#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ocz n THR 2 N 0.00 0.00 -2.52 2.03 -1.04 -1.26 -4.65 114.28 106.85 1ocz n THR 2 Ca 0.00 0.00 -0.43 0.00 -2.04 0.00 0.00 64.05 61.58 1ocz n THR 2 Cb 0.00 0.00 -0.02 0.00 -1.82 0.00 0.00 70.33 68.49 1ocz n THR 2 CO 0.00 0.00 0.00 -2.28 -0.64 0.00 0.00 175.07 172.15 1ocz s HIS 3 N 0.00 2.96 0.14 -1.42 2.46 -1.26 -4.98 115.29 113.20 1ocz s HIS 3 Ca 0.00 1.10 -0.30 0.00 0.47 0.00 0.00 55.06 56.33 1ocz s HIS 3 Cb 0.00 -3.61 -0.07 0.00 -0.13 0.00 0.00 32.58 28.77 1ocz s HIS 3 CO 0.00 -1.26 1.23 1.14 -2.47 0.00 0.00 174.74 173.38 1ocz s GLN 4 N 3.65 4.44 -0.25 2.88 -2.07 -1.26 -4.94 119.66 122.11 1ocz s GLN 4 Ca 0.51 1.89 0.13 0.00 -1.82 0.00 0.00 55.36 56.07 1ocz s GLN 4 Cb -0.17 -3.26 0.61 0.00 -1.09 0.00 0.00 33.01 29.10 1ocz s GLN 4 CO 0.15 -0.20 1.57 0.25 -1.32 0.00 0.00 175.29 175.75 1ocz n THR 5 N 3.08 2.57 -4.38 3.63 -2.24 -1.26 -4.96 114.28 110.73 1ocz n THR 5 Ca 0.07 -1.95 -0.30 0.00 -2.27 0.00 0.00 64.05 59.60 1ocz n THR 5 Cb 0.45 -0.30 -0.12 0.00 -2.10 0.00 0.00 70.33 68.26 1ocz n THR 5 CO 0.00 0.00 0.00 -1.38 -0.57 0.00 0.00 175.07 173.12 1ocz s HIS 6 N -2.96 2.53 -2.00 4.78 0.00 -1.26 -5.02 115.29 111.36 1ocz s HIS 6 Ca 0.47 -0.27 0.00 0.00 -3.00 0.00 0.00 55.06 52.27 1ocz s HIS 6 Cb 0.39 -1.37 0.01 0.00 -4.00 0.00 0.00 32.58 27.61 1ocz s HIS 6 CO 0.09 0.36 0.95 0.00 -1.00 0.00 0.00 174.74 175.13 1ocz n ALA 7 N 0.96 2.44 -2.01 -1.38 0.00 -1.26 -4.89 120.51 114.37 1ocz n ALA 7 Ca -0.16 -0.00 -0.29 0.00 0.00 0.00 0.00 53.44 52.99 1ocz n ALA 7 Cb 0.53 -1.00 0.02 0.00 0.00 0.00 0.00 19.45 19.00 1ocz n ALA 7 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.50 178.21 1ocz s TYR 8 N -2.00 3.42 -0.23 0.00 2.02 -1.26 -4.49 117.35 114.81 1ocz s TYR 8 Ca 0.00 0.95 -0.10 0.00 -0.37 0.00 0.00 57.07 57.55 1ocz s TYR 8 Cb 0.00 -2.76 -0.05 0.00 -0.40 0.00 0.00 41.96 38.76 1ocz s TYR 8 CO 0.00 -0.80 0.15 -1.58 -1.57 0.00 0.00 175.55 171.75 1ocz s HIS 9 N -3.10 3.33 -0.55 2.71 5.04 -1.26 -5.05 115.29 116.41 1ocz s HIS 9 Ca 0.54 0.23 -0.09 0.00 -1.54 0.00 0.00 55.06 54.20 1ocz s HIS 9 Cb -0.11 -2.24 0.14 0.00 0.04 0.00 0.00 32.58 30.41 1ocz s HIS 9 CO 0.49 0.10 0.42 -1.64 -2.34 0.00 0.00 174.74 171.78 1ocz s MET 10 N 0.91 2.65 0.18 2.88 -1.94 -1.26 -5.07 119.30 117.64 1ocz s MET 10 Ca 0.07 -1.99 -0.30 0.00 -1.71 0.00 0.00 55.69 51.76 1ocz s MET 10 Cb -0.13 -3.96 -0.08 0.00 2.01 0.00 0.00 34.83 32.66 1ocz s MET 10 CO 0.03 -1.21 1.27 0.54 -0.01 0.00 0.00 175.02 175.65 1ocz s VAL 11 N 0.96 3.39 0.66 -6.03 0.11 -1.26 -5.00 120.40 113.23 1ocz s VAL 11 Ca 0.09 1.13 -0.17 0.00 -2.93 0.00 0.00 61.98 60.10 1ocz s VAL 11 Cb -0.23 -3.72 -0.00 0.00 -1.53 0.00 0.00 36.38 30.90 1ocz s VAL 11 CO -0.02 0.16 1.23 0.20 -3.33 0.00 0.00 175.10 173.33 1ocz s ASN 12 N 0.40 4.69 0.34 3.54 0.02 -1.26 -4.92 114.94 117.75 1ocz s ASN 12 Ca 0.56 2.43 -0.26 0.00 -1.02 0.00 0.00 52.86 54.57 1ocz s ASN 12 Cb -0.35 -2.60 -0.13 0.00 0.02 0.00 0.00 41.25 38.20 1ocz s ASN 12 CO 0.36 -1.94 0.97 -2.65 0.02 0.00 0.00 177.10 173.87 1ocz n PRO 13 N -2.09 1.30 -4.27 -0.60 -0.02 -1.26 -4.98 135.00 123.09 1ocz n PRO 13 Ca 0.14 0.46 -0.17 0.00 -2.02 0.00 0.00 63.50 61.91 1ocz n PRO 13 Cb 0.49 -1.89 -0.14 0.00 -0.02 0.00 0.00 33.50 31.95 1ocz n PRO 13 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 1ocz s SER 14 N -0.64 1.10 0.00 2.55 0.15 -1.26 -5.03 113.70 110.56 1ocz s SER 14 Ca 0.60 -0.31 0.27 0.00 0.70 0.00 0.00 55.95 57.22 1ocz s SER 14 Cb -0.64 -0.08 0.91 0.00 -1.71 0.00 0.00 66.02 64.50 1ocz s SER 14 CO 0.59 0.02 1.66 -0.81 1.20 0.00 0.00 173.24 175.90 1ocz n PRO 15 N 2.34 1.52 -0.16 5.44 -0.04 -1.26 -4.47 135.00 138.38 1ocz n PRO 15 Ca -0.16 -0.93 0.01 0.00 -0.04 0.00 0.00 63.50 62.38 1ocz n PRO 15 Cb 0.56 -1.48 0.29 0.00 -0.04 0.00 0.00 33.50 32.82 1ocz n PRO 15 CO 0.00 0.00 0.00 -1.49 -0.04 0.00 0.00 175.50 173.97 1ocz h TRP 16 N 2.27 0.83 -0.44 0.54 -0.00 -1.96 -1.97 115.95 115.22 1ocz h TRP 16 Ca 0.00 0.01 -0.10 0.00 -0.00 0.00 0.00 58.89 58.80 1ocz h TRP 16 Cb 0.54 -0.28 -0.02 0.00 -0.00 0.00 0.00 29.16 29.40 1ocz h TRP 16 CO 0.00 0.54 -0.14 -1.35 -0.00 0.00 0.00 178.44 177.49 1ocz h PRO 17 N 0.89 0.81 -0.03 0.49 0.11 -1.98 0.17 132.00 132.46 1ocz h PRO 17 Ca 0.24 -0.29 -0.01 0.00 0.11 0.00 0.00 66.00 66.05 1ocz h PRO 17 Cb -0.07 -0.06 -0.00 0.00 0.11 0.00 0.00 31.00 30.98 1ocz h PRO 17 CO -0.05 0.91 -0.00 1.25 -0.21 0.00 0.00 178.00 179.89 1ocz h LEU 18 N 0.73 0.05 -1.35 2.35 7.12 -1.77 0.27 115.31 122.71 1ocz h LEU 18 Ca 0.12 -0.34 -0.06 0.00 0.13 0.00 0.00 57.88 57.72 1ocz h LEU 18 Cb 0.64 -0.01 -0.01 0.00 -0.53 0.00 0.00 40.66 40.74 1ocz h LEU 18 CO 0.04 0.38 -0.20 0.71 -0.13 0.00 0.00 178.44 179.25 1ocz h THR 19 N -0.28 1.20 -0.17 1.05 1.35 -1.34 0.26 112.91 114.98 1ocz h THR 19 Ca 0.01 -0.92 -0.18 0.00 -0.55 0.00 0.00 66.41 64.77 1ocz h THR 19 Cb 0.36 1.34 -0.00 0.00 -1.73 0.00 0.00 68.15 68.12 1ocz h THR 19 CO 0.00 0.28 -0.62 1.23 -0.25 0.00 0.00 175.52 176.16 1ocz h GLY 20 N 0.83 0.66 0.76 5.82 0.00 -0.51 0.20 103.07 110.82 1ocz h GLY 20 Ca 0.03 -0.82 -0.03 0.00 0.00 0.00 0.00 47.33 46.51 1ocz h GLY 20 CO 0.03 0.74 -0.03 0.00 0.00 0.00 0.00 176.54 177.28 1ocz h ALA 21 N 0.87 0.20 -0.50 3.60 0.00 0.16 -2.34 119.26 121.25 1ocz h ALA 21 Ca -0.01 -0.22 0.02 0.00 0.00 0.00 0.00 54.91 54.70 1ocz h ALA 21 Cb 1.19 -0.05 -0.03 0.00 0.00 0.00 0.00 17.79 18.91 1ocz h ALA 21 CO 0.12 -0.07 0.33 -0.07 0.00 0.00 0.00 179.25 179.56 1ocz h LEU 22 N -0.03 0.50 -1.03 0.00 4.07 -0.39 -1.21 115.31 117.23 1ocz h LEU 22 Ca 0.04 -0.01 -0.05 0.00 0.08 0.00 0.00 57.88 57.93 1ocz h LEU 22 Cb 0.44 -0.12 -0.02 0.00 1.08 0.00 0.00 40.66 42.04 1ocz h LEU 22 CO 0.01 0.35 0.09 0.28 -1.08 0.00 0.00 178.44 178.10 1ocz h SER 23 N 0.59 0.74 -0.45 -0.43 0.02 -0.29 -1.14 113.55 112.59 1ocz h SER 23 Ca 0.19 -0.14 -0.10 0.00 -0.84 0.00 0.00 61.79 60.91 1ocz h SER 23 Cb 0.05 -0.19 -0.02 0.00 0.14 0.00 0.00 62.40 62.38 1ocz h SER 23 CO -0.05 0.75 -0.08 0.00 -1.14 0.00 0.00 176.83 176.32 1ocz h ALA 24 N 1.34 0.92 0.72 3.77 0.00 -0.69 -1.36 119.26 123.97 1ocz h ALA 24 Ca 0.16 -0.32 -0.04 0.00 0.00 0.00 0.00 54.91 54.72 1ocz h ALA 24 Cb 0.33 -0.19 0.01 0.00 0.00 0.00 0.00 17.79 17.93 1ocz h ALA 24 CO 0.00 0.63 -0.35 1.25 0.00 0.00 0.00 179.25 180.79 1ocz h LEU 25 N 0.81 -0.82 -0.56 0.00 5.85 -1.11 -0.23 115.31 119.25 1ocz h LEU 25 Ca 0.14 0.00 0.10 0.00 0.84 0.00 0.00 57.88 58.96 1ocz h LEU 25 Cb 0.59 0.21 -0.11 0.00 0.37 0.00 0.00 40.66 41.72 1ocz h LEU 25 CO 0.04 -0.49 -0.35 -0.07 -0.34 0.00 0.00 178.44 177.22 1ocz h LEU 26 N -1.13 -1.20 -0.54 2.25 4.07 -1.19 0.10 115.31 117.67 1ocz h LEU 26 Ca -0.10 0.22 -0.05 0.00 0.08 0.00 0.00 57.88 58.04 1ocz h LEU 26 Cb 0.77 0.58 -0.02 0.00 1.08 0.00 0.00 40.66 43.07 1ocz h LEU 26 CO 0.16 -0.31 0.14 0.24 -1.08 0.00 0.00 178.44 177.60 1ocz h MET 27 N -0.19 0.86 -0.14 1.13 2.86 -1.24 0.51 114.93 118.72 1ocz h MET 27 Ca 0.21 -0.20 -0.06 0.00 -2.06 0.00 0.00 59.70 57.60 1ocz h MET 27 Cb 0.55 -0.12 -0.00 0.00 0.06 0.00 0.00 31.60 32.09 1ocz h MET 27 CO -0.66 0.80 -0.14 1.79 1.06 0.00 0.00 176.91 179.76 1ocz h THR 28 N 0.76 1.35 0.00 2.22 1.35 -0.30 0.12 112.91 118.41 1ocz h THR 28 Ca 0.17 -1.30 -0.05 0.00 -0.55 0.00 0.00 66.41 64.68 1ocz h THR 28 Cb 0.32 1.88 -0.01 0.00 -1.73 0.00 0.00 68.15 68.61 1ocz h THR 28 CO -0.00 0.38 -0.26 0.77 -0.25 0.00 0.00 175.52 176.16 1ocz h SER 29 N -0.03 0.00 -0.44 5.36 4.64 -0.86 -2.47 113.55 119.76 1ocz h SER 29 Ca 0.02 0.00 -0.11 0.00 -0.47 0.00 0.00 61.79 61.23 1ocz h SER 29 Cb 0.67 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.74 1ocz h SER 29 CO 0.03 0.26 -0.15 1.23 -0.87 0.00 0.00 176.83 177.34 1ocz h GLY 30 N 2.41 1.00 2.00 -0.77 0.00 0.32 -2.18 103.07 105.85 1ocz h GLY 30 Ca -0.00 -0.81 -0.09 0.00 0.00 0.00 0.00 47.33 46.43 1ocz h GLY 30 CO 0.03 0.74 -0.41 1.41 0.00 0.00 0.00 176.54 178.32 1ocz h LEU 31 N 0.82 0.00 -0.24 3.11 3.38 -0.49 -2.89 115.31 119.00 1ocz h LEU 31 Ca 0.12 0.00 -0.13 0.00 0.09 0.00 0.00 57.88 57.96 1ocz h LEU 31 Cb 0.69 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.44 1ocz h LEU 31 CO 0.05 0.41 -0.36 0.74 0.09 0.00 0.00 178.44 179.37 1ocz h THR 32 N 0.00 1.31 -0.49 0.22 2.02 -0.97 0.01 112.91 115.01 1ocz h THR 32 Ca -0.00 -1.56 -0.00 0.00 0.77 0.00 0.00 66.41 65.61 1ocz h THR 32 Cb 0.83 1.74 -0.02 0.00 -1.74 0.00 0.00 68.15 68.96 1ocz h THR 32 CO 0.05 0.49 0.29 0.24 0.37 0.00 0.00 175.52 176.97 1ocz h MET 33 N 0.37 0.66 0.52 6.66 2.86 -1.33 -1.16 114.93 123.52 1ocz h MET 33 Ca 0.02 -0.06 -0.02 0.00 -2.06 0.00 0.00 59.70 57.58 1ocz h MET 33 Cb 0.95 -0.14 -0.01 0.00 0.06 0.00 0.00 31.60 32.46 1ocz h MET 33 CO 0.08 0.48 -0.35 2.35 1.06 0.00 0.00 176.91 180.54 1ocz h TRP 34 N 0.65 -0.92 -0.19 -0.22 7.01 -1.24 0.32 115.95 121.35 1ocz h TRP 34 Ca 0.17 -0.01 0.05 0.00 2.11 0.00 0.00 58.89 61.22 1ocz h TRP 34 Cb -0.01 0.33 -0.01 0.00 -2.10 0.00 0.00 29.16 27.38 1ocz h TRP 34 CO -0.03 -0.52 0.18 0.74 -2.79 0.00 0.00 178.44 176.02 1ocz h PHE 35 N -0.84 0.00 0.00 2.65 0.04 -0.86 -3.27 116.94 114.67 1ocz h PHE 35 Ca -0.06 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.71 1ocz h PHE 35 Cb 0.69 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.84 1ocz h PHE 35 CO -0.12 0.00 0.00 0.72 -0.60 0.00 0.00 178.31 178.31 1ocz n HIS 36 N -3.99 0.00 -1.02 -0.55 8.25 -0.45 -4.77 115.22 112.69 1ocz n HIS 36 Ca 0.02 0.00 -0.13 0.00 -0.26 0.00 0.00 57.72 57.35 1ocz n HIS 36 Cb 0.31 0.00 -0.14 0.00 1.12 0.00 0.00 29.99 31.28 1ocz n HIS 36 CO 0.00 0.00 0.00 1.19 0.64 0.00 0.00 176.34 178.17 1ocz n PHE 37 N -1.76 0.23 -0.14 4.41 3.01 0.10 -4.87 117.46 118.45 1ocz n PHE 37 Ca 0.00 -1.52 0.00 0.00 1.01 0.00 0.00 57.45 56.94 1ocz n PHE 37 Cb 0.00 -1.47 0.00 0.00 -0.01 0.00 0.00 39.48 38.00 1ocz n PHE 37 CO 0.00 0.00 0.00 -1.71 1.01 0.00 0.00 176.76 176.06 1ocz n ASN 38 N 2.17 0.00 -3.62 4.37 4.05 -0.63 -4.70 115.26 116.89 1ocz n ASN 38 Ca 0.40 0.00 -0.13 0.00 0.45 0.00 0.00 54.58 55.30 1ocz n ASN 38 Cb 0.83 0.00 -0.07 0.00 1.23 0.00 0.00 39.78 41.77 1ocz n ASN 38 CO 0.00 0.00 0.00 -0.55 -3.05 0.00 0.00 177.26 173.66 1ocz s SER 39 N 0.00 -0.67 0.00 1.20 0.15 -1.22 -4.93 113.70 108.22 1ocz s SER 39 Ca 0.00 1.25 0.11 0.00 0.70 0.00 0.00 55.95 58.01 1ocz s SER 39 Cb 0.00 1.25 0.27 0.00 -1.71 0.00 0.00 66.02 65.82 1ocz s SER 39 CO 0.00 -0.26 1.18 0.23 1.20 0.00 0.00 173.24 175.59 1ocz n MET 40 N 2.40 2.43 0.19 5.44 2.81 -1.26 -2.31 117.12 126.82 1ocz n MET 40 Ca -0.14 -1.89 -0.15 0.00 -1.81 0.00 0.00 57.70 53.72 1ocz n MET 40 Cb 0.55 -1.26 -0.08 0.00 -0.71 0.00 0.00 33.22 31.73 1ocz n MET 40 CO 0.00 0.00 0.00 1.79 1.51 0.00 0.00 175.97 179.27 1ocz h THR 41 N 2.07 0.67 -0.30 2.03 1.35 -1.97 -1.85 112.91 114.90 1ocz h THR 41 Ca 0.00 0.00 0.05 0.00 -0.55 0.00 0.00 66.41 65.91 1ocz h THR 41 Cb 0.68 0.67 -0.05 0.00 -1.73 0.00 0.00 68.15 67.72 1ocz h THR 41 CO 0.00 0.00 -0.00 0.25 -0.25 0.00 0.00 175.52 175.52 1ocz h LEU 42 N -0.43 -0.12 -1.40 3.87 5.85 -1.88 -1.00 115.31 120.21 1ocz h LEU 42 Ca -0.04 0.07 0.10 0.00 0.84 0.00 0.00 57.88 58.86 1ocz h LEU 42 Cb 0.34 0.12 -0.05 0.00 0.37 0.00 0.00 40.66 41.44 1ocz h LEU 42 CO 0.05 -0.03 0.50 0.25 -0.34 0.00 0.00 178.44 178.88 1ocz h LEU 43 N 0.09 0.60 -0.33 2.25 5.85 -1.70 0.21 115.31 122.28 1ocz h LEU 43 Ca 0.14 0.02 -0.06 0.00 0.84 0.00 0.00 57.88 58.82 1ocz h LEU 43 Cb 0.19 -0.11 -0.01 0.00 0.37 0.00 0.00 40.66 41.10 1ocz h LEU 43 CO -0.24 0.35 -0.02 0.24 -0.34 0.00 0.00 178.44 178.42 1ocz h MET 44 N 0.66 0.60 -0.73 1.25 2.86 -0.35 -0.75 114.93 118.48 1ocz h MET 44 Ca 0.36 -0.20 -0.04 0.00 -2.06 0.00 0.00 59.70 57.75 1ocz h MET 44 Cb 0.50 -0.05 -0.03 0.00 0.06 0.00 0.00 31.60 32.08 1ocz h MET 44 CO -0.13 0.75 0.30 0.82 1.06 0.00 0.00 176.91 179.70 1ocz h ILE 45 N 0.40 1.25 0.40 -1.22 2.04 -0.13 -2.21 117.51 118.04 1ocz h ILE 45 Ca 0.09 -0.78 -0.02 0.00 1.00 0.00 0.00 64.86 65.15 1ocz h ILE 45 Cb 0.49 0.40 0.00 0.00 -0.74 0.00 0.00 36.82 36.97 1ocz h ILE 45 CO 0.02 0.31 -0.19 1.23 0.00 0.00 0.00 178.15 179.53 1ocz h GLY 46 N 1.04 -0.55 0.95 5.37 0.00 -0.47 -1.06 103.07 108.34 1ocz h GLY 46 Ca 0.24 0.21 0.12 0.00 0.00 0.00 0.00 47.33 47.90 1ocz h GLY 46 CO -0.02 -0.20 0.42 1.41 0.00 0.00 0.00 176.54 178.15 1ocz h LEU 47 N -0.64 0.32 0.41 3.11 3.38 -1.08 -0.45 115.31 120.36 1ocz h LEU 47 Ca -0.05 0.01 -0.02 0.00 0.09 0.00 0.00 57.88 57.91 1ocz h LEU 47 Cb 0.47 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 41.17 1ocz h LEU 47 CO 0.09 0.18 -0.20 0.74 0.09 0.00 0.00 178.44 179.34 1ocz h THR 48 N 0.35 0.00 -0.97 0.22 2.02 -1.05 -1.63 112.91 111.85 1ocz h THR 48 Ca 0.29 -0.36 0.22 0.00 0.77 0.00 0.00 66.41 67.34 1ocz h THR 48 Cb 0.68 0.00 -0.08 0.00 -1.74 0.00 0.00 68.15 67.01 1ocz h THR 48 CO -0.08 0.00 0.63 0.71 0.37 0.00 0.00 175.52 177.15 1ocz h THR 49 N -0.92 0.63 0.42 3.16 1.35 -0.98 0.05 112.91 116.62 1ocz h THR 49 Ca -0.06 -0.16 -0.02 0.00 -0.55 0.00 0.00 66.41 65.62 1ocz h THR 49 Cb 0.43 0.13 0.00 0.00 -1.73 0.00 0.00 68.15 66.98 1ocz h THR 49 CO 0.09 0.08 -0.20 -1.13 -0.25 0.00 0.00 175.52 174.12 1ocz h ASN 50 N 0.46 -0.48 -0.89 5.36 -1.24 -1.04 0.19 115.58 117.95 1ocz h ASN 50 Ca 0.53 -0.03 0.07 0.00 0.71 0.00 0.00 56.30 57.58 1ocz h ASN 50 Cb 1.25 0.12 -0.07 0.00 0.73 0.00 0.00 38.32 40.36 1ocz h ASN 50 CO -0.25 -0.27 0.55 0.24 -1.29 0.00 0.00 177.43 176.42 1ocz h MET 51 N -0.65 0.96 -0.17 6.67 2.86 -0.15 -0.61 114.93 123.83 1ocz h MET 51 Ca -0.06 -0.06 0.01 0.00 -2.06 0.00 0.00 59.70 57.53 1ocz h MET 51 Cb 0.48 -0.22 -0.01 0.00 0.06 0.00 0.00 31.60 31.91 1ocz h MET 51 CO 0.09 0.63 0.09 -0.07 1.06 0.00 0.00 176.91 178.72 1ocz h LEU 52 N 0.99 0.14 0.90 1.22 3.38 -0.71 -0.35 115.31 120.88 1ocz h LEU 52 Ca 0.40 0.00 -0.04 0.00 0.09 0.00 0.00 57.88 58.33 1ocz h LEU 52 Cb 0.22 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 40.94 1ocz h LEU 52 CO -0.19 0.11 -0.49 0.74 0.09 0.00 0.00 178.44 178.70 1ocz h THR 53 N 0.19 0.00 -0.97 0.22 2.02 -0.09 -1.93 112.91 112.35 1ocz h THR 53 Ca 0.06 0.00 0.15 0.00 0.77 0.00 0.00 66.41 67.39 1ocz h THR 53 Cb 0.00 0.00 -0.09 0.00 -1.74 0.00 0.00 68.15 66.32 1ocz h THR 53 CO -0.04 0.00 0.59 0.24 0.37 0.00 0.00 175.52 176.68 1ocz h MET 54 N -1.28 0.82 -0.27 6.66 2.86 -1.11 0.31 114.93 122.93 1ocz h MET 54 Ca -0.12 -0.05 0.00 0.00 -2.06 0.00 0.00 59.70 57.47 1ocz h MET 54 Cb 1.00 -0.19 -0.01 0.00 0.06 0.00 0.00 31.60 32.46 1ocz h MET 54 CO 0.17 0.54 0.17 -0.92 1.06 0.00 0.00 176.91 177.93 1ocz h TYR 55 N 0.85 0.34 -0.08 -0.22 3.20 -0.88 -2.11 116.97 118.06 1ocz h TYR 55 Ca 0.52 0.00 -0.19 0.00 3.14 0.00 0.00 58.73 62.21 1ocz h TYR 55 Cb 0.65 -0.11 -0.00 0.00 1.54 0.00 0.00 36.73 38.81 1ocz h TYR 55 CO -0.02 0.23 -0.73 1.96 -1.64 0.00 0.00 178.16 177.96 1ocz h GLN 56 N 0.35 0.42 0.03 1.82 4.20 -0.43 -1.51 115.11 119.99 1ocz h GLN 56 Ca 0.10 -0.34 -0.00 0.00 0.06 0.00 0.00 58.65 58.46 1ocz h GLN 56 Cb -0.02 0.07 0.00 0.00 0.30 0.00 0.00 27.48 27.83 1ocz h GLN 56 CO -0.02 0.98 -0.02 2.35 -0.67 0.00 0.00 178.83 181.45 1ocz h TRP 57 N 0.28 -0.04 -0.13 2.96 2.91 -0.31 -1.37 115.95 120.26 1ocz h TRP 57 Ca -0.03 -0.00 -0.08 0.00 1.13 0.00 0.00 58.89 59.90 1ocz h TRP 57 Cb 1.31 0.01 -0.01 0.00 -0.51 0.00 0.00 29.16 29.96 1ocz h TRP 57 CO 0.05 0.19 -0.30 -1.49 -1.03 0.00 0.00 178.44 175.86 1ocz h TRP 58 N -0.28 0.27 -0.23 2.65 6.55 -1.43 -1.31 115.95 122.17 1ocz h TRP 58 Ca -0.00 -0.05 0.05 0.00 0.95 0.00 0.00 58.89 59.83 1ocz h TRP 58 Cb 0.26 -0.07 -0.05 0.00 -0.86 0.00 0.00 29.16 28.44 1ocz h TRP 58 CO 0.00 0.52 -0.08 -0.09 -1.05 0.00 0.00 178.44 177.75 1ocz h ARG 59 N 0.21 -0.03 -0.24 0.49 2.43 -0.98 0.84 114.38 117.09 1ocz h ARG 59 Ca 0.03 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.20 1ocz h ARG 59 Cb 0.64 0.01 -0.01 0.00 -0.42 0.00 0.00 29.97 30.19 1ocz h ARG 59 CO 0.05 -0.02 0.15 -0.44 -1.51 0.00 0.00 179.97 178.20 1ocz h ASP 60 N -0.03 0.29 -0.90 -3.80 5.19 -0.91 0.08 116.42 116.34 1ocz h ASP 60 Ca 0.11 -0.03 0.19 0.00 -0.62 0.00 0.00 57.03 56.68 1ocz h ASP 60 Cb 0.21 -0.07 -0.07 0.00 0.18 0.00 0.00 39.33 39.57 1ocz h ASP 60 CO -0.25 0.23 0.59 0.58 -3.12 0.00 0.00 179.24 177.26 1ocz h VAL 61 N 0.32 0.72 0.01 -1.35 2.07 0.01 0.19 116.25 118.21 1ocz h VAL 61 Ca 0.09 -0.17 -0.05 0.00 0.82 0.00 0.00 66.70 67.39 1ocz h VAL 61 Cb -0.01 0.19 0.00 0.00 -1.52 0.00 0.00 31.29 29.95 1ocz h VAL 61 CO -0.02 0.09 -0.21 0.40 0.02 0.00 0.00 177.57 177.85 1ocz h ILE 62 N 0.49 1.59 -0.52 4.57 2.04 -0.30 -2.65 117.51 122.73 1ocz h ILE 62 Ca 0.47 -2.03 0.10 0.00 1.00 0.00 0.00 64.86 64.39 1ocz h ILE 62 Cb 1.04 2.91 -0.11 0.00 -0.74 0.00 0.00 36.82 39.92 1ocz h ILE 62 CO -0.19 0.55 -0.32 0.03 0.00 0.00 0.00 178.15 178.21 1ocz h ARG 63 N -0.61 -0.18 -0.24 2.37 3.08 0.77 0.57 114.38 120.15 1ocz h ARG 63 Ca -0.03 0.01 -0.01 0.00 0.07 0.00 0.00 59.98 60.02 1ocz h ARG 63 Cb 1.02 0.04 -0.01 0.00 0.08 0.00 0.00 29.97 31.09 1ocz h ARG 63 CO 0.04 -0.12 0.10 0.93 -1.07 0.00 0.00 179.97 179.85 1ocz h GLU 64 N -0.19 0.32 0.00 0.04 5.08 -0.80 0.67 114.58 119.70 1ocz h GLU 64 Ca 0.21 -0.03 0.00 0.00 -1.00 0.00 0.00 59.36 58.54 1ocz h GLU 64 Cb 0.54 -0.07 0.00 0.00 0.50 0.00 0.00 28.75 29.72 1ocz h GLU 64 CO -0.62 0.26 -0.26 -1.13 -1.00 0.00 0.00 179.01 176.26 1ocz n SER 65 N -4.45 0.88 -0.22 1.42 3.41 0.46 -1.44 113.62 113.67 1ocz n SER 65 Ca 0.00 0.42 -0.09 0.00 -0.26 0.00 0.00 58.87 58.95 1ocz n SER 65 Cb 0.12 -0.68 0.03 0.00 -0.26 0.00 0.00 64.21 63.42 1ocz n SER 65 CO 0.00 0.00 0.00 0.74 -0.16 0.00 0.00 175.04 175.62 1ocz h THR 66 N -0.48 1.27 0.00 6.66 2.02 -0.14 -2.95 112.91 119.28 1ocz h THR 66 Ca 0.00 -1.12 -0.18 0.00 0.77 0.00 0.00 66.41 65.88 1ocz h THR 66 Cb 0.26 0.75 -0.03 0.00 -1.74 0.00 0.00 68.15 67.39 1ocz h THR 66 CO 0.00 0.41 -1.27 0.49 0.37 0.00 0.00 175.52 175.52 1ocz n PHE 67 N -4.20 0.64 0.81 3.16 3.72 -0.89 -4.56 117.46 116.13 1ocz n PHE 67 Ca 0.03 0.28 0.11 0.00 -0.05 0.00 0.00 57.45 57.82 1ocz n PHE 67 Cb 0.33 -0.90 0.48 0.00 -0.94 0.00 0.00 39.48 38.45 1ocz n PHE 67 CO 0.00 0.00 0.00 1.04 -0.05 0.00 0.00 176.76 177.75 1ocz n GLN 68 N -4.45 0.06 -1.97 -1.08 6.02 0.18 -4.94 117.38 111.19 1ocz n GLN 68 Ca -0.27 0.12 -0.17 0.00 -0.01 0.00 0.00 57.00 56.66 1ocz n GLN 68 Cb 0.58 -1.50 -0.04 0.00 1.02 0.00 0.00 30.24 30.30 1ocz n GLN 68 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1ocz n GLY 69 N 0.71 0.55 0.03 1.08 0.00 -1.11 -4.94 105.19 101.51 1ocz n GLY 69 Ca 0.06 -0.17 0.12 0.00 0.00 0.00 0.00 46.02 46.03 1ocz n GLY 69 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1ocz n HIS 70 N -3.35 0.21 -2.68 1.61 8.25 -0.52 -4.59 115.22 114.15 1ocz n HIS 70 Ca -0.19 0.07 -0.43 0.00 -0.26 0.00 0.00 57.72 56.90 1ocz n HIS 70 Cb 0.62 -0.61 0.00 0.00 1.12 0.00 0.00 29.99 31.12 1ocz n HIS 70 CO 0.00 0.00 0.00 0.72 0.64 0.00 0.00 176.34 177.70 1ocz n HIS 71 N -1.68 3.90 -1.02 4.41 8.25 -1.26 -4.72 115.22 123.11 1ocz n HIS 71 Ca 0.06 -3.08 -0.30 0.00 -0.26 0.00 0.00 57.72 54.14 1ocz n HIS 71 Cb 0.32 -2.01 0.23 0.00 1.12 0.00 0.00 29.99 29.65 1ocz n HIS 71 CO 0.00 0.00 0.00 0.95 0.64 0.00 0.00 176.34 177.93 1ocz s THR 72 N 0.68 1.65 0.11 1.59 -4.23 -1.26 -4.65 115.64 109.53 1ocz s THR 72 Ca 0.40 0.00 -0.26 0.00 -1.18 0.00 0.00 61.69 60.65 1ocz s THR 72 Cb 0.03 -2.44 -0.08 0.00 1.34 0.00 0.00 72.50 71.35 1ocz s THR 72 CO 0.01 0.00 1.64 -0.65 -0.54 0.00 0.00 174.62 175.08 1ocz h PRO 73 N -2.55 -0.41 -0.86 3.99 0.11 -1.94 -0.51 132.00 129.82 1ocz h PRO 73 Ca -0.47 0.03 0.16 0.00 0.11 0.00 0.00 66.00 65.83 1ocz h PRO 73 Cb 1.31 0.09 -0.06 0.00 0.11 0.00 0.00 31.00 32.44 1ocz h PRO 73 CO 0.38 -0.27 0.56 0.00 -0.21 0.00 0.00 178.00 178.46 1ocz h ALA 74 N 0.35 1.99 -0.36 -0.75 0.00 -1.92 -1.39 119.26 117.19 1ocz h ALA 74 Ca 0.04 0.01 -0.16 0.00 0.00 0.00 0.00 54.91 54.80 1ocz h ALA 74 Cb 0.47 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 18.17 1ocz h ALA 74 CO -0.16 -0.24 -0.39 0.28 0.00 0.00 0.00 179.25 178.75 1ocz h VAL 75 N 0.55 1.28 -0.10 0.00 2.07 -1.36 -3.25 116.25 115.43 1ocz h VAL 75 Ca 0.43 -1.57 -0.18 0.00 0.82 0.00 0.00 66.70 66.21 1ocz h VAL 75 Cb 0.86 1.45 -0.00 0.00 -1.52 0.00 0.00 31.29 32.08 1ocz h VAL 75 CO -0.18 0.52 -0.70 1.56 0.02 0.00 0.00 177.57 178.79 1ocz h GLN 76 N 0.70 0.45 -0.69 1.57 4.20 -0.26 -3.05 115.11 118.03 1ocz h GLN 76 Ca 0.05 -0.35 0.10 0.00 0.06 0.00 0.00 58.65 58.52 1ocz h GLN 76 Cb 0.99 0.07 -0.04 0.00 0.30 0.00 0.00 27.48 28.79 1ocz h GLN 76 CO 0.10 0.98 0.46 -0.22 -0.67 0.00 0.00 178.83 179.47 1ocz h LYS 77 N 0.31 0.52 0.00 1.46 3.64 -1.35 -0.49 116.57 120.66 1ocz h LYS 77 Ca -0.02 -0.03 -0.10 0.00 -1.27 0.00 0.00 60.65 59.22 1ocz h LYS 77 Cb 1.27 -0.12 -0.01 0.00 -0.41 0.00 0.00 32.23 32.95 1ocz h LYS 77 CO 0.12 0.34 -0.50 0.78 -2.27 0.00 0.00 179.45 177.93 1ocz h GLY 78 N 0.53 0.00 2.00 5.01 0.00 -1.57 -2.83 103.07 106.20 1ocz h GLY 78 Ca 0.32 0.00 -0.07 0.00 0.00 0.00 0.00 47.33 47.58 1ocz h GLY 78 CO -0.11 0.00 -0.35 1.41 0.00 0.00 0.00 176.54 177.49 1ocz h LEU 79 N 0.00 0.00 0.34 3.11 3.38 -1.02 -2.09 115.31 119.03 1ocz h LEU 79 Ca -0.00 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.95 1ocz h LEU 79 Cb 1.16 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.91 1ocz h LEU 79 CO 0.06 0.35 -0.16 0.03 0.09 0.00 0.00 178.44 178.81 1ocz h ARG 80 N 0.00 -0.44 -0.41 1.13 3.08 -1.14 -1.76 114.38 114.84 1ocz h ARG 80 Ca -0.00 0.03 0.09 0.00 0.07 0.00 0.00 59.98 60.16 1ocz h ARG 80 Cb 1.08 0.10 -0.09 0.00 0.08 0.00 0.00 29.97 31.14 1ocz h ARG 80 CO 0.05 -0.11 -0.20 1.88 -1.07 0.00 0.00 179.97 180.51 1ocz h TYR 81 N -0.89 -0.51 -0.53 3.04 0.05 -1.51 0.18 116.97 116.80 1ocz h TYR 81 Ca -0.05 0.05 0.08 0.00 0.05 0.00 0.00 58.73 58.86 1ocz h TYR 81 Cb 0.53 0.29 -0.07 0.00 1.01 0.00 0.00 36.73 38.49 1ocz h TYR 81 CO 0.03 -0.28 0.17 0.78 -1.05 0.00 0.00 178.16 177.80 1ocz h GLY 82 N -0.12 0.70 0.75 3.88 0.00 -1.37 0.22 103.07 107.12 1ocz h GLY 82 Ca 0.20 -0.08 -0.02 0.00 0.00 0.00 0.00 47.33 47.43 1ocz h GLY 82 CO -0.49 -0.02 -0.01 1.98 0.00 0.00 0.00 176.54 177.99 1ocz h MET 83 N 0.33 0.22 -0.16 4.80 1.85 -0.38 0.27 114.93 121.86 1ocz h MET 83 Ca 0.26 -0.08 0.05 0.00 -0.61 0.00 0.00 59.70 59.32 1ocz h MET 83 Cb 0.31 -0.02 -0.06 0.00 0.43 0.00 0.00 31.60 32.27 1ocz h MET 83 CO -0.29 0.50 -0.26 0.82 -0.40 0.00 0.00 176.91 177.28 1ocz h ILE 84 N -0.07 0.37 -0.31 1.77 1.08 -0.23 0.83 117.51 120.95 1ocz h ILE 84 Ca 0.03 0.00 0.04 0.00 -0.39 0.00 0.00 64.86 64.54 1ocz h ILE 84 Cb 0.40 0.37 -0.04 0.00 -3.07 0.00 0.00 36.82 34.49 1ocz h ILE 84 CO 0.01 0.00 0.09 -0.07 -0.69 0.00 0.00 178.15 177.49 1ocz h LEU 85 N -0.31 0.07 -1.09 1.44 4.07 -0.51 -2.29 115.31 116.68 1ocz h LEU 85 Ca 0.11 0.04 0.06 0.00 0.08 0.00 0.00 57.88 58.17 1ocz h LEU 85 Cb 0.48 0.04 -0.06 0.00 1.08 0.00 0.00 40.66 42.20 1ocz h LEU 85 CO -0.34 0.08 0.61 0.15 -1.08 0.00 0.00 178.44 177.85 1ocz h PHE 86 N 0.21 1.11 -0.62 1.13 3.57 0.32 -1.84 116.94 120.81 1ocz h PHE 86 Ca 0.14 0.03 -0.09 0.00 3.53 0.00 0.00 57.97 61.58 1ocz h PHE 86 Cb 0.13 -0.37 -0.02 0.00 2.79 0.00 0.00 35.95 38.48 1ocz h PHE 86 CO -0.15 0.59 0.03 0.82 -2.23 0.00 0.00 178.31 177.37 1ocz h ILE 87 N 1.10 1.26 -0.54 1.41 2.04 -0.38 -2.96 117.51 119.45 1ocz h ILE 87 Ca 0.40 -1.11 0.04 0.00 1.00 0.00 0.00 64.86 65.19 1ocz h ILE 87 Cb 0.16 0.75 -0.04 0.00 -0.74 0.00 0.00 36.82 36.94 1ocz h ILE 87 CO -0.15 0.41 0.29 0.40 0.00 0.00 0.00 178.15 179.09 1ocz h ILE 88 N 0.99 0.98 -0.02 -0.67 2.04 -0.82 0.43 117.51 120.43 1ocz h ILE 88 Ca 0.18 -0.19 -0.01 0.00 1.00 0.00 0.00 64.86 65.84 1ocz h ILE 88 Cb 0.52 0.37 -0.00 0.00 -0.74 0.00 0.00 36.82 36.97 1ocz h ILE 88 CO 0.02 0.10 -0.04 0.77 0.00 0.00 0.00 178.15 179.00 1ocz h SER 89 N 0.55 0.02 0.12 1.72 4.64 -1.30 -0.31 113.55 118.99 1ocz h SER 89 Ca 0.23 -0.00 -0.22 0.00 -0.47 0.00 0.00 61.79 61.34 1ocz h SER 89 Cb 0.12 -0.01 0.00 0.00 -0.31 0.00 0.00 62.40 62.21 1ocz h SER 89 CO -0.15 0.07 -0.83 -0.33 -0.87 0.00 0.00 176.83 174.72 1ocz h GLU 90 N 0.02 0.56 -0.12 4.77 4.39 -0.97 -2.46 114.58 120.78 1ocz h GLU 90 Ca 0.01 -0.51 -0.06 0.00 0.34 0.00 0.00 59.36 59.14 1ocz h GLU 90 Cb 0.09 0.12 -0.01 0.00 -0.10 0.00 0.00 28.75 28.85 1ocz h GLU 90 CO 0.01 1.13 -0.19 0.28 -1.16 0.00 0.00 179.01 179.08 1ocz h VAL 91 N 0.36 1.20 0.00 3.13 2.07 0.35 -2.04 116.25 121.32 1ocz h VAL 91 Ca -0.06 -0.89 0.00 0.00 0.82 0.00 0.00 66.70 66.57 1ocz h VAL 91 Cb 1.44 1.32 0.00 0.00 -1.52 0.00 0.00 31.29 32.53 1ocz h VAL 91 CO 0.15 0.27 0.00 -0.07 0.02 0.00 0.00 177.57 177.95 1ocz h LEU 92 N 0.18 0.00 0.03 2.57 4.07 -0.90 -3.03 115.31 118.24 1ocz h LEU 92 Ca 0.03 0.00 -0.00 0.00 0.08 0.00 0.00 57.88 57.99 1ocz h LEU 92 Cb 0.44 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.18 1ocz h LEU 92 CO 0.03 0.00 -0.02 0.15 -1.08 0.00 0.00 178.44 177.52 1ocz h PHE 93 N 0.00 -0.04 0.00 1.13 3.57 -0.92 -2.89 116.94 117.79 1ocz h PHE 93 Ca 0.00 -0.00 -0.00 0.00 3.53 0.00 0.00 57.97 61.50 1ocz h PHE 93 Cb 0.98 0.01 -0.00 0.00 2.79 0.00 0.00 35.95 39.73 1ocz h PHE 93 CO 0.00 0.56 -0.01 0.74 -2.23 0.00 0.00 178.31 177.37 1ocz h PHE 94 N -0.69 0.00 -0.48 0.41 0.04 -1.47 -2.28 116.94 112.47 1ocz h PHE 94 Ca -0.00 0.00 -0.05 0.00 2.80 0.00 0.00 57.97 60.72 1ocz h PHE 94 Cb 0.62 0.00 -0.02 0.00 2.20 0.00 0.00 35.95 38.75 1ocz h PHE 94 CO 0.14 0.01 0.11 1.15 -0.60 0.00 0.00 178.31 179.12 1ocz h THR 95 N 0.00 1.21 -0.41 -1.55 2.02 -1.37 -0.88 112.91 111.92 1ocz h THR 95 Ca -0.00 -0.77 0.00 0.00 0.77 0.00 0.00 66.41 66.41 1ocz h THR 95 Cb 0.08 0.73 -0.02 0.00 -1.74 0.00 0.00 68.15 67.20 1ocz h THR 95 CO 0.00 0.28 0.27 1.23 0.37 0.00 0.00 175.52 177.68 1ocz h GLY 96 N 0.91 0.58 0.98 2.16 0.00 -1.45 0.07 103.07 106.32 1ocz h GLY 96 Ca 0.16 -0.22 -0.03 0.00 0.00 0.00 0.00 47.33 47.24 1ocz h GLY 96 CO -0.00 0.22 0.23 0.74 0.00 0.00 0.00 176.54 177.73 1ocz h PHE 97 N 0.56 0.80 -0.05 5.60 0.04 -1.49 0.12 116.94 122.53 1ocz h PHE 97 Ca 0.15 -0.05 -0.09 0.00 2.80 0.00 0.00 57.97 60.78 1ocz h PHE 97 Cb -0.06 -0.24 -0.01 0.00 2.20 0.00 0.00 35.95 37.84 1ocz h PHE 97 CO -0.05 0.65 -0.39 0.74 -0.60 0.00 0.00 178.31 178.66 1ocz h PHE 98 N 0.73 0.11 0.12 -0.55 0.04 -0.90 -1.84 116.94 114.64 1ocz h PHE 98 Ca 0.18 -0.03 -0.01 0.00 2.80 0.00 0.00 57.97 60.92 1ocz h PHE 98 Cb 0.17 -0.03 0.00 0.00 2.20 0.00 0.00 35.95 38.30 1ocz h PHE 98 CO 0.00 0.47 -0.06 2.35 -0.60 0.00 0.00 178.31 180.48 1ocz h TRP 99 N 0.08 -0.15 -0.25 -0.55 2.91 -0.08 -0.57 115.95 117.34 1ocz h TRP 99 Ca 0.01 -0.00 0.06 0.00 1.13 0.00 0.00 58.89 60.09 1ocz h TRP 99 Cb 0.73 0.05 -0.07 0.00 -0.51 0.00 0.00 29.16 29.36 1ocz h TRP 99 CO 0.00 0.17 -0.20 0.00 -1.03 0.00 0.00 178.44 177.39 1ocz h ALA 100 N 0.36 -0.04 0.06 2.65 0.00 -0.61 -0.63 119.26 121.06 1ocz h ALA 100 Ca -0.02 0.09 0.02 0.00 0.00 0.00 0.00 54.91 55.01 1ocz h ALA 100 Cb 0.38 0.43 -0.04 0.00 0.00 0.00 0.00 17.79 18.56 1ocz h ALA 100 CO 0.03 -0.61 -0.24 0.35 0.00 0.00 0.00 179.25 178.77 1ocz h PHE 101 N -0.19 -0.64 0.00 0.00 3.57 -1.15 -1.29 116.94 117.23 1ocz h PHE 101 Ca 0.14 0.02 -0.01 0.00 3.53 0.00 0.00 57.97 61.65 1ocz h PHE 101 Cb 0.40 0.28 -0.00 0.00 2.79 0.00 0.00 35.95 39.42 1ocz h PHE 101 CO -0.36 -0.34 -0.05 1.88 -2.23 0.00 0.00 178.31 177.21 1ocz h TYR 102 N -0.41 0.00 -0.08 0.41 0.05 -0.60 0.08 116.97 116.42 1ocz h TYR 102 Ca 0.05 0.00 -0.09 0.00 0.05 0.00 0.00 58.73 58.74 1ocz h TYR 102 Cb 0.46 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.21 1ocz h TYR 102 CO -0.25 0.05 -0.28 1.25 -1.05 0.00 0.00 178.16 177.87 1ocz h HIS 103 N 0.00 0.44 -0.21 4.88 2.76 -0.16 -1.75 115.15 121.11 1ocz h HIS 103 Ca -0.00 -0.18 -0.10 0.00 -2.20 0.00 0.00 60.37 57.88 1ocz h HIS 103 Cb 0.23 -0.07 -0.00 0.00 1.55 0.00 0.00 27.41 29.11 1ocz h HIS 103 CO 0.00 0.90 -0.27 0.77 -1.30 0.00 0.00 177.93 178.03 1ocz h SER 104 N -0.14 0.61 0.98 3.26 0.02 -0.64 -3.17 113.55 114.47 1ocz h SER 104 Ca -0.01 -0.50 -0.21 0.00 -0.84 0.00 0.00 61.79 60.22 1ocz h SER 104 Cb 0.91 -0.17 -0.03 0.00 0.14 0.00 0.00 62.40 63.25 1ocz h SER 104 CO 0.06 0.99 -1.01 0.77 -1.14 0.00 0.00 176.83 176.50 1ocz h SER 105 N 0.25 0.02 1.00 3.07 4.64 -1.11 -3.17 113.55 118.25 1ocz h SER 105 Ca 0.03 -0.02 -0.05 0.00 -0.47 0.00 0.00 61.79 61.27 1ocz h SER 105 Cb 0.84 -0.01 -0.01 0.00 -0.31 0.00 0.00 62.40 62.92 1ocz h SER 105 CO 0.06 1.02 -0.25 -0.07 -0.87 0.00 0.00 176.83 176.73 1ocz h LEU 106 N 0.00 0.00 -5.89 5.97 3.38 -1.42 -3.38 115.31 113.98 1ocz h LEU 106 Ca -0.02 0.00 -0.44 0.00 0.09 0.00 0.00 57.88 57.51 1ocz h LEU 106 Cb 1.78 0.00 -0.31 0.00 0.09 0.00 0.00 40.66 42.22 1ocz h LEU 106 CO 0.13 0.25 -0.81 0.00 0.09 0.00 0.00 178.44 178.10 1ocz n ALA 107 N -2.22 1.24 -2.06 1.53 0.00 -1.20 -5.09 120.51 112.71 1ocz n ALA 107 Ca 0.00 -2.40 -0.42 0.00 0.00 0.00 0.00 53.44 50.62 1ocz n ALA 107 Cb 0.46 -1.01 -0.03 0.00 0.00 0.00 0.00 19.45 18.88 1ocz n ALA 107 CO 0.00 0.00 0.00 -2.14 0.00 0.00 0.00 177.50 175.36 1ocz s PRO 108 N 0.32 4.26 0.64 0.00 0.02 -1.20 -4.77 135.00 134.27 1ocz s PRO 108 Ca 0.32 2.19 -0.15 0.00 0.02 0.00 0.00 61.00 63.38 1ocz s PRO 108 Cb 0.03 -3.37 -0.01 0.00 0.02 0.00 0.00 34.50 31.17 1ocz s PRO 108 CO -0.15 -0.58 1.11 0.95 -0.33 0.00 0.00 177.00 178.00 1ocz s THR 109 N 1.72 3.31 0.58 0.99 -4.23 -1.26 -4.47 115.64 112.28 1ocz s THR 109 Ca 0.68 0.62 0.28 0.00 -1.18 0.00 0.00 61.69 62.09 1ocz s THR 109 Cb -0.38 -3.15 0.35 0.00 1.34 0.00 0.00 72.50 70.66 1ocz s THR 109 CO 0.30 -0.36 2.14 1.55 -0.54 0.00 0.00 174.62 177.71 1ocz h PRO 110 N 0.16 0.00 0.00 3.99 0.13 -1.93 0.57 132.00 134.92 1ocz h PRO 110 Ca -0.47 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 64.66 1ocz h PRO 110 Cb 1.24 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.37 1ocz h PRO 110 CO 0.55 0.00 -0.01 0.93 -0.23 0.00 0.00 178.00 179.24 1ocz h GLU 111 N 0.00 0.00 0.00 0.86 3.07 -2.01 0.21 114.58 116.72 1ocz h GLU 111 Ca 0.07 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.93 1ocz h GLU 111 Cb 0.36 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.27 1ocz h GLU 111 CO -0.00 0.01 -0.17 -0.07 -1.40 0.00 0.00 179.01 177.38 1ocz h LEU 112 N 0.00 0.00 0.00 1.33 4.07 -1.26 -3.46 115.31 115.99 1ocz h LEU 112 Ca -0.00 -0.04 0.00 0.00 0.08 0.00 0.00 57.88 57.92 1ocz h LEU 112 Cb 0.02 0.00 0.00 0.00 1.08 0.00 0.00 40.66 41.76 1ocz h LEU 112 CO 0.00 0.02 0.00 0.61 -1.08 0.00 0.00 178.44 177.99 1ocz n GLY 113 N 1.25 1.38 2.95 0.83 0.00 0.74 -1.84 105.19 110.50 1ocz n GLY 113 Ca 0.04 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.84 1ocz n GLY 113 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ocz n GLY 114 N -0.67 -0.52 3.51 -0.02 0.00 -0.77 -4.93 105.19 101.79 1ocz n GLY 114 Ca 0.00 0.12 -0.10 0.00 0.00 0.00 0.00 46.02 46.04 1ocz n GLY 114 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ocz s TRP 116 N -3.86 0.61 0.61 0.00 -0.11 -1.26 -3.06 118.94 111.86 1ocz s TRP 116 Ca 0.08 -0.14 -0.17 0.00 1.22 0.00 0.00 56.10 57.09 1ocz s TRP 116 Cb -0.01 -0.54 -0.02 0.00 -1.50 0.00 0.00 33.47 31.39 1ocz s TRP 116 CO -0.04 -0.14 1.13 -2.14 -4.62 0.00 0.00 176.95 171.15 1ocz s PRO 117 N 0.71 2.99 0.66 5.86 0.02 -1.26 -4.97 135.00 139.02 1ocz s PRO 117 Ca -0.09 1.53 -0.17 0.00 0.02 0.00 0.00 61.00 62.30 1ocz s PRO 117 Cb -0.12 -1.96 -0.03 0.00 0.02 0.00 0.00 34.50 32.41 1ocz s PRO 117 CO -0.00 -1.12 0.85 -0.35 -0.33 0.00 0.00 177.00 176.04 1ocz n PRO 118 N -1.93 0.61 -1.80 5.54 -0.04 -1.17 -4.87 135.00 131.33 1ocz n PRO 118 Ca 0.11 0.25 -0.42 0.00 -0.04 0.00 0.00 63.50 63.41 1ocz n PRO 118 Cb 0.51 -2.08 -0.03 0.00 -0.04 0.00 0.00 33.50 31.86 1ocz n PRO 118 CO 0.00 0.00 0.00 0.95 -0.04 0.00 0.00 175.50 176.41 1ocz s THR 119 N -1.71 2.23 0.00 0.52 -4.23 -0.77 -1.84 115.64 109.84 1ocz s THR 119 Ca 0.73 0.17 0.00 0.00 -1.18 0.00 0.00 61.69 61.40 1ocz s THR 119 Cb -0.38 -3.11 0.00 0.00 1.34 0.00 0.00 72.50 70.35 1ocz s THR 119 CO 0.50 0.01 0.00 0.61 -0.54 0.00 0.00 174.62 175.21 1ocz n GLY 120 N 3.76 2.17 3.73 3.99 0.00 -1.26 -4.98 105.19 112.61 1ocz n GLY 120 Ca 0.15 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.76 1ocz n GLY 120 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1ocz s ILE 121 N -2.29 4.72 -0.48 -0.61 -1.09 -0.77 -5.02 121.20 115.67 1ocz s ILE 121 Ca 0.00 1.81 0.00 0.00 -2.23 0.00 0.00 60.65 60.23 1ocz s ILE 121 Cb 0.00 -4.20 0.13 0.00 -1.58 0.00 0.00 42.46 36.80 1ocz s ILE 121 CO 0.00 0.31 0.25 -1.00 -1.23 0.00 0.00 174.94 173.26 1ocz s HIS 122 N 0.21 3.48 0.74 3.97 3.76 -1.26 -4.88 115.29 121.31 1ocz s HIS 122 Ca 0.43 -2.82 -0.15 0.00 -0.15 0.00 0.00 55.06 52.36 1ocz s HIS 122 Cb -0.21 -3.05 0.03 0.00 1.11 0.00 0.00 32.58 30.46 1ocz s HIS 122 CO 0.25 -0.87 1.14 -0.35 -0.85 0.00 0.00 174.74 174.06 1ocz n PRO 123 N 3.85 0.55 -1.44 8.40 -0.04 -1.26 -4.77 135.00 140.29 1ocz n PRO 123 Ca 0.04 0.25 -0.29 0.00 -0.04 0.00 0.00 63.50 63.46 1ocz n PRO 123 Cb 0.38 -2.38 0.13 0.00 -0.04 0.00 0.00 33.50 31.59 1ocz n PRO 123 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 1ocz s LEU 124 N -4.37 2.13 -0.31 1.53 1.43 -1.26 -5.00 118.68 112.83 1ocz s LEU 124 Ca 0.76 1.16 -0.18 0.00 -1.03 0.00 0.00 54.13 54.83 1ocz s LEU 124 Cb -0.33 -3.55 -0.01 0.00 0.03 0.00 0.00 46.19 42.32 1ocz s LEU 124 CO 0.48 -2.50 0.53 0.21 0.23 0.00 0.00 176.35 175.30 1ocz s ASN 125 N -3.83 6.38 0.51 2.29 3.84 -1.26 -4.92 114.94 117.96 1ocz s ASN 125 Ca 0.63 0.24 0.20 0.00 0.21 0.00 0.00 52.86 54.14 1ocz s ASN 125 Cb -0.16 -2.28 1.29 0.00 -0.55 0.00 0.00 41.25 39.56 1ocz s ASN 125 CO 0.55 -0.41 2.05 1.55 -2.79 0.00 0.00 177.10 178.05 1ocz h PRO 126 N 8.27 0.06 0.00 0.43 0.13 -1.93 0.04 132.00 138.99 1ocz h PRO 126 Ca -0.28 -0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.85 1ocz h PRO 126 Cb 1.13 -0.01 0.00 0.00 0.13 0.00 0.00 31.00 32.25 1ocz h PRO 126 CO 0.75 0.04 0.00 1.28 -0.23 0.00 0.00 178.00 179.84 1ocz n LEU 127 N -4.45 0.13 0.00 1.56 4.32 -1.26 -2.41 117.00 114.88 1ocz n LEU 127 Ca 0.05 0.52 0.00 0.00 -0.02 0.00 0.00 56.01 56.56 1ocz n LEU 127 Cb 0.37 -0.50 0.00 0.00 -1.62 0.00 0.00 43.42 41.67 1ocz n LEU 127 CO 0.35 -0.21 0.00 -0.62 -1.22 0.00 0.00 177.39 175.69 1ocz n GLU 128 N -1.63 0.00 0.08 3.23 4.71 -0.00 -4.67 120.64 122.36 1ocz n GLU 128 Ca 0.04 0.00 0.01 0.00 -0.01 0.00 0.00 57.16 57.20 1ocz n GLU 128 Cb 0.24 0.00 0.33 0.00 -1.01 0.00 0.00 31.44 31.00 1ocz n GLU 128 CO 0.00 0.00 0.00 0.28 0.09 0.00 0.00 177.13 177.50 1ocz h VAL 129 N 0.00 1.21 -0.07 2.62 2.07 -1.83 -2.62 116.25 117.63 1ocz h VAL 129 Ca 0.00 -0.94 0.02 0.00 0.82 0.00 0.00 66.70 66.60 1ocz h VAL 129 Cb 0.00 1.25 -0.00 0.00 -1.52 0.00 0.00 31.29 31.02 1ocz h VAL 129 CO 0.00 0.29 0.11 -0.65 0.02 0.00 0.00 177.57 177.35 1ocz h PRO 130 N 0.29 0.00 0.22 1.57 0.11 -1.75 0.11 132.00 132.55 1ocz h PRO 130 Ca 0.05 0.00 -0.32 0.00 0.11 0.00 0.00 66.00 65.84 1ocz h PRO 130 Cb 0.46 0.00 0.03 0.00 0.11 0.00 0.00 31.00 31.60 1ocz h PRO 130 CO 0.03 0.00 -1.41 1.25 -0.21 0.00 0.00 178.00 177.65 1ocz h LEU 131 N 0.00 0.79 -0.15 2.35 6.46 -1.11 -2.57 115.31 121.09 1ocz h LEU 131 Ca 0.03 -0.83 -0.00 0.00 -0.12 0.00 0.00 57.88 56.97 1ocz h LEU 131 Cb 0.26 -0.26 -0.01 0.00 -0.73 0.00 0.00 40.66 39.93 1ocz h LEU 131 CO -0.00 1.64 0.09 0.25 -0.62 0.00 0.00 178.44 179.81 1ocz h LEU 132 N 0.15 0.18 -1.27 2.25 6.46 -0.84 -0.15 115.31 122.09 1ocz h LEU 132 Ca -0.23 -0.04 -0.04 0.00 -0.12 0.00 0.00 57.88 57.45 1ocz h LEU 132 Cb 2.11 -0.04 -0.02 0.00 -0.73 0.00 0.00 40.66 41.97 1ocz h LEU 132 CO 0.26 0.16 0.05 0.78 -0.62 0.00 0.00 178.44 179.07 1ocz h ASN 133 N 0.18 0.51 -0.12 1.25 -0.26 -1.02 0.41 115.58 116.53 1ocz h ASN 133 Ca 0.05 -0.08 -0.01 0.00 -0.56 0.00 0.00 56.30 55.71 1ocz h ASN 133 Cb 0.01 -0.13 -0.01 0.00 -1.06 0.00 0.00 38.32 37.14 1ocz h ASN 133 CO -0.01 0.54 0.05 0.74 -1.06 0.00 0.00 177.43 177.69 1ocz h THR 134 N 0.53 1.14 -0.53 2.81 2.02 -0.89 -2.21 112.91 115.79 1ocz h THR 134 Ca 0.12 -0.42 -0.06 0.00 0.77 0.00 0.00 66.41 66.81 1ocz h THR 134 Cb 0.27 1.20 -0.02 0.00 -1.74 0.00 0.00 68.15 67.86 1ocz h THR 134 CO 0.00 0.13 0.09 0.77 0.37 0.00 0.00 175.52 176.88 1ocz h SER 135 N 0.05 0.79 0.92 4.18 4.64 -0.68 -2.17 113.55 121.28 1ocz h SER 135 Ca 0.04 -0.16 -0.05 0.00 -0.47 0.00 0.00 61.79 61.16 1ocz h SER 135 Cb 0.16 -0.21 0.01 0.00 -0.31 0.00 0.00 62.40 62.05 1ocz h SER 135 CO -0.00 0.80 -0.44 0.58 -0.87 0.00 0.00 176.83 176.90 1ocz h VAL 136 N 0.80 0.06 -0.58 0.95 2.07 -0.73 -0.16 116.25 118.65 1ocz h VAL 136 Ca 0.17 -0.05 0.10 0.00 0.82 0.00 0.00 66.70 67.74 1ocz h VAL 136 Cb 0.36 0.06 -0.07 0.00 -1.52 0.00 0.00 31.29 30.11 1ocz h VAL 136 CO 0.01 0.00 0.18 -0.07 0.02 0.00 0.00 177.57 177.71 1ocz h LEU 137 N -1.28 0.13 -0.45 2.57 4.07 -1.39 -1.39 115.31 117.56 1ocz h LEU 137 Ca -0.13 0.09 0.05 0.00 0.08 0.00 0.00 57.88 57.98 1ocz h LEU 137 Cb 0.95 0.09 -0.05 0.00 1.08 0.00 0.00 40.66 42.73 1ocz h LEU 137 CO 0.21 0.08 0.17 -0.07 -1.08 0.00 0.00 178.44 177.75 1ocz h LEU 138 N 0.34 0.19 -1.04 1.67 3.38 -1.30 -1.42 115.31 117.12 1ocz h LEU 138 Ca 0.30 0.05 0.01 0.00 0.09 0.00 0.00 57.88 58.32 1ocz h LEU 138 Cb 0.39 0.02 -0.05 0.00 0.09 0.00 0.00 40.66 41.12 1ocz h LEU 138 CO -0.33 0.14 0.61 0.00 0.09 0.00 0.00 178.44 178.95 1ocz h ALA 139 N 1.29 1.29 -0.02 1.53 0.00 0.02 0.24 119.26 123.60 1ocz h ALA 139 Ca 0.21 -0.08 -0.03 0.00 0.00 0.00 0.00 54.91 55.01 1ocz h ALA 139 Cb 0.19 -0.38 -0.00 0.00 0.00 0.00 0.00 17.79 17.59 1ocz h ALA 139 CO -0.20 0.64 -0.12 0.66 0.00 0.00 0.00 179.25 180.23 1ocz h SER 140 N 1.29 0.03 -0.18 0.00 4.64 -0.55 0.24 113.55 119.02 1ocz h SER 140 Ca 0.35 -0.00 -0.07 0.00 -0.47 0.00 0.00 61.79 61.59 1ocz h SER 140 Cb -0.12 -0.01 -0.02 0.00 -0.31 0.00 0.00 62.40 61.94 1ocz h SER 140 CO -0.07 0.16 -0.10 1.23 -0.87 0.00 0.00 176.83 177.17 1ocz h GLY 141 N 0.42 0.59 1.51 -0.77 0.00 0.08 0.30 103.07 105.20 1ocz h GLY 141 Ca 0.01 -0.40 -0.29 0.00 0.00 0.00 0.00 47.33 46.65 1ocz h GLY 141 CO 0.02 0.37 -1.33 -0.39 0.00 0.00 0.00 176.54 175.21 1ocz h VAL 142 N 0.51 1.40 -0.07 4.60 -1.51 -0.70 -2.92 116.25 117.55 1ocz h VAL 142 Ca 0.10 -2.98 -0.15 0.00 -1.23 0.00 0.00 66.70 62.44 1ocz h VAL 142 Cb 0.48 2.91 -0.01 0.00 -2.13 0.00 0.00 31.29 32.54 1ocz h VAL 142 CO 0.03 0.87 -0.62 0.77 -1.23 0.00 0.00 177.57 177.38 1ocz h SER 143 N 0.08 0.31 0.41 4.19 4.64 -0.85 -1.18 113.55 121.14 1ocz h SER 143 Ca -0.17 -0.18 -0.08 0.00 -0.47 0.00 0.00 61.79 60.89 1ocz h SER 143 Cb 2.00 -0.09 -0.01 0.00 -0.31 0.00 0.00 62.40 63.99 1ocz h SER 143 CO 0.20 0.85 -0.40 -0.29 -0.87 0.00 0.00 176.83 176.31 1ocz h ILE 144 N 0.20 1.28 -0.11 0.95 2.10 -0.48 -0.89 117.51 120.56 1ocz h ILE 144 Ca -0.01 -1.39 -0.13 0.00 1.08 0.00 0.00 64.86 64.42 1ocz h ILE 144 Cb 1.14 1.75 -0.01 0.00 -1.09 0.00 0.00 36.82 38.61 1ocz h ILE 144 CO 0.10 0.40 -0.49 0.74 -1.08 0.00 0.00 178.15 177.81 1ocz h THR 145 N 0.00 1.34 -0.19 2.19 2.02 -1.12 -1.97 112.91 115.18 1ocz h THR 145 Ca -0.00 -1.72 -0.14 0.00 0.77 0.00 0.00 66.41 65.32 1ocz h THR 145 Cb 0.72 1.80 -0.01 0.00 -1.74 0.00 0.00 68.15 68.92 1ocz h THR 145 CO 0.05 0.51 -0.47 -0.25 0.37 0.00 0.00 175.52 175.73 1ocz h TRP 146 N 0.23 0.61 -0.51 3.16 7.01 -0.55 -2.78 115.95 123.10 1ocz h TRP 146 Ca 0.01 -0.19 -0.04 0.00 2.11 0.00 0.00 58.89 60.78 1ocz h TRP 146 Cb 0.95 -0.12 -0.02 0.00 -2.10 0.00 0.00 29.16 27.87 1ocz h TRP 146 CO 0.02 0.88 0.16 0.00 -2.79 0.00 0.00 178.44 176.71 1ocz h ALA 147 N 1.09 0.67 0.00 2.65 0.00 -0.76 -1.58 119.26 121.32 1ocz h ALA 147 Ca 0.02 -0.19 -0.07 0.00 0.00 0.00 0.00 54.91 54.68 1ocz h ALA 147 Cb 0.98 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 18.56 1ocz h ALA 147 CO 0.09 0.33 -0.33 1.25 0.00 0.00 0.00 179.25 180.58 1ocz h HIS 148 N 0.70 0.00 0.07 0.00 -0.00 -1.30 -2.11 115.15 112.50 1ocz h HIS 148 Ca 0.16 0.00 -0.26 0.00 -0.00 0.00 0.00 60.37 60.28 1ocz h HIS 148 Cb 0.28 0.00 0.01 0.00 -0.00 0.00 0.00 27.41 27.70 1ocz h HIS 148 CO 0.02 0.33 -1.10 0.45 -0.00 0.00 0.00 177.93 177.62 1ocz h HIS 149 N 0.00 0.69 -0.57 5.26 -0.00 -1.17 -2.83 115.15 116.53 1ocz h HIS 149 Ca -0.00 -0.42 -0.09 0.00 -0.00 0.00 0.00 60.37 59.86 1ocz h HIS 149 Cb 0.79 -0.06 -0.02 0.00 -0.00 0.00 0.00 27.41 28.12 1ocz h HIS 149 CO 0.00 1.27 -0.00 0.77 -0.00 0.00 0.00 177.93 179.97 1ocz h SER 150 N 0.20 0.96 0.25 2.45 0.02 -1.13 -2.82 113.55 113.48 1ocz h SER 150 Ca -0.12 -0.26 -0.01 0.00 -0.84 0.00 0.00 61.79 60.56 1ocz h SER 150 Cb 1.77 -0.26 -0.00 0.00 0.14 0.00 0.00 62.40 64.05 1ocz h SER 150 CO 0.19 1.02 -0.15 0.25 -1.14 0.00 0.00 176.83 177.00 1ocz h LEU 151 N 0.90 -0.38 0.00 5.07 5.85 -1.40 -0.95 115.31 124.41 1ocz h LEU 151 Ca 0.16 0.02 0.00 0.00 0.84 0.00 0.00 57.88 58.91 1ocz h LEU 151 Cb 0.53 0.11 0.00 0.00 0.37 0.00 0.00 40.66 41.68 1ocz h LEU 151 CO 0.03 -0.25 0.00 1.15 -0.34 0.00 0.00 178.44 179.03 1ocz n MET 152 N -5.27 0.47 -0.10 1.25 0.00 -1.07 -1.33 117.12 111.07 1ocz n MET 152 Ca -0.09 0.00 0.10 0.00 0.00 0.00 0.00 57.70 57.70 1ocz n MET 152 Cb 0.19 -1.36 0.14 0.00 0.00 0.00 0.00 33.22 32.19 1ocz n MET 152 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 175.97 176.36 1ocz n GLU 153 N -0.86 1.23 -1.46 3.17 1.02 -0.46 -4.94 120.64 118.35 1ocz n GLU 153 Ca 0.08 -2.53 -0.16 0.00 -0.02 0.00 0.00 57.16 54.53 1ocz n GLU 153 Cb 0.04 -1.46 -0.07 0.00 -0.02 0.00 0.00 31.44 29.93 1ocz n GLU 153 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1ocz n GLY 154 N -1.37 1.55 3.43 0.62 0.00 -0.44 -4.90 105.19 104.07 1ocz n GLY 154 Ca 0.15 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.73 1ocz n GLY 154 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1ocz s ASP 155 N -2.48 6.70 0.11 1.61 -1.08 -0.63 -4.91 116.67 115.99 1ocz s ASP 155 Ca 0.00 -2.28 -0.34 0.00 -0.52 0.00 0.00 52.55 49.41 1ocz s ASP 155 Cb 0.00 -2.36 -0.14 0.00 -1.46 0.00 0.00 42.92 38.96 1ocz s ASP 155 CO 0.00 -0.93 1.56 -0.09 0.52 0.00 0.00 175.17 176.24 1ocz h ARG 156 N 8.45 -0.73 -0.59 4.34 2.43 -1.91 -1.81 114.38 124.57 1ocz h ARG 156 Ca 0.16 0.05 0.12 0.00 -0.81 0.00 0.00 59.98 59.50 1ocz h ARG 156 Cb 1.01 0.17 -0.10 0.00 -0.42 0.00 0.00 29.97 30.63 1ocz h ARG 156 CO 1.05 -0.48 -0.02 -0.22 -1.51 0.00 0.00 179.97 178.78 1ocz h LYS 157 N -0.75 0.09 -0.01 0.20 3.64 -1.98 -1.58 116.57 116.18 1ocz h LYS 157 Ca -0.00 -0.01 -0.14 0.00 -1.27 0.00 0.00 60.65 59.23 1ocz h LYS 157 Cb 0.76 -0.02 -0.02 0.00 -0.41 0.00 0.00 32.23 32.54 1ocz h LYS 157 CO -0.26 0.06 -0.67 0.45 -2.27 0.00 0.00 179.45 176.76 1ocz h HIS 158 N 0.10 0.05 0.47 1.91 3.86 -1.93 -1.25 115.15 118.37 1ocz h HIS 158 Ca 0.30 -0.02 -0.02 0.00 -1.16 0.00 0.00 60.37 59.47 1ocz h HIS 158 Cb 0.48 -0.01 0.00 0.00 1.06 0.00 0.00 27.41 28.95 1ocz h HIS 158 CO -0.37 0.70 -0.23 1.98 0.86 0.00 0.00 177.93 180.87 1ocz h MET 159 N 0.03 -0.61 -0.58 2.45 1.85 -0.78 -0.44 114.93 116.86 1ocz h MET 159 Ca -0.01 0.04 0.17 0.00 -0.61 0.00 0.00 59.70 59.29 1ocz h MET 159 Cb 1.19 0.14 -0.02 0.00 0.43 0.00 0.00 31.60 33.33 1ocz h MET 159 CO 0.09 -0.32 0.44 1.25 -0.40 0.00 0.00 176.91 177.98 1ocz h LEU 160 N -0.84 0.00 0.02 3.39 5.85 -1.26 0.72 115.31 123.20 1ocz h LEU 160 Ca -0.06 0.00 -0.00 0.00 0.84 0.00 0.00 57.88 58.65 1ocz h LEU 160 Cb 0.57 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.60 1ocz h LEU 160 CO 0.11 0.00 -0.01 -0.61 -0.34 0.00 0.00 178.44 177.59 1ocz h GLN 161 N 0.00 -0.03 -0.67 1.25 4.15 -0.78 -2.46 115.11 116.58 1ocz h GLN 161 Ca 0.27 0.00 -0.02 0.00 0.77 0.00 0.00 58.65 59.67 1ocz h GLN 161 Cb 1.16 0.01 -0.03 0.00 0.21 0.00 0.00 27.48 28.82 1ocz h GLN 161 CO -0.00 0.67 0.33 0.00 -1.93 0.00 0.00 178.83 177.90 1ocz h ALA 162 N -0.20 1.32 -0.76 3.38 0.00 -0.34 -1.42 119.26 121.24 1ocz h ALA 162 Ca -0.00 -0.13 -0.04 0.00 0.00 0.00 0.00 54.91 54.73 1ocz h ALA 162 Cb 0.71 -0.27 -0.03 0.00 0.00 0.00 0.00 17.79 18.19 1ocz h ALA 162 CO 0.00 0.54 0.30 1.25 0.00 0.00 0.00 179.25 181.34 1ocz h LEU 163 N 0.95 1.05 -0.07 0.00 6.46 -0.99 -1.48 115.31 121.23 1ocz h LEU 163 Ca 0.24 -0.17 -0.00 0.00 -0.12 0.00 0.00 57.88 57.82 1ocz h LEU 163 Cb 0.08 -0.27 -0.00 0.00 -0.73 0.00 0.00 40.66 39.74 1ocz h LEU 163 CO -0.03 0.93 0.03 0.15 -0.62 0.00 0.00 178.44 178.90 1ocz h PHE 164 N 1.09 0.10 -0.61 1.25 3.57 -0.84 -0.94 116.94 120.56 1ocz h PHE 164 Ca 0.25 -0.01 0.08 0.00 3.53 0.00 0.00 57.97 61.83 1ocz h PHE 164 Cb 0.22 -0.03 -0.07 0.00 2.79 0.00 0.00 35.95 38.86 1ocz h PHE 164 CO 0.02 0.23 0.27 0.82 -2.23 0.00 0.00 178.31 177.41 1ocz h ILE 165 N -0.05 0.83 0.68 1.41 2.04 -1.21 -0.21 117.51 121.00 1ocz h ILE 165 Ca 0.02 -0.16 -0.03 0.00 1.00 0.00 0.00 64.86 65.69 1ocz h ILE 165 Cb 0.17 0.31 -0.01 0.00 -0.74 0.00 0.00 36.82 36.55 1ocz h ILE 165 CO -0.00 0.09 -0.48 0.74 0.00 0.00 0.00 178.15 178.49 1ocz h THR 166 N 0.48 0.04 -0.86 -0.27 2.02 -1.01 -2.00 112.91 111.30 1ocz h THR 166 Ca 0.30 0.00 0.20 0.00 0.77 0.00 0.00 66.41 67.68 1ocz h THR 166 Cb 0.32 0.04 -0.12 0.00 -1.74 0.00 0.00 68.15 66.65 1ocz h THR 166 CO -0.26 0.00 0.36 0.40 0.37 0.00 0.00 175.52 176.38 1ocz h ILE 167 N -1.11 0.51 -0.39 3.11 2.04 -0.80 -1.50 117.51 119.37 1ocz h ILE 167 Ca -0.09 -0.14 -0.14 0.00 1.00 0.00 0.00 64.86 65.49 1ocz h ILE 167 Cb 0.91 0.07 -0.01 0.00 -0.74 0.00 0.00 36.82 37.06 1ocz h ILE 167 CO 0.05 0.07 -0.32 0.71 0.00 0.00 0.00 178.15 178.67 1ocz h THR 168 N 0.40 1.27 -0.46 -0.27 1.35 -0.67 -1.59 112.91 112.94 1ocz h THR 168 Ca 0.52 -1.48 -0.04 0.00 -0.55 0.00 0.00 66.41 64.86 1ocz h THR 168 Cb 0.94 1.30 -0.02 0.00 -1.73 0.00 0.00 68.15 68.64 1ocz h THR 168 CO -0.50 0.49 0.12 -0.07 -0.25 0.00 0.00 175.52 175.31 1ocz h LEU 169 N 0.74 0.64 -0.82 3.87 3.38 -0.63 0.36 115.31 122.85 1ocz h LEU 169 Ca 0.08 -0.10 -0.09 0.00 0.09 0.00 0.00 57.88 57.86 1ocz h LEU 169 Cb 0.88 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 41.44 1ocz h LEU 169 CO 0.08 0.63 -0.04 1.23 0.09 0.00 0.00 178.44 180.43 1ocz h GLY 170 N 0.88 0.91 1.59 0.83 0.00 -0.99 -0.68 103.07 105.60 1ocz h GLY 170 Ca 0.15 -0.65 -0.19 0.00 0.00 0.00 0.00 47.33 46.64 1ocz h GLY 170 CO -0.00 0.60 -0.78 -2.08 0.00 0.00 0.00 176.54 174.27 1ocz h VAL 171 N 0.78 1.39 -0.67 4.60 2.07 -0.37 -2.73 116.25 121.32 1ocz h VAL 171 Ca 0.14 -2.23 -0.00 0.00 0.82 0.00 0.00 66.70 65.43 1ocz h VAL 171 Cb 0.53 2.20 -0.03 0.00 -1.52 0.00 0.00 31.29 32.46 1ocz h VAL 171 CO 0.03 0.67 0.42 0.22 0.02 0.00 0.00 177.57 178.93 1ocz h TYR 172 N 0.26 0.87 -0.31 1.57 3.20 0.15 -1.32 116.97 121.38 1ocz h TYR 172 Ca -0.04 0.01 -0.16 0.00 3.14 0.00 0.00 58.73 61.68 1ocz h TYR 172 Cb 1.37 -0.29 -0.01 0.00 1.54 0.00 0.00 36.73 39.35 1ocz h TYR 172 CO 0.05 0.57 -0.43 0.35 -1.64 0.00 0.00 178.16 177.05 1ocz h PHE 173 N 0.92 0.95 0.05 -3.82 3.04 -0.97 -1.01 116.94 116.10 1ocz h PHE 173 Ca 0.24 -0.30 -0.00 0.00 3.98 0.00 0.00 57.97 61.90 1ocz h PHE 173 Cb -0.06 -0.20 0.00 0.00 2.56 0.00 0.00 35.95 38.25 1ocz h PHE 173 CO 0.00 1.08 -0.02 1.15 -2.02 0.00 0.00 178.31 178.50 1ocz h THR 174 N 0.63 0.97 0.05 4.41 2.02 -0.99 0.21 112.91 120.21 1ocz h THR 174 Ca 0.04 -0.04 -0.00 0.00 0.77 0.00 0.00 66.41 67.18 1ocz h THR 174 Cb 1.00 0.99 0.00 0.00 -1.74 0.00 0.00 68.15 68.40 1ocz h THR 174 CO 0.10 0.01 -0.03 -0.07 0.37 0.00 0.00 175.52 175.90 1ocz h LEU 175 N -0.08 -0.06 -0.37 2.58 3.38 -1.22 0.24 115.31 119.78 1ocz h LEU 175 Ca -0.01 -0.06 0.07 0.00 0.09 0.00 0.00 57.88 57.97 1ocz h LEU 175 Cb 0.06 0.02 -0.06 0.00 0.09 0.00 0.00 40.66 40.77 1ocz h LEU 175 CO 0.01 0.02 0.01 -0.07 0.09 0.00 0.00 178.44 178.50 1ocz h LEU 176 N -0.13 -0.12 -0.75 1.67 3.38 -1.08 -1.08 115.31 117.20 1ocz h LEU 176 Ca -0.01 0.08 -0.07 0.00 0.09 0.00 0.00 57.88 57.98 1ocz h LEU 176 Cb 0.11 0.14 -0.03 0.00 0.09 0.00 0.00 40.66 40.98 1ocz h LEU 176 CO 0.01 -0.03 0.19 -0.61 0.09 0.00 0.00 178.44 178.09 1ocz h GLN 177 N 0.12 1.14 -0.45 1.13 5.75 -0.71 -2.31 115.11 119.77 1ocz h GLN 177 Ca 0.18 -0.26 0.06 0.00 -0.15 0.00 0.00 58.65 58.48 1ocz h GLN 177 Cb 0.25 -0.15 -0.05 0.00 1.07 0.00 0.00 27.48 28.60 1ocz h GLN 177 CO -0.29 0.99 0.17 0.00 -2.65 0.00 0.00 178.83 177.05 1ocz h ALA 178 N 1.12 0.55 -0.49 3.38 0.00 0.67 -1.09 119.26 123.39 1ocz h ALA 178 Ca 0.23 0.05 -0.07 0.00 0.00 0.00 0.00 54.91 55.11 1ocz h ALA 178 Cb 0.35 0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.14 1ocz h ALA 178 CO -0.00 -0.21 0.01 0.66 0.00 0.00 0.00 179.25 179.71 1ocz h SER 179 N 0.35 0.78 -0.95 0.00 4.64 -1.00 -1.36 113.55 116.01 1ocz h SER 179 Ca 0.21 -0.19 -0.01 0.00 -0.47 0.00 0.00 61.79 61.34 1ocz h SER 179 Cb 0.19 -0.21 -0.05 0.00 -0.31 0.00 0.00 62.40 62.03 1ocz h SER 179 CO -0.20 0.84 0.58 -0.33 -0.87 0.00 0.00 176.83 176.84 1ocz h GLU 180 N 0.76 1.29 -0.68 4.77 4.39 -0.83 0.41 114.58 124.70 1ocz h GLU 180 Ca 0.15 -0.12 0.07 0.00 0.34 0.00 0.00 59.36 59.80 1ocz h GLU 180 Cb 0.45 -0.27 -0.06 0.00 -0.10 0.00 0.00 28.75 28.76 1ocz h GLU 180 CO 0.02 0.90 0.36 1.88 -1.16 0.00 0.00 179.01 181.01 1ocz h TYR 181 N 1.31 0.65 0.24 4.33 -1.99 -0.12 0.50 116.97 121.90 1ocz h TYR 181 Ca 0.34 0.03 -0.01 0.00 2.00 0.00 0.00 58.73 61.09 1ocz h TYR 181 Cb -0.06 -0.19 0.00 0.00 2.00 0.00 0.00 36.73 38.48 1ocz h TYR 181 CO 0.01 0.28 -0.12 -0.92 -0.00 0.00 0.00 178.16 177.41 1ocz h TYR 182 N 0.64 -0.30 0.00 4.88 3.20 -0.64 -3.23 116.97 121.52 1ocz h TYR 182 Ca 0.32 -0.01 -0.02 0.00 3.14 0.00 0.00 58.73 62.16 1ocz h TYR 182 Cb 0.26 0.10 -0.00 0.00 1.54 0.00 0.00 36.73 38.62 1ocz h TYR 182 CO -0.09 0.07 -0.10 0.93 -1.64 0.00 0.00 178.16 177.32 1ocz h GLU 183 N -0.79 0.00 -6.63 1.82 4.39 0.08 -3.44 114.58 110.01 1ocz h GLU 183 Ca -0.03 0.00 -0.53 0.00 0.34 0.00 0.00 59.36 59.13 1ocz h GLU 183 Cb 0.51 0.00 0.06 0.00 -0.10 0.00 0.00 28.75 29.22 1ocz h GLU 183 CO 0.05 0.10 0.98 0.00 -1.16 0.00 0.00 179.01 178.99 1ocz n ALA 184 N -2.27 2.59 1.52 3.43 0.00 0.17 -4.91 120.51 121.05 1ocz n ALA 184 Ca -0.02 0.41 0.09 0.00 0.00 0.00 0.00 53.44 53.91 1ocz n ALA 184 Cb 0.22 -2.50 0.51 0.00 0.00 0.00 0.00 19.45 17.68 1ocz n ALA 184 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 1ocz n PRO 185 N 3.95 0.76 -4.67 0.00 -0.04 -1.26 -4.85 135.00 128.89 1ocz n PRO 185 Ca 0.16 0.00 -0.30 0.00 -0.04 0.00 0.00 63.50 63.32 1ocz n PRO 185 Cb 0.34 -1.35 -0.09 0.00 -0.04 0.00 0.00 33.50 32.36 1ocz n PRO 185 CO 0.00 0.00 0.00 -0.59 -0.04 0.00 0.00 175.50 174.87 1ocz s PHE 186 N -2.00 1.97 0.31 0.54 -0.71 -1.26 -4.89 117.98 111.94 1ocz s PHE 186 Ca 0.26 -0.97 -0.06 0.00 -1.04 0.00 0.00 56.93 55.12 1ocz s PHE 186 Cb 0.12 -1.53 0.00 0.00 -1.21 0.00 0.00 43.02 40.40 1ocz s PHE 186 CO 0.20 0.15 0.47 0.95 -1.34 0.00 0.00 175.22 175.65 1ocz s THR 187 N -2.94 0.00 0.54 -4.49 -4.23 -1.26 -5.02 115.64 98.24 1ocz s THR 187 Ca 0.16 -1.54 0.22 0.00 -1.18 0.00 0.00 61.69 59.35 1ocz s THR 187 Cb 0.04 -2.52 0.33 0.00 1.34 0.00 0.00 72.50 71.68 1ocz s THR 187 CO 0.09 0.00 2.10 0.16 -0.54 0.00 0.00 174.62 176.43 1ocz h ILE 188 N 2.18 0.81 -0.00 2.99 -0.00 -1.96 -1.31 117.51 120.21 1ocz h ILE 188 Ca -0.28 0.00 0.00 0.00 -0.00 0.00 0.00 64.86 64.58 1ocz h ILE 188 Cb 1.24 0.89 0.00 0.00 -0.00 0.00 0.00 36.82 38.96 1ocz h ILE 188 CO 0.39 0.00 -0.03 -1.54 -0.00 0.00 0.00 178.15 176.97 1ocz n SER 189 N -4.33 0.42 -3.05 2.16 3.41 -1.26 -3.39 113.62 107.59 1ocz n SER 189 Ca 0.02 -0.89 -0.34 0.00 -0.26 0.00 0.00 58.87 57.40 1ocz n SER 189 Cb 0.29 -0.05 -0.04 0.00 -0.26 0.00 0.00 64.21 64.15 1ocz n SER 189 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 1ocz n ASP 190 N -0.79 7.55 0.00 4.04 9.92 -0.49 -4.97 116.55 131.81 1ocz n ASP 190 Ca 0.19 -2.94 0.00 0.00 -0.53 0.00 0.00 54.79 51.52 1ocz n ASP 190 Cb 0.22 -1.39 0.00 0.00 -0.64 0.00 0.00 41.12 39.31 1ocz n ASP 190 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1ocz n GLY 191 N 2.08 1.12 0.23 0.44 0.00 -1.26 -3.07 105.19 104.73 1ocz n GLY 191 Ca 0.61 -0.71 -0.16 0.00 0.00 0.00 0.00 46.02 45.76 1ocz n GLY 191 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1ocz h VAL 192 N 0.00 1.28 -0.22 1.61 2.07 -1.93 -2.09 116.25 116.97 1ocz h VAL 192 Ca 0.00 -1.85 0.04 0.00 0.82 0.00 0.00 66.70 65.72 1ocz h VAL 192 Cb 0.00 1.84 -0.04 0.00 -1.52 0.00 0.00 31.29 31.57 1ocz h VAL 192 CO 0.00 0.59 -0.05 0.22 0.02 0.00 0.00 177.57 178.35 1ocz h TYR 193 N 0.56 -0.11 -0.12 1.57 5.03 -1.96 0.60 116.97 122.55 1ocz h TYR 193 Ca -0.02 0.02 -0.03 0.00 2.58 0.00 0.00 58.73 61.28 1ocz h TYR 193 Cb 1.27 0.08 -0.00 0.00 1.55 0.00 0.00 36.73 39.63 1ocz h TYR 193 CO 0.08 -0.09 -0.03 0.78 -1.32 0.00 0.00 178.16 177.59 1ocz h GLY 194 N 0.01 0.24 0.02 1.82 0.00 -1.61 -1.97 103.07 101.57 1ocz h GLY 194 Ca 0.11 -0.20 0.07 0.00 0.00 0.00 0.00 47.33 47.31 1ocz h GLY 194 CO -0.22 0.18 -0.25 1.76 0.00 0.00 0.00 176.54 178.00 1ocz h SER 195 N -0.09 -0.83 -0.56 0.19 0.02 -1.02 0.18 113.55 111.44 1ocz h SER 195 Ca 0.03 0.16 -0.09 0.00 -0.84 0.00 0.00 61.79 61.05 1ocz h SER 195 Cb 0.44 0.41 -0.02 0.00 0.14 0.00 0.00 62.40 63.36 1ocz h SER 195 CO 0.01 -0.28 0.01 0.00 -1.14 0.00 0.00 176.83 175.43 1ocz h THR 196 N -0.22 1.26 -0.04 -2.27 1.03 -0.93 -2.56 112.91 109.19 1ocz h THR 196 Ca 0.16 -1.11 -0.10 0.00 -0.01 0.00 0.00 66.41 65.35 1ocz h THR 196 Cb 0.48 0.87 0.01 0.00 -1.07 0.00 0.00 68.15 68.44 1ocz h THR 196 CO -0.46 0.40 -0.38 0.15 -0.01 0.00 0.00 175.52 175.22 1ocz h PHE 197 N 0.86 0.45 0.00 0.00 3.04 -0.99 -3.03 116.94 117.27 1ocz h PHE 197 Ca 0.16 -0.22 -0.11 0.00 3.98 0.00 0.00 57.97 61.77 1ocz h PHE 197 Cb 0.53 -0.06 -0.02 0.00 2.56 0.00 0.00 35.95 38.96 1ocz h PHE 197 CO 0.04 1.00 -0.54 0.74 -2.02 0.00 0.00 178.31 177.52 1ocz h PHE 198 N -0.21 0.00 0.14 0.41 0.04 -0.70 -2.46 116.94 114.15 1ocz h PHE 198 Ca -0.04 0.00 -0.32 0.00 2.80 0.00 0.00 57.97 60.42 1ocz h PHE 198 Cb 1.07 0.00 -0.00 0.00 2.20 0.00 0.00 35.95 39.22 1ocz h PHE 198 CO 0.14 0.54 -1.56 -0.39 -0.60 0.00 0.00 178.31 176.45 1ocz h VAL 199 N 0.00 1.13 0.61 -0.55 -1.51 -1.57 -1.66 116.25 112.71 1ocz h VAL 199 Ca -0.01 -2.75 -0.03 0.00 -1.23 0.00 0.00 66.70 62.69 1ocz h VAL 199 Cb 1.00 2.78 0.01 0.00 -2.13 0.00 0.00 31.29 32.95 1ocz h VAL 199 CO 0.07 0.83 -0.29 0.00 -1.23 0.00 0.00 177.57 176.94 1ocz h ALA 200 N 0.41 -0.82 -0.20 5.19 0.00 -1.58 0.51 119.26 122.75 1ocz h ALA 200 Ca -0.26 -0.21 -0.02 0.00 0.00 0.00 0.00 54.91 54.42 1ocz h ALA 200 Cb 2.04 0.32 -0.01 0.00 0.00 0.00 0.00 17.79 20.14 1ocz h ALA 200 CO 0.17 -0.86 0.02 1.79 0.00 0.00 0.00 179.25 180.38 1ocz h THR 201 N -1.04 1.12 -0.11 0.00 1.35 -1.61 -1.06 112.91 111.56 1ocz h THR 201 Ca -0.08 -0.44 -0.05 0.00 -0.55 0.00 0.00 66.41 65.29 1ocz h THR 201 Cb 0.68 0.94 -0.00 0.00 -1.73 0.00 0.00 68.15 68.04 1ocz h THR 201 CO 0.14 0.15 -0.13 1.23 -0.25 0.00 0.00 175.52 176.66 1ocz h GLY 202 N 0.53 0.31 1.50 5.82 0.00 -1.10 0.21 103.07 110.34 1ocz h GLY 202 Ca 0.07 -0.33 -0.07 0.00 0.00 0.00 0.00 47.33 47.00 1ocz h GLY 202 CO 0.00 0.29 -0.09 0.74 0.00 0.00 0.00 176.54 177.49 1ocz h PHE 203 N -0.12 0.65 -0.45 5.60 0.04 0.27 -0.98 116.94 121.95 1ocz h PHE 203 Ca 0.02 -0.10 -0.11 0.00 2.80 0.00 0.00 57.97 60.58 1ocz h PHE 203 Cb 0.66 -0.18 -0.02 0.00 2.20 0.00 0.00 35.95 38.62 1ocz h PHE 203 CO 0.09 0.68 -0.15 1.25 -0.60 0.00 0.00 178.31 179.58 1ocz h HIS 204 N 0.56 0.94 -0.58 -0.55 2.76 -1.09 -1.90 115.15 115.29 1ocz h HIS 204 Ca 0.10 -0.19 -0.05 0.00 -2.20 0.00 0.00 60.37 58.04 1ocz h HIS 204 Cb 0.49 -0.23 -0.03 0.00 1.55 0.00 0.00 27.41 29.19 1ocz h HIS 204 CO 0.02 0.93 0.17 0.78 -1.30 0.00 0.00 177.93 178.53 1ocz h GLY 205 N 0.96 0.94 2.00 5.26 0.00 0.21 -0.87 103.07 111.57 1ocz h GLY 205 Ca 0.12 -0.53 -0.08 0.00 0.00 0.00 0.00 47.33 46.84 1ocz h GLY 205 CO 0.05 0.49 -0.36 -2.00 0.00 0.00 0.00 176.54 174.72 1ocz h LEU 206 N 0.85 0.00 -0.41 3.11 5.85 -0.81 -2.67 115.31 121.23 1ocz h LEU 206 Ca 0.19 0.00 -0.18 0.00 0.84 0.00 0.00 57.88 58.73 1ocz h LEU 206 Cb 0.26 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 41.29 1ocz h LEU 206 CO -0.01 0.36 -0.61 0.45 -0.34 0.00 0.00 178.44 178.30 1ocz h HIS 207 N 0.00 0.81 -0.22 1.25 3.86 -0.40 -1.03 115.15 119.42 1ocz h HIS 207 Ca -0.00 -0.31 -0.09 0.00 -1.16 0.00 0.00 60.37 58.81 1ocz h HIS 207 Cb 0.69 -0.14 -0.01 0.00 1.06 0.00 0.00 27.41 29.00 1ocz h HIS 207 CO 0.00 1.07 -0.27 0.28 0.86 0.00 0.00 177.93 179.88 1ocz h VAL 208 N 0.47 1.26 -0.36 2.45 2.07 -1.13 0.45 116.25 121.46 1ocz h VAL 208 Ca -0.00 -1.27 -0.16 0.00 0.82 0.00 0.00 66.70 66.09 1ocz h VAL 208 Cb 1.18 1.39 -0.01 0.00 -1.52 0.00 0.00 31.29 32.33 1ocz h VAL 208 CO 0.12 0.40 -0.38 0.40 0.02 0.00 0.00 177.57 178.12 1ocz h ILE 209 N 0.37 1.28 -0.19 4.57 2.04 -1.36 0.13 117.51 124.35 1ocz h ILE 209 Ca 0.05 -1.56 -0.12 0.00 1.00 0.00 0.00 64.86 64.24 1ocz h ILE 209 Cb 0.67 1.44 -0.01 0.00 -0.74 0.00 0.00 36.82 38.18 1ocz h ILE 209 CO 0.05 0.52 -0.41 0.40 0.00 0.00 0.00 178.15 178.71 1ocz h ILE 210 N 0.70 1.31 0.01 -0.67 2.04 -0.81 -2.19 117.51 117.89 1ocz h ILE 210 Ca 0.05 -1.56 -0.20 0.00 1.00 0.00 0.00 64.86 64.16 1ocz h ILE 210 Cb 0.98 1.60 -0.01 0.00 -0.74 0.00 0.00 36.82 38.65 1ocz h ILE 210 CO 0.09 0.48 -0.89 1.23 0.00 0.00 0.00 178.15 179.07 1ocz h GLY 211 N 1.13 0.18 0.97 5.37 0.00 0.02 -2.76 103.07 107.97 1ocz h GLY 211 Ca 0.03 -0.33 -0.14 0.00 0.00 0.00 0.00 47.33 46.89 1ocz h GLY 211 CO 0.07 0.29 -0.43 1.76 0.00 0.00 0.00 176.54 178.23 1ocz h SER 212 N 0.09 0.73 0.04 0.19 0.02 -0.62 -2.35 113.55 111.66 1ocz h SER 212 Ca -0.04 -0.55 -0.06 0.00 -0.84 0.00 0.00 61.79 60.29 1ocz h SER 212 Cb 1.52 -0.21 -0.01 0.00 0.14 0.00 0.00 62.40 63.84 1ocz h SER 212 CO 0.13 1.15 -0.19 0.00 -1.14 0.00 0.00 176.83 176.79 1ocz h THR 213 N 0.35 1.21 0.15 -2.27 1.03 -1.45 0.74 112.91 112.67 1ocz h THR 213 Ca 0.00 -0.97 0.00 0.00 -0.01 0.00 0.00 66.41 65.43 1ocz h THR 213 Cb 1.04 1.30 -0.01 0.00 -1.07 0.00 0.00 68.15 69.41 1ocz h THR 213 CO 0.10 0.30 -0.13 0.15 -0.01 0.00 0.00 175.52 175.93 1ocz h PHE 214 N 0.25 -0.33 -0.87 0.00 3.04 -1.39 0.03 116.94 117.68 1ocz h PHE 214 Ca 0.05 0.00 0.04 0.00 3.98 0.00 0.00 57.97 62.03 1ocz h PHE 214 Cb 0.48 0.13 -0.05 0.00 2.56 0.00 0.00 35.95 39.07 1ocz h PHE 214 CO 0.01 -0.20 0.56 -0.07 -2.02 0.00 0.00 178.31 176.59 1ocz h LEU 215 N -0.29 0.93 -0.95 0.59 3.38 -0.89 -1.00 115.31 117.07 1ocz h LEU 215 Ca -0.00 -0.00 0.03 0.00 0.09 0.00 0.00 57.88 57.99 1ocz h LEU 215 Cb 0.27 -0.21 -0.05 0.00 0.09 0.00 0.00 40.66 40.76 1ocz h LEU 215 CO -0.02 0.64 0.62 0.40 0.09 0.00 0.00 178.44 180.17 1ocz h ILE 216 N 1.08 1.18 -0.68 1.22 2.04 -0.21 0.35 117.51 122.50 1ocz h ILE 216 Ca 0.35 -0.42 -0.02 0.00 1.00 0.00 0.00 64.86 65.77 1ocz h ILE 216 Cb 0.02 -0.15 -0.03 0.00 -0.74 0.00 0.00 36.82 35.92 1ocz h ILE 216 CO -0.12 0.22 0.33 0.58 0.00 0.00 0.00 178.15 179.17 1ocz h VAL 217 N 1.22 1.23 -0.32 1.67 2.07 0.03 -1.11 116.25 121.05 1ocz h VAL 217 Ca 0.37 -0.62 -0.06 0.00 0.82 0.00 0.00 66.70 67.21 1ocz h VAL 217 Cb -0.04 0.39 -0.02 0.00 -1.52 0.00 0.00 31.29 30.10 1ocz h VAL 217 CO -0.11 0.26 -0.07 0.00 0.02 0.00 0.00 177.57 177.67 1ocz h PHE 219 N 0.48 -0.15 -0.41 0.00 3.57 0.90 -1.61 116.94 119.73 1ocz h PHE 219 Ca 0.10 0.01 -0.10 0.00 3.53 0.00 0.00 57.97 61.51 1ocz h PHE 219 Cb 0.42 0.07 -0.01 0.00 2.79 0.00 0.00 35.95 39.21 1ocz h PHE 219 CO 0.01 -0.09 -0.12 0.74 -2.23 0.00 0.00 178.31 176.62 1ocz h PHE 220 N -0.10 0.91 -0.54 0.41 0.04 -1.18 -2.21 116.94 114.27 1ocz h PHE 220 Ca 0.03 -0.20 0.10 0.00 2.80 0.00 0.00 57.97 60.70 1ocz h PHE 220 Cb 0.13 -0.22 -0.03 0.00 2.20 0.00 0.00 35.95 38.04 1ocz h PHE 220 CO -0.13 0.94 0.37 0.00 -0.60 0.00 0.00 178.31 178.88 1ocz h ARG 221 N 0.62 0.27 -0.21 1.51 3.08 -1.06 -1.45 114.38 117.15 1ocz h ARG 221 Ca 0.10 -0.02 -0.15 0.00 0.07 0.00 0.00 59.98 59.98 1ocz h ARG 221 Cb 0.66 -0.06 0.00 0.00 0.08 0.00 0.00 29.97 30.65 1ocz h ARG 221 CO 0.05 0.18 -0.46 0.37 -1.07 0.00 0.00 179.97 179.04 1ocz h GLN 222 N 0.28 0.67 -0.40 0.04 5.75 -0.70 -0.73 115.11 120.02 1ocz h GLN 222 Ca 0.25 -0.45 0.06 0.00 -0.15 0.00 0.00 58.65 58.36 1ocz h GLN 222 Cb 0.61 0.06 -0.02 0.00 1.07 0.00 0.00 27.48 29.20 1ocz h GLN 222 CO -0.05 1.07 0.27 -0.07 -2.65 0.00 0.00 178.83 177.40 1ocz h LEU 223 N 0.37 0.25 -0.91 -2.39 3.38 -0.82 -0.37 115.31 114.81 1ocz h LEU 223 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1ocz h LEU 223 Cb 1.07 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 41.76 1ocz h LEU 223 CO 0.10 0.16 0.00 0.29 0.09 0.00 0.00 178.44 179.08 1ocz n LYS 224 N -4.47 1.58 -1.57 1.13 5.02 -0.77 -4.91 118.16 114.16 1ocz n LYS 224 Ca 0.05 -0.85 -0.18 0.00 -2.02 0.00 0.00 58.31 55.31 1ocz n LYS 224 Cb 0.26 -1.22 -0.07 0.00 -0.02 0.00 0.00 35.03 33.98 1ocz n LYS 224 CO 0.00 0.00 0.00 1.19 -0.52 0.00 0.00 177.40 178.07 1ocz n PHE 225 N 0.18 -0.04 -0.31 2.13 3.01 -0.15 -4.93 117.46 117.34 1ocz n PHE 225 Ca 0.08 0.00 -0.01 0.00 1.01 0.00 0.00 57.45 58.53 1ocz n PHE 225 Cb 0.22 -3.11 0.12 0.00 -0.01 0.00 0.00 39.48 36.69 1ocz n PHE 225 CO 0.00 0.00 0.00 0.45 1.01 0.00 0.00 176.76 178.22 1ocz h HIS 226 N 0.00 1.02 -3.19 1.38 3.86 -1.34 -3.43 115.15 113.43 1ocz h HIS 226 Ca -0.37 0.03 -0.58 0.00 -1.16 0.00 0.00 60.37 58.28 1ocz h HIS 226 Cb 1.19 -0.33 -0.05 0.00 1.06 0.00 0.00 27.41 29.27 1ocz h HIS 226 CO 0.51 0.57 -0.08 -0.06 0.86 0.00 0.00 177.93 179.72 1ocz s PHE 227 N -6.09 3.76 0.35 2.45 0.08 -1.26 -4.97 117.98 112.30 1ocz s PHE 227 Ca -0.13 1.17 0.07 0.00 0.12 0.00 0.00 56.93 58.16 1ocz s PHE 227 Cb 0.17 -2.46 -0.01 0.00 -0.57 0.00 0.00 43.02 40.15 1ocz s PHE 227 CO 0.79 0.55 0.42 0.95 -0.10 0.00 0.00 175.22 177.83 1ocz s THR 228 N -0.88 3.61 0.54 0.64 -4.23 -0.82 -4.98 115.64 109.50 1ocz s THR 228 Ca 0.28 -1.16 0.26 0.00 -1.18 0.00 0.00 61.69 59.89 1ocz s THR 228 Cb -0.18 -3.24 0.39 0.00 1.34 0.00 0.00 72.50 70.81 1ocz s THR 228 CO 0.17 -0.13 2.00 0.77 -0.54 0.00 0.00 174.62 176.89 1ocz h SER 229 N 0.99 0.00 -0.01 3.99 4.64 -1.93 -2.84 113.55 118.39 1ocz h SER 229 Ca -0.44 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.88 1ocz h SER 229 Cb 1.26 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.35 1ocz h SER 229 CO 0.54 0.00 -0.06 0.59 -0.87 0.00 0.00 176.83 177.03 1ocz n ASN 230 N -4.29 1.35 -3.73 4.97 3.02 -1.26 -4.28 115.26 111.04 1ocz n ASN 230 Ca 0.09 -1.18 -0.28 0.00 -0.03 0.00 0.00 54.58 53.18 1ocz n ASN 230 Cb 0.59 0.20 -0.16 0.00 -0.61 0.00 0.00 39.78 39.80 1ocz n ASN 230 CO 0.00 0.00 0.00 -2.28 -2.62 0.00 0.00 177.26 172.36 1ocz s HIS 231 N -0.81 1.20 -0.39 3.10 2.46 -1.07 -4.97 115.29 114.81 1ocz s HIS 231 Ca 0.07 -1.11 0.09 0.00 0.47 0.00 0.00 55.06 54.58 1ocz s HIS 231 Cb 0.06 -1.20 0.37 0.00 -0.13 0.00 0.00 32.58 31.67 1ocz s HIS 231 CO 0.13 -0.70 1.35 -2.39 -2.47 0.00 0.00 174.74 170.65 1ocz n HIS 232 N 5.00 -2.30 -0.34 3.88 1.44 -1.26 -1.95 115.22 119.69 1ocz n HIS 232 Ca -0.07 -1.82 0.06 0.00 -2.01 0.00 0.00 57.72 53.88 1ocz n HIS 232 Cb 0.45 1.57 0.25 0.00 0.12 0.00 0.00 29.99 32.39 1ocz n HIS 232 CO 0.00 0.00 0.00 0.35 -2.81 0.00 0.00 176.34 173.88 1ocz h PHE 233 N 1.88 1.09 -0.97 -1.40 3.57 -1.97 0.72 116.94 119.86 1ocz h PHE 233 Ca -0.31 0.03 0.26 0.00 3.53 0.00 0.00 57.97 61.48 1ocz h PHE 233 Cb 1.29 -0.35 -0.05 0.00 2.79 0.00 0.00 35.95 39.63 1ocz h PHE 233 CO 0.11 0.48 0.67 0.78 -2.23 0.00 0.00 178.31 178.12 1ocz h GLY 234 N 0.99 0.34 1.11 2.40 0.00 -1.99 0.36 103.07 106.29 1ocz h GLY 234 Ca 0.46 -0.06 -0.31 0.00 0.00 0.00 0.00 47.33 47.41 1ocz h GLY 234 CO -0.21 -0.02 -1.62 -2.75 0.00 0.00 0.00 176.54 171.93 1ocz h PHE 235 N 0.13 0.39 0.47 5.60 3.57 -1.31 -1.90 116.94 123.90 1ocz h PHE 235 Ca 0.48 -0.28 -0.02 0.00 3.53 0.00 0.00 57.97 61.67 1ocz h PHE 235 Cb 1.68 -0.02 0.00 0.00 2.79 0.00 0.00 35.95 40.41 1ocz h PHE 235 CO -0.00 1.39 -0.23 0.93 -2.23 0.00 0.00 178.31 178.17 1ocz h GLU 236 N 0.06 -0.61 -0.90 1.11 4.39 -0.31 0.24 114.58 118.56 1ocz h GLU 236 Ca -0.27 0.04 0.09 0.00 0.34 0.00 0.00 59.36 59.55 1ocz h GLU 236 Cb 2.02 0.14 -0.07 0.00 -0.10 0.00 0.00 28.75 30.73 1ocz h GLU 236 CO 0.14 -0.39 0.55 0.00 -1.16 0.00 0.00 179.01 178.15 1ocz h ALA 237 N -0.17 1.29 -0.68 3.43 0.00 -0.48 0.28 119.26 122.93 1ocz h ALA 237 Ca -0.07 0.01 0.01 0.00 0.00 0.00 0.00 54.91 54.86 1ocz h ALA 237 Cb 0.51 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 18.06 1ocz h ALA 237 CO 0.11 0.23 0.45 0.78 0.00 0.00 0.00 179.25 180.82 1ocz h GLY 238 N 0.95 0.96 1.74 0.00 0.00 -1.03 -1.36 103.07 104.33 1ocz h GLY 238 Ca 0.42 -0.36 -0.12 0.00 0.00 0.00 0.00 47.33 47.28 1ocz h GLY 238 CO -0.22 0.35 -0.44 0.00 0.00 0.00 0.00 176.54 176.22 1ocz h ALA 239 N 1.25 1.02 0.01 3.60 0.00 0.10 -1.06 119.26 124.19 1ocz h ALA 239 Ca 0.25 -0.44 -0.00 0.00 0.00 0.00 0.00 54.91 54.72 1ocz h ALA 239 Cb -0.10 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.59 1ocz h ALA 239 CO -0.06 0.62 -0.01 -1.49 0.00 0.00 0.00 179.25 178.32 1ocz h TRP 240 N 0.24 -0.01 -0.92 0.00 6.55 -0.74 -0.99 115.95 120.07 1ocz h TRP 240 Ca 0.02 -0.00 -0.01 0.00 0.95 0.00 0.00 58.89 59.84 1ocz h TRP 240 Cb 0.88 0.00 -0.04 0.00 -0.86 0.00 0.00 29.16 29.14 1ocz h TRP 240 CO 0.02 0.30 0.53 -0.92 -1.05 0.00 0.00 178.44 177.32 1ocz h TYR 241 N -0.33 1.24 -0.28 0.49 3.20 -1.16 -0.75 116.97 119.37 1ocz h TYR 241 Ca -0.00 -0.02 -0.01 0.00 3.14 0.00 0.00 58.73 61.84 1ocz h TYR 241 Cb 0.33 -0.40 -0.01 0.00 1.54 0.00 0.00 36.73 38.18 1ocz h TYR 241 CO 0.03 0.84 0.14 2.35 -1.64 0.00 0.00 178.16 179.88 1ocz h TRP 242 N 1.28 0.40 -0.31 -3.82 2.91 -1.03 0.25 115.95 115.63 1ocz h TRP 242 Ca 0.33 -0.02 -0.01 0.00 1.13 0.00 0.00 58.89 60.32 1ocz h TRP 242 Cb -0.01 -0.12 -0.02 0.00 -0.51 0.00 0.00 29.16 28.50 1ocz h TRP 242 CO 0.01 0.36 0.13 0.45 -1.03 0.00 0.00 178.44 178.36 1ocz h HIS 243 N 0.32 0.42 -0.20 2.65 3.86 -0.66 -1.18 115.15 120.35 1ocz h HIS 243 Ca 0.10 -0.01 -0.01 0.00 -1.16 0.00 0.00 60.37 59.28 1ocz h HIS 243 Cb 0.11 -0.14 -0.01 0.00 1.06 0.00 0.00 27.41 28.44 1ocz h HIS 243 CO -0.02 0.33 0.07 0.35 0.86 0.00 0.00 177.93 179.52 1ocz h PHE 244 N 0.43 0.32 -0.61 2.45 3.57 -0.45 -2.48 116.94 120.17 1ocz h PHE 244 Ca 0.11 -0.03 0.07 0.00 3.53 0.00 0.00 57.97 61.65 1ocz h PHE 244 Cb 0.08 -0.09 -0.04 0.00 2.79 0.00 0.00 35.95 38.69 1ocz h PHE 244 CO 0.00 0.39 0.40 0.28 -2.23 0.00 0.00 178.31 177.16 1ocz h VAL 245 N 0.16 0.96 0.52 1.41 2.07 0.19 -1.56 116.25 120.01 1ocz h VAL 245 Ca 0.07 -0.18 -0.03 0.00 0.82 0.00 0.00 66.70 67.38 1ocz h VAL 245 Cb 0.21 0.38 0.01 0.00 -1.52 0.00 0.00 31.29 30.37 1ocz h VAL 245 CO -0.00 0.10 -0.25 0.44 0.02 0.00 0.00 177.57 177.87 1ocz h ASP 246 N 0.54 -0.59 -0.97 0.57 3.32 -1.05 -3.00 116.42 115.23 1ocz h ASP 246 Ca 0.27 -0.03 0.26 0.00 0.02 0.00 0.00 57.03 57.55 1ocz h ASP 246 Cb 0.37 0.15 -0.13 0.00 0.22 0.00 0.00 39.33 39.94 1ocz h ASP 246 CO -0.08 -0.19 0.52 0.58 -1.72 0.00 0.00 179.24 178.34 1ocz h VAL 247 N -1.12 0.44 -0.37 -1.35 2.07 -1.21 0.48 116.25 115.21 1ocz h VAL 247 Ca -0.07 -0.15 -0.02 0.00 0.82 0.00 0.00 66.70 67.28 1ocz h VAL 247 Cb 0.59 -0.04 -0.02 0.00 -1.52 0.00 0.00 31.29 30.30 1ocz h VAL 247 CO 0.12 0.08 0.16 0.58 0.02 0.00 0.00 177.57 178.53 1ocz h VAL 248 N 0.45 1.18 -0.44 2.57 2.07 -1.35 -2.04 116.25 118.68 1ocz h VAL 248 Ca 0.64 -0.54 -0.01 0.00 0.82 0.00 0.00 66.70 67.62 1ocz h VAL 248 Cb 1.30 0.86 -0.02 0.00 -1.52 0.00 0.00 31.29 31.90 1ocz h VAL 248 CO -0.54 0.19 0.24 -0.25 0.02 0.00 0.00 177.57 177.24 1ocz h TRP 249 N 0.45 0.59 -0.20 1.57 2.91 -0.09 0.03 115.95 121.20 1ocz h TRP 249 Ca 0.12 -0.00 -0.06 0.00 1.13 0.00 0.00 58.89 60.08 1ocz h TRP 249 Cb 0.16 -0.19 -0.01 0.00 -0.51 0.00 0.00 29.16 28.60 1ocz h TRP 249 CO -0.01 0.42 -0.15 -0.07 -1.03 0.00 0.00 178.44 177.60 1ocz h LEU 250 N 0.61 0.31 -0.07 0.65 3.38 -0.07 -0.20 115.31 119.93 1ocz h LEU 250 Ca 0.16 -0.07 -0.24 0.00 0.09 0.00 0.00 57.88 57.81 1ocz h LEU 250 Cb 0.02 -0.08 0.00 0.00 0.09 0.00 0.00 40.66 40.69 1ocz h LEU 250 CO -0.03 0.49 -1.06 -0.26 0.09 0.00 0.00 178.44 177.68 1ocz h PHE 251 N 0.31 0.54 -0.13 1.13 0.04 -0.50 -2.55 116.94 115.77 1ocz h PHE 251 Ca 0.06 -0.33 -0.04 0.00 2.80 0.00 0.00 57.97 60.45 1ocz h PHE 251 Cb 0.45 -0.05 -0.00 0.00 2.20 0.00 0.00 35.95 38.55 1ocz h PHE 251 CO 0.01 1.19 -0.09 -0.07 -0.60 0.00 0.00 178.31 178.75 1ocz h LEU 252 N 0.16 0.30 -0.04 1.54 3.38 -0.92 -2.44 115.31 117.30 1ocz h LEU 252 Ca -0.10 -0.44 0.04 0.00 0.09 0.00 0.00 57.88 57.47 1ocz h LEU 252 Cb 1.73 -0.08 -0.05 0.00 0.09 0.00 0.00 40.66 42.34 1ocz h LEU 252 CO 0.18 0.68 -0.31 0.22 0.09 0.00 0.00 178.44 179.29 1ocz h TYR 253 N -0.07 -0.86 -0.34 1.13 3.20 -1.04 0.30 116.97 119.28 1ocz h TYR 253 Ca 0.03 0.03 -0.06 0.00 3.14 0.00 0.00 58.73 61.87 1ocz h TYR 253 Cb 0.57 0.39 -0.02 0.00 1.54 0.00 0.00 36.73 39.21 1ocz h TYR 253 CO 0.07 -0.40 -0.02 0.28 -1.64 0.00 0.00 178.16 176.45 1ocz h VAL 254 N -0.44 1.21 0.00 1.81 2.07 -1.52 -1.81 116.25 117.56 1ocz h VAL 254 Ca 0.07 -0.85 0.00 0.00 0.82 0.00 0.00 66.70 66.74 1ocz h VAL 254 Cb 0.55 0.98 0.00 0.00 -1.52 0.00 0.00 31.29 31.29 1ocz h VAL 254 CO -0.29 0.29 -0.17 0.28 0.02 0.00 0.00 177.57 177.71 1ocz h SER 255 N 0.52 0.00 0.11 0.57 0.02 -1.01 -2.66 113.55 111.10 1ocz h SER 255 Ca 0.11 0.00 -0.17 0.00 -0.84 0.00 0.00 61.79 60.88 1ocz h SER 255 Cb 0.37 0.00 0.01 0.00 0.14 0.00 0.00 62.40 62.92 1ocz h SER 255 CO 0.01 0.51 -0.80 0.40 -1.14 0.00 0.00 176.83 175.81 1ocz h ILE 256 N -0.86 1.46 0.06 3.27 2.04 -1.11 0.49 117.51 122.86 1ocz h ILE 256 Ca 0.00 -2.47 -0.26 0.00 1.00 0.00 0.00 64.86 63.13 1ocz h ILE 256 Cb 0.17 3.12 0.01 0.00 -0.74 0.00 0.00 36.82 39.37 1ocz h ILE 256 CO 0.00 0.68 -1.10 1.88 0.00 0.00 0.00 178.15 179.61 1ocz h TYR 257 N -0.48 0.72 0.00 1.37 -1.99 -1.42 -3.30 116.97 111.87 1ocz h TYR 257 Ca -0.15 -0.44 0.00 0.00 2.00 0.00 0.00 58.73 60.14 1ocz h TYR 257 Cb 1.55 -0.06 0.00 0.00 2.00 0.00 0.00 36.73 40.21 1ocz h TYR 257 CO 0.19 1.29 0.00 1.87 -0.00 0.00 0.00 178.16 181.51 1ocz n TRP 258 N -3.72 0.00 0.02 4.88 -0.00 -0.69 -4.31 117.44 113.62 1ocz n TRP 258 Ca -0.09 0.00 -0.11 0.00 -0.00 0.00 0.00 57.50 57.30 1ocz n TRP 258 Cb 0.92 -0.01 -0.06 0.00 -0.00 0.00 0.00 31.31 32.17 1ocz n TRP 258 CO 0.00 0.00 0.00 2.35 -0.00 0.00 0.00 177.69 180.04 1ocz h TRP 259 N 0.00 -0.03 0.00 5.87 7.01 -1.57 -2.90 115.95 124.33 1ocz h TRP 259 Ca 0.00 0.00 0.00 0.00 2.11 0.00 0.00 58.89 61.00 1ocz h TRP 259 Cb 0.00 0.02 0.00 0.00 -2.10 0.00 0.00 29.16 27.08 1ocz h TRP 259 CO 0.00 -0.02 0.00 0.41 -2.79 0.00 0.00 178.44 176.04 1ocz n GLY 260 N -1.12 1.18 0.00 2.65 0.00 0.17 -5.00 105.19 103.07 1ocz n GLY 260 Ca -0.06 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.96 1ocz n GLY 260 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76