#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2zit s ALA 3 N 0.00 3.71 0.24 1.55 0.00 -1.26 -1.93 121.76 124.07 2zit s ALA 3 Ca 0.00 -0.69 0.07 0.00 0.00 0.00 0.00 51.96 51.34 2zit s ALA 3 Cb 0.00 -1.87 -0.05 0.00 0.00 0.00 0.00 23.12 21.20 2zit s ALA 3 CO 0.00 0.56 -0.09 -0.06 0.00 0.00 0.00 175.76 176.17 2zit s PHE 4 N -0.84 1.78 0.43 0.00 0.08 -1.01 -4.95 117.98 113.48 2zit s PHE 4 Ca 0.14 -0.67 0.03 0.00 0.12 0.00 0.00 56.93 56.55 2zit s PHE 4 Cb -0.12 -0.94 0.00 0.00 -0.57 0.00 0.00 43.02 41.40 2zit s PHE 4 CO 0.03 0.27 0.62 0.95 -0.10 0.00 0.00 175.22 177.00 2zit s THR 5 N -3.05 3.64 0.55 0.64 -4.23 -1.26 -2.19 115.64 109.75 2zit s THR 5 Ca 0.26 -0.73 0.29 0.00 -1.18 0.00 0.00 61.69 60.32 2zit s THR 5 Cb 0.02 -3.31 0.34 0.00 1.34 0.00 0.00 72.50 70.89 2zit s THR 5 CO 0.09 -0.18 2.22 0.58 -0.54 0.00 0.00 174.62 176.79 2zit h VAL 6 N 0.50 0.56 -0.12 2.29 2.07 -1.99 -0.54 116.25 119.02 2zit h VAL 6 Ca -0.44 -0.11 -0.06 0.00 0.82 0.00 0.00 66.70 66.90 2zit h VAL 6 Cb 1.27 1.07 -0.00 0.00 -1.52 0.00 0.00 31.29 32.11 2zit h VAL 6 CO 0.54 0.03 -0.17 0.44 0.02 0.00 0.00 177.57 178.43 2zit h ASP 7 N 0.00 0.35 -0.15 0.57 3.32 -1.98 -2.08 116.42 116.45 2zit h ASP 7 Ca -0.00 -0.52 -0.11 0.00 0.02 0.00 0.00 57.03 56.42 2zit h ASP 7 Cb 0.07 -0.10 -0.01 0.00 0.22 0.00 0.00 39.33 39.51 2zit h ASP 7 CO 0.00 0.80 -0.28 1.56 -1.72 0.00 0.00 179.24 179.61 2zit h GLN 8 N -0.09 0.62 0.07 3.56 4.20 -1.71 -1.46 115.11 120.30 2zit h GLN 8 Ca 0.01 -0.26 -0.00 0.00 0.06 0.00 0.00 58.65 58.46 2zit h GLN 8 Cb 0.72 -0.02 0.00 0.00 0.30 0.00 0.00 27.48 28.48 2zit h GLN 8 CO 0.04 0.83 -0.03 0.52 -0.67 0.00 0.00 178.83 179.52 2zit h MET 9 N 0.54 -0.09 0.08 1.46 2.86 -1.17 -1.96 114.93 116.65 2zit h MET 9 Ca 0.07 0.01 -0.00 0.00 -2.06 0.00 0.00 59.70 57.71 2zit h MET 9 Cb 0.75 0.02 0.00 0.00 0.06 0.00 0.00 31.60 32.43 2zit h MET 9 CO 0.06 0.23 -0.04 -0.09 1.06 0.00 0.00 176.91 178.13 2zit h ARG 10 N -0.41 -0.11 -0.06 1.72 9.65 -1.35 0.40 114.38 124.22 2zit h ARG 10 Ca -0.01 0.01 0.02 0.00 -1.10 0.00 0.00 59.98 58.90 2zit h ARG 10 Cb 0.36 0.02 -0.00 0.00 -1.39 0.00 0.00 29.97 28.96 2zit h ARG 10 CO 0.01 -0.06 0.06 0.66 2.80 0.00 0.00 179.97 183.44 2zit h SER 11 N -0.12 0.00 0.49 -3.80 4.64 -1.32 -0.10 113.55 113.33 2zit h SER 11 Ca -0.01 0.00 -0.29 0.00 -0.47 0.00 0.00 61.79 61.02 2zit h SER 11 Cb 0.10 0.00 0.02 0.00 -0.31 0.00 0.00 62.40 62.20 2zit h SER 11 CO 0.02 0.00 -1.30 0.25 -0.87 0.00 0.00 176.83 174.93 2zit h LEU 12 N 0.00 0.58 -0.87 5.97 5.85 -0.63 -3.19 115.31 123.02 2zit h LEU 12 Ca 0.03 -0.61 0.00 0.00 0.84 0.00 0.00 57.88 58.14 2zit h LEU 12 Cb 0.15 -0.19 0.00 0.00 0.37 0.00 0.00 40.66 40.99 2zit h LEU 12 CO -0.00 1.47 0.00 0.24 -0.34 0.00 0.00 178.44 179.81 2zit h MET 13 N 0.11 0.00 -0.26 1.25 2.86 0.79 -2.98 114.93 116.70 2zit h MET 13 Ca -0.17 0.00 -0.07 0.00 -2.06 0.00 0.00 59.70 57.39 2zit h MET 13 Cb 2.01 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 33.67 2zit h MET 13 CO 0.23 0.00 -0.13 0.22 1.06 0.00 0.00 176.91 178.29 2zit h ASP 14 N 0.00 0.57 -0.85 1.22 3.58 -1.15 -3.35 116.42 116.43 2zit h ASP 14 Ca 0.00 -0.41 -0.70 0.00 0.42 0.00 0.00 57.03 56.34 2zit h ASP 14 Cb 0.46 -0.16 -0.09 0.00 1.72 0.00 0.00 39.33 41.26 2zit h ASP 14 CO 0.00 0.85 2.32 0.29 -2.88 0.00 0.00 179.24 179.83 2zit n LYS 15 N -4.46 3.16 0.20 0.28 5.02 -1.13 -4.77 118.16 116.46 2zit n LYS 15 Ca -0.04 -3.20 0.06 0.00 -2.02 0.00 0.00 58.31 53.11 2zit n LYS 15 Cb 0.36 -3.34 0.54 0.00 -0.02 0.00 0.00 35.03 32.57 2zit n LYS 15 CO 0.00 0.00 0.00 0.28 -0.52 0.00 0.00 177.40 177.16 2zit h VAL 16 N 4.88 1.08 0.00 -0.18 2.07 -1.80 -0.53 116.25 121.76 2zit h VAL 16 Ca 0.46 -0.32 0.00 0.00 0.82 0.00 0.00 66.70 67.66 2zit h VAL 16 Cb 0.79 1.08 0.00 0.00 -1.52 0.00 0.00 31.29 31.64 2zit h VAL 16 CO 1.56 0.10 0.07 0.71 0.02 0.00 0.00 177.57 180.02 2zit h THR 17 N 0.09 0.00 -0.64 2.57 1.35 -1.86 -0.06 112.91 114.36 2zit h THR 17 Ca 0.02 0.00 -0.42 0.00 -0.55 0.00 0.00 66.41 65.46 2zit h THR 17 Cb 0.14 0.82 -0.26 0.00 -1.73 0.00 0.00 68.15 67.12 2zit h THR 17 CO 0.01 0.00 -0.09 0.59 -0.25 0.00 0.00 175.52 175.78 2zit n ASN 18 N -2.85 4.42 -4.29 5.36 4.13 -0.21 -4.66 115.26 117.16 2zit n ASN 18 Ca -0.02 -3.78 -0.30 0.00 1.68 0.00 0.00 54.58 52.16 2zit n ASN 18 Cb 0.13 -0.62 -0.16 0.00 -1.54 0.00 0.00 39.78 37.58 2zit n ASN 18 CO 0.00 0.00 0.00 -0.69 0.28 0.00 0.00 177.26 176.85 2zit s VAL 19 N -4.03 1.97 -0.34 2.41 1.01 -0.04 -0.59 120.40 120.79 2zit s VAL 19 Ca 0.52 -1.07 0.02 0.00 0.00 0.00 0.00 61.98 61.45 2zit s VAL 19 Cb 0.43 -1.64 0.10 0.00 0.00 0.00 0.00 36.38 35.28 2zit s VAL 19 CO 0.01 0.56 0.09 -0.13 0.00 0.00 0.00 175.10 175.63 2zit s ARG 20 N -0.58 1.21 -0.55 2.72 1.81 0.09 -3.93 118.95 119.72 2zit s ARG 20 Ca 0.09 -1.63 -0.27 0.00 -1.72 0.00 0.00 55.73 52.20 2zit s ARG 20 Cb -0.10 -2.73 0.03 0.00 -0.45 0.00 0.00 34.95 31.71 2zit s ARG 20 CO -0.01 -0.98 1.11 -0.80 -0.68 0.00 0.00 175.30 173.94 2zit s ASN 21 N 1.07 6.46 0.10 0.23 0.02 -1.26 -0.37 114.94 121.19 2zit s ASN 21 Ca 0.11 0.08 -0.09 0.00 -1.02 0.00 0.00 52.86 51.94 2zit s ASN 21 Cb -0.19 -2.52 -0.00 0.00 0.02 0.00 0.00 41.25 38.56 2zit s ASN 21 CO -0.13 -1.35 0.21 0.00 0.02 0.00 0.00 177.10 175.84 2zit s MET 22 N 4.56 0.88 0.25 -0.60 0.23 -0.63 0.45 119.30 124.45 2zit s MET 22 Ca 0.41 -0.98 0.02 0.00 -1.03 0.00 0.00 55.69 54.11 2zit s MET 22 Cb -0.09 0.35 -0.01 0.00 -1.53 0.00 0.00 34.83 33.56 2zit s MET 22 CO 0.25 -0.29 0.06 -1.13 -2.03 0.00 0.00 175.02 171.88 2zit n SER 23 N -0.08 1.68 -3.89 -1.18 3.41 -1.10 -1.17 113.62 111.29 2zit n SER 23 Ca -0.14 -2.25 -0.30 0.00 -0.26 0.00 0.00 58.87 55.91 2zit n SER 23 Cb 0.62 0.46 -0.15 0.00 -0.26 0.00 0.00 64.21 64.88 2zit n SER 23 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 2zit s VAL 24 N -2.29 1.53 -0.49 -3.33 1.01 -1.26 -1.03 120.40 114.53 2zit s VAL 24 Ca 0.08 -1.62 -0.27 0.00 0.00 0.00 0.00 61.98 60.16 2zit s VAL 24 Cb 0.00 -2.02 0.03 0.00 0.00 0.00 0.00 36.38 34.39 2zit s VAL 24 CO 0.06 -0.45 1.06 -0.63 0.00 0.00 0.00 175.10 175.13 2zit s ILE 25 N 1.32 4.29 -0.24 2.22 1.01 -0.86 -4.91 121.20 124.03 2zit s ILE 25 Ca 0.05 0.98 -0.26 0.00 0.00 0.00 0.00 60.65 61.42 2zit s ILE 25 Cb -0.18 -4.56 0.11 0.00 0.01 0.00 0.00 42.46 37.84 2zit s ILE 25 CO -0.13 -0.99 0.93 0.00 0.00 0.00 0.00 174.94 174.75 2zit s ALA 26 N 4.24 -1.91 0.40 9.38 0.00 -1.26 -0.98 121.76 131.63 2zit s ALA 26 Ca 0.43 1.82 -0.26 0.00 0.00 0.00 0.00 51.96 53.95 2zit s ALA 26 Cb -0.08 -1.15 -0.08 0.00 0.00 0.00 0.00 23.12 21.80 2zit s ALA 26 CO 0.29 -0.28 1.22 -1.58 0.00 0.00 0.00 175.76 175.41 2zit s HIS 27 N -0.07 2.97 0.57 0.00 2.46 -1.26 -4.88 115.29 115.08 2zit s HIS 27 Ca 0.01 1.50 0.26 0.00 0.47 0.00 0.00 55.06 57.29 2zit s HIS 27 Cb -0.04 -3.51 1.60 0.00 -0.13 0.00 0.00 32.58 30.51 2zit s HIS 27 CO -0.02 -1.62 2.15 -0.39 -2.47 0.00 0.00 174.74 172.39 2zit h VAL 28 N 2.39 0.63 -0.37 0.89 -1.51 -1.96 -1.47 116.25 114.85 2zit h VAL 28 Ca -0.49 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 64.98 2zit h VAL 28 Cb 1.24 0.92 0.00 0.00 -2.13 0.00 0.00 31.29 31.32 2zit h VAL 28 CO 0.63 0.00 0.00 0.47 -1.23 0.00 0.00 177.57 177.44 2zit n ASP 29 N -4.03 3.16 -0.59 4.19 8.00 -1.26 -3.78 116.55 122.24 2zit n ASP 29 Ca -0.00 -2.33 0.06 0.00 0.71 0.00 0.00 54.79 53.23 2zit n ASP 29 Cb 0.22 -0.48 0.20 0.00 -0.02 0.00 0.00 41.12 41.04 2zit n ASP 29 CO 0.00 0.00 0.00 1.41 -0.39 0.00 0.00 177.20 178.22 2zit n HIS 30 N 0.51 0.00 -2.42 1.24 8.25 -0.55 -4.96 115.22 117.29 2zit n HIS 30 Ca 0.15 -1.45 -0.14 0.00 -0.26 0.00 0.00 57.72 56.02 2zit n HIS 30 Cb 0.63 -0.24 0.00 0.00 1.12 0.00 0.00 29.99 31.50 2zit n HIS 30 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2zit n GLY 31 N -1.10 -0.16 0.13 -1.41 0.00 -1.25 -4.86 105.19 96.54 2zit n GLY 31 Ca 0.19 -0.28 -0.09 0.00 0.00 0.00 0.00 46.02 45.84 2zit n GLY 31 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 2zit h LYS 32 N -0.30 0.32 -0.26 1.61 3.64 -1.74 0.62 116.57 120.47 2zit h LYS 32 Ca -0.33 -0.02 -0.13 0.00 -1.27 0.00 0.00 60.65 58.90 2zit h LYS 32 Cb 1.24 -0.07 -0.01 0.00 -0.41 0.00 0.00 32.23 32.98 2zit h LYS 32 CO 0.38 0.21 -0.38 0.66 -2.27 0.00 0.00 179.45 178.05 2zit h SER 33 N 0.33 0.62 -0.22 4.20 4.64 -1.90 -2.64 113.55 118.58 2zit h SER 33 Ca 0.11 -0.27 -0.03 0.00 -0.47 0.00 0.00 61.79 61.13 2zit h SER 33 Cb -0.00 -0.17 -0.01 0.00 -0.31 0.00 0.00 62.40 61.90 2zit h SER 33 CO -0.05 0.94 0.03 0.74 -0.87 0.00 0.00 176.83 177.62 2zit h THR 34 N 0.49 1.23 -0.19 2.95 2.02 -1.86 -2.37 112.91 115.18 2zit h THR 34 Ca 0.05 -0.78 -0.02 0.00 0.77 0.00 0.00 66.41 66.42 2zit h THR 34 Cb 0.88 1.32 -0.01 0.00 -1.74 0.00 0.00 68.15 68.60 2zit h THR 34 CO 0.08 0.24 0.04 -0.07 0.37 0.00 0.00 175.52 176.18 2zit h LEU 35 N 0.17 0.30 -1.08 2.58 3.38 -0.89 -2.96 115.31 116.81 2zit h LEU 35 Ca 0.07 -0.25 0.05 0.00 0.09 0.00 0.00 57.88 57.85 2zit h LEU 35 Cb 0.34 -0.08 -0.06 0.00 0.09 0.00 0.00 40.66 40.95 2zit h LEU 35 CO 0.01 0.47 0.62 0.71 0.09 0.00 0.00 178.44 180.34 2zit h THR 36 N 0.12 1.11 -0.85 0.22 1.35 -1.49 -0.93 112.91 112.43 2zit h THR 36 Ca 0.06 -0.39 0.07 0.00 -0.55 0.00 0.00 66.41 65.60 2zit h THR 36 Cb 0.29 -0.13 -0.06 0.00 -1.73 0.00 0.00 68.15 66.53 2zit h THR 36 CO 0.00 0.21 0.56 0.44 -0.25 0.00 0.00 175.52 176.48 2zit h ASP 37 N 1.14 0.82 -0.53 5.36 3.32 -1.28 -1.77 116.42 123.48 2zit h ASP 37 Ca 0.40 0.01 -0.02 0.00 0.02 0.00 0.00 57.03 57.44 2zit h ASP 37 Cb 0.12 -0.17 -0.02 0.00 0.22 0.00 0.00 39.33 39.48 2zit h ASP 37 CO -0.14 0.52 0.24 -1.28 -1.72 0.00 0.00 179.24 176.86 2zit h SER 38 N 0.93 0.71 -0.63 6.45 0.87 -1.02 0.29 113.55 121.15 2zit h SER 38 Ca 0.37 -0.14 -0.06 0.00 -1.23 0.00 0.00 61.79 60.73 2zit h SER 38 Cb 0.25 -0.18 -0.03 0.00 -0.44 0.00 0.00 62.40 62.00 2zit h SER 38 CO -0.14 0.65 0.15 -0.07 -0.53 0.00 0.00 176.83 176.90 2zit h LEU 39 N 0.72 0.97 -0.33 2.23 3.38 -1.18 0.14 115.31 121.23 2zit h LEU 39 Ca 0.18 -0.20 -0.15 0.00 0.09 0.00 0.00 57.88 57.81 2zit h LEU 39 Cb 0.14 -0.26 -0.00 0.00 0.09 0.00 0.00 40.66 40.63 2zit h LEU 39 CO -0.02 0.94 -0.37 0.58 0.09 0.00 0.00 178.44 179.66 2zit h VAL 40 N 0.98 1.28 0.00 1.22 2.07 -1.02 0.18 116.25 120.97 2zit h VAL 40 Ca 0.21 -1.54 -0.08 0.00 0.82 0.00 0.00 66.70 66.11 2zit h VAL 40 Cb 0.35 1.50 -0.01 0.00 -1.52 0.00 0.00 31.29 31.61 2zit h VAL 40 CO 0.00 0.51 -0.37 -0.61 0.02 0.00 0.00 177.57 177.12 2zit h GLN 41 N 0.62 0.00 0.00 1.57 4.15 -0.15 -0.12 115.11 121.18 2zit h GLN 41 Ca 0.05 0.00 -0.13 0.00 0.77 0.00 0.00 58.65 59.34 2zit h GLN 41 Cb 0.95 0.00 -0.02 0.00 0.21 0.00 0.00 27.48 28.63 2zit h GLN 41 CO 0.09 0.37 -0.95 -2.13 -1.93 0.00 0.00 178.83 174.28 2zit n ARG 42 N -3.76 0.51 -0.05 1.69 3.00 0.46 -4.67 116.66 113.84 2zit n ARG 42 Ca -0.01 0.53 0.05 0.00 -0.00 0.00 0.00 57.85 58.42 2zit n ARG 42 Cb 0.45 -1.70 0.07 0.00 0.00 0.00 0.00 32.46 31.28 2zit n ARG 42 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 2zit n ALA 43 N -3.58 2.15 -1.72 5.13 0.00 0.62 -4.79 120.51 118.32 2zit n ALA 43 Ca -0.21 -1.75 -0.41 0.00 0.00 0.00 0.00 53.44 51.07 2zit n ALA 43 Cb 0.49 -0.20 0.01 0.00 0.00 0.00 0.00 19.45 19.74 2zit n ALA 43 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2zit n GLY 44 N -0.87 0.71 3.37 0.00 0.00 -0.06 -0.89 105.19 107.45 2zit n GLY 44 Ca 0.08 0.23 -0.37 0.00 0.00 0.00 0.00 46.02 45.96 2zit n GLY 44 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2zit s ILE 45 N -1.17 4.02 0.33 -0.61 1.01 -0.41 -1.98 121.20 122.39 2zit s ILE 45 Ca 0.59 -0.57 0.07 0.00 0.00 0.00 0.00 60.65 60.74 2zit s ILE 45 Cb -0.51 -3.02 -0.01 0.00 0.01 0.00 0.00 42.46 38.93 2zit s ILE 45 CO 0.60 0.15 0.43 0.27 0.00 0.00 0.00 174.94 176.39 2zit s ILE 46 N 1.53 3.96 0.74 2.92 -4.36 -0.81 -4.76 121.20 120.42 2zit s ILE 46 Ca 0.04 -1.08 -0.08 0.00 -0.26 0.00 0.00 60.65 59.26 2zit s ILE 46 Cb -0.17 -3.36 0.07 0.00 1.25 0.00 0.00 42.46 40.25 2zit s ILE 46 CO 0.02 -0.16 1.07 -0.55 0.24 0.00 0.00 174.94 175.56 2zit s SER 47 N -4.13 4.70 0.24 4.36 0.15 -1.26 -2.41 113.70 115.35 2zit s SER 47 Ca 0.44 0.55 -0.06 0.00 0.70 0.00 0.00 55.95 57.57 2zit s SER 47 Cb -0.09 -1.14 0.23 0.00 -1.71 0.00 0.00 66.02 63.32 2zit s SER 47 CO 0.30 -1.71 1.88 0.00 1.20 0.00 0.00 173.24 174.91 2zit h ALA 48 N -0.75 1.20 0.00 5.45 0.00 -1.81 -3.41 119.26 119.94 2zit h ALA 48 Ca -0.45 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.34 2zit h ALA 48 Cb 1.32 -0.37 0.00 0.00 0.00 0.00 0.00 17.79 18.74 2zit h ALA 48 CO 0.62 0.67 0.00 0.41 0.00 0.00 0.00 179.25 180.94 2zit n GLY 67 N -1.19 0.53 3.60 0.00 0.00 -1.26 -5.04 105.19 101.82 2zit n GLY 67 Ca 0.10 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.76 2zit n GLY 67 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2zit s ILE 68 N 0.00 4.96 0.27 -0.61 1.01 -1.26 -5.05 121.20 120.52 2zit s ILE 68 Ca 0.00 0.04 -0.04 0.00 0.00 0.00 0.00 60.65 60.65 2zit s ILE 68 Cb 0.00 -3.30 -0.05 0.00 0.01 0.00 0.00 42.46 39.12 2zit s ILE 68 CO 0.00 0.36 0.52 0.42 0.00 0.00 0.00 174.94 176.24 2zit s THR 69 N 1.07 5.07 0.25 2.92 -4.23 -1.26 -3.91 115.64 115.55 2zit s THR 69 Ca 0.06 -0.05 0.02 0.00 -1.18 0.00 0.00 61.69 60.54 2zit s THR 69 Cb -0.14 -3.74 -0.05 0.00 1.34 0.00 0.00 72.50 69.91 2zit s THR 69 CO 0.04 -0.30 0.06 0.27 -0.54 0.00 0.00 174.62 174.15 2zit s ILE 70 N -2.05 0.77 -0.47 2.99 -4.36 -0.02 -1.97 121.20 116.08 2zit s ILE 70 Ca 0.43 -2.00 -0.29 0.00 -0.26 0.00 0.00 60.65 58.52 2zit s ILE 70 Cb -0.11 -2.53 0.03 0.00 1.25 0.00 0.00 42.46 41.10 2zit s ILE 70 CO 0.30 -0.14 1.20 -0.75 0.24 0.00 0.00 174.94 175.79 2zit s LYS 71 N -3.96 3.68 -0.37 0.37 2.20 -1.09 -4.69 119.74 115.87 2zit s LYS 71 Ca 0.34 0.61 -0.40 0.00 -0.36 0.00 0.00 55.97 56.16 2zit s LYS 71 Cb 0.07 -3.94 -0.16 0.00 -1.51 0.00 0.00 37.83 32.30 2zit s LYS 71 CO 0.12 -1.44 1.94 0.45 -0.36 0.00 0.00 175.35 176.05 2zit n SER 72 N 8.08 1.83 -0.00 1.43 2.88 -1.25 -4.80 113.62 121.79 2zit n SER 72 Ca 0.13 0.82 0.00 0.00 -1.33 0.00 0.00 58.87 58.48 2zit n SER 72 Cb 0.49 -1.09 -0.00 0.00 -0.75 0.00 0.00 64.21 62.85 2zit n SER 72 CO 0.00 0.00 0.00 0.41 -1.23 0.00 0.00 175.04 174.22 2zit n THR 73 N 5.68 0.01 -3.60 2.46 -1.04 -1.24 -4.92 114.28 111.63 2zit n THR 73 Ca 0.37 -0.01 -0.15 0.00 -2.04 0.00 0.00 64.05 62.22 2zit n THR 73 Cb 0.10 0.15 -0.06 0.00 -1.82 0.00 0.00 70.33 68.70 2zit n THR 73 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2zit s ALA 74 N -2.03 -1.33 -0.02 2.41 0.00 -1.26 -0.96 121.76 118.57 2zit s ALA 74 Ca -0.00 0.73 0.03 0.00 0.00 0.00 0.00 51.96 52.71 2zit s ALA 74 Cb 0.00 0.23 -0.00 0.00 0.00 0.00 0.00 23.12 23.35 2zit s ALA 74 CO 0.02 -0.42 -0.10 0.42 0.00 0.00 0.00 175.76 175.67 2zit s ILE 75 N -1.92 0.84 -0.16 0.00 1.01 -0.28 -1.56 121.20 119.13 2zit s ILE 75 Ca -0.08 -0.42 -0.15 0.00 0.00 0.00 0.00 60.65 59.99 2zit s ILE 75 Cb -0.01 -0.73 -0.04 0.00 0.01 0.00 0.00 42.46 41.69 2zit s ILE 75 CO 0.02 0.25 0.35 -0.44 0.00 0.00 0.00 174.94 175.13 2zit s SER 76 N -0.02 6.48 0.08 3.58 0.01 -1.26 -0.37 113.70 122.20 2zit s SER 76 Ca 0.00 0.57 0.10 0.00 1.31 0.00 0.00 55.95 57.93 2zit s SER 76 Cb -0.07 -2.21 -0.03 0.00 0.21 0.00 0.00 66.02 63.92 2zit s SER 76 CO 0.00 0.04 -0.25 -0.76 0.41 0.00 0.00 173.24 172.68 2zit s LEU 77 N 0.69 2.34 -0.06 2.44 1.02 0.11 -1.29 118.68 123.94 2zit s LEU 77 Ca 0.19 -0.63 0.05 0.00 0.02 0.00 0.00 54.13 53.76 2zit s LEU 77 Cb -0.14 -1.32 -0.01 0.00 0.02 0.00 0.00 46.19 44.75 2zit s LEU 77 CO 0.06 0.22 -0.23 -0.47 0.02 0.00 0.00 176.35 175.95 2zit s TYR 78 N -0.95 2.25 -0.01 0.29 5.04 -0.07 -0.28 117.35 123.61 2zit s TYR 78 Ca 0.14 -0.69 -0.02 0.00 -2.44 0.00 0.00 57.07 54.06 2zit s TYR 78 Cb -0.10 -1.49 -0.00 0.00 0.35 0.00 0.00 41.96 40.72 2zit s TYR 78 CO 0.05 -0.22 0.05 0.45 -1.34 0.00 0.00 175.55 174.54 2zit s SER 79 N -0.07 0.03 0.00 4.32 0.15 -0.87 -4.70 113.70 112.58 2zit s SER 79 Ca -0.05 -0.10 0.02 0.00 0.70 0.00 0.00 55.95 56.53 2zit s SER 79 Cb -0.13 0.13 -0.01 0.00 -1.71 0.00 0.00 66.02 64.30 2zit s SER 79 CO 0.04 -0.15 -0.07 -0.70 1.20 0.00 0.00 173.24 173.55 2zit s GLU 80 N -0.59 0.57 0.29 5.44 2.12 -1.26 -0.82 118.70 124.46 2zit s GLU 80 Ca -0.07 -0.34 0.02 0.00 0.36 0.00 0.00 54.97 54.95 2zit s GLU 80 Cb -0.04 -0.53 -0.04 0.00 0.26 0.00 0.00 34.13 33.78 2zit s GLU 80 CO 0.00 0.14 0.12 -1.64 -0.54 0.00 0.00 175.26 173.34 2zit s MET 81 N -0.40 1.54 0.68 4.30 -1.94 -1.10 -5.05 119.30 117.34 2zit s MET 81 Ca 0.01 -1.87 -0.11 0.00 -1.71 0.00 0.00 55.69 52.01 2zit s MET 81 Cb -0.04 -0.27 -0.00 0.00 2.01 0.00 0.00 34.83 36.53 2zit s MET 81 CO -0.00 -0.36 1.06 -1.54 -0.01 0.00 0.00 175.02 174.17 2zit s SER 82 N -3.37 5.60 0.61 3.03 1.04 -1.26 -4.79 113.70 114.56 2zit s SER 82 Ca 0.36 1.35 0.37 0.00 0.48 0.00 0.00 55.95 58.52 2zit s SER 82 Cb 0.06 -2.25 1.98 0.00 0.10 0.00 0.00 66.02 65.91 2zit s SER 82 CO 0.15 -1.27 2.24 0.44 0.98 0.00 0.00 173.24 175.78 2zit h ASP 83 N -0.60 0.00 0.36 7.02 5.19 -1.99 -1.84 116.42 124.56 2zit h ASP 83 Ca -0.45 0.00 -0.25 0.00 -0.62 0.00 0.00 57.03 55.71 2zit h ASP 83 Cb 1.22 0.00 0.01 0.00 0.18 0.00 0.00 39.33 40.74 2zit h ASP 83 CO 0.61 0.02 -1.06 -0.33 -3.12 0.00 0.00 179.24 175.36 2zit h GLU 84 N 0.00 0.42 -0.37 3.56 5.08 -2.01 -3.26 114.58 118.00 2zit h GLU 84 Ca -0.00 -0.52 -0.13 0.00 -1.00 0.00 0.00 59.36 57.71 2zit h GLU 84 Cb 0.15 0.16 -0.01 0.00 0.50 0.00 0.00 28.75 29.55 2zit h GLU 84 CO 0.00 1.18 -0.30 -0.44 -1.00 0.00 0.00 179.01 178.45 2zit h ASP 85 N 0.21 0.83 0.14 1.42 3.32 -1.71 -2.92 116.42 117.70 2zit h ASP 85 Ca -0.11 -0.33 -0.00 0.00 0.02 0.00 0.00 57.03 56.60 2zit h ASP 85 Cb 1.72 -0.23 -0.00 0.00 0.22 0.00 0.00 39.33 41.04 2zit h ASP 85 CO 0.19 1.07 -0.02 0.58 -1.72 0.00 0.00 179.24 179.33 2zit h VAL 86 N 0.67 0.26 0.00 -1.35 2.07 -1.53 -1.13 116.25 115.24 2zit h VAL 86 Ca 0.08 -0.13 0.00 0.00 0.82 0.00 0.00 66.70 67.47 2zit h VAL 86 Cb 0.84 1.10 0.00 0.00 -1.52 0.00 0.00 31.29 31.71 2zit h VAL 86 CO 0.07 0.02 -0.11 0.11 0.02 0.00 0.00 177.57 177.68 2zit h LYS 87 N 0.00 0.00 0.00 1.57 1.57 -1.57 -3.12 116.57 115.02 2zit h LYS 87 Ca -0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 2zit h LYS 87 Cb 0.10 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.41 2zit h LYS 87 CO 0.00 0.00 0.00 0.93 -0.57 0.00 0.00 179.45 179.81 2zit h GLU 88 N 0.00 0.00 -6.15 3.15 5.08 -1.28 -3.44 114.58 111.94 2zit h GLU 88 Ca 0.00 0.00 -0.57 0.00 -1.00 0.00 0.00 59.36 57.79 2zit h GLU 88 Cb 0.98 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 30.19 2zit h GLU 88 CO 0.00 0.00 0.88 0.42 -1.00 0.00 0.00 179.01 179.31 2zit s ILE 89 N -3.18 4.34 -0.92 3.13 1.01 -1.18 -4.93 121.20 119.46 2zit s ILE 89 Ca 0.09 1.62 -0.06 0.00 0.00 0.00 0.00 60.65 62.30 2zit s ILE 89 Cb 0.11 -4.04 0.03 0.00 0.01 0.00 0.00 42.46 38.56 2zit s ILE 89 CO 0.56 -0.13 2.74 0.29 0.00 0.00 0.00 174.94 178.39 2zit n LYS 90 N 6.47 3.46 -3.59 2.79 5.02 -1.26 -4.83 118.16 126.23 2zit n LYS 90 Ca 0.13 -2.64 -0.10 0.00 -2.02 0.00 0.00 58.31 53.68 2zit n LYS 90 Cb 0.45 -2.42 -0.05 0.00 -0.02 0.00 0.00 35.03 32.99 2zit n LYS 90 CO 0.00 0.00 0.00 1.14 -0.52 0.00 0.00 177.40 178.02 2zit s GLN 91 N -0.65 0.57 -0.29 1.97 -2.07 -1.26 -5.11 119.66 112.82 2zit s GLN 91 Ca 0.59 0.21 -0.34 0.00 -1.82 0.00 0.00 55.36 54.01 2zit s GLN 91 Cb 0.27 0.27 -0.10 0.00 -1.09 0.00 0.00 33.01 32.35 2zit s GLN 91 CO -0.12 -0.16 2.14 1.63 -1.32 0.00 0.00 175.29 177.45 2zit n LYS 92 N 0.96 1.39 -4.35 9.60 5.02 -1.26 -4.94 118.16 124.58 2zit n LYS 92 Ca -0.11 0.41 -0.20 0.00 -2.02 0.00 0.00 58.31 56.39 2zit n LYS 92 Cb 0.58 -2.62 -0.10 0.00 -0.02 0.00 0.00 35.03 32.86 2zit n LYS 92 CO 0.00 0.00 0.00 0.95 -0.52 0.00 0.00 177.40 177.83 2zit s THR 93 N 6.96 1.84 -0.15 -0.18 -4.23 -1.26 -4.72 115.64 113.90 2zit s THR 93 Ca 1.05 -2.12 -0.04 0.00 -1.18 0.00 0.00 61.69 59.40 2zit s THR 93 Cb -0.74 -1.99 0.06 0.00 1.34 0.00 0.00 72.50 71.17 2zit s THR 93 CO 0.47 -0.47 0.13 -0.62 -0.54 0.00 0.00 174.62 173.60 2zit s ASP 94 N -3.09 1.70 0.00 3.99 2.15 -1.26 -5.05 116.67 115.11 2zit s ASP 94 Ca 0.21 -0.29 0.00 0.00 0.43 0.00 0.00 52.55 52.90 2zit s ASP 94 Cb -0.03 0.02 0.00 0.00 -0.30 0.00 0.00 42.92 42.61 2zit s ASP 94 CO 0.08 -0.32 0.00 0.61 -0.17 0.00 0.00 175.17 175.37 2zit n GLY 95 N 5.30 -3.27 0.00 2.66 0.00 -1.26 -4.72 105.19 103.89 2zit n GLY 95 Ca -0.06 -1.81 0.09 0.00 0.00 0.00 0.00 46.02 44.23 2zit n GLY 95 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2zit n ASN 96 N -0.51 0.83 -4.80 1.61 3.02 -1.26 -4.97 115.26 109.18 2zit n ASN 96 Ca 0.00 -0.71 -0.38 0.00 -0.03 0.00 0.00 54.58 53.46 2zit n ASN 96 Cb 0.00 1.19 -0.06 0.00 -0.61 0.00 0.00 39.78 40.30 2zit n ASN 96 CO 0.00 0.00 0.00 -0.44 -2.62 0.00 0.00 177.26 174.20 2zit s SER 97 N -3.00 7.16 -0.03 6.41 0.01 -1.26 -2.70 113.70 120.29 2zit s SER 97 Ca 0.04 1.43 0.01 0.00 1.31 0.00 0.00 55.95 58.74 2zit s SER 97 Cb 0.13 -2.42 0.01 0.00 0.21 0.00 0.00 66.02 63.95 2zit s SER 97 CO 0.73 0.16 -0.05 -0.36 0.41 0.00 0.00 173.24 174.14 2zit s PHE 98 N -1.29 0.65 -0.33 2.43 0.08 -0.00 -4.82 117.98 114.70 2zit s PHE 98 Ca 0.37 -0.15 -0.10 0.00 0.12 0.00 0.00 56.93 57.17 2zit s PHE 98 Cb -0.19 -0.54 0.01 0.00 -0.57 0.00 0.00 43.02 41.72 2zit s PHE 98 CO 0.22 -0.12 0.17 -1.17 -0.10 0.00 0.00 175.22 174.21 2zit s LEU 99 N 0.58 4.32 -0.23 -0.37 2.96 0.24 -2.04 118.68 124.13 2zit s LEU 99 Ca -0.07 -0.71 -0.09 0.00 -0.22 0.00 0.00 54.13 53.03 2zit s LEU 99 Cb -0.11 -2.00 -0.04 0.00 0.50 0.00 0.00 46.19 44.54 2zit s LEU 99 CO -0.00 -0.26 0.12 -0.63 -1.32 0.00 0.00 176.35 174.26 2zit s ILE 100 N 1.58 5.03 -0.47 6.68 1.01 0.61 -0.73 121.20 134.91 2zit s ILE 100 Ca 0.03 0.06 -0.13 0.00 0.00 0.00 0.00 60.65 60.61 2zit s ILE 100 Cb -0.18 -3.33 0.09 0.00 0.01 0.00 0.00 42.46 39.04 2zit s ILE 100 CO 0.06 0.36 0.37 0.20 0.00 0.00 0.00 174.94 175.93 2zit s ASN 101 N 1.07 5.98 -0.68 3.58 0.02 0.50 0.10 114.94 125.52 2zit s ASN 101 Ca 0.06 -1.48 -0.20 0.00 -1.02 0.00 0.00 52.86 50.21 2zit s ASN 101 Cb -0.14 -2.12 0.10 0.00 0.02 0.00 0.00 41.25 39.11 2zit s ASN 101 CO 0.04 -0.65 0.88 -0.22 0.02 0.00 0.00 177.10 177.17 2zit s LEU 102 N 1.56 4.94 0.13 0.60 2.96 0.50 -1.60 118.68 127.75 2zit s LEU 102 Ca 0.04 -1.36 -0.30 0.00 -0.22 0.00 0.00 54.13 52.29 2zit s LEU 102 Cb -0.25 -2.36 -0.07 0.00 0.50 0.00 0.00 46.19 44.01 2zit s LEU 102 CO 0.04 -1.24 1.12 -0.63 -1.32 0.00 0.00 176.35 174.32 2zit s ILE 103 N 3.23 4.01 0.58 6.68 -1.09 -0.32 -1.12 121.20 133.16 2zit s ILE 103 Ca 0.19 1.60 -0.19 0.00 -2.23 0.00 0.00 60.65 60.02 2zit s ILE 103 Cb -0.18 -4.02 -0.04 0.00 -1.58 0.00 0.00 42.46 36.63 2zit s ILE 103 CO 0.05 0.22 1.18 -0.62 -1.23 0.00 0.00 174.94 174.54 2zit s ASP 104 N 0.35 5.37 0.13 3.58 2.15 -0.13 -4.40 116.67 123.72 2zit s ASP 104 Ca 0.52 2.32 0.08 0.00 0.43 0.00 0.00 52.55 55.90 2zit s ASP 104 Cb -0.29 -2.59 -0.04 0.00 -0.30 0.00 0.00 42.92 39.70 2zit s ASP 104 CO 0.33 -1.46 -0.18 -0.44 -0.17 0.00 0.00 175.17 173.24 2zit s SER 105 N -1.65 2.42 1.22 -0.34 0.01 -1.26 -4.83 113.70 109.27 2zit s SER 105 Ca 0.76 -0.78 -0.14 0.00 1.31 0.00 0.00 55.95 57.10 2zit s SER 105 Cb -0.28 -0.12 0.30 0.00 0.21 0.00 0.00 66.02 66.13 2zit s SER 105 CO 0.31 -0.03 0.94 -2.65 0.41 0.00 0.00 173.24 172.22 2zit n PRO 106 N 0.66 -2.82 -0.07 12.44 -0.02 -1.26 -4.99 135.00 138.94 2zit n PRO 106 Ca -0.16 -0.80 -0.15 0.00 -2.02 0.00 0.00 63.50 60.37 2zit n PRO 106 Cb 0.56 -2.11 -0.14 0.00 -0.02 0.00 0.00 33.50 31.79 2zit n PRO 106 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2zit n GLY 107 N 1.20 -0.69 3.34 -1.23 0.00 -1.26 -4.98 105.19 101.57 2zit n GLY 107 Ca 0.03 -0.21 -0.24 0.00 0.00 0.00 0.00 46.02 45.60 2zit n GLY 107 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 2zit s HIS 108 N -2.54 1.93 0.45 1.61 5.65 -1.26 -4.60 115.29 116.53 2zit s HIS 108 Ca -0.20 -0.43 0.13 0.00 0.25 0.00 0.00 55.06 54.81 2zit s HIS 108 Cb 0.07 -0.99 1.00 0.00 -1.18 0.00 0.00 32.58 31.49 2zit s HIS 108 CO 0.74 0.33 2.02 0.28 -0.65 0.00 0.00 174.74 177.47 2zit h VAL 109 N 3.49 1.11 -1.20 0.89 2.07 -1.97 -2.93 116.25 117.70 2zit h VAL 109 Ca -0.44 -0.45 0.34 0.00 0.82 0.00 0.00 66.70 66.97 2zit h VAL 109 Cb 1.20 1.13 -0.06 0.00 -1.52 0.00 0.00 31.29 32.03 2zit h VAL 109 CO 0.47 0.14 0.84 0.44 0.02 0.00 0.00 177.57 179.48 2zit h ASP 110 N 0.11 0.11 0.00 0.57 3.32 -1.96 -1.72 116.42 116.85 2zit h ASP 110 Ca 0.03 0.03 -0.19 0.00 0.02 0.00 0.00 57.03 56.91 2zit h ASP 110 Cb 0.21 0.01 -0.06 0.00 0.22 0.00 0.00 39.33 39.71 2zit h ASP 110 CO 0.01 0.01 -0.03 0.49 -1.72 0.00 0.00 179.24 177.99 2zit n PHE 111 N -4.29 0.14 -0.28 4.55 3.72 -1.11 -4.63 117.46 115.56 2zit n PHE 111 Ca 0.27 -1.42 0.09 0.00 -0.05 0.00 0.00 57.45 56.34 2zit n PHE 111 Cb 1.22 -1.51 0.23 0.00 -0.94 0.00 0.00 39.48 38.48 2zit n PHE 111 CO 0.00 0.00 0.00 0.77 -0.05 0.00 0.00 176.76 177.48 2zit h SER 112 N 3.49 0.18 -0.40 4.37 0.02 -1.59 0.17 113.55 119.79 2zit h SER 112 Ca 0.21 0.14 -0.01 0.00 -0.84 0.00 0.00 61.79 61.29 2zit h SER 112 Cb 1.27 0.16 -0.02 0.00 0.14 0.00 0.00 62.40 63.94 2zit h SER 112 CO 0.36 0.00 0.21 0.28 -1.14 0.00 0.00 176.83 176.54 2zit h SER 113 N 0.35 0.50 0.30 3.07 0.02 -1.89 -2.37 113.55 113.55 2zit h SER 113 Ca 0.48 -0.10 -0.05 0.00 -0.84 0.00 0.00 61.79 61.28 2zit h SER 113 Cb 0.84 -0.13 -0.01 0.00 0.14 0.00 0.00 62.40 63.25 2zit h SER 113 CO -0.51 0.46 -0.25 -0.08 -1.14 0.00 0.00 176.83 175.31 2zit h GLU 114 N 0.51 0.00 0.15 3.45 4.81 -1.16 -2.57 114.58 119.77 2zit h GLU 114 Ca 0.14 0.00 -0.01 0.00 -0.13 0.00 0.00 59.36 59.36 2zit h GLU 114 Cb 0.07 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.45 2zit h GLU 114 CO -0.02 0.25 -0.07 0.28 -0.73 0.00 0.00 179.01 178.72 2zit h VAL 115 N 0.00 0.99 -0.32 0.32 2.07 -0.57 -3.14 116.25 115.60 2zit h VAL 115 Ca -0.00 -1.01 -0.00 0.00 0.82 0.00 0.00 66.70 66.51 2zit h VAL 115 Cb 0.48 1.58 -0.02 0.00 -1.52 0.00 0.00 31.29 31.81 2zit h VAL 115 CO 0.03 0.22 0.20 0.74 0.02 0.00 0.00 177.57 178.78 2zit h THR 116 N -0.72 1.09 -0.45 2.57 2.02 -1.34 -2.26 112.91 113.82 2zit h THR 116 Ca -0.02 -0.20 -0.01 0.00 0.77 0.00 0.00 66.41 66.96 2zit h THR 116 Cb 0.51 0.63 -0.02 0.00 -1.74 0.00 0.00 68.15 67.54 2zit h THR 116 CO 0.03 0.09 0.26 0.00 0.37 0.00 0.00 175.52 176.27 2zit h ALA 117 N 1.78 0.58 -0.41 6.16 0.00 -1.50 -1.44 119.26 124.42 2zit h ALA 117 Ca 0.12 -0.08 -0.10 0.00 0.00 0.00 0.00 54.91 54.85 2zit h ALA 117 Cb -0.02 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.57 2zit h ALA 117 CO -0.02 0.09 -0.12 0.00 0.00 0.00 0.00 179.25 179.20 2zit h ALA 118 N 1.11 0.57 -0.24 0.00 0.00 -1.38 -3.16 119.26 116.16 2zit h ALA 118 Ca 0.16 -0.33 -0.07 0.00 0.00 0.00 0.00 54.91 54.67 2zit h ALA 118 Cb 0.03 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.66 2zit h ALA 118 CO -0.03 0.46 -0.16 -0.07 0.00 0.00 0.00 179.25 179.46 2zit h LEU 119 N 0.63 0.39 -0.29 0.00 3.38 -1.24 -3.00 115.31 115.18 2zit h LEU 119 Ca 0.10 -0.10 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2zit h LEU 119 Cb 0.65 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 41.30 2zit h LEU 119 CO 0.04 0.57 0.00 -1.14 0.09 0.00 0.00 178.44 178.01 2zit n ARG 120 N -4.20 0.12 -0.08 1.13 0.63 -0.56 -2.11 116.66 111.59 2zit n ARG 120 Ca 0.00 0.29 0.06 0.00 -0.92 0.00 0.00 57.85 57.27 2zit n ARG 120 Cb 0.33 -1.70 0.10 0.00 0.45 0.00 0.00 32.46 31.63 2zit n ARG 120 CO 0.00 0.00 0.00 1.33 -2.51 0.00 0.00 177.63 176.45 2zit n VAL 121 N -1.92 0.44 -3.86 5.15 0.24 -1.14 -4.99 118.33 112.25 2zit n VAL 121 Ca 0.04 -0.72 -0.22 0.00 -2.04 0.00 0.00 64.34 61.40 2zit n VAL 121 Cb 0.25 0.91 -0.04 0.00 -1.47 0.00 0.00 33.84 33.49 2zit n VAL 121 CO 0.00 0.00 0.00 0.42 -2.14 0.00 0.00 176.83 175.11 2zit s THR 122 N -0.98 3.40 0.00 3.34 -4.23 -0.90 -4.83 115.64 111.45 2zit s THR 122 Ca 0.18 -1.43 0.00 0.00 -1.18 0.00 0.00 61.69 59.26 2zit s THR 122 Cb 0.11 -3.14 0.00 0.00 1.34 0.00 0.00 72.50 70.81 2zit s THR 122 CO 0.15 -0.17 0.00 0.47 -0.54 0.00 0.00 174.62 174.53 2zit n ASP 123 N -1.34 4.63 -4.43 3.99 10.43 0.17 -4.92 116.55 125.09 2zit n ASP 123 Ca -0.02 0.00 -0.21 0.00 2.57 0.00 0.00 54.79 57.13 2zit n ASP 123 Cb 0.60 0.41 -0.10 0.00 1.84 0.00 0.00 41.12 43.87 2zit n ASP 123 CO 0.00 0.00 0.00 -0.83 -1.07 0.00 0.00 177.20 175.30 2zit s GLY 124 N -3.06 1.85 -0.00 0.44 0.00 -0.76 -1.93 107.32 103.86 2zit s GLY 124 Ca 0.00 -1.91 0.01 0.00 0.00 0.00 0.00 44.72 42.81 2zit s GLY 124 CO 0.00 -1.85 -0.02 0.00 0.00 0.00 0.00 173.10 171.23 2zit s ALA 125 N -3.00 0.21 -0.73 3.20 0.00 0.09 -2.71 121.76 118.83 2zit s ALA 125 Ca 0.30 -0.10 -0.13 0.00 0.00 0.00 0.00 51.96 52.03 2zit s ALA 125 Cb 0.04 -0.06 0.19 0.00 0.00 0.00 0.00 23.12 23.28 2zit s ALA 125 CO 0.12 0.05 0.65 -1.17 0.00 0.00 0.00 175.76 175.41 2zit s LEU 126 N -0.02 6.40 -0.02 0.00 2.96 -0.20 -0.85 118.68 126.95 2zit s LEU 126 Ca 0.01 -2.50 -0.29 0.00 -0.22 0.00 0.00 54.13 51.13 2zit s LEU 126 Cb -0.01 -2.15 -0.03 0.00 0.50 0.00 0.00 46.19 44.49 2zit s LEU 126 CO -0.00 -0.61 0.93 -0.69 -1.32 0.00 0.00 176.35 174.66 2zit s VAL 127 N 0.47 4.90 -0.23 1.68 1.01 0.46 -2.02 120.40 126.67 2zit s VAL 127 Ca 0.14 1.94 -0.05 0.00 0.00 0.00 0.00 61.98 64.01 2zit s VAL 127 Cb -0.16 -4.26 -0.01 0.00 0.00 0.00 0.00 36.38 31.94 2zit s VAL 127 CO -0.06 0.17 -0.02 -0.69 0.00 0.00 0.00 175.10 174.50 2zit s VAL 128 N 1.03 3.56 0.04 2.92 1.01 -0.15 -1.34 120.40 127.48 2zit s VAL 128 Ca 0.49 -0.43 0.08 0.00 0.00 0.00 0.00 61.98 62.12 2zit s VAL 128 Cb -0.20 -2.64 -0.03 0.00 0.00 0.00 0.00 36.38 33.51 2zit s VAL 128 CO 0.25 0.40 -0.22 -0.69 0.00 0.00 0.00 175.10 174.84 2zit s VAL 129 N 1.51 2.47 0.54 2.92 1.01 -1.01 -4.59 120.40 123.24 2zit s VAL 129 Ca 0.06 -1.29 -0.18 0.00 0.00 0.00 0.00 61.98 60.57 2zit s VAL 129 Cb -0.14 -2.00 -0.06 0.00 0.00 0.00 0.00 36.38 34.17 2zit s VAL 129 CO -0.02 0.35 1.04 -0.62 0.00 0.00 0.00 175.10 175.85 2zit s ASP 130 N -1.34 6.12 -0.03 3.32 2.15 -1.12 0.42 116.67 126.19 2zit s ASP 130 Ca 0.13 1.84 -0.07 0.00 0.43 0.00 0.00 52.55 54.88 2zit s ASP 130 Cb -0.10 -2.54 -0.04 0.00 -0.30 0.00 0.00 42.92 39.94 2zit s ASP 130 CO 0.04 -0.93 0.44 0.74 -0.17 0.00 0.00 175.17 175.28 2zit h THR 131 N 0.99 0.00 0.22 1.71 2.02 -1.54 -2.59 112.91 113.72 2zit h THR 131 Ca -0.48 -0.39 -0.01 0.00 0.77 0.00 0.00 66.41 66.30 2zit h THR 131 Cb 1.22 0.00 0.00 0.00 -1.74 0.00 0.00 68.15 67.63 2zit h THR 131 CO 0.59 0.00 -0.11 0.40 0.37 0.00 0.00 175.52 176.77 2zit h ILE 132 N -0.65 0.00 -0.56 3.11 5.03 -1.86 -3.30 117.51 119.29 2zit h ILE 132 Ca -0.03 -0.01 -0.09 0.00 -0.12 0.00 0.00 64.86 64.61 2zit h ILE 132 Cb 0.20 0.00 -0.02 0.00 -3.03 0.00 0.00 36.82 33.97 2zit h ILE 132 CO 0.04 0.00 -0.01 -0.33 -0.68 0.00 0.00 178.15 177.17 2zit h GLU 133 N -0.32 0.97 0.00 2.37 5.08 -1.99 -3.49 114.58 117.21 2zit h GLU 133 Ca -0.03 -0.30 0.00 0.00 -1.00 0.00 0.00 59.36 58.03 2zit h GLU 133 Cb 0.23 -0.09 0.00 0.00 0.50 0.00 0.00 28.75 29.39 2zit h GLU 133 CO 0.05 0.96 0.00 0.41 -1.00 0.00 0.00 179.01 179.43 2zit n GLY 134 N -0.48 0.53 3.65 -3.84 0.00 -0.98 -4.82 105.19 99.26 2zit n GLY 134 Ca 0.03 -1.05 -0.43 0.00 0.00 0.00 0.00 46.02 44.57 2zit n GLY 134 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2zit s VAL 135 N 0.00 4.53 0.36 1.61 1.01 -1.26 -2.80 120.40 123.85 2zit s VAL 135 Ca 0.00 1.81 -0.09 0.00 0.00 0.00 0.00 61.98 63.71 2zit s VAL 135 Cb 0.00 -4.31 -0.06 0.00 0.00 0.00 0.00 36.38 32.01 2zit s VAL 135 CO 0.00 -0.31 0.70 0.00 0.00 0.00 0.00 175.10 175.48 2zit h VAL 137 N 1.21 0.64 0.26 0.00 2.07 -1.93 -1.46 116.25 117.05 2zit h VAL 137 Ca -0.47 -0.05 -0.01 0.00 0.82 0.00 0.00 66.70 66.98 2zit h VAL 137 Cb 1.19 1.03 0.00 0.00 -1.52 0.00 0.00 31.29 31.99 2zit h VAL 137 CO 0.65 0.01 -0.13 -0.61 0.02 0.00 0.00 177.57 177.51 2zit h GLN 138 N 0.00 -0.34 -0.47 1.57 4.15 -1.93 -2.51 115.11 115.58 2zit h GLN 138 Ca -0.00 0.02 -0.01 0.00 0.77 0.00 0.00 58.65 59.43 2zit h GLN 138 Cb 0.03 0.08 -0.02 0.00 0.21 0.00 0.00 27.48 27.78 2zit h GLN 138 CO 0.00 0.01 0.24 1.15 -1.93 0.00 0.00 178.83 178.30 2zit h THR 139 N -0.88 1.15 -0.18 2.39 2.02 -1.91 -1.76 112.91 113.76 2zit h THR 139 Ca -0.04 -0.41 -0.02 0.00 0.77 0.00 0.00 66.41 66.71 2zit h THR 139 Cb 0.51 0.55 -0.01 0.00 -1.74 0.00 0.00 68.15 67.46 2zit h THR 139 CO 0.06 0.17 0.02 -0.08 0.37 0.00 0.00 175.52 176.06 2zit h GLU 140 N 0.65 0.25 0.00 6.66 4.81 -1.28 -0.68 114.58 124.99 2zit h GLU 140 Ca 0.17 -0.03 -0.00 0.00 -0.13 0.00 0.00 59.36 59.36 2zit h GLU 140 Cb 0.05 -0.05 0.00 0.00 0.63 0.00 0.00 28.75 29.38 2zit h GLU 140 CO -0.02 0.26 -0.00 1.15 -0.73 0.00 0.00 179.01 179.67 2zit h THR 141 N 0.25 1.70 -1.00 0.32 2.02 -0.87 -2.81 112.91 112.53 2zit h THR 141 Ca 0.06 -2.07 0.04 0.00 0.77 0.00 0.00 66.41 65.21 2zit h THR 141 Cb 0.14 3.10 -0.06 0.00 -1.74 0.00 0.00 68.15 69.60 2zit h THR 141 CO 0.00 0.54 0.66 0.58 0.37 0.00 0.00 175.52 177.66 2zit h VAL 142 N -0.88 1.18 -0.84 3.16 2.07 -1.34 -1.29 116.25 118.30 2zit h VAL 142 Ca -0.00 -0.44 -0.00 0.00 0.82 0.00 0.00 66.70 67.08 2zit h VAL 142 Cb 0.88 -0.21 -0.04 0.00 -1.52 0.00 0.00 31.29 30.40 2zit h VAL 142 CO 0.00 0.23 0.52 0.25 0.02 0.00 0.00 177.57 178.60 2zit h LEU 143 N 1.27 1.00 -1.39 2.57 5.85 -1.21 -0.60 115.31 122.80 2zit h LEU 143 Ca 0.40 -0.05 0.00 0.00 0.84 0.00 0.00 57.88 59.07 2zit h LEU 143 Cb -0.01 -0.25 -0.03 0.00 0.37 0.00 0.00 40.66 40.74 2zit h LEU 143 CO -0.12 0.75 0.39 -0.09 -0.34 0.00 0.00 178.44 179.02 2zit h ARG 144 N 1.16 0.80 0.01 1.25 2.43 -0.97 -0.11 114.38 118.95 2zit h ARG 144 Ca 0.31 -0.05 -0.23 0.00 -0.81 0.00 0.00 59.98 59.19 2zit h ARG 144 Cb -0.08 -0.18 0.00 0.00 -0.42 0.00 0.00 29.97 29.30 2zit h ARG 144 CO -0.06 0.54 -0.97 1.96 -1.51 0.00 0.00 179.97 179.93 2zit h GLN 145 N 0.82 0.42 -0.70 0.20 1.08 -0.89 -2.79 115.11 113.25 2zit h GLN 145 Ca 0.22 -0.47 -0.06 0.00 -1.45 0.00 0.00 58.65 56.89 2zit h GLN 145 Cb -0.07 0.14 -0.03 0.00 -0.05 0.00 0.00 27.48 27.46 2zit h GLN 145 CO -0.05 1.13 0.21 0.00 -0.95 0.00 0.00 178.83 179.17 2zit h ALA 146 N 0.70 1.04 0.00 3.87 0.00 -0.53 -1.53 119.26 122.82 2zit h ALA 146 Ca -0.09 -0.22 -0.01 0.00 0.00 0.00 0.00 54.91 54.59 2zit h ALA 146 Cb 1.61 -0.27 -0.00 0.00 0.00 0.00 0.00 17.79 19.13 2zit h ALA 146 CO 0.17 0.64 -0.02 -0.07 0.00 0.00 0.00 179.25 179.97 2zit h LEU 147 N 1.04 0.00 -0.41 0.00 3.38 -1.01 -0.11 115.31 118.21 2zit h LEU 147 Ca 0.23 0.00 -0.16 0.00 0.09 0.00 0.00 57.88 58.03 2zit h LEU 147 Cb 0.31 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.03 2zit h LEU 147 CO -0.01 0.02 -0.78 1.23 0.09 0.00 0.00 178.44 179.00 2zit h GLY 148 N 1.45 0.00 -0.20 0.83 0.00 -1.01 -3.00 103.07 101.14 2zit h GLY 148 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 2zit h GLY 148 CO 0.00 0.00 -0.01 1.18 0.00 0.00 0.00 176.54 177.71 2zit n GLU 149 N -3.57 1.52 -3.20 4.80 -0.58 -0.71 -4.92 120.64 113.98 2zit n GLU 149 Ca -0.01 -0.80 -0.15 0.00 -0.42 0.00 0.00 57.16 55.79 2zit n GLU 149 Cb 0.76 -1.48 0.05 0.00 -0.57 0.00 0.00 31.44 30.20 2zit n GLU 149 CO 0.00 0.00 0.00 0.54 -0.48 0.00 0.00 177.13 177.19 2zit n ARG 150 N -0.04 -5.21 -3.02 3.49 1.74 -0.93 -4.96 116.66 107.72 2zit n ARG 150 Ca 0.19 0.55 -0.40 0.00 -0.77 0.00 0.00 57.85 57.43 2zit n ARG 150 Cb 0.32 -4.75 -0.05 0.00 -1.02 0.00 0.00 32.46 26.96 2zit n ARG 150 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 2zit s ILE 151 N -3.22 4.92 -0.18 0.55 -1.09 -0.14 -4.94 121.20 117.12 2zit s ILE 151 Ca 0.34 1.52 -0.26 0.00 -2.23 0.00 0.00 60.65 60.03 2zit s ILE 151 Cb -0.15 -4.07 -0.01 0.00 -1.58 0.00 0.00 42.46 36.65 2zit s ILE 151 CO 0.49 0.30 0.86 -0.75 -1.23 0.00 0.00 174.94 174.60 2zit s LYS 152 N 0.43 4.29 0.37 2.79 2.20 -0.81 -4.51 119.74 124.50 2zit s LYS 152 Ca 0.38 1.06 -0.24 0.00 -0.36 0.00 0.00 55.97 56.81 2zit s LYS 152 Cb -0.19 -3.58 -0.10 0.00 -1.51 0.00 0.00 37.83 32.45 2zit s LYS 152 CO 0.20 -0.36 0.95 -2.14 -0.36 0.00 0.00 175.35 173.64 2zit s PRO 153 N 2.27 4.42 -0.10 4.03 0.02 -1.26 -0.73 135.00 143.65 2zit s PRO 153 Ca 0.39 1.24 -0.03 0.00 0.02 0.00 0.00 61.00 62.62 2zit s PRO 153 Cb -0.16 -2.53 0.04 0.00 0.02 0.00 0.00 34.50 31.87 2zit s PRO 153 CO 0.12 0.14 0.06 0.08 -0.33 0.00 0.00 177.00 177.07 2zit s VAL 154 N -1.86 0.01 0.11 3.83 1.01 -0.03 -4.88 120.40 118.58 2zit s VAL 154 Ca 0.55 0.10 -0.11 0.00 0.00 0.00 0.00 61.98 62.53 2zit s VAL 154 Cb -0.14 -0.42 -0.06 0.00 0.00 0.00 0.00 36.38 35.75 2zit s VAL 154 CO 0.19 -0.01 0.45 -0.69 0.00 0.00 0.00 175.10 175.04 2zit s VAL 155 N 2.11 5.03 -0.24 2.92 1.01 -1.09 -0.40 120.40 129.73 2zit s VAL 155 Ca 0.03 0.53 -0.03 0.00 0.00 0.00 0.00 61.98 62.51 2zit s VAL 155 Cb -0.14 -3.67 0.10 0.00 0.00 0.00 0.00 36.38 32.67 2zit s VAL 155 CO -0.06 0.24 0.20 0.54 0.00 0.00 0.00 175.10 176.02 2zit s VAL 156 N -1.46 -0.25 -0.05 2.92 0.11 -0.45 -1.33 120.40 119.89 2zit s VAL 156 Ca 0.36 -0.34 -0.30 0.00 -2.93 0.00 0.00 61.98 58.77 2zit s VAL 156 Cb -0.14 -0.79 -0.06 0.00 -1.53 0.00 0.00 36.38 33.86 2zit s VAL 156 CO 0.19 -0.39 1.65 -0.63 -3.33 0.00 0.00 175.10 172.59 2zit s ILE 157 N 2.25 3.58 0.44 7.04 1.09 0.37 -2.40 121.20 133.57 2zit s ILE 157 Ca 0.07 0.71 0.07 0.00 -1.10 0.00 0.00 60.65 60.40 2zit s ILE 157 Cb -0.15 -3.46 -0.03 0.00 -1.06 0.00 0.00 42.46 37.76 2zit s ILE 157 CO -0.21 -0.06 0.27 0.21 -0.10 0.00 0.00 174.94 175.04 2zit s ASN 158 N 3.29 4.63 -1.35 3.58 2.47 0.17 -2.19 114.94 125.54 2zit s ASN 158 Ca 0.73 -1.03 -0.06 0.00 0.42 0.00 0.00 52.86 52.92 2zit s ASN 158 Cb -0.33 -0.33 0.02 0.00 -1.45 0.00 0.00 41.25 39.16 2zit s ASN 158 CO 0.29 -0.68 1.02 0.29 -3.72 0.00 0.00 177.10 174.30 2zit n LYS 159 N -1.42 -6.63 0.05 0.43 5.02 -1.16 -1.70 118.16 112.75 2zit n LYS 159 Ca -0.00 0.75 -0.12 0.00 -2.02 0.00 0.00 58.31 56.92 2zit n LYS 159 Cb 0.64 -5.68 -0.01 0.00 -0.02 0.00 0.00 35.03 29.95 2zit n LYS 159 CO 0.00 0.00 0.00 0.28 -0.52 0.00 0.00 177.40 177.16 2zit h VAL 160 N -2.24 1.37 -0.70 -0.18 2.07 -1.78 -3.19 116.25 111.60 2zit h VAL 160 Ca -0.58 -2.22 0.14 0.00 0.82 0.00 0.00 66.70 64.85 2zit h VAL 160 Cb 1.36 2.20 -0.04 0.00 -1.52 0.00 0.00 31.29 33.28 2zit h VAL 160 CO 0.57 0.67 0.47 -2.24 0.02 0.00 0.00 177.57 177.06 2zit h ASP 161 N 0.30 0.36 -0.71 0.57 2.03 -1.91 0.18 116.42 117.25 2zit h ASP 161 Ca -0.05 0.02 0.00 0.00 -0.73 0.00 0.00 57.03 56.27 2zit h ASP 161 Cb 1.41 -0.06 -0.04 0.00 -0.83 0.00 0.00 39.33 39.82 2zit h ASP 161 CO 0.14 0.20 0.45 0.03 -1.03 0.00 0.00 179.24 179.03 2zit h ARG 162 N 0.39 0.95 0.00 4.15 3.08 -1.95 0.17 114.38 121.18 2zit h ARG 162 Ca 0.34 -0.07 0.00 0.00 0.07 0.00 0.00 59.98 60.32 2zit h ARG 162 Cb 0.78 -0.21 0.00 0.00 0.08 0.00 0.00 29.97 30.62 2zit h ARG 162 CO -0.10 0.65 0.00 0.00 -1.07 0.00 0.00 179.97 179.45 2zit h ALA 163 N 1.52 1.00 0.01 0.04 0.00 -1.10 -1.92 119.26 118.82 2zit h ALA 163 Ca 0.26 0.00 -0.39 0.00 0.00 0.00 0.00 54.91 54.78 2zit h ALA 163 Cb -0.07 0.00 -0.06 0.00 0.00 0.00 0.00 17.79 17.66 2zit h ALA 163 CO -0.05 0.00 -2.14 1.28 0.00 0.00 0.00 179.25 178.34 2zit n LEU 164 N -2.80 2.08 0.13 0.00 4.77 -0.58 -3.24 117.00 117.37 2zit n LEU 164 Ca 0.02 0.31 0.12 0.00 -0.03 0.00 0.00 56.01 56.42 2zit n LEU 164 Cb 0.32 -0.89 0.09 0.00 -2.33 0.00 0.00 43.42 40.60 2zit n LEU 164 CO 0.26 0.55 0.32 -0.07 -1.33 0.00 0.00 177.39 177.11 2zit h LEU 165 N -0.83 0.00 0.00 2.23 4.07 -1.09 -2.86 115.31 116.83 2zit h LEU 165 Ca -0.57 -0.03 -0.22 0.00 0.08 0.00 0.00 57.88 57.14 2zit h LEU 165 Cb 1.58 0.00 -0.03 0.00 1.08 0.00 0.00 40.66 43.29 2zit h LEU 165 CO -0.30 0.02 -1.72 -0.62 -1.08 0.00 0.00 178.44 174.74 2zit n GLU 166 N -2.69 0.56 0.10 1.13 1.02 -0.72 -4.65 120.64 115.38 2zit n GLU 166 Ca 0.02 0.24 0.12 0.00 -0.02 0.00 0.00 57.16 57.51 2zit n GLU 166 Cb 0.52 -1.46 0.14 0.00 -0.02 0.00 0.00 31.44 30.62 2zit n GLU 166 CO 0.00 0.00 0.00 -0.07 1.18 0.00 0.00 177.13 178.24 2zit h LEU 167 N -1.00 0.00 -3.20 -4.62 3.38 -1.66 -3.49 115.31 104.73 2zit h LEU 167 Ca -0.33 -0.10 -0.35 0.00 0.09 0.00 0.00 57.88 57.20 2zit h LEU 167 Cb 1.28 0.00 0.03 0.00 0.09 0.00 0.00 40.66 42.07 2zit h LEU 167 CO -0.20 0.05 -0.75 0.00 0.09 0.00 0.00 178.44 177.63 2zit n GLN 168 N -2.44 -1.31 -3.86 1.13 6.02 -1.08 -4.97 117.38 110.88 2zit n GLN 168 Ca 0.03 0.81 -0.22 0.00 -0.01 0.00 0.00 57.00 57.60 2zit n GLN 168 Cb 0.49 -3.90 -0.02 0.00 1.02 0.00 0.00 30.24 27.83 2zit n GLN 168 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.06 176.59 2zit s VAL 169 N -3.19 5.24 0.73 5.09 0.11 -1.20 -5.06 120.40 122.12 2zit s VAL 169 Ca 0.20 -0.83 -0.09 0.00 -2.93 0.00 0.00 61.98 58.34 2zit s VAL 169 Cb -0.08 -3.84 0.06 0.00 -1.53 0.00 0.00 36.38 31.00 2zit s VAL 169 CO 0.85 -0.32 1.07 -0.94 -3.33 0.00 0.00 175.10 172.42 2zit s SER 170 N -3.84 4.80 0.30 3.54 1.04 -1.26 -4.90 113.70 113.37 2zit s SER 170 Ca 0.35 0.61 -0.01 0.00 0.48 0.00 0.00 55.95 57.38 2zit s SER 170 Cb -0.09 -1.24 0.45 0.00 0.10 0.00 0.00 66.02 65.23 2zit s SER 170 CO 0.30 -1.65 1.93 0.11 0.98 0.00 0.00 173.24 174.91 2zit h LYS 171 N -0.72 1.00 0.27 4.02 1.57 -1.96 -1.97 116.57 118.77 2zit h LYS 171 Ca -0.45 -0.09 -0.01 0.00 -1.87 0.00 0.00 60.65 58.22 2zit h LYS 171 Cb 1.31 -0.21 0.00 0.00 0.08 0.00 0.00 32.23 33.42 2zit h LYS 171 CO 0.62 0.71 -0.13 1.49 -0.57 0.00 0.00 179.45 181.58 2zit h GLU 172 N 1.01 -0.35 -0.81 3.15 4.57 -1.97 -1.68 114.58 118.50 2zit h GLU 172 Ca 0.26 0.02 0.03 0.00 -1.18 0.00 0.00 59.36 58.50 2zit h GLU 172 Cb -0.01 0.08 -0.05 0.00 -0.16 0.00 0.00 28.75 28.61 2zit h GLU 172 CO -0.05 -0.00 0.53 -0.44 -1.18 0.00 0.00 179.01 177.87 2zit h ASP 173 N -0.78 0.86 -0.83 1.04 3.32 -1.95 0.26 116.42 118.34 2zit h ASP 173 Ca -0.04 -0.01 -0.02 0.00 0.02 0.00 0.00 57.03 56.98 2zit h ASP 173 Cb 0.51 -0.20 -0.04 0.00 0.22 0.00 0.00 39.33 39.82 2zit h ASP 173 CO 0.06 0.59 0.45 0.25 -1.72 0.00 0.00 179.24 178.87 2zit h LEU 174 N 1.00 1.05 -0.20 1.55 5.85 -1.33 -0.62 115.31 122.61 2zit h LEU 174 Ca 0.32 -0.10 -0.07 0.00 0.84 0.00 0.00 57.88 58.88 2zit h LEU 174 Cb 0.03 -0.27 -0.00 0.00 0.37 0.00 0.00 40.66 40.79 2zit h LEU 174 CO -0.09 0.85 -0.13 0.22 -0.34 0.00 0.00 178.44 178.95 2zit h TYR 175 N 1.18 0.52 0.00 1.25 3.20 -0.16 -2.80 116.97 120.16 2zit h TYR 175 Ca 0.29 -0.14 -0.00 0.00 3.14 0.00 0.00 58.73 62.02 2zit h TYR 175 Cb 0.04 -0.12 -0.00 0.00 1.54 0.00 0.00 36.73 38.20 2zit h TYR 175 CO 0.01 0.76 -0.01 1.96 -1.64 0.00 0.00 178.16 179.24 2zit h GLN 176 N 0.13 0.00 0.01 1.82 1.08 -0.19 -0.28 115.11 117.67 2zit h GLN 176 Ca 0.04 0.00 -0.27 0.00 -1.45 0.00 0.00 58.65 56.97 2zit h GLN 176 Cb 0.64 0.00 0.02 0.00 -0.05 0.00 0.00 27.48 28.09 2zit h GLN 176 CO 0.04 0.01 -1.05 1.15 -0.95 0.00 0.00 178.83 178.03 2zit h THR 177 N 0.00 1.28 -0.29 -0.54 2.02 -0.97 -2.31 112.91 112.10 2zit h THR 177 Ca -0.00 -2.25 -0.10 0.00 0.77 0.00 0.00 66.41 64.83 2zit h THR 177 Cb 0.04 2.40 -0.01 0.00 -1.74 0.00 0.00 68.15 68.83 2zit h THR 177 CO 0.00 0.70 -0.23 -0.26 0.37 0.00 0.00 175.52 176.10 2zit h PHE 178 N 0.39 0.62 -0.54 3.16 0.04 -1.00 0.99 116.94 120.60 2zit h PHE 178 Ca -0.13 -0.13 -0.08 0.00 2.80 0.00 0.00 57.97 60.43 2zit h PHE 178 Cb 1.70 -0.15 -0.02 0.00 2.20 0.00 0.00 35.95 39.68 2zit h PHE 178 CO 0.10 0.74 0.02 0.00 -0.60 0.00 0.00 178.31 178.57 2zit h ALA 179 N 1.27 0.72 -0.00 2.45 0.00 -1.10 0.95 119.26 123.54 2zit h ALA 179 Ca 0.07 -0.28 -0.17 0.00 0.00 0.00 0.00 54.91 54.53 2zit h ALA 179 Cb 0.66 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 18.23 2zit h ALA 179 CO 0.05 0.52 -0.79 0.00 0.00 0.00 0.00 179.25 179.03 2zit h ARG 180 N 0.81 0.08 0.12 0.00 3.08 -1.23 -1.70 114.38 115.54 2zit h ARG 180 Ca 0.16 -0.08 -0.01 0.00 0.07 0.00 0.00 59.98 60.12 2zit h ARG 180 Cb 0.50 0.02 0.00 0.00 0.08 0.00 0.00 29.97 30.57 2zit h ARG 180 CO 0.02 0.82 -0.06 1.15 -1.07 0.00 0.00 179.97 180.84 2zit h THR 181 N 0.05 1.08 -0.72 2.04 2.02 -0.63 -0.78 112.91 115.97 2zit h THR 181 Ca -0.02 -1.03 0.06 0.00 0.77 0.00 0.00 66.41 66.19 2zit h THR 181 Cb 1.38 1.71 -0.04 0.00 -1.74 0.00 0.00 68.15 69.45 2zit h THR 181 CO 0.11 0.24 0.47 0.58 0.37 0.00 0.00 175.52 177.29 2zit h VAL 182 N -0.66 1.03 -0.10 3.16 2.07 -0.88 -1.77 116.25 119.11 2zit h VAL 182 Ca -0.02 -0.26 -0.01 0.00 0.82 0.00 0.00 66.70 67.23 2zit h VAL 182 Cb 0.51 0.20 -0.00 0.00 -1.52 0.00 0.00 31.29 30.48 2zit h VAL 182 CO 0.03 0.14 0.03 -0.08 0.02 0.00 0.00 177.57 177.71 2zit h GLU 183 N 0.76 0.16 -0.89 1.57 4.57 -1.25 -0.35 114.58 119.15 2zit h GLU 183 Ca 0.31 -0.03 0.14 0.00 -1.18 0.00 0.00 59.36 58.59 2zit h GLU 183 Cb 0.23 -0.02 -0.07 0.00 -0.16 0.00 0.00 28.75 28.73 2zit h GLU 183 CO -0.10 0.30 0.57 0.77 -1.18 0.00 0.00 179.01 179.38 2zit h SER 184 N -0.02 0.66 -0.07 1.04 0.02 -0.44 0.71 113.55 115.44 2zit h SER 184 Ca 0.03 0.04 -0.05 0.00 -0.84 0.00 0.00 61.79 60.97 2zit h SER 184 Cb 0.21 -0.09 0.00 0.00 0.14 0.00 0.00 62.40 62.66 2zit h SER 184 CO -0.00 0.34 -0.14 0.58 -1.14 0.00 0.00 176.83 176.47 2zit h VAL 185 N 0.70 1.41 0.00 2.27 2.07 -1.06 -3.23 116.25 118.40 2zit h VAL 185 Ca 0.44 -1.43 -0.04 0.00 0.82 0.00 0.00 66.70 66.49 2zit h VAL 185 Cb 0.69 2.17 -0.01 0.00 -1.52 0.00 0.00 31.29 32.63 2zit h VAL 185 CO -0.20 0.40 -0.19 0.78 0.02 0.00 0.00 177.57 178.38 2zit h ASN 186 N -0.25 0.00 -0.32 0.57 2.35 -0.24 -1.55 115.58 116.14 2zit h ASN 186 Ca 0.00 0.00 -0.06 0.00 -0.55 0.00 0.00 56.30 55.69 2zit h ASN 186 Cb 0.72 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 39.07 2zit h ASN 186 CO 0.03 0.19 0.00 0.58 -1.65 0.00 0.00 177.43 176.58 2zit h VAL 187 N 0.00 1.22 0.00 2.81 2.07 -0.92 -1.82 116.25 119.61 2zit h VAL 187 Ca -0.00 -0.91 -0.01 0.00 0.82 0.00 0.00 66.70 66.60 2zit h VAL 187 Cb 0.46 0.90 0.00 0.00 -1.52 0.00 0.00 31.29 31.14 2zit h VAL 187 CO 0.02 0.32 -0.03 0.40 0.02 0.00 0.00 177.57 178.30 2zit h ILE 188 N 0.64 1.64 0.55 4.57 2.04 -1.37 -3.12 117.51 122.45 2zit h ILE 188 Ca 0.13 -1.92 -0.02 0.00 1.00 0.00 0.00 64.86 64.05 2zit h ILE 188 Cb 0.40 2.94 -0.02 0.00 -0.74 0.00 0.00 36.82 39.40 2zit h ILE 188 CO 0.01 0.50 -0.45 0.58 0.00 0.00 0.00 178.15 178.80 2zit h VAL 189 N -0.78 0.11 -0.67 1.67 2.07 -1.28 -1.43 116.25 115.94 2zit h VAL 189 Ca -0.00 0.00 0.07 0.00 0.82 0.00 0.00 66.70 67.58 2zit h VAL 189 Cb 0.84 0.11 -0.04 0.00 -1.52 0.00 0.00 31.29 30.68 2zit h VAL 189 CO 0.01 0.00 0.45 0.77 0.02 0.00 0.00 177.57 178.81 2zit h SER 190 N -0.98 0.59 -0.25 0.57 4.64 -1.50 0.14 113.55 116.77 2zit h SER 190 Ca -0.06 0.00 -0.18 0.00 -0.47 0.00 0.00 61.79 61.08 2zit h SER 190 Cb 0.83 -0.12 -0.00 0.00 -0.31 0.00 0.00 62.40 62.79 2zit h SER 190 CO -0.01 0.38 -0.52 0.74 -0.87 0.00 0.00 176.83 176.56 2zit h THR 191 N 0.67 1.28 -0.01 2.95 2.02 -1.40 -3.35 112.91 115.07 2zit h THR 191 Ca 0.29 -1.71 0.00 0.00 0.77 0.00 0.00 66.41 65.77 2zit h THR 191 Cb 0.29 1.60 0.00 0.00 -1.74 0.00 0.00 68.15 68.30 2zit h THR 191 CO -0.09 0.56 -0.22 -1.22 0.37 0.00 0.00 175.52 174.91 2zit n TYR 192 N -4.01 0.00 -2.98 3.16 4.01 -0.57 -4.33 117.16 112.45 2zit n TYR 192 Ca -0.04 0.00 -0.35 0.00 -0.16 0.00 0.00 57.90 57.35 2zit n TYR 192 Cb 0.61 0.00 -0.06 0.00 -0.31 0.00 0.00 39.34 39.57 2zit n TYR 192 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 2zit s ALA 193 N -1.36 3.28 0.17 -0.72 0.00 0.47 -4.68 121.76 118.91 2zit s ALA 193 Ca 0.08 0.27 -0.31 0.00 0.00 0.00 0.00 51.96 52.00 2zit s ALA 193 Cb 0.08 -2.96 -0.09 0.00 0.00 0.00 0.00 23.12 20.15 2zit s ALA 193 CO 0.25 0.25 1.41 -0.51 0.00 0.00 0.00 175.76 177.17 2zit s ASP 194 N -1.86 6.77 0.43 0.00 1.11 -1.26 -4.90 116.67 116.95 2zit s ASP 194 Ca 0.50 2.46 0.30 0.00 0.18 0.00 0.00 52.55 55.99 2zit s ASP 194 Cb -0.15 -2.60 1.29 0.00 1.07 0.00 0.00 42.92 42.53 2zit s ASP 194 CO 0.20 -0.67 1.89 -0.33 1.18 0.00 0.00 175.17 177.44 2zit h GLU 195 N 6.18 0.00 -0.17 8.23 5.08 -1.94 -2.47 114.58 129.48 2zit h GLU 195 Ca -0.43 0.00 -0.06 0.00 -1.00 0.00 0.00 59.36 57.86 2zit h GLU 195 Cb 1.21 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.45 2zit h GLU 195 CO 0.84 0.00 -0.17 0.28 -1.00 0.00 0.00 179.01 178.95 2zit h VAL 196 N 0.00 1.21 0.00 3.13 2.07 -2.05 -2.15 116.25 118.46 2zit h VAL 196 Ca 0.00 -0.95 0.00 0.00 0.82 0.00 0.00 66.70 66.57 2zit h VAL 196 Cb 0.38 1.28 0.00 0.00 -1.52 0.00 0.00 31.29 31.42 2zit h VAL 196 CO 0.00 0.30 0.00 0.18 0.02 0.00 0.00 177.57 178.07 2zit n LEU 197 N -4.22 0.00 0.00 2.57 4.77 -0.93 -4.99 117.00 114.20 2zit n LEU 197 Ca -0.01 0.20 0.00 0.00 -0.03 0.00 0.00 56.01 56.18 2zit n LEU 197 Cb 0.31 -0.20 0.00 0.00 -2.33 0.00 0.00 43.42 41.20 2zit n LEU 197 CO 0.39 -0.05 0.00 0.61 -1.33 0.00 0.00 177.39 177.01 2zit n GLY 198 N 0.65 0.31 3.55 -0.72 0.00 -0.81 -4.71 105.19 103.45 2zit n GLY 198 Ca 0.13 -0.76 -0.40 0.00 0.00 0.00 0.00 46.02 44.99 2zit n GLY 198 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2zit s ASP 199 N -4.00 6.14 0.00 1.61 2.15 -1.26 -4.75 116.67 116.56 2zit s ASP 199 Ca 0.00 -0.23 0.12 0.00 0.43 0.00 0.00 52.55 52.87 2zit s ASP 199 Cb 0.00 -2.18 0.20 0.00 -0.30 0.00 0.00 42.92 40.64 2zit s ASP 199 CO 0.00 -0.28 1.05 0.52 -0.17 0.00 0.00 175.17 176.29 2zit n VAL 200 N 5.18 0.41 -2.16 1.11 0.31 -1.26 -5.02 118.33 116.90 2zit n VAL 200 Ca -0.10 -0.70 -0.36 0.00 -0.01 0.00 0.00 64.34 63.16 2zit n VAL 200 Cb 0.50 0.95 0.01 0.00 -0.91 0.00 0.00 33.84 34.39 2zit n VAL 200 CO 0.00 0.00 0.00 -1.10 -1.32 0.00 0.00 176.83 174.41 2zit s GLN 201 N -1.02 3.30 -0.03 5.55 -0.21 -1.26 -4.67 119.66 121.32 2zit s GLN 201 Ca 0.19 1.74 -0.16 0.00 0.02 0.00 0.00 55.36 57.15 2zit s GLN 201 Cb 0.12 -2.06 -0.05 0.00 1.00 0.00 0.00 33.01 32.01 2zit s GLN 201 CO 0.16 -0.92 0.44 0.14 -2.12 0.00 0.00 175.29 172.99 2zit s VAL 202 N -1.65 5.04 -0.09 1.09 -7.23 -1.26 -5.08 120.40 111.22 2zit s VAL 202 Ca 0.73 0.90 0.00 0.00 -1.81 0.00 0.00 61.98 61.80 2zit s VAL 202 Cb -0.28 -3.75 0.02 0.00 0.56 0.00 0.00 36.38 32.93 2zit s VAL 202 CO 0.31 0.51 -0.08 -0.31 -0.31 0.00 0.00 175.10 175.22 2zit s TYR 203 N -0.62 1.33 0.38 2.82 2.02 -1.26 -4.94 117.35 117.08 2zit s TYR 203 Ca 0.25 -0.58 0.08 0.00 -0.37 0.00 0.00 57.07 56.45 2zit s TYR 203 Cb -0.16 -1.09 0.83 0.00 -0.40 0.00 0.00 41.96 41.13 2zit s TYR 203 CO 0.13 -0.40 1.96 -1.35 -1.57 0.00 0.00 175.55 174.31 2zit h PRO 204 N 7.75 0.63 -0.55 -1.71 0.11 -1.89 -1.75 132.00 134.59 2zit h PRO 204 Ca -0.30 -0.04 -0.07 0.00 0.11 0.00 0.00 66.00 65.70 2zit h PRO 204 Cb 1.15 -0.14 -0.02 0.00 0.11 0.00 0.00 31.00 32.09 2zit h PRO 204 CO 0.42 0.42 0.07 0.00 -0.21 0.00 0.00 178.00 178.70 2zit h ALA 205 N 1.63 1.08 -0.02 -0.75 0.00 -1.94 -2.30 119.26 116.96 2zit h ALA 205 Ca 0.32 -0.25 0.00 0.00 0.00 0.00 0.00 54.91 54.98 2zit h ALA 205 Cb 0.38 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 17.95 2zit h ALA 205 CO -0.11 0.59 0.00 0.54 0.00 0.00 0.00 179.25 180.28 2zit n ARG 206 N -4.23 1.14 -1.25 0.00 1.74 -0.69 -4.59 116.66 108.78 2zit n ARG 206 Ca 0.03 -0.20 -0.03 0.00 -0.77 0.00 0.00 57.85 56.88 2zit n ARG 206 Cb 0.28 -1.38 -0.01 0.00 -1.02 0.00 0.00 32.46 30.32 2zit n ARG 206 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2zit n GLY 207 N 0.93 0.57 1.59 -0.13 0.00 -0.87 -4.92 105.19 102.37 2zit n GLY 207 Ca 0.18 -0.90 0.09 0.00 0.00 0.00 0.00 46.02 45.39 2zit n GLY 207 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2zit n THR 208 N -3.08 1.82 -3.83 2.61 -2.24 -1.03 -4.74 114.28 103.79 2zit n THR 208 Ca -0.03 -1.16 -0.17 0.00 -2.27 0.00 0.00 64.05 60.42 2zit n THR 208 Cb 0.17 0.10 -0.16 0.00 -2.10 0.00 0.00 70.33 68.34 2zit n THR 208 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 2zit s VAL 209 N -1.88 0.05 0.21 2.28 1.01 -1.26 -2.69 120.40 118.14 2zit s VAL 209 Ca 0.50 0.18 0.09 0.00 0.00 0.00 0.00 61.98 62.76 2zit s VAL 209 Cb 0.33 -0.19 -0.04 0.00 0.00 0.00 0.00 36.38 36.48 2zit s VAL 209 CO 0.24 0.13 -0.07 0.00 0.00 0.00 0.00 175.10 175.40 2zit s ALA 210 N 1.21 3.01 -0.00 5.51 0.00 -0.44 -4.39 121.76 126.66 2zit s ALA 210 Ca -0.07 -1.55 0.02 0.00 0.00 0.00 0.00 51.96 50.36 2zit s ALA 210 Cb -0.13 -0.73 -0.01 0.00 0.00 0.00 0.00 23.12 22.26 2zit s ALA 210 CO -0.03 0.39 -0.08 -0.06 0.00 0.00 0.00 175.76 175.99 2zit s PHE 211 N -1.95 0.71 -2.14 0.00 0.40 0.23 -0.48 117.98 114.75 2zit s PHE 211 Ca 0.27 -0.15 0.00 0.00 -0.60 0.00 0.00 56.93 56.45 2zit s PHE 211 Cb -0.08 -0.46 0.00 0.00 0.51 0.00 0.00 43.02 43.00 2zit s PHE 211 CO 0.17 -0.01 0.00 0.41 0.70 0.00 0.00 175.22 176.48 2zit n GLY 212 N 2.80 -0.61 3.06 4.36 0.00 -0.93 0.50 105.19 114.38 2zit n GLY 212 Ca -0.14 -0.64 -0.12 0.00 0.00 0.00 0.00 46.02 45.12 2zit n GLY 212 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2zit s SER 213 N -4.00 -0.12 0.13 1.61 0.15 0.17 -2.56 113.70 109.08 2zit s SER 213 Ca 0.00 0.58 -0.14 0.00 0.70 0.00 0.00 55.95 57.09 2zit s SER 213 Cb 0.00 0.53 -0.02 0.00 -1.71 0.00 0.00 66.02 64.81 2zit s SER 213 CO 0.00 -0.19 1.54 1.23 1.20 0.00 0.00 173.24 177.02 2zit h GLY 214 N 7.50 0.84 -0.00 9.45 0.00 -1.92 -1.00 103.07 117.94 2zit h GLY 214 Ca -0.33 -0.68 0.00 0.00 0.00 0.00 0.00 47.33 46.32 2zit h GLY 214 CO 0.30 0.63 -0.00 -2.00 0.00 0.00 0.00 176.54 175.46 2zit h LEU 215 N 0.59 -0.01 -1.11 3.11 5.85 -1.95 -2.65 115.31 119.14 2zit h LEU 215 Ca 0.10 0.00 -0.02 0.00 0.84 0.00 0.00 57.88 58.80 2zit h LEU 215 Cb 0.61 0.00 -0.03 0.00 0.37 0.00 0.00 40.66 41.61 2zit h LEU 215 CO 0.04 -0.00 0.32 0.45 -0.34 0.00 0.00 178.44 178.91 2zit h HIS 216 N -0.00 0.94 -0.11 1.25 3.86 -1.94 -3.47 115.15 115.68 2zit h HIS 216 Ca 0.00 -0.03 0.00 0.00 -1.16 0.00 0.00 60.37 59.18 2zit h HIS 216 Cb 0.00 -0.30 0.00 0.00 1.06 0.00 0.00 27.41 28.18 2zit h HIS 216 CO -0.46 0.69 0.00 0.41 0.86 0.00 0.00 177.93 179.43 2zit n GLY 217 N -1.12 1.31 3.29 2.45 0.00 -0.45 -4.72 105.19 105.95 2zit n GLY 217 Ca 0.06 -0.16 -0.24 0.00 0.00 0.00 0.00 46.02 45.68 2zit n GLY 217 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 173.32 173.98 2zit s TRP 218 N -2.11 1.82 -0.05 1.61 1.48 -0.80 -1.81 118.94 119.09 2zit s TRP 218 Ca 0.00 -0.41 -0.29 0.00 -1.06 0.00 0.00 56.10 54.34 2zit s TRP 218 Cb 0.00 -1.01 0.11 0.00 -1.16 0.00 0.00 33.47 31.41 2zit s TRP 218 CO 0.00 0.20 0.89 0.00 -4.06 0.00 0.00 176.95 173.98 2zit s ALA 219 N -1.12 -1.84 0.09 2.67 0.00 0.12 0.43 121.76 122.11 2zit s ALA 219 Ca 0.07 1.18 -0.10 0.00 0.00 0.00 0.00 51.96 53.11 2zit s ALA 219 Cb -0.10 0.09 0.01 0.00 0.00 0.00 0.00 23.12 23.11 2zit s ALA 219 CO 0.04 -0.56 0.23 -0.59 0.00 0.00 0.00 175.76 174.88 2zit s PHE 220 N -2.43 0.08 0.18 0.00 -0.12 0.18 -4.26 117.98 111.61 2zit s PHE 220 Ca 0.02 -0.48 0.10 0.00 -0.05 0.00 0.00 56.93 56.52 2zit s PHE 220 Cb -0.01 0.00 -0.04 0.00 -0.63 0.00 0.00 43.02 42.34 2zit s PHE 220 CO -0.05 -0.57 -0.21 0.95 -0.05 0.00 0.00 175.22 175.30 2zit s THR 221 N -3.78 2.03 -0.03 -4.49 -4.23 -1.26 -0.60 115.64 103.28 2zit s THR 221 Ca 0.04 -1.96 0.25 0.00 -1.18 0.00 0.00 61.69 58.84 2zit s THR 221 Cb 0.04 -1.95 0.25 0.00 1.34 0.00 0.00 72.50 72.18 2zit s THR 221 CO -0.11 -0.23 1.75 0.40 -0.54 0.00 0.00 174.62 175.89 2zit h ILE 222 N 3.24 0.00 0.05 2.99 2.04 -1.76 0.14 117.51 124.20 2zit h ILE 222 Ca -0.44 0.00 -0.23 0.00 1.00 0.00 0.00 64.86 65.19 2zit h ILE 222 Cb 1.21 0.55 -0.01 0.00 -0.74 0.00 0.00 36.82 37.82 2zit h ILE 222 CO 0.50 0.00 -1.06 -0.09 0.00 0.00 0.00 178.15 177.49 2zit h ARG 223 N 0.00 0.13 -0.06 2.37 2.43 -1.88 -2.95 114.38 114.43 2zit h ARG 223 Ca 0.00 -0.21 -0.01 0.00 -0.81 0.00 0.00 59.98 58.95 2zit h ARG 223 Cb 0.06 0.07 -0.00 0.00 -0.42 0.00 0.00 29.97 29.68 2zit h ARG 223 CO 0.00 1.07 -0.02 1.96 -1.51 0.00 0.00 179.97 181.47 2zit h GLN 224 N 0.05 0.11 -0.57 0.20 4.20 -1.37 -1.04 115.11 116.69 2zit h GLN 224 Ca -0.06 -0.04 0.02 0.00 0.06 0.00 0.00 58.65 58.63 2zit h GLN 224 Cb 1.79 -0.01 -0.03 0.00 0.30 0.00 0.00 27.48 29.53 2zit h GLN 224 CO 0.16 0.45 0.36 0.74 -0.67 0.00 0.00 178.83 179.87 2zit h PHE 225 N -0.24 0.67 -0.28 2.96 -1.00 -1.67 -2.16 116.94 115.22 2zit h PHE 225 Ca 0.01 0.02 -0.01 0.00 2.81 0.00 0.00 57.97 60.80 2zit h PHE 225 Cb 0.41 -0.22 -0.01 0.00 3.61 0.00 0.00 35.95 39.74 2zit h PHE 225 CO 0.05 0.39 0.12 0.00 -1.61 0.00 0.00 178.31 177.27 2zit h ALA 226 N 1.24 1.70 -0.09 2.45 0.00 -1.43 -0.75 119.26 122.38 2zit h ALA 226 Ca 0.22 -0.07 -0.10 0.00 0.00 0.00 0.00 54.91 54.97 2zit h ALA 226 Cb -0.01 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.65 2zit h ALA 226 CO -0.08 0.25 -0.39 1.15 0.00 0.00 0.00 179.25 180.17 2zit h THR 227 N 0.38 1.30 0.02 0.00 2.02 -0.56 -2.59 112.91 113.48 2zit h THR 227 Ca 0.10 -1.44 -0.09 0.00 0.77 0.00 0.00 66.41 65.75 2zit h THR 227 Cb 0.06 1.66 0.01 0.00 -1.74 0.00 0.00 68.15 68.14 2zit h THR 227 CO -0.01 0.43 -0.37 0.03 0.37 0.00 0.00 175.52 175.96 2zit h ARG 228 N 0.16 0.21 0.00 6.66 3.08 -0.84 -3.09 114.38 120.57 2zit h ARG 228 Ca 0.02 -0.26 0.00 0.00 0.07 0.00 0.00 59.98 59.81 2zit h ARG 228 Cb 0.76 0.08 0.00 0.00 0.08 0.00 0.00 29.97 30.89 2zit h ARG 228 CO 0.06 1.01 0.00 0.66 -1.07 0.00 0.00 179.97 180.63 2zit n TYR 229 N -4.41 0.30 0.03 3.04 4.02 -0.40 -0.87 117.16 118.88 2zit n TYR 229 Ca -0.10 0.14 0.09 0.00 -0.01 0.00 0.00 57.90 58.01 2zit n TYR 229 Cb 0.58 -0.72 -0.10 0.00 -0.02 0.00 0.00 39.34 39.08 2zit n TYR 229 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 2zit n ALA 230 N -1.61 2.55 -0.05 -0.72 0.00 -0.98 -3.64 120.51 116.06 2zit n ALA 230 Ca 0.01 -0.46 0.01 0.00 0.00 0.00 0.00 53.44 53.00 2zit n ALA 230 Cb 0.11 -0.87 -0.16 0.00 0.00 0.00 0.00 19.45 18.53 2zit n ALA 230 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 2zit n LYS 231 N -2.50 0.69 0.01 0.00 5.02 -0.65 -3.99 118.16 116.74 2zit n LYS 231 Ca -0.05 -0.11 0.13 0.00 -2.02 0.00 0.00 58.31 56.27 2zit n LYS 231 Cb 0.62 -1.51 0.52 0.00 -0.02 0.00 0.00 35.03 34.63 2zit n LYS 231 CO 0.00 0.00 0.00 1.17 -0.52 0.00 0.00 177.40 178.05 2zit n LYS 232 N -2.48 0.03 0.00 1.97 3.00 -0.05 -4.87 118.16 115.76 2zit n LYS 232 Ca -0.18 0.02 0.00 0.00 -0.00 0.00 0.00 58.31 58.16 2zit n LYS 232 Cb 0.84 -1.53 0.00 0.00 0.00 0.00 0.00 35.03 34.34 2zit n LYS 232 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.40 178.59 2zit n PHE 233 N -1.59 0.00 -1.89 5.64 3.01 -1.24 -5.07 117.46 116.32 2zit n PHE 233 Ca 0.06 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.52 2zit n PHE 233 Cb 0.35 0.00 0.00 0.00 -0.01 0.00 0.00 39.48 39.82 2zit n PHE 233 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 2zit n GLY 234 N 1.11 0.14 3.85 1.37 0.00 -1.26 -4.86 105.19 105.54 2zit n GLY 234 Ca 0.00 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.70 2zit n GLY 234 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2zit s VAL 235 N 0.00 4.56 -0.02 1.61 -7.23 -1.26 -5.01 120.40 113.04 2zit s VAL 235 Ca 0.00 1.15 -0.30 0.00 -1.81 0.00 0.00 61.98 61.02 2zit s VAL 235 Cb 0.00 -3.72 -0.04 0.00 0.56 0.00 0.00 36.38 33.18 2zit s VAL 235 CO 0.00 -0.65 1.25 -1.81 -0.31 0.00 0.00 175.10 173.58 2zit s ASP 236 N -3.04 7.00 0.43 4.85 1.01 -1.26 -4.53 116.67 121.13 2zit s ASP 236 Ca 0.58 1.92 0.23 0.00 0.71 0.00 0.00 52.55 55.99 2zit s ASP 236 Cb -0.10 -2.56 0.46 0.00 1.01 0.00 0.00 42.92 41.73 2zit s ASP 236 CO 0.30 -0.60 1.64 0.07 0.21 0.00 0.00 175.17 176.80 2zit h LYS 237 N 7.45 0.00 -0.55 8.23 2.10 -1.94 -1.22 116.57 130.63 2zit h LYS 237 Ca -0.36 0.00 -0.05 0.00 -2.00 0.00 0.00 60.65 58.23 2zit h LYS 237 Cb 1.17 0.00 -0.02 0.00 -0.90 0.00 0.00 32.23 32.48 2zit h LYS 237 CO 0.88 0.10 0.12 0.00 -2.00 0.00 0.00 179.45 178.54 2zit h ALA 238 N 1.90 1.18 -0.01 0.07 0.00 -1.93 -1.08 119.26 119.39 2zit h ALA 238 Ca -0.00 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 54.69 2zit h ALA 238 Cb 0.99 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 18.56 2zit h ALA 238 CO 0.01 0.56 -0.71 1.63 0.00 0.00 0.00 179.25 180.74 2zit n LYS 239 N -4.26 0.46 -0.06 0.00 5.02 -1.19 -4.00 118.16 114.13 2zit n LYS 239 Ca 0.04 -0.36 -0.15 0.00 -2.02 0.00 0.00 58.31 55.82 2zit n LYS 239 Cb 0.24 -1.49 -0.13 0.00 -0.02 0.00 0.00 35.03 33.62 2zit n LYS 239 CO 0.00 0.00 0.00 1.98 -0.52 0.00 0.00 177.40 178.86 2zit h MET 240 N 0.89 0.03 0.00 1.97 4.05 -0.82 -3.02 114.93 118.03 2zit h MET 240 Ca 0.00 -0.05 0.00 0.00 -0.28 0.00 0.00 59.70 59.37 2zit h MET 240 Cb 0.58 0.02 0.00 0.00 -0.80 0.00 0.00 31.60 31.40 2zit h MET 240 CO 0.00 1.02 0.00 0.00 0.23 0.00 0.00 176.91 178.16 2zit h MET 241 N -0.92 0.00 0.00 0.39 -0.00 -1.40 -0.96 114.93 112.03 2zit h MET 241 Ca -0.01 0.00 -0.17 0.00 -0.00 0.00 0.00 59.70 59.51 2zit h MET 241 Cb 1.06 0.00 -0.03 0.00 -0.00 0.00 0.00 31.60 32.63 2zit h MET 241 CO 0.02 0.00 -0.96 0.22 -0.00 0.00 0.00 176.91 176.19 2zit h ASP 242 N 0.00 0.00 1.00 -0.10 1.82 -1.69 -3.31 116.42 114.13 2zit h ASP 242 Ca 0.00 0.00 -0.14 0.00 -0.39 0.00 0.00 57.03 56.50 2zit h ASP 242 Cb 0.33 0.00 -0.02 0.00 0.68 0.00 0.00 39.33 40.31 2zit h ASP 242 CO 0.00 0.75 -1.07 0.03 -1.61 0.00 0.00 179.24 177.35 2zit h ARG 243 N 0.00 0.00 0.00 0.28 3.08 -1.10 -3.34 114.38 113.30 2zit h ARG 243 Ca -0.06 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.99 2zit h ARG 243 Cb 1.63 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.68 2zit h ARG 243 CO 0.09 0.35 0.00 1.28 -1.07 0.00 0.00 179.97 180.62 2zit n LEU 244 N -3.00 0.00 -4.22 3.04 4.77 -0.48 -4.47 117.00 112.64 2zit n LEU 244 Ca -0.05 0.44 -0.16 0.00 -0.03 0.00 0.00 56.01 56.21 2zit n LEU 244 Cb 0.79 -0.44 -0.11 0.00 -2.33 0.00 0.00 43.42 41.32 2zit n LEU 244 CO 0.42 -0.27 -0.43 0.86 -1.33 0.00 0.00 177.39 176.64 2zit s TRP 245 N -2.89 1.28 0.00 -1.77 -0.11 -1.25 -3.18 118.94 111.02 2zit s TRP 245 Ca 0.07 -0.60 0.00 0.00 1.22 0.00 0.00 56.10 56.79 2zit s TRP 245 Cb 0.08 -0.67 0.00 0.00 -1.50 0.00 0.00 33.47 31.37 2zit s TRP 245 CO 0.20 0.10 0.00 0.41 -4.62 0.00 0.00 176.95 173.04 2zit n GLY 246 N 0.46 -0.84 3.14 5.86 0.00 -1.26 -4.49 105.19 108.07 2zit n GLY 246 Ca -0.15 -1.26 -0.44 0.00 0.00 0.00 0.00 46.02 44.18 2zit n GLY 246 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2zit n ASP 247 N 0.55 5.60 -3.84 1.61 8.00 -1.26 -4.76 116.55 122.46 2zit n ASP 247 Ca 0.00 -3.15 -0.23 0.00 0.71 0.00 0.00 54.79 52.12 2zit n ASP 247 Cb 0.00 -1.42 -0.17 0.00 -0.02 0.00 0.00 41.12 39.51 2zit n ASP 247 CO 0.00 0.00 0.00 -0.44 -0.39 0.00 0.00 177.20 176.37 2zit s SER 248 N 0.64 1.56 0.14 -2.24 0.01 -1.26 -4.66 113.70 107.89 2zit s SER 248 Ca 0.36 -0.15 0.11 0.00 1.31 0.00 0.00 55.95 57.58 2zit s SER 248 Cb 0.01 -0.55 -0.04 0.00 0.21 0.00 0.00 66.02 65.65 2zit s SER 248 CO 0.01 -0.13 -0.26 -0.36 0.41 0.00 0.00 173.24 172.91 2zit s PHE 249 N 1.58 2.31 -0.30 2.43 0.08 -0.06 -1.34 117.98 122.68 2zit s PHE 249 Ca -0.00 -0.37 0.02 0.00 0.12 0.00 0.00 56.93 56.70 2zit s PHE 249 Cb -0.13 -1.23 0.08 0.00 -0.57 0.00 0.00 43.02 41.17 2zit s PHE 249 CO -0.04 0.38 -0.02 0.12 -0.10 0.00 0.00 175.22 175.56 2zit s PHE 250 N -1.20 3.47 -0.00 0.36 5.36 -1.26 -0.94 117.98 123.76 2zit s PHE 250 Ca 0.16 -2.52 -0.30 0.00 -0.96 0.00 0.00 56.93 53.31 2zit s PHE 250 Cb -0.10 -2.40 -0.07 0.00 -0.34 0.00 0.00 43.02 40.12 2zit s PHE 250 CO 0.07 -0.90 1.68 1.21 -1.46 0.00 0.00 175.22 175.81 2zit s ASN 251 N 1.10 6.63 0.19 6.13 3.84 -0.75 -4.88 114.94 127.21 2zit s ASN 251 Ca -0.00 2.36 -0.10 0.00 0.21 0.00 0.00 52.86 55.33 2zit s ASN 251 Cb -0.20 -2.54 0.12 0.00 -0.55 0.00 0.00 41.25 38.07 2zit s ASN 251 CO -0.05 -0.92 1.75 1.55 -2.79 0.00 0.00 177.10 176.64 2zit h PRO 252 N 9.19 1.05 0.01 0.43 0.13 -1.97 0.50 132.00 141.35 2zit h PRO 252 Ca -0.41 -0.19 -0.00 0.00 -0.87 0.00 0.00 66.00 64.52 2zit h PRO 252 Cb 1.19 -0.17 0.00 0.00 0.13 0.00 0.00 31.00 32.15 2zit h PRO 252 CO 0.94 0.87 -0.01 0.87 -0.23 0.00 0.00 178.00 180.45 2zit h LYS 253 N 1.00 -0.02 0.00 0.86 1.57 -1.99 -3.32 116.57 114.68 2zit h LYS 253 Ca 0.23 0.00 -0.08 0.00 -1.87 0.00 0.00 60.65 58.94 2zit h LYS 253 Cb 0.22 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.52 2zit h LYS 253 CO -0.02 0.76 -0.37 1.79 -0.57 0.00 0.00 179.45 181.04 2zit h THR 254 N -0.87 0.66 -5.88 -0.16 1.35 -1.98 -3.47 112.91 102.56 2zit h THR 254 Ca -0.00 -1.82 -0.38 0.00 -0.55 0.00 0.00 66.41 63.66 2zit h THR 254 Cb 0.78 2.24 0.11 0.00 -1.73 0.00 0.00 68.15 69.55 2zit h THR 254 CO 0.00 0.36 -0.81 0.29 -0.25 0.00 0.00 175.52 175.12 2zit n LYS 255 N -3.23 -5.46 -4.02 4.72 5.02 0.18 -5.02 118.16 110.35 2zit n LYS 255 Ca 0.02 0.72 -0.08 0.00 -2.02 0.00 0.00 58.31 56.95 2zit n LYS 255 Cb 0.65 -5.47 -0.10 0.00 -0.02 0.00 0.00 35.03 30.09 2zit n LYS 255 CO 0.00 0.00 0.00 0.15 -0.52 0.00 0.00 177.40 177.03 2zit s LYS 256 N -5.66 0.50 0.32 1.97 1.02 -1.22 -4.95 119.74 111.73 2zit s LYS 256 Ca 0.03 -0.92 -0.24 0.00 0.02 0.00 0.00 55.97 54.85 2zit s LYS 256 Cb -0.01 0.18 -0.10 0.00 -0.52 0.00 0.00 37.83 37.39 2zit s LYS 256 CO 0.78 -0.10 0.91 -1.58 -0.92 0.00 0.00 175.35 174.43 2zit s TRP 257 N -2.83 3.65 -0.00 3.18 0.52 -1.26 -1.82 118.94 120.38 2zit s TRP 257 Ca -0.03 1.70 -0.11 0.00 0.02 0.00 0.00 56.10 57.67 2zit s TRP 257 Cb 0.00 -2.86 0.01 0.00 -1.15 0.00 0.00 33.47 29.47 2zit s TRP 257 CO -0.06 0.20 0.22 0.99 0.02 0.00 0.00 176.95 178.33 2zit s THR 258 N -1.65 0.07 -1.75 2.01 2.01 -0.12 -4.96 115.64 111.25 2zit s THR 258 Ca 0.50 -0.61 0.20 0.00 0.31 0.00 0.00 61.69 62.09 2zit s THR 258 Cb -0.17 -0.57 -0.03 0.00 0.01 0.00 0.00 72.50 71.74 2zit s THR 258 CO 0.22 -0.34 0.99 0.59 -0.69 0.00 0.00 174.62 175.39 2zit n ASN 259 N 1.28 1.80 -4.86 3.53 3.02 -1.26 -0.89 115.26 117.88 2zit n ASN 259 Ca -0.22 -1.40 -0.36 0.00 -0.03 0.00 0.00 54.58 52.58 2zit n ASN 259 Cb 0.56 0.52 -0.06 0.00 -0.61 0.00 0.00 39.78 40.19 2zit n ASN 259 CO 0.00 0.00 0.00 -1.59 -2.62 0.00 0.00 177.26 173.05 2zit s LYS 260 N -2.32 3.38 0.00 3.52 -2.85 -1.26 -4.80 119.74 115.41 2zit s LYS 260 Ca 0.16 -0.23 0.00 0.00 -1.00 0.00 0.00 55.97 54.90 2zit s LYS 260 Cb 0.16 -3.11 0.00 0.00 -2.06 0.00 0.00 37.83 32.82 2zit s LYS 260 CO 0.54 0.74 0.73 -0.40 0.10 0.00 0.00 175.35 177.05 2zit n ASP 261 N 1.65 0.19 -3.87 0.03 5.75 -1.26 -4.73 116.55 114.32 2zit n ASP 261 Ca -0.17 -1.64 -0.11 0.00 -0.01 0.00 0.00 54.79 52.86 2zit n ASP 261 Cb 0.54 -0.10 -0.09 0.00 -1.03 0.00 0.00 41.12 40.44 2zit n ASP 261 CO 0.00 0.00 0.00 0.42 -0.11 0.00 0.00 177.20 177.51 2zit s THR 262 N -1.76 0.10 0.96 2.12 -4.23 -1.26 -0.07 115.64 111.49 2zit s THR 262 Ca 0.00 -0.83 -0.15 0.00 -1.18 0.00 0.00 61.69 59.52 2zit s THR 262 Cb 0.00 -0.70 0.21 0.00 1.34 0.00 0.00 72.50 73.35 2zit s THR 262 CO 0.00 -0.46 1.31 1.51 -0.54 0.00 0.00 174.62 176.44 2zit s ASP 263 N -1.77 3.08 0.57 3.99 1.47 -0.97 -4.85 116.67 118.18 2zit s ASP 263 Ca -0.09 0.17 0.26 0.00 1.18 0.00 0.00 52.55 54.07 2zit s ASP 263 Cb -0.04 -0.20 1.53 0.00 -0.34 0.00 0.00 42.92 43.88 2zit s ASP 263 CO -0.01 -2.75 2.06 0.00 0.68 0.00 0.00 175.17 175.15 2zit h ALA 264 N -1.62 2.03 0.02 2.11 0.00 -2.00 -0.41 119.26 119.40 2zit h ALA 264 Ca -0.44 -0.01 -0.23 0.00 0.00 0.00 0.00 54.91 54.24 2zit h ALA 264 Cb 1.23 0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.04 2zit h ALA 264 CO 0.36 -0.39 -0.97 1.49 0.00 0.00 0.00 179.25 179.74 2zit h GLU 265 N 0.00 0.38 0.00 0.00 4.81 -2.05 -3.47 114.58 114.24 2zit h GLU 265 Ca 0.13 -0.43 0.00 0.00 -0.13 0.00 0.00 59.36 58.93 2zit h GLU 265 Cb 0.62 0.13 0.00 0.00 0.63 0.00 0.00 28.75 30.13 2zit h GLU 265 CO -0.00 1.11 0.00 0.41 -0.73 0.00 0.00 179.01 179.80 2zit n GLY 266 N 1.01 1.38 3.74 1.92 0.00 -0.16 -5.11 105.19 107.96 2zit n GLY 266 Ca -0.07 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.56 2zit n GLY 266 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2zit s LYS 267 N -0.26 4.45 0.47 1.61 2.20 -1.26 -4.77 119.74 122.19 2zit s LYS 267 Ca 0.00 0.98 -0.22 0.00 -0.36 0.00 0.00 55.97 56.37 2zit s LYS 267 Cb 0.00 -3.39 -0.10 0.00 -1.51 0.00 0.00 37.83 32.83 2zit s LYS 267 CO 0.00 0.22 0.76 -2.30 -0.36 0.00 0.00 175.35 173.67 2zit n PRO 268 N 3.13 0.88 -5.04 4.03 -0.02 -1.26 -2.30 135.00 134.42 2zit n PRO 268 Ca -0.02 0.32 -0.30 0.00 -2.02 0.00 0.00 63.50 61.48 2zit n PRO 268 Cb 0.51 -1.82 -0.15 0.00 -0.02 0.00 0.00 33.50 32.02 2zit n PRO 268 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 2zit s LEU 269 N 0.25 2.13 0.26 2.45 1.43 0.90 -4.83 118.68 121.27 2zit s LEU 269 Ca 0.66 -0.55 -0.28 0.00 -1.03 0.00 0.00 54.13 52.93 2zit s LEU 269 Cb -0.53 -1.30 -0.09 0.00 0.03 0.00 0.00 46.19 44.29 2zit s LEU 269 CO 0.55 0.28 0.92 -0.70 0.23 0.00 0.00 176.35 177.64 2zit s GLU 270 N -1.03 4.73 0.58 1.70 2.12 -1.26 -4.87 118.70 120.66 2zit s GLU 270 Ca 0.11 1.39 -0.18 0.00 0.36 0.00 0.00 54.97 56.65 2zit s GLU 270 Cb -0.10 -3.10 -0.04 0.00 0.26 0.00 0.00 34.13 31.15 2zit s GLU 270 CO 0.01 0.44 1.14 0.50 -0.54 0.00 0.00 175.26 176.81 2zit s ARG 271 N -1.50 3.15 0.38 4.30 3.52 -1.26 -4.17 118.95 123.37 2zit s ARG 271 Ca 0.44 1.60 0.05 0.00 -0.13 0.00 0.00 55.73 57.70 2zit s ARG 271 Cb -0.23 -1.98 0.75 0.00 -1.56 0.00 0.00 34.95 31.93 2zit s ARG 271 CO 0.28 -1.01 2.00 0.00 -0.81 0.00 0.00 175.30 175.76 2zit h ALA 272 N 0.87 1.58 -0.16 6.12 0.00 -1.46 -0.92 119.26 125.29 2zit h ALA 272 Ca -0.49 -0.08 -0.02 0.00 0.00 0.00 0.00 54.91 54.31 2zit h ALA 272 Cb 1.27 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.87 2zit h ALA 272 CO 0.56 0.35 0.03 0.35 0.00 0.00 0.00 179.25 180.53 2zit h PHE 273 N 0.59 0.29 0.00 0.00 3.57 -1.80 -0.38 116.94 119.21 2zit h PHE 273 Ca 0.15 -0.04 -0.06 0.00 3.53 0.00 0.00 57.97 61.55 2zit h PHE 273 Cb 0.05 -0.08 -0.01 0.00 2.79 0.00 0.00 35.95 38.70 2zit h PHE 273 CO 0.00 0.44 -0.30 -0.91 -2.23 0.00 0.00 178.31 175.32 2zit h ASN 274 N 0.06 0.00 0.05 0.41 4.21 -1.78 -0.20 115.58 118.33 2zit h ASN 274 Ca 0.05 0.00 -0.26 0.00 1.21 0.00 0.00 56.30 57.30 2zit h ASN 274 Cb 0.31 0.00 -0.02 0.00 -1.12 0.00 0.00 38.32 37.48 2zit h ASN 274 CO 0.00 0.30 -1.39 -0.03 -1.29 0.00 0.00 177.43 175.02 2zit h MET 275 N 0.00 0.11 0.00 0.81 4.05 -0.98 -0.93 114.93 117.99 2zit h MET 275 Ca -0.00 -0.19 0.00 0.00 -0.28 0.00 0.00 59.70 59.22 2zit h MET 275 Cb 0.57 0.07 0.00 0.00 -0.80 0.00 0.00 31.60 31.44 2zit h MET 275 CO 0.04 1.09 -1.49 1.19 0.23 0.00 0.00 176.91 177.98 2zit n PHE 276 N -4.12 0.11 0.00 1.39 3.72 -0.17 -4.30 117.46 114.09 2zit n PHE 276 Ca -0.29 0.03 -0.01 0.00 -0.05 0.00 0.00 57.45 57.13 2zit n PHE 276 Cb 0.80 -0.38 -0.00 0.00 -0.94 0.00 0.00 39.48 38.95 2zit n PHE 276 CO 0.00 0.00 0.00 -0.89 -0.05 0.00 0.00 176.76 175.82 2zit n ILE 277 N -2.03 0.40 0.10 4.37 5.41 -0.77 -4.65 119.36 122.19 2zit n ILE 277 Ca -0.00 0.20 0.03 0.00 1.00 0.00 0.00 62.75 63.97 2zit n ILE 277 Cb 0.48 -1.34 0.41 0.00 -0.71 0.00 0.00 39.64 38.48 2zit n ILE 277 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 176.55 176.48 2zit h LEU 278 N -0.08 0.27 0.38 1.39 3.38 -1.18 -3.19 115.31 116.28 2zit h LEU 278 Ca 0.00 -0.04 -0.02 0.00 0.09 0.00 0.00 57.88 57.91 2zit h LEU 278 Cb 0.08 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 40.76 2zit h LEU 278 CO 0.00 0.37 -0.18 -0.78 0.09 0.00 0.00 178.44 177.93 2zit h ASP 279 N 0.29 -0.43 -0.00 -0.43 1.82 -1.35 0.82 116.42 117.14 2zit h ASP 279 Ca 0.06 -0.12 0.00 0.00 -0.39 0.00 0.00 57.03 56.59 2zit h ASP 279 Cb 0.27 0.11 -0.00 0.00 0.68 0.00 0.00 39.33 40.39 2zit h ASP 279 CO 0.01 -0.11 0.09 -0.65 -1.61 0.00 0.00 179.24 176.98 2zit h PRO 280 N -0.78 0.00 0.10 0.28 0.11 -1.77 -0.45 132.00 129.49 2zit h PRO 280 Ca -0.05 0.00 -0.25 0.00 0.11 0.00 0.00 66.00 65.80 2zit h PRO 280 Cb 0.52 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.63 2zit h PRO 280 CO 0.08 0.00 -1.30 0.82 -0.21 0.00 0.00 178.00 177.39 2zit h ILE 281 N 0.00 1.07 0.00 4.15 2.04 -1.48 -3.31 117.51 119.98 2zit h ILE 281 Ca 0.00 -2.38 -0.00 0.00 1.00 0.00 0.00 64.86 63.48 2zit h ILE 281 Cb 0.18 2.72 -0.00 0.00 -0.74 0.00 0.00 36.82 38.98 2zit h ILE 281 CO -0.00 0.66 -0.02 -0.26 0.00 0.00 0.00 178.15 178.53 2zit h PHE 282 N -0.41 0.00 0.62 1.37 -1.00 0.05 -2.01 116.94 115.56 2zit h PHE 282 Ca -0.29 0.00 -0.03 0.00 2.81 0.00 0.00 57.97 60.46 2zit h PHE 282 Cb 1.67 0.00 0.01 0.00 3.61 0.00 0.00 35.95 41.24 2zit h PHE 282 CO 0.13 0.02 -0.30 0.00 -1.61 0.00 0.00 178.31 176.56 2zit h ARG 283 N 0.00 -0.80 -0.23 1.51 2.47 -1.21 -1.30 114.38 114.81 2zit h ARG 283 Ca -0.00 0.05 -0.03 0.00 -1.26 0.00 0.00 59.98 58.75 2zit h ARG 283 Cb 0.05 0.18 -0.01 0.00 -1.65 0.00 0.00 29.97 28.54 2zit h ARG 283 CO 0.00 -0.50 0.03 -0.07 0.56 0.00 0.00 179.97 179.99 2zit h LEU 284 N -0.95 0.30 -1.00 3.04 3.38 -1.58 0.15 115.31 118.66 2zit h LEU 284 Ca -0.08 -0.04 -0.01 0.00 0.09 0.00 0.00 57.88 57.84 2zit h LEU 284 Cb 0.67 -0.08 -0.00 0.00 0.09 0.00 0.00 40.66 41.34 2zit h LEU 284 CO 0.14 0.34 -0.03 -0.26 0.09 0.00 0.00 178.44 178.72 2zit h PHE 285 N 0.33 0.00 0.00 1.13 0.04 -1.25 0.11 116.94 117.30 2zit h PHE 285 Ca 0.08 0.00 -0.26 0.00 2.80 0.00 0.00 57.97 60.59 2zit h PHE 285 Cb 0.18 0.00 -0.05 0.00 2.20 0.00 0.00 35.95 38.28 2zit h PHE 285 CO 0.00 0.03 -2.15 2.41 -0.60 0.00 0.00 178.31 178.01 2zit n THR 286 N -3.13 1.06 -0.03 -1.55 -1.04 -0.50 -3.79 114.28 105.30 2zit n THR 286 Ca 0.01 -0.75 -0.19 0.00 -2.04 0.00 0.00 64.05 61.08 2zit n THR 286 Cb 0.39 -0.42 -0.13 0.00 -1.82 0.00 0.00 70.33 68.35 2zit n THR 286 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2zit h ALA 287 N 1.28 0.12 -0.05 2.41 0.00 -0.68 -3.31 119.26 119.03 2zit h ALA 287 Ca -0.36 -0.91 -0.01 0.00 0.00 0.00 0.00 54.91 53.62 2zit h ALA 287 Cb 1.87 0.37 -0.00 0.00 0.00 0.00 0.00 17.79 20.03 2zit h ALA 287 CO 0.03 0.53 -0.01 0.82 0.00 0.00 0.00 179.25 180.61 2zit h ILE 288 N -0.66 1.29 0.00 0.00 1.08 -1.19 -3.01 117.51 115.02 2zit h ILE 288 Ca -0.22 -0.90 0.00 0.00 -0.39 0.00 0.00 64.86 63.35 2zit h ILE 288 Cb 1.44 1.81 0.00 0.00 -3.07 0.00 0.00 36.82 37.00 2zit h ILE 288 CO -0.01 0.25 0.00 0.23 -0.69 0.00 0.00 178.15 177.93 2zit n MET 289 N -4.84 0.42 -0.08 2.37 2.81 -1.25 -2.26 117.12 114.29 2zit n MET 289 Ca -0.07 0.06 0.03 0.00 -1.81 0.00 0.00 57.70 55.91 2zit n MET 289 Cb 0.22 -1.50 0.07 0.00 -0.71 0.00 0.00 33.22 31.30 2zit n MET 289 CO 0.00 0.00 0.00 0.09 1.51 0.00 0.00 175.97 177.57 2zit n ASN 290 N -1.14 2.41 -2.19 7.83 4.13 -1.20 -4.94 115.26 120.15 2zit n ASN 290 Ca 0.11 -2.14 -0.14 0.00 1.68 0.00 0.00 54.58 54.09 2zit n ASN 290 Cb 0.11 -0.13 -0.02 0.00 -1.54 0.00 0.00 39.78 38.19 2zit n ASN 290 CO 0.00 0.00 0.00 0.49 0.28 0.00 0.00 177.26 178.03 2zit n PHE 291 N -0.27 -1.10 -2.54 3.10 3.72 -0.96 -4.85 117.46 114.57 2zit n PHE 291 Ca 0.06 0.00 -0.42 0.00 -0.05 0.00 0.00 57.45 57.04 2zit n PHE 291 Cb 0.37 -2.92 -0.01 0.00 -0.94 0.00 0.00 39.48 35.98 2zit n PHE 291 CO 0.00 0.00 0.00 0.15 -0.05 0.00 0.00 176.76 176.86 2zit s LYS 292 N -4.60 3.83 0.00 -1.08 1.02 -1.14 -4.80 119.74 112.98 2zit s LYS 292 Ca 0.00 -1.85 0.06 0.00 0.02 0.00 0.00 55.97 54.20 2zit s LYS 292 Cb 0.00 -5.50 0.27 0.00 -0.52 0.00 0.00 37.83 32.08 2zit s LYS 292 CO 0.00 -2.39 1.11 0.36 -0.92 0.00 0.00 175.35 173.51 2zit n LYS 293 N 8.44 0.04 0.06 1.68 2.85 -1.26 -1.80 118.16 128.17 2zit n LYS 293 Ca 0.47 0.32 0.11 0.00 -1.05 0.00 0.00 58.31 58.16 2zit n LYS 293 Cb 0.46 -1.50 -0.05 0.00 -0.65 0.00 0.00 35.03 33.29 2zit n LYS 293 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 177.40 177.10 2zit n ASP 294 N -1.40 0.56 -0.01 -5.58 8.00 -1.26 -4.17 116.55 112.69 2zit n ASP 294 Ca 0.02 0.17 0.11 0.00 0.71 0.00 0.00 54.79 55.80 2zit n ASP 294 Cb 0.06 0.97 -0.16 0.00 -0.02 0.00 0.00 41.12 41.97 2zit n ASP 294 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 2zit n GLU 295 N -2.47 0.62 0.08 -1.24 1.02 -0.74 -4.48 120.64 113.43 2zit n GLU 295 Ca -0.01 -0.19 -0.13 0.00 -0.02 0.00 0.00 57.16 56.82 2zit n GLU 295 Cb 0.54 -1.50 -0.08 0.00 -0.02 0.00 0.00 31.44 30.38 2zit n GLU 295 CO 0.00 0.00 0.00 0.82 1.18 0.00 0.00 177.13 179.13 2zit h ILE 296 N 0.00 0.97 -0.02 -3.67 2.04 -1.69 -0.75 117.51 114.40 2zit h ILE 296 Ca 0.00 -0.80 0.00 0.00 1.00 0.00 0.00 64.86 65.07 2zit h ILE 296 Cb 0.95 1.44 -0.00 0.00 -0.74 0.00 0.00 36.82 38.47 2zit h ILE 296 CO 0.00 0.18 0.01 1.55 0.00 0.00 0.00 178.15 179.89 2zit h PRO 297 N -0.62 0.00 0.00 2.37 0.13 -1.81 -0.43 132.00 131.64 2zit h PRO 297 Ca -0.02 0.00 -0.22 0.00 -0.87 0.00 0.00 66.00 64.88 2zit h PRO 297 Cb 0.46 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 31.56 2zit h PRO 297 CO 0.04 0.00 -1.17 0.28 -0.23 0.00 0.00 178.00 176.92 2zit h VAL 298 N 0.00 1.41 0.15 1.56 2.07 -1.77 -3.14 116.25 116.53 2zit h VAL 298 Ca 0.01 -3.13 -0.29 0.00 0.82 0.00 0.00 66.70 64.11 2zit h VAL 298 Cb 0.03 2.69 0.01 0.00 -1.52 0.00 0.00 31.29 32.50 2zit h VAL 298 CO -0.00 0.80 -1.30 0.25 0.02 0.00 0.00 177.57 177.34 2zit h LEU 299 N 0.00 0.51 0.25 2.57 5.85 -0.31 -2.91 115.31 121.27 2zit h LEU 299 Ca -0.09 -0.55 -0.01 0.00 0.84 0.00 0.00 57.88 58.08 2zit h LEU 299 Cb 1.81 -0.16 0.00 0.00 0.37 0.00 0.00 40.66 42.68 2zit h LEU 299 CO 0.11 1.43 -0.12 -0.07 -0.34 0.00 0.00 178.44 179.45 2zit h LEU 300 N 0.09 -0.29 -2.02 2.25 4.07 -1.24 -2.80 115.31 115.38 2zit h LEU 300 Ca -0.16 -0.22 0.14 0.00 0.08 0.00 0.00 57.88 57.72 2zit h LEU 300 Cb 2.01 0.07 -0.02 0.00 1.08 0.00 0.00 40.66 43.81 2zit h LEU 300 CO 0.22 0.10 0.38 -0.08 -1.08 0.00 0.00 178.44 177.98 2zit h GLU 301 N -0.73 0.00 -0.18 1.13 4.81 -1.67 -0.65 114.58 117.29 2zit h GLU 301 Ca -0.03 0.00 -0.15 0.00 -0.13 0.00 0.00 59.36 59.05 2zit h GLU 301 Cb 0.49 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 29.86 2zit h GLU 301 CO 0.06 0.00 -0.51 -0.22 -0.73 0.00 0.00 179.01 177.61 2zit h LYS 302 N 0.00 0.48 -0.63 1.92 3.64 -1.37 -2.89 116.57 117.73 2zit h LYS 302 Ca 0.24 -0.29 0.00 0.00 -1.27 0.00 0.00 60.65 59.33 2zit h LYS 302 Cb 0.99 0.03 0.00 0.00 -0.41 0.00 0.00 32.23 32.84 2zit h LYS 302 CO -0.00 0.88 0.00 1.28 -2.27 0.00 0.00 179.45 179.34 2zit n LEU 303 N -3.97 3.83 -3.21 5.20 4.77 -0.32 -4.96 117.00 118.35 2zit n LEU 303 Ca -0.03 -1.93 -0.08 0.00 -0.03 0.00 0.00 56.01 53.95 2zit n LEU 303 Cb 0.57 -0.49 0.02 0.00 -2.33 0.00 0.00 43.42 41.19 2zit n LEU 303 CO 0.46 0.73 0.19 1.21 -1.33 0.00 0.00 177.39 178.65 2zit n GLU 304 N 1.03 -1.56 -3.75 3.23 2.13 -0.81 -5.02 120.64 115.89 2zit n GLU 304 Ca 0.21 1.21 -0.28 0.00 0.66 0.00 0.00 57.16 58.96 2zit n GLU 304 Cb 0.69 -5.38 -0.16 0.00 0.27 0.00 0.00 31.44 26.86 2zit n GLU 304 CO 0.00 0.00 0.00 0.42 -0.41 0.00 0.00 177.13 177.14 2zit s ILE 305 N -3.13 0.69 -0.35 6.31 1.01 -0.83 -5.01 121.20 119.89 2zit s ILE 305 Ca 0.15 -0.81 -0.13 0.00 0.00 0.00 0.00 60.65 59.86 2zit s ILE 305 Cb -0.03 -1.24 -0.01 0.00 0.01 0.00 0.00 42.46 41.19 2zit s ILE 305 CO 0.77 -0.31 0.24 0.68 0.00 0.00 0.00 174.94 176.32 2zit s VAL 306 N 1.77 5.24 0.58 2.92 -7.23 -1.26 -4.34 120.40 118.07 2zit s VAL 306 Ca 0.01 -0.28 -0.16 0.00 -1.81 0.00 0.00 61.98 59.73 2zit s VAL 306 Cb -0.17 -3.72 -0.04 0.00 0.56 0.00 0.00 36.38 33.00 2zit s VAL 306 CO -0.12 -0.04 1.05 -0.76 -0.31 0.00 0.00 175.10 174.91 2zit s LEU 307 N 1.71 3.54 -1.06 1.32 1.43 -1.26 -4.98 118.68 119.39 2zit s LEU 307 Ca 0.06 1.80 -0.02 0.00 -1.03 0.00 0.00 54.13 54.93 2zit s LEU 307 Cb -0.18 -4.53 0.31 0.00 0.03 0.00 0.00 46.19 41.82 2zit s LEU 307 CO 0.10 -1.07 1.75 0.29 0.23 0.00 0.00 176.35 177.65 2zit n LYS 308 N -1.90 5.15 0.00 1.70 4.76 -1.26 -4.96 118.16 121.65 2zit n LYS 308 Ca 0.09 -4.59 0.00 0.00 -2.87 0.00 0.00 58.31 50.93 2zit n LYS 308 Cb 0.53 -2.49 0.00 0.00 -1.84 0.00 0.00 35.03 31.23 2zit n LYS 308 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2zit n GLY 309 N 0.40 0.61 0.37 0.72 0.00 -1.26 -3.74 105.19 102.29 2zit n GLY 309 Ca 0.42 0.65 0.12 0.00 0.00 0.00 0.00 46.02 47.20 2zit n GLY 309 CO 0.00 0.00 0.00 -1.80 0.00 0.00 0.00 173.32 171.52 2zit h ASP 310 N 0.00 0.73 0.46 1.61 -0.00 -2.05 -1.46 116.42 115.71 2zit h ASP 310 Ca 0.00 0.05 0.00 0.00 -0.00 0.00 0.00 57.03 57.08 2zit h ASP 310 Cb 0.00 -0.09 0.00 0.00 -0.00 0.00 0.00 39.33 39.24 2zit h ASP 310 CO 0.00 0.34 0.00 -0.62 -0.00 0.00 0.00 179.24 178.96 2zit n GLU 311 N -4.61 0.03 0.20 0.28 1.02 -1.25 -3.45 120.64 112.86 2zit n GLU 311 Ca 0.19 0.30 0.07 0.00 -0.02 0.00 0.00 57.16 57.71 2zit n GLU 311 Cb 0.49 -1.55 0.41 0.00 -0.02 0.00 0.00 31.44 30.77 2zit n GLU 311 CO 0.00 0.00 0.00 1.57 1.18 0.00 0.00 177.13 179.88 2zit h LYS 312 N 0.00 0.00 -0.25 3.49 5.09 -1.58 -3.07 116.57 120.25 2zit h LYS 312 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 60.65 60.74 2zit h LYS 312 Cb 0.23 0.00 0.00 0.00 0.10 0.00 0.00 32.23 32.56 2zit h LYS 312 CO 0.00 0.31 0.00 -0.40 -2.09 0.00 0.00 179.45 177.27 2zit n ASP 313 N -3.53 1.45 -4.83 7.07 5.68 -1.22 -4.90 116.55 116.26 2zit n ASP 313 Ca -0.00 -1.94 -0.33 0.00 -0.50 0.00 0.00 54.79 52.03 2zit n ASP 313 Cb 0.46 -0.17 -0.06 0.00 -1.14 0.00 0.00 41.12 40.21 2zit n ASP 313 CO 0.00 0.00 0.00 -0.76 -1.33 0.00 0.00 177.20 175.11 2zit s LEU 314 N -1.10 3.84 -0.22 -2.12 1.43 -1.16 -5.08 118.68 114.26 2zit s LEU 314 Ca 0.21 1.58 -0.16 0.00 -1.03 0.00 0.00 54.13 54.73 2zit s LEU 314 Cb 0.11 -4.46 0.06 0.00 0.03 0.00 0.00 46.19 41.93 2zit s LEU 314 CO 0.15 -0.42 0.57 -1.83 0.23 0.00 0.00 176.35 175.04 2zit s GLU 315 N -3.49 0.62 0.12 1.70 -1.05 -1.26 -4.69 118.70 110.65 2zit s GLU 315 Ca 0.60 0.92 0.00 0.00 -0.15 0.00 0.00 54.97 56.34 2zit s GLU 315 Cb -0.09 0.19 0.00 0.00 -0.44 0.00 0.00 34.13 33.78 2zit s GLU 315 CO 0.20 -0.12 0.00 0.41 0.95 0.00 0.00 175.26 176.70 2zit n GLY 316 N 3.57 0.49 0.35 -3.83 0.00 -1.25 -4.29 105.19 100.23 2zit n GLY 316 Ca -0.18 -1.71 -0.02 0.00 0.00 0.00 0.00 46.02 44.12 2zit n GLY 316 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2zit h LYS 317 N 0.00 1.09 -0.11 1.61 1.57 -1.97 0.24 116.57 119.00 2zit h LYS 317 Ca 0.00 -0.11 0.03 0.00 -1.87 0.00 0.00 60.65 58.70 2zit h LYS 317 Cb 0.00 -0.22 -0.00 0.00 0.08 0.00 0.00 32.23 32.09 2zit h LYS 317 CO 0.00 0.78 0.09 0.00 -0.57 0.00 0.00 179.45 179.75 2zit h ALA 318 N 1.39 1.98 0.01 3.86 0.00 -1.98 -1.47 119.26 123.06 2zit h ALA 318 Ca 0.28 -0.00 -0.24 0.00 0.00 0.00 0.00 54.91 54.95 2zit h ALA 318 Cb 0.00 0.01 -0.03 0.00 0.00 0.00 0.00 17.79 17.77 2zit h ALA 318 CO -0.05 -0.14 -1.29 1.25 0.00 0.00 0.00 179.25 179.02 2zit h LEU 319 N 0.00 0.04 -1.44 0.00 5.85 -1.52 -3.35 115.31 114.89 2zit h LEU 319 Ca 0.05 -0.57 0.09 0.00 0.84 0.00 0.00 57.88 58.29 2zit h LEU 319 Cb 0.22 -0.01 -0.05 0.00 0.37 0.00 0.00 40.66 41.19 2zit h LEU 319 CO -0.00 1.51 0.47 0.25 -0.34 0.00 0.00 178.44 180.34 2zit h LEU 320 N -0.89 0.58 -0.33 2.25 5.85 -0.83 -1.99 115.31 119.95 2zit h LEU 320 Ca -0.34 0.01 -0.04 0.00 0.84 0.00 0.00 57.88 58.34 2zit h LEU 320 Cb 1.37 -0.11 -0.01 0.00 0.37 0.00 0.00 40.66 42.28 2zit h LEU 320 CO -0.17 0.35 0.04 0.11 -0.34 0.00 0.00 178.44 178.43 2zit h LYS 321 N 0.65 0.55 -0.17 1.25 1.57 -1.45 -2.06 116.57 116.90 2zit h LYS 321 Ca 0.33 -0.16 -0.15 0.00 -1.87 0.00 0.00 60.65 58.80 2zit h LYS 321 Cb 0.42 -0.06 -0.01 0.00 0.08 0.00 0.00 32.23 32.67 2zit h LYS 321 CO -0.11 0.65 -0.54 0.28 -0.57 0.00 0.00 179.45 179.16 2zit h VAL 322 N 0.37 1.33 -0.17 0.50 2.07 -1.57 -2.86 116.25 115.92 2zit h VAL 322 Ca 0.10 -1.79 -0.04 0.00 0.82 0.00 0.00 66.70 65.79 2zit h VAL 322 Cb 0.37 1.78 -0.01 0.00 -1.52 0.00 0.00 31.29 31.92 2zit h VAL 322 CO 0.01 0.55 -0.04 0.58 0.02 0.00 0.00 177.57 178.69 2zit h VAL 323 N 0.39 1.29 0.00 2.57 2.07 -1.34 -3.01 116.25 118.22 2zit h VAL 323 Ca 0.01 -1.01 -0.03 0.00 0.82 0.00 0.00 66.70 66.49 2zit h VAL 323 Cb 1.06 1.60 -0.00 0.00 -1.52 0.00 0.00 31.29 32.43 2zit h VAL 323 CO 0.10 0.30 -0.14 0.24 0.02 0.00 0.00 177.57 178.09 2zit h MET 324 N 0.05 0.00 0.64 1.57 2.07 -1.39 -1.57 114.93 116.30 2zit h MET 324 Ca 0.04 0.00 -0.03 0.00 -2.07 0.00 0.00 59.70 57.64 2zit h MET 324 Cb 0.48 0.00 0.01 0.00 -1.87 0.00 0.00 31.60 30.21 2zit h MET 324 CO 0.02 0.14 -0.31 0.00 1.07 0.00 0.00 176.91 177.83 2zit h ARG 325 N 0.00 -0.83 -0.07 1.72 3.08 -1.38 -1.60 114.38 115.31 2zit h ARG 325 Ca -0.00 0.06 -0.01 0.00 0.07 0.00 0.00 59.98 60.10 2zit h ARG 325 Cb 0.28 0.19 -0.00 0.00 0.08 0.00 0.00 29.97 30.52 2zit h ARG 325 CO 0.02 -0.55 0.02 0.87 -1.07 0.00 0.00 179.97 179.25 2zit h LYS 326 N -0.95 0.09 0.13 0.04 1.79 -1.44 -2.37 116.57 113.86 2zit h LYS 326 Ca -0.09 -0.01 -0.01 0.00 -2.18 0.00 0.00 60.65 58.37 2zit h LYS 326 Cb 0.66 -0.02 0.00 0.00 -1.58 0.00 0.00 32.23 31.29 2zit h LYS 326 CO 0.15 0.09 -0.06 0.35 -1.08 0.00 0.00 179.45 178.89 2zit h PHE 327 N 0.09 -0.16 -2.80 -1.35 3.57 -1.26 -3.41 116.94 111.61 2zit h PHE 327 Ca 0.02 -0.00 -0.61 0.00 3.53 0.00 0.00 57.97 60.91 2zit h PHE 327 Cb 0.04 0.05 -0.41 0.00 2.79 0.00 0.00 35.95 38.42 2zit h PHE 327 CO 0.00 -0.10 -0.69 1.28 -2.23 0.00 0.00 178.31 176.57 2zit n LEU 328 N -2.80 2.17 -4.54 0.59 4.77 -0.61 -5.08 117.00 111.50 2zit n LEU 328 Ca -0.02 -5.02 -0.52 0.00 -0.03 0.00 0.00 56.01 50.43 2zit n LEU 328 Cb 0.07 -0.39 -0.07 0.00 -2.33 0.00 0.00 43.42 40.70 2zit n LEU 328 CO 0.05 1.82 1.66 -2.65 -1.33 0.00 0.00 177.39 176.94 2zit n PRO 329 N 2.05 1.29 -0.22 3.23 -0.02 -0.89 -0.71 135.00 139.73 2zit n PRO 329 Ca 0.23 0.41 0.02 0.00 -2.02 0.00 0.00 63.50 62.14 2zit n PRO 329 Cb 0.39 -2.44 0.14 0.00 -0.02 0.00 0.00 33.50 31.57 2zit n PRO 329 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2zit h ALA 330 N 10.88 0.88 0.00 3.55 0.00 -1.53 -1.93 119.26 131.11 2zit h ALA 330 Ca -0.35 0.10 -0.00 0.00 0.00 0.00 0.00 54.91 54.66 2zit h ALA 330 Cb 1.31 0.09 -0.00 0.00 0.00 0.00 0.00 17.79 19.19 2zit h ALA 330 CO 1.00 -0.21 -0.01 0.00 0.00 0.00 0.00 179.25 180.02 2zit h ALA 331 N 1.48 1.02 0.00 0.00 0.00 -1.87 -2.04 119.26 117.85 2zit h ALA 331 Ca 0.35 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.25 2zit h ALA 331 Cb 0.49 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.27 2zit h ALA 331 CO -0.36 0.01 -0.83 -0.44 0.00 0.00 0.00 179.25 177.63 2zit h ASP 332 N 0.00 0.00 0.92 0.00 5.19 -1.70 -2.43 116.42 118.40 2zit h ASP 332 Ca -0.00 -0.13 -0.22 0.00 -0.62 0.00 0.00 57.03 56.06 2zit h ASP 332 Cb 0.21 0.00 -0.03 0.00 0.18 0.00 0.00 39.33 39.69 2zit h ASP 332 CO 0.00 0.07 -1.13 0.00 -3.12 0.00 0.00 179.24 175.06 2zit h ALA 333 N 2.27 0.50 0.01 3.45 0.00 -1.36 -3.06 119.26 121.07 2zit h ALA 333 Ca 0.00 -0.99 -0.00 0.00 0.00 0.00 0.00 54.91 53.92 2zit h ALA 333 Cb 0.86 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.67 2zit h ALA 333 CO 0.00 1.25 -0.00 -0.07 0.00 0.00 0.00 179.25 180.42 2zit h LEU 334 N 0.00 -0.01 -1.71 0.00 3.38 -1.57 -3.19 115.31 112.21 2zit h LEU 334 Ca -0.08 -0.71 0.14 0.00 0.09 0.00 0.00 57.88 57.32 2zit h LEU 334 Cb 1.78 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 42.49 2zit h LEU 334 CO 0.11 0.84 0.45 -0.07 0.09 0.00 0.00 178.44 179.86 2zit h LEU 335 N -0.99 0.28 -0.05 1.67 3.38 -1.60 -0.84 115.31 117.17 2zit h LEU 335 Ca -0.00 0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.98 2zit h LEU 335 Cb 0.72 -0.04 -0.00 0.00 0.09 0.00 0.00 40.66 41.42 2zit h LEU 335 CO 0.00 0.15 0.02 -0.08 0.09 0.00 0.00 178.44 178.62 2zit h GLU 336 N 0.30 0.05 -0.40 1.13 4.81 -1.61 -1.59 114.58 117.26 2zit h GLU 336 Ca 0.32 -0.00 -0.06 0.00 -0.13 0.00 0.00 59.36 59.49 2zit h GLU 336 Cb 0.83 -0.01 -0.01 0.00 0.63 0.00 0.00 28.75 30.19 2zit h GLU 336 CO -0.08 0.03 0.02 0.52 -0.73 0.00 0.00 179.01 178.78 2zit h MET 337 N 0.05 0.68 -0.31 1.92 2.86 -1.19 -1.45 114.93 117.49 2zit h MET 337 Ca 0.02 -0.20 0.03 0.00 -2.06 0.00 0.00 59.70 57.48 2zit h MET 337 Cb 0.00 -0.07 -0.03 0.00 0.06 0.00 0.00 31.60 31.57 2zit h MET 337 CO -0.01 0.76 0.14 0.82 1.06 0.00 0.00 176.91 179.67 2zit h ILE 338 N 0.52 0.96 -0.03 -1.22 2.04 -1.16 -0.49 117.51 118.12 2zit h ILE 338 Ca 0.11 -0.10 -0.16 0.00 1.00 0.00 0.00 64.86 65.72 2zit h ILE 338 Cb 0.44 0.64 -0.01 0.00 -0.74 0.00 0.00 36.82 37.14 2zit h ILE 338 CO 0.02 0.05 -0.70 0.58 0.00 0.00 0.00 178.15 178.10 2zit h VAL 339 N 0.29 1.45 0.00 1.67 2.07 -1.25 -2.86 116.25 117.62 2zit h VAL 339 Ca 0.13 -2.27 -0.23 0.00 0.82 0.00 0.00 66.70 65.15 2zit h VAL 339 Cb 0.07 2.21 -0.04 0.00 -1.52 0.00 0.00 31.29 32.01 2zit h VAL 339 CO -0.11 0.66 -1.54 -0.07 0.02 0.00 0.00 177.57 176.52 2zit h LEU 340 N 0.10 0.00 0.00 2.57 3.38 -1.04 -3.43 115.31 116.89 2zit h LEU 340 Ca -0.02 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.95 2zit h LEU 340 Cb 1.25 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.00 2zit h LEU 340 CO 0.10 0.81 -0.70 1.41 0.09 0.00 0.00 178.44 180.15 2zit n HIS 341 N -2.99 0.00 -2.17 1.13 8.25 -0.21 -4.59 115.22 114.63 2zit n HIS 341 Ca -0.13 0.00 -0.42 0.00 -0.26 0.00 0.00 57.72 56.91 2zit n HIS 341 Cb 0.95 0.00 -0.03 0.00 1.12 0.00 0.00 29.99 32.03 2zit n HIS 341 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 2zit s LEU 342 N -3.29 4.38 0.51 2.41 1.43 -1.08 -4.97 118.68 118.07 2zit s LEU 342 Ca 0.00 2.35 -0.23 0.00 -1.03 0.00 0.00 54.13 55.22 2zit s LEU 342 Cb 0.00 -3.59 -0.06 0.00 0.03 0.00 0.00 46.19 42.57 2zit s LEU 342 CO 0.00 -0.63 1.31 -2.16 0.23 0.00 0.00 176.35 175.10 2zit s PRO 343 N 0.83 3.40 0.53 1.29 0.04 -1.26 -4.83 135.00 135.00 2zit s PRO 343 Ca 0.63 2.14 -0.05 0.00 0.04 0.00 0.00 61.00 63.76 2zit s PRO 343 Cb -0.37 -2.37 -0.01 0.00 0.04 0.00 0.00 34.50 31.80 2zit s PRO 343 CO 0.32 -0.95 0.83 -1.54 0.04 0.00 0.00 177.00 175.70 2zit s SER 344 N -0.99 5.87 0.48 6.66 1.04 -1.26 -4.44 113.70 121.06 2zit s SER 344 Ca 0.68 0.74 0.19 0.00 0.48 0.00 0.00 55.95 58.04 2zit s SER 344 Cb -0.38 -1.88 1.20 0.00 0.10 0.00 0.00 66.02 65.06 2zit s SER 344 CO 0.46 -0.84 1.97 -0.65 0.98 0.00 0.00 173.24 175.16 2zit h PRO 345 N 0.04 0.22 -0.74 4.02 0.11 -1.76 -0.06 132.00 133.84 2zit h PRO 345 Ca -0.46 -0.01 -0.05 0.00 0.11 0.00 0.00 66.00 65.58 2zit h PRO 345 Cb 1.24 -0.05 -0.03 0.00 0.11 0.00 0.00 31.00 32.27 2zit h PRO 345 CO 0.61 0.14 0.25 0.28 -0.21 0.00 0.00 178.00 179.07 2zit h VAL 346 N 0.22 1.26 0.00 3.15 2.07 -1.92 -2.33 116.25 118.71 2zit h VAL 346 Ca 0.29 -0.87 -0.01 0.00 0.82 0.00 0.00 66.70 66.94 2zit h VAL 346 Cb 0.84 0.43 0.00 0.00 -1.52 0.00 0.00 31.29 31.04 2zit h VAL 346 CO -0.06 0.34 -0.03 0.74 0.02 0.00 0.00 177.57 178.59 2zit h THR 347 N 1.08 1.74 -0.30 2.57 2.02 -1.45 -3.36 112.91 115.20 2zit h THR 347 Ca 0.24 -2.20 -0.11 0.00 0.77 0.00 0.00 66.41 65.11 2zit h THR 347 Cb 0.28 3.23 -0.01 0.00 -1.74 0.00 0.00 68.15 69.91 2zit h THR 347 CO -0.01 0.57 -0.25 0.00 0.37 0.00 0.00 175.52 176.20 2zit h ALA 348 N 0.07 0.43 0.00 6.16 0.00 -1.20 -3.06 119.26 121.66 2zit h ALA 348 Ca -0.00 -0.38 -0.00 0.00 0.00 0.00 0.00 54.91 54.52 2zit h ALA 348 Cb 0.96 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 18.65 2zit h ALA 348 CO 0.01 0.42 -0.00 1.96 0.00 0.00 0.00 179.25 181.63 2zit h GLN 349 N 0.45 0.00 -0.23 0.00 4.20 -1.61 -0.89 115.11 117.03 2zit h GLN 349 Ca 0.05 0.00 -0.08 0.00 0.06 0.00 0.00 58.65 58.68 2zit h GLN 349 Cb 0.81 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.58 2zit h GLN 349 CO 0.06 0.00 -0.20 0.00 -0.67 0.00 0.00 178.83 178.03 2zit h ALA 350 N 2.00 1.24 -0.01 3.87 0.00 -1.59 -1.82 119.26 122.94 2zit h ALA 350 Ca -0.00 -0.30 0.00 0.00 0.00 0.00 0.00 54.91 54.61 2zit h ALA 350 Cb 0.06 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 17.73 2zit h ALA 350 CO 0.00 0.50 -0.01 2.48 0.00 0.00 0.00 179.25 182.22 2zit n TYR 351 N -4.17 0.00 0.53 0.00 0.18 -0.63 -4.49 117.16 108.58 2zit n TYR 351 Ca -0.00 0.00 0.06 0.00 1.88 0.00 0.00 57.90 59.84 2zit n TYR 351 Cb 0.36 0.00 -0.02 0.00 -0.38 0.00 0.00 39.34 39.30 2zit n TYR 351 CO 0.00 0.00 0.00 0.54 -2.08 0.00 0.00 176.86 175.32 2zit n ARG 352 N 0.55 2.28 0.28 -3.48 1.74 -0.44 -4.72 116.66 112.88 2zit n ARG 352 Ca 0.06 -0.50 -0.14 0.00 -0.77 0.00 0.00 57.85 56.50 2zit n ARG 352 Cb 0.26 -1.12 -0.07 0.00 -1.02 0.00 0.00 32.46 30.51 2zit n ARG 352 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2zit h ALA 353 N 1.96 -0.75 -0.44 7.54 0.00 -1.56 -2.18 119.26 123.85 2zit h ALA 353 Ca 0.00 -0.20 0.13 0.00 0.00 0.00 0.00 54.91 54.84 2zit h ALA 353 Cb 0.37 0.29 -0.02 0.00 0.00 0.00 0.00 17.79 18.43 2zit h ALA 353 CO 0.00 -0.77 0.41 0.93 0.00 0.00 0.00 179.25 179.81 2zit h GLU 354 N -1.05 0.00 0.03 0.00 5.08 -1.86 0.68 114.58 117.46 2zit h GLU 354 Ca -0.08 0.00 -0.24 0.00 -1.00 0.00 0.00 59.36 58.05 2zit h GLU 354 Cb 0.64 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.86 2zit h GLU 354 CO 0.13 0.00 -1.17 0.37 -1.00 0.00 0.00 179.01 177.34 2zit h GLN 355 N 0.00 0.06 -0.01 2.33 4.15 -1.83 -3.30 115.11 116.51 2zit h GLN 355 Ca 0.21 -0.10 0.00 0.00 0.77 0.00 0.00 58.65 59.52 2zit h GLN 355 Cb 1.02 0.04 0.00 0.00 0.21 0.00 0.00 27.48 28.74 2zit h GLN 355 CO -0.00 0.98 -0.25 1.28 -1.93 0.00 0.00 178.83 178.90 2zit n LEU 356 N -3.35 1.47 -4.24 -2.39 4.77 0.10 -4.71 117.00 108.65 2zit n LEU 356 Ca -0.05 -0.47 -0.34 0.00 -0.03 0.00 0.00 56.01 55.12 2zit n LEU 356 Cb 0.97 -0.07 -0.15 0.00 -2.33 0.00 0.00 43.42 41.85 2zit n LEU 356 CO 0.48 0.27 -0.43 -0.47 -1.33 0.00 0.00 177.39 175.90 2zit s TYR 357 N -2.38 2.90 -2.07 -1.77 5.04 -0.42 -1.44 117.35 117.21 2zit s TYR 357 Ca 0.25 -1.19 0.30 0.00 -2.44 0.00 0.00 57.07 53.99 2zit s TYR 357 Cb 0.19 -2.04 1.70 0.00 0.35 0.00 0.00 41.96 42.16 2zit s TYR 357 CO 0.49 -0.64 2.11 0.39 -1.34 0.00 0.00 175.55 176.55 2zit n GLU 358 N 4.74 1.10 -1.13 4.97 1.02 -1.03 -4.83 120.64 125.48 2zit n GLU 358 Ca -0.19 -0.15 -0.03 0.00 -0.02 0.00 0.00 57.16 56.77 2zit n GLU 358 Cb 0.50 -1.48 0.01 0.00 -0.02 0.00 0.00 31.44 30.46 2zit n GLU 358 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2zit n GLY 359 N 1.01 1.40 3.64 0.62 0.00 -1.26 -4.95 105.19 105.64 2zit n GLY 359 Ca 0.22 -2.07 -0.37 0.00 0.00 0.00 0.00 46.02 43.80 2zit n GLY 359 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 2zit n PRO 360 N -1.23 0.89 0.22 1.61 -0.02 -1.26 -4.91 135.00 130.30 2zit n PRO 360 Ca 0.03 0.35 0.10 0.00 -2.02 0.00 0.00 63.50 61.96 2zit n PRO 360 Cb 0.09 -2.24 0.39 0.00 -0.02 0.00 0.00 33.50 31.72 2zit n PRO 360 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2zit h ALA 361 N 0.41 0.96 -0.51 3.55 0.00 -1.95 -2.97 119.26 118.75 2zit h ALA 361 Ca -0.49 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 54.23 2zit h ALA 361 Cb 1.36 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.12 2zit h ALA 361 CO 0.51 0.25 0.00 -0.40 0.00 0.00 0.00 179.25 179.61 2zit n ASP 362 N -3.28 4.03 -4.71 0.00 5.68 -1.26 -4.58 116.55 112.43 2zit n ASP 362 Ca 0.01 -2.36 -0.37 0.00 -0.50 0.00 0.00 54.79 51.57 2zit n ASP 362 Cb 0.47 -0.47 0.07 0.00 -1.14 0.00 0.00 41.12 40.06 2zit n ASP 362 CO 0.00 0.00 0.00 -0.67 -1.33 0.00 0.00 177.20 175.20 2zit n ASP 363 N 0.75 1.76 -0.33 -1.12 2.03 -1.12 -4.81 116.55 113.71 2zit n ASP 363 Ca 0.21 0.80 0.02 0.00 0.52 0.00 0.00 54.79 56.34 2zit n ASP 363 Cb 0.73 -1.53 0.16 0.00 -0.72 0.00 0.00 41.12 39.76 2zit n ASP 363 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2zit h ALA 364 N 0.37 1.26 -0.23 -1.67 0.00 -1.94 -1.46 119.26 115.59 2zit h ALA 364 Ca -0.50 -0.01 -0.20 0.00 0.00 0.00 0.00 54.91 54.20 2zit h ALA 364 Cb 1.34 -0.26 0.00 0.00 0.00 0.00 0.00 17.79 18.88 2zit h ALA 364 CO 0.52 0.33 -0.64 -0.91 0.00 0.00 0.00 179.25 178.55 2zit h ASN 365 N 1.04 0.96 -0.86 0.00 2.35 -1.95 -2.64 115.58 114.48 2zit h ASN 365 Ca 0.40 -0.57 0.00 0.00 -0.55 0.00 0.00 56.30 55.58 2zit h ASN 365 Cb 0.18 -0.28 -0.04 0.00 0.05 0.00 0.00 38.32 38.23 2zit h ASN 365 CO -0.18 1.36 0.54 0.00 -1.65 0.00 0.00 177.43 177.50 2zit h ILE 367 N 1.17 1.24 -0.12 0.00 2.04 -1.27 -1.10 117.51 119.48 2zit h ILE 367 Ca 0.31 -0.86 -0.03 0.00 1.00 0.00 0.00 64.86 65.28 2zit h ILE 367 Cb -0.08 0.54 -0.01 0.00 -0.74 0.00 0.00 36.82 36.53 2zit h ILE 367 CO -0.06 0.33 -0.08 0.00 0.00 0.00 0.00 178.15 178.34 2zit h ALA 368 N 1.24 1.65 -0.07 1.87 0.00 -0.93 -0.08 119.26 122.94 2zit h ALA 368 Ca 0.21 -0.15 -0.22 0.00 0.00 0.00 0.00 54.91 54.76 2zit h ALA 368 Cb 0.30 -0.07 0.01 0.00 0.00 0.00 0.00 17.79 18.03 2zit h ALA 368 CO -0.01 0.26 -0.80 0.82 0.00 0.00 0.00 179.25 179.52 2zit h ILE 369 N 0.17 1.31 -0.38 0.00 2.04 -0.54 0.07 117.51 120.19 2zit h ILE 369 Ca 0.04 -2.06 0.00 0.00 1.00 0.00 0.00 64.86 63.84 2zit h ILE 369 Cb 0.26 2.25 -0.02 0.00 -0.74 0.00 0.00 36.82 38.57 2zit h ILE 369 CO 0.01 0.63 0.24 0.11 0.00 0.00 0.00 178.15 179.15 2zit h LYS 370 N 0.33 0.50 -0.00 2.37 1.57 -0.78 -2.54 116.57 118.02 2zit h LYS 370 Ca -0.08 -0.03 0.00 0.00 -1.87 0.00 0.00 60.65 58.66 2zit h LYS 370 Cb 1.46 -0.11 0.00 0.00 0.08 0.00 0.00 32.23 33.66 2zit h LYS 370 CO 0.16 0.34 -0.03 0.09 -0.57 0.00 0.00 179.45 179.44 2zit n ASN 371 N -4.81 0.05 -3.89 0.86 3.02 -0.08 -3.61 115.26 106.80 2zit n ASN 371 Ca 0.00 0.17 -0.28 0.00 -0.03 0.00 0.00 54.58 54.44 2zit n ASN 371 Cb 0.03 -0.36 0.02 0.00 -0.61 0.00 0.00 39.78 38.86 2zit n ASN 371 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2zit s ASP 373 N -3.75 6.98 0.00 0.00 2.15 -0.16 -4.80 116.67 117.09 2zit s ASP 373 Ca 0.39 1.18 0.29 0.00 0.43 0.00 0.00 52.55 54.84 2zit s ASP 373 Cb -0.20 -2.54 1.31 0.00 -0.30 0.00 0.00 42.92 41.19 2zit s ASP 373 CO 0.84 -0.81 1.95 -0.81 -0.17 0.00 0.00 175.17 176.17 2zit n PRO 374 N 6.69 0.16 0.02 4.34 -0.04 -1.26 0.30 135.00 145.22 2zit n PRO 374 Ca 0.12 0.01 0.11 0.00 -0.04 0.00 0.00 63.50 63.71 2zit n PRO 374 Cb 0.47 -1.50 -0.02 0.00 -0.04 0.00 0.00 33.50 32.40 2zit n PRO 374 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 2zit n LYS 375 N -1.42 0.30 -1.57 0.54 4.76 -1.26 -2.25 118.16 117.27 2zit n LYS 375 Ca 0.10 -0.03 -0.26 0.00 -2.87 0.00 0.00 58.31 55.25 2zit n LYS 375 Cb 0.29 -1.58 0.19 0.00 -1.84 0.00 0.00 35.03 32.09 2zit n LYS 375 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2zit n ALA 376 N -1.85 -1.57 -1.76 7.82 0.00 -1.22 -4.90 120.51 117.04 2zit n ALA 376 Ca 0.01 -1.51 -0.39 0.00 0.00 0.00 0.00 53.44 51.55 2zit n ALA 376 Cb 0.44 -0.08 0.02 0.00 0.00 0.00 0.00 19.45 19.84 2zit n ALA 376 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2zit s ASP 377 N -5.13 5.65 0.26 0.00 1.01 -1.26 -3.64 116.67 113.56 2zit s ASP 377 Ca 0.66 2.77 -0.31 0.00 0.71 0.00 0.00 52.55 56.38 2zit s ASP 377 Cb -0.02 -2.64 -0.12 0.00 1.01 0.00 0.00 42.92 41.15 2zit s ASP 377 CO 0.47 -1.31 1.65 -0.11 0.21 0.00 0.00 175.17 176.07 2zit n LEU 378 N -0.59 4.21 -3.40 1.23 7.94 -1.26 -3.66 117.00 121.47 2zit n LEU 378 Ca 0.08 1.11 -0.26 0.00 -1.11 0.00 0.00 56.01 55.83 2zit n LEU 378 Cb 0.44 -1.58 -0.09 0.00 0.53 0.00 0.00 43.42 42.71 2zit n LEU 378 CO 0.55 0.16 -0.23 0.23 -1.11 0.00 0.00 177.39 176.99 2zit n MET 379 N 2.87 0.82 -3.78 1.96 2.81 -0.28 -3.01 117.12 118.51 2zit n MET 379 Ca 0.12 -3.53 -0.37 0.00 -1.81 0.00 0.00 57.70 52.11 2zit n MET 379 Cb 0.36 -1.67 -0.06 0.00 -0.71 0.00 0.00 33.22 31.14 2zit n MET 379 CO 0.00 0.00 0.00 -1.17 1.51 0.00 0.00 175.97 176.31 2zit s LEU 380 N -0.81 4.40 -0.27 4.03 0.20 0.13 -1.16 118.68 125.21 2zit s LEU 380 Ca 0.33 0.58 0.03 0.00 0.69 0.00 0.00 54.13 55.76 2zit s LEU 380 Cb 0.08 -2.31 0.06 0.00 -0.43 0.00 0.00 46.19 43.59 2zit s LEU 380 CO -0.15 0.36 -0.09 -0.47 -0.29 0.00 0.00 176.35 175.70 2zit s TYR 381 N -1.10 3.31 -0.34 5.38 5.04 -0.30 -0.80 117.35 128.54 2zit s TYR 381 Ca 0.20 -2.37 -0.27 0.00 -2.44 0.00 0.00 57.07 52.18 2zit s TYR 381 Cb -0.13 -2.01 0.01 0.00 0.35 0.00 0.00 41.96 40.18 2zit s TYR 381 CO 0.09 -0.88 0.97 0.08 -1.34 0.00 0.00 175.55 174.47 2zit s VAL 382 N 1.09 4.58 0.03 3.14 1.01 -0.85 -1.16 120.40 128.24 2zit s VAL 382 Ca -0.07 1.45 -0.05 0.00 0.00 0.00 0.00 61.98 63.30 2zit s VAL 382 Cb -0.20 -4.34 -0.29 0.00 0.00 0.00 0.00 36.38 31.55 2zit s VAL 382 CO -0.05 -0.46 0.95 0.77 0.00 0.00 0.00 175.10 176.31 2zit h SER 383 N 8.24 0.46 -5.18 3.32 4.64 -1.04 -3.05 113.55 120.94 2zit h SER 383 Ca -0.22 -0.57 0.12 0.00 -0.47 0.00 0.00 61.79 60.65 2zit h SER 383 Cb 1.07 -0.15 -0.06 0.00 -0.31 0.00 0.00 62.40 62.95 2zit h SER 383 CO 0.99 1.46 0.38 -1.59 -0.87 0.00 0.00 176.83 177.20 2zit s LYS 384 N -2.63 1.51 -0.16 4.77 -2.85 -0.97 -4.58 119.74 114.83 2zit s LYS 384 Ca -0.08 -0.85 -0.02 0.00 -1.00 0.00 0.00 55.97 54.02 2zit s LYS 384 Cb 0.07 0.50 -0.02 0.00 -2.06 0.00 0.00 37.83 36.32 2zit s LYS 384 CO 0.87 -0.69 -0.08 -1.64 0.10 0.00 0.00 175.35 173.91 2zit s MET 385 N -3.40 3.47 -0.16 1.78 -1.94 -1.25 -0.94 119.30 116.86 2zit s MET 385 Ca 0.13 -0.62 -0.06 0.00 -1.71 0.00 0.00 55.69 53.43 2zit s MET 385 Cb -0.04 -2.83 -0.04 0.00 2.01 0.00 0.00 34.83 33.94 2zit s MET 385 CO 0.05 0.11 0.03 0.54 -0.01 0.00 0.00 175.02 175.73 2zit s VAL 386 N 0.67 4.47 0.31 -6.03 0.11 -0.21 -4.92 120.40 114.82 2zit s VAL 386 Ca -0.04 -0.15 -0.29 0.00 -2.93 0.00 0.00 61.98 58.57 2zit s VAL 386 Cb -0.15 -2.98 -0.10 0.00 -1.53 0.00 0.00 36.38 31.61 2zit s VAL 386 CO 0.02 0.49 1.38 -2.84 -3.33 0.00 0.00 175.10 170.82 2zit s PRO 387 N 0.19 4.29 0.26 1.54 0.02 -1.26 -1.62 135.00 138.41 2zit s PRO 387 Ca 0.02 2.30 0.05 0.00 0.02 0.00 0.00 61.00 63.40 2zit s PRO 387 Cb -0.13 -3.06 -0.05 0.00 0.02 0.00 0.00 34.50 31.27 2zit s PRO 387 CO 0.01 -0.32 -0.04 0.95 -0.33 0.00 0.00 177.00 177.28 2zit s THR 388 N -0.78 1.37 -0.95 0.99 -4.23 -0.98 -2.68 115.64 108.36 2zit s THR 388 Ca 0.53 -2.08 0.23 0.00 -1.18 0.00 0.00 61.69 59.18 2zit s THR 388 Cb -0.42 -2.39 0.20 0.00 1.34 0.00 0.00 72.50 71.23 2zit s THR 388 CO 0.52 -0.32 1.72 -1.54 -0.54 0.00 0.00 174.62 174.46 2zit n SER 389 N -0.50 0.09 -4.58 3.99 3.41 -0.83 -4.01 113.62 111.19 2zit n SER 389 Ca -0.05 0.51 -0.32 0.00 -0.26 0.00 0.00 58.87 58.75 2zit n SER 389 Cb 0.64 -0.54 -0.04 0.00 -0.26 0.00 0.00 64.21 64.01 2zit n SER 389 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 2zit s ASP 390 N -3.17 5.58 -1.66 4.04 2.15 -1.26 -4.30 116.67 118.05 2zit s ASP 390 Ca 0.10 -1.73 -0.14 0.00 0.43 0.00 0.00 52.55 51.21 2zit s ASP 390 Cb 0.14 -2.58 0.13 0.00 -0.30 0.00 0.00 42.92 40.31 2zit s ASP 390 CO 0.42 -2.48 0.64 0.29 -0.17 0.00 0.00 175.17 173.88 2zit n LYS 391 N 8.41 -2.75 -1.98 4.34 5.02 -1.26 -0.57 118.16 129.37 2zit n LYS 391 Ca 0.45 0.33 -0.16 0.00 -2.02 0.00 0.00 58.31 56.91 2zit n LYS 391 Cb 0.47 -4.84 -0.03 0.00 -0.02 0.00 0.00 35.03 30.61 2zit n LYS 391 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2zit n GLY 392 N -1.56 0.43 3.85 0.72 0.00 -1.26 -4.99 105.19 102.38 2zit n GLY 392 Ca -0.02 -0.24 -0.32 0.00 0.00 0.00 0.00 46.02 45.44 2zit n GLY 392 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2zit s ARG 393 N -4.25 3.99 -0.22 1.61 1.81 0.26 -4.91 118.95 117.25 2zit s ARG 393 Ca 0.00 0.64 -0.02 0.00 -1.72 0.00 0.00 55.73 54.62 2zit s ARG 393 Cb 0.00 -2.46 0.00 0.00 -0.45 0.00 0.00 34.95 32.04 2zit s ARG 393 CO 0.00 0.18 -0.08 -0.06 -0.68 0.00 0.00 175.30 174.66 2zit s PHE 394 N -1.96 2.94 0.16 -0.53 0.08 -1.26 -2.32 117.98 115.09 2zit s PHE 394 Ca 0.53 -1.19 -0.27 0.00 0.12 0.00 0.00 56.93 56.13 2zit s PHE 394 Cb -0.10 -2.06 -0.08 0.00 -0.57 0.00 0.00 43.02 40.21 2zit s PHE 394 CO 0.18 -0.64 0.82 0.71 -0.10 0.00 0.00 175.22 176.20 2zit s TYR 395 N 1.41 3.90 -0.31 0.36 1.51 -0.64 -4.03 117.35 119.56 2zit s TYR 395 Ca 0.05 1.69 -0.27 0.00 -1.01 0.00 0.00 57.07 57.53 2zit s TYR 395 Cb -0.14 -2.84 0.01 0.00 -0.11 0.00 0.00 41.96 38.88 2zit s TYR 395 CO -0.06 0.45 0.97 0.00 -1.11 0.00 0.00 175.55 175.81 2zit s ALA 396 N -0.94 3.53 -0.20 3.71 0.00 0.89 -1.04 121.76 127.71 2zit s ALA 396 Ca 0.38 -0.17 -0.09 0.00 0.00 0.00 0.00 51.96 52.08 2zit s ALA 396 Cb -0.23 -3.53 -0.05 0.00 0.00 0.00 0.00 23.12 19.31 2zit s ALA 396 CO 0.27 -1.35 0.10 0.12 0.00 0.00 0.00 175.76 174.91 2zit s PHE 397 N 3.36 3.32 0.00 0.00 5.36 -0.11 0.37 117.98 130.27 2zit s PHE 397 Ca 0.41 0.19 0.00 0.00 -0.96 0.00 0.00 56.93 56.56 2zit s PHE 397 Cb -0.13 -2.14 0.00 0.00 -0.34 0.00 0.00 43.02 40.41 2zit s PHE 397 CO 0.13 0.19 0.00 0.41 -1.46 0.00 0.00 175.22 174.49 2zit n GLY 398 N 3.66 2.15 2.88 13.12 0.00 -0.84 -0.46 105.19 125.70 2zit n GLY 398 Ca -0.16 -0.70 -0.15 0.00 0.00 0.00 0.00 46.02 45.01 2zit n GLY 398 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2zit s ARG 399 N 0.98 0.23 -0.26 1.61 3.52 -0.30 -1.82 118.95 122.91 2zit s ARG 399 Ca 0.00 -0.03 -0.25 0.00 -0.13 0.00 0.00 55.73 55.32 2zit s ARG 399 Cb 0.00 -0.29 -0.00 0.00 -1.56 0.00 0.00 34.95 33.09 2zit s ARG 399 CO 0.00 -0.01 0.86 0.08 -0.81 0.00 0.00 175.30 175.42 2zit s VAL 400 N 0.31 4.79 -0.12 7.11 1.01 -0.58 -1.15 120.40 131.77 2zit s VAL 400 Ca -0.03 1.55 0.20 0.00 0.00 0.00 0.00 61.98 63.69 2zit s VAL 400 Cb -0.05 -4.16 -0.27 0.00 0.00 0.00 0.00 36.38 31.89 2zit s VAL 400 CO -0.01 -0.15 0.35 0.49 0.00 0.00 0.00 175.10 175.79 2zit n PHE 401 N 6.14 0.13 -3.67 5.22 3.72 -0.30 0.11 117.46 128.80 2zit n PHE 401 Ca 0.06 0.04 -0.13 0.00 -0.05 0.00 0.00 57.45 57.37 2zit n PHE 401 Cb 0.47 -0.79 -0.07 0.00 -0.94 0.00 0.00 39.48 38.16 2zit n PHE 401 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 2zit s ALA 402 N -3.00 -1.01 0.09 4.37 0.00 -1.16 -4.42 121.76 116.62 2zit s ALA 402 Ca -0.08 0.37 0.00 0.00 0.00 0.00 0.00 51.96 52.25 2zit s ALA 402 Cb 0.10 0.28 0.00 0.00 0.00 0.00 0.00 23.12 23.50 2zit s ALA 402 CO 0.86 -0.42 0.00 0.41 0.00 0.00 0.00 175.76 176.62 2zit n GLY 403 N 0.66 -1.72 3.12 0.00 0.00 0.15 -1.12 105.19 106.28 2zit n GLY 403 Ca -0.19 -1.24 -0.26 0.00 0.00 0.00 0.00 46.02 44.33 2zit n GLY 403 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2zit s THR 404 N -0.76 1.41 -0.20 2.61 -4.23 -0.95 -2.10 115.64 111.41 2zit s THR 404 Ca 0.00 -0.69 -0.08 0.00 -1.18 0.00 0.00 61.69 59.74 2zit s THR 404 Cb 0.00 -1.22 -0.04 0.00 1.34 0.00 0.00 72.50 72.58 2zit s THR 404 CO 0.00 0.41 0.09 0.54 -0.54 0.00 0.00 174.62 175.12 2zit s VAL 405 N 0.14 4.94 0.16 2.29 0.11 -0.99 -4.89 120.40 122.16 2zit s VAL 405 Ca -0.06 0.02 0.07 0.00 -2.93 0.00 0.00 61.98 59.09 2zit s VAL 405 Cb -0.12 -3.25 -0.04 0.00 -1.53 0.00 0.00 36.38 31.43 2zit s VAL 405 CO 0.03 0.43 -0.16 -1.59 -3.33 0.00 0.00 175.10 170.48 2zit s LYS 406 N 0.60 1.21 0.37 1.54 0.00 -1.26 -0.19 119.74 122.01 2zit s LYS 406 Ca 0.05 -1.41 -0.28 0.00 0.00 0.00 0.00 55.97 54.33 2zit s LYS 406 Cb -0.13 -1.12 -0.11 0.00 0.00 0.00 0.00 37.83 36.47 2zit s LYS 406 CO 0.01 0.21 1.47 -1.12 0.00 0.00 0.00 175.35 175.92 2zit s SER 407 N -2.80 6.39 0.00 0.03 0.01 -0.30 -2.37 113.70 114.67 2zit s SER 407 Ca 0.16 3.01 0.00 0.00 1.31 0.00 0.00 55.95 60.42 2zit s SER 407 Cb -0.04 -2.66 0.00 0.00 0.21 0.00 0.00 66.02 63.53 2zit s SER 407 CO 0.05 -0.84 0.00 0.61 0.41 0.00 0.00 173.24 173.47 2zit n GLY 408 N 0.58 2.74 3.74 3.44 0.00 0.21 -5.00 105.19 110.90 2zit n GLY 408 Ca 0.01 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.63 2zit n GLY 408 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 2zit n GLN 409 N -2.00 2.22 -3.00 1.61 7.27 -1.00 -4.54 117.38 117.95 2zit n GLN 409 Ca 0.00 0.79 -0.40 0.00 0.07 0.00 0.00 57.00 57.46 2zit n GLN 409 Cb 0.00 -2.53 -0.05 0.00 2.41 0.00 0.00 30.24 30.07 2zit n GLN 409 CO 0.00 0.00 0.00 0.21 0.07 0.00 0.00 177.06 177.34 2zit s LYS 410 N -2.26 4.47 0.02 3.69 2.47 -1.26 -0.38 119.74 126.49 2zit s LYS 410 Ca 0.59 1.00 0.01 0.00 -1.56 0.00 0.00 55.97 56.01 2zit s LYS 410 Cb -0.48 -3.41 -0.02 0.00 -1.46 0.00 0.00 37.83 32.47 2zit s LYS 410 CO 0.59 0.17 -0.04 0.08 0.16 0.00 0.00 175.35 176.31 2zit s VAL 411 N 0.39 0.28 -0.25 4.02 1.01 0.22 -4.95 120.40 121.11 2zit s VAL 411 Ca 0.39 -0.73 -0.26 0.00 0.00 0.00 0.00 61.98 61.38 2zit s VAL 411 Cb -0.19 -0.35 -0.00 0.00 0.00 0.00 0.00 36.38 35.84 2zit s VAL 411 CO 0.21 -0.30 0.88 -0.13 0.00 0.00 0.00 175.10 175.76 2zit s ARG 412 N -1.09 4.18 -0.49 2.72 0.52 -0.59 -1.82 118.95 122.38 2zit s ARG 412 Ca -0.09 1.01 -0.16 0.00 -0.52 0.00 0.00 55.73 55.97 2zit s ARG 412 Cb -0.07 -3.65 0.09 0.00 0.52 0.00 0.00 34.95 31.83 2zit s ARG 412 CO -0.00 -0.57 0.42 0.42 0.02 0.00 0.00 175.30 175.59 2zit s ILE 413 N 2.96 5.23 -0.38 1.52 1.01 0.13 -1.75 121.20 129.91 2zit s ILE 413 Ca 0.37 -1.18 -0.14 0.00 0.00 0.00 0.00 60.65 59.70 2zit s ILE 413 Cb -0.15 -4.18 0.00 0.00 0.01 0.00 0.00 42.46 38.14 2zit s ILE 413 CO 0.08 -0.65 0.29 -1.10 0.00 0.00 0.00 174.94 173.55 2zit s GLN 414 N 1.63 3.20 0.89 2.79 -0.21 0.36 -1.71 119.66 126.61 2zit s GLN 414 Ca 0.04 -0.84 -0.15 0.00 0.02 0.00 0.00 55.36 54.42 2zit s GLN 414 Cb -0.26 -3.91 0.22 0.00 1.00 0.00 0.00 33.01 30.06 2zit s GLN 414 CO 0.06 -0.63 0.86 0.41 -2.12 0.00 0.00 175.29 173.87 2zit n GLY 415 N 5.13 -2.44 0.32 3.09 0.00 -0.53 -1.31 105.19 109.45 2zit n GLY 415 Ca -0.11 -1.53 0.20 0.00 0.00 0.00 0.00 46.02 44.58 2zit n GLY 415 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2zit h PRO 416 N 0.00 0.00 -0.23 1.61 0.13 -1.89 -2.64 132.00 128.99 2zit h PRO 416 Ca -0.31 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.82 2zit h PRO 416 Cb 0.94 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.07 2zit h PRO 416 CO 0.21 0.01 0.00 0.09 -0.23 0.00 0.00 178.00 178.08 2zit n ASN 417 N -3.29 3.40 -4.80 1.44 3.02 -1.26 -5.03 115.26 108.74 2zit n ASN 417 Ca -0.03 -2.78 -0.34 0.00 -0.03 0.00 0.00 54.58 51.40 2zit n ASN 417 Cb 0.11 -0.44 -0.04 0.00 -0.61 0.00 0.00 39.78 38.80 2zit n ASN 417 CO 0.00 0.00 0.00 -0.47 -2.62 0.00 0.00 177.26 174.17 2zit s TYR 418 N -2.40 3.11 -0.06 3.10 5.04 -0.99 -4.79 117.35 120.37 2zit s TYR 418 Ca 0.35 1.60 -0.03 0.00 -2.44 0.00 0.00 57.07 56.54 2zit s TYR 418 Cb 0.27 -3.03 0.03 0.00 0.35 0.00 0.00 41.96 39.58 2zit s TYR 418 CO 0.09 -0.63 0.13 0.08 -1.34 0.00 0.00 175.55 173.88 2zit s VAL 419 N -1.96 -0.03 0.13 3.14 1.01 -1.26 -4.79 120.40 116.63 2zit s VAL 419 Ca 0.64 0.11 0.12 0.00 0.00 0.00 0.00 61.98 62.85 2zit s VAL 419 Cb -0.16 -0.21 0.12 0.00 0.00 0.00 0.00 36.38 36.13 2zit s VAL 419 CO 0.20 0.04 1.24 -0.65 0.00 0.00 0.00 175.10 175.93 2zit h PRO 420 N 6.72 0.00 0.00 2.72 0.11 -1.91 -2.48 132.00 137.16 2zit h PRO 420 Ca -0.36 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.75 2zit h PRO 420 Cb 1.16 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.27 2zit h PRO 420 CO 0.43 0.00 -0.29 0.78 -0.21 0.00 0.00 178.00 178.71 2zit h GLY 421 N 0.00 0.00 -0.97 -0.55 0.00 -1.95 -3.46 103.07 96.13 2zit h GLY 421 Ca 0.00 0.00 -0.45 0.00 0.00 0.00 0.00 47.33 46.88 2zit h GLY 421 CO 0.00 0.00 0.36 0.54 0.00 0.00 0.00 176.54 177.44 2zit s LYS 422 N -1.91 0.68 -0.13 4.80 1.02 -0.93 -5.01 119.74 118.26 2zit s LYS 422 Ca -0.08 -0.63 0.15 0.00 0.02 0.00 0.00 55.97 55.42 2zit s LYS 422 Cb 0.01 -1.93 0.38 0.00 -0.52 0.00 0.00 37.83 35.77 2zit s LYS 422 CO 0.12 -2.33 1.28 1.63 -0.92 0.00 0.00 175.35 175.13 2zit n LYS 423 N -3.64 2.42 -2.51 1.68 5.02 -1.26 -4.60 118.16 115.27 2zit n LYS 423 Ca 0.16 -2.54 -0.41 0.00 -2.02 0.00 0.00 58.31 53.50 2zit n LYS 423 Cb 0.59 -1.59 -0.04 0.00 -0.02 0.00 0.00 35.03 33.97 2zit n LYS 423 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 2zit s ASP 424 N -2.02 7.25 -1.31 4.39 -1.08 -1.26 -3.44 116.67 119.20 2zit s ASP 424 Ca 0.33 2.08 -0.04 0.00 -0.52 0.00 0.00 52.55 54.39 2zit s ASP 424 Cb 0.26 -2.60 0.00 0.00 -1.46 0.00 0.00 42.92 39.13 2zit s ASP 424 CO 0.07 -0.24 0.53 -0.67 0.52 0.00 0.00 175.17 175.38 2zit n ASP 425 N 2.53 -5.44 -4.21 -0.34 -0.08 -1.26 -4.17 116.55 103.58 2zit n ASP 425 Ca 0.03 -0.25 -0.32 0.00 -1.51 0.00 0.00 54.79 52.75 2zit n ASP 425 Cb 0.46 -4.27 -0.17 0.00 2.34 0.00 0.00 41.12 39.48 2zit n ASP 425 CO 0.00 0.00 0.00 -0.22 0.12 0.00 0.00 177.20 177.10 2zit s LEU 426 N -5.72 2.07 -0.15 -2.67 2.96 -1.22 -1.45 118.68 112.49 2zit s LEU 426 Ca 0.26 -0.55 -0.02 0.00 -0.22 0.00 0.00 54.13 53.61 2zit s LEU 426 Cb -0.12 -1.38 0.05 0.00 0.50 0.00 0.00 46.19 45.24 2zit s LEU 426 CO 0.33 0.16 -0.01 -0.36 -1.32 0.00 0.00 176.35 175.15 2zit s PHE 427 N 0.33 1.19 -1.09 5.38 0.08 -0.69 -4.97 117.98 118.20 2zit s PHE 427 Ca -0.18 -0.77 -0.14 0.00 0.12 0.00 0.00 56.93 55.96 2zit s PHE 427 Cb -0.18 -1.08 0.19 0.00 -0.57 0.00 0.00 43.02 41.38 2zit s PHE 427 CO 0.09 -0.54 1.25 0.42 -0.10 0.00 0.00 175.22 176.33 2zit s ILE 428 N 1.80 5.19 0.49 0.64 1.01 -1.26 0.18 121.20 129.25 2zit s ILE 428 Ca 0.01 -2.53 0.02 0.00 0.00 0.00 0.00 60.65 58.16 2zit s ILE 428 Cb -0.15 -4.79 0.02 0.00 0.01 0.00 0.00 42.46 37.55 2zit s ILE 428 CO -0.07 -1.47 0.17 0.29 0.00 0.00 0.00 174.94 173.87 2zit n LYS 429 N 5.17 0.80 -4.81 2.79 4.76 -0.76 -4.85 118.16 121.27 2zit n LYS 429 Ca 0.29 -3.32 -0.32 0.00 -2.87 0.00 0.00 58.31 52.10 2zit n LYS 429 Cb 0.44 0.65 -0.13 0.00 -1.84 0.00 0.00 35.03 34.15 2zit n LYS 429 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2zit s ALA 430 N -2.77 2.63 -0.55 7.82 0.00 -1.26 0.71 121.76 128.33 2zit s ALA 430 Ca 0.13 -1.07 -0.28 0.00 0.00 0.00 0.00 51.96 50.75 2zit s ALA 430 Cb -0.01 -0.87 0.00 0.00 0.00 0.00 0.00 23.12 22.25 2zit s ALA 430 CO 0.08 0.57 1.53 0.42 0.00 0.00 0.00 175.76 178.36 2zit s ILE 431 N -0.81 3.67 0.39 0.00 -1.09 0.49 -4.87 121.20 118.97 2zit s ILE 431 Ca 0.13 0.56 0.06 0.00 -2.23 0.00 0.00 60.65 59.17 2zit s ILE 431 Cb -0.11 -4.29 0.23 0.00 -1.58 0.00 0.00 42.46 36.71 2zit s ILE 431 CO 0.03 -1.08 2.00 -0.61 -1.23 0.00 0.00 174.94 174.05 2zit h GLN 432 N 11.90 0.53 -1.89 2.79 4.15 -1.61 0.60 115.11 131.57 2zit h GLN 432 Ca -0.27 -0.06 -0.01 0.00 0.77 0.00 0.00 58.65 59.08 2zit h GLN 432 Cb 1.11 -0.11 -0.22 0.00 0.21 0.00 0.00 27.48 28.47 2zit h GLN 432 CO 1.17 0.42 0.20 0.50 -1.93 0.00 0.00 178.83 179.20 2zit s ARG 433 N -5.32 0.73 -0.26 1.69 6.06 -1.21 -4.31 118.95 116.33 2zit s ARG 433 Ca -0.08 0.92 -0.08 0.00 -2.50 0.00 0.00 55.73 53.99 2zit s ARG 433 Cb 0.17 0.33 -0.03 0.00 0.06 0.00 0.00 34.95 35.48 2zit s ARG 433 CO 0.74 -0.10 0.09 0.08 -2.50 0.00 0.00 175.30 173.62 2zit s VAL 434 N 0.50 4.43 0.08 7.11 1.01 -1.26 -1.27 120.40 131.00 2zit s VAL 434 Ca -0.01 -0.19 0.06 0.00 0.00 0.00 0.00 61.98 61.85 2zit s VAL 434 Cb -0.05 -3.11 -0.03 0.00 0.00 0.00 0.00 36.38 33.19 2zit s VAL 434 CO -0.03 0.29 -0.17 0.68 0.00 0.00 0.00 175.10 175.86 2zit s VAL 435 N 1.62 1.38 -0.20 2.92 -7.23 -0.40 -0.91 120.40 117.59 2zit s VAL 435 Ca 0.06 -1.36 -0.24 0.00 -1.81 0.00 0.00 61.98 58.63 2zit s VAL 435 Cb -0.15 -1.28 -0.01 0.00 0.56 0.00 0.00 36.38 35.49 2zit s VAL 435 CO 0.05 -0.11 0.79 -0.76 -0.31 0.00 0.00 175.10 174.75 2zit s LEU 436 N -1.71 4.14 -1.38 1.32 1.43 -0.19 -1.57 118.68 120.72 2zit s LEU 436 Ca 0.02 1.06 -0.15 0.00 -1.03 0.00 0.00 54.13 54.03 2zit s LEU 436 Cb -0.10 -3.14 0.01 0.00 0.03 0.00 0.00 46.19 42.99 2zit s LEU 436 CO 0.03 -0.41 2.21 0.23 0.23 0.00 0.00 176.35 178.65 2zit n MET 437 N 5.42 2.72 -1.33 1.70 2.81 -1.26 -2.17 117.12 125.00 2zit n MET 437 Ca 0.03 -2.50 -0.39 0.00 -1.81 0.00 0.00 57.70 53.03 2zit n MET 437 Cb 0.49 -3.23 -0.06 0.00 -0.71 0.00 0.00 33.22 29.70 2zit n MET 437 CO 0.00 0.00 0.00 -1.33 1.51 0.00 0.00 175.97 176.15 2zit n MET 438 N 6.13 1.38 0.00 0.03 0.00 0.10 -4.54 117.12 120.22 2zit n MET 438 Ca 0.52 -1.93 0.00 0.00 0.00 0.00 0.00 57.70 56.30 2zit n MET 438 Cb 0.39 -3.10 0.00 0.00 0.00 0.00 0.00 33.22 30.51 2zit n MET 438 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 2zit n GLY 439 N 4.90 1.05 0.17 3.03 0.00 -0.60 -1.96 105.19 111.78 2zit n GLY 439 Ca 0.48 0.39 0.02 0.00 0.00 0.00 0.00 46.02 46.92 2zit n GLY 439 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 2zit n ARG 440 N 0.00 0.60 -4.57 1.61 0.63 -1.26 -3.69 116.66 109.97 2zit n ARG 440 Ca 0.00 -0.68 -0.27 0.00 -0.92 0.00 0.00 57.85 55.99 2zit n ARG 440 Cb 0.00 -1.04 -0.11 0.00 0.45 0.00 0.00 32.46 31.76 2zit n ARG 440 CO 0.00 0.00 0.00 -0.06 -2.51 0.00 0.00 177.63 175.06 2zit s PHE 441 N -0.58 2.42 0.31 -0.14 0.08 -0.83 -0.84 117.98 118.40 2zit s PHE 441 Ca 0.05 -0.62 0.10 0.00 0.12 0.00 0.00 56.93 56.58 2zit s PHE 441 Cb 0.04 -1.57 -0.05 0.00 -0.57 0.00 0.00 43.02 40.87 2zit s PHE 441 CO 0.08 0.47 -0.04 0.14 -0.10 0.00 0.00 175.22 175.77 2zit s VAL 442 N -2.71 2.82 -0.23 -0.44 -7.23 -1.25 -0.72 120.40 110.64 2zit s VAL 442 Ca 0.34 -2.06 -0.03 0.00 -1.81 0.00 0.00 61.98 58.42 2zit s VAL 442 Cb 0.07 -2.70 0.12 0.00 0.56 0.00 0.00 36.38 34.43 2zit s VAL 442 CO 0.17 -0.30 0.35 -0.70 -0.31 0.00 0.00 175.10 174.31 2zit s GLU 443 N -3.66 0.31 0.16 4.82 2.56 -0.92 -4.77 118.70 117.20 2zit s GLU 443 Ca 0.33 0.49 -0.34 0.00 0.00 0.00 0.00 54.97 55.45 2zit s GLU 443 Cb -0.03 -0.58 -0.14 0.00 2.00 0.00 0.00 34.13 35.38 2zit s GLU 443 CO 0.18 -0.62 1.55 -2.30 -0.56 0.00 0.00 175.26 173.51 2zit n PRO 444 N 5.36 2.07 -3.83 4.30 -0.02 -1.26 -1.02 135.00 140.59 2zit n PRO 444 Ca -0.04 0.75 -0.12 0.00 -2.02 0.00 0.00 63.50 62.06 2zit n PRO 444 Cb 0.50 -2.50 -0.12 0.00 -0.02 0.00 0.00 33.50 31.37 2zit n PRO 444 CO 0.00 0.00 0.00 -1.50 1.98 0.00 0.00 175.50 175.98 2zit s ILE 445 N 0.79 0.02 0.00 4.25 2.07 -0.09 -4.91 121.20 123.33 2zit s ILE 445 Ca 0.78 -0.18 0.00 0.00 -1.41 0.00 0.00 60.65 59.84 2zit s ILE 445 Cb -0.70 -0.28 0.00 0.00 0.13 0.00 0.00 42.46 41.62 2zit s ILE 445 CO 0.40 -0.10 0.62 0.47 -1.91 0.00 0.00 174.94 174.42 2zit n ASP 446 N 2.60 0.00 -4.50 4.50 8.00 -1.26 -4.22 116.55 121.67 2zit n ASP 446 Ca -0.15 0.62 -0.29 0.00 0.71 0.00 0.00 54.79 55.68 2zit n ASP 446 Cb 0.58 -0.12 -0.08 0.00 -0.02 0.00 0.00 41.12 41.48 2zit n ASP 446 CO 0.00 0.00 0.00 1.51 -0.39 0.00 0.00 177.20 178.32 2zit s ASP 447 N -2.32 3.50 -0.27 -2.24 -4.77 -1.26 -1.15 116.67 108.16 2zit s ASP 447 Ca 0.00 -1.60 -0.01 0.00 -3.30 0.00 0.00 52.55 47.64 2zit s ASP 447 Cb 0.00 0.35 0.15 0.00 -1.09 0.00 0.00 42.92 42.33 2zit s ASP 447 CO 0.00 -0.81 0.41 0.00 0.70 0.00 0.00 175.17 175.47 2zit s PRO 449 N 2.58 -0.11 0.50 0.00 0.04 -1.26 -2.34 135.00 134.41 2zit s PRO 449 Ca 0.12 1.03 -0.22 0.00 0.04 0.00 0.00 61.00 61.97 2zit s PRO 449 Cb -0.14 -1.63 -0.06 0.00 0.04 0.00 0.00 34.50 32.70 2zit s PRO 449 CO -0.21 -3.23 1.24 0.00 0.04 0.00 0.00 177.00 174.83 2zit s ALA 450 N -2.58 2.88 0.00 8.56 0.00 -0.89 -3.49 121.76 126.24 2zit s ALA 450 Ca 0.67 1.08 0.00 0.00 0.00 0.00 0.00 51.96 53.71 2zit s ALA 450 Cb -0.23 -3.45 0.00 0.00 0.00 0.00 0.00 23.12 19.43 2zit s ALA 450 CO 0.62 -0.95 0.00 0.41 0.00 0.00 0.00 175.76 175.84 2zit n GLY 451 N 0.54 0.51 3.68 0.00 0.00 0.30 -4.90 105.19 105.33 2zit n GLY 451 Ca 0.09 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.81 2zit n GLY 451 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2zit s ASN 452 N -2.96 4.96 -0.14 1.61 0.01 -1.23 -4.78 114.94 112.41 2zit s ASN 452 Ca 0.00 -0.22 -0.20 0.00 -0.71 0.00 0.00 52.86 51.73 2zit s ASN 452 Cb 0.00 -1.15 -0.04 0.00 0.41 0.00 0.00 41.25 40.47 2zit s ASN 452 CO 0.00 0.16 0.56 -0.63 -1.51 0.00 0.00 177.10 175.68 2zit s ILE 453 N -1.36 5.11 0.14 0.60 1.09 -1.26 -1.53 121.20 123.99 2zit s ILE 453 Ca 0.26 1.10 -0.04 0.00 -1.10 0.00 0.00 60.65 60.87 2zit s ILE 453 Cb -0.11 -3.89 -0.03 0.00 -1.06 0.00 0.00 42.46 37.37 2zit s ILE 453 CO 0.18 0.23 0.14 -0.51 -0.10 0.00 0.00 174.94 174.89 2zit s ILE 454 N 1.15 0.09 0.01 2.92 1.10 -0.76 -4.80 121.20 120.90 2zit s ILE 454 Ca 0.28 -1.71 0.08 0.00 -0.51 0.00 0.00 60.65 58.79 2zit s ILE 454 Cb -0.16 -1.97 -0.02 0.00 0.15 0.00 0.00 42.46 40.46 2zit s ILE 454 CO 0.12 -0.40 -0.24 -0.83 -2.11 0.00 0.00 174.94 171.48 2zit s GLY 455 N -3.02 1.22 0.04 1.50 0.00 -0.61 -1.98 107.32 104.48 2zit s GLY 455 Ca 0.21 -1.09 0.08 0.00 0.00 0.00 0.00 44.72 43.92 2zit s GLY 455 CO 0.01 -0.94 -0.21 1.08 0.00 0.00 0.00 173.10 173.04 2zit s LEU 456 N -0.81 2.45 -0.09 0.66 1.43 0.16 -1.28 118.68 121.19 2zit s LEU 456 Ca 0.10 -0.48 0.02 0.00 -1.03 0.00 0.00 54.13 52.73 2zit s LEU 456 Cb -0.09 -1.43 -0.02 0.00 0.03 0.00 0.00 46.19 44.68 2zit s LEU 456 CO 0.00 0.26 -0.16 -0.69 0.23 0.00 0.00 176.35 175.99 2zit s VAL 457 N -0.88 2.84 0.00 -1.59 1.01 -0.40 -0.08 120.40 121.31 2zit s VAL 457 Ca 0.13 -0.76 0.00 0.00 0.00 0.00 0.00 61.98 61.35 2zit s VAL 457 Cb -0.10 -2.14 0.00 0.00 0.00 0.00 0.00 36.38 34.13 2zit s VAL 457 CO 0.04 0.55 0.00 0.61 0.00 0.00 0.00 175.10 176.30 2zit n GLY 458 N 3.09 0.60 0.00 4.51 0.00 -1.26 -1.73 105.19 110.40 2zit n GLY 458 Ca -0.18 -0.24 0.00 0.00 0.00 0.00 0.00 46.02 45.61 2zit n GLY 458 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 2zit n ILE 459 N -0.61 0.00 -0.14 -0.61 5.41 -1.26 -4.68 119.36 117.48 2zit n ILE 459 Ca 0.00 -0.04 0.24 0.00 1.00 0.00 0.00 62.75 63.95 2zit n ILE 459 Cb 0.22 0.92 0.68 0.00 -0.71 0.00 0.00 39.64 40.75 2zit n ILE 459 CO 0.00 0.00 0.00 -2.24 0.00 0.00 0.00 176.55 174.31 2zit h ASP 460 N 0.00 0.07 -0.27 4.38 3.04 -1.81 0.34 116.42 122.17 2zit h ASP 460 Ca 0.00 0.01 0.00 0.00 -3.24 0.00 0.00 57.03 53.80 2zit h ASP 460 Cb 0.00 -0.01 0.00 0.00 -1.04 0.00 0.00 39.33 38.28 2zit h ASP 460 CO 0.00 0.03 0.00 0.00 -2.04 0.00 0.00 179.24 177.23 2zit n GLN 461 N -4.34 1.68 0.00 4.15 0.00 -1.26 -3.94 117.38 113.67 2zit n GLN 461 Ca 0.16 -1.05 0.00 0.00 0.00 0.00 0.00 57.00 56.11 2zit n GLN 461 Cb 0.81 -1.26 0.00 0.00 0.00 0.00 0.00 30.24 29.79 2zit n GLN 461 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.06 178.25 2zit n PHE 462 N 0.33 0.00 -4.92 2.61 3.72 0.10 -5.02 117.46 114.29 2zit n PHE 462 Ca 0.11 0.00 -0.33 0.00 -0.05 0.00 0.00 57.45 57.19 2zit n PHE 462 Cb 0.26 0.00 -0.15 0.00 -0.94 0.00 0.00 39.48 38.65 2zit n PHE 462 CO 0.00 0.00 0.00 -0.51 -0.05 0.00 0.00 176.76 176.20 2zit s LEU 463 N -3.65 2.55 -0.09 4.37 1.43 -0.36 -4.93 118.68 117.99 2zit s LEU 463 Ca 0.00 -0.37 -0.18 0.00 -1.03 0.00 0.00 54.13 52.55 2zit s LEU 463 Cb 0.00 -1.55 -0.15 0.00 0.03 0.00 0.00 46.19 44.53 2zit s LEU 463 CO 0.00 0.19 0.61 0.25 0.23 0.00 0.00 176.35 177.63 2zit h LEU 464 N 6.51 -0.08 0.00 1.79 5.85 -1.89 -3.42 115.31 124.08 2zit h LEU 464 Ca -0.27 -0.46 0.00 0.00 0.84 0.00 0.00 57.88 57.99 2zit h LEU 464 Cb 1.21 0.02 0.00 0.00 0.37 0.00 0.00 40.66 42.26 2zit h LEU 464 CO 0.53 0.60 0.00 0.29 -0.34 0.00 0.00 178.44 179.52 2zit n LYS 465 N -4.79 0.00 -4.55 1.25 5.02 -1.26 -4.77 118.16 109.06 2zit n LYS 465 Ca -0.06 0.00 -0.28 0.00 -2.02 0.00 0.00 58.31 55.94 2zit n LYS 465 Cb 0.26 0.00 -0.14 0.00 -0.02 0.00 0.00 35.03 35.14 2zit n LYS 465 CO 0.00 0.00 0.00 0.99 -0.52 0.00 0.00 177.40 177.87 2zit s THR 466 N -1.99 2.11 -0.05 -0.18 2.01 -1.26 -3.63 115.64 112.64 2zit s THR 466 Ca 0.00 -1.58 -0.30 0.00 0.31 0.00 0.00 61.69 60.12 2zit s THR 466 Cb 0.00 -1.85 0.11 0.00 0.01 0.00 0.00 72.50 70.77 2zit s THR 466 CO 0.00 0.16 1.34 -0.83 -0.69 0.00 0.00 174.62 174.60 2zit s GLY 467 N -1.72 -0.25 -0.05 4.40 0.00 -1.15 -4.38 107.32 104.16 2zit s GLY 467 Ca 0.12 0.30 0.05 0.00 0.00 0.00 0.00 44.72 45.19 2zit s GLY 467 CO 0.04 4.53 -0.19 -1.59 0.00 0.00 0.00 173.10 175.89 2zit s THR 468 N -2.06 2.60 -0.21 0.90 2.01 -0.43 -2.00 115.64 116.45 2zit s THR 468 Ca 0.26 -0.88 -0.02 0.00 0.31 0.00 0.00 61.69 61.36 2zit s THR 468 Cb 0.02 -1.99 0.00 0.00 0.01 0.00 0.00 72.50 70.54 2zit s THR 468 CO -0.03 0.58 -0.09 -0.76 -0.69 0.00 0.00 174.62 173.63 2zit s LEU 469 N -0.45 2.70 0.42 4.42 1.02 0.02 -0.49 118.68 126.33 2zit s LEU 469 Ca 0.05 -0.52 0.04 0.00 0.02 0.00 0.00 54.13 53.72 2zit s LEU 469 Cb -0.12 -1.65 -0.02 0.00 0.02 0.00 0.00 46.19 44.42 2zit s LEU 469 CO 0.01 -0.02 0.12 0.42 0.02 0.00 0.00 176.35 176.90 2zit s THR 470 N 1.41 0.64 0.00 5.49 -4.23 -0.72 -0.69 115.64 117.54 2zit s THR 470 Ca 0.05 -2.00 0.00 0.00 -1.18 0.00 0.00 61.69 58.56 2zit s THR 470 Cb -0.14 -2.32 0.00 0.00 1.34 0.00 0.00 72.50 71.38 2zit s THR 470 CO -0.06 0.00 0.00 0.41 -0.54 0.00 0.00 174.62 174.43 2zit n THR 471 N -0.96 0.00 -2.52 3.99 -1.04 -1.17 -1.54 114.28 111.05 2zit n THR 471 Ca -0.07 0.00 -0.38 0.00 -2.04 0.00 0.00 64.05 61.56 2zit n THR 471 Cb 0.65 -0.43 -0.04 0.00 -1.82 0.00 0.00 70.33 68.69 2zit n THR 471 CO 0.00 0.00 0.00 -0.55 -0.64 0.00 0.00 175.07 173.88 2zit s SER 472 N -2.28 6.89 0.00 8.00 0.15 -1.26 -4.93 113.70 120.27 2zit s SER 472 Ca 0.00 2.11 0.29 0.00 0.70 0.00 0.00 55.95 59.05 2zit s SER 472 Cb 0.00 -2.60 1.21 0.00 -1.71 0.00 0.00 66.02 62.92 2zit s SER 472 CO 0.00 -0.40 1.88 1.21 1.20 0.00 0.00 173.24 177.13 2zit n GLU 473 N 0.28 0.18 -0.18 5.44 2.13 -1.26 -3.32 120.64 123.91 2zit n GLU 473 Ca 0.03 -0.03 0.09 0.00 0.66 0.00 0.00 57.16 57.91 2zit n GLU 473 Cb 0.48 -1.50 0.16 0.00 0.27 0.00 0.00 31.44 30.85 2zit n GLU 473 CO 0.00 0.00 0.00 0.25 -0.41 0.00 0.00 177.13 176.97 2zit n THR 474 N -1.38 1.98 -3.03 6.31 -2.24 -1.26 -4.91 114.28 109.76 2zit n THR 474 Ca 0.09 -2.34 -0.40 0.00 -2.27 0.00 0.00 64.05 59.13 2zit n THR 474 Cb 0.31 -0.24 -0.05 0.00 -2.10 0.00 0.00 70.33 68.24 2zit n THR 474 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2zit s ALA 475 N -2.92 3.51 0.98 6.98 0.00 -1.21 -4.97 121.76 124.12 2zit s ALA 475 Ca 0.34 -0.11 -0.15 0.00 0.00 0.00 0.00 51.96 52.04 2zit s ALA 475 Cb 0.30 -3.06 0.19 0.00 0.00 0.00 0.00 23.12 20.55 2zit s ALA 475 CO 0.03 -0.52 1.23 -1.01 0.00 0.00 0.00 175.76 175.48 2zit s HIS 476 N 1.83 1.73 0.47 0.00 3.76 -1.26 -4.63 115.29 117.18 2zit s HIS 476 Ca 0.33 0.50 -0.16 0.00 -0.15 0.00 0.00 55.06 55.58 2zit s HIS 476 Cb -0.16 -3.78 -0.08 0.00 1.11 0.00 0.00 32.58 29.66 2zit s HIS 476 CO 0.12 -2.72 0.93 -0.80 -0.85 0.00 0.00 174.74 171.42 2zit s ASN 477 N -4.51 6.67 0.23 1.40 0.01 -1.26 -4.92 114.94 112.56 2zit s ASN 477 Ca 0.70 1.50 -0.14 0.00 -0.71 0.00 0.00 52.86 54.21 2zit s ASN 477 Cb -0.08 -2.47 -0.08 0.00 0.41 0.00 0.00 41.25 39.03 2zit s ASN 477 CO 0.53 -0.49 0.63 -0.04 -1.51 0.00 0.00 177.10 176.22 2zit s MET 478 N -3.80 3.97 -0.41 -0.60 -1.94 -1.26 -2.46 119.30 112.81 2zit s MET 478 Ca 0.58 0.53 -0.15 0.00 -1.71 0.00 0.00 55.69 54.94 2zit s MET 478 Cb -0.10 -2.69 -0.10 0.00 2.01 0.00 0.00 34.83 33.95 2zit s MET 478 CO 0.27 0.32 1.17 1.17 -0.01 0.00 0.00 175.02 177.95 2zit n LYS 479 N 0.17 0.00 -2.85 2.03 3.00 -0.52 -4.82 118.16 115.16 2zit n LYS 479 Ca -0.01 0.00 -0.33 0.00 -0.00 0.00 0.00 58.31 57.98 2zit n LYS 479 Cb 0.52 -0.68 -0.07 0.00 0.00 0.00 0.00 35.03 34.81 2zit n LYS 479 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.40 177.54 2zit s VAL 480 N 3.81 4.45 -0.35 3.15 -7.23 -1.26 -5.05 120.40 117.92 2zit s VAL 480 Ca 0.60 1.38 -0.07 0.00 -1.81 0.00 0.00 61.98 62.09 2zit s VAL 480 Cb -0.59 -3.61 0.04 0.00 0.56 0.00 0.00 36.38 32.78 2zit s VAL 480 CO 0.24 -0.31 0.13 -0.04 -0.31 0.00 0.00 175.10 174.80 2zit s MET 481 N -3.19 2.63 0.47 4.82 1.00 -1.26 -5.08 119.30 118.68 2zit s MET 481 Ca 0.61 -1.20 -0.25 0.00 0.00 0.00 0.00 55.69 54.85 2zit s MET 481 Cb -0.09 -3.51 -0.08 0.00 0.00 0.00 0.00 34.83 31.15 2zit s MET 481 CO 0.15 -0.70 1.39 1.63 0.00 0.00 0.00 175.02 177.49 2zit n LYS 482 N 4.83 2.08 -3.67 2.03 5.02 -1.26 -4.94 118.16 122.27 2zit n LYS 482 Ca -0.12 0.75 -0.14 0.00 -2.02 0.00 0.00 58.31 56.77 2zit n LYS 482 Cb 0.45 -2.58 -0.08 0.00 -0.02 0.00 0.00 35.03 32.79 2zit n LYS 482 CO 0.00 0.00 0.00 -0.59 -0.52 0.00 0.00 177.40 176.29 2zit s PHE 483 N -1.22 -0.53 -0.02 2.13 -0.12 -1.26 -5.06 117.98 111.91 2zit s PHE 483 Ca 0.63 1.14 0.00 0.00 -0.05 0.00 0.00 56.93 58.66 2zit s PHE 483 Cb -0.45 0.23 -0.04 0.00 -0.63 0.00 0.00 43.02 42.13 2zit s PHE 483 CO 0.56 -0.38 0.02 -1.54 -0.05 0.00 0.00 175.22 173.82 2zit s SER 484 N -0.38 5.24 0.00 1.98 1.04 -1.26 -4.99 113.70 115.34 2zit s SER 484 Ca -0.05 0.05 0.12 0.00 0.48 0.00 0.00 55.95 56.55 2zit s SER 484 Cb -0.03 -1.42 0.23 0.00 0.10 0.00 0.00 66.02 64.90 2zit s SER 484 CO 0.04 0.30 1.10 0.52 0.98 0.00 0.00 173.24 176.17 2zit n VAL 485 N 1.50 0.51 -2.47 5.02 0.31 -1.26 -4.93 118.33 117.02 2zit n VAL 485 Ca -0.15 -0.76 -0.43 0.00 -0.01 0.00 0.00 64.34 62.99 2zit n VAL 485 Cb 0.53 0.87 -0.02 0.00 -0.91 0.00 0.00 33.84 34.31 2zit n VAL 485 CO 0.00 0.00 0.00 -0.55 -1.32 0.00 0.00 176.83 174.96 2zit s SER 486 N -1.02 6.67 -0.62 4.52 0.15 -1.26 -4.97 113.70 117.16 2zit s SER 486 Ca 0.21 1.04 -0.27 0.00 0.70 0.00 0.00 55.95 57.63 2zit s SER 486 Cb 0.12 -2.54 -0.00 0.00 -1.71 0.00 0.00 66.02 61.89 2zit s SER 486 CO 0.17 -1.11 1.65 -2.84 1.20 0.00 0.00 173.24 172.31 2zit s PRO 487 N 4.21 2.89 0.00 5.44 0.02 -1.26 -4.53 135.00 141.77 2zit s PRO 487 Ca 0.54 0.42 0.10 0.00 0.02 0.00 0.00 61.00 62.08 2zit s PRO 487 Cb -0.14 -4.29 -0.04 0.00 0.02 0.00 0.00 34.50 30.04 2zit s PRO 487 CO 0.24 -2.44 0.54 1.33 -0.33 0.00 0.00 177.00 176.35 2zit n VAL 488 N 6.97 0.00 -4.46 3.83 0.24 -1.12 -4.82 118.33 118.97 2zit n VAL 488 Ca 0.15 -0.35 -0.21 0.00 -2.04 0.00 0.00 64.34 61.90 2zit n VAL 488 Cb 0.51 1.07 -0.14 0.00 -1.47 0.00 0.00 33.84 33.81 2zit n VAL 488 CO 0.00 0.00 0.00 0.68 -2.14 0.00 0.00 176.83 175.37 2zit s VAL 489 N -1.57 1.10 -0.00 3.34 -7.23 -1.21 -1.20 120.40 113.61 2zit s VAL 489 Ca 0.06 -0.83 -0.23 0.00 -1.81 0.00 0.00 61.98 59.18 2zit s VAL 489 Cb 0.08 -0.96 0.05 0.00 0.56 0.00 0.00 36.38 36.10 2zit s VAL 489 CO 0.31 0.13 0.50 0.00 -0.31 0.00 0.00 175.10 175.72 2zit s GLN 490 N -0.80 0.92 -0.02 4.82 -2.07 -0.30 -0.27 119.66 121.94 2zit s GLN 490 Ca 0.03 -0.08 0.03 0.00 -1.82 0.00 0.00 55.36 53.52 2zit s GLN 490 Cb -0.07 0.42 -0.00 0.00 -1.09 0.00 0.00 33.01 32.27 2zit s GLN 490 CO 0.01 -0.30 -0.09 0.14 -1.32 0.00 0.00 175.29 173.73 2zit s VAL 491 N -1.72 0.73 -0.29 3.63 -7.23 -0.87 -0.87 120.40 113.78 2zit s VAL 491 Ca -0.10 -0.36 -0.29 0.00 -1.81 0.00 0.00 61.98 59.42 2zit s VAL 491 Cb -0.02 -0.63 0.01 0.00 0.56 0.00 0.00 36.38 36.30 2zit s VAL 491 CO 0.04 0.22 1.20 0.00 -0.31 0.00 0.00 175.10 176.25 2zit s ALA 492 N 0.00 3.47 -0.61 1.32 0.00 -1.26 -2.99 121.76 121.69 2zit s ALA 492 Ca 0.00 0.09 -0.04 0.00 0.00 0.00 0.00 51.96 52.02 2zit s ALA 492 Cb -0.06 -3.71 0.16 0.00 0.00 0.00 0.00 23.12 19.51 2zit s ALA 492 CO -0.00 -1.56 0.43 0.08 0.00 0.00 0.00 175.76 174.71 2zit s VAL 493 N 3.94 3.80 0.61 0.00 1.01 -1.23 -1.12 120.40 127.41 2zit s VAL 493 Ca 0.51 -2.78 0.05 0.00 0.00 0.00 0.00 61.98 59.76 2zit s VAL 493 Cb -0.16 -3.48 0.09 0.00 0.00 0.00 0.00 36.38 32.83 2zit s VAL 493 CO 0.18 -0.86 0.84 -0.70 0.00 0.00 0.00 175.10 174.57 2zit s GLU 494 N 0.14 2.14 0.20 2.72 2.12 -0.55 -4.81 118.70 120.66 2zit s GLU 494 Ca 0.16 -1.34 -0.03 0.00 0.36 0.00 0.00 54.97 54.12 2zit s GLU 494 Cb -0.20 -2.53 -0.05 0.00 0.26 0.00 0.00 34.13 31.61 2zit s GLU 494 CO -0.04 -1.01 0.41 0.14 -0.54 0.00 0.00 175.26 174.22 2zit s VAL 495 N -2.82 5.17 0.00 3.70 -7.23 -1.26 -0.73 120.40 117.23 2zit s VAL 495 Ca 0.62 -0.18 0.00 0.00 -1.81 0.00 0.00 61.98 60.62 2zit s VAL 495 Cb -0.06 -3.70 0.00 0.00 0.56 0.00 0.00 36.38 33.18 2zit s VAL 495 CO 0.40 -0.13 0.00 1.17 -0.31 0.00 0.00 175.10 176.23 2zit n LYS 496 N -0.47 2.02 -3.95 4.82 3.00 -1.26 -4.62 118.16 117.70 2zit n LYS 496 Ca -0.03 0.00 -0.33 0.00 -0.00 0.00 0.00 58.31 57.95 2zit n LYS 496 Cb 0.53 -0.98 -0.14 0.00 0.00 0.00 0.00 35.03 34.44 2zit n LYS 496 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.40 176.60 2zit s ASN 497 N -3.40 4.87 0.00 3.14 0.01 -1.26 -4.95 114.94 113.35 2zit s ASN 497 Ca 0.00 -1.95 0.05 0.00 -0.71 0.00 0.00 52.86 50.25 2zit s ASN 497 Cb 0.00 -1.68 0.22 0.00 0.41 0.00 0.00 41.25 40.21 2zit s ASN 497 CO 0.00 -0.39 1.03 0.00 -1.51 0.00 0.00 177.10 176.23 2zit n ALA 498 N 4.40 1.35 0.01 0.60 0.00 -1.26 -1.81 120.51 123.80 2zit n ALA 498 Ca -0.01 -0.02 -0.16 0.00 0.00 0.00 0.00 53.44 53.25 2zit n ALA 498 Cb 0.42 -1.08 -0.05 0.00 0.00 0.00 0.00 19.45 18.74 2zit n ALA 498 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 177.50 176.59 2zit h ASN 499 N 0.00 0.81 -0.31 0.00 2.35 -2.04 -3.23 115.58 113.16 2zit h ASN 499 Ca 0.00 -0.56 -0.03 0.00 -0.55 0.00 0.00 56.30 55.16 2zit h ASN 499 Cb 0.05 -0.24 -0.02 0.00 0.05 0.00 0.00 38.32 38.16 2zit h ASN 499 CO 0.00 1.34 0.01 0.47 -1.65 0.00 0.00 177.43 177.60 2zit n ASP 500 N -3.89 3.89 -0.05 5.81 9.92 -0.75 -4.66 116.55 126.82 2zit n ASP 500 Ca -0.07 -3.11 -0.12 0.00 -0.53 0.00 0.00 54.79 50.96 2zit n ASP 500 Cb 0.76 -0.57 -0.07 0.00 -0.64 0.00 0.00 41.12 40.60 2zit n ASP 500 CO 0.00 0.00 0.00 0.25 0.13 0.00 0.00 177.20 177.58 2zit h LEU 501 N 1.87 0.32 -2.05 0.64 6.46 -1.48 -3.10 115.31 117.98 2zit h LEU 501 Ca 0.04 -0.42 0.04 0.00 -0.12 0.00 0.00 57.88 57.42 2zit h LEU 501 Cb 1.55 -0.09 -0.01 0.00 -0.73 0.00 0.00 40.66 41.38 2zit h LEU 501 CO 0.28 0.67 0.34 -0.65 -0.62 0.00 0.00 178.44 178.46 2zit h PRO 502 N -0.02 0.00 -0.01 5.25 0.11 -1.83 0.34 132.00 135.84 2zit h PRO 502 Ca 0.03 0.00 -0.16 0.00 0.11 0.00 0.00 66.00 65.98 2zit h PRO 502 Cb 0.55 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 31.64 2zit h PRO 502 CO 0.02 0.00 -0.75 0.87 -0.21 0.00 0.00 178.00 177.93 2zit h LYS 503 N 0.00 0.07 0.09 1.05 1.79 -1.78 -3.30 116.57 114.48 2zit h LYS 503 Ca 0.06 -0.07 -0.00 0.00 -2.18 0.00 0.00 60.65 58.46 2zit h LYS 503 Cb 0.75 0.02 0.00 0.00 -1.58 0.00 0.00 32.23 31.42 2zit h LYS 503 CO -0.00 0.79 -0.04 1.25 -1.08 0.00 0.00 179.45 180.37 2zit h LEU 504 N 0.05 -0.10 -1.01 2.94 5.85 -0.18 -1.56 115.31 121.31 2zit h LEU 504 Ca -0.02 -0.32 0.26 0.00 0.84 0.00 0.00 57.88 58.65 2zit h LEU 504 Cb 1.33 0.03 -0.13 0.00 0.37 0.00 0.00 40.66 42.25 2zit h LEU 504 CO 0.10 0.52 0.59 0.58 -0.34 0.00 0.00 178.44 179.90 2zit h VAL 505 N -0.98 0.48 0.19 1.05 2.07 -1.64 0.57 116.25 117.99 2zit h VAL 505 Ca -0.01 -0.18 -0.31 0.00 0.82 0.00 0.00 66.70 67.02 2zit h VAL 505 Cb 0.41 -0.09 0.02 0.00 -1.52 0.00 0.00 31.29 30.11 2zit h VAL 505 CO 0.02 0.10 -1.40 -0.08 0.02 0.00 0.00 177.57 176.23 2zit h GLU 506 N 0.52 0.39 -0.04 1.57 4.57 -1.68 -3.34 114.58 116.57 2zit h GLU 506 Ca 0.67 -0.67 -0.09 0.00 -1.18 0.00 0.00 59.36 58.09 2zit h GLU 506 Cb 1.33 0.25 -0.01 0.00 -0.16 0.00 0.00 28.75 30.16 2zit h GLU 506 CO -0.51 1.31 -0.38 0.78 -1.18 0.00 0.00 179.01 179.03 2zit h GLY 507 N 0.94 0.09 1.00 1.92 0.00 0.54 -2.58 103.07 104.99 2zit h GLY 507 Ca -0.21 -0.08 0.00 0.00 0.00 0.00 0.00 47.33 47.05 2zit h GLY 507 CO 0.23 0.07 0.41 1.41 0.00 0.00 0.00 176.54 178.66 2zit h LEU 508 N 0.07 0.74 -0.08 3.11 3.38 -0.17 0.39 115.31 122.76 2zit h LEU 508 Ca 0.01 -0.03 0.00 0.00 0.09 0.00 0.00 57.88 57.95 2zit h LEU 508 Cb 0.71 -0.19 0.00 0.00 0.09 0.00 0.00 40.66 41.28 2zit h LEU 508 CO 0.05 0.55 0.00 0.29 0.09 0.00 0.00 178.44 179.42 2zit n LYS 509 N -4.63 0.08 0.13 1.13 5.02 -1.11 -2.79 118.16 115.98 2zit n LYS 509 Ca 0.05 0.15 -0.24 0.00 -2.02 0.00 0.00 58.31 56.25 2zit n LYS 509 Cb 0.03 -1.60 -0.16 0.00 -0.02 0.00 0.00 35.03 33.28 2zit n LYS 509 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2zit h ARG 510 N 0.00 0.50 -0.58 1.97 3.08 -0.70 -3.24 114.38 115.41 2zit h ARG 510 Ca 0.00 -0.85 -0.03 0.00 0.07 0.00 0.00 59.98 59.17 2zit h ARG 510 Cb 0.47 0.32 -0.03 0.00 0.08 0.00 0.00 29.97 30.81 2zit h ARG 510 CO 0.00 1.41 0.26 1.25 -1.07 0.00 0.00 179.97 181.82 2zit h LEU 511 N 0.05 0.75 -2.01 3.04 5.85 -0.82 -0.03 115.31 122.14 2zit h LEU 511 Ca -0.24 -0.08 -0.02 0.00 0.84 0.00 0.00 57.88 58.38 2zit h LEU 511 Cb 2.08 -0.19 -0.00 0.00 0.37 0.00 0.00 40.66 42.91 2zit h LEU 511 CO 0.25 0.66 -0.09 0.28 -0.34 0.00 0.00 178.44 179.20 2zit h SER 512 N 0.83 0.00 0.76 1.25 0.02 -1.62 -1.88 113.55 112.91 2zit h SER 512 Ca 0.20 0.00 -0.23 0.00 -0.84 0.00 0.00 61.79 60.92 2zit h SER 512 Cb 0.12 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 62.65 2zit h SER 512 CO -0.02 0.09 -1.07 0.11 -1.14 0.00 0.00 176.83 174.80 2zit h LYS 513 N 0.00 0.15 0.00 3.45 1.57 -1.06 -3.31 116.57 117.38 2zit h LYS 513 Ca -0.00 -0.23 -0.00 0.00 -1.87 0.00 0.00 60.65 58.55 2zit h LYS 513 Cb 0.20 0.08 -0.00 0.00 0.08 0.00 0.00 32.23 32.59 2zit h LYS 513 CO 0.01 1.08 -0.00 0.66 -0.57 0.00 0.00 179.45 180.63 2zit h SER 514 N 0.05 0.00 -2.87 0.86 4.64 -0.55 -3.44 113.55 112.25 2zit h SER 514 Ca -0.07 0.00 -0.18 0.00 -0.47 0.00 0.00 61.79 61.07 2zit h SER 514 Cb 1.79 0.00 -0.31 0.00 -0.31 0.00 0.00 62.40 63.57 2zit h SER 514 CO 0.16 0.00 -0.48 -0.62 -0.87 0.00 0.00 176.83 175.02 2zit s ASP 515 N -6.16 0.12 0.42 4.97 -1.08 -0.92 -4.99 116.67 109.04 2zit s ASP 515 Ca 0.06 0.68 0.30 0.00 -0.52 0.00 0.00 52.55 53.07 2zit s ASP 515 Cb 0.05 0.80 1.29 0.00 -1.46 0.00 0.00 42.92 43.61 2zit s ASP 515 CO 0.66 -0.23 1.88 -0.65 0.52 0.00 0.00 175.17 177.35 2zit h PRO 516 N 8.08 0.00 0.06 4.34 0.11 -1.85 -3.13 132.00 139.61 2zit h PRO 516 Ca -0.19 0.00 -0.33 0.00 0.11 0.00 0.00 66.00 65.60 2zit h PRO 516 Cb 1.12 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 32.20 2zit h PRO 516 CO 0.17 0.00 -1.84 0.00 -0.21 0.00 0.00 178.00 176.12 2zit s VAL 518 N -2.58 3.16 -0.25 0.00 0.11 -1.18 -4.77 120.40 114.89 2zit s VAL 518 Ca -0.13 0.90 -0.04 0.00 -2.93 0.00 0.00 61.98 59.78 2zit s VAL 518 Cb 0.07 -3.47 0.09 0.00 -1.53 0.00 0.00 36.38 31.53 2zit s VAL 518 CO 0.80 0.02 0.12 -0.22 -3.33 0.00 0.00 175.10 172.49 2zit s LEU 519 N -2.82 0.45 -0.22 2.54 2.96 -0.96 -4.74 118.68 115.88 2zit s LEU 519 Ca 0.61 -1.02 -0.11 0.00 -0.22 0.00 0.00 54.13 53.38 2zit s LEU 519 Cb -0.29 -0.29 -0.05 0.00 0.50 0.00 0.00 46.19 46.06 2zit s LEU 519 CO 0.36 -0.41 0.19 0.42 -1.32 0.00 0.00 176.35 175.59 2zit s THR 520 N 2.12 5.35 0.34 3.68 -4.23 -1.26 -1.56 115.64 120.08 2zit s THR 520 Ca 0.06 0.27 0.02 0.00 -1.18 0.00 0.00 61.69 60.87 2zit s THR 520 Cb -0.16 -3.53 -0.01 0.00 1.34 0.00 0.00 72.50 70.14 2zit s THR 520 CO -0.26 0.35 0.37 -0.72 -0.54 0.00 0.00 174.62 173.83 2zit s TYR 521 N 0.92 1.42 -0.17 3.99 -0.85 -1.14 -4.95 117.35 116.57 2zit s TYR 521 Ca 0.09 -1.49 0.00 0.00 -0.52 0.00 0.00 57.07 55.16 2zit s TYR 521 Cb -0.13 -0.40 0.00 0.00 0.38 0.00 0.00 41.96 41.81 2zit s TYR 521 CO 0.04 -1.00 -0.16 -1.64 -1.52 0.00 0.00 175.55 171.27 2zit s MET 522 N -3.24 3.17 0.63 -3.49 -1.94 -1.26 -1.93 119.30 111.24 2zit s MET 522 Ca 0.36 -0.76 -0.10 0.00 -1.71 0.00 0.00 55.69 53.47 2zit s MET 522 Cb 0.01 -2.64 -0.02 0.00 2.01 0.00 0.00 34.83 34.20 2zit s MET 522 CO 0.24 -0.05 1.02 -1.54 -0.01 0.00 0.00 175.02 174.68 2zit s SER 523 N 0.98 5.90 0.26 3.03 1.04 0.11 -4.94 113.70 120.09 2zit s SER 523 Ca -0.02 1.21 0.21 0.00 0.48 0.00 0.00 55.95 57.82 2zit s SER 523 Cb -0.15 -2.19 1.00 0.00 0.10 0.00 0.00 66.02 64.78 2zit s SER 523 CO -0.03 -1.03 1.63 1.21 0.98 0.00 0.00 173.24 176.00 2zit n GLU 524 N -2.78 0.15 -0.21 4.02 2.13 -1.26 -0.89 120.64 121.79 2zit n GLU 524 Ca 0.06 0.53 0.04 0.00 0.66 0.00 0.00 57.16 58.45 2zit n GLU 524 Cb 0.56 -1.88 0.13 0.00 0.27 0.00 0.00 31.44 30.52 2zit n GLU 524 CO 0.00 0.00 0.00 -1.13 -0.41 0.00 0.00 177.13 175.59 2zit n SER 525 N -2.17 1.93 0.00 4.31 3.41 -1.26 -4.87 113.62 114.97 2zit n SER 525 Ca 0.00 -2.13 0.00 0.00 -0.26 0.00 0.00 58.87 56.48 2zit n SER 525 Cb 0.11 -0.33 0.00 0.00 -0.26 0.00 0.00 64.21 63.73 2zit n SER 525 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2zit n GLY 526 N 0.66 0.53 3.80 5.00 0.00 -0.07 -5.00 105.19 110.11 2zit n GLY 526 Ca 0.09 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.75 2zit n GLY 526 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2zit s GLU 527 N -0.42 4.41 -0.24 1.61 2.02 -1.24 -4.84 118.70 120.00 2zit s GLU 527 Ca 0.00 1.11 -0.07 0.00 0.02 0.00 0.00 54.97 56.03 2zit s GLU 527 Cb 0.00 -2.77 -0.03 0.00 0.10 0.00 0.00 34.13 31.43 2zit s GLU 527 CO 0.00 0.30 0.07 -1.01 0.02 0.00 0.00 175.26 174.64 2zit s HIS 528 N -1.64 3.10 0.47 1.61 3.76 -1.26 -0.71 115.29 120.62 2zit s HIS 528 Ca 0.48 -0.37 0.05 0.00 -0.15 0.00 0.00 55.06 55.08 2zit s HIS 528 Cb -0.17 -2.22 -0.02 0.00 1.11 0.00 0.00 32.58 31.28 2zit s HIS 528 CO 0.22 -0.31 0.18 0.42 -0.85 0.00 0.00 174.74 174.41 2zit s ILE 529 N 1.49 1.82 -0.16 0.60 -1.09 -0.81 -3.57 121.20 119.47 2zit s ILE 529 Ca 0.06 -1.74 -0.04 0.00 -2.23 0.00 0.00 60.65 56.70 2zit s ILE 529 Cb -0.15 -2.56 0.08 0.00 -1.58 0.00 0.00 42.46 38.25 2zit s ILE 529 CO 0.04 0.00 0.26 0.54 -1.23 0.00 0.00 174.94 174.55 2zit s VAL 530 N -2.72 -0.41 -0.04 2.92 0.11 -1.16 -2.86 120.40 116.23 2zit s VAL 530 Ca 0.30 0.13 0.01 0.00 -2.93 0.00 0.00 61.98 59.48 2zit s VAL 530 Cb 0.02 -0.55 -0.03 0.00 -1.53 0.00 0.00 36.38 34.28 2zit s VAL 530 CO 0.17 -0.00 -0.04 0.00 -3.33 0.00 0.00 175.10 171.89 2zit s ALA 531 N 2.41 3.11 0.48 1.54 0.00 -0.60 -2.06 121.76 126.63 2zit s ALA 531 Ca 0.04 -0.91 0.02 0.00 0.00 0.00 0.00 51.96 51.10 2zit s ALA 531 Cb -0.13 -1.28 -0.01 0.00 0.00 0.00 0.00 23.12 21.70 2zit s ALA 531 CO -0.10 0.60 0.06 0.41 0.00 0.00 0.00 175.76 176.72 2zit n GLY 532 N 1.90 3.42 0.16 0.00 0.00 0.63 -2.28 105.19 109.02 2zit n GLY 532 Ca -0.17 -2.28 -0.23 0.00 0.00 0.00 0.00 46.02 43.34 2zit n GLY 532 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 2zit h THR 533 N 1.43 1.30 -2.24 2.61 2.02 -1.85 -2.95 112.91 113.22 2zit h THR 533 Ca -0.39 -2.54 -0.03 0.00 0.77 0.00 0.00 66.41 64.22 2zit h THR 533 Cb 1.28 2.86 -0.01 0.00 -1.74 0.00 0.00 68.15 70.54 2zit h THR 533 CO 0.64 0.77 0.00 0.61 0.37 0.00 0.00 175.52 177.90 2zit n GLY 534 N 1.52 2.59 0.39 2.16 0.00 -1.26 -4.44 105.19 106.15 2zit n GLY 534 Ca -0.15 -1.28 -0.18 0.00 0.00 0.00 0.00 46.02 44.41 2zit n GLY 534 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 2zit h GLU 535 N 0.00 -0.88 0.31 1.61 4.81 -1.94 -1.20 114.58 117.28 2zit h GLU 535 Ca -0.04 0.06 -0.02 0.00 -0.13 0.00 0.00 59.36 59.23 2zit h GLU 535 Cb 0.17 0.20 0.00 0.00 0.63 0.00 0.00 28.75 29.76 2zit h GLU 535 CO 0.06 -0.59 -0.15 1.25 -0.73 0.00 0.00 179.01 178.85 2zit h LEU 536 N -0.92 -0.35 -1.07 1.64 5.85 -1.97 -0.28 115.31 118.20 2zit h LEU 536 Ca -0.08 0.01 0.15 0.00 0.84 0.00 0.00 57.88 58.79 2zit h LEU 536 Cb 0.73 0.09 -0.09 0.00 0.37 0.00 0.00 40.66 41.76 2zit h LEU 536 CO 0.10 -0.25 0.62 -0.74 -0.34 0.00 0.00 178.44 177.83 2zit h HIS 537 N -0.42 1.05 -0.31 1.25 2.76 -1.96 -0.02 115.15 117.49 2zit h HIS 537 Ca -0.04 0.03 -0.14 0.00 -2.20 0.00 0.00 60.37 58.02 2zit h HIS 537 Cb 0.32 -0.33 -0.00 0.00 1.55 0.00 0.00 27.41 28.95 2zit h HIS 537 CO -0.05 0.36 -0.34 1.25 -1.30 0.00 0.00 177.93 177.84 2zit h LEU 538 N 0.86 0.84 -1.28 0.26 5.85 -0.85 -2.24 115.31 118.76 2zit h LEU 538 Ca 0.51 -0.48 -0.06 0.00 0.84 0.00 0.00 57.88 58.69 2zit h LEU 538 Cb 0.67 -0.24 -0.01 0.00 0.37 0.00 0.00 40.66 41.45 2zit h LEU 538 CO -0.28 1.15 -0.29 -0.33 -0.34 0.00 0.00 178.44 178.34 2zit h GLU 539 N 0.55 0.00 0.01 1.25 5.08 0.04 -1.92 114.58 119.59 2zit h GLU 539 Ca 0.05 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.41 2zit h GLU 539 Cb 0.92 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.17 2zit h GLU 539 CO 0.08 0.29 -0.00 0.82 -1.00 0.00 0.00 179.01 179.20 2zit h ILE 540 N 0.00 1.62 0.00 3.13 2.04 -0.98 -2.88 117.51 120.44 2zit h ILE 540 Ca -0.00 -2.09 0.00 0.00 1.00 0.00 0.00 64.86 63.77 2zit h ILE 540 Cb 0.69 2.99 0.00 0.00 -0.74 0.00 0.00 36.82 39.76 2zit h ILE 540 CO 0.04 0.52 0.00 0.00 0.00 0.00 0.00 178.15 178.71 2zit h LEU 542 N 0.00 0.75 -0.29 0.00 5.85 -1.27 -3.19 115.31 117.15 2zit h LEU 542 Ca 0.00 -0.79 -0.10 0.00 0.84 0.00 0.00 57.88 57.83 2zit h LEU 542 Cb 0.00 -0.24 -0.01 0.00 0.37 0.00 0.00 40.66 40.79 2zit h LEU 542 CO 0.00 1.61 -0.21 1.56 -0.34 0.00 0.00 178.44 181.07 2zit h GLN 543 N 0.14 0.66 0.00 1.25 4.20 -1.00 -3.03 115.11 117.33 2zit h GLN 543 Ca -0.22 -0.32 0.00 0.00 0.06 0.00 0.00 58.65 58.17 2zit h GLN 543 Cb 2.10 -0.00 0.00 0.00 0.30 0.00 0.00 27.48 29.88 2zit h GLN 543 CO 0.26 0.91 0.00 -0.44 -0.67 0.00 0.00 178.83 178.89 2zit h ASP 544 N 0.40 0.00 0.01 1.46 5.19 -1.61 -3.04 116.42 118.83 2zit h ASP 544 Ca 0.06 0.00 -0.00 0.00 -0.62 0.00 0.00 57.03 56.47 2zit h ASP 544 Cb 0.75 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.26 2zit h ASP 544 CO 0.06 0.00 -0.00 0.25 -3.12 0.00 0.00 179.24 176.42 2zit h LEU 545 N 0.00 -0.01 -0.77 1.55 5.85 -1.51 -2.19 115.31 118.22 2zit h LEU 545 Ca 0.00 -0.82 0.00 0.00 0.84 0.00 0.00 57.88 57.90 2zit h LEU 545 Cb 0.35 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.38 2zit h LEU 545 CO 0.00 0.86 0.00 -1.84 -0.34 0.00 0.00 178.44 177.12 2zit n GLU 546 N -4.67 0.93 0.00 1.25 -0.00 -1.16 -1.88 120.64 115.12 2zit n GLU 546 Ca -0.09 0.00 0.00 0.00 -0.00 0.00 0.00 57.16 57.07 2zit n GLU 546 Cb 0.40 -1.36 0.00 0.00 -0.00 0.00 0.00 31.44 30.48 2zit n GLU 546 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 177.13 178.71 2zit n HIS 547 N -0.09 -0.01 0.02 -1.84 -0.00 -1.17 -3.72 115.22 108.41 2zit n HIS 547 Ca 0.00 0.00 0.05 0.00 0.46 0.00 0.00 57.72 58.24 2zit n HIS 547 Cb 0.18 0.17 -0.10 0.00 -0.12 0.00 0.00 29.99 30.12 2zit n HIS 547 CO 0.00 0.00 0.00 -0.25 0.46 0.00 0.00 176.34 176.55 2zit n ASP 548 N -2.84 0.49 -0.08 0.26 8.00 -0.83 -4.28 116.55 117.26 2zit n ASP 548 Ca 0.00 0.20 0.01 0.00 0.71 0.00 0.00 54.79 55.72 2zit n ASP 548 Cb 0.33 0.91 0.00 0.00 -0.02 0.00 0.00 41.12 42.35 2zit n ASP 548 CO 0.00 0.00 0.00 1.41 -0.39 0.00 0.00 177.20 178.22 2zit n HIS 549 N -2.62 0.00 -3.67 1.24 8.25 -0.79 -5.03 115.22 112.60 2zit n HIS 549 Ca -0.08 0.00 -0.07 0.00 -0.26 0.00 0.00 57.72 57.31 2zit n HIS 549 Cb 0.71 0.00 -0.00 0.00 1.12 0.00 0.00 29.99 31.82 2zit n HIS 549 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2zit n ALA 550 N -0.23 -0.46 -0.03 -1.41 0.00 -0.79 -2.85 120.51 114.74 2zit n ALA 550 Ca 0.01 -0.78 -0.05 0.00 0.00 0.00 0.00 53.44 52.63 2zit n ALA 550 Cb 0.07 0.63 -0.03 0.00 0.00 0.00 0.00 19.45 20.11 2zit n ALA 550 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2zit n GLY 551 N -0.29 -0.09 2.91 0.00 0.00 -1.24 -3.47 105.19 103.00 2zit n GLY 551 Ca -0.02 -0.04 -0.15 0.00 0.00 0.00 0.00 46.02 45.81 2zit n GLY 551 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2zit s VAL 552 N -2.13 0.30 -0.38 1.61 1.01 -1.25 -4.80 120.40 114.75 2zit s VAL 552 Ca -0.09 -0.12 -0.43 0.00 0.00 0.00 0.00 61.98 61.34 2zit s VAL 552 Cb 0.02 -0.28 -0.17 0.00 0.00 0.00 0.00 36.38 35.95 2zit s VAL 552 CO 0.15 0.10 1.71 -0.81 0.00 0.00 0.00 175.10 176.26 2zit n PRO 553 N 3.22 0.66 0.00 2.72 -0.04 -1.26 -4.95 135.00 135.36 2zit n PRO 553 Ca -0.16 0.24 0.00 0.00 -0.04 0.00 0.00 63.50 63.54 2zit n PRO 553 Cb 0.57 -1.86 0.00 0.00 -0.04 0.00 0.00 33.50 32.17 2zit n PRO 553 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 2zit n LEU 554 N 5.00 0.00 -3.76 1.53 4.77 -1.26 -4.85 117.00 118.43 2zit n LEU 554 Ca 0.29 0.00 -0.42 0.00 -0.03 0.00 0.00 56.01 55.85 2zit n LEU 554 Cb 0.05 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.11 2zit n LEU 554 CO 0.85 0.00 2.31 1.17 -1.33 0.00 0.00 177.39 180.39 2zit n LYS 555 N 0.00 2.13 -2.91 3.23 3.00 0.10 -4.88 118.16 118.82 2zit n LYS 555 Ca 0.00 -2.24 -0.43 0.00 -0.00 0.00 0.00 58.31 55.63 2zit n LYS 555 Cb 0.00 -3.13 -0.04 0.00 0.00 0.00 0.00 35.03 31.86 2zit n LYS 555 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 177.40 175.90 2zit s ILE 556 N 4.54 4.51 0.76 3.15 2.07 -1.26 -1.48 121.20 133.49 2zit s ILE 556 Ca 0.54 -0.82 -0.11 0.00 -1.41 0.00 0.00 60.65 58.85 2zit s ILE 556 Cb 0.13 -4.69 0.05 0.00 0.13 0.00 0.00 42.46 38.08 2zit s ILE 556 CO 0.03 -1.43 1.09 -0.94 -1.91 0.00 0.00 174.94 171.78 2zit s SER 557 N 3.67 4.63 0.83 4.50 1.04 -0.27 -4.98 113.70 123.10 2zit s SER 557 Ca 0.24 1.83 -0.14 0.00 0.48 0.00 0.00 55.95 58.36 2zit s SER 557 Cb -0.14 -2.52 0.03 0.00 0.10 0.00 0.00 66.02 63.49 2zit s SER 557 CO 0.04 -1.95 0.77 -2.65 0.98 0.00 0.00 173.24 170.42 2zit n PRO 558 N -3.38 0.06 -1.71 4.02 -0.02 -1.26 -4.42 135.00 128.28 2zit n PRO 558 Ca 0.09 0.08 -0.43 0.00 -2.02 0.00 0.00 63.50 61.22 2zit n PRO 558 Cb 0.53 -2.09 -0.03 0.00 -0.02 0.00 0.00 33.50 31.89 2zit n PRO 558 CO 0.00 0.00 0.00 -0.35 1.98 0.00 0.00 175.50 177.13 2zit n PRO 559 N -2.09 2.61 -5.12 0.52 -0.04 -1.26 -4.64 135.00 124.97 2zit n PRO 559 Ca 0.11 0.94 -0.29 0.00 -0.04 0.00 0.00 63.50 64.22 2zit n PRO 559 Cb 0.51 -2.74 -0.16 0.00 -0.04 0.00 0.00 33.50 31.07 2zit n PRO 559 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 2zit s VAL 560 N 0.72 1.79 -0.03 0.52 1.01 -0.05 -4.99 120.40 119.36 2zit s VAL 560 Ca 0.72 -0.96 -0.16 0.00 0.00 0.00 0.00 61.98 61.58 2zit s VAL 560 Cb -0.54 -1.49 -0.05 0.00 0.00 0.00 0.00 36.38 34.30 2zit s VAL 560 CO 0.39 0.50 0.44 -0.69 0.00 0.00 0.00 175.10 175.74 2zit s VAL 561 N -0.48 5.05 0.13 2.92 1.01 -1.26 -1.15 120.40 126.61 2zit s VAL 561 Ca 0.07 0.89 -0.30 0.00 0.00 0.00 0.00 61.98 62.65 2zit s VAL 561 Cb -0.09 -3.75 -0.06 0.00 0.00 0.00 0.00 36.38 32.47 2zit s VAL 561 CO -0.00 0.50 1.01 0.00 0.00 0.00 0.00 175.10 176.61 2zit s ALA 562 N -0.57 3.29 0.46 5.51 0.00 -0.34 -4.98 121.76 125.12 2zit s ALA 562 Ca 0.24 0.66 0.03 0.00 0.00 0.00 0.00 51.96 52.89 2zit s ALA 562 Cb -0.16 -3.31 -0.03 0.00 0.00 0.00 0.00 23.12 19.61 2zit s ALA 562 CO 0.13 -0.10 0.03 0.71 0.00 0.00 0.00 175.76 176.52 2zit s TYR 563 N -0.01 2.02 -0.00 0.00 2.02 -1.26 -4.29 117.35 115.82 2zit s TYR 563 Ca 0.48 -0.94 0.03 0.00 -0.37 0.00 0.00 57.07 56.28 2zit s TYR 563 Cb -0.25 -1.56 -0.01 0.00 -0.40 0.00 0.00 41.96 39.73 2zit s TYR 563 CO 0.31 0.19 -0.10 1.03 -1.57 0.00 0.00 175.55 175.41 2zit s ARG 564 N -3.81 0.81 -0.10 -0.62 1.81 -0.82 -4.10 118.95 112.12 2zit s ARG 564 Ca 0.17 -0.38 -0.11 0.00 -1.72 0.00 0.00 55.73 53.69 2zit s ARG 564 Cb 0.04 -0.78 -0.05 0.00 -0.45 0.00 0.00 34.95 33.71 2zit s ARG 564 CO 0.09 0.21 0.25 -1.21 -0.68 0.00 0.00 175.30 173.97 2zit s GLU 565 N -0.30 3.81 0.32 3.54 2.02 0.14 0.16 118.70 128.39 2zit s GLU 565 Ca 0.04 0.08 -0.04 0.00 0.02 0.00 0.00 54.97 55.07 2zit s GLU 565 Cb -0.04 -3.27 -0.00 0.00 0.10 0.00 0.00 34.13 30.92 2zit s GLU 565 CO -0.00 0.60 0.45 -0.08 0.02 0.00 0.00 175.26 176.25 2zit s THR 566 N -0.63 0.00 0.17 3.63 -1.32 -0.10 -0.36 115.64 117.03 2zit s THR 566 Ca 0.18 -1.60 0.10 0.00 -1.21 0.00 0.00 61.69 59.15 2zit s THR 566 Cb -0.14 -2.56 -0.04 0.00 -1.51 0.00 0.00 72.50 68.25 2zit s THR 566 CO 0.06 0.00 -0.22 0.68 -2.21 0.00 0.00 174.62 172.94 2zit s VAL 567 N -3.28 2.10 -0.50 5.08 -7.23 -1.26 -0.52 120.40 114.79 2zit s VAL 567 Ca 0.30 -1.94 0.11 0.00 -1.81 0.00 0.00 61.98 58.64 2zit s VAL 567 Cb 0.00 -1.97 -0.13 0.00 0.56 0.00 0.00 36.38 34.84 2zit s VAL 567 CO 0.18 -0.17 0.47 1.21 -0.31 0.00 0.00 175.10 176.47 2zit n GLU 568 N 0.37 3.01 -1.02 4.82 4.07 -0.37 -4.46 120.64 127.06 2zit n GLU 568 Ca -0.14 -0.01 0.00 0.00 -0.06 0.00 0.00 57.16 56.96 2zit n GLU 568 Cb 0.56 -1.06 0.00 0.00 -0.06 0.00 0.00 31.44 30.88 2zit n GLU 568 CO 0.00 0.00 0.00 -1.13 -0.06 0.00 0.00 177.13 175.94 2zit n SER 569 N -1.32 0.00 -4.84 4.31 3.41 -0.99 -4.86 113.62 109.34 2zit n SER 569 Ca 0.02 -0.90 -0.36 0.00 -0.26 0.00 0.00 58.87 57.37 2zit n SER 569 Cb 0.19 0.00 -0.06 0.00 -0.26 0.00 0.00 64.21 64.08 2zit n SER 569 CO 0.00 0.00 0.00 -0.70 -0.16 0.00 0.00 175.04 174.18 2zit s GLU 570 N -1.70 3.99 -0.17 4.33 2.12 -1.26 -3.93 118.70 122.09 2zit s GLU 570 Ca 0.00 0.50 -0.40 0.00 0.36 0.00 0.00 54.97 55.44 2zit s GLU 570 Cb 0.00 -2.96 -0.17 0.00 0.26 0.00 0.00 34.13 31.26 2zit s GLU 570 CO 0.00 0.50 1.55 0.43 -0.54 0.00 0.00 175.26 177.20 2zit n SER 571 N 0.90 1.85 0.29 -1.70 7.64 -0.28 -4.58 113.62 117.73 2zit n SER 571 Ca -0.06 1.11 0.17 0.00 1.01 0.00 0.00 58.87 61.10 2zit n SER 571 Cb 0.52 -1.11 0.85 0.00 -1.01 0.00 0.00 64.21 63.46 2zit n SER 571 CO 0.00 0.00 0.00 0.77 -3.01 0.00 0.00 175.04 172.80 2zit h SER 572 N 5.83 0.00 -4.96 6.43 4.64 -1.18 -3.42 113.55 120.89 2zit h SER 572 Ca -0.47 0.00 0.01 0.00 -0.47 0.00 0.00 61.79 60.87 2zit h SER 572 Cb 1.34 0.00 -0.12 0.00 -0.31 0.00 0.00 62.40 63.31 2zit h SER 572 CO 0.88 0.00 0.26 0.00 -0.87 0.00 0.00 176.83 177.10 2zit s GLN 573 N -4.22 1.27 0.26 4.77 -2.07 -1.26 -5.14 119.66 113.27 2zit s GLN 573 Ca -0.04 -0.51 -0.31 0.00 -1.82 0.00 0.00 55.36 52.68 2zit s GLN 573 Cb 0.11 0.56 -0.12 0.00 -1.09 0.00 0.00 33.01 32.46 2zit s GLN 573 CO 0.35 -0.56 1.65 2.41 -1.32 0.00 0.00 175.29 177.81 2zit n THR 574 N -0.37 0.60 -3.29 3.63 -1.04 -1.26 -4.92 114.28 107.62 2zit n THR 574 Ca -0.14 -0.15 -0.38 0.00 -2.04 0.00 0.00 64.05 61.34 2zit n THR 574 Cb 0.64 -1.96 -0.06 0.00 -1.82 0.00 0.00 70.33 67.13 2zit n THR 574 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2zit s ALA 575 N 0.48 3.47 -0.03 2.41 0.00 0.31 -4.93 121.76 123.46 2zit s ALA 575 Ca 0.69 -0.15 0.04 0.00 0.00 0.00 0.00 51.96 52.54 2zit s ALA 575 Cb -0.50 -2.67 -0.00 0.00 0.00 0.00 0.00 23.12 19.94 2zit s ALA 575 CO 0.42 0.01 -0.13 -1.17 0.00 0.00 0.00 175.76 174.89 2zit s LEU 576 N 0.55 1.90 -0.12 0.00 2.96 -1.26 -1.13 118.68 121.58 2zit s LEU 576 Ca 0.27 -0.26 -0.10 0.00 -0.22 0.00 0.00 54.13 53.83 2zit s LEU 576 Cb -0.16 -0.73 0.03 0.00 0.50 0.00 0.00 46.19 45.84 2zit s LEU 576 CO 0.11 0.12 0.30 -0.44 -1.32 0.00 0.00 176.35 175.13 2zit s SER 577 N -0.01 -0.32 0.17 3.68 0.01 -0.96 -0.58 113.70 115.69 2zit s SER 577 Ca -0.01 0.62 0.09 0.00 1.31 0.00 0.00 55.95 57.96 2zit s SER 577 Cb -0.08 0.61 -0.04 0.00 0.21 0.00 0.00 66.02 66.71 2zit s SER 577 CO 0.01 -0.11 -0.09 -1.59 0.41 0.00 0.00 173.24 171.86 2zit s LYS 578 N 0.32 2.07 0.83 12.44 -2.85 -1.26 -0.95 119.74 130.33 2zit s LYS 578 Ca -0.01 -1.25 -0.11 0.00 -1.00 0.00 0.00 55.97 53.60 2zit s LYS 578 Cb -0.03 -2.17 0.09 0.00 -2.06 0.00 0.00 37.83 33.65 2zit s LYS 578 CO -0.01 0.44 1.10 -1.54 0.10 0.00 0.00 175.35 175.44 2zit s SER 579 N -2.78 3.98 0.64 0.03 1.04 0.88 -4.82 113.70 112.67 2zit s SER 579 Ca 0.25 1.83 0.31 0.00 0.48 0.00 0.00 55.95 58.81 2zit s SER 579 Cb -0.09 -2.47 1.68 0.00 0.10 0.00 0.00 66.02 65.25 2zit s SER 579 CO 0.15 -2.37 1.99 -0.65 0.98 0.00 0.00 173.24 173.34 2zit h PRO 580 N -1.36 0.00 -0.02 4.02 0.11 -1.90 0.14 132.00 132.99 2zit h PRO 580 Ca -0.45 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.66 2zit h PRO 580 Cb 1.25 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.36 2zit h PRO 580 CO 0.50 0.00 -0.12 0.27 -0.21 0.00 0.00 178.00 178.44 2zit n ASN 581 N -3.19 1.81 -0.14 -2.05 6.94 -1.26 -4.95 115.26 112.42 2zit n ASN 581 Ca 0.00 -1.48 -0.02 0.00 -0.02 0.00 0.00 54.58 53.06 2zit n ASN 581 Cb 0.40 0.09 -0.01 0.00 -2.36 0.00 0.00 39.78 37.90 2zit n ASN 581 CO 0.00 0.00 0.00 0.29 -1.03 0.00 0.00 177.26 176.52 2zit n LYS 582 N 0.24 -0.80 -0.01 -3.83 4.76 0.48 -4.85 118.16 114.16 2zit n LYS 582 Ca 0.15 0.34 0.08 0.00 -2.87 0.00 0.00 58.31 56.00 2zit n LYS 582 Cb 0.43 -4.02 -0.13 0.00 -1.84 0.00 0.00 35.03 29.46 2zit n LYS 582 CO 0.00 0.00 0.00 0.72 -1.37 0.00 0.00 177.40 176.75 2zit n HIS 583 N -2.61 0.00 -5.04 2.13 8.25 -1.26 -4.93 115.22 111.75 2zit n HIS 583 Ca -0.02 0.00 -0.32 0.00 -0.26 0.00 0.00 57.72 57.12 2zit n HIS 583 Cb 0.23 -0.42 -0.15 0.00 1.12 0.00 0.00 29.99 30.77 2zit n HIS 583 CO 0.00 0.00 0.00 -0.80 0.64 0.00 0.00 176.34 176.18 2zit s ASN 584 N -4.03 3.52 0.25 0.41 0.01 -1.26 -3.81 114.94 110.02 2zit s ASN 584 Ca -0.06 -0.42 0.11 0.00 -0.71 0.00 0.00 52.86 51.78 2zit s ASN 584 Cb 0.11 -1.22 -0.05 0.00 0.41 0.00 0.00 41.25 40.50 2zit s ASN 584 CO 0.71 0.21 -0.20 -0.13 -1.51 0.00 0.00 177.10 176.18 2zit s ARG 585 N 0.03 1.61 -0.04 -0.60 0.52 -0.50 -0.08 118.95 119.89 2zit s ARG 585 Ca -0.07 -1.70 -0.01 0.00 -0.52 0.00 0.00 55.73 53.43 2zit s ARG 585 Cb -0.15 -1.72 0.03 0.00 0.52 0.00 0.00 34.95 33.63 2zit s ARG 585 CO 0.05 0.33 0.06 0.42 0.02 0.00 0.00 175.30 176.18 2zit s ILE 586 N -2.37 -0.10 -0.11 1.52 1.01 -0.13 -2.70 121.20 118.33 2zit s ILE 586 Ca 0.27 0.34 -0.02 0.00 0.00 0.00 0.00 60.65 61.24 2zit s ILE 586 Cb -0.05 -0.13 -0.03 0.00 0.01 0.00 0.00 42.46 42.25 2zit s ILE 586 CO 0.13 0.14 -0.03 -0.31 0.00 0.00 0.00 174.94 174.87 2zit s TYR 587 N 1.74 3.05 0.20 3.97 2.02 0.08 -2.28 117.35 126.13 2zit s TYR 587 Ca -0.01 -0.05 -0.20 0.00 -0.37 0.00 0.00 57.07 56.44 2zit s TYR 587 Cb -0.12 -1.84 0.04 0.00 -0.40 0.00 0.00 41.96 39.64 2zit s TYR 587 CO -0.03 0.23 0.59 -0.48 -1.57 0.00 0.00 175.55 174.29 2zit s LEU 588 N -0.34 -0.22 0.04 -1.29 0.05 -0.29 -1.07 118.68 115.55 2zit s LEU 588 Ca 0.06 -0.33 0.04 0.00 0.05 0.00 0.00 54.13 53.95 2zit s LEU 588 Cb -0.12 2.43 -0.02 0.00 -2.05 0.00 0.00 46.19 46.43 2zit s LEU 588 CO 0.02 -1.08 -0.12 -0.54 -0.55 0.00 0.00 176.35 174.08 2zit s LYS 589 N -3.84 0.77 0.06 1.48 1.02 -0.85 -0.53 119.74 117.86 2zit s LYS 589 Ca 0.06 -0.71 0.05 0.00 0.02 0.00 0.00 55.97 55.39 2zit s LYS 589 Cb -0.02 -0.72 -0.04 0.00 -0.52 0.00 0.00 37.83 36.53 2zit s LYS 589 CO -0.05 0.17 -0.04 0.00 -0.92 0.00 0.00 175.35 174.52 2zit s ALA 590 N -0.93 3.16 0.08 5.17 0.00 -1.26 -0.51 121.76 127.47 2zit s ALA 590 Ca -0.01 -1.10 -0.13 0.00 0.00 0.00 0.00 51.96 50.72 2zit s ALA 590 Cb -0.08 -1.13 0.02 0.00 0.00 0.00 0.00 23.12 21.92 2zit s ALA 590 CO 0.01 0.66 0.30 -1.83 0.00 0.00 0.00 175.76 174.90 2zit s GLU 591 N -1.99 0.90 0.63 0.00 -1.05 -0.20 -1.13 118.70 115.85 2zit s GLU 591 Ca 0.22 -0.70 -0.17 0.00 -0.15 0.00 0.00 54.97 54.17 2zit s GLU 591 Cb -0.11 0.38 -0.01 0.00 -0.44 0.00 0.00 34.13 33.94 2zit s GLU 591 CO 0.14 -0.31 1.15 -2.14 0.95 0.00 0.00 175.26 175.05 2zit s PRO 592 N -3.32 2.85 -0.17 -4.83 0.02 -1.25 -0.88 135.00 127.40 2zit s PRO 592 Ca 0.00 1.59 -0.04 0.00 0.02 0.00 0.00 61.00 62.58 2zit s PRO 592 Cb 0.02 -1.94 -0.02 0.00 0.02 0.00 0.00 34.50 32.58 2zit s PRO 592 CO -0.08 -1.25 -0.04 0.42 -0.33 0.00 0.00 177.00 175.72 2zit s ILE 593 N -2.00 3.75 0.32 2.83 1.01 0.91 -4.70 121.20 123.30 2zit s ILE 593 Ca 0.72 -0.40 -0.29 0.00 0.00 0.00 0.00 60.65 60.68 2zit s ILE 593 Cb -0.25 -2.66 -0.13 0.00 0.01 0.00 0.00 42.46 39.44 2zit s ILE 593 CO 0.37 0.47 1.30 0.47 0.00 0.00 0.00 174.94 177.55 2zit n ASP 594 N 3.92 2.70 -0.29 3.58 8.00 -1.26 -4.72 116.55 128.47 2zit n ASP 594 Ca -0.17 1.19 0.11 0.00 0.71 0.00 0.00 54.79 56.63 2zit n ASP 594 Cb 0.52 -1.46 0.26 0.00 -0.02 0.00 0.00 41.12 40.42 2zit n ASP 594 CO 0.00 0.00 0.00 -0.33 -0.39 0.00 0.00 177.20 176.48 2zit h GLU 595 N 2.92 0.23 -0.78 -1.24 4.39 -1.98 0.10 114.58 118.22 2zit h GLU 595 Ca -0.45 -0.01 0.18 0.00 0.34 0.00 0.00 59.36 59.41 2zit h GLU 595 Cb 1.28 -0.05 -0.12 0.00 -0.10 0.00 0.00 28.75 29.76 2zit h GLU 595 CO 0.66 0.15 0.17 0.93 -1.16 0.00 0.00 179.01 179.75 2zit h GLU 596 N 0.24 0.22 -0.02 2.33 5.08 -2.00 -0.37 114.58 120.06 2zit h GLU 596 Ca 0.52 -0.01 -0.07 0.00 -1.00 0.00 0.00 59.36 58.79 2zit h GLU 596 Cb 1.00 -0.05 0.01 0.00 0.50 0.00 0.00 28.75 30.21 2zit h GLU 596 CO -0.62 0.15 -0.28 0.28 -1.00 0.00 0.00 179.01 177.54 2zit h VAL 597 N 0.23 1.50 -0.51 3.13 2.07 -1.19 -2.70 116.25 118.78 2zit h VAL 597 Ca 0.45 -1.87 0.10 0.00 0.82 0.00 0.00 66.70 66.20 2zit h VAL 597 Cb 0.82 2.63 -0.10 0.00 -1.52 0.00 0.00 31.29 33.12 2zit h VAL 597 CO -0.57 0.52 -0.11 0.28 0.02 0.00 0.00 177.57 177.71 2zit h SER 598 N -0.39 -0.43 -0.57 0.57 0.02 -0.65 0.60 113.55 112.70 2zit h SER 598 Ca -0.03 0.15 0.05 0.00 -0.84 0.00 0.00 61.79 61.11 2zit h SER 598 Cb 1.00 0.30 -0.05 0.00 0.14 0.00 0.00 62.40 63.79 2zit h SER 598 CO 0.06 -0.16 0.31 -0.07 -1.14 0.00 0.00 176.83 175.83 2zit h LEU 599 N 0.02 0.46 -2.05 5.07 3.38 -1.14 -0.79 115.31 120.25 2zit h LEU 599 Ca 0.25 0.02 -0.01 0.00 0.09 0.00 0.00 57.88 58.23 2zit h LEU 599 Cb 0.38 -0.06 -0.00 0.00 0.09 0.00 0.00 40.66 41.06 2zit h LEU 599 CO -0.51 0.31 -0.04 0.00 0.09 0.00 0.00 178.44 178.29 2zit h ALA 600 N 1.29 1.80 0.16 1.53 0.00 -0.62 0.46 119.26 123.89 2zit h ALA 600 Ca 0.25 -0.03 -0.31 0.00 0.00 0.00 0.00 54.91 54.81 2zit h ALA 600 Cb 0.13 -0.01 0.03 0.00 0.00 0.00 0.00 17.79 17.94 2zit h ALA 600 CO -0.15 0.05 -1.32 0.82 0.00 0.00 0.00 179.25 178.64 2zit h ILE 601 N 0.00 1.29 -0.06 0.00 2.04 -0.04 0.22 117.51 120.97 2zit h ILE 601 Ca -0.00 -2.56 -0.13 0.00 1.00 0.00 0.00 64.86 63.17 2zit h ILE 601 Cb 0.07 2.81 -0.01 0.00 -0.74 0.00 0.00 36.82 38.95 2zit h ILE 601 CO 0.00 0.78 -0.54 -0.33 0.00 0.00 0.00 178.15 178.06 2zit h GLU 602 N 0.23 0.18 -0.08 2.37 5.08 -0.25 -3.11 114.58 118.99 2zit h GLU 602 Ca -0.21 -0.11 0.00 0.00 -1.00 0.00 0.00 59.36 58.05 2zit h GLU 602 Cb 2.00 0.01 0.00 0.00 0.50 0.00 0.00 28.75 31.26 2zit h GLU 602 CO 0.25 0.67 0.00 0.09 -1.00 0.00 0.00 179.01 179.02 2zit n ASN 603 N -3.91 1.27 0.00 1.42 3.02 0.15 -4.91 115.26 112.30 2zit n ASN 603 Ca -0.02 -1.55 0.00 0.00 -0.03 0.00 0.00 54.58 52.98 2zit n ASN 603 Cb 0.57 -0.05 0.00 0.00 -0.61 0.00 0.00 39.78 39.69 2zit n ASN 603 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2zit n GLY 604 N 1.09 0.51 0.12 7.41 0.00 -1.16 -4.92 105.19 108.24 2zit n GLY 604 Ca 0.17 -0.01 -0.12 0.00 0.00 0.00 0.00 46.02 46.07 2zit n GLY 604 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 2zit h ILE 605 N 0.00 0.99 -2.89 -0.61 1.08 -0.94 -3.39 117.51 111.75 2zit h ILE 605 Ca 0.00 -1.13 -0.70 0.00 -0.39 0.00 0.00 64.86 62.64 2zit h ILE 605 Cb 0.00 1.62 -0.20 0.00 -3.07 0.00 0.00 36.82 35.18 2zit h ILE 605 CO 0.00 0.24 0.14 -0.63 -0.69 0.00 0.00 178.15 177.21 2zit s ILE 606 N -3.68 4.81 -0.13 -0.67 1.01 0.20 -4.99 121.20 117.75 2zit s ILE 606 Ca -0.14 -1.00 -0.08 0.00 0.00 0.00 0.00 60.65 59.43 2zit s ILE 606 Cb 0.01 -4.50 -0.04 0.00 0.01 0.00 0.00 42.46 37.93 2zit s ILE 606 CO 0.54 -1.14 0.15 0.20 0.00 0.00 0.00 174.94 174.68 2zit s ASN 607 N 3.62 6.38 0.54 3.58 0.01 -1.26 -4.43 114.94 123.39 2zit s ASN 607 Ca 0.12 0.46 0.31 0.00 -0.71 0.00 0.00 52.86 53.04 2zit s ASN 607 Cb -0.24 -2.08 1.49 0.00 0.41 0.00 0.00 41.25 40.84 2zit s ASN 607 CO 0.06 0.37 2.05 -0.65 -1.51 0.00 0.00 177.10 177.43 2zit h PRO 608 N 5.20 0.00 0.00 -0.60 0.11 -1.93 -2.90 132.00 131.88 2zit h PRO 608 Ca -0.53 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.58 2zit h PRO 608 Cb 1.22 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.33 2zit h PRO 608 CO 0.61 0.08 -1.54 0.54 -0.21 0.00 0.00 178.00 177.48 2zit n ARG 609 N -3.35 0.62 -1.90 1.05 1.74 -1.26 -4.95 116.66 108.61 2zit n ARG 609 Ca -0.01 -0.05 -0.37 0.00 -0.77 0.00 0.00 57.85 56.65 2zit n ARG 609 Cb 0.26 -1.65 0.04 0.00 -1.02 0.00 0.00 32.46 30.09 2zit n ARG 609 CO 0.00 0.00 0.00 0.34 -1.52 0.00 0.00 177.63 176.45 2zit s ASP 610 N -4.85 5.17 0.14 0.55 2.15 -1.10 -4.91 116.67 113.82 2zit s ASP 610 Ca -0.04 2.55 -0.34 0.00 0.43 0.00 0.00 52.55 55.15 2zit s ASP 610 Cb 0.12 -2.62 -0.14 0.00 -0.30 0.00 0.00 42.92 39.98 2zit s ASP 610 CO 0.86 -1.62 1.56 -0.67 -0.17 0.00 0.00 175.17 175.13 2zit n ASP 611 N -1.38 2.93 -0.35 -0.34 2.03 -1.26 -4.79 116.55 113.39 2zit n ASP 611 Ca 0.13 1.08 -0.03 0.00 0.52 0.00 0.00 54.79 56.49 2zit n ASP 611 Cb 0.48 -1.40 0.10 0.00 -0.72 0.00 0.00 41.12 39.58 2zit n ASP 611 CO 0.00 0.00 0.00 2.19 -1.92 0.00 0.00 177.20 177.47 2zit h PHE 612 N 5.88 1.19 -0.61 -0.67 -5.15 -1.94 0.40 116.94 116.05 2zit h PHE 612 Ca -0.45 0.02 -0.05 0.00 -0.20 0.00 0.00 57.97 57.29 2zit h PHE 612 Cb 1.26 -0.40 -0.03 0.00 0.22 0.00 0.00 35.95 37.01 2zit h PHE 612 CO 0.63 0.76 0.18 0.87 -2.00 0.00 0.00 178.31 178.74 2zit h LYS 613 N 1.28 0.92 -0.03 6.09 1.57 -1.94 0.28 116.57 124.74 2zit h LYS 613 Ca 0.34 -0.18 -0.05 0.00 -1.87 0.00 0.00 60.65 58.89 2zit h LYS 613 Cb -0.13 -0.14 0.00 0.00 0.08 0.00 0.00 32.23 32.04 2zit h LYS 613 CO -0.07 0.80 -0.19 0.00 -0.57 0.00 0.00 179.45 179.43 2zit h ALA 614 N 1.30 0.06 -0.51 3.86 0.00 -1.73 -2.23 119.26 120.01 2zit h ALA 614 Ca 0.20 -0.41 0.08 0.00 0.00 0.00 0.00 54.91 54.78 2zit h ALA 614 Cb 0.28 0.00 -0.06 0.00 0.00 0.00 0.00 17.79 18.00 2zit h ALA 614 CO -0.01 0.03 0.14 -0.09 0.00 0.00 0.00 179.25 179.33 2zit h ARG 615 N -0.44 0.28 -0.76 0.00 2.43 -0.08 -1.61 114.38 114.20 2zit h ARG 615 Ca -0.02 -0.02 -0.00 0.00 -0.81 0.00 0.00 59.98 59.14 2zit h ARG 615 Cb 0.87 -0.06 -0.04 0.00 -0.42 0.00 0.00 29.97 30.32 2zit h ARG 615 CO 0.04 0.19 0.47 0.00 -1.51 0.00 0.00 179.97 179.16 2zit h ALA 616 N 1.37 0.97 -0.93 2.80 0.00 -0.48 -0.68 119.26 122.31 2zit h ALA 616 Ca 0.25 -0.08 0.11 0.00 0.00 0.00 0.00 54.91 55.19 2zit h ALA 616 Cb 0.31 -0.31 -0.08 0.00 0.00 0.00 0.00 17.79 17.71 2zit h ALA 616 CO -0.29 0.42 0.56 -0.09 0.00 0.00 0.00 179.25 179.85 2zit h ARG 617 N 1.04 0.89 0.26 0.00 9.65 -0.70 0.06 114.38 125.58 2zit h ARG 617 Ca 0.28 -0.05 -0.01 0.00 -1.10 0.00 0.00 59.98 59.09 2zit h ARG 617 Cb -0.06 -0.20 0.00 0.00 -1.39 0.00 0.00 29.97 28.32 2zit h ARG 617 CO -0.05 0.59 -0.13 0.82 2.80 0.00 0.00 179.97 184.00 2zit h ILE 618 N 0.92 0.78 -0.02 1.20 1.08 -0.35 -2.23 117.51 118.90 2zit h ILE 618 Ca 0.45 -0.50 -0.02 0.00 -0.39 0.00 0.00 64.86 64.40 2zit h ILE 618 Cb 0.42 1.06 -0.00 0.00 -3.07 0.00 0.00 36.82 35.22 2zit h ILE 618 CO -0.25 0.11 -0.11 0.24 -0.69 0.00 0.00 178.15 177.44 2zit h MET 619 N -0.62 0.02 0.06 2.37 2.86 -0.76 -0.81 114.93 118.06 2zit h MET 619 Ca -0.04 -0.00 -0.13 0.00 -2.06 0.00 0.00 59.70 57.47 2zit h MET 619 Cb 0.44 -0.00 0.01 0.00 0.06 0.00 0.00 31.60 32.11 2zit h MET 619 CO 0.06 0.13 -0.54 0.00 1.06 0.00 0.00 176.91 177.63 2zit h ALA 620 N 1.87 -0.02 -0.04 6.32 0.00 -0.99 -2.05 119.26 124.35 2zit h ALA 620 Ca 0.00 -0.60 -0.10 0.00 0.00 0.00 0.00 54.91 54.22 2zit h ALA 620 Cb 0.21 0.05 0.01 0.00 0.00 0.00 0.00 17.79 18.06 2zit h ALA 620 CO 0.01 0.26 -0.35 -0.44 0.00 0.00 0.00 179.25 178.73 2zit h ASP 621 N -0.45 0.38 0.03 0.00 3.32 -1.22 -3.09 116.42 115.40 2zit h ASP 621 Ca -0.09 -0.69 0.00 0.00 0.02 0.00 0.00 57.03 56.27 2zit h ASP 621 Cb 1.36 -0.11 0.00 0.00 0.22 0.00 0.00 39.33 40.79 2zit h ASP 621 CO 0.10 1.01 -0.75 0.47 -1.72 0.00 0.00 179.24 178.35 2zit n ASP 622 N -4.41 1.35 -0.34 6.45 8.00 -0.33 -4.46 116.55 122.81 2zit n ASP 622 Ca -0.09 -1.14 0.01 0.00 0.71 0.00 0.00 54.79 54.28 2zit n ASP 622 Cb 0.53 0.73 0.01 0.00 -0.02 0.00 0.00 41.12 42.37 2zit n ASP 622 CO 0.00 0.00 0.00 -1.22 -0.39 0.00 0.00 177.20 175.59 2zit n TYR 623 N -0.92 0.00 -3.10 1.24 4.01 -0.99 -5.02 117.16 112.37 2zit n TYR 623 Ca 0.06 -0.12 -0.22 0.00 -0.16 0.00 0.00 57.90 57.47 2zit n TYR 623 Cb 0.38 -0.05 0.01 0.00 -0.31 0.00 0.00 39.34 39.37 2zit n TYR 623 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2zit n GLY 624 N -0.17 -0.50 3.86 2.72 0.00 -1.16 -4.88 105.19 105.06 2zit n GLY 624 Ca 0.02 0.09 -0.34 0.00 0.00 0.00 0.00 46.02 45.79 2zit n GLY 624 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 2zit s TRP 625 N -2.99 3.54 -0.34 1.61 0.52 -0.81 -4.99 118.94 115.48 2zit s TRP 625 Ca 0.30 0.98 -0.29 0.00 0.02 0.00 0.00 56.10 57.11 2zit s TRP 625 Cb -0.15 -2.32 -0.01 0.00 -1.15 0.00 0.00 33.47 29.85 2zit s TRP 625 CO 0.38 0.38 1.59 -0.51 0.02 0.00 0.00 176.95 178.81 2zit s ASP 626 N -1.94 6.18 0.57 2.95 -0.00 -1.26 -4.18 116.67 118.99 2zit s ASP 626 Ca 0.41 1.16 0.33 0.00 -0.00 0.00 0.00 52.55 54.45 2zit s ASP 626 Cb -0.14 -2.53 1.43 0.00 -0.00 0.00 0.00 42.92 41.68 2zit s ASP 626 CO 0.20 -1.50 1.76 1.62 -0.00 0.00 0.00 175.17 177.24 2zit h VAL 627 N 6.53 0.32 -0.24 -1.27 3.04 -1.93 0.58 116.25 123.29 2zit h VAL 627 Ca -0.31 0.00 -0.07 0.00 -1.01 0.00 0.00 66.70 65.31 2zit h VAL 627 Cb 1.14 0.41 -0.01 0.00 -2.01 0.00 0.00 31.29 30.82 2zit h VAL 627 CO 1.05 0.00 -0.11 0.71 -1.01 0.00 0.00 177.57 178.20 2zit h THR 628 N 0.00 1.30 -0.60 3.17 1.35 -1.96 -2.51 112.91 113.66 2zit h THR 628 Ca 0.44 -1.19 -0.05 0.00 -0.55 0.00 0.00 66.41 65.06 2zit h THR 628 Cb 2.01 1.58 -0.03 0.00 -1.73 0.00 0.00 68.15 69.98 2zit h THR 628 CO -0.00 0.37 0.18 0.44 -0.25 0.00 0.00 175.52 176.25 2zit h ASP 629 N 0.21 0.88 -0.28 5.36 3.32 -0.27 -3.06 116.42 122.58 2zit h ASP 629 Ca 0.05 -0.21 -0.03 0.00 0.02 0.00 0.00 57.03 56.86 2zit h ASP 629 Cb 0.62 -0.23 -0.02 0.00 0.22 0.00 0.00 39.33 39.92 2zit h ASP 629 CO 0.03 0.86 0.10 0.00 -1.72 0.00 0.00 179.24 178.51 2zit h ALA 630 N 1.05 1.52 0.00 3.45 0.00 -1.21 -0.43 119.26 123.65 2zit h ALA 630 Ca 0.19 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.97 2zit h ALA 630 Cb 0.30 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 17.94 2zit h ALA 630 CO -0.00 0.36 0.00 0.54 0.00 0.00 0.00 179.25 180.15 2zit n ARG 631 N -4.36 0.02 -0.67 0.00 1.74 -0.95 -3.33 116.66 109.11 2zit n ARG 631 Ca 0.02 0.06 0.08 0.00 -0.77 0.00 0.00 57.85 57.24 2zit n ARG 631 Cb 0.17 -1.50 0.36 0.00 -1.02 0.00 0.00 32.46 30.47 2zit n ARG 631 CO 0.00 0.00 0.00 1.63 -1.52 0.00 0.00 177.63 177.74 2zit n LYS 632 N -1.49 3.94 -2.05 5.56 4.76 -0.17 -4.95 118.16 123.76 2zit n LYS 632 Ca 0.06 -2.84 -0.42 0.00 -2.87 0.00 0.00 58.31 52.25 2zit n LYS 632 Cb 0.30 -1.98 -0.03 0.00 -1.84 0.00 0.00 35.03 31.48 2zit n LYS 632 CO 0.00 0.00 0.00 0.42 -1.37 0.00 0.00 177.40 176.45 2zit s ILE 633 N -2.06 3.37 -0.11 -0.18 1.01 -1.21 -1.53 121.20 120.48 2zit s ILE 633 Ca 0.50 0.74 0.02 0.00 0.00 0.00 0.00 60.65 61.92 2zit s ILE 633 Cb 0.34 -3.48 -0.24 0.00 0.01 0.00 0.00 42.46 39.09 2zit s ILE 633 CO 0.22 -0.01 0.39 0.79 0.00 0.00 0.00 174.94 176.32 2zit n TRP 634 N 5.77 0.96 -3.62 3.97 7.02 0.17 -4.96 117.44 126.76 2zit n TRP 634 Ca 0.15 0.25 -0.03 0.00 -1.02 0.00 0.00 57.50 56.86 2zit n TRP 634 Cb 0.42 -1.14 -0.01 0.00 -2.42 0.00 0.00 31.31 28.15 2zit n TRP 634 CO 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 177.69 175.67 2zit s PHE 636 N -2.64 2.11 -0.14 0.00 0.08 -1.26 -2.63 117.98 113.50 2zit s PHE 636 Ca 0.11 -0.62 -0.30 0.00 0.12 0.00 0.00 56.93 56.24 2zit s PHE 636 Cb 0.01 -2.17 0.12 0.00 -0.57 0.00 0.00 43.02 40.41 2zit s PHE 636 CO -0.04 -0.57 0.96 0.20 -0.10 0.00 0.00 175.22 175.67 2zit s GLY 637 N -4.37 -0.31 0.06 4.36 0.00 -0.41 -3.99 107.32 102.66 2zit s GLY 637 Ca 0.51 1.89 -0.01 0.00 0.00 0.00 0.00 44.72 47.11 2zit s GLY 637 CO 0.31 0.98 0.08 -1.05 0.00 0.00 0.00 173.10 173.43 2zit n PRO 638 N 0.70 0.16 -1.18 2.90 -0.02 -1.26 -2.51 135.00 133.78 2zit n PRO 638 Ca -0.11 -0.16 -0.09 0.00 -2.02 0.00 0.00 63.50 61.11 2zit n PRO 638 Cb 0.58 -0.08 -0.04 0.00 -0.02 0.00 0.00 33.50 33.94 2zit n PRO 638 CO 0.00 0.00 0.00 -0.25 1.98 0.00 0.00 175.50 177.23 2zit n ASP 639 N -3.03 -4.45 -0.98 2.55 8.00 -1.26 -1.52 116.55 115.85 2zit n ASP 639 Ca 0.01 0.23 -0.12 0.00 0.71 0.00 0.00 54.79 55.63 2zit n ASP 639 Cb 0.04 -3.46 -0.04 0.00 -0.02 0.00 0.00 41.12 37.64 2zit n ASP 639 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2zit n GLY 640 N 0.15 1.03 0.00 0.44 0.00 -1.26 -4.77 105.19 100.79 2zit n GLY 640 Ca -0.09 -0.47 0.00 0.00 0.00 0.00 0.00 46.02 45.46 2zit n GLY 640 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 2zit n ASN 641 N 0.05 0.00 -4.57 1.61 0.23 -0.67 -4.42 115.26 107.49 2zit n ASN 641 Ca -0.12 -0.97 -0.29 0.00 -0.53 0.00 0.00 54.58 52.66 2zit n ASN 641 Cb 0.42 0.00 0.15 0.00 -2.08 0.00 0.00 39.78 38.28 2zit n ASN 641 CO 0.00 0.00 0.00 -0.83 -0.93 0.00 0.00 177.26 175.50 2zit s GLY 642 N 0.00 1.61 -0.63 4.83 0.00 -0.58 -4.78 107.32 107.77 2zit s GLY 642 Ca 0.00 -0.69 -0.07 0.00 0.00 0.00 0.00 44.72 43.96 2zit s GLY 642 CO 0.00 -0.07 3.13 -1.55 0.00 0.00 0.00 173.10 174.61 2zit n PRO 643 N -3.86 2.49 -3.82 2.90 -0.04 -1.19 -3.34 135.00 128.14 2zit n PRO 643 Ca 0.09 -1.39 -0.12 0.00 -0.04 0.00 0.00 63.50 62.03 2zit n PRO 643 Cb 0.59 -2.28 -0.12 0.00 -0.04 0.00 0.00 33.50 31.65 2zit n PRO 643 CO 0.00 0.00 0.00 -0.80 -0.04 0.00 0.00 175.50 174.66 2zit s ASN 644 N 2.22 -0.16 0.07 3.54 0.01 -1.05 -0.86 114.94 118.72 2zit s ASN 644 Ca 0.62 0.27 0.04 0.00 -0.71 0.00 0.00 52.86 53.08 2zit s ASN 644 Cb 0.24 0.35 -0.03 0.00 0.41 0.00 0.00 41.25 42.22 2zit s ASN 644 CO -0.02 -0.13 -0.12 -0.76 -1.51 0.00 0.00 177.10 174.56 2zit s LEU 645 N -0.21 2.30 -0.15 0.60 1.43 -0.65 -1.29 118.68 120.71 2zit s LEU 645 Ca -0.03 -0.64 0.00 0.00 -1.03 0.00 0.00 54.13 52.43 2zit s LEU 645 Cb -0.03 -0.39 -0.00 0.00 0.03 0.00 0.00 46.19 45.81 2zit s LEU 645 CO 0.01 -0.15 -0.16 -0.69 0.23 0.00 0.00 176.35 175.59 2zit s VAL 646 N -1.54 2.61 -0.16 -1.59 1.01 -1.08 -0.42 120.40 119.23 2zit s VAL 646 Ca -0.02 -0.79 -0.01 0.00 0.00 0.00 0.00 61.98 61.16 2zit s VAL 646 Cb -0.09 -2.10 -0.01 0.00 0.00 0.00 0.00 36.38 34.19 2zit s VAL 646 CO 0.01 0.52 -0.13 -0.63 0.00 0.00 0.00 175.10 174.87 2zit s ILE 647 N 0.83 2.89 -0.39 2.22 -1.09 0.13 -0.65 121.20 125.14 2zit s ILE 647 Ca -0.05 -0.69 -0.29 0.00 -2.23 0.00 0.00 60.65 57.39 2zit s ILE 647 Cb -0.15 -2.24 0.01 0.00 -1.58 0.00 0.00 42.46 38.50 2zit s ILE 647 CO -0.01 0.50 1.28 -0.62 -1.23 0.00 0.00 174.94 174.86 2zit s ASP 648 N 0.82 6.56 -0.08 3.58 2.15 -0.58 -1.82 116.67 127.30 2zit s ASP 648 Ca -0.04 0.84 0.11 0.00 0.43 0.00 0.00 52.55 53.89 2zit s ASP 648 Cb -0.15 -2.54 0.17 0.00 -0.30 0.00 0.00 42.92 40.09 2zit s ASP 648 CO 0.00 -1.24 1.09 0.00 -0.17 0.00 0.00 175.17 174.85 2zit n GLN 649 N 7.71 2.01 -1.17 4.34 6.02 -0.58 -4.87 117.38 130.84 2zit n GLN 649 Ca 0.14 -2.12 -0.31 0.00 -0.01 0.00 0.00 57.00 54.70 2zit n GLN 649 Cb 0.48 -1.29 0.10 0.00 1.02 0.00 0.00 30.24 30.55 2zit n GLN 649 CO 0.00 0.00 0.00 0.95 -1.01 0.00 0.00 177.06 177.00 2zit s THR 650 N -2.09 3.12 -0.21 5.09 -4.23 -0.95 -4.70 115.64 111.67 2zit s THR 650 Ca 0.19 0.36 -0.02 0.00 -1.18 0.00 0.00 61.69 61.04 2zit s THR 650 Cb 0.16 -2.78 0.06 0.00 1.34 0.00 0.00 72.50 71.29 2zit s THR 650 CO 0.02 -0.47 0.01 -0.54 -0.54 0.00 0.00 174.62 173.09 2zit s LYS 651 N -4.87 0.96 -0.94 3.99 1.02 -1.26 -4.90 119.74 113.74 2zit s LYS 651 Ca 0.62 -0.64 -0.07 0.00 0.02 0.00 0.00 55.97 55.90 2zit s LYS 651 Cb -0.18 -2.26 -0.02 0.00 -0.52 0.00 0.00 37.83 34.85 2zit s LYS 651 CO 0.56 -0.65 0.77 0.00 -0.92 0.00 0.00 175.35 175.12 2zit n ALA 652 N 4.92 -2.55 -3.69 5.17 0.00 -1.26 -4.98 120.51 118.11 2zit n ALA 652 Ca -0.09 -0.06 -0.36 0.00 0.00 0.00 0.00 53.44 52.92 2zit n ALA 652 Cb 0.46 -3.28 -0.12 0.00 0.00 0.00 0.00 19.45 16.51 2zit n ALA 652 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 2zit s VAL 653 N -3.23 3.34 0.55 0.00 1.01 -1.26 -5.09 120.40 115.73 2zit s VAL 653 Ca 0.25 -1.86 -0.21 0.00 0.00 0.00 0.00 61.98 60.16 2zit s VAL 653 Cb -0.06 -3.20 -0.05 0.00 0.00 0.00 0.00 36.38 33.07 2zit s VAL 653 CO 0.79 -0.57 1.34 -1.58 0.00 0.00 0.00 175.10 175.08 2zit s GLN 654 N 1.19 3.11 0.00 2.72 0.74 -1.26 -2.25 119.66 123.92 2zit s GLN 654 Ca 0.05 2.18 0.00 0.00 0.05 0.00 0.00 55.36 57.64 2zit s GLN 654 Cb -0.22 -2.21 0.00 0.00 1.10 0.00 0.00 33.01 31.67 2zit s GLN 654 CO -0.03 -1.20 0.00 0.66 -0.55 0.00 0.00 175.29 174.18 2zit n TYR 655 N -1.10 0.00 -0.03 1.67 4.01 -1.26 -4.84 117.16 115.60 2zit n TYR 655 Ca 0.11 0.00 -0.09 0.00 -0.16 0.00 0.00 57.90 57.76 2zit n TYR 655 Cb 0.46 -0.77 -0.03 0.00 -0.31 0.00 0.00 39.34 38.69 2zit n TYR 655 CO 0.00 0.00 0.00 1.25 -0.46 0.00 0.00 176.86 177.65 2zit h LEU 656 N 0.00 -0.93 -1.99 7.72 5.85 -1.89 0.28 115.31 124.35 2zit h LEU 656 Ca 0.00 0.15 0.18 0.00 0.84 0.00 0.00 57.88 59.05 2zit h LEU 656 Cb 0.10 0.41 -0.02 0.00 0.37 0.00 0.00 40.66 41.52 2zit h LEU 656 CO 0.00 -0.32 0.49 -0.74 -0.34 0.00 0.00 178.44 177.52 2zit h HIS 657 N -0.32 0.00 0.00 1.25 2.76 -1.90 -0.34 115.15 116.60 2zit h HIS 657 Ca 0.12 0.00 0.00 0.00 -2.20 0.00 0.00 60.37 58.29 2zit h HIS 657 Cb 0.51 0.00 0.00 0.00 1.55 0.00 0.00 27.41 29.47 2zit h HIS 657 CO -0.42 0.00 0.00 0.39 -1.30 0.00 0.00 177.93 176.60 2zit n GLU 658 N -4.14 0.21 -0.01 5.26 1.02 0.09 -1.90 120.64 121.17 2zit n GLU 658 Ca 0.12 0.13 0.00 0.00 -0.02 0.00 0.00 57.16 57.39 2zit n GLU 658 Cb 0.73 -1.50 0.01 0.00 -0.02 0.00 0.00 31.44 30.66 2zit n GLU 658 CO 0.00 0.00 0.00 0.44 1.18 0.00 0.00 177.13 178.75 2zit n ILE 659 N -1.32 0.54 -0.13 -3.67 -5.35 -0.14 -4.78 119.36 104.51 2zit n ILE 659 Ca 0.08 -0.77 -0.07 0.00 -0.27 0.00 0.00 62.75 61.72 2zit n ILE 659 Cb 0.15 0.74 0.01 0.00 -1.74 0.00 0.00 39.64 38.81 2zit n ILE 659 CO 0.00 0.00 0.00 0.50 -1.76 0.00 0.00 176.55 175.29 2zit h LYS 660 N 0.17 0.45 -0.82 6.28 3.64 -1.35 -1.16 116.57 123.80 2zit h LYS 660 Ca 0.00 -0.03 0.05 0.00 -1.27 0.00 0.00 60.65 59.41 2zit h LYS 660 Cb 0.30 -0.10 -0.06 0.00 -0.41 0.00 0.00 32.23 31.96 2zit h LYS 660 CO 0.00 0.30 0.50 -0.44 -2.27 0.00 0.00 179.45 177.54 2zit h ASP 661 N 0.46 0.79 -0.31 4.20 3.32 -1.86 0.66 116.42 123.69 2zit h ASP 661 Ca 0.16 0.01 -0.05 0.00 0.02 0.00 0.00 57.03 57.18 2zit h ASP 661 Cb 0.03 -0.15 -0.01 0.00 0.22 0.00 0.00 39.33 39.41 2zit h ASP 661 CO -0.09 0.52 -0.01 0.28 -1.72 0.00 0.00 179.24 178.22 2zit h SER 662 N 0.93 0.54 0.09 6.45 0.02 -1.79 0.11 113.55 119.90 2zit h SER 662 Ca 0.35 -0.32 0.01 0.00 -0.84 0.00 0.00 61.79 60.99 2zit h SER 662 Cb 0.14 -0.15 -0.01 0.00 0.14 0.00 0.00 62.40 62.52 2zit h SER 662 CO -0.16 0.72 -0.10 0.58 -1.14 0.00 0.00 176.83 176.74 2zit h VAL 663 N 0.34 0.77 -0.16 2.27 2.07 -0.72 0.26 116.25 121.08 2zit h VAL 663 Ca 0.09 0.00 0.03 0.00 0.82 0.00 0.00 66.70 67.64 2zit h VAL 663 Cb 0.45 0.77 -0.03 0.00 -1.52 0.00 0.00 31.29 30.97 2zit h VAL 663 CO 0.02 0.00 -0.03 0.58 0.02 0.00 0.00 177.57 178.16 2zit h VAL 664 N -0.21 0.86 -0.79 2.57 2.07 -0.84 -0.84 116.25 119.06 2zit h VAL 664 Ca 0.01 -0.01 0.10 0.00 0.82 0.00 0.00 66.70 67.62 2zit h VAL 664 Cb 0.21 0.84 -0.07 0.00 -1.52 0.00 0.00 31.29 30.74 2zit h VAL 664 CO -0.04 0.00 0.43 0.00 0.02 0.00 0.00 177.57 177.99 2zit h ALA 665 N 1.15 1.13 -0.54 1.67 0.00 -0.74 -0.78 119.26 121.14 2zit h ALA 665 Ca 0.08 0.04 -0.06 0.00 0.00 0.00 0.00 54.91 54.96 2zit h ALA 665 Cb 0.11 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 17.78 2zit h ALA 665 CO -0.15 0.04 0.07 0.00 0.00 0.00 0.00 179.25 179.21 2zit h ALA 666 N 1.46 1.12 -0.51 0.00 0.00 -0.41 -2.90 119.26 118.01 2zit h ALA 666 Ca 0.39 -0.24 -0.08 0.00 0.00 0.00 0.00 54.91 54.97 2zit h ALA 666 Cb 0.39 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.94 2zit h ALA 666 CO -0.26 0.58 -0.02 0.35 0.00 0.00 0.00 179.25 179.89 2zit h PHE 667 N 0.82 0.94 -0.44 0.00 3.57 0.27 0.11 116.94 122.21 2zit h PHE 667 Ca 0.17 -0.15 -0.00 0.00 3.53 0.00 0.00 57.97 61.52 2zit h PHE 667 Cb 0.38 -0.25 -0.02 0.00 2.79 0.00 0.00 35.95 38.85 2zit h PHE 667 CO 0.02 0.87 0.26 1.96 -2.23 0.00 0.00 178.31 179.19 2zit h GLN 668 N 0.80 0.60 -0.06 1.11 1.08 -1.22 0.13 115.11 117.55 2zit h GLN 668 Ca 0.15 -0.06 -0.11 0.00 -1.45 0.00 0.00 58.65 57.18 2zit h GLN 668 Cb 0.51 -0.12 -0.01 0.00 -0.05 0.00 0.00 27.48 27.81 2zit h GLN 668 CO 0.03 0.45 -0.47 2.35 -0.95 0.00 0.00 178.83 180.23 2zit h TRP 669 N 0.58 0.17 0.08 2.96 7.01 -1.26 -1.20 115.95 124.28 2zit h TRP 669 Ca 0.16 -0.05 -0.25 0.00 2.11 0.00 0.00 58.89 60.85 2zit h TRP 669 Cb 0.01 -0.04 0.00 0.00 -2.10 0.00 0.00 29.16 27.04 2zit h TRP 669 CO -0.03 0.59 -1.11 0.00 -2.79 0.00 0.00 178.44 175.10 2zit h ALA 670 N 1.40 0.22 0.00 2.65 0.00 -0.45 -3.22 119.26 119.86 2zit h ALA 670 Ca 0.00 -0.81 0.00 0.00 0.00 0.00 0.00 54.91 54.11 2zit h ALA 670 Cb 0.88 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.67 2zit h ALA 670 CO 0.07 0.91 -0.39 0.25 0.00 0.00 0.00 179.25 180.08 2zit n THR 671 N -3.62 0.24 0.07 0.00 -2.24 0.42 -3.58 114.28 105.57 2zit n THR 671 Ca -0.08 -0.16 -0.09 0.00 -2.27 0.00 0.00 64.05 61.45 2zit n THR 671 Cb 0.94 -0.16 -0.13 0.00 -2.10 0.00 0.00 70.33 68.88 2zit n THR 671 CO 0.00 0.00 0.00 0.50 -0.57 0.00 0.00 175.07 175.00 2zit h LYS 672 N 0.00 0.07 -2.33 -0.78 1.63 -1.27 0.07 116.57 113.96 2zit h LYS 672 Ca 0.00 -0.12 -0.41 0.00 -0.85 0.00 0.00 60.65 59.27 2zit h LYS 672 Cb 0.64 0.04 -0.35 0.00 -0.60 0.00 0.00 32.23 31.96 2zit h LYS 672 CO 0.00 1.05 -0.70 -1.21 -3.45 0.00 0.00 179.45 175.14 2zit s GLU 673 N -2.70 0.36 0.84 1.90 2.02 -1.22 -3.36 118.70 116.54 2zit s GLU 673 Ca -0.00 -0.46 -0.11 0.00 0.02 0.00 0.00 54.97 54.42 2zit s GLU 673 Cb 0.09 -0.86 0.10 0.00 0.10 0.00 0.00 34.13 33.56 2zit s GLU 673 CO 0.84 -1.07 1.10 0.20 0.02 0.00 0.00 175.26 176.35 2zit s GLY 674 N 2.03 1.66 0.07 -1.39 0.00 0.12 -4.73 107.32 105.08 2zit s GLY 674 Ca 0.11 0.28 0.19 0.00 0.00 0.00 0.00 44.72 45.31 2zit s GLY 674 CO -0.26 0.68 1.60 -1.55 0.00 0.00 0.00 173.10 173.57 2zit n PRO 675 N -3.81 0.06 0.17 2.90 -0.04 -1.26 -1.26 135.00 131.75 2zit n PRO 675 Ca 0.09 0.26 -0.08 0.00 -0.04 0.00 0.00 63.50 63.73 2zit n PRO 675 Cb 0.53 -1.60 -0.04 0.00 -0.04 0.00 0.00 33.50 32.35 2zit n PRO 675 CO 0.00 0.00 0.00 0.82 -0.04 0.00 0.00 175.50 176.28 2zit h ILE 676 N 0.00 0.03 -0.02 0.52 2.04 -1.93 -3.43 117.51 114.72 2zit h ILE 676 Ca 0.00 -0.64 -0.15 0.00 1.00 0.00 0.00 64.86 65.07 2zit h ILE 676 Cb 0.33 0.05 -0.18 0.00 -0.74 0.00 0.00 36.82 36.29 2zit h ILE 676 CO 0.00 0.01 -0.41 2.22 0.00 0.00 0.00 178.15 179.97 2zit n PHE 677 N -5.11 -0.33 -0.48 1.37 1.16 -1.24 -4.83 117.46 107.99 2zit n PHE 677 Ca -0.06 -0.78 0.00 0.00 -1.87 0.00 0.00 57.45 54.74 2zit n PHE 677 Cb 0.20 0.59 0.00 0.00 -1.61 0.00 0.00 39.48 38.66 2zit n PHE 677 CO 0.00 0.00 0.00 0.41 -1.87 0.00 0.00 176.76 175.30 2zit n GLY 678 N -0.24 1.16 3.85 4.97 0.00 -0.39 -4.87 105.19 109.68 2zit n GLY 678 Ca -0.21 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.50 2zit n GLY 678 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2zit s GLU 679 N -0.33 3.75 0.63 1.61 0.41 -1.26 -4.00 118.70 119.51 2zit s GLU 679 Ca 0.00 0.87 -0.19 0.00 -0.41 0.00 0.00 54.97 55.25 2zit s GLU 679 Cb 0.00 -2.10 -0.02 0.00 -1.78 0.00 0.00 34.13 30.23 2zit s GLU 679 CO 0.00 -0.44 1.31 -1.21 -0.49 0.00 0.00 175.26 174.43 2zit s GLU 680 N -4.58 2.65 0.48 1.61 2.02 -1.21 0.12 118.70 119.79 2zit s GLU 680 Ca 0.57 2.11 -0.08 0.00 0.02 0.00 0.00 54.97 57.59 2zit s GLU 680 Cb -0.11 -1.92 -0.05 0.00 0.10 0.00 0.00 34.13 32.16 2zit s GLU 680 CO 0.42 -1.53 0.83 -1.64 0.02 0.00 0.00 175.26 173.36 2zit s MET 681 N -3.29 3.64 -0.18 1.61 -1.94 0.01 0.25 119.30 119.39 2zit s MET 681 Ca 0.81 0.40 -0.16 0.00 -1.71 0.00 0.00 55.69 55.03 2zit s MET 681 Cb -0.38 -2.32 0.05 0.00 2.01 0.00 0.00 34.83 34.19 2zit s MET 681 CO 0.41 -0.22 0.48 0.50 -0.01 0.00 0.00 175.02 176.18 2zit s ARG 682 N -4.53 0.55 -1.36 2.03 3.52 0.51 -4.75 118.95 114.92 2zit s ARG 682 Ca 0.50 0.69 -0.05 0.00 -0.13 0.00 0.00 55.73 56.75 2zit s ARG 682 Cb -0.10 0.24 0.01 0.00 -1.56 0.00 0.00 34.95 33.53 2zit s ARG 682 CO 0.42 -0.08 0.66 0.43 -0.81 0.00 0.00 175.30 175.92 2zit n SER 683 N 3.00 -5.74 -4.37 -2.12 7.64 -0.04 -4.37 113.62 107.62 2zit n SER 683 Ca -0.14 -0.31 -0.33 0.00 1.01 0.00 0.00 58.87 59.09 2zit n SER 683 Cb 0.57 -4.52 -0.14 0.00 -1.01 0.00 0.00 64.21 59.11 2zit n SER 683 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 2zit s VAL 684 N -3.15 3.22 -0.11 0.44 1.01 -1.24 -0.07 120.40 120.51 2zit s VAL 684 Ca 0.33 -0.59 0.02 0.00 0.00 0.00 0.00 61.98 61.74 2zit s VAL 684 Cb -0.14 -2.39 -0.01 0.00 0.00 0.00 0.00 36.38 33.83 2zit s VAL 684 CO 0.41 0.50 -0.18 -0.60 0.00 0.00 0.00 175.10 175.23 2zit s ARG 685 N 0.62 3.13 -0.16 2.72 3.52 -0.06 -1.64 118.95 127.08 2zit s ARG 685 Ca -0.06 -0.77 -0.02 0.00 -0.13 0.00 0.00 55.73 54.75 2zit s ARG 685 Cb -0.15 -2.46 -0.02 0.00 -1.56 0.00 0.00 34.95 30.76 2zit s ARG 685 CO 0.03 0.25 -0.07 0.08 -0.81 0.00 0.00 175.30 174.78 2zit s VAL 686 N 0.21 3.43 -0.41 7.11 1.01 0.44 -1.04 120.40 131.16 2zit s VAL 686 Ca -0.11 -0.51 -0.04 0.00 0.00 0.00 0.00 61.98 61.31 2zit s VAL 686 Cb -0.16 -2.49 0.10 0.00 0.00 0.00 0.00 36.38 33.83 2zit s VAL 686 CO 0.06 0.49 0.21 0.20 0.00 0.00 0.00 175.10 176.06 2zit s ASN 687 N 0.67 5.32 -0.53 3.32 0.01 0.34 0.22 114.94 124.28 2zit s ASN 687 Ca -0.04 -1.87 -0.27 0.00 -0.71 0.00 0.00 52.86 49.97 2zit s ASN 687 Cb -0.15 -1.86 -0.03 0.00 0.41 0.00 0.00 41.25 39.62 2zit s ASN 687 CO 0.02 -0.53 1.93 -0.63 -1.51 0.00 0.00 177.10 176.38 2zit s ILE 688 N 1.22 3.33 0.10 0.60 1.01 -0.75 -2.00 121.20 124.70 2zit s ILE 688 Ca 0.06 0.23 0.00 0.00 0.00 0.00 0.00 60.65 60.95 2zit s ILE 688 Cb -0.23 -3.75 -0.25 0.00 0.01 0.00 0.00 42.46 38.25 2zit s ILE 688 CO -0.03 -0.68 1.20 -0.07 0.00 0.00 0.00 174.94 175.37 2zit h LEU 689 N 16.30 0.25 -7.00 2.97 3.38 -1.38 -1.43 115.31 128.41 2zit h LEU 689 Ca -0.27 -0.27 0.01 0.00 0.09 0.00 0.00 57.88 57.44 2zit h LEU 689 Cb 1.18 -0.08 -0.14 0.00 0.09 0.00 0.00 40.66 41.70 2zit h LEU 689 CO 1.17 1.20 0.30 -0.62 0.09 0.00 0.00 178.44 180.58 2zit s ASP 690 N -6.97 -0.52 -0.14 -0.43 2.15 -1.12 -4.12 116.67 105.52 2zit s ASP 690 Ca -0.02 0.12 -0.13 0.00 0.43 0.00 0.00 52.55 52.95 2zit s ASP 690 Cb 0.08 0.52 0.04 0.00 -0.30 0.00 0.00 42.92 43.26 2zit s ASP 690 CO 0.86 -0.80 0.38 -0.69 -0.17 0.00 0.00 175.17 174.75 2zit s VAL 691 N -3.10 -0.00 -0.11 1.11 1.01 -1.26 -0.74 120.40 117.30 2zit s VAL 691 Ca 0.00 0.00 0.02 0.00 0.00 0.00 0.00 61.98 62.01 2zit s VAL 691 Cb -0.01 -0.54 0.01 0.00 0.00 0.00 0.00 36.38 35.85 2zit s VAL 691 CO -0.08 0.00 -0.16 0.42 0.00 0.00 0.00 175.10 175.28 2zit s THR 692 N 0.25 1.57 0.10 3.92 -4.23 -1.10 -4.94 115.64 111.21 2zit s THR 692 Ca -0.00 -0.69 0.09 0.00 -1.18 0.00 0.00 61.69 59.91 2zit s THR 692 Cb -0.03 -1.42 -0.04 0.00 1.34 0.00 0.00 72.50 72.36 2zit s THR 692 CO -0.00 0.45 -0.24 -0.76 -0.54 0.00 0.00 174.62 173.53 2zit s LEU 693 N 0.90 2.28 0.57 4.79 1.43 -1.26 -1.41 118.68 125.98 2zit s LEU 693 Ca -0.08 -0.68 -0.20 0.00 -1.03 0.00 0.00 54.13 52.14 2zit s LEU 693 Cb -0.15 -1.07 -0.04 0.00 0.03 0.00 0.00 46.19 44.95 2zit s LEU 693 CO -0.01 0.14 1.21 -2.28 0.23 0.00 0.00 176.35 175.65 2zit s HIS 694 N -1.04 2.44 0.17 0.29 5.65 -1.25 -4.95 115.29 116.60 2zit s HIS 694 Ca 0.10 1.50 -0.12 0.00 0.25 0.00 0.00 55.06 56.80 2zit s HIS 694 Cb -0.10 -3.49 0.06 0.00 -1.18 0.00 0.00 32.58 27.87 2zit s HIS 694 CO 0.04 -2.18 1.69 0.00 -0.65 0.00 0.00 174.74 173.64 2zit h ALA 695 N 1.08 0.74 -2.67 1.58 0.00 -2.00 -3.43 119.26 114.57 2zit h ALA 695 Ca -0.50 -0.20 -0.55 0.00 0.00 0.00 0.00 54.91 53.65 2zit h ALA 695 Cb 1.29 -0.22 -0.04 0.00 0.00 0.00 0.00 17.79 18.82 2zit h ALA 695 CO 0.56 0.42 0.14 -0.51 0.00 0.00 0.00 179.25 179.85 2zit s ASP 696 N -6.18 7.14 0.51 0.00 1.01 -1.26 -4.96 116.67 112.93 2zit s ASP 696 Ca -0.13 1.37 0.28 0.00 0.71 0.00 0.00 52.55 54.78 2zit s ASP 696 Cb 0.12 -2.45 1.34 0.00 1.01 0.00 0.00 42.92 42.95 2zit s ASP 696 CO 0.80 -0.02 2.01 0.00 0.21 0.00 0.00 175.17 178.17 2zit h ALA 697 N 5.99 1.17 0.00 5.23 0.00 -2.03 -3.34 119.26 126.28 2zit h ALA 697 Ca -0.43 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.35 2zit h ALA 697 Cb 1.20 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.97 2zit h ALA 697 CO 0.72 0.17 0.00 1.51 0.00 0.00 0.00 179.25 181.65 2zit n ILE 698 N -3.50 0.19 -0.54 0.00 3.06 -1.26 -3.39 119.36 113.92 2zit n ILE 698 Ca -0.01 -0.03 0.00 0.00 -2.50 0.00 0.00 62.75 60.20 2zit n ILE 698 Cb 0.29 -0.84 0.00 0.00 0.54 0.00 0.00 39.64 39.63 2zit n ILE 698 CO 0.00 0.00 0.00 0.54 -2.50 0.00 0.00 176.55 174.59 2zit n ARG 700 N 1.49 -0.72 -0.56 9.51 1.74 -1.26 -5.06 116.66 121.81 2zit n ARG 700 Ca 0.00 0.00 -0.30 0.00 -0.77 0.00 0.00 57.85 56.78 2zit n ARG 700 Cb 0.06 -2.37 0.27 0.00 -1.02 0.00 0.00 32.46 29.41 2zit n ARG 700 CO 0.00 0.00 0.00 0.20 -1.52 0.00 0.00 177.63 176.31 2zit s GLY 701 N -0.54 1.46 0.22 -0.13 0.00 -1.22 -4.58 107.32 102.55 2zit s GLY 701 Ca 0.00 -0.79 -0.07 0.00 0.00 0.00 0.00 44.72 43.85 2zit s GLY 701 CO 0.00 0.17 1.83 -1.33 0.00 0.00 0.00 173.10 173.76 2zit h GLY 702 N -3.17 1.12 1.22 0.20 0.00 -1.97 -1.78 103.07 98.70 2zit h GLY 702 Ca -0.45 -0.31 0.09 0.00 0.00 0.00 0.00 47.33 46.66 2zit h GLY 702 CO 0.32 0.20 0.30 -1.33 0.00 0.00 0.00 176.54 176.02 2zit h GLY 703 N 0.81 0.00 0.26 4.60 0.00 -2.00 -0.49 103.07 106.24 2zit h GLY 703 Ca 0.33 0.00 -0.37 0.00 0.00 0.00 0.00 47.33 47.29 2zit h GLY 703 CO -0.18 0.00 -2.19 -1.06 0.00 0.00 0.00 176.54 173.11 2zit n GLN 704 N -4.00 0.68 -0.01 4.80 1.13 -0.74 -4.49 117.38 114.76 2zit n GLN 704 Ca 0.05 0.24 -0.19 0.00 -1.94 0.00 0.00 57.00 55.17 2zit n GLN 704 Cb 0.46 -1.62 -0.14 0.00 0.11 0.00 0.00 30.24 29.06 2zit n GLN 704 CO 0.00 0.00 0.00 0.82 -1.44 0.00 0.00 177.06 176.44 2zit h ILE 705 N -0.14 1.45 -0.39 5.09 1.08 -1.16 -3.29 117.51 120.14 2zit h ILE 705 Ca -0.51 -2.42 0.08 0.00 -0.39 0.00 0.00 64.86 61.63 2zit h ILE 705 Cb 1.88 3.07 -0.08 0.00 -3.07 0.00 0.00 36.82 38.62 2zit h ILE 705 CO -0.05 0.64 -0.18 0.40 -0.69 0.00 0.00 178.15 178.26 2zit h ILE 706 N -0.62 0.44 -0.79 -0.67 2.04 -1.32 0.41 117.51 117.01 2zit h ILE 706 Ca -0.15 0.00 -0.00 0.00 1.00 0.00 0.00 64.86 65.71 2zit h ILE 706 Cb 1.43 0.44 -0.04 0.00 -0.74 0.00 0.00 36.82 37.92 2zit h ILE 706 CO 0.05 0.00 0.49 -0.65 0.00 0.00 0.00 178.15 178.04 2zit h PRO 707 N -0.11 1.06 0.07 2.37 0.11 -1.75 -1.11 132.00 132.63 2zit h PRO 707 Ca 0.19 -0.09 0.02 0.00 0.11 0.00 0.00 66.00 66.24 2zit h PRO 707 Cb 0.41 -0.23 -0.03 0.00 0.11 0.00 0.00 31.00 31.26 2zit h PRO 707 CO -0.46 0.73 -0.21 1.15 -0.21 0.00 0.00 178.00 179.00 2zit h THR 708 N 1.08 0.53 0.05 -1.15 2.02 -1.08 0.15 112.91 114.51 2zit h THR 708 Ca 0.29 0.00 -0.00 0.00 0.77 0.00 0.00 66.41 67.46 2zit h THR 708 Cb -0.07 0.53 0.00 0.00 -1.74 0.00 0.00 68.15 66.87 2zit h THR 708 CO -0.06 0.00 -0.03 -0.03 0.37 0.00 0.00 175.52 175.78 2zit h MET 709 N -0.37 -0.07 -0.80 6.66 1.85 -0.92 0.13 114.93 121.41 2zit h MET 709 Ca 0.04 0.00 0.11 0.00 -0.61 0.00 0.00 59.70 59.24 2zit h MET 709 Cb 0.41 0.02 -0.08 0.00 0.43 0.00 0.00 31.60 32.37 2zit h MET 709 CO -0.14 0.01 0.42 -0.09 -0.40 0.00 0.00 176.91 176.71 2zit h ARG 710 N -0.13 0.66 -0.04 0.39 1.12 -0.94 0.26 114.38 115.71 2zit h ARG 710 Ca -0.01 -0.04 -0.05 0.00 -1.11 0.00 0.00 59.98 58.77 2zit h ARG 710 Cb 0.11 -0.15 0.00 0.00 -0.01 0.00 0.00 29.97 29.93 2zit h ARG 710 CO 0.01 0.44 -0.19 0.00 -3.11 0.00 0.00 179.97 177.12 2zit h ARG 711 N 0.68 0.20 -0.99 0.20 3.08 -0.51 -2.14 114.38 114.90 2zit h ARG 711 Ca 0.40 -0.16 0.14 0.00 0.07 0.00 0.00 59.98 60.44 2zit h ARG 711 Cb 0.46 0.03 -0.09 0.00 0.08 0.00 0.00 29.97 30.45 2zit h ARG 711 CO -0.29 0.81 0.61 0.00 -1.07 0.00 0.00 179.97 180.03 2zit h ALA 712 N 0.38 1.53 -0.48 0.04 0.00 -0.38 0.42 119.26 120.77 2zit h ALA 712 Ca -0.01 0.04 -0.03 0.00 0.00 0.00 0.00 54.91 54.91 2zit h ALA 712 Cb 0.85 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 18.46 2zit h ALA 712 CO 0.04 0.12 0.19 1.15 0.00 0.00 0.00 179.25 180.75 2zit h THR 713 N 0.89 1.21 -0.59 0.00 2.02 -0.43 -1.53 112.91 114.48 2zit h THR 713 Ca 0.52 -0.66 0.01 0.00 0.77 0.00 0.00 66.41 67.04 2zit h THR 713 Cb 0.62 0.75 -0.03 0.00 -1.74 0.00 0.00 68.15 67.74 2zit h THR 713 CO -0.31 0.25 0.39 1.88 0.37 0.00 0.00 175.52 178.10 2zit h TYR 714 N 0.64 0.74 -0.97 3.16 0.05 -0.48 -0.40 116.97 119.71 2zit h TYR 714 Ca 0.16 0.02 0.00 0.00 0.05 0.00 0.00 58.73 58.96 2zit h TYR 714 Cb 0.20 -0.25 -0.05 0.00 1.01 0.00 0.00 36.73 37.64 2zit h TYR 714 CO 0.00 0.47 0.61 0.00 -1.05 0.00 0.00 178.16 178.20 2zit h ALA 715 N 1.22 1.25 -0.29 3.88 0.00 -0.69 -1.25 119.26 123.37 2zit h ALA 715 Ca 0.22 -0.09 -0.17 0.00 0.00 0.00 0.00 54.91 54.87 2zit h ALA 715 Cb -0.09 -0.39 -0.00 0.00 0.00 0.00 0.00 17.79 17.30 2zit h ALA 715 CO -0.05 0.67 -0.49 0.78 0.00 0.00 0.00 179.25 180.16 2zit h GLY 716 N 1.33 0.89 0.95 0.00 0.00 -0.93 -2.67 103.07 102.64 2zit h GLY 716 Ca 0.35 -0.99 0.01 0.00 0.00 0.00 0.00 47.33 46.70 2zit h GLY 716 CO -0.07 0.89 0.23 -2.75 0.00 0.00 0.00 176.54 174.84 2zit h PHE 717 N 0.64 0.43 0.00 5.60 3.57 -0.60 -2.43 116.94 124.14 2zit h PHE 717 Ca 0.03 0.01 -0.02 0.00 3.53 0.00 0.00 57.97 61.52 2zit h PHE 717 Cb 1.08 -0.14 -0.00 0.00 2.79 0.00 0.00 35.95 39.68 2zit h PHE 717 CO 0.06 0.26 -0.11 -0.07 -2.23 0.00 0.00 178.31 176.21 2zit h LEU 718 N 0.46 0.00 -0.35 0.59 3.38 -1.23 -2.58 115.31 115.58 2zit h LEU 718 Ca 0.14 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.11 2zit h LEU 718 Cb -0.02 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.73 2zit h LEU 718 CO -0.05 0.11 -0.27 0.18 0.09 0.00 0.00 178.44 178.50 2zit n LEU 719 N -3.24 0.81 -2.04 1.67 4.77 -1.01 -4.19 117.00 113.77 2zit n LEU 719 Ca 0.01 -0.15 -0.20 0.00 -0.03 0.00 0.00 56.01 55.63 2zit n LEU 719 Cb 0.39 -0.16 0.19 0.00 -2.33 0.00 0.00 43.42 41.50 2zit n LEU 719 CO 0.31 0.16 1.18 0.00 -1.33 0.00 0.00 177.39 177.71 2zit n ALA 720 N -0.87 5.37 -3.03 -1.18 0.00 -0.95 -0.55 120.51 119.29 2zit n ALA 720 Ca 0.11 -2.93 -0.12 0.00 0.00 0.00 0.00 53.44 50.50 2zit n ALA 720 Cb 0.33 -1.32 0.01 0.00 0.00 0.00 0.00 19.45 18.48 2zit n ALA 720 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 2zit n ASP 721 N -1.12 -7.44 -4.77 0.00 2.03 -1.26 -2.33 116.55 101.66 2zit n ASP 721 Ca 0.55 0.25 -0.36 0.00 0.52 0.00 0.00 54.79 55.75 2zit n ASP 721 Cb 1.56 -4.67 0.00 0.00 -0.72 0.00 0.00 41.12 37.29 2zit n ASP 721 CO 0.00 0.00 0.00 -2.84 -1.92 0.00 0.00 177.20 172.44 2zit s PRO 722 N -2.77 3.49 0.22 -0.67 0.02 -1.26 -1.24 135.00 132.79 2zit s PRO 722 Ca 0.21 1.77 -0.07 0.00 0.02 0.00 0.00 61.00 62.94 2zit s PRO 722 Cb -0.05 -2.22 -0.02 0.00 0.02 0.00 0.00 34.50 32.23 2zit s PRO 722 CO 0.79 -0.77 0.29 0.15 -0.33 0.00 0.00 177.00 177.12 2zit s LYS 723 N -2.96 1.34 0.11 5.54 3.01 0.32 -4.58 119.74 122.51 2zit s LYS 723 Ca 0.69 -1.43 0.09 0.00 -1.01 0.00 0.00 55.97 54.31 2zit s LYS 723 Cb -0.28 0.36 -0.04 0.00 -1.01 0.00 0.00 37.83 36.86 2zit s LYS 723 CO 0.33 -0.50 -0.23 0.96 0.51 0.00 0.00 175.35 176.43 2zit s ILE 724 N -4.08 1.90 -0.01 2.17 -4.36 -1.26 -0.93 121.20 114.63 2zit s ILE 724 Ca 0.30 -1.60 0.04 0.00 -0.26 0.00 0.00 60.65 59.13 2zit s ILE 724 Cb 0.03 -1.71 -0.03 0.00 1.25 0.00 0.00 42.46 42.01 2zit s ILE 724 CO 0.10 0.01 -0.12 -1.10 0.24 0.00 0.00 174.94 174.06 2zit s GLN 725 N -1.92 2.44 -0.02 0.37 -0.21 0.12 -0.64 119.66 119.81 2zit s GLN 725 Ca 0.09 -0.76 0.05 0.00 0.02 0.00 0.00 55.36 54.76 2zit s GLN 725 Cb -0.10 -2.39 -0.03 0.00 1.00 0.00 0.00 33.01 31.49 2zit s GLN 725 CO 0.05 0.60 -0.15 -1.83 -2.12 0.00 0.00 175.29 171.84 2zit s GLU 726 N -1.12 2.38 0.48 2.91 -1.05 0.38 -1.95 118.70 120.73 2zit s GLU 726 Ca 0.14 -0.78 -0.23 0.00 -0.15 0.00 0.00 54.97 53.95 2zit s GLU 726 Cb -0.11 -2.32 -0.07 0.00 -0.44 0.00 0.00 34.13 31.19 2zit s GLU 726 CO 0.04 0.60 1.23 -1.25 0.95 0.00 0.00 175.26 176.82 2zit s PRO 727 N -0.96 3.60 -0.05 -4.83 0.04 -1.26 -0.32 135.00 131.23 2zit s PRO 727 Ca 0.13 1.93 0.02 0.00 0.04 0.00 0.00 61.00 63.12 2zit s PRO 727 Cb -0.11 -2.39 0.01 0.00 0.04 0.00 0.00 34.50 32.06 2zit s PRO 727 CO 0.02 -0.72 -0.09 0.08 0.04 0.00 0.00 177.00 176.33 2zit s VAL 728 N -1.46 0.85 0.45 -0.36 1.01 -0.06 -2.21 120.40 118.63 2zit s VAL 728 Ca 0.65 -0.33 -0.09 0.00 0.00 0.00 0.00 61.98 62.21 2zit s VAL 728 Cb -0.33 -0.80 -0.05 0.00 0.00 0.00 0.00 36.38 35.20 2zit s VAL 728 CO 0.39 0.29 0.81 -0.36 0.00 0.00 0.00 175.10 176.23 2zit s PHE 729 N 0.67 3.51 -0.39 5.22 0.08 0.36 -0.73 117.98 126.70 2zit s PHE 729 Ca -0.12 1.02 0.01 0.00 0.12 0.00 0.00 56.93 57.96 2zit s PHE 729 Cb -0.14 -2.44 0.11 0.00 -0.57 0.00 0.00 43.02 39.98 2zit s PHE 729 CO 0.02 -0.22 0.13 -1.17 -0.10 0.00 0.00 175.22 173.89 2zit s LEU 730 N -4.23 4.93 -0.33 -0.37 0.20 0.18 -1.09 118.68 117.97 2zit s LEU 730 Ca 0.51 -2.20 -0.15 0.00 0.69 0.00 0.00 54.13 52.97 2zit s LEU 730 Cb -0.10 -1.71 -0.02 0.00 -0.43 0.00 0.00 46.19 43.93 2zit s LEU 730 CO 0.37 -0.43 0.38 0.54 -0.29 0.00 0.00 176.35 176.93 2zit s VAL 731 N 0.86 5.15 -0.26 1.68 0.11 0.01 -1.76 120.40 126.20 2zit s VAL 731 Ca 0.11 0.19 -0.12 0.00 -2.93 0.00 0.00 61.98 59.22 2zit s VAL 731 Cb -0.21 -3.81 -0.05 0.00 -1.53 0.00 0.00 36.38 30.78 2zit s VAL 731 CO -0.06 -0.06 0.23 -0.70 -3.33 0.00 0.00 175.10 171.18 2zit s GLU 732 N 2.08 4.01 -0.14 1.54 2.12 0.60 -1.93 118.70 126.98 2zit s GLU 732 Ca 0.13 -0.21 0.00 0.00 0.36 0.00 0.00 54.97 55.26 2zit s GLU 732 Cb -0.16 -3.62 0.02 0.00 0.26 0.00 0.00 34.13 30.63 2zit s GLU 732 CO 0.12 -0.12 -0.13 0.42 -0.54 0.00 0.00 175.26 175.01 2zit s ILE 733 N 1.58 1.49 -0.11 -3.70 1.01 -0.31 -2.19 121.20 118.97 2zit s ILE 733 Ca 0.09 -0.58 -0.25 0.00 0.00 0.00 0.00 60.65 59.91 2zit s ILE 733 Cb -0.15 -1.41 -0.03 0.00 0.01 0.00 0.00 42.46 40.89 2zit s ILE 733 CO 0.09 0.44 0.79 -1.10 0.00 0.00 0.00 174.94 175.16 2zit s GLN 734 N 1.49 4.38 -0.25 2.79 1.11 -1.13 -0.69 119.66 127.36 2zit s GLN 734 Ca 0.04 0.99 -0.18 0.00 0.01 0.00 0.00 55.36 56.22 2zit s GLN 734 Cb -0.13 -3.51 0.07 0.00 -1.01 0.00 0.00 33.01 28.43 2zit s GLN 734 CO -0.10 -0.14 0.64 0.00 0.01 0.00 0.00 175.29 175.70 2zit n PRO 736 N 3.72 1.33 -0.11 0.00 -0.02 -1.26 -1.43 135.00 137.23 2zit n PRO 736 Ca -0.18 0.49 0.26 0.00 -2.02 0.00 0.00 63.50 62.04 2zit n PRO 736 Cb 0.57 -2.18 0.72 0.00 -0.02 0.00 0.00 33.50 32.58 2zit n PRO 736 CO 0.00 0.00 0.00 1.49 1.98 0.00 0.00 175.50 178.97 2zit h GLU 737 N 1.28 0.00 -0.30 -0.52 4.81 -1.38 0.01 114.58 118.48 2zit h GLU 737 Ca -0.47 0.00 -0.13 0.00 -0.13 0.00 0.00 59.36 58.63 2zit h GLU 737 Cb 1.34 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 30.70 2zit h GLU 737 CO 0.55 0.00 -0.34 -0.56 -0.73 0.00 0.00 179.01 177.93 2zit h GLN 738 N 0.00 0.65 -0.34 1.92 3.07 -1.89 -3.18 115.11 115.35 2zit h GLN 738 Ca 0.36 -0.31 0.00 0.00 0.09 0.00 0.00 58.65 58.79 2zit h GLN 738 Cb 1.47 -0.01 0.00 0.00 0.08 0.00 0.00 27.48 29.02 2zit h GLN 738 CO -0.00 0.90 0.00 0.00 0.09 0.00 0.00 178.83 179.82 2zit n ALA 739 N -2.51 2.41 0.20 0.06 0.00 -0.10 -4.34 120.51 116.23 2zit n ALA 739 Ca -0.01 -0.96 0.05 0.00 0.00 0.00 0.00 53.44 52.52 2zit n ALA 739 Cb 0.49 -0.78 0.50 0.00 0.00 0.00 0.00 19.45 19.65 2zit n ALA 739 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 2zit h VAL 740 N 4.08 1.12 0.00 0.00 2.07 -1.29 -1.93 116.25 120.30 2zit h VAL 740 Ca 0.00 -0.55 -0.01 0.00 0.82 0.00 0.00 66.70 66.96 2zit h VAL 740 Cb 0.92 1.23 -0.00 0.00 -1.52 0.00 0.00 31.29 31.92 2zit h VAL 740 CO 0.00 0.16 -0.04 1.23 0.02 0.00 0.00 177.57 178.94 2zit h GLY 741 N 0.51 0.00 1.89 2.17 0.00 -1.78 -1.96 103.07 103.89 2zit h GLY 741 Ca 0.01 0.00 -0.18 0.00 0.00 0.00 0.00 47.33 47.16 2zit h GLY 741 CO 0.02 0.00 -0.82 -1.33 0.00 0.00 0.00 176.54 174.41 2zit h GLY 742 N 0.45 0.11 0.86 4.60 0.00 -1.54 -3.01 103.07 104.54 2zit h GLY 742 Ca -0.00 -0.19 -0.01 0.00 0.00 0.00 0.00 47.33 47.13 2zit h GLY 742 CO 0.01 0.17 0.05 -2.22 0.00 0.00 0.00 176.54 174.55 2zit h ILE 743 N 0.06 1.17 0.00 2.60 2.04 -1.42 -2.37 117.51 119.59 2zit h ILE 743 Ca -0.02 -0.53 0.00 0.00 1.00 0.00 0.00 64.86 65.30 2zit h ILE 743 Cb 1.43 1.25 0.00 0.00 -0.74 0.00 0.00 36.82 38.76 2zit h ILE 743 CO 0.12 0.16 0.00 -1.22 0.00 0.00 0.00 178.15 177.21 2zit n TYR 744 N -4.86 0.49 0.01 1.37 4.01 -1.20 -2.29 117.16 114.70 2zit n TYR 744 Ca -0.05 0.20 -0.13 0.00 -0.16 0.00 0.00 57.90 57.76 2zit n TYR 744 Cb 0.14 -0.82 -0.01 0.00 -0.31 0.00 0.00 39.34 38.34 2zit n TYR 744 CO 0.00 0.00 0.00 1.03 -0.46 0.00 0.00 176.86 177.43 2zit h SER 745 N 0.00 0.71 0.38 7.72 0.87 -1.28 -3.23 113.55 118.72 2zit h SER 745 Ca 0.00 -0.44 -0.32 0.00 -1.23 0.00 0.00 61.79 59.80 2zit h SER 745 Cb 0.30 -0.21 -0.03 0.00 -0.44 0.00 0.00 62.40 62.02 2zit h SER 745 CO 0.00 1.20 -1.75 0.58 -0.53 0.00 0.00 176.83 176.34 2zit h VAL 746 N 0.42 0.86 0.00 2.23 2.07 -1.42 -3.34 116.25 117.08 2zit h VAL 746 Ca -0.03 -2.62 0.00 0.00 0.82 0.00 0.00 66.70 64.87 2zit h VAL 746 Cb 1.30 2.53 0.00 0.00 -1.52 0.00 0.00 31.29 33.60 2zit h VAL 746 CO 0.13 0.71 0.00 0.18 0.02 0.00 0.00 177.57 178.61 2zit n LEU 747 N -3.29 0.03 -0.73 2.57 4.77 -0.97 -1.58 117.00 117.80 2zit n LEU 747 Ca -0.21 0.51 0.12 0.00 -0.03 0.00 0.00 56.01 56.39 2zit n LEU 747 Cb 1.05 -0.51 0.07 0.00 -2.33 0.00 0.00 43.42 41.70 2zit n LEU 747 CO 0.46 -0.35 0.49 0.59 -1.33 0.00 0.00 177.39 177.24 2zit n ASN 748 N -1.53 2.51 0.00 -1.43 3.02 -1.22 -0.08 115.26 116.53 2zit n ASN 748 Ca 0.02 -1.76 0.00 0.00 -0.03 0.00 0.00 54.58 52.81 2zit n ASN 748 Cb 0.11 0.21 0.00 0.00 -0.61 0.00 0.00 39.78 39.50 2zit n ASN 748 CO 0.00 0.00 0.00 2.29 -2.62 0.00 0.00 177.26 176.93 2zit n LYS 749 N 0.69 0.06 -0.06 3.52 2.85 -0.62 -4.59 118.16 120.00 2zit n LYS 749 Ca 0.12 -0.74 0.08 0.00 -1.05 0.00 0.00 58.31 56.72 2zit n LYS 749 Cb 0.53 -0.98 0.11 0.00 -0.65 0.00 0.00 35.03 34.04 2zit n LYS 749 CO 0.00 0.00 0.00 1.63 -0.05 0.00 0.00 177.40 178.98 2zit n LYS 750 N -0.13 1.61 -3.56 -1.58 4.01 -0.94 -4.98 118.16 112.58 2zit n LYS 750 Ca 0.00 -2.31 -0.19 0.00 -0.51 0.00 0.00 58.31 55.30 2zit n LYS 750 Cb 0.08 -1.37 0.06 0.00 -0.51 0.00 0.00 35.03 33.29 2zit n LYS 750 CO 0.00 0.00 0.00 0.54 -1.11 0.00 0.00 177.40 176.83 2zit n ARG 751 N -1.20 -5.75 -3.36 1.97 1.74 -1.25 -4.52 116.66 104.28 2zit n ARG 751 Ca 0.12 0.74 -0.28 0.00 -0.77 0.00 0.00 57.85 57.66 2zit n ARG 751 Cb 0.56 -5.53 -0.03 0.00 -1.02 0.00 0.00 32.46 26.44 2zit n ARG 751 CO 0.00 0.00 0.00 0.20 -1.52 0.00 0.00 177.63 176.31 2zit s GLY 752 N -4.36 1.85 -0.15 -0.13 0.00 0.88 -4.54 107.32 100.87 2zit s GLY 752 Ca 0.00 -0.58 -0.02 0.00 0.00 0.00 0.00 44.72 44.12 2zit s GLY 752 CO 0.77 -0.48 0.00 1.62 0.00 0.00 0.00 173.10 175.02 2zit s GLN 753 N -3.54 0.83 -0.10 2.90 0.74 -0.84 -4.80 119.66 114.84 2zit s GLN 753 Ca 0.43 -0.30 -0.30 0.00 0.05 0.00 0.00 55.36 55.25 2zit s GLN 753 Cb -0.11 -1.77 -0.03 0.00 1.10 0.00 0.00 33.01 32.20 2zit s GLN 753 CO 0.30 -0.50 1.35 0.08 -0.55 0.00 0.00 175.29 175.98 2zit s VAL 754 N 1.83 4.05 -0.12 1.34 1.01 -1.26 -0.21 120.40 127.04 2zit s VAL 754 Ca 0.01 1.31 -0.17 0.00 0.00 0.00 0.00 61.98 63.13 2zit s VAL 754 Cb -0.15 -3.85 -0.26 0.00 0.00 0.00 0.00 36.38 32.12 2zit s VAL 754 CO -0.07 -0.08 0.51 0.58 0.00 0.00 0.00 175.10 176.03 2zit h VAL 755 N 5.36 1.05 -2.05 2.92 2.07 -1.37 -3.48 116.25 120.75 2zit h VAL 755 Ca -0.32 -2.36 0.00 0.00 0.82 0.00 0.00 66.70 64.85 2zit h VAL 755 Cb 1.14 2.68 -0.19 0.00 -1.52 0.00 0.00 31.29 33.40 2zit h VAL 755 CO 0.95 0.64 0.32 -0.94 0.02 0.00 0.00 177.57 178.56 2zit s SER 756 N -6.94 -0.54 -0.44 0.57 1.04 -1.03 -5.04 113.70 101.32 2zit s SER 756 Ca -0.21 0.46 0.02 0.00 0.48 0.00 0.00 55.95 56.70 2zit s SER 756 Cb 0.04 0.47 0.15 0.00 0.10 0.00 0.00 66.02 66.78 2zit s SER 756 CO 0.73 -0.59 0.29 -0.70 0.98 0.00 0.00 173.24 173.96 2zit s GLU 757 N -1.73 1.16 0.00 4.02 2.12 -1.26 -1.79 118.70 121.22 2zit s GLU 757 Ca -0.05 -2.04 0.00 0.00 0.36 0.00 0.00 54.97 53.23 2zit s GLU 757 Cb -0.00 -1.99 0.00 0.00 0.26 0.00 0.00 34.13 32.40 2zit s GLU 757 CO 0.02 -1.25 0.00 0.39 -0.54 0.00 0.00 175.26 173.89 2zit n GLU 758 N 3.28 0.67 0.00 4.30 -0.58 -1.01 -4.93 120.64 122.36 2zit n GLU 758 Ca 0.16 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.90 2zit n GLU 758 Cb 0.39 0.00 0.00 0.00 -0.57 0.00 0.00 31.44 31.26 2zit n GLU 758 CO 0.00 0.00 0.00 0.94 -0.48 0.00 0.00 177.13 177.59 2zit n GLN 759 N -0.97 0.00 -3.78 3.49 7.27 -1.26 -2.24 117.38 119.89 2zit n GLN 759 Ca 0.00 0.00 -0.13 0.00 0.07 0.00 0.00 57.00 56.94 2zit n GLN 759 Cb 0.00 0.00 -0.13 0.00 2.41 0.00 0.00 30.24 32.52 2zit n GLN 759 CO 0.00 0.00 0.00 0.50 0.07 0.00 0.00 177.06 177.63 2zit s ARG 760 N 2.38 0.14 0.22 3.69 3.52 -1.20 -4.71 118.95 122.99 2zit s ARG 760 Ca 0.00 0.31 -0.03 0.00 -0.13 0.00 0.00 55.73 55.88 2zit s ARG 760 Cb 0.00 -0.05 0.44 0.00 -1.56 0.00 0.00 34.95 33.78 2zit s ARG 760 CO 0.00 -0.10 1.17 -2.30 -0.81 0.00 0.00 175.30 173.26 2zit n PRO 761 N 3.66 -0.06 -0.03 5.12 -0.02 -1.26 -3.57 135.00 138.83 2zit n PRO 761 Ca -0.20 1.15 -0.07 0.00 -2.02 0.00 0.00 63.50 62.36 2zit n PRO 761 Cb 0.55 -1.77 -0.02 0.00 -0.02 0.00 0.00 33.50 32.24 2zit n PRO 761 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2zit n GLY 762 N -1.43 -0.13 3.72 -1.23 0.00 -1.26 -5.06 105.19 99.80 2zit n GLY 762 Ca 0.14 -0.04 -0.35 0.00 0.00 0.00 0.00 46.02 45.77 2zit n GLY 762 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2zit s THR 763 N -2.15 2.15 -0.82 2.61 -4.23 -1.23 -4.89 115.64 107.08 2zit s THR 763 Ca -0.10 0.08 0.01 0.00 -1.18 0.00 0.00 61.69 60.50 2zit s THR 763 Cb 0.04 -2.74 0.08 0.00 1.34 0.00 0.00 72.50 71.22 2zit s THR 763 CO 0.13 -0.04 0.68 -0.81 -0.54 0.00 0.00 174.62 174.04 2zit n PRO 764 N -2.59 1.36 -3.12 3.99 -0.04 -1.26 -4.35 135.00 128.99 2zit n PRO 764 Ca 0.14 -0.31 -0.39 0.00 -0.04 0.00 0.00 63.50 62.90 2zit n PRO 764 Cb 0.50 -1.52 -0.05 0.00 -0.04 0.00 0.00 33.50 32.38 2zit n PRO 764 CO 0.00 0.00 0.00 -1.17 -0.04 0.00 0.00 175.50 174.29 2zit s LEU 765 N -0.28 4.25 -0.07 1.53 2.96 -1.26 -0.91 118.68 124.89 2zit s LEU 765 Ca 0.05 1.00 0.01 0.00 -0.22 0.00 0.00 54.13 54.98 2zit s LEU 765 Cb 0.04 -2.95 -0.03 0.00 0.50 0.00 0.00 46.19 43.76 2zit s LEU 765 CO 0.02 -0.14 -0.08 -0.36 -1.32 0.00 0.00 176.35 174.46 2zit s PHE 766 N 1.13 2.91 -0.34 5.38 0.40 -0.51 -3.22 117.98 123.73 2zit s PHE 766 Ca 0.32 -0.03 -0.11 0.00 -0.60 0.00 0.00 56.93 56.51 2zit s PHE 766 Cb -0.16 -1.72 0.00 0.00 0.51 0.00 0.00 43.02 41.65 2zit s PHE 766 CO 0.14 0.28 0.19 -0.08 0.70 0.00 0.00 175.22 176.45 2zit s THR 767 N -0.71 4.76 -0.34 0.64 -1.32 -0.95 -1.48 115.64 116.23 2zit s THR 767 Ca 0.11 -0.50 -0.09 0.00 -1.21 0.00 0.00 61.69 59.99 2zit s THR 767 Cb -0.11 -3.50 0.02 0.00 -1.51 0.00 0.00 72.50 67.40 2zit s THR 767 CO 0.01 -0.04 0.15 -0.69 -2.21 0.00 0.00 174.62 171.84 2zit s VAL 768 N 1.62 4.27 -0.14 5.08 1.01 0.13 -2.41 120.40 129.97 2zit s VAL 768 Ca 0.04 -0.85 -0.06 0.00 0.00 0.00 0.00 61.98 61.11 2zit s VAL 768 Cb -0.18 -3.34 -0.04 0.00 0.00 0.00 0.00 36.38 32.82 2zit s VAL 768 CO 0.07 -0.13 0.08 -0.54 0.00 0.00 0.00 175.10 174.58 2zit s LYS 769 N 1.51 3.60 0.10 2.72 1.02 -0.74 -1.16 119.74 126.79 2zit s LYS 769 Ca 0.01 -0.27 -0.20 0.00 0.02 0.00 0.00 55.97 55.54 2zit s LYS 769 Cb -0.19 -3.14 0.05 0.00 -0.52 0.00 0.00 37.83 34.03 2zit s LYS 769 CO 0.05 0.55 0.49 0.00 -0.92 0.00 0.00 175.35 175.52 2zit s ALA 770 N -0.40 -1.22 -0.06 5.17 0.00 -0.81 -0.92 121.76 123.52 2zit s ALA 770 Ca 0.10 0.31 -0.20 0.00 0.00 0.00 0.00 51.96 52.17 2zit s ALA 770 Cb -0.12 0.61 -0.05 0.00 0.00 0.00 0.00 23.12 23.57 2zit s ALA 770 CO 0.02 -0.61 0.58 0.71 0.00 0.00 0.00 175.76 176.45 2zit s TYR 771 N -3.26 3.60 -0.18 0.00 4.12 0.71 -0.81 117.35 121.53 2zit s TYR 771 Ca -0.01 1.11 -0.02 0.00 0.02 0.00 0.00 57.07 58.17 2zit s TYR 771 Cb 0.00 -2.64 0.06 0.00 -1.52 0.00 0.00 41.96 37.86 2zit s TYR 771 CO -0.08 0.23 0.02 -1.17 0.02 0.00 0.00 175.55 174.56 2zit s LEU 772 N 0.32 1.30 0.13 -1.29 2.96 -0.25 -1.98 118.68 119.88 2zit s LEU 772 Ca 0.31 -0.77 -0.35 0.00 -0.22 0.00 0.00 54.13 53.10 2zit s LEU 772 Cb -0.17 -0.67 -0.15 0.00 0.50 0.00 0.00 46.19 45.70 2zit s LEU 772 CO 0.15 -0.28 1.44 -2.65 -1.32 0.00 0.00 176.35 173.69 2zit n PRO 773 N 5.01 1.65 -0.09 0.98 -0.02 -1.26 -0.48 135.00 140.77 2zit n PRO 773 Ca -0.09 0.59 0.06 0.00 -2.02 0.00 0.00 63.50 62.04 2zit n PRO 773 Cb 0.47 -2.28 0.41 0.00 -0.02 0.00 0.00 33.50 32.07 2zit n PRO 773 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 2zit h VAL 774 N 3.40 1.04 0.00 -1.45 2.07 -1.80 0.75 116.25 120.26 2zit h VAL 774 Ca -0.46 -0.21 0.00 0.00 0.82 0.00 0.00 66.70 66.85 2zit h VAL 774 Cb 1.30 0.36 0.00 0.00 -1.52 0.00 0.00 31.29 31.43 2zit h VAL 774 CO 0.82 0.11 0.00 -0.46 0.02 0.00 0.00 177.57 178.06 2zit n ASN 775 N -4.47 0.00 -0.02 0.57 6.94 -1.26 -2.19 115.26 114.83 2zit n ASN 775 Ca 0.07 -1.23 0.01 0.00 -0.02 0.00 0.00 54.58 53.41 2zit n ASN 775 Cb 0.18 0.00 -0.00 0.00 -2.36 0.00 0.00 39.78 37.60 2zit n ASN 775 CO 0.00 0.00 0.00 -0.62 -1.03 0.00 0.00 177.26 175.61 2zit n GLU 776 N -0.74 3.90 -0.07 -3.83 -0.58 0.23 -4.68 120.64 114.86 2zit n GLU 776 Ca 0.10 -0.21 0.10 0.00 -0.42 0.00 0.00 57.16 56.73 2zit n GLU 776 Cb 0.04 -0.72 0.38 0.00 -0.57 0.00 0.00 31.44 30.57 2zit n GLU 776 CO 0.00 0.00 0.00 -1.13 -0.48 0.00 0.00 177.13 175.52 2zit n SER 777 N -0.62 1.43 -4.61 1.62 3.41 -0.93 -4.68 113.62 109.24 2zit n SER 777 Ca 0.00 -1.69 -0.43 0.00 -0.26 0.00 0.00 58.87 56.50 2zit n SER 777 Cb 0.02 -0.10 -0.02 0.00 -0.26 0.00 0.00 64.21 63.85 2zit n SER 777 CO 0.00 0.00 0.00 -0.36 -0.16 0.00 0.00 175.04 174.52 2zit s PHE 778 N -1.81 2.40 0.00 7.33 0.08 -1.26 -2.30 117.98 122.42 2zit s PHE 778 Ca 0.31 0.69 0.00 0.00 0.12 0.00 0.00 56.93 58.05 2zit s PHE 778 Cb 0.16 -4.24 0.00 0.00 -0.57 0.00 0.00 43.02 38.38 2zit s PHE 778 CO 0.25 -2.03 0.00 0.41 -0.10 0.00 0.00 175.22 173.75 2zit n GLY 779 N 4.98 0.49 0.12 4.36 0.00 -1.26 -4.96 105.19 108.91 2zit n GLY 779 Ca 0.17 -0.41 -0.13 0.00 0.00 0.00 0.00 46.02 45.65 2zit n GLY 779 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 2zit h PHE 780 N 0.00 -0.19 -0.34 1.61 3.57 -1.73 -2.30 116.94 117.55 2zit h PHE 780 Ca 0.00 -0.00 0.10 0.00 3.53 0.00 0.00 57.97 61.59 2zit h PHE 780 Cb 0.00 0.06 -0.01 0.00 2.79 0.00 0.00 35.95 38.79 2zit h PHE 780 CO 0.00 -0.11 0.26 1.15 -2.23 0.00 0.00 178.31 177.37 2zit h THR 781 N -0.22 0.76 -0.23 4.41 2.02 -1.93 0.22 112.91 117.94 2zit h THR 781 Ca -0.02 0.00 -0.10 0.00 0.77 0.00 0.00 66.41 67.06 2zit h THR 781 Cb 0.17 0.82 -0.00 0.00 -1.74 0.00 0.00 68.15 67.39 2zit h THR 781 CO 0.04 0.00 -0.24 1.23 0.37 0.00 0.00 175.52 176.92 2zit h GLY 782 N 0.00 0.62 2.00 2.16 0.00 -1.83 -2.71 103.07 103.31 2zit h GLY 782 Ca 0.16 -0.64 -0.10 0.00 0.00 0.00 0.00 47.33 46.75 2zit h GLY 782 CO -0.00 0.58 -0.47 0.83 0.00 0.00 0.00 176.54 177.48 2zit h GLU 783 N 0.27 0.00 0.00 4.80 5.08 -0.95 -2.74 114.58 121.03 2zit h GLU 783 Ca 0.04 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.40 2zit h GLU 783 Cb 0.80 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.05 2zit h GLU 783 CO 0.06 0.47 0.00 1.25 -1.00 0.00 0.00 179.01 179.79 2zit h LEU 784 N 0.00 0.00 0.17 1.33 5.85 -0.99 -2.74 115.31 118.93 2zit h LEU 784 Ca -0.00 0.00 -0.01 0.00 0.84 0.00 0.00 57.88 58.71 2zit h LEU 784 Cb 1.26 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.30 2zit h LEU 784 CO 0.06 0.00 -0.08 -0.09 -0.34 0.00 0.00 178.44 177.99 2zit h ARG 785 N 0.00 -0.22 -0.59 1.25 9.65 -1.16 -3.17 114.38 120.14 2zit h ARG 785 Ca 0.00 0.02 -0.10 0.00 -1.10 0.00 0.00 59.98 58.80 2zit h ARG 785 Cb 0.51 0.05 -0.02 0.00 -1.39 0.00 0.00 29.97 29.12 2zit h ARG 785 CO 0.00 0.20 -0.01 1.96 2.80 0.00 0.00 179.97 184.92 2zit h GLN 786 N -0.85 1.03 -0.37 0.20 7.50 -1.60 0.06 115.11 121.08 2zit h GLN 786 Ca -0.02 -0.33 -0.03 0.00 0.50 0.00 0.00 58.65 58.76 2zit h GLN 786 Cb 0.52 -0.09 -0.02 0.00 0.05 0.00 0.00 27.48 27.94 2zit h GLN 786 CO 0.04 1.02 0.08 0.00 -1.50 0.00 0.00 178.83 178.47 2zit h ALA 787 N 1.03 1.45 -0.18 3.87 0.00 -1.60 -3.06 119.26 120.76 2zit h ALA 787 Ca 0.17 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 54.92 2zit h ALA 787 Cb 0.56 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.19 2zit h ALA 787 CO 0.03 0.40 0.00 0.25 0.00 0.00 0.00 179.25 179.93 2zit n THR 788 N -4.33 1.29 -1.48 0.00 -2.24 -1.20 -4.32 114.28 102.00 2zit n THR 788 Ca 0.02 -1.27 -0.16 0.00 -2.27 0.00 0.00 64.05 60.36 2zit n THR 788 Cb 0.19 0.30 -0.07 0.00 -2.10 0.00 0.00 70.33 68.66 2zit n THR 788 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2zit n GLY 789 N -0.18 1.60 1.53 3.38 0.00 -0.69 -1.56 105.19 109.27 2zit n GLY 789 Ca 0.10 -0.08 0.00 0.00 0.00 0.00 0.00 46.02 46.04 2zit n GLY 789 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2zit n GLY 790 N -0.43 0.61 0.11 -0.02 0.00 -0.08 -4.93 105.19 100.45 2zit n GLY 790 Ca -0.16 -0.08 0.12 0.00 0.00 0.00 0.00 46.02 45.89 2zit n GLY 790 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 2zit h GLN 791 N 1.54 0.00 -6.85 1.61 4.20 -1.57 -3.44 115.11 110.60 2zit h GLN 791 Ca 0.00 0.00 -0.48 0.00 0.06 0.00 0.00 58.65 58.23 2zit h GLN 791 Cb 0.00 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 27.76 2zit h GLN 791 CO 0.00 0.00 0.35 0.00 -0.67 0.00 0.00 178.83 178.51 2zit s ALA 792 N -3.22 3.25 -0.58 3.87 0.00 -1.26 -4.60 121.76 119.22 2zit s ALA 792 Ca 0.05 0.57 0.02 0.00 0.00 0.00 0.00 51.96 52.60 2zit s ALA 792 Cb 0.11 -3.20 0.15 0.00 0.00 0.00 0.00 23.12 20.18 2zit s ALA 792 CO 0.71 0.16 0.36 0.12 0.00 0.00 0.00 175.76 177.11 2zit s PHE 793 N -1.48 3.31 0.76 0.00 5.36 0.27 -4.98 117.98 121.22 2zit s PHE 793 Ca 0.48 -3.03 -0.14 0.00 -0.96 0.00 0.00 56.93 53.27 2zit s PHE 793 Cb -0.21 -2.96 0.05 0.00 -0.34 0.00 0.00 43.02 39.56 2zit s PHE 793 CO 0.27 -0.76 1.22 -2.14 -1.46 0.00 0.00 175.22 172.34 2zit s PRO 794 N -0.35 1.95 -0.35 10.12 0.02 -1.26 -2.82 135.00 142.31 2zit s PRO 794 Ca 0.18 1.79 -0.06 0.00 0.02 0.00 0.00 61.00 62.92 2zit s PRO 794 Cb -0.22 -1.81 0.20 0.00 0.02 0.00 0.00 34.50 32.69 2zit s PRO 794 CO -0.03 -1.99 1.01 -1.14 -0.33 0.00 0.00 177.00 174.53 2zit s GLN 795 N -3.97 0.28 0.04 5.54 0.74 -0.93 -4.76 119.66 116.61 2zit s GLN 795 Ca 0.75 -0.17 0.04 0.00 0.05 0.00 0.00 55.36 56.03 2zit s GLN 795 Cb -0.30 0.01 -0.04 0.00 1.10 0.00 0.00 33.01 33.79 2zit s GLN 795 CO 0.47 -0.38 -0.06 0.00 -0.55 0.00 0.00 175.29 174.77 2zit s MET 796 N 1.60 2.47 0.02 1.67 0.23 -1.26 -0.29 119.30 123.73 2zit s MET 796 Ca 0.18 -0.80 0.00 0.00 -1.03 0.00 0.00 55.69 54.04 2zit s MET 796 Cb 0.05 -2.47 -0.02 0.00 -1.53 0.00 0.00 34.83 30.87 2zit s MET 796 CO -0.12 0.57 -0.03 0.54 -2.03 0.00 0.00 175.02 173.95 2zit s VAL 797 N -1.10 0.11 0.26 5.16 0.11 -0.72 -4.91 120.40 119.31 2zit s VAL 797 Ca 0.19 -0.78 -0.31 0.00 -2.93 0.00 0.00 61.98 58.15 2zit s VAL 797 Cb -0.11 -0.24 -0.12 0.00 -1.53 0.00 0.00 36.38 34.38 2zit s VAL 797 CO 0.11 -0.42 1.58 0.33 -3.33 0.00 0.00 175.10 173.37 2zit n PHE 798 N 1.81 2.67 0.00 1.54 7.35 -1.26 0.49 117.46 130.06 2zit n PHE 798 Ca -0.22 0.25 -0.00 0.00 -0.76 0.00 0.00 57.45 56.72 2zit n PHE 798 Cb 0.56 -2.58 -0.00 0.00 0.35 0.00 0.00 39.48 37.81 2zit n PHE 798 CO 0.00 0.00 0.00 -3.47 -0.76 0.00 0.00 176.76 172.53 2zit n ASP 799 N 2.55 0.02 -2.69 -2.13 -0.08 0.09 -4.76 116.55 109.55 2zit n ASP 799 Ca 0.11 0.00 -0.14 0.00 -1.51 0.00 0.00 54.79 53.25 2zit n ASP 799 Cb 0.35 -0.15 -0.05 0.00 2.34 0.00 0.00 41.12 43.61 2zit n ASP 799 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 2zit n HIS 800 N -2.52 -0.88 -4.75 -0.67 1.44 -1.15 -5.00 115.22 101.69 2zit n HIS 800 Ca -0.00 -2.07 -0.33 0.00 -2.01 0.00 0.00 57.72 53.31 2zit n HIS 800 Cb 0.00 0.32 -0.13 0.00 0.12 0.00 0.00 29.99 30.30 2zit n HIS 800 CO 0.00 0.00 0.00 -1.58 -2.81 0.00 0.00 176.34 171.95 2zit s TRP 801 N -3.18 2.82 -0.17 -1.40 0.52 -1.26 -0.88 118.94 115.39 2zit s TRP 801 Ca 0.28 -0.22 0.01 0.00 0.02 0.00 0.00 56.10 56.18 2zit s TRP 801 Cb 0.01 -1.72 0.01 0.00 -1.15 0.00 0.00 33.47 30.61 2zit s TRP 801 CO 0.20 0.13 -0.17 0.45 0.02 0.00 0.00 176.95 177.57 2zit s SER 802 N -0.44 3.40 0.07 2.95 0.15 0.57 -4.90 113.70 115.51 2zit s SER 802 Ca 0.06 -0.56 -0.31 0.00 0.70 0.00 0.00 55.95 55.84 2zit s SER 802 Cb -0.12 -1.52 -0.06 0.00 -1.71 0.00 0.00 66.02 62.60 2zit s SER 802 CO 0.02 0.04 1.25 -0.89 1.20 0.00 0.00 173.24 174.86 2zit s THR 803 N 1.06 3.86 -0.06 6.45 2.01 -1.26 -0.47 115.64 127.23 2zit s THR 803 Ca -0.01 1.33 -0.26 0.00 0.31 0.00 0.00 61.69 63.06 2zit s THR 803 Cb -0.14 -3.85 -0.03 0.00 0.01 0.00 0.00 72.50 68.48 2zit s THR 803 CO -0.05 0.10 0.81 -0.76 -0.69 0.00 0.00 174.62 174.02 2zit s LEU 804 N 1.16 4.32 0.26 4.42 1.43 0.19 -4.96 118.68 125.50 2zit s LEU 804 Ca 0.60 1.34 0.08 0.00 -1.03 0.00 0.00 54.13 55.13 2zit s LEU 804 Cb -0.31 -3.26 0.32 0.00 0.03 0.00 0.00 46.19 42.97 2zit s LEU 804 CO 0.29 -0.20 1.60 1.23 0.23 0.00 0.00 176.35 179.50 2zit h GLY 805 N 6.97 0.09 -1.32 -3.19 0.00 -1.95 -3.39 103.07 100.28 2zit h GLY 805 Ca -0.40 -0.11 -0.48 0.00 0.00 0.00 0.00 47.33 46.35 2zit h GLY 805 CO 0.76 0.10 -0.16 -1.14 0.00 0.00 0.00 176.54 176.10 2zit n SER 806 N -3.83 -1.25 -4.48 0.19 3.41 -1.26 -4.93 113.62 101.47 2zit n SER 806 Ca -0.02 0.08 -0.43 0.00 -0.26 0.00 0.00 58.87 58.24 2zit n SER 806 Cb 0.61 -1.28 -0.06 0.00 -0.26 0.00 0.00 64.21 63.23 2zit n SER 806 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 2zit s ASP 807 N -2.35 6.28 0.55 4.04 3.68 -1.26 -4.72 116.67 122.88 2zit s ASP 807 Ca 0.65 -0.64 0.23 0.00 2.13 0.00 0.00 52.55 54.93 2zit s ASP 807 Cb -0.22 -2.33 1.48 0.00 -1.45 0.00 0.00 42.92 40.39 2zit s ASP 807 CO 0.63 -0.94 2.12 1.55 0.13 0.00 0.00 175.17 178.67 2zit h PRO 808 N 9.03 0.00 -0.00 4.34 0.13 -1.85 0.19 132.00 143.84 2zit h PRO 808 Ca -0.27 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.86 2zit h PRO 808 Cb 1.09 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.22 2zit h PRO 808 CO 0.97 0.00 -0.09 1.28 -0.23 0.00 0.00 178.00 179.93 2zit n LEU 809 N -4.22 0.25 -4.29 1.56 4.77 -1.26 -3.76 117.00 110.05 2zit n LEU 809 Ca 0.01 0.17 -0.43 0.00 -0.03 0.00 0.00 56.01 55.73 2zit n LEU 809 Cb 0.27 -0.27 -0.08 0.00 -2.33 0.00 0.00 43.42 41.01 2zit n LEU 809 CO 0.32 0.05 0.02 -0.62 -1.33 0.00 0.00 177.39 175.83 2zit s ASP 810 N -2.63 5.93 0.45 -1.43 2.15 0.67 -4.95 116.67 116.87 2zit s ASP 810 Ca 0.25 -1.65 0.20 0.00 0.43 0.00 0.00 52.55 51.79 2zit s ASP 810 Cb 0.20 -2.10 1.17 0.00 -0.30 0.00 0.00 42.92 41.89 2zit s ASP 810 CO 0.50 -0.69 1.88 -0.65 -0.17 0.00 0.00 175.17 176.04 2zit h PRO 811 N 8.64 0.30 0.00 4.34 0.11 -1.80 -0.54 132.00 143.05 2zit h PRO 811 Ca -0.26 -0.02 -0.04 0.00 0.11 0.00 0.00 66.00 65.79 2zit h PRO 811 Cb 1.09 -0.07 -0.01 0.00 0.11 0.00 0.00 31.00 32.13 2zit h PRO 811 CO 0.89 0.20 -0.21 1.79 -0.21 0.00 0.00 178.00 180.46 2zit h THR 812 N 0.30 0.38 -3.85 -1.15 1.35 -1.91 -3.00 112.91 105.03 2zit h THR 812 Ca 0.43 -1.40 -0.45 0.00 -0.55 0.00 0.00 66.41 64.43 2zit h THR 812 Cb 1.19 2.07 0.16 0.00 -1.73 0.00 0.00 68.15 69.85 2zit h THR 812 CO -0.12 0.20 0.18 -0.94 -0.25 0.00 0.00 175.52 174.59 2zit s SER 813 N -6.25 2.52 0.39 5.36 1.04 -0.21 -4.80 113.70 111.74 2zit s SER 813 Ca 0.05 1.20 0.17 0.00 0.48 0.00 0.00 55.95 57.84 2zit s SER 813 Cb 0.07 -1.87 0.79 0.00 0.10 0.00 0.00 66.02 65.11 2zit s SER 813 CO 0.68 -3.20 1.82 0.11 0.98 0.00 0.00 173.24 173.63 2zit h LYS 814 N -1.94 0.00 0.00 4.02 1.57 -1.88 -0.72 116.57 117.62 2zit h LYS 814 Ca -0.55 0.00 -0.02 0.00 -1.87 0.00 0.00 60.65 58.21 2zit h LYS 814 Cb 1.33 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 33.64 2zit h LYS 814 CO 0.57 0.36 -0.14 0.00 -0.57 0.00 0.00 179.45 179.67 2zit h ALA 815 N 1.64 0.03 0.00 3.86 0.00 -1.84 -3.29 119.26 119.65 2zit h ALA 815 Ca -0.00 -0.54 0.00 0.00 0.00 0.00 0.00 54.91 54.37 2zit h ALA 815 Cb 0.72 0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.59 2zit h ALA 815 CO 0.05 0.08 0.00 0.78 0.00 0.00 0.00 179.25 180.16 2zit h GLY 816 N -1.00 0.00 0.67 0.00 0.00 -1.52 -1.89 103.07 99.33 2zit h GLY 816 Ca -0.04 0.00 -0.00 0.00 0.00 0.00 0.00 47.33 47.29 2zit h GLY 816 CO -0.02 0.00 -0.01 -2.09 0.00 0.00 0.00 176.54 174.42 2zit h GLU 817 N 0.00 -0.03 -0.51 4.80 4.81 -0.98 -0.65 114.58 122.03 2zit h GLU 817 Ca 0.00 0.00 -0.12 0.00 -0.13 0.00 0.00 59.36 59.12 2zit h GLU 817 Cb 0.09 0.01 -0.02 0.00 0.63 0.00 0.00 28.75 29.46 2zit h GLU 817 CO 0.00 0.30 -0.14 0.82 -0.73 0.00 0.00 179.01 179.25 2zit h ILE 818 N -0.36 1.27 -0.44 2.32 2.04 -1.45 -2.20 117.51 118.69 2zit h ILE 818 Ca -0.00 -1.29 0.01 0.00 1.00 0.00 0.00 64.86 64.57 2zit h ILE 818 Cb 0.34 1.03 -0.02 0.00 -0.74 0.00 0.00 36.82 37.42 2zit h ILE 818 CO 0.01 0.45 0.28 0.58 0.00 0.00 0.00 178.15 179.47 2zit h VAL 819 N 0.86 1.09 0.17 1.67 2.07 -1.37 -0.95 116.25 119.79 2zit h VAL 819 Ca 0.13 -0.20 -0.01 0.00 0.82 0.00 0.00 66.70 67.44 2zit h VAL 819 Cb 0.70 0.47 0.00 0.00 -1.52 0.00 0.00 31.29 30.94 2zit h VAL 819 CO 0.05 0.10 -0.08 0.25 0.02 0.00 0.00 177.57 177.92 2zit h LEU 820 N 0.57 -0.19 -0.51 2.57 5.85 -1.04 -1.03 115.31 121.53 2zit h LEU 820 Ca 0.17 -0.05 0.08 0.00 0.84 0.00 0.00 57.88 58.92 2zit h LEU 820 Cb -0.04 0.05 -0.07 0.00 0.37 0.00 0.00 40.66 40.97 2zit h LEU 820 CO -0.05 -0.07 0.13 0.00 -0.34 0.00 0.00 178.44 178.11 2zit h ALA 821 N 0.52 0.59 -0.17 1.25 0.00 -1.15 -1.22 119.26 119.09 2zit h ALA 821 Ca -0.02 0.09 -0.04 0.00 0.00 0.00 0.00 54.91 54.94 2zit h ALA 821 Cb 0.23 0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.13 2zit h ALA 821 CO 0.04 -0.28 -0.04 0.00 0.00 0.00 0.00 179.25 178.97 2zit h ALA 822 N 1.38 0.23 -0.35 0.00 0.00 -1.13 -2.28 119.26 117.11 2zit h ALA 822 Ca 0.25 -0.24 0.07 0.00 0.00 0.00 0.00 54.91 54.99 2zit h ALA 822 Cb 0.32 -0.06 -0.06 0.00 0.00 0.00 0.00 17.79 17.99 2zit h ALA 822 CO -0.31 -0.01 -0.06 0.00 0.00 0.00 0.00 179.25 178.87 2zit h ARG 823 N 0.02 0.03 -0.60 0.00 3.08 -0.81 -0.42 114.38 115.68 2zit h ARG 823 Ca 0.04 -0.00 0.02 0.00 0.07 0.00 0.00 59.98 60.11 2zit h ARG 823 Cb 0.47 -0.01 -0.04 0.00 0.08 0.00 0.00 29.97 30.48 2zit h ARG 823 CO 0.02 0.02 0.38 0.87 -1.07 0.00 0.00 179.97 180.18 2zit h LYS 824 N 0.03 0.73 -0.73 0.04 1.57 -1.23 -0.48 116.57 116.50 2zit h LYS 824 Ca 0.17 -0.04 0.05 0.00 -1.87 0.00 0.00 60.65 58.96 2zit h LYS 824 Cb 0.25 -0.16 -0.05 0.00 0.08 0.00 0.00 32.23 32.34 2zit h LYS 824 CO -0.33 0.48 0.44 -0.09 -0.57 0.00 0.00 179.45 179.38 2zit h ARG 825 N 0.75 0.79 -0.01 3.15 2.43 -0.69 -1.46 114.38 119.34 2zit h ARG 825 Ca 0.24 -0.05 0.00 0.00 -0.81 0.00 0.00 59.98 59.36 2zit h ARG 825 Cb -0.01 -0.18 0.00 0.00 -0.42 0.00 0.00 29.97 29.37 2zit h ARG 825 CO -0.09 0.52 0.00 0.72 -1.51 0.00 0.00 179.97 179.61 2zit n HIS 826 N -4.71 0.01 -2.01 2.20 8.25 -0.26 -4.88 115.22 113.83 2zit n HIS 826 Ca 0.09 -0.01 -0.12 0.00 -0.26 0.00 0.00 57.72 57.42 2zit n HIS 826 Cb 0.15 0.00 -0.02 0.00 1.12 0.00 0.00 29.99 31.24 2zit n HIS 826 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2zit n GLY 827 N 0.89 0.23 3.93 -1.41 0.00 -0.55 -5.02 105.19 103.26 2zit n GLY 827 Ca 0.17 -0.39 -0.26 0.00 0.00 0.00 0.00 46.02 45.55 2zit n GLY 827 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2zit s MET 828 N -4.22 2.79 0.12 1.61 -1.94 -0.24 -5.02 119.30 112.40 2zit s MET 828 Ca 0.00 -0.17 -0.31 0.00 -1.71 0.00 0.00 55.69 53.50 2zit s MET 828 Cb 0.00 -2.31 -0.09 0.00 2.01 0.00 0.00 34.83 34.44 2zit s MET 828 CO 0.00 -0.74 1.62 0.21 -0.01 0.00 0.00 175.02 176.10 2zit s LYS 829 N -4.96 4.20 0.36 2.03 2.20 -1.26 -4.50 119.74 117.81 2zit s LYS 829 Ca 0.54 2.36 0.11 0.00 -0.36 0.00 0.00 55.97 58.63 2zit s LYS 829 Cb -0.10 -3.37 0.89 0.00 -1.51 0.00 0.00 37.83 33.73 2zit s LYS 829 CO 0.44 -0.68 1.83 0.93 -0.36 0.00 0.00 175.35 177.51 2zit h GLU 830 N 7.56 0.60 -6.19 4.03 5.08 -1.95 -3.40 114.58 120.30 2zit h GLU 830 Ca -0.43 -0.04 -0.55 0.00 -1.00 0.00 0.00 59.36 57.34 2zit h GLU 830 Cb 1.20 -0.14 -0.04 0.00 0.50 0.00 0.00 28.75 30.27 2zit h GLU 830 CO 0.92 0.40 0.13 -1.21 -1.00 0.00 0.00 179.01 178.25 2zit s GLU 831 N -5.65 4.46 -0.07 2.33 8.01 -1.26 -4.83 118.70 121.69 2zit s GLU 831 Ca -0.10 0.99 -0.30 0.00 0.01 0.00 0.00 54.97 55.57 2zit s GLU 831 Cb 0.23 -3.39 -0.04 0.00 -4.31 0.00 0.00 34.13 26.62 2zit s GLU 831 CO 0.79 0.20 1.47 0.08 0.01 0.00 0.00 175.26 177.82 2zit s VAL 832 N 0.27 3.82 0.31 2.63 1.01 -1.26 -4.95 120.40 122.23 2zit s VAL 832 Ca 0.38 1.06 -0.28 0.00 0.00 0.00 0.00 61.98 63.13 2zit s VAL 832 Cb -0.19 -3.68 -0.13 0.00 0.00 0.00 0.00 36.38 32.38 2zit s VAL 832 CO 0.21 -0.07 1.21 -2.65 0.00 0.00 0.00 175.10 173.80 2zit n PRO 833 N 6.54 1.86 -1.33 2.72 -0.02 -1.26 -4.97 135.00 138.54 2zit n PRO 833 Ca 0.15 0.65 -0.30 0.00 -2.02 0.00 0.00 63.50 61.99 2zit n PRO 833 Cb 0.44 -2.18 0.12 0.00 -0.02 0.00 0.00 33.50 31.87 2zit n PRO 833 CO 0.00 0.00 0.00 0.20 1.98 0.00 0.00 175.50 177.68 2zit s GLY 834 N -0.32 1.61 0.48 -1.23 0.00 -1.26 -4.93 107.32 101.68 2zit s GLY 834 Ca 0.58 -0.15 0.20 0.00 0.00 0.00 0.00 44.72 45.35 2zit s GLY 834 CO 0.60 0.33 2.04 0.11 0.00 0.00 0.00 173.10 176.18 2zit h TRP 835 N -1.42 0.00 0.00 1.90 5.08 -1.91 -2.53 115.95 117.07 2zit h TRP 835 Ca -0.49 0.00 -0.00 0.00 1.08 0.00 0.00 58.89 59.48 2zit h TRP 835 Cb 1.28 0.00 -0.00 0.00 -3.00 0.00 0.00 29.16 27.44 2zit h TRP 835 CO 0.42 0.15 -0.01 1.96 -1.28 0.00 0.00 178.44 179.68 2zit h GLN 836 N 0.00 0.00 0.00 0.12 7.50 -1.92 -0.75 115.11 120.06 2zit h GLN 836 Ca -0.00 0.00 -0.06 0.00 0.50 0.00 0.00 58.65 59.09 2zit h GLN 836 Cb 0.31 0.00 -0.01 0.00 0.05 0.00 0.00 27.48 27.83 2zit h GLN 836 CO 0.02 0.01 -0.28 0.93 -1.50 0.00 0.00 178.83 178.01 2zit h GLU 837 N 0.00 0.00 -0.01 1.46 5.08 -1.82 -3.03 114.58 116.26 2zit h GLU 837 Ca -0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 2zit h GLU 837 Cb 0.03 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.28 2zit h GLU 837 CO 0.00 0.28 -0.55 0.66 -1.00 0.00 0.00 179.01 178.41 2zit n TYR 838 N -3.38 0.00 -2.48 4.33 4.02 -0.48 -4.96 117.16 114.21 2zit n TYR 838 Ca 0.00 0.00 -0.28 0.00 -0.01 0.00 0.00 57.90 57.61 2zit n TYR 838 Cb 0.49 0.00 0.00 0.00 -0.02 0.00 0.00 39.34 39.81 2zit n TYR 838 CO 0.00 0.00 0.00 -0.47 -1.01 0.00 0.00 176.86 175.38 2zit s TYR 839 N -2.30 3.56 0.17 -0.72 5.04 -0.41 -4.19 117.35 118.49 2zit s TYR 839 Ca 0.12 0.89 -0.33 0.00 -2.44 0.00 0.00 57.07 55.31 2zit s TYR 839 Cb 0.14 -2.41 -0.13 0.00 0.35 0.00 0.00 41.96 39.92 2zit s TYR 839 CO 0.56 -0.39 1.65 -3.47 -1.34 0.00 0.00 175.55 172.56 2zit n ASP 840 N -2.37 3.46 -4.57 4.32 4.64 0.26 -4.84 116.55 117.44 2zit n ASP 840 Ca 0.02 1.07 -0.29 0.00 -1.38 0.00 0.00 54.79 54.21 2zit n ASP 840 Cb 0.55 -1.48 -0.05 0.00 -1.04 0.00 0.00 41.12 39.10 2zit n ASP 840 CO 0.00 0.00 0.00 -0.75 -0.82 0.00 0.00 177.20 175.63 2zit s LYS 841 N 1.20 2.64 0.00 -0.67 2.20 -1.26 -5.04 119.74 118.81 2zit s LYS 841 Ca 0.78 -0.85 0.00 0.00 -0.36 0.00 0.00 55.97 55.54 2zit s LYS 841 Cb -0.61 -5.19 0.00 0.00 -1.51 0.00 0.00 37.83 30.52 2zit s LYS 841 CO 0.36 -3.58 0.12 1.28 -0.36 0.00 0.00 175.35 173.18