#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 -2.49 2.03 -1.04 -1.26 -4.66 114.28 106.86 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 3.02 0.18 -1.42 5.65 -1.26 -4.97 115.29 116.48 1ocz s HIS 3 Ca 0.00 1.16 -0.30 0.00 0.25 0.00 0.00 55.06 56.17 1ocz s HIS 3 Cb 0.00 -3.43 -0.08 0.00 -1.18 0.00 0.00 32.58 27.89 1ocz s HIS 3 CO 0.00 -1.32 1.13 1.14 -0.65 0.00 0.00 174.74 175.05 1ocz s GLN 4 N 3.29 4.56 -0.25 2.88 -2.07 -1.26 -4.94 119.66 121.86 1ocz s GLN 4 Ca 0.52 1.77 0.12 0.00 -1.82 0.00 0.00 55.36 55.95 1ocz s GLN 4 Cb -0.20 -3.27 0.57 0.00 -1.09 0.00 0.00 33.01 29.03 1ocz s GLN 4 CO 0.13 0.02 1.54 0.25 -1.32 0.00 0.00 175.29 175.90 1ocz n THR 5 N 2.43 2.54 -4.44 3.63 -2.24 -1.26 -4.97 114.28 109.97 1ocz n THR 5 Ca 0.03 -2.10 -0.30 0.00 -2.27 0.00 0.00 64.05 59.41 1ocz n THR 5 Cb 0.46 -0.31 -0.11 0.00 -2.10 0.00 0.00 70.33 68.27 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 -3.01 2.62 -1.72 4.78 0.00 -1.26 -5.03 115.29 111.66 1ocz s HIS 6 Ca 0.46 -0.21 0.00 0.00 -3.00 0.00 0.00 55.06 52.31 1ocz s HIS 6 Cb 0.39 -1.44 0.00 0.00 -4.00 0.00 0.00 32.58 27.53 1ocz s HIS 6 CO 0.07 0.34 0.85 0.00 -1.00 0.00 0.00 174.74 175.00 1ocz n ALA 7 N 1.15 2.48 -2.07 -1.38 0.00 -1.26 -4.90 120.51 114.53 1ocz n ALA 7 Ca -0.15 0.00 -0.28 0.00 0.00 0.00 0.00 53.44 53.01 1ocz n ALA 7 Cb 0.52 -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 -1.72 3.38 -0.23 0.00 2.02 -1.26 -4.47 117.35 115.07 1ocz s TYR 8 Ca 0.00 0.83 -0.10 0.00 -0.37 0.00 0.00 57.07 57.43 1ocz s TYR 8 Cb 0.00 -2.69 -0.05 0.00 -0.40 0.00 0.00 41.96 38.82 1ocz s TYR 8 CO 0.00 -0.74 0.13 -1.58 -1.57 0.00 0.00 175.55 171.79 1ocz s HIS 9 N -3.02 3.30 -0.54 2.71 5.04 -1.26 -5.05 115.29 116.46 1ocz s HIS 9 Ca 0.53 0.17 -0.09 0.00 -1.54 0.00 0.00 55.06 54.14 1ocz s HIS 9 Cb -0.11 -2.22 0.14 0.00 0.04 0.00 0.00 32.58 30.43 1ocz s HIS 9 CO 0.47 0.08 0.42 -1.64 -2.34 0.00 0.00 174.74 171.73 1ocz s MET 10 N 0.89 2.64 0.17 2.88 -1.94 -1.26 -5.07 119.30 117.62 1ocz s MET 10 Ca 0.07 -1.98 -0.30 0.00 -1.71 0.00 0.00 55.69 51.77 1ocz s MET 10 Cb -0.13 -3.97 -0.08 0.00 2.01 0.00 0.00 34.83 32.66 1ocz s MET 10 CO 0.03 -1.21 1.25 0.54 -0.01 0.00 0.00 175.02 175.62 1ocz s VAL 11 N 0.98 3.49 0.70 -6.03 0.11 -1.26 -4.99 120.40 113.39 1ocz s VAL 11 Ca 0.09 1.21 -0.16 0.00 -2.93 0.00 0.00 61.98 60.19 1ocz s VAL 11 Cb -0.23 -3.77 0.02 0.00 -1.53 0.00 0.00 36.38 30.87 1ocz s VAL 11 CO -0.02 0.17 1.22 0.20 -3.33 0.00 0.00 175.10 173.34 1ocz s ASN 12 N 0.36 4.38 0.29 3.54 0.02 -1.26 -4.91 114.94 117.37 1ocz s ASN 12 Ca 0.55 2.39 -0.28 0.00 -1.02 0.00 0.00 52.86 54.50 1ocz s ASN 12 Cb -0.34 -2.59 -0.14 0.00 0.02 0.00 0.00 41.25 38.20 1ocz s ASN 12 CO 0.36 -2.14 1.07 -2.65 0.02 0.00 0.00 177.10 173.76 1ocz n PRO 13 N -2.48 1.49 -4.54 -0.60 -0.02 -1.26 -4.97 135.00 122.61 1ocz n PRO 13 Ca 0.14 0.52 -0.21 0.00 -2.02 0.00 0.00 63.50 61.93 1ocz n PRO 13 Cb 0.50 -1.93 -0.15 0.00 -0.02 0.00 0.00 33.50 31.90 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 -0.49 1.58 0.00 2.55 0.15 -1.26 -5.03 113.70 111.20 1ocz s SER 14 Ca 0.59 -0.29 0.27 0.00 0.70 0.00 0.00 55.95 57.22 1ocz s SER 14 Cb -0.68 -0.16 0.98 0.00 -1.71 0.00 0.00 66.02 64.45 1ocz s SER 14 CO 0.60 0.13 1.70 -0.81 1.20 0.00 0.00 173.24 176.07 1ocz n PRO 15 N 2.55 1.72 -0.09 5.44 -0.04 -1.26 -4.46 135.00 138.85 1ocz n PRO 15 Ca -0.15 -1.04 0.01 0.00 -0.04 0.00 0.00 63.50 62.28 1ocz n PRO 15 Cb 0.55 -1.48 0.30 0.00 -0.04 0.00 0.00 33.50 32.84 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 2.52 0.72 -0.46 0.54 -0.00 -1.96 -2.08 115.95 115.24 1ocz h TRP 16 Ca 0.00 -0.01 -0.12 0.00 -0.00 0.00 0.00 58.89 58.76 1ocz h TRP 16 Cb 0.54 -0.23 -0.01 0.00 -0.00 0.00 0.00 29.16 29.45 1ocz h TRP 16 CO 0.00 0.52 -0.19 -1.35 -0.00 0.00 0.00 178.44 177.42 1ocz h PRO 17 N 0.74 0.91 -0.04 0.49 0.11 -1.98 0.57 132.00 132.80 1ocz h PRO 17 Ca 0.19 -0.37 -0.01 0.00 0.11 0.00 0.00 66.00 65.92 1ocz h PRO 17 Cb 0.05 -0.04 -0.00 0.00 0.11 0.00 0.00 31.00 31.12 1ocz h PRO 17 CO -0.03 1.02 0.00 1.25 -0.21 0.00 0.00 178.00 180.04 1ocz h LEU 18 N 0.80 0.06 -1.39 2.35 7.12 -1.78 0.23 115.31 122.69 1ocz h LEU 18 Ca 0.11 -0.28 -0.06 0.00 0.13 0.00 0.00 57.88 57.78 1ocz h LEU 18 Cb 0.74 -0.02 -0.01 0.00 -0.53 0.00 0.00 40.66 40.85 1ocz h LEU 18 CO 0.06 0.33 -0.30 0.71 -0.13 0.00 0.00 178.44 179.10 1ocz h THR 19 N -0.21 1.21 -0.00 1.05 1.35 -1.38 0.21 112.91 115.14 1ocz h THR 19 Ca 0.01 -1.04 -0.17 0.00 -0.55 0.00 0.00 66.41 64.65 1ocz h THR 19 Cb 0.29 1.56 -0.02 0.00 -1.73 0.00 0.00 68.15 68.26 1ocz h THR 19 CO 0.00 0.30 -0.80 1.23 -0.25 0.00 0.00 175.52 176.00 1ocz h GLY 20 N 0.92 0.10 0.55 5.82 0.00 -0.64 0.13 103.07 109.95 1ocz h GLY 20 Ca -0.00 -0.18 -0.01 0.00 0.00 0.00 0.00 47.33 47.14 1ocz h GLY 20 CO 0.04 0.15 -0.02 0.00 0.00 0.00 0.00 176.54 176.71 1ocz h ALA 21 N 1.13 0.03 -0.66 3.60 0.00 0.25 -2.47 119.26 121.14 1ocz h ALA 21 Ca -0.02 -0.26 0.07 0.00 0.00 0.00 0.00 54.91 54.70 1ocz h ALA 21 Cb 1.40 -0.01 -0.04 0.00 0.00 0.00 0.00 17.79 19.14 1ocz h ALA 21 CO 0.11 -0.20 0.43 -0.07 0.00 0.00 0.00 179.25 179.52 1ocz h LEU 22 N -0.42 0.56 -1.11 0.00 4.07 -0.58 -1.13 115.31 116.69 1ocz h LEU 22 Ca 0.00 0.00 -0.06 0.00 0.08 0.00 0.00 57.88 57.91 1ocz h LEU 22 Cb 0.52 -0.12 -0.02 0.00 1.08 0.00 0.00 40.66 42.12 1ocz h LEU 22 CO 0.01 0.36 0.02 0.28 -1.08 0.00 0.00 178.44 178.02 1ocz h SER 23 N 0.63 0.61 -0.36 -0.43 0.02 -0.54 -1.11 113.55 112.37 1ocz h SER 23 Ca 0.29 -0.12 -0.10 0.00 -0.84 0.00 0.00 61.79 61.02 1ocz h SER 23 Cb 0.31 -0.16 -0.02 0.00 0.14 0.00 0.00 62.40 62.68 1ocz h SER 23 CO -0.09 0.66 -0.12 0.00 -1.14 0.00 0.00 176.83 176.14 1ocz h ALA 24 N 1.41 0.95 0.65 3.77 0.00 -0.74 -1.06 119.26 124.23 1ocz h ALA 24 Ca 0.13 -0.33 -0.03 0.00 0.00 0.00 0.00 54.91 54.68 1ocz h ALA 24 Cb 0.36 -0.17 0.01 0.00 0.00 0.00 0.00 17.79 17.98 1ocz h ALA 24 CO 0.01 0.62 -0.31 1.25 0.00 0.00 0.00 179.25 180.82 1ocz h LEU 25 N 0.73 -0.73 -0.65 0.00 5.85 -1.19 -0.99 115.31 118.32 1ocz h LEU 25 Ca 0.12 -0.02 0.12 0.00 0.84 0.00 0.00 57.88 58.94 1ocz h LEU 25 Cb 0.62 0.19 -0.12 0.00 0.37 0.00 0.00 40.66 41.72 1ocz h LEU 25 CO 0.04 -0.39 -0.31 -0.07 -0.34 0.00 0.00 178.44 177.37 1ocz h LEU 26 N -1.10 -1.10 -0.49 2.25 4.07 -1.16 0.11 115.31 117.89 1ocz h LEU 26 Ca -0.09 0.23 -0.07 0.00 0.08 0.00 0.00 57.88 58.04 1ocz h LEU 26 Cb 0.71 0.57 -0.02 0.00 1.08 0.00 0.00 40.66 43.00 1ocz h LEU 26 CO 0.15 -0.29 0.03 0.24 -1.08 0.00 0.00 178.44 177.49 1ocz h MET 27 N -0.12 0.84 -0.14 1.13 2.86 -1.18 0.46 114.93 118.78 1ocz h MET 27 Ca 0.26 -0.25 -0.08 0.00 -2.06 0.00 0.00 59.70 57.58 1ocz h MET 27 Cb 0.55 -0.08 -0.00 0.00 0.06 0.00 0.00 31.60 32.13 1ocz h MET 27 CO -0.72 0.86 -0.21 1.79 1.06 0.00 0.00 176.91 179.69 1ocz h THR 28 N 0.70 1.36 0.00 2.22 1.35 -0.57 0.16 112.91 118.13 1ocz h THR 28 Ca 0.14 -1.44 -0.02 0.00 -0.55 0.00 0.00 66.41 64.55 1ocz h THR 28 Cb 0.46 1.97 -0.00 0.00 -1.73 0.00 0.00 68.15 68.85 1ocz h THR 28 CO 0.02 0.42 -0.10 0.77 -0.25 0.00 0.00 175.52 176.39 1ocz h SER 29 N -0.00 0.00 -0.36 5.36 4.64 -1.05 -2.60 113.55 119.53 1ocz h SER 29 Ca 0.01 0.00 -0.15 0.00 -0.47 0.00 0.00 61.79 61.18 1ocz h SER 29 Cb 0.78 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.86 1ocz h SER 29 CO 0.05 0.10 -0.36 1.23 -0.87 0.00 0.00 176.83 176.98 1ocz h GLY 30 N 2.81 0.99 2.00 -0.77 0.00 0.24 -2.60 103.07 105.74 1ocz h GLY 30 Ca -0.00 -0.98 -0.08 0.00 0.00 0.00 0.00 47.33 46.27 1ocz h GLY 30 CO 0.01 0.89 -0.38 1.41 0.00 0.00 0.00 176.54 178.47 1ocz h LEU 31 N 0.75 0.00 -0.35 3.11 3.38 -0.45 -2.80 115.31 118.95 1ocz h LEU 31 Ca 0.07 0.00 -0.17 0.00 0.09 0.00 0.00 57.88 57.87 1ocz h LEU 31 Cb 0.94 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.69 1ocz h LEU 31 CO 0.09 0.38 -0.46 0.74 0.09 0.00 0.00 178.44 179.28 1ocz h THR 32 N 0.00 1.27 -0.41 0.22 2.02 -1.21 -0.05 112.91 114.75 1ocz h THR 32 Ca -0.00 -1.63 -0.03 0.00 0.77 0.00 0.00 66.41 65.51 1ocz h THR 32 Cb 0.75 1.48 -0.02 0.00 -1.74 0.00 0.00 68.15 68.62 1ocz h THR 32 CO 0.05 0.54 0.15 0.24 0.37 0.00 0.00 175.52 176.87 1ocz h MET 33 N 0.73 0.63 0.48 6.66 2.86 -1.33 -1.44 114.93 123.52 1ocz h MET 33 Ca 0.04 -0.13 -0.01 0.00 -2.06 0.00 0.00 59.70 57.54 1ocz h MET 33 Cb 1.06 -0.10 -0.01 0.00 0.06 0.00 0.00 31.60 32.61 1ocz h MET 33 CO 0.11 0.61 -0.34 2.35 1.06 0.00 0.00 176.91 180.70 1ocz h TRP 34 N 0.53 -0.91 -0.06 -0.22 7.01 -1.19 0.26 115.95 121.36 1ocz h TRP 34 Ca 0.14 -0.00 0.02 0.00 2.11 0.00 0.00 58.89 61.15 1ocz h TRP 34 Cb 0.23 0.34 -0.00 0.00 -2.10 0.00 0.00 29.16 27.63 1ocz h TRP 34 CO 0.01 -0.51 0.07 0.74 -2.79 0.00 0.00 178.44 175.96 1ocz h PHE 35 N -0.80 0.00 0.00 2.65 0.04 -0.93 -3.24 116.94 114.67 1ocz h PHE 35 Ca -0.05 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.72 1ocz h PHE 35 Cb 0.67 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.82 1ocz h PHE 35 CO -0.14 0.00 0.00 0.72 -0.60 0.00 0.00 178.31 178.29 1ocz n HIS 36 N -3.81 0.00 -0.94 -0.55 8.25 -0.55 -4.78 115.22 112.83 1ocz n HIS 36 Ca -0.02 0.00 -0.11 0.00 -0.26 0.00 0.00 57.72 57.34 1ocz n HIS 36 Cb 0.16 0.00 -0.15 0.00 1.12 0.00 0.00 29.99 31.12 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 -1.55 0.01 -0.12 4.41 3.01 0.81 -4.85 117.46 119.19 1ocz n PHE 37 Ca 0.00 -1.44 0.00 0.00 1.01 0.00 0.00 57.45 57.02 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 2.37 0.00 -3.63 4.37 4.05 -0.63 -4.71 115.26 117.08 1ocz n ASN 38 Ca 0.38 0.00 -0.12 0.00 0.45 0.00 0.00 54.58 55.29 1ocz n ASN 38 Cb 0.87 0.00 -0.07 0.00 1.23 0.00 0.00 39.78 41.81 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 -0.71 0.00 1.20 0.15 -1.21 -4.93 113.70 108.20 1ocz s SER 39 Ca 0.00 1.34 0.13 0.00 0.70 0.00 0.00 55.95 58.12 1ocz s SER 39 Cb 0.00 1.35 0.27 0.00 -1.71 0.00 0.00 66.02 65.93 1ocz s SER 39 CO 0.00 -0.23 1.16 0.23 1.20 0.00 0.00 173.24 175.60 1ocz n MET 40 N 2.76 2.05 0.22 5.44 2.81 -1.26 -2.30 117.12 126.85 1ocz n MET 40 Ca -0.14 -1.82 -0.15 0.00 -1.81 0.00 0.00 57.70 53.77 1ocz n MET 40 Cb 0.56 -1.30 -0.07 0.00 -0.71 0.00 0.00 33.22 31.69 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 2.55 0.47 -0.50 2.03 1.35 -1.98 -1.60 112.91 115.23 1ocz h THR 41 Ca 0.00 0.00 0.08 0.00 -0.55 0.00 0.00 66.41 65.94 1ocz h THR 41 Cb 0.69 0.47 -0.06 0.00 -1.73 0.00 0.00 68.15 67.52 1ocz h THR 41 CO 0.00 0.00 0.15 0.25 -0.25 0.00 0.00 175.52 175.67 1ocz h LEU 42 N -0.60 0.10 -1.47 3.87 5.85 -1.88 -0.20 115.31 120.99 1ocz h LEU 42 Ca -0.03 0.07 0.04 0.00 0.84 0.00 0.00 57.88 58.80 1ocz h LEU 42 Cb 0.51 0.08 -0.03 0.00 0.37 0.00 0.00 40.66 41.59 1ocz h LEU 42 CO 0.01 0.08 0.40 0.25 -0.34 0.00 0.00 178.44 178.85 1ocz h LEU 43 N 0.30 0.59 -0.34 2.25 5.85 -1.69 0.15 115.31 122.43 1ocz h LEU 43 Ca 0.25 -0.01 -0.07 0.00 0.84 0.00 0.00 57.88 58.90 1ocz h LEU 43 Cb 0.30 -0.14 -0.01 0.00 0.37 0.00 0.00 40.66 41.18 1ocz h LEU 43 CO -0.28 0.41 -0.05 0.24 -0.34 0.00 0.00 178.44 178.41 1ocz h MET 44 N 0.69 0.63 -0.64 1.25 2.86 -0.05 -0.85 114.93 118.81 1ocz h MET 44 Ca 0.25 -0.22 -0.03 0.00 -2.06 0.00 0.00 59.70 57.63 1ocz h MET 44 Cb 0.12 -0.04 -0.03 0.00 0.06 0.00 0.00 31.60 31.71 1ocz h MET 44 CO -0.07 0.78 0.29 0.82 1.06 0.00 0.00 176.91 179.80 1ocz h ILE 45 N 0.42 1.23 0.29 -1.22 2.04 -0.35 -2.37 117.51 117.55 1ocz h ILE 45 Ca 0.09 -0.66 -0.01 0.00 1.00 0.00 0.00 64.86 65.28 1ocz h ILE 45 Cb 0.53 0.46 0.00 0.00 -0.74 0.00 0.00 36.82 37.08 1ocz h ILE 45 CO 0.03 0.27 -0.14 1.23 0.00 0.00 0.00 178.15 179.53 1ocz h GLY 46 N 0.89 -0.41 1.37 5.37 0.00 -0.57 -1.28 103.07 108.44 1ocz h GLY 46 Ca 0.22 0.15 0.08 0.00 0.00 0.00 0.00 47.33 47.78 1ocz h GLY 46 CO -0.02 -0.15 0.25 1.41 0.00 0.00 0.00 176.54 178.02 1ocz h LEU 47 N -0.49 0.11 0.31 3.11 3.38 -1.11 -0.90 115.31 119.72 1ocz h LEU 47 Ca -0.04 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.92 1ocz h LEU 47 Cb 0.36 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 41.10 1ocz h LEU 47 CO 0.07 0.07 -0.15 0.74 0.09 0.00 0.00 178.44 179.26 1ocz h THR 48 N 0.12 0.00 -1.00 0.22 2.02 -1.03 -1.74 112.91 111.50 1ocz h THR 48 Ca 0.16 -0.41 0.24 0.00 0.77 0.00 0.00 66.41 67.17 1ocz h THR 48 Cb 0.50 0.00 -0.09 0.00 -1.74 0.00 0.00 68.15 66.81 1ocz h THR 48 CO -0.02 0.00 0.64 0.71 0.37 0.00 0.00 175.52 177.22 1ocz h THR 49 N -0.83 0.59 0.46 3.16 1.35 -1.11 -0.51 112.91 116.02 1ocz h THR 49 Ca -0.04 -0.17 -0.02 0.00 -0.55 0.00 0.00 66.41 65.63 1ocz h THR 49 Cb 0.32 0.07 0.00 0.00 -1.73 0.00 0.00 68.15 66.81 1ocz h THR 49 CO 0.07 0.09 -0.22 -1.13 -0.25 0.00 0.00 175.52 174.08 1ocz h ASN 50 N 0.48 -0.53 -0.82 5.36 -1.24 -1.16 0.15 115.58 117.84 1ocz h ASN 50 Ca 0.57 -0.02 0.08 0.00 0.71 0.00 0.00 56.30 57.64 1ocz h ASN 50 Cb 1.30 0.14 -0.07 0.00 0.73 0.00 0.00 38.32 40.42 1ocz h ASN 50 CO -0.30 -0.32 0.48 0.24 -1.29 0.00 0.00 177.43 176.24 1ocz h MET 51 N -0.69 0.81 -0.25 6.67 2.86 -0.32 -0.99 114.93 123.03 1ocz h MET 51 Ca -0.06 -0.05 0.01 0.00 -2.06 0.00 0.00 59.70 57.54 1ocz h MET 51 Cb 0.51 -0.18 -0.02 0.00 0.06 0.00 0.00 31.60 31.97 1ocz h MET 51 CO 0.10 0.54 0.15 -0.07 1.06 0.00 0.00 176.91 178.69 1ocz h LEU 52 N 0.84 0.24 0.96 1.22 3.38 -0.85 -0.30 115.31 120.80 1ocz h LEU 52 Ca 0.38 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 58.30 1ocz h LEU 52 Cb 0.28 -0.05 0.01 0.00 0.09 0.00 0.00 40.66 40.99 1ocz h LEU 52 CO -0.22 0.18 -0.46 0.74 0.09 0.00 0.00 178.44 178.77 1ocz h THR 53 N 0.31 0.03 -1.00 0.22 2.02 -0.25 -2.28 112.91 111.96 1ocz h THR 53 Ca 0.10 -0.03 0.17 0.00 0.77 0.00 0.00 66.41 67.42 1ocz h THR 53 Cb -0.01 0.03 -0.10 0.00 -1.74 0.00 0.00 68.15 66.34 1ocz h THR 53 CO -0.04 0.00 0.62 0.24 0.37 0.00 0.00 175.52 176.70 1ocz h MET 54 N -1.32 0.78 -0.38 6.66 2.86 -1.14 0.12 114.93 122.50 1ocz h MET 54 Ca -0.13 -0.05 -0.02 0.00 -2.06 0.00 0.00 59.70 57.44 1ocz h MET 54 Cb 0.99 -0.18 -0.02 0.00 0.06 0.00 0.00 31.60 32.46 1ocz h MET 54 CO 0.22 0.51 0.17 -0.92 1.06 0.00 0.00 176.91 177.96 1ocz h TYR 55 N 0.80 0.57 -0.04 -0.22 3.20 -0.90 -2.28 116.97 118.11 1ocz h TYR 55 Ca 0.55 -0.03 -0.20 0.00 3.14 0.00 0.00 58.73 62.19 1ocz h TYR 55 Cb 0.80 -0.17 -0.00 0.00 1.54 0.00 0.00 36.73 38.90 1ocz h TYR 55 CO -0.00 0.49 -0.82 1.96 -1.64 0.00 0.00 178.16 178.15 1ocz h GLN 56 N 0.48 0.37 -0.04 1.82 4.20 -0.69 -1.60 115.11 119.65 1ocz h GLN 56 Ca 0.13 -0.34 -0.01 0.00 0.06 0.00 0.00 58.65 58.49 1ocz h GLN 56 Cb 0.14 0.08 -0.00 0.00 0.30 0.00 0.00 27.48 28.01 1ocz h GLN 56 CO -0.01 1.00 0.00 2.35 -0.67 0.00 0.00 178.83 181.50 1ocz h TRP 57 N 0.23 0.08 0.00 2.96 2.91 -0.72 -1.30 115.95 120.11 1ocz h TRP 57 Ca -0.05 -0.01 -0.09 0.00 1.13 0.00 0.00 58.89 59.86 1ocz h TRP 57 Cb 1.42 -0.02 -0.01 0.00 -0.51 0.00 0.00 29.16 30.03 1ocz h TRP 57 CO 0.05 0.35 -0.45 -1.49 -1.03 0.00 0.00 178.44 175.86 1ocz h TRP 58 N -0.21 0.00 -0.16 2.65 6.55 -1.48 -1.52 115.95 121.79 1ocz h TRP 58 Ca 0.01 0.00 0.02 0.00 0.95 0.00 0.00 58.89 59.88 1ocz h TRP 58 Cb 0.31 0.00 -0.02 0.00 -0.86 0.00 0.00 29.16 28.59 1ocz h TRP 58 CO 0.03 0.45 0.01 -0.09 -1.05 0.00 0.00 178.44 177.79 1ocz h ARG 59 N 0.00 0.07 -0.20 0.49 2.43 -0.91 0.18 114.38 116.44 1ocz h ARG 59 Ca -0.00 -0.00 -0.00 0.00 -0.81 0.00 0.00 59.98 59.16 1ocz h ARG 59 Cb 0.80 -0.02 -0.01 0.00 -0.42 0.00 0.00 29.97 30.32 1ocz h ARG 59 CO 0.06 0.04 0.12 -0.44 -1.51 0.00 0.00 179.97 178.24 1ocz h ASP 60 N 0.07 0.25 -0.97 -3.80 5.19 -0.97 0.05 116.42 116.23 1ocz h ASP 60 Ca 0.07 -0.06 0.21 0.00 -0.62 0.00 0.00 57.03 56.63 1ocz h ASP 60 Cb 0.08 -0.06 -0.08 0.00 0.18 0.00 0.00 39.33 39.44 1ocz h ASP 60 CO -0.11 0.23 0.62 0.58 -3.12 0.00 0.00 179.24 177.44 1ocz h VAL 61 N 0.24 0.66 -0.02 -1.35 2.07 -0.47 0.28 116.25 117.66 1ocz h VAL 61 Ca 0.07 -0.18 -0.06 0.00 0.82 0.00 0.00 66.70 67.35 1ocz h VAL 61 Cb 0.03 0.08 0.00 0.00 -1.52 0.00 0.00 31.29 29.89 1ocz h VAL 61 CO -0.01 0.10 -0.22 0.40 0.02 0.00 0.00 177.57 177.86 1ocz h ILE 62 N 0.53 1.52 -0.50 4.57 2.04 -0.44 -2.54 117.51 122.69 1ocz h ILE 62 Ca 0.53 -1.83 0.10 0.00 1.00 0.00 0.00 64.86 64.66 1ocz h ILE 62 Cb 1.14 2.64 -0.10 0.00 -0.74 0.00 0.00 36.82 39.76 1ocz h ILE 62 CO -0.27 0.50 -0.28 0.03 0.00 0.00 0.00 178.15 178.14 1ocz h ARG 63 N -0.46 -0.16 -0.16 2.37 3.08 0.10 0.43 114.38 119.59 1ocz h ARG 63 Ca -0.02 0.01 -0.03 0.00 0.07 0.00 0.00 59.98 60.01 1ocz h ARG 63 Cb 0.94 0.04 -0.01 0.00 0.08 0.00 0.00 29.97 31.01 1ocz h ARG 63 CO 0.04 -0.10 -0.03 0.93 -1.07 0.00 0.00 179.97 179.73 1ocz h GLU 64 N -0.16 0.23 0.00 0.04 5.08 -0.60 0.81 114.58 119.97 1ocz h GLU 64 Ca 0.22 -0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.54 1ocz h GLU 64 Cb 0.51 -0.04 0.00 0.00 0.50 0.00 0.00 28.75 29.72 1ocz h GLU 64 CO -0.59 0.28 -0.29 -1.13 -1.00 0.00 0.00 179.01 176.28 1ocz n SER 65 N -4.37 0.94 -0.20 1.42 3.41 0.31 -1.43 113.62 113.71 1ocz n SER 65 Ca -0.01 0.42 -0.08 0.00 -0.26 0.00 0.00 58.87 58.94 1ocz n SER 65 Cb 0.19 -0.68 0.02 0.00 -0.26 0.00 0.00 64.21 63.47 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 -0.52 1.25 0.00 6.66 2.02 -0.42 -2.94 112.91 118.96 1ocz h THR 66 Ca 0.00 -0.89 -0.21 0.00 0.77 0.00 0.00 66.41 66.09 1ocz h THR 66 Cb 0.29 0.76 -0.03 0.00 -1.74 0.00 0.00 68.15 67.43 1ocz h THR 66 CO 0.00 0.33 -1.33 0.49 0.37 0.00 0.00 175.52 175.38 1ocz n PHE 67 N -4.40 0.71 1.00 3.16 3.72 -1.04 -4.55 117.46 116.06 1ocz n PHE 67 Ca 0.02 0.31 0.12 0.00 -0.05 0.00 0.00 57.45 57.85 1ocz n PHE 67 Cb 0.24 -0.96 0.58 0.00 -0.94 0.00 0.00 39.48 38.40 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 -4.44 0.14 -1.99 -1.08 6.02 0.25 -4.94 117.38 111.33 1ocz n GLN 68 Ca -0.30 0.06 -0.17 0.00 -0.01 0.00 0.00 57.00 56.58 1ocz n GLN 68 Cb 0.61 -1.50 -0.03 0.00 1.02 0.00 0.00 30.24 30.34 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 1.04 0.49 0.00 1.08 0.00 -1.11 -4.94 105.19 101.75 1ocz n GLY 69 Ca 0.08 -0.18 0.13 0.00 0.00 0.00 0.00 46.02 46.06 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 -3.40 0.00 -2.59 1.61 8.25 -0.51 -4.58 115.22 113.99 1ocz n HIS 70 Ca -0.19 0.00 -0.43 0.00 -0.26 0.00 0.00 57.72 56.84 1ocz n HIS 70 Cb 0.62 -0.48 0.00 0.00 1.12 0.00 0.00 29.99 31.25 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 -1.48 3.77 -0.99 4.41 8.25 -1.26 -4.73 115.22 123.19 1ocz n HIS 71 Ca 0.07 -3.02 -0.30 0.00 -0.26 0.00 0.00 57.72 54.22 1ocz n HIS 71 Cb 0.31 -2.05 0.23 0.00 1.12 0.00 0.00 29.99 29.60 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 0.86 1.67 0.12 1.59 -4.23 -1.26 -4.64 115.64 109.75 1ocz s THR 72 Ca 0.41 0.00 -0.22 0.00 -1.18 0.00 0.00 61.69 60.70 1ocz s THR 72 Cb 0.05 -2.42 -0.06 0.00 1.34 0.00 0.00 72.50 71.41 1ocz s THR 72 CO 0.00 0.00 1.69 -0.65 -0.54 0.00 0.00 174.62 175.13 1ocz h PRO 73 N -2.55 -0.12 -0.72 3.99 0.11 -1.94 -0.81 132.00 129.97 1ocz h PRO 73 Ca -0.48 0.01 0.11 0.00 0.11 0.00 0.00 66.00 65.75 1ocz h PRO 73 Cb 1.31 0.03 -0.05 0.00 0.11 0.00 0.00 31.00 32.40 1ocz h PRO 73 CO 0.40 -0.08 0.47 0.00 -0.21 0.00 0.00 178.00 178.58 1ocz h ALA 74 N 0.93 1.93 -0.27 -0.75 0.00 -1.91 -1.54 119.26 117.65 1ocz h ALA 74 Ca 0.06 -0.01 -0.18 0.00 0.00 0.00 0.00 54.91 54.79 1ocz h ALA 74 Cb 0.21 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 17.89 1ocz h ALA 74 CO -0.15 -0.10 -0.53 0.28 0.00 0.00 0.00 179.25 178.76 1ocz h VAL 75 N 0.54 1.28 -0.25 0.00 2.07 -1.42 -3.25 116.25 115.23 1ocz h VAL 75 Ca 0.34 -1.72 -0.16 0.00 0.82 0.00 0.00 66.70 65.98 1ocz h VAL 75 Cb 0.58 1.68 -0.01 0.00 -1.52 0.00 0.00 31.29 32.02 1ocz h VAL 75 CO -0.11 0.56 -0.49 1.56 0.02 0.00 0.00 177.57 179.10 1ocz h GLN 76 N 0.60 0.69 -0.58 1.57 4.20 -0.31 -3.06 115.11 118.22 1ocz h GLN 76 Ca 0.01 -0.40 0.12 0.00 0.06 0.00 0.00 58.65 58.44 1ocz h GLN 76 Cb 1.14 0.03 -0.03 0.00 0.30 0.00 0.00 27.48 28.92 1ocz h GLN 76 CO 0.12 1.02 0.40 -0.22 -0.67 0.00 0.00 178.83 179.48 1ocz h LYS 77 N 0.54 0.25 0.00 1.46 3.64 -1.38 -0.26 116.57 120.83 1ocz h LYS 77 Ca 0.03 -0.02 -0.13 0.00 -1.27 0.00 0.00 60.65 59.26 1ocz h LYS 77 Cb 1.05 -0.06 -0.02 0.00 -0.41 0.00 0.00 32.23 32.79 1ocz h LYS 77 CO 0.10 0.17 -0.60 0.78 -2.27 0.00 0.00 179.45 177.63 1ocz h GLY 78 N 0.26 0.00 2.00 5.01 0.00 -1.57 -2.96 103.07 105.82 1ocz h GLY 78 Ca 0.28 0.00 -0.05 0.00 0.00 0.00 0.00 47.33 47.55 1ocz h GLY 78 CO -0.06 0.00 -0.26 1.41 0.00 0.00 0.00 176.54 177.63 1ocz h LEU 79 N 0.00 0.00 0.40 3.11 3.38 -1.00 -2.09 115.31 119.11 1ocz h LEU 79 Ca -0.01 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.94 1ocz h LEU 79 Cb 1.33 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.08 1ocz h LEU 79 CO 0.08 0.26 -0.19 0.03 0.09 0.00 0.00 178.44 178.70 1ocz h ARG 80 N 0.00 -0.52 -0.51 1.13 3.08 -1.26 -2.05 114.38 114.25 1ocz h ARG 80 Ca -0.00 0.04 0.10 0.00 0.07 0.00 0.00 59.98 60.19 1ocz h ARG 80 Cb 1.00 0.12 -0.10 0.00 0.08 0.00 0.00 29.97 31.07 1ocz h ARG 80 CO 0.03 -0.24 -0.17 1.88 -1.07 0.00 0.00 179.97 180.41 1ocz h TYR 81 N -1.04 -0.39 -0.58 3.04 0.05 -1.53 0.21 116.97 116.73 1ocz h TYR 81 Ca -0.06 0.05 0.08 0.00 0.05 0.00 0.00 58.73 58.85 1ocz h TYR 81 Cb 0.52 0.25 -0.06 0.00 1.01 0.00 0.00 36.73 38.45 1ocz h TYR 81 CO 0.02 -0.26 0.25 0.78 -1.05 0.00 0.00 178.16 177.90 1ocz h GLY 82 N -0.05 0.82 0.74 3.88 0.00 -1.39 0.25 103.07 107.33 1ocz h GLY 82 Ca 0.24 -0.14 -0.05 0.00 0.00 0.00 0.00 47.33 47.38 1ocz h GLY 82 CO -0.55 0.03 -0.10 1.98 0.00 0.00 0.00 176.54 177.90 1ocz h MET 83 N 0.45 0.33 -0.28 4.80 1.85 -0.34 -0.47 114.93 121.26 1ocz h MET 83 Ca 0.28 -0.15 0.06 0.00 -0.61 0.00 0.00 59.70 59.28 1ocz h MET 83 Cb 0.30 -0.00 -0.06 0.00 0.43 0.00 0.00 31.60 32.27 1ocz h MET 83 CO -0.26 0.68 -0.13 0.82 -0.40 0.00 0.00 176.91 177.62 1ocz h ILE 84 N -0.03 0.60 -0.38 1.77 1.08 -0.10 0.28 117.51 120.73 1ocz h ILE 84 Ca 0.03 0.00 0.02 0.00 -0.39 0.00 0.00 64.86 64.52 1ocz h ILE 84 Cb 0.59 0.60 -0.03 0.00 -3.07 0.00 0.00 36.82 34.92 1ocz h ILE 84 CO 0.03 0.00 0.23 -0.07 -0.69 0.00 0.00 178.15 177.64 1ocz h LEU 85 N -0.08 0.37 -1.25 1.44 4.07 -0.46 -2.44 115.31 116.95 1ocz h LEU 85 Ca 0.14 0.00 -0.02 0.00 0.08 0.00 0.00 57.88 58.09 1ocz h LEU 85 Cb 0.30 -0.07 -0.03 0.00 1.08 0.00 0.00 40.66 41.94 1ocz h LEU 85 CO -0.33 0.26 0.29 0.15 -1.08 0.00 0.00 178.44 177.73 1ocz h PHE 86 N 0.46 0.79 -0.57 1.13 3.57 -0.00 -2.55 116.94 119.76 1ocz h PHE 86 Ca 0.15 -0.02 -0.09 0.00 3.53 0.00 0.00 57.97 61.54 1ocz h PHE 86 Cb 0.00 -0.25 -0.02 0.00 2.79 0.00 0.00 35.95 38.47 1ocz h PHE 86 CO -0.07 0.57 0.01 0.82 -2.23 0.00 0.00 178.31 177.41 1ocz h ILE 87 N 0.80 1.26 -0.54 1.41 2.04 -0.64 -3.00 117.51 118.84 1ocz h ILE 87 Ca 0.20 -1.11 0.05 0.00 1.00 0.00 0.00 64.86 65.00 1ocz h ILE 87 Cb 0.07 0.85 -0.05 0.00 -0.74 0.00 0.00 36.82 36.94 1ocz h ILE 87 CO -0.03 0.40 0.27 0.40 0.00 0.00 0.00 178.15 179.19 1ocz h ILE 88 N 0.89 0.93 0.00 -0.67 2.04 -1.05 0.43 117.51 120.09 1ocz h ILE 88 Ca 0.16 -0.18 -0.02 0.00 1.00 0.00 0.00 64.86 65.83 1ocz h ILE 88 Cb 0.53 0.37 -0.00 0.00 -0.74 0.00 0.00 36.82 36.98 1ocz h ILE 88 CO 0.03 0.09 -0.11 0.77 0.00 0.00 0.00 178.15 178.93 1ocz h SER 89 N 0.51 0.00 0.15 1.72 4.64 -1.40 -0.11 113.55 119.07 1ocz h SER 89 Ca 0.25 0.00 -0.23 0.00 -0.47 0.00 0.00 61.79 61.34 1ocz h SER 89 Cb 0.17 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 62.27 1ocz h SER 89 CO -0.18 0.11 -0.90 -0.33 -0.87 0.00 0.00 176.83 174.66 1ocz h GLU 90 N 0.00 0.55 -0.09 4.77 4.39 -0.97 -2.55 114.58 120.68 1ocz h GLU 90 Ca -0.00 -0.54 -0.05 0.00 0.34 0.00 0.00 59.36 59.11 1ocz h GLU 90 Cb 0.21 0.14 -0.01 0.00 -0.10 0.00 0.00 28.75 28.99 1ocz h GLU 90 CO 0.01 1.16 -0.17 0.28 -1.16 0.00 0.00 179.01 179.14 1ocz h VAL 91 N 0.34 1.17 0.00 3.13 2.07 0.75 -1.95 116.25 121.76 1ocz h VAL 91 Ca -0.08 -0.76 0.00 0.00 0.82 0.00 0.00 66.70 66.68 1ocz h VAL 91 Cb 1.53 1.29 0.00 0.00 -1.52 0.00 0.00 31.29 32.59 1ocz h VAL 91 CO 0.17 0.23 -0.18 -0.07 0.02 0.00 0.00 177.57 177.73 1ocz h LEU 92 N 0.13 0.00 0.05 2.57 4.07 -1.05 -3.06 115.31 118.01 1ocz h LEU 92 Ca 0.03 -0.01 -0.00 0.00 0.08 0.00 0.00 57.88 57.97 1ocz h LEU 92 Cb 0.38 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.12 1ocz h LEU 92 CO 0.02 0.00 -0.02 0.15 -1.08 0.00 0.00 178.44 177.52 1ocz h PHE 93 N 0.00 -0.06 -0.02 1.13 3.57 -0.95 -3.00 116.94 117.61 1ocz h PHE 93 Ca 0.00 -0.00 0.01 0.00 3.53 0.00 0.00 57.97 61.51 1ocz h PHE 93 Cb 0.96 0.02 -0.00 0.00 2.79 0.00 0.00 35.95 39.71 1ocz h PHE 93 CO 0.00 0.53 0.04 0.74 -2.23 0.00 0.00 178.31 177.38 1ocz h PHE 94 N -0.72 0.00 -0.63 0.41 0.04 -1.51 -2.25 116.94 112.27 1ocz h PHE 94 Ca -0.01 0.00 -0.04 0.00 2.80 0.00 0.00 57.97 60.73 1ocz h PHE 94 Cb 0.62 0.00 -0.03 0.00 2.20 0.00 0.00 35.95 38.74 1ocz h PHE 94 CO 0.14 0.00 0.25 1.15 -0.60 0.00 0.00 178.31 179.25 1ocz h THR 95 N 0.00 1.22 -0.74 -1.55 2.02 -1.42 -0.53 112.91 111.92 1ocz h THR 95 Ca 0.01 -0.70 0.02 0.00 0.77 0.00 0.00 66.41 66.51 1ocz h THR 95 Cb 0.08 0.47 -0.04 0.00 -1.74 0.00 0.00 68.15 66.92 1ocz h THR 95 CO -0.00 0.28 0.47 1.23 0.37 0.00 0.00 175.52 177.87 1ocz h GLY 96 N 1.01 1.06 0.96 2.16 0.00 -1.46 0.91 103.07 107.72 1ocz h GLY 96 Ca 0.22 -0.36 -0.06 0.00 0.00 0.00 0.00 47.33 47.12 1ocz h GLY 96 CO -0.02 0.32 0.04 0.74 0.00 0.00 0.00 176.54 177.63 1ocz h PHE 97 N 0.94 0.80 0.00 5.60 0.04 -1.37 0.64 116.94 123.59 1ocz h PHE 97 Ca 0.29 -0.12 -0.08 0.00 2.80 0.00 0.00 57.97 60.85 1ocz h PHE 97 Cb -0.03 -0.21 -0.01 0.00 2.20 0.00 0.00 35.95 37.90 1ocz h PHE 97 CO -0.03 0.77 -0.40 0.74 -0.60 0.00 0.00 178.31 178.79 1ocz h PHE 98 N 0.59 0.00 -0.03 -0.55 0.04 -0.74 -1.81 116.94 114.44 1ocz h PHE 98 Ca 0.13 0.00 -0.01 0.00 2.80 0.00 0.00 57.97 60.89 1ocz h PHE 98 Cb 0.43 0.00 -0.00 0.00 2.20 0.00 0.00 35.95 38.58 1ocz h PHE 98 CO 0.03 0.40 -0.02 2.35 -0.60 0.00 0.00 178.31 180.48 1ocz h TRP 99 N 0.00 0.07 -0.36 -0.55 2.91 -0.25 -1.41 115.95 116.36 1ocz h TRP 99 Ca -0.00 -0.02 0.06 0.00 1.13 0.00 0.00 58.89 60.06 1ocz h TRP 99 Cb 0.79 -0.02 -0.05 0.00 -0.51 0.00 0.00 29.16 29.37 1ocz h TRP 99 CO 0.00 0.48 0.03 0.00 -1.03 0.00 0.00 178.44 177.93 1ocz h ALA 100 N 0.58 0.35 0.30 2.65 0.00 -0.67 -0.34 119.26 122.13 1ocz h ALA 100 Ca 0.01 0.09 -0.00 0.00 0.00 0.00 0.00 54.91 55.00 1ocz h ALA 100 Cb 0.47 0.14 -0.02 0.00 0.00 0.00 0.00 17.79 18.38 1ocz h ALA 100 CO 0.00 -0.37 -0.27 0.35 0.00 0.00 0.00 179.25 178.96 1ocz h PHE 101 N 0.14 -0.72 0.00 0.00 3.57 -1.25 -1.50 116.94 117.17 1ocz h PHE 101 Ca 0.17 0.00 -0.00 0.00 3.53 0.00 0.00 57.97 61.67 1ocz h PHE 101 Cb 0.22 0.28 -0.00 0.00 2.79 0.00 0.00 35.95 39.24 1ocz h PHE 101 CO -0.22 -0.40 -0.01 1.88 -2.23 0.00 0.00 178.31 177.33 1ocz h TYR 102 N -0.60 0.00 -0.07 0.41 0.05 -0.76 -0.03 116.97 115.97 1ocz h TYR 102 Ca -0.02 0.00 -0.12 0.00 0.05 0.00 0.00 58.73 58.65 1ocz h TYR 102 Cb 0.54 0.00 0.01 0.00 1.01 0.00 0.00 36.73 38.28 1ocz h TYR 102 CO -0.16 0.01 -0.42 1.25 -1.05 0.00 0.00 178.16 177.80 1ocz h HIS 103 N 0.00 0.56 -0.16 4.88 2.76 -0.22 -2.19 115.15 120.78 1ocz h HIS 103 Ca -0.00 -0.25 -0.11 0.00 -2.20 0.00 0.00 60.37 57.81 1ocz h HIS 103 Cb 0.16 -0.08 0.00 0.00 1.55 0.00 0.00 27.41 29.04 1ocz h HIS 103 CO 0.00 1.02 -0.33 0.77 -1.30 0.00 0.00 177.93 178.09 1ocz h SER 104 N -0.05 0.56 1.02 3.26 0.02 -0.44 -3.19 113.55 114.73 1ocz h SER 104 Ca -0.03 -0.56 -0.20 0.00 -0.84 0.00 0.00 61.79 60.16 1ocz h SER 104 Cb 1.07 -0.16 -0.03 0.00 0.14 0.00 0.00 62.40 63.42 1ocz h SER 104 CO 0.09 1.01 -0.99 0.77 -1.14 0.00 0.00 176.83 176.57 1ocz h SER 105 N 0.12 0.00 1.22 3.07 4.64 -1.15 -3.13 113.55 118.32 1ocz h SER 105 Ca 0.00 0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 61.30 1ocz h SER 105 Cb 0.93 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.01 1ocz h SER 105 CO 0.07 0.95 -0.12 -0.07 -0.87 0.00 0.00 176.83 176.79 1ocz h LEU 106 N 0.00 0.00 -5.83 5.97 3.38 -1.50 -3.38 115.31 113.95 1ocz h LEU 106 Ca -0.03 0.00 -0.42 0.00 0.09 0.00 0.00 57.88 57.53 1ocz h LEU 106 Cb 1.74 0.00 -0.29 0.00 0.09 0.00 0.00 40.66 42.20 1ocz h LEU 106 CO 0.12 0.12 -0.79 0.00 0.09 0.00 0.00 178.44 177.98 1ocz s ALA 107 N -3.51 0.02 0.10 1.53 0.00 -1.21 -5.09 121.76 113.60 1ocz s ALA 107 Ca 0.02 -1.65 -0.31 0.00 0.00 0.00 0.00 51.96 50.02 1ocz s ALA 107 Cb 0.08 -2.03 -0.08 0.00 0.00 0.00 0.00 23.12 21.09 1ocz s ALA 107 CO 0.62 -2.08 1.47 -2.14 0.00 0.00 0.00 175.76 173.63 1ocz s PRO 108 N 0.38 4.27 0.71 0.00 0.02 -1.18 -4.76 135.00 134.44 1ocz s PRO 108 Ca 0.32 2.16 -0.13 0.00 0.02 0.00 0.00 61.00 63.36 1ocz s PRO 108 Cb 0.02 -3.34 0.03 0.00 0.02 0.00 0.00 34.50 31.23 1ocz s PRO 108 CO -0.14 -0.54 1.11 0.95 -0.33 0.00 0.00 177.00 178.04 1ocz s THR 109 N 1.56 3.22 0.56 0.99 -4.23 -1.26 -4.49 115.64 111.99 1ocz s THR 109 Ca 0.67 0.49 0.27 0.00 -1.18 0.00 0.00 61.69 61.95 1ocz s THR 109 Cb -0.38 -2.99 0.33 0.00 1.34 0.00 0.00 72.50 70.80 1ocz s THR 109 CO 0.30 -0.42 2.21 1.55 -0.54 0.00 0.00 174.62 177.72 1ocz h PRO 110 N -0.48 0.00 0.00 3.99 0.13 -1.93 -0.57 132.00 133.14 1ocz h PRO 110 Ca -0.45 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 64.67 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 0.53 0.02 -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 0.22 114.58 116.72 1ocz h GLU 111 Ca -0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.86 1ocz h GLU 111 Cb 0.06 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 27.97 1ocz h GLU 111 CO 0.00 0.01 -0.13 -0.07 -1.40 0.00 0.00 179.01 177.42 1ocz h LEU 112 N 0.00 0.00 0.00 1.33 4.07 -1.50 -3.46 115.31 115.75 1ocz h LEU 112 Ca -0.00 -0.02 0.00 0.00 0.08 0.00 0.00 57.88 57.94 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 0.01 0.00 0.61 -1.08 0.00 0.00 178.44 177.98 1ocz n GLY 113 N 1.20 1.39 2.65 0.83 0.00 0.77 -2.00 105.19 110.03 1ocz n GLY 113 Ca 0.04 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.85 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 -0.71 -0.51 3.42 -0.02 0.00 -0.53 -4.93 105.19 101.91 1ocz n GLY 114 Ca 0.00 0.05 -0.10 0.00 0.00 0.00 0.00 46.02 45.97 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 -3.87 0.92 0.61 0.00 -0.11 -1.26 -3.17 118.94 112.07 1ocz s TRP 116 Ca 0.09 -0.28 -0.17 0.00 1.22 0.00 0.00 56.10 56.97 1ocz s TRP 116 Cb 0.01 -0.74 -0.02 0.00 -1.50 0.00 0.00 33.47 31.22 1ocz s TRP 116 CO -0.05 -0.18 1.12 -2.14 -4.62 0.00 0.00 176.95 171.08 1ocz s PRO 117 N 0.69 3.01 0.66 5.86 0.02 -1.26 -4.97 135.00 139.01 1ocz s PRO 117 Ca -0.11 1.50 -0.17 0.00 0.02 0.00 0.00 61.00 62.24 1ocz s PRO 117 Cb -0.13 -1.97 -0.03 0.00 0.02 0.00 0.00 34.50 32.39 1ocz s PRO 117 CO 0.01 -1.11 0.90 -0.35 -0.33 0.00 0.00 177.00 176.12 1ocz n PRO 118 N -1.96 0.65 -1.82 5.54 -0.04 -1.19 -4.87 135.00 131.31 1ocz n PRO 118 Ca 0.11 0.27 -0.42 0.00 -0.04 0.00 0.00 63.50 63.42 1ocz n PRO 118 Cb 0.51 -2.13 -0.03 0.00 -0.04 0.00 0.00 33.50 31.81 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 -1.68 2.35 0.00 0.52 -4.23 -0.85 -1.76 115.64 109.99 1ocz s THR 119 Ca 0.74 0.22 0.00 0.00 -1.18 0.00 0.00 61.69 61.47 1ocz s THR 119 Cb -0.38 -3.14 0.00 0.00 1.34 0.00 0.00 72.50 70.32 1ocz s THR 119 CO 0.49 0.02 0.00 0.61 -0.54 0.00 0.00 174.62 175.20 1ocz n GLY 120 N 3.90 1.98 3.72 3.99 0.00 -1.26 -4.98 105.19 112.53 1ocz n GLY 120 Ca 0.15 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.77 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 -2.10 4.93 -0.54 -0.61 -1.09 -0.72 -5.02 121.20 116.04 1ocz s ILE 121 Ca 0.00 1.62 -0.02 0.00 -2.23 0.00 0.00 60.65 60.03 1ocz s ILE 121 Cb 0.00 -4.12 0.14 0.00 -1.58 0.00 0.00 42.46 36.90 1ocz s ILE 121 CO 0.00 0.26 0.33 -1.00 -1.23 0.00 0.00 174.94 173.30 1ocz s HIS 122 N 0.61 3.46 0.74 3.97 3.76 -1.26 -4.87 115.29 121.70 1ocz s HIS 122 Ca 0.41 -2.69 -0.15 0.00 -0.15 0.00 0.00 55.06 52.48 1ocz s HIS 122 Cb -0.19 -3.16 0.02 0.00 1.11 0.00 0.00 32.58 30.36 1ocz s HIS 122 CO 0.21 -0.88 1.02 -0.35 -0.85 0.00 0.00 174.74 173.90 1ocz n PRO 123 N 3.82 0.45 -1.51 8.40 -0.04 -1.26 -4.77 135.00 140.08 1ocz n PRO 123 Ca 0.04 0.21 -0.30 0.00 -0.04 0.00 0.00 63.50 63.42 1ocz n PRO 123 Cb 0.38 -2.27 0.10 0.00 -0.04 0.00 0.00 33.50 31.67 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 -3.65 2.54 -0.31 1.53 1.43 -1.26 -5.00 118.68 113.96 1ocz s LEU 124 Ca 0.73 1.32 -0.20 0.00 -1.03 0.00 0.00 54.13 54.95 1ocz s LEU 124 Cb -0.33 -3.90 -0.01 0.00 0.03 0.00 0.00 46.19 41.98 1ocz s LEU 124 CO 0.50 -2.07 0.59 0.21 0.23 0.00 0.00 176.35 175.82 1ocz s ASN 125 N -3.85 6.46 0.53 2.29 3.84 -1.26 -4.91 114.94 118.03 1ocz s ASN 125 Ca 0.61 0.36 0.22 0.00 0.21 0.00 0.00 52.86 54.26 1ocz s ASN 125 Cb -0.15 -2.31 1.35 0.00 -0.55 0.00 0.00 41.25 39.59 1ocz s ASN 125 CO 0.54 -0.45 2.05 1.55 -2.79 0.00 0.00 177.10 178.01 1ocz h PRO 126 N 8.21 0.00 0.00 0.43 0.13 -1.93 0.11 132.00 138.96 1ocz h PRO 126 Ca -0.27 -0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.86 1ocz h PRO 126 Cb 1.12 -0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.25 1ocz h PRO 126 CO 0.78 0.00 0.00 1.28 -0.23 0.00 0.00 178.00 179.84 1ocz n LEU 127 N -4.44 0.19 0.00 1.56 4.32 -1.26 -2.36 117.00 115.01 1ocz n LEU 127 Ca 0.05 0.53 0.00 0.00 -0.02 0.00 0.00 56.01 56.57 1ocz n LEU 127 Cb 0.41 -0.49 0.00 0.00 -1.62 0.00 0.00 43.42 41.72 1ocz n LEU 127 CO 0.36 -0.20 0.00 -0.62 -1.22 0.00 0.00 177.39 175.71 1ocz n GLU 128 N -1.69 0.00 0.12 3.23 4.71 0.40 -4.65 120.64 122.75 1ocz n GLU 128 Ca 0.05 0.00 0.02 0.00 -0.01 0.00 0.00 57.16 57.22 1ocz n GLU 128 Cb 0.27 0.00 0.38 0.00 -1.01 0.00 0.00 31.44 31.08 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 1.19 -0.04 2.62 2.07 -1.83 -2.59 116.25 117.67 1ocz h VAL 129 Ca 0.00 -0.86 0.01 0.00 0.82 0.00 0.00 66.70 66.67 1ocz h VAL 129 Cb 0.00 1.27 -0.00 0.00 -1.52 0.00 0.00 31.29 31.04 1ocz h VAL 129 CO 0.00 0.26 0.09 -0.65 0.02 0.00 0.00 177.57 177.30 1ocz h PRO 130 N 0.21 0.00 0.23 1.57 0.11 -1.75 0.87 132.00 133.23 1ocz h PRO 130 Ca 0.04 0.00 -0.33 0.00 0.11 0.00 0.00 66.00 65.82 1ocz h PRO 130 Cb 0.42 0.00 0.03 0.00 0.11 0.00 0.00 31.00 31.56 1ocz h PRO 130 CO 0.03 0.00 -1.50 1.25 -0.21 0.00 0.00 178.00 177.56 1ocz h LEU 131 N 0.00 0.77 -0.24 2.35 6.46 -1.07 -2.66 115.31 120.92 1ocz h LEU 131 Ca 0.02 -0.87 -0.01 0.00 -0.12 0.00 0.00 57.88 56.91 1ocz h LEU 131 Cb 0.21 -0.25 -0.01 0.00 -0.73 0.00 0.00 40.66 39.88 1ocz h LEU 131 CO -0.00 1.69 0.13 0.25 -0.62 0.00 0.00 178.44 179.89 1ocz h LEU 132 N 0.13 0.30 -1.31 2.25 6.46 -0.96 0.01 115.31 122.19 1ocz h LEU 132 Ca -0.26 -0.09 -0.03 0.00 -0.12 0.00 0.00 57.88 57.37 1ocz h LEU 132 Cb 2.14 -0.08 -0.02 0.00 -0.73 0.00 0.00 40.66 41.98 1ocz h LEU 132 CO 0.26 0.31 0.08 0.78 -0.62 0.00 0.00 178.44 179.24 1ocz h ASN 133 N 0.28 0.50 -0.10 1.25 -0.26 -1.01 0.07 115.58 116.30 1ocz h ASN 133 Ca 0.08 -0.07 -0.01 0.00 -0.56 0.00 0.00 56.30 55.75 1ocz h ASN 133 Cb 0.07 -0.13 -0.00 0.00 -1.06 0.00 0.00 38.32 37.20 1ocz h ASN 133 CO -0.01 0.51 0.04 0.74 -1.06 0.00 0.00 177.43 177.65 1ocz h THR 134 N 0.54 1.16 -0.47 2.81 2.02 -0.89 -2.25 112.91 115.83 1ocz h THR 134 Ca 0.12 -0.48 -0.07 0.00 0.77 0.00 0.00 66.41 66.75 1ocz h THR 134 Cb 0.22 1.29 -0.02 0.00 -1.74 0.00 0.00 68.15 67.90 1ocz h THR 134 CO -0.00 0.14 0.01 0.77 0.37 0.00 0.00 175.52 176.81 1ocz h SER 135 N -0.01 0.73 0.89 4.18 4.64 -0.62 -2.19 113.55 121.17 1ocz h SER 135 Ca 0.03 -0.17 -0.04 0.00 -0.47 0.00 0.00 61.79 61.14 1ocz h SER 135 Cb 0.19 -0.19 0.01 0.00 -0.31 0.00 0.00 62.40 62.10 1ocz h SER 135 CO -0.00 0.79 -0.43 0.58 -0.87 0.00 0.00 176.83 176.90 1ocz h VAL 136 N 0.72 0.10 -0.55 0.95 2.07 -0.84 -0.40 116.25 118.30 1ocz h VAL 136 Ca 0.14 -0.04 0.08 0.00 0.82 0.00 0.00 66.70 67.71 1ocz h VAL 136 Cb 0.42 0.10 -0.07 0.00 -1.52 0.00 0.00 31.29 30.23 1ocz h VAL 136 CO 0.02 0.00 0.18 -0.07 0.02 0.00 0.00 177.57 177.72 1ocz h LEU 137 N -1.23 0.16 -0.58 2.57 4.07 -1.39 -1.56 115.31 117.34 1ocz h LEU 137 Ca -0.12 0.07 0.07 0.00 0.08 0.00 0.00 57.88 57.98 1ocz h LEU 137 Cb 0.92 0.07 -0.06 0.00 1.08 0.00 0.00 40.66 42.67 1ocz h LEU 137 CO 0.20 0.11 0.28 -0.07 -1.08 0.00 0.00 178.44 177.88 1ocz h LEU 138 N 0.35 0.37 -0.83 1.67 3.38 -1.29 -1.31 115.31 117.65 1ocz h LEU 138 Ca 0.27 0.05 -0.01 0.00 0.09 0.00 0.00 57.88 58.28 1ocz h LEU 138 Cb 0.32 -0.02 -0.04 0.00 0.09 0.00 0.00 40.66 41.02 1ocz h LEU 138 CO -0.29 0.24 0.50 0.00 0.09 0.00 0.00 178.44 178.98 1ocz h ALA 139 N 1.34 1.06 -0.15 1.53 0.00 -0.12 -0.65 119.26 122.27 1ocz h ALA 139 Ca 0.27 -0.10 -0.02 0.00 0.00 0.00 0.00 54.91 55.07 1ocz h ALA 139 Cb 0.23 -0.33 -0.01 0.00 0.00 0.00 0.00 17.79 17.68 1ocz h ALA 139 CO -0.21 0.53 -0.00 0.66 0.00 0.00 0.00 179.25 180.22 1ocz h SER 140 N 1.14 0.19 -0.01 0.00 4.64 -0.60 0.41 113.55 119.33 1ocz h SER 140 Ca 0.30 -0.02 -0.05 0.00 -0.47 0.00 0.00 61.79 61.54 1ocz h SER 140 Cb -0.04 -0.05 -0.01 0.00 -0.31 0.00 0.00 62.40 61.99 1ocz h SER 140 CO -0.06 0.24 -0.13 1.23 -0.87 0.00 0.00 176.83 177.24 1ocz h GLY 141 N 0.46 0.31 1.39 -0.77 0.00 -0.02 0.17 103.07 104.62 1ocz h GLY 141 Ca 0.05 -0.20 -0.29 0.00 0.00 0.00 0.00 47.33 46.90 1ocz h GLY 141 CO 0.00 0.18 -1.42 -0.24 0.00 0.00 0.00 176.54 175.07 1ocz h VAL 142 N 0.27 1.27 -0.11 4.60 3.04 -0.71 -2.99 116.25 121.62 1ocz h VAL 142 Ca 0.05 -2.92 -0.16 0.00 -1.01 0.00 0.00 66.70 62.66 1ocz h VAL 142 Cb 0.40 2.78 -0.01 0.00 -2.01 0.00 0.00 31.29 32.45 1ocz h VAL 142 CO 0.02 0.83 -0.63 0.77 -1.01 0.00 0.00 177.57 177.55 1ocz h SER 143 N 0.05 0.45 0.54 3.17 4.64 -0.90 -0.99 113.55 120.50 1ocz h SER 143 Ca -0.19 -0.26 -0.06 0.00 -0.47 0.00 0.00 61.79 60.80 1ocz h SER 143 Cb 1.97 -0.13 -0.01 0.00 -0.31 0.00 0.00 62.40 63.92 1ocz h SER 143 CO 0.16 0.96 -0.30 -0.29 -0.87 0.00 0.00 176.83 176.49 1ocz h ILE 144 N 0.29 0.94 -0.05 0.95 2.10 -0.75 -0.78 117.51 120.20 1ocz h ILE 144 Ca -0.01 -1.15 -0.14 0.00 1.08 0.00 0.00 64.86 64.63 1ocz h ILE 144 Cb 1.16 1.68 -0.01 0.00 -1.09 0.00 0.00 36.82 38.56 1ocz h ILE 144 CO 0.11 0.30 -0.62 0.74 -1.08 0.00 0.00 178.15 177.59 1ocz h THR 145 N 0.00 1.40 -0.24 2.19 2.02 -1.11 -2.18 112.91 114.99 1ocz h THR 145 Ca -0.00 -2.04 -0.16 0.00 0.77 0.00 0.00 66.41 64.98 1ocz h THR 145 Cb 0.65 2.05 -0.01 0.00 -1.74 0.00 0.00 68.15 69.11 1ocz h THR 145 CO 0.04 0.60 -0.49 -0.25 0.37 0.00 0.00 175.52 175.78 1ocz h TRP 146 N 0.13 0.80 -0.64 3.16 7.01 -0.13 -2.78 115.95 123.50 1ocz h TRP 146 Ca -0.01 -0.26 -0.04 0.00 2.11 0.00 0.00 58.89 60.69 1ocz h TRP 146 Cb 1.12 -0.16 -0.03 0.00 -2.10 0.00 0.00 29.16 27.99 1ocz h TRP 146 CO 0.02 1.01 0.24 0.00 -2.79 0.00 0.00 178.44 176.92 1ocz h ALA 147 N 0.94 0.83 0.00 2.65 0.00 -0.94 -1.26 119.26 121.48 1ocz h ALA 147 Ca 0.02 -0.18 -0.07 0.00 0.00 0.00 0.00 54.91 54.68 1ocz h ALA 147 Cb 1.04 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 18.57 1ocz h ALA 147 CO 0.10 0.47 -0.32 1.25 0.00 0.00 0.00 179.25 180.75 1ocz h HIS 148 N 0.91 0.00 0.08 0.00 -0.00 -1.34 -2.18 115.15 112.61 1ocz h HIS 148 Ca 0.21 0.00 -0.26 0.00 -0.00 0.00 0.00 60.37 60.32 1ocz h HIS 148 Cb 0.23 0.00 0.01 0.00 -0.00 0.00 0.00 27.41 27.66 1ocz h HIS 148 CO 0.02 0.32 -1.12 0.45 -0.00 0.00 0.00 177.93 177.59 1ocz h HIS 149 N 0.00 0.70 -0.64 5.26 -0.00 -1.13 -2.90 115.15 116.43 1ocz h HIS 149 Ca -0.00 -0.43 -0.09 0.00 -0.00 0.00 0.00 60.37 59.85 1ocz h HIS 149 Cb 0.80 -0.06 -0.02 0.00 -0.00 0.00 0.00 27.41 28.13 1ocz h HIS 149 CO 0.00 1.29 0.06 0.77 -0.00 0.00 0.00 177.93 180.05 1ocz h SER 150 N 0.20 1.06 0.08 2.45 0.02 -1.10 -2.78 113.55 113.47 1ocz h SER 150 Ca -0.13 -0.27 0.00 0.00 -0.84 0.00 0.00 61.79 60.55 1ocz h SER 150 Cb 1.80 -0.28 -0.01 0.00 0.14 0.00 0.00 62.40 64.05 1ocz h SER 150 CO 0.20 1.07 -0.08 0.25 -1.14 0.00 0.00 176.83 177.13 1ocz h LEU 151 N 1.01 -0.20 0.00 5.07 5.85 -1.44 -1.24 115.31 124.35 1ocz h LEU 151 Ca 0.19 0.02 0.00 0.00 0.84 0.00 0.00 57.88 58.93 1ocz h LEU 151 Cb 0.49 0.07 0.00 0.00 0.37 0.00 0.00 40.66 41.59 1ocz h LEU 151 CO 0.02 -0.12 0.00 1.15 -0.34 0.00 0.00 178.44 179.15 1ocz n MET 152 N -5.19 0.57 -0.20 1.25 0.00 -1.10 -1.56 117.12 110.90 1ocz n MET 152 Ca -0.07 0.00 0.09 0.00 0.00 0.00 0.00 57.70 57.71 1ocz n MET 152 Cb 0.12 -1.32 0.14 0.00 0.00 0.00 0.00 33.22 32.16 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 -0.82 1.20 -1.43 3.17 1.02 -0.58 -4.94 120.64 118.27 1ocz n GLU 153 Ca 0.09 -2.55 -0.15 0.00 -0.02 0.00 0.00 57.16 54.53 1ocz n GLU 153 Cb 0.04 -1.42 -0.07 0.00 -0.02 0.00 0.00 31.44 29.98 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 -1.26 1.46 3.44 0.62 0.00 -0.60 -4.90 105.19 103.95 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 -2.47 6.85 0.11 1.61 -1.08 -0.58 -4.90 116.67 116.22 1ocz s ASP 155 Ca 0.00 -2.55 -0.33 0.00 -0.52 0.00 0.00 52.55 49.15 1ocz s ASP 155 Cb 0.00 -2.38 -0.13 0.00 -1.46 0.00 0.00 42.92 38.95 1ocz s ASP 155 CO 0.00 -0.87 1.54 -0.09 0.52 0.00 0.00 175.17 176.27 1ocz h ARG 156 N 7.98 -0.56 -0.61 4.34 2.43 -1.90 -1.89 114.38 124.16 1ocz h ARG 156 Ca 0.22 0.04 0.12 0.00 -0.81 0.00 0.00 59.98 59.55 1ocz h ARG 156 Cb 0.96 0.13 -0.10 0.00 -0.42 0.00 0.00 29.97 30.54 1ocz h ARG 156 CO 1.14 -0.38 0.03 -0.22 -1.51 0.00 0.00 179.97 179.03 1ocz h LYS 157 N -0.59 0.14 -0.00 0.20 3.64 -1.98 -1.60 116.57 116.39 1ocz h LYS 157 Ca 0.03 -0.01 -0.14 0.00 -1.27 0.00 0.00 60.65 59.25 1ocz h LYS 157 Cb 0.67 -0.03 -0.02 0.00 -0.41 0.00 0.00 32.23 32.44 1ocz h LYS 157 CO -0.41 0.09 -0.68 0.45 -2.27 0.00 0.00 179.45 176.63 1ocz h HIS 158 N 0.15 0.02 0.58 1.91 3.86 -1.91 -1.38 115.15 118.37 1ocz h HIS 158 Ca 0.32 -0.01 -0.03 0.00 -1.16 0.00 0.00 60.37 59.49 1ocz h HIS 158 Cb 0.51 -0.00 0.01 0.00 1.06 0.00 0.00 27.41 28.98 1ocz h HIS 158 CO -0.33 0.69 -0.28 1.98 0.86 0.00 0.00 177.93 180.85 1ocz h MET 159 N 0.01 -0.75 -0.78 2.45 1.85 -0.72 0.07 114.93 117.06 1ocz h MET 159 Ca -0.01 0.05 0.23 0.00 -0.61 0.00 0.00 59.70 59.36 1ocz h MET 159 Cb 1.20 0.17 -0.03 0.00 0.43 0.00 0.00 31.60 33.37 1ocz h MET 159 CO 0.09 -0.44 0.58 1.25 -0.40 0.00 0.00 176.91 177.98 1ocz h LEU 160 N -0.95 0.00 0.00 3.39 5.85 -1.28 0.91 115.31 123.24 1ocz h LEU 160 Ca -0.08 0.00 -0.00 0.00 0.84 0.00 0.00 57.88 58.64 1ocz h LEU 160 Cb 0.65 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.68 1ocz h LEU 160 CO 0.13 0.00 -0.00 -0.61 -0.34 0.00 0.00 178.44 177.62 1ocz h GLN 161 N 0.00 -0.00 -0.65 1.25 4.15 -0.67 -2.44 115.11 116.75 1ocz h GLN 161 Ca 0.37 0.00 -0.02 0.00 0.77 0.00 0.00 58.65 59.77 1ocz h GLN 161 Cb 1.52 0.00 -0.03 0.00 0.21 0.00 0.00 27.48 29.18 1ocz h GLN 161 CO -0.00 0.82 0.33 0.00 -1.93 0.00 0.00 178.83 178.04 1ocz h ALA 162 N -0.15 1.36 -0.69 3.38 0.00 0.06 -1.57 119.26 121.65 1ocz h ALA 162 Ca -0.00 -0.12 -0.05 0.00 0.00 0.00 0.00 54.91 54.74 1ocz h ALA 162 Cb 0.82 -0.26 -0.03 0.00 0.00 0.00 0.00 17.79 18.32 1ocz h ALA 162 CO 0.00 0.51 0.23 1.25 0.00 0.00 0.00 179.25 181.24 1ocz h LEU 163 N 0.91 1.00 -0.07 0.00 6.46 -0.96 -1.57 115.31 121.08 1ocz h LEU 163 Ca 0.23 -0.20 -0.00 0.00 -0.12 0.00 0.00 57.88 57.78 1ocz h LEU 163 Cb 0.07 -0.26 -0.00 0.00 -0.73 0.00 0.00 40.66 39.73 1ocz h LEU 163 CO -0.03 0.94 0.03 0.15 -0.62 0.00 0.00 178.44 178.90 1ocz h PHE 164 N 1.01 0.11 -0.61 1.25 3.57 -0.83 -0.69 116.94 120.75 1ocz h PHE 164 Ca 0.23 -0.01 0.09 0.00 3.53 0.00 0.00 57.97 61.81 1ocz h PHE 164 Cb 0.28 -0.03 -0.07 0.00 2.79 0.00 0.00 35.95 38.92 1ocz h PHE 164 CO 0.02 0.25 0.25 0.82 -2.23 0.00 0.00 178.31 177.42 1ocz h ILE 165 N -0.06 0.80 0.72 1.41 2.04 -1.25 -0.85 117.51 120.31 1ocz h ILE 165 Ca 0.02 -0.15 -0.03 0.00 1.00 0.00 0.00 64.86 65.70 1ocz h ILE 165 Cb 0.19 0.32 -0.00 0.00 -0.74 0.00 0.00 36.82 36.58 1ocz h ILE 165 CO -0.00 0.08 -0.40 0.74 0.00 0.00 0.00 178.15 178.57 1ocz h THR 166 N 0.44 0.18 -0.80 -0.27 2.02 -1.04 -2.10 112.91 111.34 1ocz h THR 166 Ca 0.31 0.00 0.18 0.00 0.77 0.00 0.00 66.41 67.66 1ocz h THR 166 Cb 0.36 0.18 -0.11 0.00 -1.74 0.00 0.00 68.15 66.83 1ocz h THR 166 CO -0.29 0.00 0.26 0.40 0.37 0.00 0.00 175.52 176.26 1ocz h ILE 167 N -1.04 0.51 -0.49 3.11 2.04 -0.83 -1.54 117.51 119.26 1ocz h ILE 167 Ca -0.09 -0.11 -0.12 0.00 1.00 0.00 0.00 64.86 65.53 1ocz h ILE 167 Cb 0.83 0.15 -0.01 0.00 -0.74 0.00 0.00 36.82 37.04 1ocz h ILE 167 CO 0.12 0.06 -0.18 0.71 0.00 0.00 0.00 178.15 178.86 1ocz h THR 168 N 0.33 1.27 -0.69 -0.27 1.35 -0.90 -1.50 112.91 112.51 1ocz h THR 168 Ca 0.47 -1.34 -0.02 0.00 -0.55 0.00 0.00 66.41 64.97 1ocz h THR 168 Cb 0.82 1.08 -0.03 0.00 -1.73 0.00 0.00 68.15 68.29 1ocz h THR 168 CO -0.51 0.46 0.34 -0.07 -0.25 0.00 0.00 175.52 175.49 1ocz h LEU 169 N 0.85 0.87 -0.95 3.87 3.38 -0.71 0.31 115.31 122.93 1ocz h LEU 169 Ca 0.12 -0.08 -0.09 0.00 0.09 0.00 0.00 57.88 57.91 1ocz h LEU 169 Cb 0.75 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 41.26 1ocz h LEU 169 CO 0.06 0.72 -0.21 1.23 0.09 0.00 0.00 178.44 180.33 1ocz h GLY 170 N 1.03 0.57 1.59 0.83 0.00 -0.98 -0.28 103.07 105.82 1ocz h GLY 170 Ca 0.24 -0.45 -0.20 0.00 0.00 0.00 0.00 47.33 46.92 1ocz h GLY 170 CO -0.03 0.41 -0.83 -2.08 0.00 0.00 0.00 176.54 174.00 1ocz h VAL 171 N 0.47 1.40 -0.87 4.60 2.07 -0.26 -2.84 116.25 120.83 1ocz h VAL 171 Ca 0.07 -2.32 0.02 0.00 0.82 0.00 0.00 66.70 65.30 1ocz h VAL 171 Cb 0.63 2.27 -0.05 0.00 -1.52 0.00 0.00 31.29 32.62 1ocz h VAL 171 CO 0.04 0.69 0.57 0.22 0.02 0.00 0.00 177.57 179.11 1ocz h TYR 172 N 0.24 1.07 -0.53 1.57 3.20 0.12 -1.07 116.97 121.57 1ocz h TYR 172 Ca -0.05 0.03 -0.10 0.00 3.14 0.00 0.00 58.73 61.74 1ocz h TYR 172 Cb 1.44 -0.36 -0.02 0.00 1.54 0.00 0.00 36.73 39.33 1ocz h TYR 172 CO 0.05 0.64 -0.08 0.35 -1.64 0.00 0.00 178.16 177.48 1ocz h PHE 173 N 1.13 1.06 0.06 -3.82 3.04 -1.00 -0.59 116.94 116.82 1ocz h PHE 173 Ca 0.34 -0.20 0.00 0.00 3.98 0.00 0.00 57.97 62.09 1ocz h PHE 173 Cb -0.05 -0.27 -0.00 0.00 2.56 0.00 0.00 35.95 38.19 1ocz h PHE 173 CO -0.02 0.98 -0.05 1.15 -2.02 0.00 0.00 178.31 178.36 1ocz h THR 174 N 0.87 0.89 0.03 4.41 2.02 -1.05 0.09 112.91 120.16 1ocz h THR 174 Ca 0.14 0.00 -0.00 0.00 0.77 0.00 0.00 66.41 67.32 1ocz h THR 174 Cb 0.62 0.89 0.00 0.00 -1.74 0.00 0.00 68.15 67.92 1ocz h THR 174 CO 0.04 0.00 -0.01 -0.07 0.37 0.00 0.00 175.52 175.85 1ocz h LEU 175 N -0.12 -0.03 -0.37 2.58 3.38 -1.09 0.14 115.31 119.80 1ocz h LEU 175 Ca -0.00 -0.12 0.07 0.00 0.09 0.00 0.00 57.88 57.92 1ocz h LEU 175 Cb 0.11 0.01 -0.07 0.00 0.09 0.00 0.00 40.66 40.80 1ocz h LEU 175 CO -0.01 0.10 -0.08 -0.07 0.09 0.00 0.00 178.44 178.47 1ocz h LEU 176 N -0.16 -0.32 -0.82 1.67 3.38 -1.02 -0.58 115.31 117.47 1ocz h LEU 176 Ca -0.00 0.11 -0.06 0.00 0.09 0.00 0.00 57.88 58.02 1ocz h LEU 176 Cb 0.15 0.22 -0.03 0.00 0.09 0.00 0.00 40.66 41.09 1ocz h LEU 176 CO 0.01 -0.11 0.21 -0.61 0.09 0.00 0.00 178.44 178.02 1ocz h GLN 177 N 0.01 1.09 -0.65 1.13 5.75 -0.83 -2.29 115.11 119.32 1ocz h GLN 177 Ca 0.18 -0.23 0.04 0.00 -0.15 0.00 0.00 58.65 58.49 1ocz h GLN 177 Cb 0.27 -0.16 -0.05 0.00 1.07 0.00 0.00 27.48 28.61 1ocz h GLN 177 CO -0.37 0.93 0.39 0.00 -2.65 0.00 0.00 178.83 177.13 1ocz h ALA 178 N 1.18 0.86 -0.63 3.38 0.00 0.66 -1.70 119.26 123.01 1ocz h ALA 178 Ca 0.23 -0.00 -0.09 0.00 0.00 0.00 0.00 54.91 55.04 1ocz h ALA 178 Cb 0.31 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 17.91 1ocz h ALA 178 CO -0.01 0.11 0.04 0.66 0.00 0.00 0.00 179.25 180.05 1ocz h SER 179 N 0.74 1.05 -0.94 0.00 4.64 -0.73 -2.04 113.55 116.27 1ocz h SER 179 Ca 0.28 -0.29 0.03 0.00 -0.47 0.00 0.00 61.79 61.33 1ocz h SER 179 Cb 0.09 -0.28 -0.05 0.00 -0.31 0.00 0.00 62.40 61.85 1ocz h SER 179 CO -0.14 1.08 0.62 -0.33 -0.87 0.00 0.00 176.83 177.19 1ocz h GLU 180 N 0.99 1.18 -0.77 4.77 4.39 -1.02 0.30 114.58 124.41 1ocz h GLU 180 Ca 0.18 -0.07 0.06 0.00 0.34 0.00 0.00 59.36 59.87 1ocz h GLU 180 Cb 0.51 -0.27 -0.06 0.00 -0.10 0.00 0.00 28.75 28.84 1ocz h GLU 180 CO 0.02 0.78 0.46 1.88 -1.16 0.00 0.00 179.01 181.00 1ocz h TYR 181 N 1.22 0.86 0.16 4.33 -1.99 -0.61 0.42 116.97 121.35 1ocz h TYR 181 Ca 0.36 0.03 -0.01 0.00 2.00 0.00 0.00 58.73 61.11 1ocz h TYR 181 Cb -0.05 -0.27 0.00 0.00 2.00 0.00 0.00 36.73 38.41 1ocz h TYR 181 CO -0.00 0.43 -0.08 -0.92 -0.00 0.00 0.00 178.16 177.60 1ocz h TYR 182 N 0.85 -0.20 0.00 4.88 3.20 -0.76 -3.24 116.97 121.71 1ocz h TYR 182 Ca 0.34 -0.00 -0.04 0.00 3.14 0.00 0.00 58.73 62.16 1ocz h TYR 182 Cb 0.16 0.07 -0.01 0.00 1.54 0.00 0.00 36.73 38.49 1ocz h TYR 182 CO -0.05 0.22 -0.18 0.93 -1.64 0.00 0.00 178.16 177.44 1ocz h GLU 183 N -0.72 0.00 -6.64 1.82 4.39 -0.25 -3.45 114.58 109.73 1ocz h GLU 183 Ca -0.02 0.00 -0.54 0.00 0.34 0.00 0.00 59.36 59.13 1ocz h GLU 183 Cb 0.51 0.00 0.07 0.00 -0.10 0.00 0.00 28.75 29.23 1ocz h GLU 183 CO 0.04 0.18 0.91 0.00 -1.16 0.00 0.00 179.01 178.97 1ocz n ALA 184 N -2.32 2.30 1.56 3.43 0.00 0.15 -4.90 120.51 120.72 1ocz n ALA 184 Ca -0.02 0.41 0.11 0.00 0.00 0.00 0.00 53.44 53.94 1ocz n ALA 184 Cb 0.29 -2.45 0.66 0.00 0.00 0.00 0.00 19.45 17.95 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 3.35 0.78 -4.69 0.00 -0.04 -1.26 -4.86 135.00 128.27 1ocz n PRO 185 Ca 0.14 0.00 -0.31 0.00 -0.04 0.00 0.00 63.50 63.30 1ocz n PRO 185 Cb 0.33 -1.44 -0.09 0.00 -0.04 0.00 0.00 33.50 32.26 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 2.11 0.30 0.54 -0.71 -1.26 -4.90 117.98 112.06 1ocz s PHE 186 Ca 0.33 -0.86 -0.04 0.00 -1.04 0.00 0.00 56.93 55.32 1ocz s PHE 186 Cb 0.15 -1.66 -0.00 0.00 -1.21 0.00 0.00 43.02 40.30 1ocz s PHE 186 CO 0.26 0.29 0.43 0.95 -1.34 0.00 0.00 175.22 175.81 1ocz s THR 187 N -2.83 0.00 0.54 -4.49 -4.23 -1.26 -5.02 115.64 98.35 1ocz s THR 187 Ca 0.18 -1.61 0.21 0.00 -1.18 0.00 0.00 61.69 59.29 1ocz s THR 187 Cb 0.05 -2.52 0.31 0.00 1.34 0.00 0.00 72.50 71.68 1ocz s THR 187 CO 0.09 0.00 2.14 0.16 -0.54 0.00 0.00 174.62 176.47 1ocz h ILE 188 N 2.20 0.83 -0.01 2.99 -0.00 -1.96 -1.81 117.51 119.75 1ocz h ILE 188 Ca -0.29 0.00 0.00 0.00 -0.00 0.00 0.00 64.86 64.57 1ocz h ILE 188 Cb 1.24 0.94 0.00 0.00 -0.00 0.00 0.00 36.82 39.00 1ocz h ILE 188 CO 0.40 0.00 -0.01 -1.54 -0.00 0.00 0.00 178.15 176.99 1ocz n SER 189 N -4.33 0.57 -3.04 2.16 3.41 -1.26 -3.38 113.62 107.75 1ocz n SER 189 Ca -0.01 -1.11 -0.34 0.00 -0.26 0.00 0.00 58.87 57.16 1ocz n SER 189 Cb 0.19 -0.01 -0.04 0.00 -0.26 0.00 0.00 64.21 64.09 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 -0.59 7.47 0.00 4.04 9.92 -0.68 -4.97 116.55 131.73 1ocz n ASP 190 Ca 0.21 -3.01 0.00 0.00 -0.53 0.00 0.00 54.79 51.46 1ocz n ASP 190 Cb 0.21 -1.36 0.00 0.00 -0.64 0.00 0.00 41.12 39.33 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 1.85 1.34 0.21 0.44 0.00 -1.26 -3.03 105.19 104.74 1ocz n GLY 191 Ca 0.59 -0.68 -0.17 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 1.29 -0.17 1.61 2.07 -1.93 -2.11 116.25 117.01 1ocz h VAL 192 Ca 0.00 -2.07 0.02 0.00 0.82 0.00 0.00 66.70 65.47 1ocz h VAL 192 Cb 0.00 2.10 -0.02 0.00 -1.52 0.00 0.00 31.29 31.85 1ocz h VAL 192 CO 0.00 0.65 0.03 0.22 0.02 0.00 0.00 177.57 178.49 1ocz h TYR 193 N 0.48 0.06 -0.17 1.57 5.03 -1.96 -0.10 116.97 121.88 1ocz h TYR 193 Ca -0.07 0.01 -0.03 0.00 2.58 0.00 0.00 58.73 61.22 1ocz h TYR 193 Cb 1.48 -0.00 -0.01 0.00 1.55 0.00 0.00 36.73 39.75 1ocz h TYR 193 CO 0.09 0.02 -0.03 0.78 -1.32 0.00 0.00 178.16 177.70 1ocz h GLY 194 N 0.10 0.34 0.17 1.82 0.00 -1.62 -1.91 103.07 101.97 1ocz h GLY 194 Ca 0.08 -0.27 0.07 0.00 0.00 0.00 0.00 47.33 47.21 1ocz h GLY 194 CO -0.10 0.24 -0.15 1.76 0.00 0.00 0.00 176.54 178.29 1ocz h SER 195 N 0.03 -0.53 -0.47 0.19 0.02 -1.13 0.32 113.55 111.98 1ocz h SER 195 Ca 0.04 0.13 -0.12 0.00 -0.84 0.00 0.00 61.79 61.00 1ocz h SER 195 Cb 0.44 0.30 -0.01 0.00 0.14 0.00 0.00 62.40 63.27 1ocz h SER 195 CO 0.01 -0.19 -0.17 0.00 -1.14 0.00 0.00 176.83 175.34 1ocz h THR 196 N -0.09 1.27 -0.03 -2.27 1.03 -1.06 -2.81 112.91 108.94 1ocz h THR 196 Ca 0.17 -1.32 -0.06 0.00 -0.01 0.00 0.00 66.41 65.20 1ocz h THR 196 Cb 0.36 1.14 0.00 0.00 -1.07 0.00 0.00 68.15 68.58 1ocz h THR 196 CO -0.41 0.45 -0.21 0.15 -0.01 0.00 0.00 175.52 175.49 1ocz h PHE 197 N 0.78 0.28 0.00 0.00 3.04 -1.02 -3.07 116.94 116.94 1ocz h PHE 197 Ca 0.11 -0.13 -0.09 0.00 3.98 0.00 0.00 57.97 61.85 1ocz h PHE 197 Cb 0.74 -0.04 -0.01 0.00 2.56 0.00 0.00 35.95 39.19 1ocz h PHE 197 CO 0.05 0.86 -0.41 0.74 -2.02 0.00 0.00 178.31 177.53 1ocz h PHE 198 N -0.39 0.00 0.08 0.41 0.04 -1.03 -2.40 116.94 113.65 1ocz h PHE 198 Ca -0.02 0.00 -0.30 0.00 2.80 0.00 0.00 57.97 60.45 1ocz h PHE 198 Cb 0.89 0.00 -0.02 0.00 2.20 0.00 0.00 35.95 39.02 1ocz h PHE 198 CO 0.15 0.41 -1.57 -0.39 -0.60 0.00 0.00 178.31 176.31 1ocz h VAL 199 N 0.00 1.08 0.40 -0.55 -1.51 -1.61 -2.12 116.25 111.95 1ocz h VAL 199 Ca -0.00 -2.79 -0.02 0.00 -1.23 0.00 0.00 66.70 62.66 1ocz h VAL 199 Cb 0.84 2.66 0.00 0.00 -2.13 0.00 0.00 31.29 32.66 1ocz h VAL 199 CO 0.05 0.76 -0.19 0.00 -1.23 0.00 0.00 177.57 176.97 1ocz h ALA 200 N 0.62 -0.54 -0.29 5.19 0.00 -1.58 0.13 119.26 122.80 1ocz h ALA 200 Ca -0.25 -0.19 -0.03 0.00 0.00 0.00 0.00 54.91 54.44 1ocz h ALA 200 Cb 1.99 0.21 -0.02 0.00 0.00 0.00 0.00 17.79 19.97 1ocz h ALA 200 CO 0.13 -0.63 0.04 1.79 0.00 0.00 0.00 179.25 180.58 1ocz h THR 201 N -0.89 1.15 -0.12 0.00 1.35 -1.61 -1.21 112.91 111.59 1ocz h THR 201 Ca -0.05 -0.57 -0.05 0.00 -0.55 0.00 0.00 66.41 65.18 1ocz h THR 201 Cb 0.55 0.90 -0.00 0.00 -1.73 0.00 0.00 68.15 67.87 1ocz h THR 201 CO 0.09 0.20 -0.12 1.23 -0.25 0.00 0.00 175.52 176.67 1ocz h GLY 202 N 0.68 0.32 1.16 5.82 0.00 -1.28 0.16 103.07 109.94 1ocz h GLY 202 Ca 0.10 -0.33 -0.07 0.00 0.00 0.00 0.00 47.33 47.02 1ocz h GLY 202 CO 0.00 0.30 0.10 0.74 0.00 0.00 0.00 176.54 177.68 1ocz h PHE 203 N -0.10 1.09 -0.55 5.60 0.04 -0.63 -1.14 116.94 121.26 1ocz h PHE 203 Ca 0.02 -0.14 -0.05 0.00 2.80 0.00 0.00 57.97 60.59 1ocz h PHE 203 Cb 0.65 -0.30 -0.03 0.00 2.20 0.00 0.00 35.95 38.47 1ocz h PHE 203 CO 0.09 0.92 0.13 1.25 -0.60 0.00 0.00 178.31 180.09 1ocz h HIS 204 N 0.97 0.87 -0.33 -0.55 2.76 -1.11 -1.42 115.15 116.34 1ocz h HIS 204 Ca 0.19 -0.08 -0.07 0.00 -2.20 0.00 0.00 60.37 58.21 1ocz h HIS 204 Cb 0.42 -0.25 -0.02 0.00 1.55 0.00 0.00 27.41 29.11 1ocz h HIS 204 CO 0.03 0.73 -0.09 0.78 -1.30 0.00 0.00 177.93 178.09 1ocz h GLY 205 N 0.98 0.59 2.00 5.26 0.00 -0.05 -0.97 103.07 110.88 1ocz h GLY 205 Ca 0.18 -0.40 -0.10 0.00 0.00 0.00 0.00 47.33 47.01 1ocz h GLY 205 CO -0.00 0.37 -0.49 -2.00 0.00 0.00 0.00 176.54 174.41 1ocz h LEU 206 N 0.51 0.00 -0.58 3.11 5.85 -0.67 -2.67 115.31 120.86 1ocz h LEU 206 Ca 0.10 0.00 -0.15 0.00 0.84 0.00 0.00 57.88 58.67 1ocz h LEU 206 Cb 0.46 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.48 1ocz h LEU 206 CO 0.02 0.49 -0.49 0.45 -0.34 0.00 0.00 178.44 178.58 1ocz h HIS 207 N 0.00 0.70 -0.11 1.25 3.86 -0.14 -1.16 115.15 119.55 1ocz h HIS 207 Ca -0.00 -0.23 -0.11 0.00 -1.16 0.00 0.00 60.37 58.86 1ocz h HIS 207 Cb 0.90 -0.14 -0.01 0.00 1.06 0.00 0.00 27.41 29.22 1ocz h HIS 207 CO 0.00 0.95 -0.44 0.28 0.86 0.00 0.00 177.93 179.57 1ocz h VAL 208 N 0.45 1.32 -0.34 2.45 2.07 -1.14 0.33 116.25 121.39 1ocz h VAL 208 Ca 0.02 -1.60 -0.12 0.00 0.82 0.00 0.00 66.70 65.83 1ocz h VAL 208 Cb 1.01 1.73 -0.01 0.00 -1.52 0.00 0.00 31.29 32.50 1ocz h VAL 208 CO 0.09 0.48 -0.25 0.40 0.02 0.00 0.00 177.57 178.32 1ocz h ILE 209 N 0.21 1.29 -0.28 4.57 2.04 -1.33 0.37 117.51 124.38 1ocz h ILE 209 Ca 0.02 -1.39 -0.11 0.00 1.00 0.00 0.00 64.86 64.37 1ocz h ILE 209 Cb 0.87 1.43 -0.01 0.00 -0.74 0.00 0.00 36.82 38.36 1ocz h ILE 209 CO 0.07 0.46 -0.28 0.40 0.00 0.00 0.00 178.15 178.80 1ocz h ILE 210 N 0.55 1.28 0.00 -0.67 2.04 -0.89 -1.88 117.51 117.94 1ocz h ILE 210 Ca 0.07 -1.35 -0.18 0.00 1.00 0.00 0.00 64.86 64.39 1ocz h ILE 210 Cb 0.81 1.37 -0.02 0.00 -0.74 0.00 0.00 36.82 38.23 1ocz h ILE 210 CO 0.07 0.43 -0.86 1.23 0.00 0.00 0.00 178.15 179.02 1ocz h GLY 211 N 1.02 0.03 0.92 5.37 0.00 -0.20 -2.86 103.07 107.35 1ocz h GLY 211 Ca 0.06 -0.05 -0.16 0.00 0.00 0.00 0.00 47.33 47.19 1ocz h GLY 211 CO 0.06 0.04 -0.56 1.76 0.00 0.00 0.00 176.54 177.84 1ocz h SER 212 N 0.01 0.67 -0.09 0.19 0.02 -0.76 -2.29 113.55 111.30 1ocz h SER 212 Ca -0.01 -0.65 -0.05 0.00 -0.84 0.00 0.00 61.79 60.23 1ocz h SER 212 Cb 1.52 -0.20 -0.01 0.00 0.14 0.00 0.00 62.40 63.84 1ocz h SER 212 CO 0.11 1.21 -0.08 0.00 -1.14 0.00 0.00 176.83 176.94 1ocz h THR 213 N 0.17 1.19 0.19 -2.27 1.03 -1.41 0.78 112.91 112.58 1ocz h THR 213 Ca -0.04 -0.80 0.00 0.00 -0.01 0.00 0.00 66.41 65.56 1ocz h THR 213 Cb 1.21 1.10 -0.01 0.00 -1.07 0.00 0.00 68.15 69.38 1ocz h THR 213 CO 0.12 0.26 -0.17 0.15 -0.01 0.00 0.00 175.52 175.87 1ocz h PHE 214 N 0.35 -0.44 -0.97 0.00 3.04 -1.42 -0.17 116.94 117.33 1ocz h PHE 214 Ca 0.07 0.00 0.03 0.00 3.98 0.00 0.00 57.97 62.06 1ocz h PHE 214 Cb 0.37 0.17 -0.06 0.00 2.56 0.00 0.00 35.95 38.99 1ocz h PHE 214 CO 0.01 -0.26 0.64 -0.07 -2.02 0.00 0.00 178.31 176.61 1ocz h LEU 215 N -0.38 1.06 -0.76 0.59 3.38 -0.89 -1.32 115.31 117.00 1ocz h LEU 215 Ca -0.00 -0.01 0.02 0.00 0.09 0.00 0.00 57.88 57.98 1ocz h LEU 215 Cb 0.35 -0.24 -0.04 0.00 0.09 0.00 0.00 40.66 40.81 1ocz h LEU 215 CO -0.03 0.73 0.49 0.40 0.09 0.00 0.00 178.44 180.12 1ocz h ILE 216 N 1.23 1.15 -0.70 1.22 2.04 -0.18 0.37 117.51 122.64 1ocz h ILE 216 Ca 0.39 -0.34 -0.00 0.00 1.00 0.00 0.00 64.86 65.91 1ocz h ILE 216 Cb -0.01 0.09 -0.03 0.00 -0.74 0.00 0.00 36.82 36.13 1ocz h ILE 216 CO -0.12 0.18 0.43 0.58 0.00 0.00 0.00 178.15 179.21 1ocz h VAL 217 N 0.98 1.20 -0.16 1.67 2.07 -0.14 0.33 116.25 122.20 1ocz h VAL 217 Ca 0.29 -0.44 -0.06 0.00 0.82 0.00 0.00 66.70 67.31 1ocz h VAL 217 Cb -0.05 0.22 -0.01 0.00 -1.52 0.00 0.00 31.29 29.93 1ocz h VAL 217 CO -0.09 0.21 -0.17 0.00 0.02 0.00 0.00 177.57 177.54 1ocz h PHE 219 N 0.24 -0.10 -0.46 0.00 3.57 0.18 -2.09 116.94 118.28 1ocz h PHE 219 Ca 0.05 -0.00 -0.09 0.00 3.53 0.00 0.00 57.97 61.45 1ocz h PHE 219 Cb 0.45 0.03 -0.02 0.00 2.79 0.00 0.00 35.95 39.21 1ocz h PHE 219 CO 0.01 -0.06 -0.07 0.74 -2.23 0.00 0.00 178.31 176.70 1ocz h PHE 220 N -0.11 0.96 -0.67 0.41 0.04 -0.95 -2.23 116.94 114.39 1ocz h PHE 220 Ca -0.01 -0.19 0.10 0.00 2.80 0.00 0.00 57.97 60.67 1ocz h PHE 220 Cb 0.08 -0.24 -0.04 0.00 2.20 0.00 0.00 35.95 37.95 1ocz h PHE 220 CO -0.07 0.94 0.45 0.00 -0.60 0.00 0.00 178.31 179.02 1ocz h ARG 221 N 0.71 0.48 -0.27 1.51 3.08 -1.15 -1.40 114.38 117.35 1ocz h ARG 221 Ca 0.12 -0.03 -0.10 0.00 0.07 0.00 0.00 59.98 60.04 1ocz h ARG 221 Cb 0.60 -0.11 -0.00 0.00 0.08 0.00 0.00 29.97 30.54 1ocz h ARG 221 CO 0.04 0.32 -0.24 0.37 -1.07 0.00 0.00 179.97 179.39 1ocz h GLN 222 N 0.50 0.64 -0.32 0.04 5.75 -0.80 -0.62 115.11 120.30 1ocz h GLN 222 Ca 0.31 -0.33 0.07 0.00 -0.15 0.00 0.00 58.65 58.55 1ocz h GLN 222 Cb 0.55 0.01 -0.02 0.00 1.07 0.00 0.00 27.48 29.09 1ocz h GLN 222 CO -0.10 0.93 0.22 -0.07 -2.65 0.00 0.00 178.83 177.16 1ocz h LEU 223 N 0.36 0.12 -1.03 -2.39 3.38 -0.83 1.00 115.31 115.93 1ocz h LEU 223 Ca 0.05 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.02 1ocz h LEU 223 Cb 0.80 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 41.52 1ocz h LEU 223 CO 0.06 0.08 0.00 0.29 0.09 0.00 0.00 178.44 178.96 1ocz n LYS 224 N -4.47 1.65 -1.75 1.13 5.02 -0.83 -4.92 118.16 113.99 1ocz n LYS 224 Ca 0.04 -1.00 -0.19 0.00 -2.02 0.00 0.00 58.31 55.14 1ocz n LYS 224 Cb 0.30 -1.23 -0.06 0.00 -0.02 0.00 0.00 35.03 34.02 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 0.31 -0.23 -0.21 2.13 3.01 0.34 -4.92 117.46 117.90 1ocz n PHE 225 Ca 0.10 0.00 -0.01 0.00 1.01 0.00 0.00 57.45 58.55 1ocz n PHE 225 Cb 0.24 -3.27 0.21 0.00 -0.01 0.00 0.00 39.48 36.65 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 0.96 -3.08 1.38 3.86 -1.31 -3.44 115.15 113.52 1ocz h HIS 226 Ca -0.39 -0.02 -0.60 0.00 -1.16 0.00 0.00 60.37 58.20 1ocz h HIS 226 Cb 1.24 -0.31 -0.05 0.00 1.06 0.00 0.00 27.41 29.35 1ocz h HIS 226 CO 0.51 0.67 -0.15 -0.06 0.86 0.00 0.00 177.93 179.76 1ocz s PHE 227 N -5.66 3.75 0.30 2.45 0.08 -1.26 -4.96 117.98 112.68 1ocz s PHE 227 Ca -0.11 1.07 0.07 0.00 0.12 0.00 0.00 56.93 58.09 1ocz s PHE 227 Cb 0.17 -2.35 -0.03 0.00 -0.57 0.00 0.00 43.02 40.24 1ocz s PHE 227 CO 0.79 0.63 0.25 0.95 -0.10 0.00 0.00 175.22 177.74 1ocz s THR 228 N -1.08 4.00 0.51 0.64 -4.23 -0.85 -4.99 115.64 109.64 1ocz s THR 228 Ca 0.25 -1.37 0.29 0.00 -1.18 0.00 0.00 61.69 59.68 1ocz s THR 228 Cb -0.17 -3.30 0.47 0.00 1.34 0.00 0.00 72.50 70.83 1ocz s THR 228 CO 0.15 -0.26 1.86 0.77 -0.54 0.00 0.00 174.62 176.61 1ocz h SER 229 N 1.35 0.10 -0.01 3.99 4.64 -1.93 -2.36 113.55 119.32 1ocz h SER 229 Ca -0.47 0.01 0.00 0.00 -0.47 0.00 0.00 61.79 60.87 1ocz h SER 229 Cb 1.25 -0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.33 1ocz h SER 229 CO 0.59 0.03 -0.09 0.59 -0.87 0.00 0.00 176.83 177.09 1ocz n ASN 230 N -4.32 1.35 -3.73 4.97 3.02 -1.26 -4.29 115.26 110.99 1ocz n ASN 230 Ca 0.20 -1.17 -0.28 0.00 -0.03 0.00 0.00 54.58 53.30 1ocz n ASN 230 Cb 0.95 0.25 -0.16 0.00 -0.61 0.00 0.00 39.78 40.21 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 -0.93 1.14 -0.39 3.10 2.46 -0.89 -4.96 115.29 114.82 1ocz s HIS 231 Ca 0.08 -1.02 0.08 0.00 0.47 0.00 0.00 55.06 54.67 1ocz s HIS 231 Cb 0.06 -1.14 0.37 0.00 -0.13 0.00 0.00 32.58 31.74 1ocz s HIS 231 CO 0.15 -0.67 1.34 -2.39 -2.47 0.00 0.00 174.74 170.70 1ocz n HIS 232 N 5.02 -2.33 -0.36 3.88 1.44 -1.26 -2.01 115.22 119.60 1ocz n HIS 232 Ca -0.08 -1.83 0.06 0.00 -2.01 0.00 0.00 57.72 53.86 1ocz n HIS 232 Cb 0.46 1.58 0.23 0.00 0.12 0.00 0.00 29.99 32.38 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 1.94 1.14 -1.00 -1.40 3.57 -1.96 0.10 116.94 119.33 1ocz h PHE 233 Ca -0.30 0.03 0.28 0.00 3.53 0.00 0.00 57.97 61.51 1ocz h PHE 233 Cb 1.30 -0.37 -0.05 0.00 2.79 0.00 0.00 35.95 39.62 1ocz h PHE 233 CO 0.12 0.48 0.70 0.78 -2.23 0.00 0.00 178.31 178.16 1ocz h GLY 234 N 1.02 0.27 1.09 2.40 0.00 -1.99 0.37 103.07 106.24 1ocz h GLY 234 Ca 0.48 -0.05 -0.28 0.00 0.00 0.00 0.00 47.33 47.48 1ocz h GLY 234 CO -0.24 -0.02 -1.63 -2.75 0.00 0.00 0.00 176.54 171.89 1ocz h PHE 235 N 0.10 0.02 0.23 5.60 3.57 -1.24 -1.98 116.94 123.23 1ocz h PHE 235 Ca 0.49 -0.01 -0.01 0.00 3.53 0.00 0.00 57.97 61.97 1ocz h PHE 235 Cb 1.77 -0.00 0.00 0.00 2.79 0.00 0.00 35.95 40.51 1ocz h PHE 235 CO -0.00 1.03 -0.11 0.93 -2.23 0.00 0.00 178.31 177.93 1ocz h GLU 236 N 0.00 -0.29 -0.69 1.11 4.39 -0.07 -0.95 114.58 118.08 1ocz h GLU 236 Ca -0.26 0.02 0.08 0.00 0.34 0.00 0.00 59.36 59.54 1ocz h GLU 236 Cb 1.99 0.07 -0.07 0.00 -0.10 0.00 0.00 28.75 30.64 1ocz h GLU 236 CO 0.09 -0.05 0.35 0.00 -1.16 0.00 0.00 179.01 178.23 1ocz h ALA 237 N 0.23 0.94 -0.77 3.43 0.00 -0.52 -0.09 119.26 122.48 1ocz h ALA 237 Ca -0.03 0.04 0.02 0.00 0.00 0.00 0.00 54.91 54.95 1ocz h ALA 237 Cb 0.37 -0.07 -0.04 0.00 0.00 0.00 0.00 17.79 18.05 1ocz h ALA 237 CO 0.05 -0.03 0.50 0.78 0.00 0.00 0.00 179.25 180.55 1ocz h GLY 238 N 0.62 1.11 1.91 0.00 0.00 -1.24 -1.15 103.07 104.31 1ocz h GLY 238 Ca 0.33 -0.38 -0.14 0.00 0.00 0.00 0.00 47.33 47.13 1ocz h GLY 238 CO -0.24 0.34 -0.66 0.00 0.00 0.00 0.00 176.54 175.98 1ocz h ALA 239 N 1.31 0.87 0.15 3.60 0.00 0.31 -1.87 119.26 123.63 1ocz h ALA 239 Ca 0.30 -0.59 -0.01 0.00 0.00 0.00 0.00 54.91 54.62 1ocz h ALA 239 Cb -0.03 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 17.67 1ocz h ALA 239 CO -0.10 0.79 -0.07 -1.49 0.00 0.00 0.00 179.25 178.39 1ocz h TRP 240 N 0.07 -0.19 -0.88 0.00 6.55 -0.58 -1.32 115.95 119.60 1ocz h TRP 240 Ca -0.01 -0.00 0.01 0.00 0.95 0.00 0.00 58.89 59.83 1ocz h TRP 240 Cb 1.17 0.06 -0.04 0.00 -0.86 0.00 0.00 29.16 29.49 1ocz h TRP 240 CO 0.01 0.09 0.57 -0.92 -1.05 0.00 0.00 178.44 177.15 1ocz h TYR 241 N -0.46 1.12 -0.19 0.49 3.20 -1.22 -1.23 116.97 118.69 1ocz h TYR 241 Ca -0.02 0.02 -0.00 0.00 3.14 0.00 0.00 58.73 61.87 1ocz h TYR 241 Cb 0.36 -0.38 -0.01 0.00 1.54 0.00 0.00 36.73 38.25 1ocz h TYR 241 CO 0.01 0.72 0.11 2.35 -1.64 0.00 0.00 178.16 179.71 1ocz h TRP 242 N 1.20 0.26 -0.18 -3.82 2.91 -1.21 0.37 115.95 115.49 1ocz h TRP 242 Ca 0.32 -0.00 -0.01 0.00 1.13 0.00 0.00 58.89 60.33 1ocz h TRP 242 Cb -0.12 -0.08 -0.01 0.00 -0.51 0.00 0.00 29.16 28.44 1ocz h TRP 242 CO -0.01 0.23 0.05 0.45 -1.03 0.00 0.00 178.44 178.13 1ocz h HIS 243 N 0.22 0.24 0.01 2.65 3.86 -0.77 -1.33 115.15 120.02 1ocz h HIS 243 Ca 0.07 -0.00 -0.00 0.00 -1.16 0.00 0.00 60.37 59.27 1ocz h HIS 243 Cb 0.05 -0.08 0.00 0.00 1.06 0.00 0.00 27.41 28.45 1ocz h HIS 243 CO -0.04 0.21 -0.00 0.35 0.86 0.00 0.00 177.93 179.30 1ocz h PHE 244 N 0.24 -0.01 -0.85 2.45 3.57 -0.41 -2.47 116.94 119.47 1ocz h PHE 244 Ca 0.06 -0.00 0.15 0.00 3.53 0.00 0.00 57.97 61.72 1ocz h PHE 244 Cb 0.09 0.00 -0.06 0.00 2.79 0.00 0.00 35.95 38.77 1ocz h PHE 244 CO 0.00 0.20 0.55 0.28 -2.23 0.00 0.00 178.31 177.11 1ocz h VAL 245 N -0.22 0.80 0.55 1.41 2.07 0.10 -1.81 116.25 119.15 1ocz h VAL 245 Ca -0.00 -0.19 -0.03 0.00 0.82 0.00 0.00 66.70 67.30 1ocz h VAL 245 Cb 0.21 0.19 0.01 0.00 -1.52 0.00 0.00 31.29 30.18 1ocz h VAL 245 CO 0.00 0.10 -0.27 0.44 0.02 0.00 0.00 177.57 177.87 1ocz h ASP 246 N 0.56 -0.63 -0.94 0.57 3.32 -1.06 -2.98 116.42 115.25 1ocz h ASP 246 Ca 0.43 -0.02 0.28 0.00 0.02 0.00 0.00 57.03 57.74 1ocz h ASP 246 Cb 0.83 0.16 -0.15 0.00 0.22 0.00 0.00 39.33 40.40 1ocz h ASP 246 CO -0.17 -0.23 0.40 0.58 -1.72 0.00 0.00 179.24 178.09 1ocz h VAL 247 N -1.14 0.30 -0.41 -1.35 2.07 -0.94 0.58 116.25 115.36 1ocz h VAL 247 Ca -0.08 -0.09 -0.02 0.00 0.82 0.00 0.00 66.70 67.33 1ocz h VAL 247 Cb 0.61 0.01 -0.02 0.00 -1.52 0.00 0.00 31.29 30.38 1ocz h VAL 247 CO 0.13 0.05 0.18 0.58 0.02 0.00 0.00 177.57 178.52 1ocz h VAL 248 N 0.27 1.18 -0.42 2.57 2.07 -1.41 -1.63 116.25 118.88 1ocz h VAL 248 Ca 0.64 -0.54 -0.02 0.00 0.82 0.00 0.00 66.70 67.60 1ocz h VAL 248 Cb 1.38 0.79 -0.02 0.00 -1.52 0.00 0.00 31.29 31.92 1ocz h VAL 248 CO -0.64 0.20 0.17 -0.25 0.02 0.00 0.00 177.57 177.08 1ocz h TRP 249 N 0.51 0.59 -0.11 1.57 2.91 0.16 -0.05 115.95 121.54 1ocz h TRP 249 Ca 0.14 -0.02 -0.06 0.00 1.13 0.00 0.00 58.89 60.07 1ocz h TRP 249 Cb 0.15 -0.19 -0.01 0.00 -0.51 0.00 0.00 29.16 28.60 1ocz h TRP 249 CO -0.01 0.47 -0.22 -0.07 -1.03 0.00 0.00 178.44 177.58 1ocz h LEU 250 N 0.60 0.18 -0.00 0.65 3.38 -0.15 -0.34 115.31 119.62 1ocz h LEU 250 Ca 0.15 -0.05 -0.26 0.00 0.09 0.00 0.00 57.88 57.81 1ocz h LEU 250 Cb 0.12 -0.05 0.01 0.00 0.09 0.00 0.00 40.66 40.83 1ocz h LEU 250 CO -0.02 0.41 -1.11 -0.26 0.09 0.00 0.00 178.44 177.55 1ocz h PHE 251 N 0.17 0.73 -0.22 1.13 0.04 -0.26 -2.68 116.94 115.85 1ocz h PHE 251 Ca 0.03 -0.45 -0.04 0.00 2.80 0.00 0.00 57.97 60.31 1ocz h PHE 251 Cb 0.49 -0.06 -0.01 0.00 2.20 0.00 0.00 35.95 38.57 1ocz h PHE 251 CO 0.01 1.30 -0.03 -0.07 -0.60 0.00 0.00 178.31 178.91 1ocz h LEU 252 N 0.22 0.41 0.27 1.54 3.38 -0.94 -2.38 115.31 117.80 1ocz h LEU 252 Ca -0.13 -0.34 0.00 0.00 0.09 0.00 0.00 57.88 57.50 1ocz h LEU 252 Cb 1.78 -0.11 -0.04 0.00 0.09 0.00 0.00 40.66 42.38 1ocz h LEU 252 CO 0.20 0.65 -0.51 0.22 0.09 0.00 0.00 178.44 179.09 1ocz h TYR 253 N 0.16 -1.46 -0.37 1.13 3.20 -1.07 0.85 116.97 119.40 1ocz h TYR 253 Ca 0.06 0.03 -0.01 0.00 3.14 0.00 0.00 58.73 61.95 1ocz h TYR 253 Cb 0.46 0.60 -0.02 0.00 1.54 0.00 0.00 36.73 39.32 1ocz h TYR 253 CO 0.04 -0.62 0.19 0.28 -1.64 0.00 0.00 178.16 176.41 1ocz h VAL 254 N -0.85 1.13 0.00 1.81 2.07 -1.54 -1.66 116.25 117.21 1ocz h VAL 254 Ca -0.02 -0.34 0.00 0.00 0.82 0.00 0.00 66.70 67.15 1ocz h VAL 254 Cb 0.80 0.64 0.00 0.00 -1.52 0.00 0.00 31.29 31.22 1ocz h VAL 254 CO -0.20 0.14 -0.20 0.28 0.02 0.00 0.00 177.57 177.62 1ocz h SER 255 N 0.51 0.00 0.10 0.57 0.02 -0.95 -2.63 113.55 111.17 1ocz h SER 255 Ca 0.13 0.00 -0.18 0.00 -0.84 0.00 0.00 61.79 60.90 1ocz h SER 255 Cb 0.04 0.00 0.01 0.00 0.14 0.00 0.00 62.40 62.59 1ocz h SER 255 CO -0.02 0.58 -0.86 0.40 -1.14 0.00 0.00 176.83 175.78 1ocz h ILE 256 N -0.96 1.39 0.07 3.27 2.04 -0.98 0.31 117.51 122.66 1ocz h ILE 256 Ca 0.00 -2.44 -0.25 0.00 1.00 0.00 0.00 64.86 63.17 1ocz h ILE 256 Cb 0.20 3.03 0.00 0.00 -0.74 0.00 0.00 36.82 39.31 1ocz h ILE 256 CO 0.00 0.66 -1.10 1.88 0.00 0.00 0.00 178.15 179.59 1ocz h TYR 257 N -0.52 0.54 0.00 1.37 -1.99 -1.37 -3.31 116.97 111.69 1ocz h TYR 257 Ca -0.18 -0.34 0.00 0.00 2.00 0.00 0.00 58.73 60.21 1ocz h TYR 257 Cb 1.53 -0.04 0.00 0.00 2.00 0.00 0.00 36.73 40.22 1ocz h TYR 257 CO 0.19 1.22 0.00 1.87 -0.00 0.00 0.00 178.16 181.43 1ocz n TRP 258 N -3.63 0.00 0.04 4.88 -0.00 -0.65 -4.27 117.44 113.80 1ocz n TRP 258 Ca -0.08 0.00 -0.11 0.00 -0.00 0.00 0.00 57.50 57.31 1ocz n TRP 258 Cb 0.94 -0.01 -0.05 0.00 -0.00 0.00 0.00 31.31 32.19 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 -0.15 0.00 5.87 7.01 -1.58 -2.97 115.95 124.13 1ocz h TRP 259 Ca 0.00 0.01 0.00 0.00 2.11 0.00 0.00 58.89 61.01 1ocz h TRP 259 Cb 0.00 0.07 0.00 0.00 -2.10 0.00 0.00 29.16 27.13 1ocz h TRP 259 CO 0.00 -0.10 0.00 0.41 -2.79 0.00 0.00 178.44 175.96 1ocz n GLY 260 N -1.18 1.39 0.00 2.65 0.00 0.11 -5.01 105.19 103.15 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