#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1zrh s ALA 13 N 0.00 2.09 0.37 3.52 0.00 0.54 -4.91 121.76 123.37 1zrh s ALA 13 Ca 0.00 -0.03 0.12 0.00 0.00 0.00 0.00 51.96 52.05 1zrh s ALA 13 Cb 0.00 -3.17 0.92 0.00 0.00 0.00 0.00 23.12 20.86 1zrh s ALA 13 CO 0.00 -1.86 1.84 -1.00 0.00 0.00 0.00 175.76 174.73 1zrh h PRO 14 N -1.19 0.57 0.00 0.00 0.13 -2.07 -1.38 132.00 128.06 1zrh h PRO 14 Ca -0.47 -0.03 0.00 0.00 -0.87 0.00 0.00 66.00 64.63 1zrh h PRO 14 Cb 1.26 -0.13 0.00 0.00 0.13 0.00 0.00 31.00 32.26 1zrh h PRO 14 CO 0.56 0.37 0.00 0.27 -0.23 0.00 0.00 178.00 178.97 1zrh n ASN 15 N -4.59 0.00 0.00 1.44 6.94 -1.26 -4.87 115.26 112.92 1zrh n ASN 15 Ca 0.20 -0.13 0.00 0.00 -0.02 0.00 0.00 54.58 54.63 1zrh n ASN 15 Cb 0.61 -0.19 0.00 0.00 -2.36 0.00 0.00 39.78 37.83 1zrh n ASN 15 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1zrh n GLY 16 N 0.04 0.75 3.92 4.83 0.00 -0.52 -5.07 105.19 109.13 1zrh n GLY 16 Ca 0.09 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.84 1zrh n GLY 16 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1zrh s SER 17 N -2.97 5.52 -0.04 1.61 1.04 -1.26 -4.77 113.70 112.83 1zrh s SER 17 Ca 0.00 0.73 -0.29 0.00 0.48 0.00 0.00 55.95 56.87 1zrh s SER 17 Cb 0.00 -1.68 0.09 0.00 0.10 0.00 0.00 66.02 64.53 1zrh s SER 17 CO 0.00 -1.13 0.81 0.00 0.98 0.00 0.00 173.24 173.90 1zrh s ALA 18 N -3.04 -1.80 0.07 5.32 0.00 0.41 -0.34 121.76 122.38 1zrh s ALA 18 Ca 0.55 1.21 -0.30 0.00 0.00 0.00 0.00 51.96 53.41 1zrh s ALA 18 Cb -0.11 0.01 -0.05 0.00 0.00 0.00 0.00 23.12 22.97 1zrh s ALA 18 CO 0.46 -0.48 1.06 -0.65 0.00 0.00 0.00 175.76 176.14 1zrh s GLN 19 N -1.96 4.56 0.15 0.00 -0.21 -1.26 -0.79 119.66 120.15 1zrh s GLN 19 Ca -0.03 1.57 0.11 0.00 0.02 0.00 0.00 55.36 57.03 1zrh s GLN 19 Cb -0.00 -3.38 -0.04 0.00 1.00 0.00 0.00 33.01 30.58 1zrh s GLN 19 CO 0.00 -0.04 -0.24 -0.65 -2.12 0.00 0.00 175.29 172.24 1zrh s GLN 20 N 0.61 1.52 0.57 2.91 -0.21 -1.26 -4.99 119.66 118.81 1zrh s GLN 20 Ca 0.52 -1.37 -0.19 0.00 0.02 0.00 0.00 55.36 54.35 1zrh s GLN 20 Cb -0.25 -1.93 -0.04 0.00 1.00 0.00 0.00 33.01 31.78 1zrh s GLN 20 CO 0.30 0.44 1.19 -0.51 -2.12 0.00 0.00 175.29 174.59 1zrh s LEU 21 N -2.27 3.70 0.30 2.90 1.43 -1.26 -4.86 118.68 118.62 1zrh s LEU 21 Ca 0.17 2.33 -0.29 0.00 -1.03 0.00 0.00 54.13 55.31 1zrh s LEU 21 Cb -0.09 -4.58 -0.10 0.00 0.03 0.00 0.00 46.19 41.44 1zrh s LEU 21 CO 0.08 -1.47 1.43 -2.16 0.23 0.00 0.00 176.35 174.47 1zrh s PRO 22 N -3.29 4.24 0.11 1.29 0.04 -1.26 -4.67 135.00 131.45 1zrh s PRO 22 Ca 0.76 2.37 0.25 0.00 0.04 0.00 0.00 61.00 64.42 1zrh s PRO 22 Cb -0.29 -3.06 0.44 0.00 0.04 0.00 0.00 34.50 31.64 1zrh s PRO 22 CO 0.31 -0.41 1.40 1.04 0.04 0.00 0.00 177.00 179.38 1zrh n GLN 23 N 1.49 0.24 -3.82 4.56 6.02 -0.44 -4.89 117.38 120.54 1zrh n GLN 23 Ca 0.04 0.08 -0.12 0.00 -0.01 0.00 0.00 57.00 56.99 1zrh n GLN 23 Cb 0.40 -1.66 -0.09 0.00 1.02 0.00 0.00 30.24 29.91 1zrh n GLN 23 CO 0.00 0.00 0.00 -0.08 -1.01 0.00 0.00 177.06 175.97 1zrh s THR 24 N -3.13 0.08 -0.03 5.09 -1.32 -1.10 -3.71 115.64 111.52 1zrh s THR 24 Ca 0.08 -0.69 0.01 0.00 -1.21 0.00 0.00 61.69 59.88 1zrh s THR 24 Cb 0.14 -0.69 0.02 0.00 -1.51 0.00 0.00 72.50 70.45 1zrh s THR 24 CO 0.70 -0.38 -0.05 -0.63 -2.21 0.00 0.00 174.62 172.05 1zrh s ILE 25 N -1.86 0.56 -0.45 5.08 1.01 -1.23 -3.54 121.20 120.76 1zrh s ILE 25 Ca -0.10 -0.18 -0.22 0.00 0.00 0.00 0.00 60.65 60.14 1zrh s ILE 25 Cb -0.04 -0.55 0.03 0.00 0.01 0.00 0.00 42.46 41.90 1zrh s ILE 25 CO 0.00 0.21 0.75 -0.63 0.00 0.00 0.00 174.94 175.27 1zrh s ILE 26 N 0.62 4.70 -2.01 2.92 1.01 -0.09 -1.35 121.20 127.01 1zrh s ILE 26 Ca -0.08 0.32 0.25 0.00 0.00 0.00 0.00 60.65 61.14 1zrh s ILE 26 Cb -0.12 -4.29 0.23 0.00 0.01 0.00 0.00 42.46 38.29 1zrh s ILE 26 CO 0.00 -0.70 1.44 2.30 0.00 0.00 0.00 174.94 177.99 1zrh n ILE 27 N 6.05 0.00 0.00 2.92 -5.35 -0.56 -2.23 119.36 120.19 1zrh n ILE 27 Ca 0.01 -0.20 0.00 0.00 -0.27 0.00 0.00 62.75 62.29 1zrh n ILE 27 Cb 0.48 0.71 0.00 0.00 -1.74 0.00 0.00 39.64 39.09 1zrh n ILE 27 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1zrh n GLY 28 N 1.34 0.93 3.85 3.28 0.00 -1.26 -0.53 105.19 112.80 1zrh n GLY 28 Ca 0.12 -1.94 -0.32 0.00 0.00 0.00 0.00 46.02 43.89 1zrh n GLY 28 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1zrh s VAL 29 N -1.94 4.60 -0.22 1.61 0.11 -0.18 -0.26 120.40 124.12 1zrh s VAL 29 Ca 0.00 1.05 -0.41 0.00 -2.93 0.00 0.00 61.98 59.69 1zrh s VAL 29 Cb 0.00 -3.72 -0.17 0.00 -1.53 0.00 0.00 36.38 30.96 1zrh s VAL 29 CO 0.00 -0.64 1.60 -1.14 -3.33 0.00 0.00 175.10 171.59 1zrh n ARG 30 N -1.50 0.89 -0.99 1.54 0.63 -1.25 -0.16 116.66 115.82 1zrh n ARG 30 Ca 0.05 0.33 0.00 0.00 -0.92 0.00 0.00 57.85 57.31 1zrh n ARG 30 Cb 0.54 -1.96 0.00 0.00 0.45 0.00 0.00 32.46 31.49 1zrh n ARG 30 CO 0.00 0.00 0.00 1.63 -2.51 0.00 0.00 177.63 176.75 1zrh n LYS 31 N 4.34 -0.82 0.24 -0.14 4.76 -1.26 -4.89 118.16 120.39 1zrh n LYS 31 Ca 0.25 0.21 0.12 0.00 -2.87 0.00 0.00 58.31 56.01 1zrh n LYS 31 Cb 0.11 -3.84 0.53 0.00 -1.84 0.00 0.00 35.03 29.99 1zrh n LYS 31 CO 0.00 0.00 0.00 0.78 -1.37 0.00 0.00 177.40 176.81 1zrh h GLY 32 N 0.00 0.00 0.00 0.72 0.00 -0.76 -3.46 103.07 99.57 1zrh h GLY 32 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1zrh h GLY 32 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.54 177.15 1zrh n GLY 33 N 0.02 1.35 0.27 4.60 0.00 -1.26 -4.35 105.19 105.82 1zrh n GLY 33 Ca -0.00 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.91 1zrh n GLY 33 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 1zrh h THR 34 N 0.00 1.27 -0.11 2.61 1.35 -1.90 -1.16 112.91 114.98 1zrh h THR 34 Ca 0.00 -1.48 -0.06 0.00 -0.55 0.00 0.00 66.41 64.32 1zrh h THR 34 Cb 0.00 1.29 -0.00 0.00 -1.73 0.00 0.00 68.15 67.71 1zrh h THR 34 CO 0.00 0.50 -0.17 -0.09 -0.25 0.00 0.00 175.52 175.50 1zrh h ARG 35 N 0.76 0.31 -0.52 4.72 9.65 -1.97 -0.55 114.38 126.78 1zrh h ARG 35 Ca 0.08 -0.19 0.10 0.00 -1.10 0.00 0.00 59.98 58.88 1zrh h ARG 35 Cb 0.89 0.02 -0.10 0.00 -1.39 0.00 0.00 29.97 29.39 1zrh h ARG 35 CO 0.08 0.77 -0.15 0.00 2.80 0.00 0.00 179.97 183.46 1zrh h ALA 36 N 0.54 0.30 0.03 2.80 0.00 -1.98 -0.48 119.26 120.46 1zrh h ALA 36 Ca 0.01 0.20 -0.00 0.00 0.00 0.00 0.00 54.91 55.11 1zrh h ALA 36 Cb 0.74 0.43 0.00 0.00 0.00 0.00 0.00 17.79 18.97 1zrh h ALA 36 CO 0.04 -0.46 -0.01 1.25 0.00 0.00 0.00 179.25 180.06 1zrh h LEU 37 N -0.03 -0.03 -0.31 0.00 5.85 -1.14 -0.87 115.31 118.79 1zrh h LEU 37 Ca 0.25 -0.10 0.07 0.00 0.84 0.00 0.00 57.88 58.93 1zrh h LEU 37 Cb 0.41 0.01 -0.08 0.00 0.37 0.00 0.00 40.66 41.36 1zrh h LEU 37 CO -0.55 0.08 -0.32 0.25 -0.34 0.00 0.00 178.44 177.57 1zrh h LEU 38 N -0.14 -1.03 -0.71 2.25 5.85 -0.98 -0.29 115.31 120.26 1zrh h LEU 38 Ca -0.00 0.17 -0.08 0.00 0.84 0.00 0.00 57.88 58.81 1zrh h LEU 38 Cb 0.13 0.47 -0.03 0.00 0.37 0.00 0.00 40.66 41.61 1zrh h LEU 38 CO 0.01 -0.33 0.09 -0.33 -0.34 0.00 0.00 178.44 177.54 1zrh h GLU 39 N -0.29 1.08 -0.17 1.25 4.39 -0.98 -1.39 114.58 118.47 1zrh h GLU 39 Ca 0.15 -0.29 -0.04 0.00 0.34 0.00 0.00 59.36 59.51 1zrh h GLU 39 Cb 0.53 -0.12 -0.00 0.00 -0.10 0.00 0.00 28.75 29.05 1zrh h GLU 39 CO -0.47 1.00 -0.06 0.52 -1.16 0.00 0.00 179.01 178.84 1zrh h MET 40 N 1.01 0.33 -0.95 2.33 2.86 -1.07 -3.02 114.93 116.43 1zrh h MET 40 Ca 0.20 -0.14 0.06 0.00 -2.06 0.00 0.00 59.70 57.76 1zrh h MET 40 Cb 0.46 -0.01 -0.06 0.00 0.06 0.00 0.00 31.60 32.04 1zrh h MET 40 CO 0.02 0.63 0.61 1.25 1.06 0.00 0.00 176.91 180.48 1zrh h LEU 41 N 0.02 0.98 0.00 1.22 5.85 -1.02 -2.45 115.31 119.91 1zrh h LEU 41 Ca 0.04 0.01 0.00 0.00 0.84 0.00 0.00 57.88 58.77 1zrh h LEU 41 Cb 0.52 -0.20 0.00 0.00 0.37 0.00 0.00 40.66 41.35 1zrh h LEU 41 CO 0.02 0.63 0.00 -1.54 -0.34 0.00 0.00 178.44 177.21 1zrh n SER 42 N -4.53 0.00 0.10 1.25 3.41 -0.53 -1.40 113.62 111.92 1zrh n SER 42 Ca 0.14 0.19 0.14 0.00 -0.26 0.00 0.00 58.87 59.08 1zrh n SER 42 Cb 0.16 -0.34 0.65 0.00 -0.26 0.00 0.00 64.21 64.42 1zrh n SER 42 CO 0.00 0.00 0.00 -0.07 -0.16 0.00 0.00 175.04 174.81 1zrh h LEU 43 N 0.00 0.03 -9.48 1.04 3.38 -1.31 -3.43 115.31 105.53 1zrh h LEU 43 Ca 0.00 0.00 -0.53 0.00 0.09 0.00 0.00 57.88 57.44 1zrh h LEU 43 Cb 0.17 -0.01 0.02 0.00 0.09 0.00 0.00 40.66 40.93 1zrh h LEU 43 CO 0.00 0.02 0.88 -2.28 0.09 0.00 0.00 178.44 177.15 1zrh s HIS 44 N -5.07 2.81 0.62 1.13 2.46 -0.49 -4.89 115.29 111.86 1zrh s HIS 44 Ca -0.05 0.62 0.36 0.00 0.47 0.00 0.00 55.06 56.45 1zrh s HIS 44 Cb 0.19 -3.83 2.07 0.00 -0.13 0.00 0.00 32.58 30.87 1zrh s HIS 44 CO 0.71 -3.17 2.30 -1.00 -2.47 0.00 0.00 174.74 171.11 1zrh h PRO 45 N 7.60 0.00 -0.06 2.88 0.13 -1.89 -1.38 132.00 139.27 1zrh h PRO 45 Ca -0.41 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.72 1zrh h PRO 45 Cb 1.20 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.33 1zrh h PRO 45 CO 0.91 0.00 0.00 -3.47 -0.23 0.00 0.00 178.00 175.21 1zrh n ASP 46 N -3.53 1.27 -4.54 1.44 2.03 -1.26 -4.86 116.55 107.10 1zrh n ASP 46 Ca -0.03 -1.51 -0.34 0.00 0.52 0.00 0.00 54.79 53.44 1zrh n ASP 46 Cb 0.09 -0.04 -0.11 0.00 -0.72 0.00 0.00 41.12 40.34 1zrh n ASP 46 CO 0.00 0.00 0.00 -0.69 -1.92 0.00 0.00 177.20 174.59 1zrh s VAL 47 N -1.93 3.96 -0.26 5.18 1.01 -0.52 0.29 120.40 128.14 1zrh s VAL 47 Ca 0.36 -0.35 -0.03 0.00 0.00 0.00 0.00 61.98 61.97 1zrh s VAL 47 Cb 0.19 -2.71 0.02 0.00 0.00 0.00 0.00 36.38 33.88 1zrh s VAL 47 CO 0.31 0.52 -0.02 0.00 0.00 0.00 0.00 175.10 175.90 1zrh s ALA 48 N 0.02 2.80 -0.17 5.51 0.00 0.05 -4.85 121.76 125.12 1zrh s ALA 48 Ca 0.01 -1.44 -0.09 0.00 0.00 0.00 0.00 51.96 50.44 1zrh s ALA 48 Cb -0.13 -1.80 -0.05 0.00 0.00 0.00 0.00 23.12 21.14 1zrh s ALA 48 CO 0.03 -0.81 0.13 0.00 0.00 0.00 0.00 175.76 175.11 1zrh s ALA 49 N 1.38 3.76 0.19 0.00 0.00 -1.26 -1.57 121.76 124.26 1zrh s ALA 49 Ca 0.01 -0.67 -0.31 0.00 0.00 0.00 0.00 51.96 50.99 1zrh s ALA 49 Cb -0.17 -2.09 -0.10 0.00 0.00 0.00 0.00 23.12 20.77 1zrh s ALA 49 CO -0.03 0.34 1.46 0.00 0.00 0.00 0.00 175.76 177.54 1zrh s ALA 50 N -0.19 3.66 0.20 0.00 0.00 -0.42 -4.68 121.76 120.33 1zrh s ALA 50 Ca 0.11 1.29 -0.02 0.00 0.00 0.00 0.00 51.96 53.34 1zrh s ALA 50 Cb -0.11 -3.57 0.13 0.00 0.00 0.00 0.00 23.12 19.56 1zrh s ALA 50 CO 0.00 -0.72 1.50 1.49 0.00 0.00 0.00 175.76 178.04 1zrh h GLU 51 N 5.96 0.50 -6.20 0.00 4.81 -1.91 -3.44 114.58 114.31 1zrh h GLU 51 Ca -0.44 -0.33 -0.52 0.00 -0.13 0.00 0.00 59.36 57.94 1zrh h GLU 51 Cb 1.21 0.04 -0.06 0.00 0.63 0.00 0.00 28.75 30.57 1zrh h GLU 51 CO 0.84 0.93 -0.56 -0.80 -0.73 0.00 0.00 179.01 178.69 1zrh s ASN 52 N -6.93 5.19 0.08 1.04 0.02 -1.26 -5.07 114.94 108.01 1zrh s ASN 52 Ca -0.07 -0.40 -0.31 0.00 -1.02 0.00 0.00 52.86 51.07 1zrh s ASN 52 Cb 0.11 -1.20 -0.08 0.00 0.02 0.00 0.00 41.25 40.11 1zrh s ASN 52 CO 0.83 -0.05 1.47 -1.61 0.02 0.00 0.00 177.10 177.77 1zrh s GLU 53 N -3.80 4.27 -0.04 -0.60 2.02 -1.26 -4.70 118.70 114.59 1zrh s GLU 53 Ca 0.33 2.13 -0.04 0.00 0.02 0.00 0.00 54.97 57.41 1zrh s GLU 53 Cb -0.07 -3.41 -0.28 0.00 0.10 0.00 0.00 34.13 30.47 1zrh s GLU 53 CO 0.23 -0.56 0.67 0.28 0.02 0.00 0.00 175.26 175.90 1zrh h VAL 54 N 4.54 0.93 -5.93 2.63 2.07 -1.98 -3.48 116.25 115.03 1zrh h VAL 54 Ca -0.41 -2.60 -0.39 0.00 0.82 0.00 0.00 66.70 64.12 1zrh h VAL 54 Cb 1.20 2.67 0.10 0.00 -1.52 0.00 0.00 31.29 33.73 1zrh h VAL 54 CO 0.90 0.81 -0.77 1.41 0.02 0.00 0.00 177.57 179.94 1zrh n HIS 55 N -3.46 -2.24 0.03 1.57 8.25 -1.26 -4.95 115.22 113.16 1zrh n HIS 55 Ca -0.22 0.92 -0.06 0.00 -0.26 0.00 0.00 57.72 58.09 1zrh n HIS 55 Cb 1.05 -4.69 -0.04 0.00 1.12 0.00 0.00 29.99 27.44 1zrh n HIS 55 CO 0.00 0.00 0.00 0.35 0.64 0.00 0.00 176.34 177.33 1zrh h PHE 56 N -2.07 -0.18 0.00 4.41 3.57 -1.93 -3.26 116.94 117.49 1zrh h PHE 56 Ca -0.59 -0.00 -0.08 0.00 3.53 0.00 0.00 57.97 60.82 1zrh h PHE 56 Cb 1.36 0.06 -0.01 0.00 2.79 0.00 0.00 35.95 40.14 1zrh h PHE 56 CO 0.48 0.07 -0.40 0.74 -2.23 0.00 0.00 178.31 176.97 1zrh h PHE 57 N -1.01 0.00 0.00 0.41 0.04 -1.95 -2.92 116.94 111.52 1zrh h PHE 57 Ca -0.02 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.75 1zrh h PHE 57 Cb 0.33 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.48 1zrh h PHE 57 CO 0.05 0.40 -1.65 -0.40 -0.60 0.00 0.00 178.31 176.12 1zrh n ASP 58 N -3.57 0.30 -4.48 2.17 5.75 -1.26 -4.72 116.55 110.73 1zrh n ASP 58 Ca -0.00 0.08 -0.38 0.00 -0.01 0.00 0.00 54.79 54.48 1zrh n ASP 58 Cb 0.52 1.47 -0.12 0.00 -1.03 0.00 0.00 41.12 41.96 1zrh n ASP 58 CO 0.00 0.00 0.00 0.26 -0.11 0.00 0.00 177.20 177.35 1zrh s TRP 59 N -3.46 3.17 0.38 2.11 0.52 -1.23 -4.99 118.94 115.45 1zrh s TRP 59 Ca -0.05 -0.35 0.14 0.00 0.02 0.00 0.00 56.10 55.85 1zrh s TRP 59 Cb 0.13 -2.34 0.97 0.00 -1.15 0.00 0.00 33.47 31.07 1zrh s TRP 59 CO 0.87 -0.36 1.84 0.93 0.02 0.00 0.00 176.95 180.25 1zrh h GLU 60 N 8.34 0.51 0.00 4.98 4.39 -1.87 0.23 114.58 131.16 1zrh h GLU 60 Ca -0.34 -0.03 0.00 0.00 0.34 0.00 0.00 59.36 59.33 1zrh h GLU 60 Cb 1.16 -0.12 0.00 0.00 -0.10 0.00 0.00 28.75 29.70 1zrh h GLU 60 CO 0.59 0.34 0.00 1.05 -1.16 0.00 0.00 179.01 179.83 1zrh h GLU 61 N 0.53 0.00 0.04 2.33 9.09 -1.94 -1.94 114.58 122.69 1zrh h GLU 61 Ca 0.49 0.00 -0.34 0.00 0.05 0.00 0.00 59.36 59.55 1zrh h GLU 61 Cb 1.04 0.00 -0.04 0.00 -1.65 0.00 0.00 28.75 28.10 1zrh h GLU 61 CO -0.22 0.00 -1.94 0.72 0.05 0.00 0.00 179.01 177.62 1zrh n HIS 62 N -2.43 0.76 0.18 2.06 8.25 -0.23 -4.50 115.22 119.31 1zrh n HIS 62 Ca 0.02 0.23 0.03 0.00 -0.26 0.00 0.00 57.72 57.75 1zrh n HIS 62 Cb 0.28 -1.09 0.41 0.00 1.12 0.00 0.00 29.99 30.71 1zrh n HIS 62 CO 0.00 0.00 0.00 -0.92 0.64 0.00 0.00 176.34 176.06 1zrh h TYR 63 N -0.47 0.05 0.00 4.41 3.20 -0.82 -2.37 116.97 120.96 1zrh h TYR 63 Ca -0.48 -0.01 -0.04 0.00 3.14 0.00 0.00 58.73 61.34 1zrh h TYR 63 Cb 1.70 -0.01 -0.01 0.00 1.54 0.00 0.00 36.73 39.95 1zrh h TYR 63 CO 0.05 0.32 -0.20 0.66 -1.64 0.00 0.00 178.16 177.34 1zrh h SER 64 N 0.04 0.00 0.50 -2.11 4.64 -1.59 -2.12 113.55 112.92 1zrh h SER 64 Ca 0.01 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.33 1zrh h SER 64 Cb 0.50 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.59 1zrh h SER 64 CO 0.04 0.20 0.00 1.41 -0.87 0.00 0.00 176.83 177.61 1zrh n HIS 65 N -3.69 0.33 -1.29 4.77 8.25 -0.89 -5.00 115.22 117.69 1zrh n HIS 65 Ca -0.01 0.13 0.09 0.00 -0.26 0.00 0.00 57.72 57.67 1zrh n HIS 65 Cb 0.32 -0.72 -0.02 0.00 1.12 0.00 0.00 29.99 30.69 1zrh n HIS 65 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1zrh n GLY 66 N -0.22 -1.99 0.29 -1.41 0.00 -0.80 -3.83 105.19 97.24 1zrh n GLY 66 Ca 0.02 -1.31 0.12 0.00 0.00 0.00 0.00 46.02 44.85 1zrh n GLY 66 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1zrh h LEU 67 N 0.00 0.00 -0.81 0.99 3.38 -1.94 -1.12 115.31 115.80 1zrh h LEU 67 Ca 0.01 0.00 -0.06 0.00 0.09 0.00 0.00 57.88 57.92 1zrh h LEU 67 Cb 0.63 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.35 1zrh h LEU 67 CO 0.00 0.00 0.17 1.23 0.09 0.00 0.00 178.44 179.93 1zrh h GLY 68 N 0.00 1.14 0.75 0.83 0.00 -2.00 -0.22 103.07 103.57 1zrh h GLY 68 Ca 0.06 -0.70 -0.01 0.00 0.00 0.00 0.00 47.33 46.69 1zrh h GLY 68 CO -0.00 0.65 0.00 -0.25 0.00 0.00 0.00 176.54 176.94 1zrh h TRP 69 N 1.01 0.07 -0.29 5.60 7.01 -1.32 -2.21 115.95 125.82 1zrh h TRP 69 Ca 0.21 -0.01 0.07 0.00 2.11 0.00 0.00 58.89 61.27 1zrh h TRP 69 Cb 0.35 -0.02 -0.08 0.00 -2.10 0.00 0.00 29.16 27.31 1zrh h TRP 69 CO 0.03 0.32 -0.26 -0.92 -2.79 0.00 0.00 178.44 174.82 1zrh h TYR 70 N -0.19 -0.68 -0.69 2.65 3.20 -1.13 -1.56 116.97 118.56 1zrh h TYR 70 Ca 0.01 0.04 0.12 0.00 3.14 0.00 0.00 58.73 62.04 1zrh h TYR 70 Cb 0.28 0.34 -0.08 0.00 1.54 0.00 0.00 36.73 38.81 1zrh h TYR 70 CO 0.02 -0.33 0.27 1.25 -1.64 0.00 0.00 178.16 177.73 1zrh h LEU 71 N -0.24 0.26 -0.76 2.82 5.85 -1.07 -0.28 115.31 121.89 1zrh h LEU 71 Ca 0.15 0.09 0.00 0.00 0.84 0.00 0.00 57.88 58.97 1zrh h LEU 71 Cb 0.48 0.07 0.00 0.00 0.37 0.00 0.00 40.66 41.58 1zrh h LEU 71 CO -0.43 0.12 0.00 -1.54 -0.34 0.00 0.00 178.44 176.26 1zrh n SER 72 N -4.99 0.48 -0.08 1.25 3.41 -0.62 -1.29 113.62 111.77 1zrh n SER 72 Ca 0.12 0.66 0.13 0.00 -0.26 0.00 0.00 58.87 59.51 1zrh n SER 72 Cb 0.35 -0.74 0.35 0.00 -0.26 0.00 0.00 64.21 63.91 1zrh n SER 72 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1zrh n GLN 73 N -2.07 0.30 -2.56 4.33 1.13 -0.12 -4.95 117.38 113.45 1zrh n GLN 73 Ca 0.01 -0.16 -0.33 0.00 -1.94 0.00 0.00 57.00 54.58 1zrh n GLN 73 Cb 0.14 -1.50 -0.04 0.00 0.11 0.00 0.00 30.24 28.95 1zrh n GLN 73 CO 0.00 0.00 0.00 -1.64 -1.44 0.00 0.00 177.06 173.98 1zrh s MET 74 N -2.81 3.92 0.78 -1.09 -1.94 -0.41 -4.91 119.30 112.84 1zrh s MET 74 Ca 0.17 1.19 -0.12 0.00 -1.71 0.00 0.00 55.69 55.21 1zrh s MET 74 Cb 0.18 -2.12 0.07 0.00 2.01 0.00 0.00 34.83 34.97 1zrh s MET 74 CO 0.61 -0.31 1.14 -1.25 -0.01 0.00 0.00 175.02 175.20 1zrh s PRO 75 N -3.46 1.99 0.14 2.03 0.04 -1.26 -4.88 135.00 129.60 1zrh s PRO 75 Ca 0.64 1.46 -0.30 0.00 0.04 0.00 0.00 61.00 62.84 1zrh s PRO 75 Cb -0.13 -1.84 -0.07 0.00 0.04 0.00 0.00 34.50 32.50 1zrh s PRO 75 CO 0.21 -1.89 1.14 -0.06 0.04 0.00 0.00 177.00 176.44 1zrh s PHE 76 N -2.50 3.53 0.29 0.56 0.08 -1.26 -4.38 117.98 114.31 1zrh s PHE 76 Ca 0.67 1.50 0.04 0.00 0.12 0.00 0.00 56.93 59.27 1zrh s PHE 76 Cb -0.22 -3.33 -0.03 0.00 -0.57 0.00 0.00 43.02 38.87 1zrh s PHE 76 CO 0.51 -0.85 0.25 -1.54 -0.10 0.00 0.00 175.22 173.50 1zrh s SER 77 N 0.25 1.20 0.21 1.36 1.04 0.03 -4.83 113.70 112.96 1zrh s SER 77 Ca 0.52 -1.63 0.07 0.00 0.48 0.00 0.00 55.95 55.39 1zrh s SER 77 Cb -0.30 0.51 -0.04 0.00 0.10 0.00 0.00 66.02 66.30 1zrh s SER 77 CO 0.34 -1.02 0.12 0.26 0.98 0.00 0.00 173.24 173.92 1zrh s TRP 78 N -3.63 3.03 0.34 5.02 0.51 -1.26 -0.44 118.94 122.50 1zrh s TRP 78 Ca 0.40 -0.10 0.09 0.00 -2.12 0.00 0.00 56.10 54.37 1zrh s TRP 78 Cb 0.03 -1.40 0.83 0.00 -0.81 0.00 0.00 33.47 32.12 1zrh s TRP 78 CO 0.23 0.53 1.81 -1.35 -0.51 0.00 0.00 176.95 177.66 1zrh h PRO 79 N 2.01 0.66 -0.07 4.98 0.11 -1.94 -0.69 132.00 137.06 1zrh h PRO 79 Ca -0.47 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.60 1zrh h PRO 79 Cb 1.22 -0.15 0.00 0.00 0.11 0.00 0.00 31.00 32.18 1zrh h PRO 79 CO 0.61 0.44 0.00 0.72 -0.21 0.00 0.00 178.00 179.56 1zrh n HIS 80 N -4.66 0.09 -3.12 0.65 8.25 -1.26 -4.87 115.22 110.31 1zrh n HIS 80 Ca 0.21 -0.05 -0.30 0.00 -0.26 0.00 0.00 57.72 57.33 1zrh n HIS 80 Cb 0.58 0.00 -0.04 0.00 1.12 0.00 0.00 29.99 31.65 1zrh n HIS 80 CO 0.00 0.00 0.00 -0.65 0.64 0.00 0.00 176.34 176.33 1zrh s GLN 81 N -1.91 3.75 -0.20 -0.41 -0.21 -0.27 -5.01 119.66 115.41 1zrh s GLN 81 Ca 0.32 0.31 -0.09 0.00 0.02 0.00 0.00 55.36 55.92 1zrh s GLN 81 Cb 0.16 -2.51 -0.05 0.00 1.00 0.00 0.00 33.01 31.61 1zrh s GLN 81 CO 0.26 0.11 0.11 -0.51 -2.12 0.00 0.00 175.29 173.14 1zrh s LEU 82 N -3.53 4.08 -0.07 2.90 1.02 0.15 -4.91 118.68 118.32 1zrh s LEU 82 Ca 0.49 0.17 -0.13 0.00 0.02 0.00 0.00 54.13 54.68 1zrh s LEU 82 Cb -0.11 -2.05 -0.05 0.00 0.02 0.00 0.00 46.19 44.00 1zrh s LEU 82 CO 0.28 0.17 0.33 -0.89 0.02 0.00 0.00 176.35 176.26 1zrh s THR 83 N 0.44 5.20 0.05 5.49 2.01 -1.26 -0.77 115.64 126.80 1zrh s THR 83 Ca 0.07 0.65 0.03 0.00 0.31 0.00 0.00 61.69 62.75 1zrh s THR 83 Cb -0.12 -3.64 -0.03 0.00 0.01 0.00 0.00 72.50 68.73 1zrh s THR 83 CO -0.01 0.53 -0.09 0.54 -0.69 0.00 0.00 174.62 174.90 1zrh s VAL 84 N -0.60 0.65 0.01 3.82 0.11 -0.61 -1.32 120.40 122.46 1zrh s VAL 84 Ca 0.20 -1.22 0.01 0.00 -2.93 0.00 0.00 61.98 58.04 1zrh s VAL 84 Cb -0.15 -0.82 -0.01 0.00 -1.53 0.00 0.00 36.38 33.88 1zrh s VAL 84 CO 0.09 -0.42 -0.03 -0.70 -3.33 0.00 0.00 175.10 170.71 1zrh s GLU 85 N -1.89 0.23 -0.14 1.54 -6.30 -1.23 -1.30 118.70 109.61 1zrh s GLU 85 Ca -0.06 -0.30 0.02 0.00 -2.50 0.00 0.00 54.97 52.12 1zrh s GLU 85 Cb -0.08 -0.08 0.00 0.00 0.00 0.00 0.00 34.13 33.98 1zrh s GLU 85 CO 0.00 0.01 -0.19 -1.59 0.02 0.00 0.00 175.26 173.51 1zrh s LYS 86 N -0.64 3.12 -0.27 4.30 0.00 -1.26 -0.91 119.74 124.08 1zrh s LYS 86 Ca -0.06 -0.81 -0.02 0.00 0.00 0.00 0.00 55.97 55.09 1zrh s LYS 86 Cb -0.04 -2.51 0.09 0.00 0.00 0.00 0.00 37.83 35.37 1zrh s LYS 86 CO -0.00 0.03 0.09 0.99 0.00 0.00 0.00 175.35 176.46 1zrh s THR 87 N 0.74 0.56 0.48 3.79 2.01 -0.95 -4.00 115.64 118.27 1zrh s THR 87 Ca -0.08 -1.03 0.28 0.00 0.31 0.00 0.00 61.69 61.17 1zrh s THR 87 Cb -0.16 -1.34 0.31 0.00 0.01 0.00 0.00 72.50 71.33 1zrh s THR 87 CO 0.00 -0.57 2.14 -0.65 -0.69 0.00 0.00 174.62 174.86 1zrh h PRO 88 N 8.21 0.00 0.00 4.92 0.11 -1.79 -2.26 132.00 141.18 1zrh h PRO 88 Ca -0.16 0.00 -0.00 0.00 0.11 0.00 0.00 66.00 65.95 1zrh h PRO 88 Cb 1.04 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.15 1zrh h PRO 88 CO 0.43 0.08 -0.02 0.00 -0.21 0.00 0.00 178.00 178.28 1zrh h ALA 89 N 1.92 1.41 -0.61 -0.75 0.00 -1.95 -3.22 119.26 116.06 1zrh h ALA 89 Ca -0.00 -0.01 0.12 0.00 0.00 0.00 0.00 54.91 55.02 1zrh h ALA 89 Cb 0.20 -0.00 -0.12 0.00 0.00 0.00 0.00 17.79 17.88 1zrh h ALA 89 CO 0.01 0.02 -0.17 1.88 0.00 0.00 0.00 179.25 180.99 1zrh h TYR 90 N 0.00 -0.38 -0.81 0.00 0.05 -1.46 -2.57 116.97 111.80 1zrh h TYR 90 Ca -0.00 0.06 0.08 0.00 0.05 0.00 0.00 58.73 58.91 1zrh h TYR 90 Cb 0.05 0.26 -0.07 0.00 1.01 0.00 0.00 36.73 37.98 1zrh h TYR 90 CO 0.00 -0.28 0.47 0.35 -1.05 0.00 0.00 178.16 177.65 1zrh h PHE 91 N -0.02 0.86 -0.57 4.88 3.57 -0.82 -2.67 116.94 122.17 1zrh h PHE 91 Ca 0.29 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.82 1zrh h PHE 91 Cb 0.46 -0.27 0.00 0.00 2.79 0.00 0.00 35.95 38.93 1zrh h PHE 91 CO -0.51 0.39 0.00 0.25 -2.23 0.00 0.00 178.31 176.20 1zrh n THR 92 N -4.72 0.80 -3.45 4.41 -2.24 -1.12 -4.81 114.28 103.16 1zrh n THR 92 Ca 0.12 -0.90 -0.41 0.00 -2.27 0.00 0.00 64.05 60.59 1zrh n THR 92 Cb 0.23 0.69 -0.10 0.00 -2.10 0.00 0.00 70.33 69.05 1zrh n THR 92 CO 0.00 0.00 0.00 -0.44 -0.57 0.00 0.00 175.07 174.06 1zrh s SER 93 N -1.17 6.13 0.47 3.42 0.01 -0.99 -5.00 113.70 116.57 1zrh s SER 93 Ca 0.43 -0.33 0.19 0.00 1.31 0.00 0.00 55.95 57.55 1zrh s SER 93 Cb 0.23 -2.17 1.19 0.00 0.21 0.00 0.00 66.02 65.48 1zrh s SER 93 CO 0.31 -0.31 1.96 -0.65 0.41 0.00 0.00 173.24 174.97 1zrh h PRO 94 N 8.48 0.24 0.00 12.44 0.11 -1.89 -2.25 132.00 149.14 1zrh h PRO 94 Ca -0.30 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.79 1zrh h PRO 94 Cb 1.15 -0.05 0.00 0.00 0.11 0.00 0.00 31.00 32.20 1zrh h PRO 94 CO 0.67 0.16 -0.26 0.36 -0.21 0.00 0.00 178.00 178.72 1zrh n LYS 95 N -4.44 0.21 0.12 1.05 2.85 -1.26 -4.39 118.16 112.30 1zrh n LYS 95 Ca 0.11 0.12 -0.13 0.00 -1.05 0.00 0.00 58.31 57.36 1zrh n LYS 95 Cb 0.53 -1.69 -0.08 0.00 -0.65 0.00 0.00 35.03 33.13 1zrh n LYS 95 CO 0.00 0.00 0.00 0.28 -0.05 0.00 0.00 177.40 177.63 1zrh h VAL 96 N 0.00 0.84 -0.98 0.58 2.07 -1.69 -3.25 116.25 113.83 1zrh h VAL 96 Ca 0.00 -0.61 0.17 0.00 0.82 0.00 0.00 66.70 67.08 1zrh h VAL 96 Cb 0.69 1.19 -0.09 0.00 -1.52 0.00 0.00 31.29 31.55 1zrh h VAL 96 CO 0.00 0.13 0.61 -0.65 0.02 0.00 0.00 177.57 177.68 1zrh h PRO 97 N -0.63 0.73 -0.67 1.57 0.11 -1.77 -0.25 132.00 131.09 1zrh h PRO 97 Ca -0.03 -0.04 -0.05 0.00 0.11 0.00 0.00 66.00 65.99 1zrh h PRO 97 Cb 0.45 -0.16 -0.03 0.00 0.11 0.00 0.00 31.00 31.37 1zrh h PRO 97 CO 0.05 0.48 0.22 1.49 -0.21 0.00 0.00 178.00 180.04 1zrh h GLU 98 N 0.75 1.01 -0.30 1.05 4.81 -1.86 0.21 114.58 120.26 1zrh h GLU 98 Ca 0.53 -0.20 -0.18 0.00 -0.13 0.00 0.00 59.36 59.38 1zrh h GLU 98 Cb 0.84 -0.16 -0.00 0.00 0.63 0.00 0.00 28.75 30.07 1zrh h GLU 98 CO -0.31 0.86 -0.54 0.00 -0.73 0.00 0.00 179.01 178.29 1zrh h ARG 99 N 0.98 0.88 -0.46 1.92 3.08 -1.22 -2.23 114.38 117.33 1zrh h ARG 99 Ca 0.22 -0.55 -0.02 0.00 0.07 0.00 0.00 59.98 59.70 1zrh h ARG 99 Cb 0.26 0.06 -0.02 0.00 0.08 0.00 0.00 29.97 30.35 1zrh h ARG 99 CO -0.01 1.19 0.22 0.28 -1.07 0.00 0.00 179.97 180.58 1zrh h VAL 100 N 0.68 1.18 -0.85 2.04 2.07 -0.85 -2.70 116.25 117.82 1zrh h VAL 100 Ca 0.02 -0.51 0.07 0.00 0.82 0.00 0.00 66.70 67.09 1zrh h VAL 100 Cb 1.14 0.68 -0.06 0.00 -1.52 0.00 0.00 31.29 31.53 1zrh h VAL 100 CO 0.12 0.20 0.53 0.22 0.02 0.00 0.00 177.57 178.65 1zrh h TYR 101 N 0.60 0.97 0.00 1.57 3.20 -0.58 -0.83 116.97 121.89 1zrh h TYR 101 Ca 0.16 0.03 -0.03 0.00 3.14 0.00 0.00 58.73 62.02 1zrh h TYR 101 Cb 0.11 -0.31 -0.00 0.00 1.54 0.00 0.00 36.73 38.07 1zrh h TYR 101 CO -0.01 0.48 -0.16 0.66 -1.64 0.00 0.00 178.16 177.49 1zrh h SER 102 N 0.95 0.00 0.06 -2.11 4.64 -1.27 -2.74 113.55 113.07 1zrh h SER 102 Ca 0.38 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.69 1zrh h SER 102 Cb 0.20 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.29 1zrh h SER 102 CO -0.18 0.16 -0.03 -0.03 -0.87 0.00 0.00 176.83 175.88 1zrh h MET 103 N 0.00 -0.08 -1.00 4.77 1.85 -1.12 -3.45 114.93 115.90 1zrh h MET 103 Ca -0.00 0.01 -0.01 0.00 -0.61 0.00 0.00 59.70 59.08 1zrh h MET 103 Cb 0.80 0.02 -0.20 0.00 0.43 0.00 0.00 31.60 32.65 1zrh h MET 103 CO 0.02 0.29 -0.41 1.21 -0.40 0.00 0.00 176.91 177.62 1zrh s ASN 104 N -5.48 -1.59 0.65 1.39 3.84 -0.36 -5.01 114.94 108.37 1zrh s ASN 104 Ca -0.15 -0.24 0.40 0.00 0.21 0.00 0.00 52.86 53.08 1zrh s ASN 104 Cb 0.03 2.01 2.26 0.00 -0.55 0.00 0.00 41.25 44.99 1zrh s ASN 104 CO 0.64 -0.24 2.34 -0.65 -2.79 0.00 0.00 177.10 176.40 1zrh h PRO 105 N 7.55 0.00 -0.02 0.43 0.11 -1.71 -2.65 132.00 135.71 1zrh h PRO 105 Ca 0.02 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.13 1zrh h PRO 105 Cb 1.19 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.30 1zrh h PRO 105 CO 0.13 0.00 -0.07 0.43 -0.21 0.00 0.00 178.00 178.28 1zrh n SER 106 N -3.31 2.38 -4.69 -2.05 7.64 -1.26 -4.91 113.62 107.42 1zrh n SER 106 Ca -0.03 -1.75 -0.39 0.00 1.01 0.00 0.00 58.87 57.71 1zrh n SER 106 Cb 0.07 0.06 0.04 0.00 -1.01 0.00 0.00 64.21 63.38 1zrh n SER 106 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1zrh n ILE 107 N 0.77 3.75 -3.80 0.44 3.06 -1.00 -4.99 119.36 117.59 1zrh n ILE 107 Ca 0.15 -0.50 -0.36 0.00 -2.50 0.00 0.00 62.75 59.54 1zrh n ILE 107 Cb 0.51 -1.45 -0.07 0.00 0.54 0.00 0.00 39.64 39.16 1zrh n ILE 107 CO 0.00 0.00 0.00 -0.13 -2.50 0.00 0.00 176.55 173.92 1zrh s ARG 108 N -2.80 3.86 0.10 9.51 0.52 -1.24 -4.91 118.95 124.00 1zrh s ARG 108 Ca 0.73 -0.18 0.09 0.00 -0.52 0.00 0.00 55.73 55.85 1zrh s ARG 108 Cb -0.43 -3.32 -0.04 0.00 0.52 0.00 0.00 34.95 31.69 1zrh s ARG 108 CO 0.49 0.51 -0.23 -0.51 0.02 0.00 0.00 175.30 175.58 1zrh s LEU 109 N -0.26 2.29 -0.15 2.53 1.43 0.63 -3.55 118.68 121.59 1zrh s LEU 109 Ca 0.11 -0.69 -0.00 0.00 -1.03 0.00 0.00 54.13 52.52 1zrh s LEU 109 Cb -0.11 -1.01 -0.00 0.00 0.03 0.00 0.00 46.19 45.09 1zrh s LEU 109 CO 0.01 0.11 -0.14 -0.76 0.23 0.00 0.00 176.35 175.80 1zrh s LEU 110 N -1.86 2.55 -0.13 1.79 1.43 -0.46 -0.41 118.68 121.59 1zrh s LEU 110 Ca 0.09 -0.44 0.01 0.00 -1.03 0.00 0.00 54.13 52.76 1zrh s LEU 110 Cb -0.10 -1.59 0.02 0.00 0.03 0.00 0.00 46.19 44.56 1zrh s LEU 110 CO 0.04 0.09 -0.13 -0.22 0.23 0.00 0.00 176.35 176.36 1zrh s LEU 111 N 0.77 1.61 -0.19 1.79 2.96 -0.37 -1.50 118.68 123.75 1zrh s LEU 111 Ca -0.06 -0.44 -0.04 0.00 -0.22 0.00 0.00 54.13 53.38 1zrh s LEU 111 Cb -0.15 -1.10 -0.02 0.00 0.50 0.00 0.00 46.19 45.42 1zrh s LEU 111 CO 0.01 -0.05 -0.04 -0.51 -1.32 0.00 0.00 176.35 174.44 1zrh s ILE 112 N 1.40 3.64 -0.03 6.68 2.07 0.64 -0.20 121.20 135.40 1zrh s ILE 112 Ca 0.02 -0.43 0.06 0.00 -1.41 0.00 0.00 60.65 58.90 1zrh s ILE 112 Cb -0.13 -2.62 -0.01 0.00 0.13 0.00 0.00 42.46 39.82 1zrh s ILE 112 CO -0.08 0.45 -0.23 -0.76 -1.91 0.00 0.00 174.94 172.41 1zrh s LEU 113 N 0.92 2.03 0.39 8.50 1.43 -0.70 -1.01 118.68 130.24 1zrh s LEU 113 Ca -0.00 -0.44 0.08 0.00 -1.03 0.00 0.00 54.13 52.73 1zrh s LEU 113 Cb -0.15 -1.23 -0.02 0.00 0.03 0.00 0.00 46.19 44.82 1zrh s LEU 113 CO 0.01 0.26 0.37 -0.13 0.23 0.00 0.00 176.35 177.08 1zrh s ARG 114 N -0.34 2.64 -0.03 1.70 0.52 -1.26 0.29 118.95 122.48 1zrh s ARG 114 Ca 0.03 -1.41 -0.39 0.00 -0.52 0.00 0.00 55.73 53.44 1zrh s ARG 114 Cb -0.11 -2.46 -0.19 0.00 0.52 0.00 0.00 34.95 32.72 1zrh s ARG 114 CO 0.01 -0.09 1.25 -3.47 0.02 0.00 0.00 175.30 173.02 1zrh n ASP 115 N -1.51 0.81 0.22 0.23 2.03 -1.26 -4.77 116.55 112.31 1zrh n ASP 115 Ca 0.02 1.14 0.06 0.00 0.52 0.00 0.00 54.79 56.53 1zrh n ASP 115 Cb 0.61 -1.02 0.52 0.00 -0.72 0.00 0.00 41.12 40.50 1zrh n ASP 115 CO 0.00 0.00 0.00 1.55 -1.92 0.00 0.00 177.20 176.83 1zrh h PRO 116 N 3.96 0.01 -0.08 -0.67 0.13 -1.97 0.14 132.00 133.51 1zrh h PRO 116 Ca -0.49 -0.00 -0.20 0.00 -0.87 0.00 0.00 66.00 64.44 1zrh h PRO 116 Cb 1.39 -0.00 0.01 0.00 0.13 0.00 0.00 31.00 32.53 1zrh h PRO 116 CO 0.74 0.16 -0.73 0.77 -0.23 0.00 0.00 178.00 178.71 1zrh h SER 117 N 0.01 0.77 -0.66 1.44 0.02 -1.91 -2.26 113.55 110.96 1zrh h SER 117 Ca 0.00 -0.68 -0.04 0.00 -0.84 0.00 0.00 61.79 60.23 1zrh h SER 117 Cb 0.27 -0.23 -0.03 0.00 0.14 0.00 0.00 62.40 62.55 1zrh h SER 117 CO 0.02 1.34 0.26 -0.33 -1.14 0.00 0.00 176.83 176.97 1zrh h GLU 118 N 0.27 1.02 -0.65 3.45 5.08 -1.76 -2.39 114.58 119.60 1zrh h GLU 118 Ca -0.07 -0.18 -0.02 0.00 -1.00 0.00 0.00 59.36 58.09 1zrh h GLU 118 Cb 1.38 -0.17 -0.03 0.00 0.50 0.00 0.00 28.75 30.43 1zrh h GLU 118 CO 0.15 0.84 0.33 -0.09 -1.00 0.00 0.00 179.01 179.25 1zrh h ARG 119 N 1.00 0.91 -0.14 2.33 2.43 -0.70 -0.75 114.38 119.47 1zrh h ARG 119 Ca 0.23 -0.12 0.04 0.00 -0.81 0.00 0.00 59.98 59.32 1zrh h ARG 119 Cb 0.22 -0.17 -0.04 0.00 -0.42 0.00 0.00 29.97 29.55 1zrh h ARG 119 CO -0.02 0.71 -0.11 0.28 -1.51 0.00 0.00 179.97 179.32 1zrh h VAL 120 N 0.89 0.67 -0.58 0.20 2.07 -1.21 -0.76 116.25 117.52 1zrh h VAL 120 Ca 0.22 0.00 -0.04 0.00 0.82 0.00 0.00 66.70 67.71 1zrh h VAL 120 Cb 0.08 0.67 -0.03 0.00 -1.52 0.00 0.00 31.29 30.49 1zrh h VAL 120 CO -0.03 0.00 0.20 -0.07 0.02 0.00 0.00 177.57 177.69 1zrh h LEU 121 N -0.13 0.79 -0.77 2.57 4.07 -1.26 -0.74 115.31 119.84 1zrh h LEU 121 Ca 0.09 -0.12 -0.00 0.00 0.08 0.00 0.00 57.88 57.93 1zrh h LEU 121 Cb 0.26 -0.20 -0.04 0.00 1.08 0.00 0.00 40.66 41.76 1zrh h LEU 121 CO -0.22 0.73 0.47 -1.28 -1.08 0.00 0.00 178.44 177.06 1zrh h SER 122 N 0.84 0.93 0.13 -0.43 0.87 -0.91 -0.94 113.55 114.04 1zrh h SER 122 Ca 0.20 -0.06 -0.01 0.00 -1.23 0.00 0.00 61.79 60.69 1zrh h SER 122 Cb 0.21 -0.23 0.00 0.00 -0.44 0.00 0.00 62.40 61.94 1zrh h SER 122 CO -0.01 0.72 -0.06 -0.78 -0.53 0.00 0.00 176.83 176.16 1zrh h ASP 123 N 1.06 -0.15 -0.36 6.23 1.82 -0.64 -1.62 116.42 122.76 1zrh h ASP 123 Ca 0.28 -0.26 0.08 0.00 -0.39 0.00 0.00 57.03 56.74 1zrh h ASP 123 Cb -0.04 0.04 -0.08 0.00 0.68 0.00 0.00 39.33 39.93 1zrh h ASP 123 CO -0.05 0.18 -0.19 0.22 -1.61 0.00 0.00 179.24 177.79 1zrh h TYR 124 N -0.50 -0.47 -0.57 0.28 3.20 -1.17 -2.66 116.97 115.08 1zrh h TYR 124 Ca -0.02 0.04 0.07 0.00 3.14 0.00 0.00 58.73 61.97 1zrh h TYR 124 Cb 0.40 0.27 -0.06 0.00 1.54 0.00 0.00 36.73 38.87 1zrh h TYR 124 CO 0.03 -0.27 0.24 1.15 -1.64 0.00 0.00 178.16 177.68 1zrh h THR 125 N -0.13 0.85 -0.36 1.81 2.02 -1.06 0.11 112.91 116.15 1zrh h THR 125 Ca 0.18 -0.16 -0.00 0.00 0.77 0.00 0.00 66.41 67.20 1zrh h THR 125 Cb 0.41 0.36 -0.02 0.00 -1.74 0.00 0.00 68.15 67.16 1zrh h THR 125 CO -0.44 0.08 0.22 -0.61 0.37 0.00 0.00 175.52 175.14 1zrh h GLN 126 N 0.46 0.49 -0.36 6.66 4.15 -1.13 0.77 115.11 126.15 1zrh h GLN 126 Ca 0.27 -0.04 -0.16 0.00 0.77 0.00 0.00 58.65 59.49 1zrh h GLN 126 Cb 0.27 -0.10 -0.00 0.00 0.21 0.00 0.00 27.48 27.85 1zrh h GLN 126 CO -0.24 0.37 -0.40 0.28 -1.93 0.00 0.00 178.83 176.91 1zrh h VAL 127 N 0.48 1.27 -0.42 2.39 2.07 -1.10 -0.83 116.25 120.10 1zrh h VAL 127 Ca 0.13 -1.57 0.08 0.00 0.82 0.00 0.00 66.70 66.16 1zrh h VAL 127 Cb 0.00 1.43 -0.07 0.00 -1.52 0.00 0.00 31.29 31.13 1zrh h VAL 127 CO -0.02 0.52 -0.04 0.15 0.02 0.00 0.00 177.57 178.19 1zrh h PHE 128 N 0.72 -0.11 -0.51 1.57 3.57 -0.65 -1.65 116.94 119.88 1zrh h PHE 128 Ca 0.05 0.03 -0.06 0.00 3.53 0.00 0.00 57.97 61.52 1zrh h PHE 128 Cb 0.99 0.11 -0.02 0.00 2.79 0.00 0.00 35.95 39.83 1zrh h PHE 128 CO 0.07 -0.13 0.07 1.88 -2.23 0.00 0.00 178.31 177.97 1zrh h TYR 129 N 0.06 0.92 -1.01 0.41 -1.99 -0.62 -1.00 116.97 113.74 1zrh h TYR 129 Ca 0.21 -0.13 0.21 0.00 2.00 0.00 0.00 58.73 61.02 1zrh h TYR 129 Cb 0.31 -0.25 -0.11 0.00 2.00 0.00 0.00 36.73 38.68 1zrh h TYR 129 CO -0.32 0.83 0.61 -0.91 -0.00 0.00 0.00 178.16 178.37 1zrh h ASN 130 N 0.74 0.75 0.11 3.88 2.35 -0.95 -2.88 115.58 119.58 1zrh h ASN 130 Ca 0.16 0.11 -0.01 0.00 -0.55 0.00 0.00 56.30 56.01 1zrh h ASN 130 Cb 0.41 -0.02 0.00 0.00 0.05 0.00 0.00 38.32 38.77 1zrh h ASN 130 CO 0.01 0.22 -0.05 0.45 -1.65 0.00 0.00 177.43 176.41 1zrh h HIS 131 N 0.70 -0.14 -0.92 1.19 3.86 -0.75 -3.14 115.15 115.95 1zrh h HIS 131 Ca 0.60 -0.00 0.21 0.00 -1.16 0.00 0.00 60.37 60.02 1zrh h HIS 131 Cb 1.01 0.05 -0.07 0.00 1.06 0.00 0.00 27.41 29.46 1zrh h HIS 131 CO -0.00 0.35 0.61 0.52 0.86 0.00 0.00 177.93 180.26 1zrh h MET 132 N -0.75 0.39 0.00 2.45 2.86 -1.04 0.45 114.93 119.29 1zrh h MET 132 Ca -0.02 -0.02 -0.16 0.00 -2.06 0.00 0.00 59.70 57.44 1zrh h MET 132 Cb 0.55 -0.09 -0.02 0.00 0.06 0.00 0.00 31.60 32.10 1zrh h MET 132 CO 0.03 0.26 -0.83 -0.56 1.06 0.00 0.00 176.91 176.86 1zrh h GLN 133 N 0.40 0.00 -0.15 1.72 3.07 -1.64 -3.17 115.11 115.34 1zrh h GLN 133 Ca 0.49 0.00 0.00 0.00 0.09 0.00 0.00 58.65 59.23 1zrh h GLN 133 Cb 1.22 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.78 1zrh h GLN 133 CO -0.19 0.70 0.00 1.63 0.09 0.00 0.00 178.83 181.06 1zrh n LYS 134 N -3.25 1.42 -2.08 0.06 5.02 0.06 -4.92 118.16 114.47 1zrh n LYS 134 Ca -0.01 -0.64 -0.16 0.00 -2.02 0.00 0.00 58.31 55.48 1zrh n LYS 134 Cb 0.84 -1.23 -0.03 0.00 -0.02 0.00 0.00 35.03 34.60 1zrh n LYS 134 CO 0.00 0.00 0.00 0.72 -0.52 0.00 0.00 177.40 177.60 1zrh n HIS 135 N -0.05 -0.89 -3.30 2.13 8.25 -0.66 -5.01 115.22 115.70 1zrh n HIS 135 Ca 0.10 0.00 -0.29 0.00 -0.26 0.00 0.00 57.72 57.27 1zrh n HIS 135 Cb 0.18 -3.14 -0.03 0.00 1.12 0.00 0.00 29.99 28.12 1zrh n HIS 135 CO 0.00 0.00 0.00 0.15 0.64 0.00 0.00 176.34 177.13 1zrh s LYS 136 N -4.44 3.65 0.62 -0.41 1.02 -0.88 -5.01 119.74 114.29 1zrh s LYS 136 Ca 0.00 0.06 -0.16 0.00 0.02 0.00 0.00 55.97 55.89 1zrh s LYS 136 Cb 0.00 -2.63 -0.02 0.00 -0.52 0.00 0.00 37.83 34.66 1zrh s LYS 136 CO 0.00 0.20 1.09 -1.25 -0.92 0.00 0.00 175.35 174.47 1zrh s PRO 137 N -3.52 3.09 -0.06 -1.68 0.04 -1.26 -4.24 135.00 127.37 1zrh s PRO 137 Ca 0.45 1.33 -0.03 0.00 0.04 0.00 0.00 61.00 62.79 1zrh s PRO 137 Cb -0.11 -1.99 0.03 0.00 0.04 0.00 0.00 34.50 32.47 1zrh s PRO 137 CO 0.29 -1.01 0.13 -0.47 0.04 0.00 0.00 177.00 175.98 1zrh s TYR 138 N -2.33 -0.14 0.98 0.56 5.04 -1.26 -4.98 117.35 115.22 1zrh s TYR 138 Ca 0.66 0.41 -0.12 0.00 -2.44 0.00 0.00 57.07 55.58 1zrh s TYR 138 Cb -0.19 -0.05 0.13 0.00 0.35 0.00 0.00 41.96 42.20 1zrh s TYR 138 CO 0.38 -0.13 0.80 -2.30 -1.34 0.00 0.00 175.55 172.96 1zrh n PRO 139 N 3.84 -0.76 -1.67 4.97 -0.02 -1.26 -4.98 135.00 135.13 1zrh n PRO 139 Ca -0.22 -0.17 -0.32 0.00 -2.02 0.00 0.00 63.50 60.77 1zrh n PRO 139 Cb 0.54 -2.13 0.05 0.00 -0.02 0.00 0.00 33.50 31.94 1zrh n PRO 139 CO 0.00 0.00 0.00 -1.12 1.98 0.00 0.00 175.50 176.36 1zrh s SER 140 N -2.34 5.19 0.40 2.55 0.01 -1.26 -4.96 113.70 113.28 1zrh s SER 140 Ca 0.63 1.83 0.09 0.00 1.31 0.00 0.00 55.95 59.80 1zrh s SER 140 Cb -0.22 -2.53 0.82 0.00 0.21 0.00 0.00 66.02 64.31 1zrh s SER 140 CO 0.63 -1.57 1.97 -0.29 0.41 0.00 0.00 173.24 174.38 1zrh h ILE 141 N -0.32 1.14 -0.20 1.44 2.10 -1.97 -1.96 117.51 117.75 1zrh h ILE 141 Ca -0.45 -0.55 -0.02 0.00 1.08 0.00 0.00 64.86 64.92 1zrh h ILE 141 Cb 1.23 0.97 -0.01 0.00 -1.09 0.00 0.00 36.82 37.91 1zrh h ILE 141 CO 0.55 0.19 0.05 -0.33 -1.08 0.00 0.00 178.15 177.52 1zrh h GLU 142 N 0.33 0.27 -0.26 2.19 3.07 -1.96 -0.35 114.58 117.87 1zrh h GLU 142 Ca 0.08 -0.03 -0.05 0.00 -0.50 0.00 0.00 59.36 58.86 1zrh h GLU 142 Cb 0.22 -0.05 -0.01 0.00 -0.84 0.00 0.00 28.75 28.06 1zrh h GLU 142 CO 0.00 0.26 -0.05 0.93 -1.40 0.00 0.00 179.01 178.75 1zrh h GLU 143 N 0.27 0.40 0.20 2.33 5.08 -1.64 -0.28 114.58 120.96 1zrh h GLU 143 Ca 0.07 -0.09 -0.33 0.00 -1.00 0.00 0.00 59.36 58.01 1zrh h GLU 143 Cb 0.11 -0.06 0.02 0.00 0.50 0.00 0.00 28.75 29.32 1zrh h GLU 143 CO -0.00 0.48 -1.60 0.74 -1.00 0.00 0.00 179.01 177.62 1zrh h PHE 144 N 0.39 0.78 0.00 4.33 0.04 -1.36 -3.39 116.94 117.73 1zrh h PHE 144 Ca 0.08 -0.57 -0.16 0.00 2.80 0.00 0.00 57.97 60.12 1zrh h PHE 144 Cb 0.34 -0.03 -0.02 0.00 2.20 0.00 0.00 35.95 38.44 1zrh h PHE 144 CO 0.01 1.62 -0.79 -0.07 -0.60 0.00 0.00 178.31 178.48 1zrh h LEU 145 N 0.06 0.00 -8.16 1.54 3.38 -1.01 -3.42 115.31 107.71 1zrh h LEU 145 Ca -0.31 0.00 -0.66 0.00 0.09 0.00 0.00 57.88 57.00 1zrh h LEU 145 Cb 2.08 0.00 -0.34 0.00 0.09 0.00 0.00 40.66 42.49 1zrh h LEU 145 CO 0.20 0.76 -0.86 -0.69 0.09 0.00 0.00 178.44 177.94 1zrh s VAL 146 N -2.83 1.97 -0.07 1.22 1.01 -0.12 0.11 120.40 121.69 1zrh s VAL 146 Ca 0.02 -0.92 -0.00 0.00 0.00 0.00 0.00 61.98 61.08 1zrh s VAL 146 Cb 0.09 -1.75 0.02 0.00 0.00 0.00 0.00 36.38 34.74 1zrh s VAL 146 CO 0.79 0.53 -0.03 -0.60 0.00 0.00 0.00 175.10 175.78 1zrh s ARG 147 N 0.88 0.86 -1.37 2.72 3.52 0.07 -4.72 118.95 120.92 1zrh s ARG 147 Ca -0.06 -0.05 -0.06 0.00 -0.13 0.00 0.00 55.73 55.43 1zrh s ARG 147 Cb -0.15 -1.01 0.03 0.00 -1.56 0.00 0.00 34.95 32.25 1zrh s ARG 147 CO -0.03 -0.19 0.95 -0.25 -0.81 0.00 0.00 175.30 174.97 1zrh n ASP 148 N 4.61 -3.62 -0.06 -2.12 8.00 -1.26 -1.54 116.55 120.56 1zrh n ASP 148 Ca -0.16 -0.71 -0.01 0.00 0.71 0.00 0.00 54.79 54.63 1zrh n ASP 148 Cb 0.50 -4.43 -0.00 0.00 -0.02 0.00 0.00 41.12 37.17 1zrh n ASP 148 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1zrh n GLY 149 N -1.63 0.15 3.33 0.44 0.00 -1.26 -4.97 105.19 101.24 1zrh n GLY 149 Ca -0.13 -0.01 -0.22 0.00 0.00 0.00 0.00 46.02 45.67 1zrh n GLY 149 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1zrh s ARG 150 N -1.79 1.26 0.11 1.61 0.52 -0.59 -5.10 118.95 114.96 1zrh s ARG 150 Ca 0.00 -1.38 -0.35 0.00 -0.52 0.00 0.00 55.73 53.48 1zrh s ARG 150 Cb 0.00 -1.35 -0.15 0.00 0.52 0.00 0.00 34.95 33.98 1zrh s ARG 150 CO 0.00 0.28 1.54 -0.11 0.02 0.00 0.00 175.30 177.03 1zrh n LEU 151 N 0.40 2.71 -4.52 2.53 7.94 -1.26 -0.75 117.00 124.05 1zrh n LEU 151 Ca -0.14 1.08 -0.42 0.00 -1.11 0.00 0.00 56.01 55.43 1zrh n LEU 151 Cb 0.57 -1.35 -0.03 0.00 0.53 0.00 0.00 43.42 43.13 1zrh n LEU 151 CO 0.28 -0.48 1.08 0.21 -1.11 0.00 0.00 177.39 177.37 1zrh s ASN 152 N 1.08 6.21 0.05 1.96 2.47 0.30 -4.74 114.94 122.26 1zrh s ASN 152 Ca 0.82 -0.75 0.21 0.00 0.42 0.00 0.00 52.86 53.56 1zrh s ASN 152 Cb -0.76 -2.52 0.86 0.00 -1.45 0.00 0.00 41.25 37.38 1zrh s ASN 152 CO 0.42 -1.67 1.66 1.33 -3.72 0.00 0.00 177.10 175.11 1zrh n VAL 153 N 6.27 0.65 1.40 -5.21 0.24 -1.26 -2.53 118.33 117.89 1zrh n VAL 153 Ca 0.05 0.13 0.14 0.00 -2.04 0.00 0.00 64.34 62.62 1zrh n VAL 153 Cb 0.48 -0.84 0.44 0.00 -1.47 0.00 0.00 33.84 32.45 1zrh n VAL 153 CO 0.00 0.00 0.00 0.47 -2.14 0.00 0.00 176.83 175.16 1zrh n ASP 154 N -1.64 1.72 -4.63 -1.34 8.00 -1.26 -4.81 116.55 112.59 1zrh n ASP 154 Ca 0.05 -1.54 -0.43 0.00 0.71 0.00 0.00 54.79 53.58 1zrh n ASP 154 Cb 0.25 0.01 -0.03 0.00 -0.02 0.00 0.00 41.12 41.33 1zrh n ASP 154 CO 0.00 0.00 0.00 -0.47 -0.39 0.00 0.00 177.20 176.34 1zrh s TYR 155 N -2.04 1.68 0.37 1.24 5.04 -1.05 -4.89 117.35 117.70 1zrh s TYR 155 Ca 0.35 0.31 0.09 0.00 -2.44 0.00 0.00 57.07 55.38 1zrh s TYR 155 Cb 0.21 -4.03 0.82 0.00 0.35 0.00 0.00 41.96 39.31 1zrh s TYR 155 CO 0.34 -3.83 1.90 -0.22 -1.34 0.00 0.00 175.55 172.41 1zrh h LYS 156 N 11.76 0.66 -0.57 4.97 1.63 -1.91 -1.06 116.57 132.05 1zrh h LYS 156 Ca -0.39 -0.04 0.13 0.00 -0.85 0.00 0.00 60.65 59.50 1zrh h LYS 156 Cb 1.19 -0.15 -0.03 0.00 -0.60 0.00 0.00 32.23 32.65 1zrh h LYS 156 CO 0.98 0.43 0.40 0.00 -3.45 0.00 0.00 179.45 177.81 1zrh h ALA 157 N 1.60 2.28 -0.36 5.00 0.00 -1.97 -1.01 119.26 124.80 1zrh h ALA 157 Ca 0.40 -0.01 -0.14 0.00 0.00 0.00 0.00 54.91 55.16 1zrh h ALA 157 Cb 0.59 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.36 1zrh h ALA 157 CO -0.16 -0.43 -0.30 -0.07 0.00 0.00 0.00 179.25 178.28 1zrh h LEU 158 N 0.19 0.90 -1.55 0.00 4.07 -1.56 -2.70 115.31 114.66 1zrh h LEU 158 Ca 0.27 -0.45 -0.00 0.00 0.08 0.00 0.00 57.88 57.78 1zrh h LEU 158 Cb 0.82 -0.25 -0.02 0.00 1.08 0.00 0.00 40.66 42.29 1zrh h LEU 158 CO -0.05 1.16 0.24 -1.13 -1.08 0.00 0.00 178.44 177.59 1zrh h ASN 159 N 0.65 0.48 1.27 -0.43 -0.73 -1.24 -2.26 115.58 113.31 1zrh h ASN 159 Ca 0.07 -0.02 -0.02 0.00 1.87 0.00 0.00 56.30 58.20 1zrh h ASN 159 Cb 0.88 -0.12 -0.00 0.00 0.27 0.00 0.00 38.32 39.35 1zrh h ASN 159 CO 0.08 0.37 -0.08 0.03 -0.37 0.00 0.00 177.43 177.45 1zrh h ARG 160 N 0.55 0.00 -0.00 6.67 3.08 -1.10 -2.31 114.38 121.27 1zrh h ARG 160 Ca 0.15 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.20 1zrh h ARG 160 Cb -0.02 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.03 1zrh h ARG 160 CO -0.03 0.08 -0.29 0.43 -1.07 0.00 0.00 179.97 179.09 1zrh n SER 161 N -3.17 0.60 -3.88 7.04 7.64 -0.88 -4.45 113.62 116.52 1zrh n SER 161 Ca 0.01 -0.43 -0.42 0.00 1.01 0.00 0.00 58.87 59.04 1zrh n SER 161 Cb 0.42 0.07 -0.01 0.00 -1.01 0.00 0.00 64.21 63.68 1zrh n SER 161 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 1zrh n LEU 162 N -1.13 6.15 -0.24 -3.43 4.77 -0.87 -4.80 117.00 117.46 1zrh n LEU 162 Ca 0.09 -3.94 0.07 0.00 -0.03 0.00 0.00 56.01 52.20 1zrh n LEU 162 Cb 0.33 -1.62 0.33 0.00 -2.33 0.00 0.00 43.42 40.13 1zrh n LEU 162 CO 0.29 0.72 1.23 1.88 -1.33 0.00 0.00 177.39 180.17 1zrh h TYR 163 N 6.56 0.86 -0.84 -1.77 0.05 -1.84 -2.32 116.97 117.68 1zrh h TYR 163 Ca 0.53 0.02 0.07 0.00 0.05 0.00 0.00 58.73 59.40 1zrh h TYR 163 Cb 0.69 -0.28 -0.05 0.00 1.01 0.00 0.00 36.73 38.10 1zrh h TYR 163 CO 1.43 0.42 0.55 1.12 -1.05 0.00 0.00 178.16 180.62 1zrh h HIS 164 N 0.81 0.93 0.07 4.88 2.07 -1.87 0.13 115.15 122.18 1zrh h HIS 164 Ca 0.37 0.02 -0.00 0.00 -2.85 0.00 0.00 60.37 57.91 1zrh h HIS 164 Cb 0.36 -0.31 0.00 0.00 2.57 0.00 0.00 27.41 30.04 1zrh h HIS 164 CO -0.00 0.48 -0.04 0.28 -3.07 0.00 0.00 177.93 175.59 1zrh h VAL 165 N 0.91 1.06 -0.34 6.12 2.07 -1.81 -1.57 116.25 122.69 1zrh h VAL 165 Ca 0.36 -0.47 -0.16 0.00 0.82 0.00 0.00 66.70 67.25 1zrh h VAL 165 Cb 0.24 1.37 -0.01 0.00 -1.52 0.00 0.00 31.29 31.38 1zrh h VAL 165 CO -0.13 0.12 -0.42 0.45 0.02 0.00 0.00 177.57 177.60 1zrh h HIS 166 N -0.31 1.05 -0.92 1.57 -0.00 -1.50 -3.11 115.15 111.93 1zrh h HIS 166 Ca -0.01 -0.33 0.02 0.00 -0.00 0.00 0.00 60.37 60.06 1zrh h HIS 166 Cb 0.27 -0.22 -0.05 0.00 -0.00 0.00 0.00 27.41 27.41 1zrh h HIS 166 CO -0.00 1.13 0.60 1.98 -0.00 0.00 0.00 177.93 181.65 1zrh h MET 167 N 0.70 1.17 -0.99 2.45 -1.53 -0.73 -2.23 114.93 113.77 1zrh h MET 167 Ca 0.05 -0.07 0.01 0.00 -3.44 0.00 0.00 59.70 56.25 1zrh h MET 167 Cb 1.01 -0.26 -0.05 0.00 -0.55 0.00 0.00 31.60 31.74 1zrh h MET 167 CO 0.10 0.78 0.66 0.37 0.14 0.00 0.00 176.91 178.95 1zrh h GLN 168 N 1.21 1.30 -0.69 0.39 4.15 -1.24 0.30 115.11 120.53 1zrh h GLN 168 Ca 0.35 -0.08 -0.02 0.00 0.77 0.00 0.00 58.65 59.68 1zrh h GLN 168 Cb -0.08 -0.29 -0.03 0.00 0.21 0.00 0.00 27.48 27.29 1zrh h GLN 168 CO -0.09 0.86 0.36 -0.97 -1.93 0.00 0.00 178.83 177.06 1zrh h ASN 169 N 1.34 0.86 -0.21 -0.69 -1.24 -1.34 -2.51 115.58 111.79 1zrh h ASN 169 Ca 0.37 -0.08 -0.21 0.00 0.71 0.00 0.00 56.30 57.09 1zrh h ASN 169 Cb -0.14 -0.22 0.01 0.00 0.73 0.00 0.00 38.32 38.69 1zrh h ASN 169 CO -0.08 0.71 -0.69 -0.50 -1.29 0.00 0.00 177.43 175.58 1zrh h TRP 170 N 0.97 1.09 0.00 0.67 4.06 -1.18 -3.21 115.95 118.35 1zrh h TRP 170 Ca 0.24 -0.44 0.00 0.00 2.06 0.00 0.00 58.89 60.75 1zrh h TRP 170 Cb 0.05 -0.18 0.00 0.00 -1.00 0.00 0.00 29.16 28.03 1zrh h TRP 170 CO 0.01 1.28 0.00 1.28 -3.56 0.00 0.00 178.44 177.45 1zrh n LEU 171 N -3.96 0.55 0.27 -4.49 4.77 0.04 -1.29 117.00 112.89 1zrh n LEU 171 Ca -0.06 0.66 0.15 0.00 -0.03 0.00 0.00 56.01 56.74 1zrh n LEU 171 Cb 0.70 -0.62 0.76 0.00 -2.33 0.00 0.00 43.42 41.93 1zrh n LEU 171 CO 0.52 -0.62 0.99 0.03 -1.33 0.00 0.00 177.39 176.99 1zrh h ARG 172 N 0.00 0.00 0.00 3.23 3.08 -1.45 -3.35 114.38 115.88 1zrh h ARG 172 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 1zrh h ARG 172 Cb 0.26 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.31 1zrh h ARG 172 CO 0.00 0.08 -0.96 1.19 -1.07 0.00 0.00 179.97 179.21 1zrh n PHE 173 N -3.34 0.00 -4.79 3.04 3.72 -0.44 -5.05 117.46 110.60 1zrh n PHE 173 Ca -0.01 0.00 -0.24 0.00 -0.05 0.00 0.00 57.45 57.15 1zrh n PHE 173 Cb 0.26 0.00 -0.15 0.00 -0.94 0.00 0.00 39.48 38.65 1zrh n PHE 173 CO 0.00 0.00 0.00 -0.06 -0.05 0.00 0.00 176.76 176.65 1zrh s PHE 174 N -1.94 1.51 0.52 1.38 0.08 -0.41 -4.99 117.98 114.13 1zrh s PHE 174 Ca 0.00 -0.29 -0.20 0.00 0.12 0.00 0.00 56.93 56.56 1zrh s PHE 174 Cb 0.00 -0.97 -0.06 0.00 -0.57 0.00 0.00 43.02 41.42 1zrh s PHE 174 CO 0.00 -0.02 1.12 -1.25 -0.10 0.00 0.00 175.22 174.97 1zrh s PRO 175 N -0.43 3.48 0.31 0.24 0.04 -1.26 -4.31 135.00 133.07 1zrh s PRO 175 Ca 0.06 1.61 0.08 0.00 0.04 0.00 0.00 61.00 62.79 1zrh s PRO 175 Cb -0.07 -2.08 0.84 0.00 0.04 0.00 0.00 34.50 33.23 1zrh s PRO 175 CO -0.01 -0.74 1.73 1.25 0.04 0.00 0.00 177.00 179.27 1zrh h LEU 176 N 1.39 0.65 0.00 -3.56 5.85 -1.94 -0.83 115.31 116.87 1zrh h LEU 176 Ca -0.50 0.13 0.00 0.00 0.84 0.00 0.00 57.88 58.35 1zrh h LEU 176 Cb 1.25 0.03 0.00 0.00 0.37 0.00 0.00 40.66 42.32 1zrh h LEU 176 CO 0.58 0.12 0.00 0.54 -0.34 0.00 0.00 178.44 179.33 1zrh n ARG 177 N -4.89 0.13 -0.11 1.25 5.12 -1.26 -2.27 116.66 114.63 1zrh n ARG 177 Ca 0.26 0.09 0.11 0.00 -1.93 0.00 0.00 57.85 56.38 1zrh n ARG 177 Cb 0.70 -1.50 0.16 0.00 -1.16 0.00 0.00 32.46 30.66 1zrh n ARG 177 CO 0.00 0.00 0.00 0.72 -1.93 0.00 0.00 177.63 176.42 1zrh n HIS 178 N -1.41 0.28 -3.94 -1.55 8.25 -0.32 -4.73 115.22 111.80 1zrh n HIS 178 Ca 0.08 -0.15 -0.34 0.00 -0.26 0.00 0.00 57.72 57.04 1zrh n HIS 178 Cb 0.23 -0.00 -0.14 0.00 1.12 0.00 0.00 29.99 31.20 1zrh n HIS 178 CO 0.00 0.00 0.00 0.42 0.64 0.00 0.00 176.34 177.40 1zrh s ILE 179 N -1.56 2.81 -0.18 1.59 1.01 -0.96 -0.27 121.20 123.64 1zrh s ILE 179 Ca 0.32 -1.49 -0.21 0.00 0.00 0.00 0.00 60.65 59.27 1zrh s ILE 179 Cb 0.20 -2.65 -0.03 0.00 0.01 0.00 0.00 42.46 39.99 1zrh s ILE 179 CO 0.28 -0.13 0.62 -2.28 0.00 0.00 0.00 174.94 173.44 1zrh s HIS 180 N 1.21 3.41 -0.37 3.97 5.65 0.45 -4.94 115.29 124.66 1zrh s HIS 180 Ca -0.05 0.95 -0.19 0.00 0.25 0.00 0.00 55.06 56.03 1zrh s HIS 180 Cb -0.20 -2.77 0.00 0.00 -1.18 0.00 0.00 32.58 28.43 1zrh s HIS 180 CO -0.02 -0.11 0.54 0.42 -0.65 0.00 0.00 174.74 174.91 1zrh s ILE 181 N 1.66 4.98 -0.04 0.89 1.01 -1.26 -1.24 121.20 127.20 1zrh s ILE 181 Ca 0.29 0.26 -0.27 0.00 0.00 0.00 0.00 60.65 60.93 1zrh s ILE 181 Cb -0.16 -4.02 -0.03 0.00 0.01 0.00 0.00 42.46 38.26 1zrh s ILE 181 CO 0.11 -0.31 0.85 -0.69 0.00 0.00 0.00 174.94 174.91 1zrh s VAL 182 N 2.46 4.95 -0.70 2.92 1.01 0.72 -4.99 120.40 126.78 1zrh s VAL 182 Ca 0.19 1.77 -0.27 0.00 0.00 0.00 0.00 61.98 63.67 1zrh s VAL 182 Cb -0.15 -4.19 0.03 0.00 0.00 0.00 0.00 36.38 32.06 1zrh s VAL 182 CO 0.14 0.19 1.32 -0.62 0.00 0.00 0.00 175.10 176.13 1zrh s ASP 183 N 0.93 6.14 0.28 3.32 -1.08 -1.26 -1.72 116.67 123.27 1zrh s ASP 183 Ca 0.45 -0.28 0.00 0.00 -0.52 0.00 0.00 52.55 52.20 1zrh s ASP 183 Cb -0.19 -2.56 0.40 0.00 -1.46 0.00 0.00 42.92 39.11 1zrh s ASP 183 CO 0.23 -1.82 1.76 1.23 0.52 0.00 0.00 175.17 177.09 1zrh h GLY 184 N 13.11 0.70 0.98 2.66 0.00 -0.41 -1.15 103.07 118.96 1zrh h GLY 184 Ca -0.27 -0.49 -0.00 0.00 0.00 0.00 0.00 47.33 46.57 1zrh h GLY 184 CO 1.26 0.45 0.14 -0.55 0.00 0.00 0.00 176.54 177.84 1zrh h ASP 185 N 0.60 0.27 -0.62 0.19 3.32 -1.87 -2.26 116.42 116.05 1zrh h ASP 185 Ca 0.11 -0.04 -0.04 0.00 0.02 0.00 0.00 57.03 57.08 1zrh h ASP 185 Cb 0.51 -0.07 -0.03 0.00 0.22 0.00 0.00 39.33 39.96 1zrh h ASP 185 CO 0.03 0.23 0.26 0.03 -1.72 0.00 0.00 179.24 178.07 1zrh h ARG 186 N 0.29 0.95 -0.99 3.56 3.08 -1.86 -2.48 114.38 116.93 1zrh h ARG 186 Ca 0.08 -0.15 0.04 0.00 0.07 0.00 0.00 59.98 60.02 1zrh h ARG 186 Cb 0.01 -0.16 -0.06 0.00 0.08 0.00 0.00 29.97 29.83 1zrh h ARG 186 CO -0.02 0.78 0.65 1.25 -1.07 0.00 0.00 179.97 181.56 1zrh h LEU 187 N 0.93 1.07 -0.02 3.04 5.85 -1.03 0.90 115.31 126.05 1zrh h LEU 187 Ca 0.22 -0.01 -0.00 0.00 0.84 0.00 0.00 57.88 58.93 1zrh h LEU 187 Cb 0.18 -0.24 -0.00 0.00 0.37 0.00 0.00 40.66 40.97 1zrh h LEU 187 CO -0.02 0.72 0.01 0.40 -0.34 0.00 0.00 178.44 179.21 1zrh h ILE 188 N 1.24 1.08 -0.32 4.05 2.04 -1.00 -2.93 117.51 121.66 1zrh h ILE 188 Ca 0.40 -0.24 -0.14 0.00 1.00 0.00 0.00 64.86 65.88 1zrh h ILE 188 Cb 0.03 1.22 -0.00 0.00 -0.74 0.00 0.00 36.82 37.33 1zrh h ILE 188 CO -0.13 0.07 -0.36 0.03 0.00 0.00 0.00 178.15 177.75 1zrh h ARG 189 N -0.07 0.82 -0.96 2.37 3.08 -1.02 -3.43 114.38 115.16 1zrh h ARG 189 Ca 0.01 -0.45 -0.11 0.00 0.07 0.00 0.00 59.98 59.50 1zrh h ARG 189 Cb 0.10 0.02 -0.17 0.00 0.08 0.00 0.00 29.97 30.00 1zrh h ARG 189 CO -0.00 1.08 -0.46 0.34 -1.07 0.00 0.00 179.97 179.86 1zrh s ASP 190 N -6.71 -1.43 0.18 7.04 2.15 0.27 -5.05 116.67 113.11 1zrh s ASP 190 Ca -0.12 -1.33 -0.10 0.00 0.43 0.00 0.00 52.55 51.43 1zrh s ASP 190 Cb 0.10 1.86 0.08 0.00 -0.30 0.00 0.00 42.92 44.66 1zrh s ASP 190 CO 0.86 -0.09 1.69 1.55 -0.17 0.00 0.00 175.17 179.00 1zrh h PRO 191 N 5.71 1.02 -0.42 4.34 0.13 -1.64 -3.34 132.00 137.81 1zrh h PRO 191 Ca 0.05 -0.26 0.08 0.00 -0.87 0.00 0.00 66.00 65.01 1zrh h PRO 191 Cb 1.14 -0.13 -0.07 0.00 0.13 0.00 0.00 31.00 32.07 1zrh h PRO 191 CO 0.04 0.93 -0.01 0.35 -0.23 0.00 0.00 178.00 179.08 1zrh h PHE 192 N 0.94 -0.05 -0.58 1.56 3.57 -1.92 0.52 116.94 120.98 1zrh h PHE 192 Ca 0.20 0.03 0.10 0.00 3.53 0.00 0.00 57.97 61.83 1zrh h PHE 192 Cb 0.38 0.09 -0.03 0.00 2.79 0.00 0.00 35.95 39.17 1zrh h PHE 192 CO 0.03 -0.10 0.39 -1.35 -2.23 0.00 0.00 178.31 175.05 1zrh h PRO 193 N 0.09 0.36 -0.06 6.41 0.11 -1.97 -0.33 132.00 136.61 1zrh h PRO 193 Ca 0.20 -0.02 -0.16 0.00 0.11 0.00 0.00 66.00 66.14 1zrh h PRO 193 Cb 0.30 -0.08 -0.01 0.00 0.11 0.00 0.00 31.00 31.31 1zrh h PRO 193 CO -0.35 0.24 -0.66 0.93 -0.21 0.00 0.00 178.00 177.95 1zrh h GLU 194 N 0.37 0.24 -0.04 1.05 4.39 -1.11 -2.96 114.58 116.52 1zrh h GLU 194 Ca 0.27 -0.18 -0.20 0.00 0.34 0.00 0.00 59.36 59.59 1zrh h GLU 194 Cb 0.56 0.03 -0.00 0.00 -0.10 0.00 0.00 28.75 29.24 1zrh h GLU 194 CO -0.07 0.81 -0.82 0.82 -1.16 0.00 0.00 179.01 178.59 1zrh h ILE 195 N 0.17 1.40 -0.63 3.13 1.08 -0.44 -2.68 117.51 119.54 1zrh h ILE 195 Ca -0.01 -2.31 0.05 0.00 -0.39 0.00 0.00 64.86 62.20 1zrh h ILE 195 Cb 1.18 2.26 -0.05 0.00 -3.07 0.00 0.00 36.82 37.15 1zrh h ILE 195 CO 0.10 0.69 0.36 1.56 -0.69 0.00 0.00 178.15 180.17 1zrh h GLN 196 N 0.24 0.66 -0.91 2.37 4.20 -1.05 -1.01 115.11 119.60 1zrh h GLN 196 Ca -0.05 -0.04 0.01 0.00 0.06 0.00 0.00 58.65 58.63 1zrh h GLN 196 Cb 1.43 -0.15 -0.05 0.00 0.30 0.00 0.00 27.48 29.01 1zrh h GLN 196 CO 0.14 0.43 0.60 0.87 -0.67 0.00 0.00 178.83 180.21 1zrh h LYS 197 N 0.68 1.20 -0.14 1.46 1.57 -1.35 -0.59 116.57 119.40 1zrh h LYS 197 Ca 0.27 -0.07 -0.01 0.00 -1.87 0.00 0.00 60.65 58.97 1zrh h LYS 197 Cb 0.13 -0.27 -0.01 0.00 0.08 0.00 0.00 32.23 32.16 1zrh h LYS 197 CO -0.15 0.80 0.06 0.28 -0.57 0.00 0.00 179.45 179.86 1zrh h VAL 198 N 1.24 1.14 -0.67 0.50 2.07 -1.12 -0.09 116.25 119.32 1zrh h VAL 198 Ca 0.33 -0.41 0.04 0.00 0.82 0.00 0.00 66.70 67.48 1zrh h VAL 198 Cb -0.14 1.15 -0.05 0.00 -1.52 0.00 0.00 31.29 30.74 1zrh h VAL 198 CO -0.07 0.13 0.40 -0.33 0.02 0.00 0.00 177.57 177.71 1zrh h GLU 199 N 0.08 0.74 -0.30 1.57 5.08 -0.85 -0.23 114.58 120.66 1zrh h GLU 199 Ca 0.05 -0.04 -0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1zrh h GLU 199 Cb 0.15 -0.17 -0.01 0.00 0.50 0.00 0.00 28.75 29.22 1zrh h GLU 199 CO -0.00 0.49 0.18 -0.09 -1.00 0.00 0.00 179.01 178.59 1zrh h ARG 200 N 0.76 0.41 -0.98 2.33 9.65 -0.92 0.15 114.38 125.77 1zrh h ARG 200 Ca 0.28 -0.04 0.02 0.00 -1.10 0.00 0.00 59.98 59.14 1zrh h ARG 200 Cb 0.09 -0.09 -0.05 0.00 -1.39 0.00 0.00 29.97 28.53 1zrh h ARG 200 CO -0.14 0.32 0.65 0.35 2.80 0.00 0.00 179.97 183.95 1zrh h PHE 201 N 0.39 1.22 -0.03 2.20 3.57 -0.65 -1.58 116.94 122.07 1zrh h PHE 201 Ca 0.11 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.64 1zrh h PHE 201 Cb 0.01 -0.41 0.00 0.00 2.79 0.00 0.00 35.95 38.34 1zrh h PHE 201 CO -0.04 0.74 0.00 1.28 -2.23 0.00 0.00 178.31 178.06 1zrh n LEU 202 N -4.42 0.84 -2.75 0.59 4.77 -0.13 -4.90 117.00 110.99 1zrh n LEU 202 Ca 0.12 -0.30 -0.21 0.00 -0.03 0.00 0.00 56.01 55.60 1zrh n LEU 202 Cb 0.04 -0.01 0.03 0.00 -2.33 0.00 0.00 43.42 41.15 1zrh n LEU 202 CO 0.36 0.15 -0.02 0.29 -1.33 0.00 0.00 177.39 176.84 1zrh n LYS 203 N -0.32 -4.35 -3.52 3.23 5.02 -0.60 -5.01 118.16 112.61 1zrh n LYS 203 Ca 0.20 0.85 -0.37 0.00 -2.02 0.00 0.00 58.31 56.97 1zrh n LYS 203 Cb 0.24 -5.55 -0.06 0.00 -0.02 0.00 0.00 35.03 29.63 1zrh n LYS 203 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 1zrh s LEU 204 N -6.15 4.44 0.53 -0.35 1.43 -0.06 -5.03 118.68 113.49 1zrh s LEU 204 Ca 0.26 0.91 -0.22 0.00 -1.03 0.00 0.00 54.13 54.06 1zrh s LEU 204 Cb -0.12 -2.70 -0.06 0.00 0.03 0.00 0.00 46.19 43.34 1zrh s LEU 204 CO 0.32 0.28 1.18 -1.54 0.23 0.00 0.00 176.35 176.82 1zrh n SER 205 N 1.55 1.89 -3.56 2.29 3.41 -1.26 -4.49 113.62 113.44 1zrh n SER 205 Ca -0.12 0.95 -0.41 0.00 -0.26 0.00 0.00 58.87 59.03 1zrh n SER 205 Cb 0.52 -1.48 -0.06 0.00 -0.26 0.00 0.00 64.21 62.93 1zrh n SER 205 CO 0.00 0.00 0.00 -0.81 -0.16 0.00 0.00 175.04 174.07 1zrh n PRO 206 N -0.70 1.31 0.04 4.33 -0.04 -1.26 -4.61 135.00 134.07 1zrh n PRO 206 Ca 0.11 -1.68 -0.06 0.00 -0.04 0.00 0.00 63.50 61.83 1zrh n PRO 206 Cb 0.44 -2.81 -0.11 0.00 -0.04 0.00 0.00 33.50 30.98 1zrh n PRO 206 CO 0.00 0.00 0.00 1.96 -0.04 0.00 0.00 175.50 177.42 1zrh h GLN 207 N 8.08 0.00 -6.91 0.54 1.08 -2.00 -3.46 115.11 112.45 1zrh h GLN 207 Ca 0.40 0.00 -0.49 0.00 -1.45 0.00 0.00 58.65 57.11 1zrh h GLN 207 Cb 0.63 0.00 0.02 0.00 -0.05 0.00 0.00 27.48 28.08 1zrh h GLN 207 CO 1.93 0.78 0.44 0.42 -0.95 0.00 0.00 178.83 181.44 1zrh s ILE 208 N -2.71 3.57 0.15 2.54 1.01 -1.26 -5.03 121.20 119.47 1zrh s ILE 208 Ca -0.01 1.32 0.08 0.00 0.00 0.00 0.00 60.65 62.04 1zrh s ILE 208 Cb 0.09 -3.74 -0.04 0.00 0.01 0.00 0.00 42.46 38.78 1zrh s ILE 208 CO 0.81 0.12 -0.18 0.20 0.00 0.00 0.00 174.94 175.90 1zrh s ASN 209 N -1.31 2.57 0.55 3.58 -0.87 -1.26 -5.01 114.94 113.20 1zrh s ASN 209 Ca 0.54 -0.84 0.27 0.00 -1.57 0.00 0.00 52.86 51.26 1zrh s ASN 209 Cb -0.26 -0.14 1.46 0.00 -0.02 0.00 0.00 41.25 42.28 1zrh s ASN 209 CO 0.33 -0.04 1.98 0.00 -2.57 0.00 0.00 177.10 176.80 1zrh h ALA 210 N 3.34 2.38 0.00 0.60 0.00 -1.96 0.25 119.26 123.87 1zrh h ALA 210 Ca -0.42 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.47 1zrh h ALA 210 Cb 1.20 0.04 0.00 0.00 0.00 0.00 0.00 17.79 19.03 1zrh h ALA 210 CO 0.50 -0.66 0.00 -1.13 0.00 0.00 0.00 179.25 177.96 1zrh n SER 211 N -4.16 0.00 0.00 0.00 3.41 -1.26 -2.46 113.62 109.15 1zrh n SER 211 Ca 0.09 0.46 0.12 0.00 -0.26 0.00 0.00 58.87 59.28 1zrh n SER 211 Cb 0.61 -0.48 0.65 0.00 -0.26 0.00 0.00 64.21 64.73 1zrh n SER 211 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 1zrh n ASN 212 N -1.48 0.00 -4.22 4.04 4.13 0.08 -4.70 115.26 113.10 1zrh n ASN 212 Ca 0.05 -0.17 -0.29 0.00 1.68 0.00 0.00 54.58 55.85 1zrh n ASN 212 Cb 0.21 -0.25 -0.16 0.00 -1.54 0.00 0.00 39.78 38.04 1zrh n ASN 212 CO 0.00 0.00 0.00 -0.36 0.28 0.00 0.00 177.26 177.18 1zrh s PHE 213 N -2.50 2.09 0.00 3.10 0.08 -1.03 0.31 117.98 120.03 1zrh s PHE 213 Ca 0.26 -0.55 -0.02 0.00 0.12 0.00 0.00 56.93 56.74 1zrh s PHE 213 Cb 0.17 -1.37 -0.01 0.00 -0.57 0.00 0.00 43.02 41.24 1zrh s PHE 213 CO 0.37 -0.15 0.04 1.52 -0.10 0.00 0.00 175.22 176.90 1zrh s TYR 214 N -0.21 0.09 -0.16 0.36 -0.85 -0.28 -4.95 117.35 111.35 1zrh s TYR 214 Ca -0.00 -0.18 -0.29 0.00 -0.52 0.00 0.00 57.07 56.08 1zrh s TYR 214 Cb -0.12 -0.08 -0.01 0.00 0.38 0.00 0.00 41.96 42.14 1zrh s TYR 214 CO 0.02 -0.14 1.13 0.12 -1.52 0.00 0.00 175.55 175.16 1zrh s PHE 215 N -0.83 3.19 -0.31 -3.49 5.36 -1.26 -0.15 117.98 120.49 1zrh s PHE 215 Ca -0.09 1.31 -0.12 0.00 -0.96 0.00 0.00 56.93 57.07 1zrh s PHE 215 Cb -0.06 -3.35 -0.03 0.00 -0.34 0.00 0.00 43.02 39.24 1zrh s PHE 215 CO -0.00 -0.95 0.21 1.21 -1.46 0.00 0.00 175.22 174.23 1zrh s ASN 216 N 1.47 6.00 0.25 6.13 3.84 -0.70 -4.93 114.94 126.99 1zrh s ASN 216 Ca 0.50 -0.25 0.03 0.00 0.21 0.00 0.00 52.86 53.35 1zrh s ASN 216 Cb -0.19 -2.12 0.29 0.00 -0.55 0.00 0.00 41.25 38.68 1zrh s ASN 216 CO 0.13 -0.15 1.60 0.11 -2.79 0.00 0.00 177.10 176.00 1zrh h LYS 217 N 8.43 0.31 -0.24 0.43 1.57 -1.95 0.38 116.57 125.50 1zrh h LYS 217 Ca -0.33 -0.18 -0.05 0.00 -1.87 0.00 0.00 60.65 58.22 1zrh h LYS 217 Cb 1.17 0.02 -0.01 0.00 0.08 0.00 0.00 32.23 33.49 1zrh h LYS 217 CO 0.60 0.75 -0.04 1.15 -0.57 0.00 0.00 179.45 181.34 1zrh h THR 218 N 0.25 1.28 -0.44 -0.16 2.02 -1.95 -3.17 112.91 110.74 1zrh h THR 218 Ca 0.01 -1.03 -0.13 0.00 0.77 0.00 0.00 66.41 66.04 1zrh h THR 218 Cb 0.99 1.46 -0.01 0.00 -1.74 0.00 0.00 68.15 68.85 1zrh h THR 218 CO 0.08 0.32 -0.22 0.50 0.37 0.00 0.00 175.52 176.57 1zrh h LYS 219 N 0.20 0.89 -0.06 6.66 1.63 -1.87 -3.46 116.57 120.57 1zrh h LYS 219 Ca 0.06 -0.37 -0.02 0.00 -0.85 0.00 0.00 60.65 59.46 1zrh h LYS 219 Cb 0.50 -0.03 -0.01 0.00 -0.60 0.00 0.00 32.23 32.08 1zrh h LYS 219 CO 0.02 1.02 -0.02 0.41 -3.45 0.00 0.00 179.45 177.43 1zrh n GLY 220 N -0.16 0.49 3.17 5.01 0.00 0.13 -5.02 105.19 108.81 1zrh n GLY 220 Ca 0.00 -0.84 -0.08 0.00 0.00 0.00 0.00 46.02 45.10 1zrh n GLY 220 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1zrh s PHE 221 N -2.03 0.25 0.53 1.61 0.08 -1.18 -5.00 117.98 112.24 1zrh s PHE 221 Ca 0.00 -0.70 -0.22 0.00 0.12 0.00 0.00 56.93 56.13 1zrh s PHE 221 Cb 0.00 -0.15 -0.05 0.00 -0.57 0.00 0.00 43.02 42.25 1zrh s PHE 221 CO 0.00 -0.49 1.33 0.71 -0.10 0.00 0.00 175.22 176.67 1zrh s TYR 222 N -3.79 2.38 0.32 0.36 2.02 -1.26 -1.72 117.35 115.66 1zrh s TYR 222 Ca 0.05 1.40 0.05 0.00 -0.37 0.00 0.00 57.07 58.20 1zrh s TYR 222 Cb 0.05 -3.73 -0.06 0.00 -0.40 0.00 0.00 41.96 37.82 1zrh s TYR 222 CO -0.10 -2.68 0.02 0.00 -1.57 0.00 0.00 175.55 171.22 1zrh s LEU 224 N -3.50 3.36 -0.10 0.00 1.43 0.82 -1.13 118.68 119.57 1zrh s LEU 224 Ca 0.34 -0.02 0.01 0.00 -1.03 0.00 0.00 54.13 53.43 1zrh s LEU 224 Cb 0.08 -1.86 0.02 0.00 0.03 0.00 0.00 46.19 44.45 1zrh s LEU 224 CO 0.15 0.31 -0.11 -0.60 0.23 0.00 0.00 176.35 176.33 1zrh s ARG 225 N -1.25 1.73 -0.26 1.70 3.52 0.15 -0.57 118.95 123.97 1zrh s ARG 225 Ca 0.16 -0.37 -0.02 0.00 -0.13 0.00 0.00 55.73 55.36 1zrh s ARG 225 Cb -0.11 -1.58 0.15 0.00 -1.56 0.00 0.00 34.95 31.84 1zrh s ARG 225 CO 0.06 -0.12 0.43 0.34 -0.81 0.00 0.00 175.30 175.20 1zrh s ASP 226 N 1.18 -0.16 -1.02 -2.12 2.15 0.06 -4.37 116.67 112.39 1zrh s ASP 226 Ca -0.04 0.41 -0.17 0.00 0.43 0.00 0.00 52.55 53.18 1zrh s ASP 226 Cb -0.14 1.38 0.01 0.00 -0.30 0.00 0.00 42.92 43.87 1zrh s ASP 226 CO -0.03 -0.29 0.69 -1.54 -0.17 0.00 0.00 175.17 173.84 1zrh n SER 227 N 5.38 -5.06 0.00 -0.34 3.41 -1.26 -2.44 113.62 113.30 1zrh n SER 227 Ca -0.03 -1.00 0.00 0.00 -0.26 0.00 0.00 58.87 57.58 1zrh n SER 227 Cb 0.50 -2.50 0.00 0.00 -0.26 0.00 0.00 64.21 61.96 1zrh n SER 227 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1zrh n GLY 228 N -1.81 2.93 3.77 5.00 0.00 -1.26 -5.01 105.19 108.81 1zrh n GLY 228 Ca -0.16 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.49 1zrh n GLY 228 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1zrh s ARG 229 N -0.18 4.08 -0.13 1.61 3.52 -1.02 -5.08 118.95 121.75 1zrh s ARG 229 Ca 0.00 0.20 -0.00 0.00 -0.13 0.00 0.00 55.73 55.79 1zrh s ARG 229 Cb 0.00 -3.34 -0.01 0.00 -1.56 0.00 0.00 34.95 30.03 1zrh s ARG 229 CO 0.00 0.42 -0.13 -0.51 -0.81 0.00 0.00 175.30 174.27 1zrh s ASP 230 N -0.11 4.02 -0.10 -2.12 1.11 -1.26 -0.76 116.67 117.45 1zrh s ASP 230 Ca 0.19 -0.32 -0.06 0.00 0.18 0.00 0.00 52.55 52.54 1zrh s ASP 230 Cb -0.14 -1.61 0.04 0.00 1.07 0.00 0.00 42.92 42.28 1zrh s ASP 230 CO 0.07 0.17 0.24 0.00 1.18 0.00 0.00 175.17 176.83 1zrh s ARG 231 N 0.35 0.21 0.44 8.23 1.70 0.27 -5.00 118.95 125.15 1zrh s ARG 231 Ca -0.11 0.48 0.02 0.00 -0.47 0.00 0.00 55.73 55.65 1zrh s ARG 231 Cb -0.16 -0.07 0.00 0.00 -0.57 0.00 0.00 34.95 34.15 1zrh s ARG 231 CO 0.06 -0.14 0.64 0.00 -1.08 0.00 0.00 175.30 174.78 1zrh s LEU 233 N -4.50 3.14 1.13 0.00 1.02 -1.26 -4.97 118.68 113.23 1zrh s LEU 233 Ca 0.50 1.72 -0.16 0.00 0.02 0.00 0.00 54.13 56.20 1zrh s LEU 233 Cb -0.10 -4.51 0.25 0.00 0.02 0.00 0.00 46.19 41.85 1zrh s LEU 233 CO 0.36 -1.63 1.10 -1.00 0.02 0.00 0.00 176.35 175.20 1zrh s HIS 234 N -2.92 1.16 0.24 0.29 3.76 -1.26 -4.86 115.29 111.69 1zrh s HIS 234 Ca 0.60 0.71 -0.06 0.00 -0.15 0.00 0.00 55.06 56.16 1zrh s HIS 234 Cb -0.15 -3.35 0.44 0.00 1.11 0.00 0.00 32.58 30.62 1zrh s HIS 234 CO 0.53 -3.52 1.69 1.49 -0.85 0.00 0.00 174.74 174.08 1zrh h GLU 235 N -2.33 0.27 0.00 1.40 4.57 -2.00 -0.78 114.58 115.70 1zrh h GLU 235 Ca -0.50 -0.02 0.00 0.00 -1.18 0.00 0.00 59.36 57.67 1zrh h GLU 235 Cb 1.31 -0.06 0.00 0.00 -0.16 0.00 0.00 28.75 29.84 1zrh h GLU 235 CO 0.45 0.18 0.00 0.66 -1.18 0.00 0.00 179.01 179.11 1zrh h SER 236 N 0.28 0.00 -3.75 1.04 4.64 -2.03 -3.42 113.55 110.30 1zrh h SER 236 Ca 0.40 0.00 -0.66 0.00 -0.47 0.00 0.00 61.79 61.06 1zrh h SER 236 Cb 0.67 0.00 -0.20 0.00 -0.31 0.00 0.00 62.40 62.56 1zrh h SER 236 CO -0.49 0.00 -0.53 -0.54 -0.87 0.00 0.00 176.83 174.40 1zrh s LYS 237 N -3.70 3.61 0.00 4.77 -0.14 -0.30 -4.46 119.74 119.52 1zrh s LYS 237 Ca -0.02 -0.54 0.00 0.00 -1.36 0.00 0.00 55.97 54.05 1zrh s LYS 237 Cb 0.09 -3.63 0.00 0.00 -1.68 0.00 0.00 37.83 32.61 1zrh s LYS 237 CO 0.31 -0.32 0.00 0.41 -0.76 0.00 0.00 175.35 174.99 1zrh n GLY 238 N 5.03 0.64 3.87 -3.33 0.00 -1.26 -4.79 105.19 105.35 1zrh n GLY 238 Ca -0.14 -0.35 -0.37 0.00 0.00 0.00 0.00 46.02 45.17 1zrh n GLY 238 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1zrh s ARG 239 N -1.49 3.42 0.12 1.61 0.52 -1.26 -5.03 118.95 116.83 1zrh s ARG 239 Ca 0.00 -0.15 -0.31 0.00 -0.52 0.00 0.00 55.73 54.75 1zrh s ARG 239 Cb 0.00 -3.17 -0.10 0.00 0.52 0.00 0.00 34.95 32.20 1zrh s ARG 239 CO 0.00 0.77 1.79 0.00 0.02 0.00 0.00 175.30 177.88 1zrh s ALA 240 N -1.03 3.77 0.63 2.13 0.00 -1.26 -4.99 121.76 121.01 1zrh s ALA 240 Ca 0.15 1.42 -0.13 0.00 0.00 0.00 0.00 51.96 53.41 1zrh s ALA 240 Cb -0.12 -3.74 -0.02 0.00 0.00 0.00 0.00 23.12 19.23 1zrh s ALA 240 CO 0.04 -1.17 1.05 -1.01 0.00 0.00 0.00 175.76 174.67 1zrh s HIS 241 N 2.54 3.20 0.56 0.00 0.09 -1.26 -4.98 115.29 115.44 1zrh s HIS 241 Ca 0.79 1.43 -0.20 0.00 -0.00 0.00 0.00 55.06 57.09 1zrh s HIS 241 Cb -0.45 -2.88 -0.05 0.00 -0.00 0.00 0.00 32.58 29.20 1zrh s HIS 241 CO 0.35 -1.01 1.19 -1.25 -0.00 0.00 0.00 174.74 174.02 1zrh s PRO 242 N -4.66 3.18 0.16 8.40 0.04 -1.26 -4.98 135.00 135.88 1zrh s PRO 242 Ca 0.59 1.79 -0.32 0.00 0.04 0.00 0.00 61.00 63.11 1zrh s PRO 242 Cb -0.14 -2.02 -0.10 0.00 0.04 0.00 0.00 34.50 32.28 1zrh s PRO 242 CO 0.47 -1.03 1.62 -1.14 0.04 0.00 0.00 177.00 176.95 1zrh s GLN 243 N -3.22 4.19 -0.05 4.56 0.74 -1.26 -5.02 119.66 119.60 1zrh s GLN 243 Ca 0.74 2.41 0.02 0.00 0.05 0.00 0.00 55.36 58.59 1zrh s GLN 243 Cb -0.29 -3.20 0.01 0.00 1.10 0.00 0.00 33.01 30.63 1zrh s GLN 243 CO 0.32 -0.66 -0.11 0.08 -0.55 0.00 0.00 175.29 174.38 1zrh s VAL 244 N 1.36 0.98 -0.01 1.34 1.01 -1.26 -5.05 120.40 118.77 1zrh s VAL 244 Ca 0.72 -0.41 -0.38 0.00 0.00 0.00 0.00 61.98 61.90 1zrh s VAL 244 Cb -0.45 -0.89 -0.18 0.00 0.00 0.00 0.00 36.38 34.87 1zrh s VAL 244 CO 0.32 0.31 1.33 -0.67 0.00 0.00 0.00 175.10 176.39 1zrh n ASP 245 N 3.65 1.28 -0.34 3.32 -0.08 -1.26 -4.72 116.55 118.39 1zrh n ASP 245 Ca -0.22 1.13 0.22 0.00 -1.51 0.00 0.00 54.79 54.41 1zrh n ASP 245 Cb 0.52 -1.10 0.47 0.00 2.34 0.00 0.00 41.12 43.35 1zrh n ASP 245 CO 0.00 0.00 0.00 -0.65 0.12 0.00 0.00 177.20 176.67 1zrh h PRO 246 N 4.47 0.42 -0.67 -0.67 0.11 -1.99 -0.56 132.00 133.12 1zrh h PRO 246 Ca -0.48 -0.03 -0.08 0.00 0.11 0.00 0.00 66.00 65.52 1zrh h PRO 246 Cb 1.36 -0.09 -0.03 0.00 0.11 0.00 0.00 31.00 32.35 1zrh h PRO 246 CO 0.77 0.28 0.11 -0.22 -0.21 0.00 0.00 178.00 178.73 1zrh h LYS 247 N 0.43 1.11 -0.20 1.05 3.64 -1.99 0.61 116.57 121.22 1zrh h LYS 247 Ca 0.65 -0.30 -0.13 0.00 -1.27 0.00 0.00 60.65 59.61 1zrh h LYS 247 Cb 1.51 -0.13 0.00 0.00 -0.41 0.00 0.00 32.23 33.20 1zrh h LYS 247 CO -0.41 1.01 -0.37 1.25 -2.27 0.00 0.00 179.45 178.65 1zrh h LEU 248 N 1.03 0.68 -1.03 5.20 5.85 -1.54 -2.41 115.31 123.09 1zrh h LEU 248 Ca 0.20 -0.54 0.03 0.00 0.84 0.00 0.00 57.88 58.41 1zrh h LEU 248 Cb 0.44 -0.20 -0.05 0.00 0.37 0.00 0.00 40.66 41.22 1zrh h LEU 248 CO 0.01 1.09 0.65 0.25 -0.34 0.00 0.00 178.44 180.11 1zrh h LEU 249 N 0.30 1.10 -0.47 2.25 5.85 -1.09 -1.62 115.31 121.64 1zrh h LEU 249 Ca 0.01 -0.02 -0.02 0.00 0.84 0.00 0.00 57.88 58.70 1zrh h LEU 249 Cb 0.97 -0.26 -0.02 0.00 0.37 0.00 0.00 40.66 41.72 1zrh h LEU 249 CO 0.08 0.77 0.23 -1.13 -0.34 0.00 0.00 178.44 178.05 1zrh h ASN 250 N 1.28 0.61 -0.45 1.25 -1.24 -0.81 -1.52 115.58 114.71 1zrh h ASN 250 Ca 0.38 -0.12 -0.04 0.00 0.71 0.00 0.00 56.30 57.23 1zrh h ASN 250 Cb -0.05 -0.16 -0.02 0.00 0.73 0.00 0.00 38.32 38.82 1zrh h ASN 250 CO -0.11 0.56 0.17 0.11 -1.29 0.00 0.00 177.43 176.87 1zrh h LYS 251 N 0.61 0.74 0.07 6.67 1.79 -0.92 -1.01 116.57 124.52 1zrh h LYS 251 Ca 0.16 -0.12 -0.00 0.00 -2.18 0.00 0.00 60.65 58.51 1zrh h LYS 251 Cb 0.11 -0.13 0.00 0.00 -1.58 0.00 0.00 32.23 30.64 1zrh h LYS 251 CO -0.02 0.64 -0.03 1.25 -1.08 0.00 0.00 179.45 180.20 1zrh h LEU 252 N 0.72 -0.08 -0.51 2.94 5.85 -1.13 -0.08 115.31 123.03 1zrh h LEU 252 Ca 0.17 -0.12 0.10 0.00 0.84 0.00 0.00 57.88 58.87 1zrh h LEU 252 Cb 0.20 0.02 -0.08 0.00 0.37 0.00 0.00 40.66 41.17 1zrh h LEU 252 CO -0.01 0.07 0.05 0.45 -0.34 0.00 0.00 178.44 178.66 1zrh h HIS 253 N -0.22 0.06 -0.60 1.25 3.86 -1.02 -2.46 115.15 116.02 1zrh h HIS 253 Ca -0.01 0.03 -0.08 0.00 -1.16 0.00 0.00 60.37 59.16 1zrh h HIS 253 Cb 0.19 0.05 -0.02 0.00 1.06 0.00 0.00 27.41 28.69 1zrh h HIS 253 CO -0.03 -0.07 0.07 0.93 0.86 0.00 0.00 177.93 179.69 1zrh h GLU 254 N 0.17 0.99 -0.91 2.45 5.08 -1.11 -2.89 114.58 118.36 1zrh h GLU 254 Ca 0.26 -0.26 0.13 0.00 -1.00 0.00 0.00 59.36 58.49 1zrh h GLU 254 Cb 0.38 -0.12 -0.09 0.00 0.50 0.00 0.00 28.75 29.43 1zrh h GLU 254 CO -0.39 0.93 0.53 -0.92 -1.00 0.00 0.00 179.01 178.16 1zrh h TYR 255 N 0.92 0.95 -0.00 4.33 3.20 -0.52 -2.23 116.97 123.62 1zrh h TYR 255 Ca 0.18 0.03 0.00 0.00 3.14 0.00 0.00 58.73 62.08 1zrh h TYR 255 Cb 0.44 -0.29 0.00 0.00 1.54 0.00 0.00 36.73 38.42 1zrh h TYR 255 CO 0.03 0.33 -0.05 1.19 -1.64 0.00 0.00 178.16 178.02 1zrh n PHE 256 N -4.74 0.00 -0.03 -3.82 3.72 -1.10 -4.31 117.46 107.18 1zrh n PHE 256 Ca 0.17 0.00 -0.10 0.00 -0.05 0.00 0.00 57.45 57.47 1zrh n PHE 256 Cb 0.38 -0.44 -0.04 0.00 -0.94 0.00 0.00 39.48 38.44 1zrh n PHE 256 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 176.76 177.16 1zrh h HIS 257 N 0.02 0.22 -0.05 1.38 3.86 -1.38 0.31 115.15 119.51 1zrh h HIS 257 Ca 0.00 0.00 -0.01 0.00 -1.16 0.00 0.00 60.37 59.20 1zrh h HIS 257 Cb 0.47 -0.07 -0.00 0.00 1.06 0.00 0.00 27.41 28.86 1zrh h HIS 257 CO 0.00 0.15 -0.00 1.49 0.86 0.00 0.00 177.93 180.42 1zrh h GLU 258 N 0.22 0.10 -0.46 2.45 4.81 -1.78 -1.55 114.58 118.37 1zrh h GLU 258 Ca 0.06 -0.03 0.01 0.00 -0.13 0.00 0.00 59.36 59.27 1zrh h GLU 258 Cb -0.01 -0.01 -0.02 0.00 0.63 0.00 0.00 28.75 29.33 1zrh h GLU 258 CO -0.01 0.40 0.31 -1.35 -0.73 0.00 0.00 179.01 177.62 1zrh h PRO 259 N -0.21 0.57 -0.16 0.92 0.10 -1.76 -1.97 132.00 129.47 1zrh h PRO 259 Ca 0.01 -0.03 0.00 0.00 0.10 0.00 0.00 66.00 66.08 1zrh h PRO 259 Cb 0.35 -0.13 -0.01 0.00 0.10 0.00 0.00 31.00 31.32 1zrh h PRO 259 CO 0.00 0.37 0.11 -0.91 0.10 0.00 0.00 178.00 177.67 1zrh h ASN 260 N 0.58 0.19 -0.63 -2.05 2.35 -0.23 -1.17 115.58 114.62 1zrh h ASN 260 Ca 0.17 -0.02 0.04 0.00 -0.55 0.00 0.00 56.30 55.95 1zrh h ASN 260 Cb -0.01 -0.05 -0.05 0.00 0.05 0.00 0.00 38.32 38.27 1zrh h ASN 260 CO -0.04 0.15 0.37 0.11 -1.65 0.00 0.00 177.43 176.37 1zrh h LYS 261 N 0.21 0.69 -0.93 0.81 1.57 -1.05 0.38 116.57 118.26 1zrh h LYS 261 Ca 0.06 -0.04 0.08 0.00 -1.87 0.00 0.00 60.65 58.88 1zrh h LYS 261 Cb -0.01 -0.16 -0.07 0.00 0.08 0.00 0.00 32.23 32.08 1zrh h LYS 261 CO -0.01 0.46 0.58 0.87 -0.57 0.00 0.00 179.45 180.77 1zrh h LYS 262 N 0.71 0.99 -0.13 3.15 1.57 -1.23 -0.79 116.57 120.85 1zrh h LYS 262 Ca 0.27 -0.06 -0.02 0.00 -1.87 0.00 0.00 60.65 58.97 1zrh h LYS 262 Cb 0.09 -0.22 -0.00 0.00 0.08 0.00 0.00 32.23 32.17 1zrh h LYS 262 CO -0.14 0.66 0.02 0.35 -0.57 0.00 0.00 179.45 179.77 1zrh h PHE 263 N 1.02 0.23 -0.87 -1.35 3.57 -0.53 -1.76 116.94 117.25 1zrh h PHE 263 Ca 0.42 -0.03 0.06 0.00 3.53 0.00 0.00 57.97 61.94 1zrh h PHE 263 Cb 0.25 -0.06 -0.06 0.00 2.79 0.00 0.00 35.95 38.87 1zrh h PHE 263 CO -0.02 0.41 0.54 0.74 -2.23 0.00 0.00 178.31 177.75 1zrh h PHE 264 N -0.01 1.01 -0.10 0.41 0.04 -0.65 -1.12 116.94 116.51 1zrh h PHE 264 Ca 0.04 0.03 -0.15 0.00 2.80 0.00 0.00 57.97 60.69 1zrh h PHE 264 Cb 0.30 -0.33 -0.01 0.00 2.20 0.00 0.00 35.95 38.11 1zrh h PHE 264 CO 0.02 0.52 -0.57 0.93 -0.60 0.00 0.00 178.31 178.61 1zrh h GLU 265 N 1.00 0.32 -0.20 1.51 5.08 -1.05 -1.24 114.58 119.99 1zrh h GLU 265 Ca 0.37 -0.20 -0.18 0.00 -1.00 0.00 0.00 59.36 58.35 1zrh h GLU 265 Cb 0.15 0.03 -0.00 0.00 0.50 0.00 0.00 28.75 29.42 1zrh h GLU 265 CO -0.17 0.80 -0.59 1.25 -1.00 0.00 0.00 179.01 179.30 1zrh h LEU 266 N 0.24 0.75 -0.91 1.33 5.85 -0.65 -3.31 115.31 118.62 1zrh h LEU 266 Ca -0.00 -0.42 0.00 0.00 0.84 0.00 0.00 57.88 58.30 1zrh h LEU 266 Cb 1.07 -0.22 0.00 0.00 0.37 0.00 0.00 40.66 41.88 1zrh h LEU 266 CO 0.09 1.17 -0.49 1.33 -0.34 0.00 0.00 178.44 180.21 1zrh n VAL 267 N -3.96 0.00 -1.52 1.05 0.24 -0.49 -4.99 118.33 108.67 1zrh n VAL 267 Ca -0.04 -0.26 -0.08 0.00 -2.04 0.00 0.00 64.34 61.92 1zrh n VAL 267 Cb 0.64 1.23 -0.03 0.00 -1.47 0.00 0.00 33.84 34.21 1zrh n VAL 267 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1zrh n GLY 268 N 1.37 0.73 3.57 7.63 0.00 -0.49 -5.03 105.19 112.98 1zrh n GLY 268 Ca 0.08 -0.62 -0.10 0.00 0.00 0.00 0.00 46.02 45.39 1zrh n GLY 268 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1zrh s ARG 269 N -3.22 1.44 0.32 1.61 1.70 -1.10 -5.06 118.95 114.65 1zrh s ARG 269 Ca 0.00 -0.83 0.09 0.00 -0.47 0.00 0.00 55.73 54.52 1zrh s ARG 269 Cb 0.00 0.55 -0.05 0.00 -0.57 0.00 0.00 34.95 34.88 1zrh s ARG 269 CO 0.00 -0.63 0.06 0.95 -1.08 0.00 0.00 175.30 174.61 1zrh s THR 270 N -3.86 2.98 0.07 4.99 -4.23 -1.26 -4.34 115.64 109.98 1zrh s THR 270 Ca 0.08 -1.84 0.05 0.00 -1.18 0.00 0.00 61.69 58.80 1zrh s THR 270 Cb -0.02 -2.88 -0.03 0.00 1.34 0.00 0.00 72.50 70.91 1zrh s THR 270 CO -0.03 -0.23 -0.13 -0.36 -0.54 0.00 0.00 174.62 173.33 1zrh s PHE 271 N -2.44 1.16 -1.25 3.99 0.08 -1.26 -5.07 117.98 113.18 1zrh s PHE 271 Ca 0.35 -0.45 -0.15 0.00 0.12 0.00 0.00 56.93 56.80 1zrh s PHE 271 Cb -0.03 -0.66 0.13 0.00 -0.57 0.00 0.00 43.02 41.90 1zrh s PHE 271 CO 0.21 0.04 1.59 -3.47 -0.10 0.00 0.00 175.22 173.49 1zrh n ASP 272 N 1.35 5.08 -4.78 1.36 2.03 -1.26 -4.97 116.55 115.36 1zrh n ASP 272 Ca -0.21 -2.96 -0.22 0.00 0.52 0.00 0.00 54.79 51.92 1zrh n ASP 272 Cb 0.54 -1.64 -0.05 0.00 -0.72 0.00 0.00 41.12 39.25 1zrh n ASP 272 CO 0.00 0.00 0.00 0.26 -1.92 0.00 0.00 177.20 175.54 1zrh s TRP 273 N 2.61 2.83 -1.77 -0.67 0.51 -1.26 -4.99 118.94 116.20 1zrh s TRP 273 Ca 0.47 -0.31 0.00 0.00 -2.12 0.00 0.00 56.10 54.14 1zrh s TRP 273 Cb 0.01 -1.65 0.00 0.00 -0.81 0.00 0.00 33.47 31.02 1zrh s TRP 273 CO 0.03 0.31 0.44 0.72 -0.51 0.00 0.00 176.95 177.95