 0.39 -2.37 -0.03 0.00 1.00 0.00 0.00 64.86 63.85 3mz4 h ILE 291 Cb 0.23 2.77 -0.01 0.00 -0.74 0.00 0.00 36.82 39.07 3mz4 h ILE 291 CO -0.15 0.70 -0.14 -0.07 0.00 0.00 0.00 178.15 178.49 3mz4 h LEU 292 N 0.03 0.04 -2.08 1.44 3.38 -0.55 -2.40 115.31 115.17 3mz4 h LEU 292 Ca -0.15 -0.01 -0.01 0.00 0.09 0.00 0.00 57.88 57.81 3mz4 h LEU 292 Cb 1.69 -0.01 -0.00 0.00 0.09 0.00 0.00 40.66 42.43 3mz4 h LEU 292 CO 0.19 0.19 -0.05 0.06 0.09 0.00 0.00 178.44 178.92 3mz4 h GLN 293 N 0.05 0.00 0.00 1.13 -0.00 -1.22 -1.16 115.11 113.91 3mz4 h GLN 293 Ca 0.01 0.00 -0.02 0.00 -0.00 0.00 0.00 58.65 58.64 3mz4 h GLN 293 Cb 0.28 0.00 -0.00 0.00 -0.00 0.00 0.00 27.48 27.76 3mz4 h GLN 293 CO 0.02 0.05 -0.08 -1.49 -0.00 0.00 0.00 178.83 177.33 3mz4 h TRP 294 N 0.00 0.00 -5.48 0.06 6.55 -1.53 -3.47 115.95 112.08 3mz4 h TRP 294 Ca -0.00 0.00 -0.37 0.00 0.95 0.00 0.00 58.89 59.47 3mz4 h TRP 294 Cb 0.30 0.00 0.13 0.00 -0.86 0.00 0.00 29.16 28.73 3mz4 h TRP 294 CO 0.00 0.08 -0.63 1.04 -1.05 0.00 0.00 178.44 177.88 3mz4 n GLN 295 N -3.53 -7.37 -3.96 0.49 6.02 -0.44 -5.02 117.38 103.58 3mz4 n GLN 295 Ca -0.02 0.77 -0.26 0.00 -0.01 0.00 0.00 57.00 57.48 3mz4 n GLN 295 Cb 0.21 -5.63 -0.03 0.00 1.02 0.00 0.00 30.24 25.81 3mz4 n GLN 295 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 3mz4 s LEU 296 N -6.82 4.30 -0.23 1.08 1.43 -1.26 -5.06 118.68 112.13 3mz4 s LEU 296 Ca 0.53 0.14 -0.40 0.00 -1.03 0.00 0.00 54.13 53.37 3mz4 s LEU 296 Cb -0.23 -2.87 -0.16 0.00 0.03 0.00 0.00 46.19 42.95 3mz4 s LEU 296 CO 0.67 0.04 1.68 0.00 0.23 0.00 0.00 176.35 178.97 3mz4 n ALA 297 N -0.62 -0.37 -3.67 4.21 0.00 -1.26 -4.80 120.51 114.00 3mz4 n ALA 297 Ca -0.07 0.41 -0.22 0.00 0.00 0.00 0.00 53.44 53.56 3mz4 n ALA 297 Cb 0.54 -2.19 -0.17 0.00 0.00 0.00 0.00 19.45 17.64 3mz4 n ALA 297 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 3mz4 s THR 298 N 3.05 0.62 -0.29 0.00 2.01 0.33 -0.14 115.64 121.21 3mz4 s THR 298 Ca 0.96 -0.13 -0.08 0.00 0.31 0.00 0.00 61.69 62.76 3mz4 s THR 298 Cb -1.07 -0.66 -0.01 0.00 0.01 0.00 0.00 72.50 70.77 3mz4 s THR 298 CO 0.63 0.26 0.11 -0.22 -0.69 0.00 0.00 174.62 174.72 3mz4 s LEU 299 N 1.21 3.90 -0.19 4.42 0.20 0.57 -1.66 118.68 127.14 3mz4 s LEU 299 Ca -0.06 -0.52 -0.14 0.00 0.69 0.00 0.00 54.13 54.09 3mz4 s LEU 299 Cb -0.14 -1.95 -0.04 0.00 -0.43 0.00 0.00 46.19 43.63 3mz4 s LEU 299 CO -0.02 -0.16 0.32 -0.63 -0.29 0.00 0.00 176.35 175.57 3mz4 s ILE 300 N 1.58 5.27 0.13 6.68 -1.09 -0.08 -0.54 121.20 133.14 3mz4 s ILE 300 Ca 0.04 0.56 0.09 0.00 -2.23 0.00 0.00 60.65 59.11 3mz4 s ILE 300 Cb -0.17 -3.65 -0.04 0.00 -1.58 0.00 0.00 42.46 37.02 3mz4 s ILE 300 CO 0.04 0.33 -0.21 -0.76 -1.23 0.00 0.00 174.94 173.11 3mz4 s LEU 301 N 0.89 2.35 0.00 2.97 1.43 0.33 -0.53 118.68 126.10 3mz4 s LEU 301 Ca 0.16 -0.75 0.00 0.00 -1.03 0.00 0.00 54.13 52.51 3mz4 s LEU 301 Cb -0.14 -0.94 0.00 0.00 0.03 0.00 0.00 46.19 45.15 3mz4 s LEU 301 CO 0.06 0.06 0.00 0.61 0.23 0.00 0.00 176.35 177.30 3mz4 n GLY 302 N 0.81 1.01 0.00 -3.19 0.00 -1.10 -1.44 105.19 101.28 3mz4 n GLY 302 Ca -0.17 -0.92 0.00 0.00 0.00 0.00 0.00 46.02 44.93 3mz4 n GLY 302 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3mz4 n GLY 303 N 5.00 -0.20 3.47 -0.02 0.00 -1.01 -3.27 105.19 109.15 3mz4 n GLY 303 Ca 0.00 -0.60 -0.28 0.00 0.00 0.00 0.00 46.02 45.14 3mz4 n GLY 303 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3mz4 s GLY 304 N 0.00 1.52 0.00 -0.02 0.00 -1.26 -4.77 107.32 102.80 3mz4 s GLY 304 Ca 0.00 -0.25 0.00 0.00 0.00 0.00 0.00 44.72 44.47 3mz4 s GLY 304 CO 0.00 0.52 0.00 0.61 0.00 0.00 0.00 173.10 174.23 3mz4 n GLY 305 N 0.83 2.96 0.00 0.20 0.00 -1.26 -0.87 105.19 107.04 3mz4 n GLY 305 Ca 0.03 -0.32 0.00 0.00 0.00 0.00 0.00 46.02 45.74 3mz4 n GLY 305 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 3mz4 n TYR 306 N 0.00 0.00 -3.02 1.61 4.02 -1.26 -4.69 117.16 113.82 3mz4 n TYR 306 Ca 0.00 0.00 -0.44 0.00 -0.01 0.00 0.00 57.90 57.45 3mz4 n TYR 306 Cb 0.00 0.00 -0.05 0.00 -0.02 0.00 0.00 39.34 39.27 3mz4 n TYR 306 CO 0.00 0.00 0.00 1.21 -1.01 0.00 0.00 176.86 177.06 3mz4 s ASN 307 N -0.64 6.20 0.12 7.72 3.84 -1.26 -4.72 114.94 126.21 3mz4 s ASN 307 Ca 0.00 -1.11 -0.14 0.00 0.21 0.00 0.00 52.86 51.82 3mz4 s ASN 307 Cb 0.00 -2.35 -0.03 0.00 -0.55 0.00 0.00 41.25 38.32 3mz4 s ASN 307 CO 0.00 -1.18 1.52 -0.07 -2.79 0.00 0.00 177.10 174.58 3mz4 h LEU 308 N 10.42 0.77 -0.44 3.21 3.38 -1.96 -0.39 115.31 130.30 3mz4 h LEU 308 Ca -0.29 -0.37 -0.02 0.00 0.09 0.00 0.00 57.88 57.29 3mz4 h LEU 308 Cb 1.08 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 41.60 3mz4 h LEU 308 CO 1.10 0.96 0.19 0.00 0.09 0.00 0.00 178.44 180.78 3mz4 h ALA 309 N 0.83 0.57 -0.73 1.53 0.00 -1.92 -0.80 119.26 118.74 3mz4 h ALA 309 Ca 0.10 -0.13 -0.01 0.00 0.00 0.00 0.00 54.91 54.87 3mz4 h ALA 309 Cb 0.63 -0.17 -0.04 0.00 0.00 0.00 0.00 17.79 18.22 3mz4 h ALA 309 CO 0.04 0.16 0.43 -0.91 0.00 0.00 0.00 179.25 178.97 3mz4 h ASN 310 N 0.56 0.87 -0.65 0.00 4.21 -1.81 0.23 115.58 118.99 3mz4 h ASN 310 Ca 0.15 -0.05 -0.06 0.00 1.21 0.00 0.00 56.30 57.55 3mz4 h ASN 310 Cb 0.17 -0.22 -0.03 0.00 -1.12 0.00 0.00 38.32 37.12 3mz4 h ASN 310 CO -0.01 0.68 0.17 0.74 -1.29 0.00 0.00 177.43 177.72 3mz4 h THR 311 N 1.00 1.25 -0.32 2.81 2.02 -0.81 -0.69 112.91 118.19 3mz4 h THR 311 Ca 0.26 -0.91 -0.02 0.00 0.77 0.00 0.00 66.41 66.51 3mz4 h THR 311 Cb -0.03 0.61 -0.01 0.00 -1.74 0.00 0.00 68.15 66.97 3mz4 h THR 311 CO -0.05 0.35 0.11 0.00 0.37 0.00 0.00 175.52 176.30 3mz4 h ALA 312 N 1.07 0.41 -0.81 6.16 0.00 -0.55 -1.59 119.26 123.95 3mz4 h ALA 312 Ca 0.21 -0.14 0.11 0.00 0.00 0.00 0.00 54.91 55.08 3mz4 h ALA 312 Cb 0.34 -0.12 -0.08 0.00 0.00 0.00 0.00 17.79 17.93 3mz4 h ALA 312 CO -0.00 0.04 0.45 0.00 0.00 0.00 0.00 179.25 179.73 3mz4 h ARG 313 N 0.36 0.70 0.01 0.00 3.08 -0.29 -1.57 114.38 116.66 3mz4 h ARG 313 Ca 0.10 -0.04 -0.00 0.00 0.07 0.00 0.00 59.98 60.11 3mz4 h ARG 313 Cb 0.22 -0.16 0.00 0.00 0.08 0.00 0.00 29.97 30.11 3mz4 h ARG 313 CO -0.01 0.46 -0.00 0.00 -1.07 0.00 0.00 179.97 179.36 3mz4 h TRP 315 N -0.43 0.07 -0.05 0.00 6.55 -1.24 0.11 115.95 120.95 3mz4 h TRP 315 Ca -0.00 -0.03 -0.01 0.00 0.95 0.00 0.00 58.89 59.80 3mz4 h TRP 315 Cb 0.42 -0.01 -0.00 0.00 -0.86 0.00 0.00 29.16 28.71 3mz4 h TRP 315 CO 0.07 0.70 0.01 1.15 -1.05 0.00 0.00 178.44 179.33 3mz4 h THR 316 N 0.03 1.20 -0.46 1.49 2.02 -1.30 0.18 112.91 116.07 3mz4 h THR 316 Ca -0.01 -0.60 0.07 0.00 0.77 0.00 0.00 66.41 66.64 3mz4 h THR 316 Cb 1.19 1.50 -0.06 0.00 -1.74 0.00 0.00 68.15 69.04 3mz4 h THR 316 CO 0.09 0.16 0.12 0.22 0.37 0.00 0.00 175.52 176.48 3mz4 h TYR 317 N -0.14 0.20 -0.25 3.16 3.20 -0.91 -1.27 116.97 120.96 3mz4 h TYR 317 Ca 0.02 0.03 -0.04 0.00 3.14 0.00 0.00 58.73 61.87 3mz4 h TYR 317 Cb 0.25 -0.02 -0.01 0.00 1.54 0.00 0.00 36.73 38.49 3mz4 h TYR 317 CO 0.01 0.04 -0.02 -0.07 -1.64 0.00 0.00 178.16 176.48 3mz4 h LEU 318 N 0.26 0.34 -1.18 2.82 3.38 -0.71 0.83 115.31 121.06 3mz4 h LEU 318 Ca 0.22 -0.06 -0.05 0.00 0.09 0.00 0.00 57.88 58.09 3mz4 h LEU 318 Cb 0.26 -0.09 -0.02 0.00 0.09 0.00 0.00 40.66 40.91 3mz4 h LEU 318 CO -0.27 0.42 0.02 0.74 0.09 0.00 0.00 178.44 179.45 3mz4 h THR 319 N 0.36 1.20 -0.68 0.22 2.02 0.03 -1.27 112.91 114.80 3mz4 h THR 319 Ca 0.08 -0.80 -0.05 0.00 0.77 0.00 0.00 66.41 66.41 3mz4 h THR 319 Cb 0.28 0.90 -0.03 0.00 -1.74 0.00 0.00 68.15 67.55 3mz4 h THR 319 CO 0.01 0.28 0.21 1.23 0.37 0.00 0.00 175.52 177.62 3mz4 h GLY 320 N 0.86 1.11 0.86 2.16 0.00 0.20 -1.91 103.07 106.36 3mz4 h GLY 320 Ca 0.12 -0.64 -0.01 0.00 0.00 0.00 0.00 47.33 46.80 3mz4 h GLY 320 CO 0.01 0.60 0.04 -2.08 0.00 0.00 0.00 176.54 175.11 3mz4 h VAL 321 N 1.00 1.16 -0.77 4.60 2.07 -0.53 0.41 116.25 124.19 3mz4 h VAL 321 Ca 0.22 -0.47 0.13 0.00 0.82 0.00 0.00 66.70 67.40 3mz4 h VAL 321 Cb 0.28 1.27 -0.05 0.00 -1.52 0.00 0.00 31.29 31.27 3mz4 h VAL 321 CO -0.01 0.14 0.51 0.40 0.02 0.00 0.00 177.57 178.63 3mz4 h ILE 322 N 0.01 0.84 0.00 4.57 2.04 -0.91 -0.48 117.51 123.57 3mz4 h ILE 322 Ca 0.04 -0.18 0.00 0.00 1.00 0.00 0.00 64.86 65.72 3mz4 h ILE 322 Cb 0.18 0.27 0.00 0.00 -0.74 0.00 0.00 36.82 36.54 3mz4 h ILE 322 CO -0.00 0.10 -0.69 0.18 0.00 0.00 0.00 178.15 177.74 3mz4 n LEU 323 N -4.50 0.67 -1.86 1.44 4.77 -0.75 -4.97 117.00 111.81 3mz4 n LEU 323 Ca 0.14 -0.17 -0.10 0.00 -0.03 0.00 0.00 56.01 55.86 3mz4 n LEU 323 Cb 0.46 -0.16 0.03 0.00 -2.33 0.00 0.00 43.42 41.43 3mz4 n LEU 323 CO 0.32 0.16 0.10 0.61 -1.33 0.00 0.00 177.39 177.25 3mz4 n GLY 324 N 1.50 0.27 3.31 -0.72 0.00 0.12 -5.05 105.19 104.62 3mz4 n GLY 324 Ca 0.05 -0.27 -0.31 0.00 0.00 0.00 0.00 46.02 45.49 3mz4 n GLY 324 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3mz4 s LYS 325 N -5.37 2.09 -0.17 1.61 -0.14 0.23 -5.02 119.74 112.97 3mz4 s LYS 325 Ca 0.20 -0.94 -0.22 0.00 -1.36 0.00 0.00 55.97 53.66 3mz4 s LYS 325 Cb -0.09 -2.04 -0.03 0.00 -1.68 0.00 0.00 37.83 34.00 3mz4 s LYS 325 CO 0.31 0.56 0.65 0.99 -0.76 0.00 0.00 175.35 177.10 3mz4 s THR 326 N -0.62 5.02 0.15 2.17 2.01 -1.26 -4.41 115.64 118.69 3mz4 s THR 326 Ca 0.10 1.27 -0.08 0.00 0.31 0.00 0.00 61.69 63.29 3mz4 s THR 326 Cb -0.10 -3.97 -0.06 0.00 0.01 0.00 0.00 72.50 68.37 3mz4 s THR 326 CO -0.01 0.14 0.44 -0.76 -0.69 0.00 0.00 174.62 173.73 3mz4 s LEU 327 N 1.68 4.27 0.32 4.42 1.43 -1.26 -5.05 118.68 124.48 3mz4 s LEU 327 Ca 0.31 0.76 -0.29 0.00 -1.03 0.00 0.00 54.13 53.88 3mz4 s LEU 327 Cb -0.16 -3.31 -0.10 0.00 0.03 0.00 0.00 46.19 42.65 3mz4 s LEU 327 CO 0.12 0.06 1.30 -0.55 0.23 0.00 0.00 176.35 177.50 3mz4 s SER 328 N -2.18 6.81 0.43 2.29 0.15 -1.26 -4.91 113.70 115.02 3mz4 s SER 328 Ca 0.40 2.65 0.15 0.00 0.70 0.00 0.00 55.95 59.85 3mz4 s SER 328 Cb -0.13 -2.65 1.04 0.00 -1.71 0.00 0.00 66.02 62.58 3mz4 s SER 328 CO 0.21 -0.51 1.94 -1.28 1.20 0.00 0.00 173.24 174.80 3mz4 h SER 329 N 3.55 0.39 -3.36 5.45 0.87 -1.98 -3.43 113.55 115.04 3mz4 h SER 329 Ca -0.48 0.02 -0.56 0.00 -1.23 0.00 0.00 61.79 59.54 3mz4 h SER 329 Cb 1.22 -0.06 -0.04 0.00 -0.44 0.00 0.00 62.40 63.08 3mz4 h SER 329 CO 0.66 0.21 0.27 -1.61 -0.53 0.00 0.00 176.83 175.84 3mz4 s GLU 330 N -5.41 4.45 -0.05 2.24 2.02 -1.26 -0.83 118.70 119.85 3mz4 s GLU 330 Ca -0.08 1.12 -0.30 0.00 0.02 0.00 0.00 54.97 55.73 3mz4 s GLU 330 Cb 0.21 -3.48 -0.05 0.00 0.10 0.00 0.00 34.13 30.90 3mz4 s GLU 330 CO 0.76 -0.07 1.61 0.42 0.02 0.00 0.00 175.26 178.00 3mz4 s ILE 331 N 1.20 3.61 0.58 -1.63 -1.09 -0.16 -4.88 121.20 118.82 3mz4 s ILE 331 Ca 0.43 0.77 -0.19 0.00 -2.23 0.00 0.00 60.65 59.43 3mz4 s ILE 331 Cb -0.19 -3.50 -0.04 0.00 -1.58 0.00 0.00 42.46 37.15 3mz4 s ILE 331 CO 0.20 -0.06 1.19 -2.84 -1.23 0.00 0.00 174.94 172.20 3mz4 s PRO 332 N 3.84 3.10 0.31 2.79 0.02 -1.26 -4.96 135.00 138.84 3mz4 s PRO 332 Ca 0.72 1.78 -0.29 0.00 0.02 0.00 0.00 61.00 63.22 3mz4 s PRO 332 Cb -0.33 -1.97 -0.12 0.00 0.02 0.00 0.00 34.50 32.11 3mz4 s PRO 332 CO 0.28 -1.09 1.46 -3.47 -0.33 0.00 0.00 177.00 173.86 3mz4 n ASP 333 N -1.47 3.36 -3.36 2.53 2.03 -1.26 -4.82 116.55 113.56 3mz4 n ASP 333 Ca 0.13 1.18 -0.03 0.00 0.52 0.00 0.00 54.79 56.59 3mz4 n ASP 333 Cb 0.50 -1.54 0.02 0.00 -0.72 0.00 0.00 41.12 39.38 3mz4 n ASP 333 CO 0.00 0.00 0.00 -1.38 -1.92 0.00 0.00 177.20 173.90 3mz4 s HIS 334 N -0.48 0.08 0.37 -0.67 -3.43 -1.26 -4.97 115.29 104.93 3mz4 s HIS 334 Ca 0.61 -0.48 0.19 0.00 -0.80 0.00 0.00 55.06 54.58 3mz4 s HIS 334 Cb -0.54 0.70 1.24 0.00 -1.43 0.00 0.00 32.58 32.55 3mz4 s HIS 334 CO 0.55 -0.90 1.62 1.49 -2.00 0.00 0.00 174.74 175.50 3mz4 h GLU 335 N 2.00 0.15 -0.24 -0.38 4.81 -1.93 -1.53 114.58 117.47 3mz4 h GLU 335 Ca -0.27 -0.01 -0.05 0.00 -0.13 0.00 0.00 59.36 58.90 3mz4 h GLU 335 Cb 1.21 -0.03 -0.03 0.00 0.63 0.00 0.00 28.75 30.53 3mz4 h GLU 335 CO 0.37 0.10 -0.03 1.19 -0.73 0.00 0.00 179.01 179.91 3mz4 n PHE 336 N -5.09 0.81 -0.32 0.92 3.72 -1.26 -4.79 117.46 111.45 3mz4 n PHE 336 Ca 0.35 -1.09 0.17 0.00 -0.05 0.00 0.00 57.45 56.83 3mz4 n PHE 336 Cb 1.17 -0.33 0.35 0.00 -0.94 0.00 0.00 39.48 39.73 3mz4 n PHE 336 CO 0.00 0.00 0.00 0.35 -0.05 0.00 0.00 176.76 177.06 3mz4 h PHE 337 N 1.28 0.33 0.00 1.38 3.04 -1.59 -0.67 116.94 120.72 3mz4 h PHE 337 Ca 0.06 0.05 -0.04 0.00 3.98 0.00 0.00 57.97 62.02 3mz4 h PHE 337 Cb 1.42 0.01 -0.01 0.00 2.56 0.00 0.00 35.95 39.93 3mz4 h PHE 337 CO 0.55 -0.32 -0.19 1.79 -2.02 0.00 0.00 178.31 178.12 3mz4 h THR 338 N 0.12 0.82 0.00 4.41 1.35 -1.87 -2.14 112.91 115.61 3mz4 h THR 338 Ca 0.63 -0.75 0.00 0.00 -0.55 0.00 0.00 66.41 65.73 3mz4 h THR 338 Cb 1.37 1.45 0.00 0.00 -1.73 0.00 0.00 68.15 69.23 3mz4 h THR 338 CO -0.76 0.19 0.06 0.00 -0.25 0.00 0.00 175.52 174.77 3mz4 h ALA 339 N 1.81 1.06 -0.37 6.62 0.00 -1.51 -2.28 119.26 124.59 3mz4 h ALA 339 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 3mz4 h ALA 339 Cb 0.43 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.22 3mz4 h ALA 339 CO 0.03 -0.06 0.00 0.66 0.00 0.00 0.00 179.25 179.88 3mz4 n TYR 340 N -2.84 0.48 -1.74 0.00 4.02 -0.80 -4.84 117.16 111.43 3mz4 n TYR 340 Ca -0.02 -0.24 -0.30 0.00 -0.01 0.00 0.00 57.90 57.32 3mz4 n TYR 340 Cb 0.12 0.00 0.06 0.00 -0.02 0.00 0.00 39.34 39.50 3mz4 n TYR 340 CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 176.86 176.05 3mz4 s GLY 341 N -1.43 1.63 0.00 2.72 0.00 -0.86 -1.09 107.32 108.29 3mz4 s GLY 341 Ca 0.37 -0.23 0.28 0.00 0.00 0.00 0.00 44.72 45.14 3mz4 s GLY 341 CO 0.30 0.14 1.81 -1.55 0.00 0.00 0.00 173.10 173.80 3mz4 n PRO 342 N -3.13 0.90 -0.03 2.90 -0.04 -1.26 -4.79 135.00 129.55 3mz4 n PRO 342 Ca 0.07 -0.38 0.02 0.00 -0.04 0.00 0.00 63.50 63.17 3mz4 n PRO 342 Cb 0.56 -1.49 -0.10 0.00 -0.04 0.00 0.00 33.50 32.43 3mz4 n PRO 342 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 3mz4 n ASP 343 N -0.72 1.87 -3.42 3.54 8.00 -1.24 -5.02 116.55 119.56 3mz4 n ASP 343 Ca 0.16 0.00 -0.23 0.00 0.71 0.00 0.00 54.79 55.42 3mz4 n ASP 343 Cb 0.29 1.32 0.07 0.00 -0.02 0.00 0.00 41.12 42.78 3mz4 n ASP 343 CO 0.00 0.00 0.00 -1.22 -0.39 0.00 0.00 177.20 175.59 3mz4 n TYR 344 N -2.16 -2.67 -4.28 1.24 4.01 -0.25 -4.96 117.16 108.08 3mz4 n TYR 344 Ca -0.09 0.91 -0.25 0.00 -0.16 0.00 0.00 57.90 58.31 3mz4 n TYR 344 Cb 0.57 -4.86 -0.08 0.00 -0.31 0.00 0.00 39.34 34.66 3mz4 n TYR 344 CO 0.00 0.00 0.00 0.14 -0.46 0.00 0.00 176.86 176.54 3mz4 s VAL 345 N -3.29 3.38 0.11 -0.72 -7.23 -1.26 -0.99 120.40 110.40 3mz4 s VAL 345 Ca 0.53 -1.71 -0.06 0.00 -1.81 0.00 0.00 61.98 58.92 3mz4 s VAL 345 Cb -0.23 -2.73 -0.21 0.00 0.56 0.00 0.00 36.38 33.77 3mz4 s VAL 345 CO 0.65 -0.21 1.25 0.25 -0.31 0.00 0.00 175.10 176.73 3mz4 h LEU 346 N 2.49 0.60 -9.98 1.32 5.85 -1.28 -3.45 115.31 110.86 3mz4 h LEU 346 Ca -0.46 -0.50 -0.53 0.00 0.84 0.00 0.00 57.88 57.22 3mz4 h LEU 346 Cb 1.22 -0.18 0.10 0.00 0.37 0.00 0.00 40.66 42.17 3mz4 h LEU 346 CO 0.57 1.32 0.63 -1.61 -0.34 0.00 0.00 178.44 179.01 3mz4 s GLU 347 N -3.16 3.76 -0.11 1.25 8.01 -1.26 -4.88 118.70 122.30 3mz4 s GLU 347 Ca -0.06 2.23 0.00 0.00 0.01 0.00 0.00 54.97 57.15 3mz4 s GLU 347 Cb 0.08 -2.64 -0.02 0.00 -4.31 0.00 0.00 34.13 27.24 3mz4 s GLU 347 CO 0.88 -0.69 -0.11 0.42 0.01 0.00 0.00 175.26 175.77 3mz4 s ILE 348 N -1.26 3.26 -0.08 -1.63 1.01 -1.26 -5.11 121.20 116.12 3mz4 s ILE 348 Ca 0.60 -0.61 -0.16 0.00 0.00 0.00 0.00 60.65 60.48 3mz4 s ILE 348 Cb -0.40 -2.35 -0.05 0.00 0.01 0.00 0.00 42.46 39.67 3mz4 s ILE 348 CO 0.50 0.54 0.42 -0.89 0.00 0.00 0.00 174.94 175.52 3mz4 s THR 349 N -0.04 5.15 0.38 2.92 2.01 -1.26 -4.87 115.64 119.92 3mz4 s THR 349 Ca -0.02 0.85 -0.26 0.00 0.31 0.00 0.00 61.69 62.58 3mz4 s THR 349 Cb -0.14 -3.75 -0.11 0.00 0.01 0.00 0.00 72.50 68.50 3mz4 s THR 349 CO 0.04 0.42 1.05 -2.65 -0.69 0.00 0.00 174.62 172.78 3mz4 n PRO 350 N 3.04 1.46 -1.54 4.92 -0.02 -1.26 -4.87 135.00 136.72 3mz4 n PRO 350 Ca -0.10 0.52 -0.30 0.00 -2.02 0.00 0.00 63.50 61.60 3mz4 n PRO 350 Cb 0.52 -2.04 0.19 0.00 -0.02 0.00 0.00 33.50 32.14 3mz4 n PRO 350 CO 0.00 0.00 0.00 -1.54 1.98 0.00 0.00 175.50 175.94 3mz4 s SER 351 N -0.64 2.53 -0.12 2.55 1.04 -1.26 -4.98 113.70 112.81 3mz4 s SER 351 Ca 0.61 0.59 0.17 0.00 0.48 0.00 0.00 55.95 57.80 3mz4 s SER 351 Cb -0.59 -0.85 0.71 0.00 0.10 0.00 0.00 66.02 65.40 3mz4 s SER 351 CO 0.58 -3.13 1.61 0.00 0.98 0.00 0.00 173.24 173.29 3mz4 s ARG 353 N -1.94 3.43 0.52 0.00 1.81 -1.26 -4.96 118.95 116.54 3mz4 s ARG 353 Ca 0.50 2.16 -0.21 0.00 -1.72 0.00 0.00 55.73 56.45 3mz4 s ARG 353 Cb 0.33 -2.40 -0.06 0.00 -0.45 0.00 0.00 34.95 32.37 3mz4 s ARG 353 CO 0.23 -0.93 1.21 -1.25 -0.68 0.00 0.00 175.30 173.88 3mz4 s PRO 354 N -2.73 3.41 -0.45 3.54 0.04 -1.26 -4.94 135.00 132.61 3mz4 s PRO 354 Ca 0.67 1.87 -0.25 0.00 0.04 0.00 0.00 61.00 63.33 3mz4 s PRO 354 Cb -0.38 -2.23 0.03 0.00 0.04 0.00 0.00 34.50 31.96 3mz4 s PRO 354 CO 0.46 -0.87 0.91 0.34 0.04 0.00 0.00 177.00 177.89 3mz4 s ASP 355 N -1.37 6.51 0.00 6.66 -1.08 -1.26 -4.09 116.67 122.04 3mz4 s ASP 355 Ca 0.69 0.14 0.14 0.00 -0.52 0.00 0.00 52.55 53.00 3mz4 s ASP 355 Cb -0.31 -2.45 0.54 0.00 -1.46 0.00 0.00 42.92 39.24 3mz4 s ASP 355 CO 0.36 -1.02 1.39 0.54 0.52 0.00 0.00 175.17 176.96 3mz4 n ARG 356 N 7.08 1.51 -3.03 4.34 5.12 -0.29 -4.82 116.66 126.58 3mz4 n ARG 356 Ca 0.06 -0.78 -0.44 0.00 -1.93 0.00 0.00 57.85 54.77 3mz4 n ARG 356 Cb 0.48 -1.27 -0.05 0.00 -1.16 0.00 0.00 32.46 30.47 3mz4 n ARG 356 CO 0.00 0.00 0.00 -0.80 -1.93 0.00 0.00 177.63 174.90 3mz4 s ASN 357 N -1.28 6.22 0.11 0.55 0.01 -1.26 -4.86 114.94 114.43 3mz4 s ASN 357 Ca 0.23 -0.97 -0.31 0.00 -0.71 0.00 0.00 52.86 51.10 3mz4 s ASN 357 Cb 0.12 -2.34 -0.08 0.00 0.41 0.00 0.00 41.25 39.35 3mz4 s ASN 357 CO 0.18 -1.12 1.50 -1.61 -1.51 0.00 0.00 177.10 174.54 3mz4 s GLU 358 N 3.16 4.26 0.54 -0.60 0.41 -1.26 -4.91 118.70 120.29 3mz4 s GLU 358 Ca 0.18 2.21 0.26 0.00 -0.41 0.00 0.00 54.97 57.21 3mz4 s GLU 358 Cb -0.19 -3.32 1.55 0.00 -1.78 0.00 0.00 34.13 30.39 3mz4 s GLU 358 CO 0.11 -0.57 2.15 -1.35 -0.49 0.00 0.00 175.26 175.11 3mz4 h PRO 359 N 7.20 0.00 -0.37 0.39 0.11 -1.99 -1.52 132.00 135.81 3mz4 h PRO 359 Ca -0.42 0.00 -0.08 0.00 0.11 0.00 0.00 66.00 65.61 3mz4 h PRO 359 Cb 1.20 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.30 3mz4 h PRO 359 CO 0.90 0.07 -0.08 1.25 -0.21 0.00 0.00 178.00 179.93 3mz4 h HIS 360 N 0.00 0.79 -0.41 0.65 -0.00 -1.99 -1.87 115.15 112.32 3mz4 h HIS 360 Ca -0.00 -0.17 -0.11 0.00 -0.00 0.00 0.00 60.37 60.09 3mz4 h HIS 360 Cb 0.17 -0.19 -0.01 0.00 -0.00 0.00 0.00 27.41 27.38 3mz4 h HIS 360 CO 0.00 0.85 -0.19 -0.09 -0.00 0.00 0.00 177.93 178.50 3mz4 h ARG 361 N 0.51 0.85 -0.84 5.26 9.65 -1.69 -0.92 114.38 127.19 3mz4 h ARG 361 Ca 0.09 -0.37 0.05 0.00 -1.10 0.00 0.00 59.98 58.66 3mz4 h ARG 361 Cb 0.59 -0.03 -0.06 0.00 -1.39 0.00 0.00 29.97 29.08 3mz4 h ARG 361 CO 0.03 1.01 0.53 0.82 2.80 0.00 0.00 179.97 185.16 3mz4 h ILE 362 N 0.67 1.06 -0.33 1.20 1.08 -1.36 -0.73 117.51 119.10 3mz4 h ILE 362 Ca 0.09 -0.33 -0.06 0.00 -0.39 0.00 0.00 64.86 64.17 3mz4 h ILE 362 Cb 0.75 -0.00 -0.01 0.00 -3.07 0.00 0.00 36.82 34.49 3mz4 h ILE 362 CO 0.06 0.18 -0.02 -0.61 -0.69 0.00 0.00 178.15 177.07 3mz4 h GLN 363 N 0.97 0.60 -0.63 2.37 5.75 -0.80 -1.44 115.11 121.93 3mz4 h GLN 363 Ca 0.36 -0.20 0.12 0.00 -0.15 0.00 0.00 58.65 58.78 3mz4 h GLN 363 Cb 0.13 -0.05 -0.09 0.00 1.07 0.00 0.00 27.48 28.55 3mz4 h GLN 363 CO -0.16 0.74 0.16 0.37 -2.65 0.00 0.00 178.83 177.29 3mz4 h GLN 364 N 0.40 0.29 -0.24 1.69 4.15 -0.85 0.22 115.11 120.77 3mz4 h GLN 364 Ca 0.09 -0.02 -0.02 0.00 0.77 0.00 0.00 58.65 59.47 3mz4 h GLN 364 Cb 0.48 -0.07 -0.01 0.00 0.21 0.00 0.00 27.48 28.10 3mz4 h GLN 364 CO 0.02 0.19 0.07 0.82 -1.93 0.00 0.00 178.83 178.00 3mz4 h ILE 365 N 0.30 1.20 -0.43 2.39 2.04 -0.86 -0.44 117.51 121.70 3mz4 h ILE 365 Ca 0.33 -0.64 -0.11 0.00 1.00 0.00 0.00 64.86 65.44 3mz4 h ILE 365 Cb 0.49 1.18 -0.02 0.00 -0.74 0.00 0.00 36.82 37.73 3mz4 h ILE 365 CO -0.40 0.21 -0.18 -0.07 0.00 0.00 0.00 178.15 177.71 3mz4 h LEU 366 N 0.21 0.83 -0.65 1.44 3.38 -0.85 -1.68 115.31 117.99 3mz4 h LEU 366 Ca 0.07 -0.28 -0.01 0.00 0.09 0.00 0.00 57.88 57.75 3mz4 h LEU 366 Cb 0.25 -0.23 -0.03 0.00 0.09 0.00 0.00 40.66 40.75 3mz4 h LEU 366 CO -0.00 1.00 0.35 0.78 0.09 0.00 0.00 178.44 180.66 3mz4 h ASN 367 N 0.73 0.82 0.05 -0.43 2.35 -0.42 -0.69 115.58 117.99 3mz4 h ASN 367 Ca 0.11 -0.10 -0.00 0.00 -0.55 0.00 0.00 56.30 55.76 3mz4 h ASN 367 Cb 0.69 -0.21 0.00 0.00 0.05 0.00 0.00 38.32 38.85 3mz4 h ASN 367 CO 0.05 0.68 -0.03 1.88 -1.65 0.00 0.00 177.43 178.37 3mz4 h TYR 368 N 0.89 -0.06 -0.95 1.19 0.05 -0.75 -1.89 116.97 115.45 3mz4 h TYR 368 Ca 0.23 -0.00 0.05 0.00 0.05 0.00 0.00 58.73 59.05 3mz4 h TYR 368 Cb 0.05 0.02 -0.06 0.00 1.01 0.00 0.00 36.73 37.75 3mz4 h TYR 368 CO -0.01 0.06 0.62 0.82 -1.05 0.00 0.00 178.16 178.60 3mz4 h ILE 369 N -0.17 1.13 -0.50 -2.88 2.04 -1.22 -0.19 117.51 115.73 3mz4 h ILE 369 Ca -0.01 -0.40 -0.05 0.00 1.00 0.00 0.00 64.86 65.41 3mz4 h ILE 369 Cb 0.15 -0.13 -0.02 0.00 -0.74 0.00 0.00 36.82 36.08 3mz4 h ILE 369 CO 0.01 0.21 0.13 0.50 0.00 0.00 0.00 178.15 179.01 3mz4 h LYS 370 N 1.16 0.79 -0.17 2.37 3.64 -0.85 -1.51 116.57 122.00 3mz4 h LYS 370 Ca 0.39 -0.18 0.05 0.00 -1.27 0.00 0.00 60.65 59.63 3mz4 h LYS 370 Cb 0.07 -0.11 -0.06 0.00 -0.41 0.00 0.00 32.23 31.72 3mz4 h LYS 370 CO -0.13 0.75 -0.20 0.78 -2.27 0.00 0.00 179.45 178.39 3mz4 h GLY 371 N 0.68 -0.14 -0.42 5.01 0.00 -0.86 -2.64 103.07 104.71 3mz4 h GLY 371 Ca 0.16 0.25 0.10 0.00 0.00 0.00 0.00 47.33 47.83 3mz4 h GLY 371 CO -0.00 -0.18 -0.36 3.43 0.00 0.00 0.00 176.54 179.43 3mz4 h ASN 372 N -0.23 -1.25 1.04 0.19 2.35 -0.80 -2.43 115.58 114.45 3mz4 h ASN 372 Ca 0.11 0.23 0.00 0.00 -0.55 0.00 0.00 56.30 56.09 3mz4 h ASN 372 Cb 0.40 0.60 0.00 0.00 0.05 0.00 0.00 38.32 39.37 3mz4 h ASN 372 CO -0.31 -0.32 0.00 -0.07 -1.65 0.00 0.00 177.43 175.09 3mz4 h LEU 373 N -0.19 0.00 -2.25 1.61 3.38 -1.04 -0.94 115.31 115.88 3mz4 h LEU 373 Ca 0.21 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.18 3mz4 h LEU 373 Cb 0.56 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.30 3mz4 h LEU 373 CO -0.67 0.00 -0.04 0.11 0.09 0.00 0.00 178.44 177.93 3mz4 h LYS 374 N 0.00 0.00 0.00 1.13 1.57 -1.08 -0.31 116.57 117.89 3mz4 h LYS 374 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 3mz4 h LYS 374 Cb 0.52 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.83 3mz4 h LYS 374 CO 0.00 0.04 0.00 0.45 -0.57 0.00 0.00 179.45 179.37 3mz4 h HIS 375 N 0.00 0.00 -3.58 -1.35 3.86 -1.26 -3.42 115.15 109.40 3mz4 h HIS 375 Ca -0.00 0.00 -0.64 0.00 -1.16 0.00 0.00 60.37 58.57 3mz4 h HIS 375 Cb 0.22 0.00 -0.14 0.00 1.06 0.00 0.00 27.41 28.55 3mz4 h HIS 375 CO 0.00 0.00 0.08 0.08 0.86 0.00 0.00 177.93 178.95 3mz4 s VAL 376 N -3.37 4.92 -0.04 2.45 1.01 -0.13 -5.02 120.40 120.22 3mz4 s VAL 376 Ca 0.04 0.41 0.01 0.00 0.00 0.00 0.00 61.98 62.45 3mz4 s VAL 376 Cb 0.09 -4.07 0.02 0.00 0.00 0.00 0.00 36.38 32.42 3mz4 s VAL 376 CO 0.46 -0.34 -0.06 -0.69 0.00 0.00 0.00 175.10 174.47 3mz4 s VAL 377 N 2.63 0.61 -2.49 2.92 1.01 -1.26 -4.78 120.40 119.03 3mz4 s VAL 377 Ca 0.22 -0.19 0.28 0.00 0.00 0.00 0.00 61.98 62.29 3mz4 s VAL 377 Cb -0.15 -0.60 0.55 0.00 0.00 0.00 0.00 36.38 36.19 3mz4 s VAL 377 CO 0.15 0.23 1.75 -0.38 0.00 0.00 0.00 175.10 176.85