#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ivr n SER 2 N 0.00 1.57 -0.19 -3.46 7.64 -1.26 -5.04 113.62 112.88 1ivr n SER 2 Ca 0.00 -2.15 -0.08 0.00 1.01 0.00 0.00 58.87 57.65 1ivr n SER 2 Cb 0.00 -0.33 0.02 0.00 -1.01 0.00 0.00 64.21 62.89 1ivr n SER 2 CO 0.00 0.00 0.00 -0.50 -3.01 0.00 0.00 175.04 171.53 1ivr h TRP 3 N 0.04 0.80 -0.72 1.43 -0.00 -2.07 -3.23 115.95 112.20 1ivr h TRP 3 Ca -0.21 -0.05 -0.31 0.00 -0.00 0.00 0.00 58.89 58.33 1ivr h TRP 3 Cb 0.95 -0.24 -0.18 0.00 -0.00 0.00 0.00 29.16 29.68 1ivr h TRP 3 CO 0.00 0.64 0.32 0.91 -0.00 0.00 0.00 178.44 180.31 1ivr n TRP 4 N -4.55 2.30 0.12 0.49 7.02 -1.26 -4.69 117.44 116.86 1ivr n TRP 4 Ca 0.03 -1.50 -0.03 0.00 -1.02 0.00 0.00 57.50 54.97 1ivr n TRP 4 Cb 0.14 -0.72 0.16 0.00 -2.42 0.00 0.00 31.31 28.46 1ivr n TRP 4 CO 0.00 0.00 0.00 0.66 -2.02 0.00 0.00 177.69 176.33 1ivr h SER 5 N 1.64 0.12 1.25 -0.99 4.64 -1.96 -3.10 113.55 115.16 1ivr h SER 5 Ca 0.38 -0.07 0.00 0.00 -0.47 0.00 0.00 61.79 61.63 1ivr h SER 5 Cb 2.34 -0.04 0.00 0.00 -0.31 0.00 0.00 62.40 64.39 1ivr h SER 5 CO 0.77 0.69 0.00 1.12 -0.87 0.00 0.00 176.83 178.54 1ivr h HIS 6 N 0.08 0.00 -3.09 4.77 2.07 -1.87 -3.44 115.15 113.68 1ivr h HIS 6 Ca -0.01 0.00 -0.57 0.00 -2.85 0.00 0.00 60.37 56.95 1ivr h HIS 6 Cb 1.08 0.00 -0.04 0.00 2.57 0.00 0.00 27.41 31.02 1ivr h HIS 6 CO 0.01 0.00 1.07 0.08 -3.07 0.00 0.00 177.93 176.02 1ivr s VAL 7 N -3.30 3.89 0.51 6.12 1.01 -1.17 -5.00 120.40 122.46 1ivr s VAL 7 Ca 0.06 0.95 -0.03 0.00 0.00 0.00 0.00 61.98 62.96 1ivr s VAL 7 Cb 0.09 -4.04 -0.00 0.00 0.00 0.00 0.00 36.38 32.43 1ivr s VAL 7 CO 0.54 -0.56 0.78 -1.61 0.00 0.00 0.00 175.10 174.25 1ivr s GLU 8 N 4.75 3.04 -0.26 2.72 2.02 -1.26 -5.03 118.70 124.68 1ivr s GLU 8 Ca 0.64 -0.22 -0.29 0.00 0.02 0.00 0.00 54.97 55.11 1ivr s GLU 8 Cb -0.17 -2.42 -0.01 0.00 0.10 0.00 0.00 34.13 31.63 1ivr s GLU 8 CO 0.29 -0.45 1.36 1.41 0.02 0.00 0.00 175.26 177.89 1ivr s MET 9 N -4.76 3.96 0.54 1.61 -2.45 -1.26 -5.03 119.30 111.91 1ivr s MET 9 Ca 0.51 1.41 -0.05 0.00 -1.25 0.00 0.00 55.69 56.31 1ivr s MET 9 Cb -0.10 -3.89 -0.00 0.00 1.25 0.00 0.00 34.83 32.09 1ivr s MET 9 CO 0.42 -1.07 0.83 0.20 1.05 0.00 0.00 175.02 176.45 1ivr s GLY 10 N 2.90 1.57 0.65 2.11 0.00 -1.26 -5.08 107.32 108.22 1ivr s GLY 10 Ca 0.59 -0.72 -0.11 0.00 0.00 0.00 0.00 44.72 44.48 1ivr s GLY 10 CO 0.23 -0.48 1.04 2.56 0.00 0.00 0.00 173.10 176.45 1ivr s PRO 11 N -4.85 3.34 0.55 2.90 0.04 -1.26 -5.05 135.00 130.67 1ivr s PRO 11 Ca 0.51 0.80 -0.18 0.00 0.04 0.00 0.00 61.00 62.17 1ivr s PRO 11 Cb -0.10 -2.05 -0.05 0.00 0.04 0.00 0.00 34.50 32.33 1ivr s PRO 11 CO 0.44 -0.77 1.05 -2.14 0.04 0.00 0.00 177.00 175.62 1ivr s PRO 12 N -5.15 3.49 0.35 0.56 0.02 -1.26 -4.95 135.00 128.06 1ivr s PRO 12 Ca 0.56 1.28 -0.28 0.00 0.02 0.00 0.00 61.00 62.59 1ivr s PRO 12 Cb -0.12 -2.05 -0.12 0.00 0.02 0.00 0.00 34.50 32.23 1ivr s PRO 12 CO 0.54 -0.68 1.28 -3.47 -0.33 0.00 0.00 177.00 174.34 1ivr n ASP 13 N -1.61 2.68 0.02 2.53 2.03 -1.26 -4.76 116.55 116.18 1ivr n ASP 13 Ca 0.09 1.20 0.17 0.00 0.52 0.00 0.00 54.79 56.76 1ivr n ASP 13 Cb 0.53 -1.48 0.64 0.00 -0.72 0.00 0.00 41.12 40.08 1ivr n ASP 13 CO 0.00 0.00 0.00 -0.65 -1.92 0.00 0.00 177.20 174.63 1ivr h PRO 14 N 2.47 0.10 0.00 -0.67 0.11 -1.95 -1.35 132.00 130.71 1ivr h PRO 14 Ca -0.46 -0.01 -0.06 0.00 0.11 0.00 0.00 66.00 65.59 1ivr h PRO 14 Cb 1.29 -0.02 -0.01 0.00 0.11 0.00 0.00 31.00 32.37 1ivr h PRO 14 CO 0.62 0.06 -0.82 -0.89 -0.21 0.00 0.00 178.00 176.77 1ivr n ILE 15 N -4.43 1.23 -0.27 4.15 5.41 -1.26 -4.59 119.36 119.60 1ivr n ILE 15 Ca 0.08 0.16 -0.02 0.00 1.00 0.00 0.00 62.75 63.97 1ivr n ILE 15 Cb 0.48 -1.91 0.10 0.00 -0.71 0.00 0.00 39.64 37.60 1ivr n ILE 15 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 176.55 176.48 1ivr h LEU 16 N -0.51 0.77 -2.52 1.39 4.07 -1.97 -0.52 115.31 116.02 1ivr h LEU 16 Ca -0.09 0.01 0.01 0.00 0.08 0.00 0.00 57.88 57.89 1ivr h LEU 16 Cb 0.70 -0.16 -0.00 0.00 1.08 0.00 0.00 40.66 42.28 1ivr h LEU 16 CO -0.05 0.52 0.04 1.23 -1.08 0.00 0.00 178.44 179.10 1ivr h GLY 17 N 0.91 0.00 2.00 0.83 0.00 -1.51 -0.99 103.07 104.30 1ivr h GLY 17 Ca 0.32 0.00 -0.14 0.00 0.00 0.00 0.00 47.33 47.50 1ivr h GLY 17 CO -0.13 0.00 -0.67 -2.08 0.00 0.00 0.00 176.54 173.66 1ivr h VAL 18 N 0.00 1.43 0.00 4.60 2.07 -1.21 -2.71 116.25 120.44 1ivr h VAL 18 Ca 0.01 -2.34 -0.11 0.00 0.82 0.00 0.00 66.70 65.09 1ivr h VAL 18 Cb 0.10 2.28 -0.02 0.00 -1.52 0.00 0.00 31.29 32.13 1ivr h VAL 18 CO -0.00 0.66 -0.51 0.74 0.02 0.00 0.00 177.57 178.47 1ivr h THR 19 N 0.00 0.97 -0.18 2.57 2.02 -1.26 -1.66 112.91 115.36 1ivr h THR 19 Ca -0.01 -2.10 -0.04 0.00 0.77 0.00 0.00 66.41 65.03 1ivr h THR 19 Cb 1.22 2.29 -0.01 0.00 -1.74 0.00 0.00 68.15 69.92 1ivr h THR 19 CO 0.09 0.50 -0.06 -0.33 0.37 0.00 0.00 175.52 176.09 1ivr h GLU 20 N 0.00 0.36 -0.28 6.66 5.08 -1.38 -1.81 114.58 123.21 1ivr h GLU 20 Ca -0.01 -0.15 -0.14 0.00 -1.00 0.00 0.00 59.36 58.07 1ivr h GLU 20 Cb 1.25 -0.02 -0.01 0.00 0.50 0.00 0.00 28.75 30.47 1ivr h GLU 20 CO 0.07 0.64 -0.41 0.00 -1.00 0.00 0.00 179.01 178.30 1ivr h ALA 21 N 0.72 0.76 -0.70 3.43 0.00 -1.51 -2.66 119.26 119.29 1ivr h ALA 21 Ca 0.05 -0.45 0.09 0.00 0.00 0.00 0.00 54.91 54.59 1ivr h ALA 21 Cb 0.51 -0.11 -0.07 0.00 0.00 0.00 0.00 17.79 18.12 1ivr h ALA 21 CO 0.02 0.66 0.35 0.35 0.00 0.00 0.00 179.25 180.63 1ivr h PHE 22 N 0.55 0.62 -0.19 0.00 3.57 -1.24 -2.76 116.94 117.48 1ivr h PHE 22 Ca 0.04 0.03 0.04 0.00 3.53 0.00 0.00 57.97 61.61 1ivr h PHE 22 Cb 0.94 -0.17 -0.04 0.00 2.79 0.00 0.00 35.95 39.47 1ivr h PHE 22 CO 0.04 0.23 -0.07 0.87 -2.23 0.00 0.00 178.31 177.15 1ivr h LYS 23 N 0.60 -0.04 0.00 1.11 1.79 -0.96 -2.21 116.57 116.86 1ivr h LYS 23 Ca 0.34 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.81 1ivr h LYS 23 Cb 0.35 0.01 0.00 0.00 -1.58 0.00 0.00 32.23 31.01 1ivr h LYS 23 CO -0.26 -0.02 0.00 0.54 -1.08 0.00 0.00 179.45 178.63 1ivr n ARG 24 N -5.22 0.12 -2.36 3.15 1.74 -1.05 -4.80 116.66 108.24 1ivr n ARG 24 Ca -0.02 0.47 -0.41 0.00 -0.77 0.00 0.00 57.85 57.12 1ivr n ARG 24 Cb 0.15 -1.79 -0.04 0.00 -1.02 0.00 0.00 32.46 29.76 1ivr n ARG 24 CO 0.00 0.00 0.00 0.34 -1.52 0.00 0.00 177.63 176.45 1ivr s ASP 25 N -3.83 7.11 0.00 0.55 -1.08 -0.84 -4.97 116.67 113.61 1ivr s ASP 25 Ca 0.02 2.35 0.25 0.00 -0.52 0.00 0.00 52.55 54.66 1ivr s ASP 25 Cb 0.07 -2.63 0.48 0.00 -1.46 0.00 0.00 42.92 39.39 1ivr s ASP 25 CO 0.27 -0.30 1.40 0.35 0.52 0.00 0.00 175.17 177.41 1ivr n THR 26 N 1.49 0.00 -1.73 1.71 -2.24 -1.26 -4.97 114.28 107.28 1ivr n THR 26 Ca 0.01 -0.21 -0.42 0.00 -2.27 0.00 0.00 64.05 61.15 1ivr n THR 26 Cb 0.44 0.78 -0.03 0.00 -2.10 0.00 0.00 70.33 69.42 1ivr n THR 26 CO 0.00 0.00 0.00 0.21 -0.57 0.00 0.00 175.07 174.71 1ivr s ASN 27 N -2.41 6.46 0.00 3.42 3.84 -1.26 -4.89 114.94 120.11 1ivr s ASN 27 Ca 0.24 2.66 0.20 0.00 0.21 0.00 0.00 52.86 56.17 1ivr s ASN 27 Cb 0.19 -2.55 0.93 0.00 -0.55 0.00 0.00 41.25 39.27 1ivr s ASN 27 CO 0.50 -1.01 1.64 -1.54 -2.79 0.00 0.00 177.10 173.90 1ivr n SER 28 N 6.63 0.00 -1.06 -4.21 3.41 -1.26 -2.41 113.62 114.72 1ivr n SER 28 Ca 0.19 0.28 0.12 0.00 -0.26 0.00 0.00 58.87 59.19 1ivr n SER 28 Cb 0.40 -0.41 0.22 0.00 -0.26 0.00 0.00 64.21 64.16 1ivr n SER 28 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 1ivr n LYS 29 N -1.41 2.40 -2.05 4.33 5.02 -1.26 -5.02 118.16 120.17 1ivr n LYS 29 Ca 0.07 -2.11 -0.38 0.00 -2.02 0.00 0.00 58.31 53.88 1ivr n LYS 29 Cb 0.20 -1.50 0.01 0.00 -0.02 0.00 0.00 35.03 33.73 1ivr n LYS 29 CO 0.00 0.00 0.00 -1.59 -0.52 0.00 0.00 177.40 175.29 1ivr s LYS 30 N -1.60 3.46 -0.07 1.97 -2.85 -1.01 -4.87 119.74 114.78 1ivr s LYS 30 Ca 0.37 1.97 0.03 0.00 -1.00 0.00 0.00 55.97 57.34 1ivr s LYS 30 Cb 0.22 -2.32 0.01 0.00 -2.06 0.00 0.00 37.83 33.67 1ivr s LYS 30 CO 0.31 -0.85 -0.16 -1.64 0.10 0.00 0.00 175.35 173.11 1ivr s MET 31 N -2.82 2.01 -0.61 1.78 -1.94 -0.10 -5.01 119.30 112.62 1ivr s MET 31 Ca 0.68 -0.56 -0.09 0.00 -1.71 0.00 0.00 55.69 54.01 1ivr s MET 31 Cb -0.34 -1.63 0.16 0.00 2.01 0.00 0.00 34.83 35.03 1ivr s MET 31 CO 0.40 0.11 0.48 1.21 -0.01 0.00 0.00 175.02 177.22 1ivr s ASN 32 N 0.44 5.85 -0.10 3.03 3.04 -1.26 -2.64 114.94 123.30 1ivr s ASN 32 Ca -0.13 -2.38 0.15 0.00 0.04 0.00 0.00 52.86 50.55 1ivr s ASN 32 Cb -0.15 -2.02 0.62 0.00 -1.54 0.00 0.00 41.25 38.15 1ivr s ASN 32 CO 0.05 -0.58 1.50 0.18 -3.04 0.00 0.00 177.10 175.21 1ivr n LEU 33 N 4.27 4.16 0.00 3.21 4.77 -0.09 -4.71 117.00 128.61 1ivr n LEU 33 Ca 0.02 -2.10 0.00 0.00 -0.03 0.00 0.00 56.01 53.90 1ivr n LEU 33 Cb 0.41 -0.54 0.00 0.00 -2.33 0.00 0.00 43.42 40.96 1ivr n LEU 33 CO 0.38 0.69 0.00 0.61 -1.33 0.00 0.00 177.39 177.74 1ivr n GLY 34 N 0.99 -0.28 3.76 -0.72 0.00 -1.09 0.09 105.19 107.94 1ivr n GLY 34 Ca 0.22 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.90 1ivr n GLY 34 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1ivr s VAL 35 N -0.66 2.98 -0.60 1.61 0.11 -1.26 -4.64 120.40 117.94 1ivr s VAL 35 Ca 0.00 0.51 -0.21 0.00 -2.93 0.00 0.00 61.98 59.35 1ivr s VAL 35 Cb 0.00 -3.07 -0.18 0.00 -1.53 0.00 0.00 36.38 31.59 1ivr s VAL 35 CO 0.00 -0.23 1.84 0.61 -3.33 0.00 0.00 175.10 173.99 1ivr n GLY 36 N -0.08 2.19 3.14 6.54 0.00 -1.26 -4.83 105.19 110.89 1ivr n GLY 36 Ca 0.12 -1.11 -0.27 0.00 0.00 0.00 0.00 46.02 44.76 1ivr n GLY 36 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ivr s ALA 37 N 5.21 1.63 0.10 4.61 0.00 -1.26 -4.96 121.76 127.09 1ivr s ALA 37 Ca 0.55 -0.71 -0.30 0.00 0.00 0.00 0.00 51.96 51.50 1ivr s ALA 37 Cb 0.13 -0.58 -0.06 0.00 0.00 0.00 0.00 23.12 22.62 1ivr s ALA 37 CO 0.14 0.26 1.08 -0.47 0.00 0.00 0.00 175.76 176.77 1ivr s TYR 38 N 0.20 3.59 0.13 0.00 5.04 -1.26 -3.86 117.35 121.19 1ivr s TYR 38 Ca -0.08 1.56 0.11 0.00 -2.44 0.00 0.00 57.07 56.21 1ivr s TYR 38 Cb -0.14 -3.25 -0.04 0.00 0.35 0.00 0.00 41.96 38.88 1ivr s TYR 38 CO 0.04 -0.56 -0.26 1.03 -1.34 0.00 0.00 175.55 174.46 1ivr s ARG 39 N 0.40 1.45 0.22 4.97 1.81 -1.16 -3.66 118.95 122.98 1ivr s ARG 39 Ca 0.52 -1.34 -0.04 0.00 -1.72 0.00 0.00 55.73 53.16 1ivr s ARG 39 Cb -0.27 -1.92 0.05 0.00 -0.45 0.00 0.00 34.95 32.36 1ivr s ARG 39 CO 0.31 0.45 0.27 -0.40 -0.68 0.00 0.00 175.30 175.25 1ivr n ASP 40 N 0.87 -0.39 -0.77 0.23 5.75 0.49 -4.77 116.55 117.96 1ivr n ASP 40 Ca -0.17 -0.95 0.00 0.00 -0.01 0.00 0.00 54.79 53.65 1ivr n ASP 40 Cb 0.53 -0.21 0.00 0.00 -1.03 0.00 0.00 41.12 40.41 1ivr n ASP 40 CO 0.00 0.00 0.00 -0.67 -0.11 0.00 0.00 177.20 176.42 1ivr n ASP 41 N -3.25 1.84 0.00 -1.12 2.03 -1.26 -1.16 116.55 113.63 1ivr n ASP 41 Ca 0.03 -1.76 0.00 0.00 0.52 0.00 0.00 54.79 53.58 1ivr n ASP 41 Cb 0.12 -0.44 0.00 0.00 -0.72 0.00 0.00 41.12 40.08 1ivr n ASP 41 CO 0.00 0.00 0.00 0.59 -1.92 0.00 0.00 177.20 175.87 1ivr n ASN 42 N 0.33 0.34 -3.11 1.67 3.02 -1.26 -4.03 115.26 112.22 1ivr n ASN 42 Ca 0.00 -0.93 -0.14 0.00 -0.03 0.00 0.00 54.58 53.48 1ivr n ASN 42 Cb 0.34 0.03 0.07 0.00 -0.61 0.00 0.00 39.78 39.61 1ivr n ASN 42 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1ivr n GLY 43 N 0.03 -0.94 3.15 7.41 0.00 -0.31 -5.02 105.19 109.52 1ivr n GLY 43 Ca 0.00 0.48 -0.21 0.00 0.00 0.00 0.00 46.02 46.29 1ivr n GLY 43 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1ivr s LYS 44 N -4.35 0.98 0.26 1.61 2.47 -1.26 -4.83 119.74 114.63 1ivr s LYS 44 Ca 0.39 -0.75 -0.31 0.00 -1.56 0.00 0.00 55.97 53.74 1ivr s LYS 44 Cb -0.05 -0.99 -0.13 0.00 -1.46 0.00 0.00 37.83 35.20 1ivr s LYS 44 CO 0.68 0.25 1.51 -2.30 0.16 0.00 0.00 175.35 175.65 1ivr n PRO 45 N 1.96 2.38 -4.02 4.03 -0.02 -1.26 0.18 135.00 138.25 1ivr n PRO 45 Ca -0.18 0.85 -0.34 0.00 -2.02 0.00 0.00 63.50 61.82 1ivr n PRO 45 Cb 0.55 -2.57 -0.15 0.00 -0.02 0.00 0.00 33.50 31.30 1ivr n PRO 45 CO 0.00 0.00 0.00 -0.47 1.98 0.00 0.00 175.50 177.01 1ivr s TYR 46 N 0.04 3.02 -0.41 6.00 5.04 -1.24 -4.75 117.35 125.04 1ivr s TYR 46 Ca 0.67 -1.68 -0.14 0.00 -2.44 0.00 0.00 57.07 53.48 1ivr s TYR 46 Cb -0.57 -2.00 0.03 0.00 0.35 0.00 0.00 41.96 39.77 1ivr s TYR 46 CO 0.48 -0.77 0.29 0.08 -1.34 0.00 0.00 175.55 174.29 1ivr s VAL 47 N 1.28 5.01 0.46 3.14 1.01 -1.26 -4.87 120.40 125.17 1ivr s VAL 47 Ca 0.00 -0.82 -0.25 0.00 0.00 0.00 0.00 61.98 60.91 1ivr s VAL 47 Cb -0.16 -3.84 -0.09 0.00 0.00 0.00 0.00 36.38 32.29 1ivr s VAL 47 CO -0.07 -0.35 1.30 0.18 0.00 0.00 0.00 175.10 176.17 1ivr n LEU 48 N 5.11 4.47 -0.21 3.92 4.32 -1.26 -4.79 117.00 128.55 1ivr n LEU 48 Ca -0.11 1.08 0.01 0.00 -0.02 0.00 0.00 56.01 56.96 1ivr n LEU 48 Cb 0.46 -1.53 0.12 0.00 -1.62 0.00 0.00 43.42 40.85 1ivr n LEU 48 CO 0.41 -0.59 0.96 0.78 -1.22 0.00 0.00 177.39 177.72 1ivr h ASN 49 N 1.96 0.12 0.83 -1.43 2.35 -1.98 0.67 115.58 118.10 1ivr h ASN 49 Ca -0.49 0.10 -0.02 0.00 -0.55 0.00 0.00 56.30 55.34 1ivr h ASN 49 Cb 1.29 0.11 -0.00 0.00 0.05 0.00 0.00 38.32 39.77 1ivr h ASN 49 CO 0.59 0.07 -0.08 0.00 -1.65 0.00 0.00 177.43 176.36 1ivr h VAL 51 N 0.00 1.40 -0.79 0.00 2.07 -0.07 -1.80 116.25 117.07 1ivr h VAL 51 Ca -0.00 -1.28 0.12 0.00 0.82 0.00 0.00 66.70 66.36 1ivr h VAL 51 Cb 0.52 2.27 -0.09 0.00 -1.52 0.00 0.00 31.29 32.47 1ivr h VAL 51 CO 0.01 0.33 0.39 0.03 0.02 0.00 0.00 177.57 178.35 1ivr h ARG 52 N -0.57 0.59 -0.01 1.57 2.47 -0.95 -1.32 114.38 116.16 1ivr h ARG 52 Ca -0.00 -0.04 -0.17 0.00 -1.26 0.00 0.00 59.98 58.52 1ivr h ARG 52 Cb 0.55 -0.13 -0.02 0.00 -1.65 0.00 0.00 29.97 28.72 1ivr h ARG 52 CO 0.00 0.39 -0.76 0.87 0.56 0.00 0.00 179.97 181.03 1ivr h LYS 53 N 0.61 0.08 -0.18 0.04 1.57 -1.46 -3.17 116.57 114.05 1ivr h LYS 53 Ca 0.41 -0.07 -0.11 0.00 -1.87 0.00 0.00 60.65 59.01 1ivr h LYS 53 Cb 0.53 0.02 -0.01 0.00 0.08 0.00 0.00 32.23 32.85 1ivr h LYS 53 CO -0.33 0.80 -0.36 0.00 -0.57 0.00 0.00 179.45 179.00 1ivr h ALA 54 N 1.18 1.06 -0.66 3.86 0.00 -0.54 -2.99 119.26 121.16 1ivr h ALA 54 Ca -0.02 -0.39 -0.07 0.00 0.00 0.00 0.00 54.91 54.44 1ivr h ALA 54 Cb 1.34 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 19.00 1ivr h ALA 54 CO 0.11 0.59 0.16 0.93 0.00 0.00 0.00 179.25 181.03 1ivr h GLU 55 N 0.32 1.07 -0.22 0.00 5.08 -1.29 -2.95 114.58 116.60 1ivr h GLU 55 Ca 0.04 -0.26 -0.06 0.00 -1.00 0.00 0.00 59.36 58.07 1ivr h GLU 55 Cb 0.78 -0.14 -0.01 0.00 0.50 0.00 0.00 28.75 29.88 1ivr h GLU 55 CO 0.06 0.96 -0.14 0.00 -1.00 0.00 0.00 179.01 178.89 1ivr h ALA 56 N 1.06 1.36 0.01 3.43 0.00 -1.52 -1.66 119.26 121.95 1ivr h ALA 56 Ca 0.21 -0.25 -0.20 0.00 0.00 0.00 0.00 54.91 54.67 1ivr h ALA 56 Cb 0.37 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.03 1ivr h ALA 56 CO 0.00 0.43 -0.95 0.52 0.00 0.00 0.00 179.25 179.26 1ivr h MET 57 N 0.33 0.05 -0.32 0.00 2.86 -1.37 -1.37 114.93 115.11 1ivr h MET 57 Ca 0.06 -0.07 -0.13 0.00 -2.06 0.00 0.00 59.70 57.50 1ivr h MET 57 Cb 0.45 0.02 -0.01 0.00 0.06 0.00 0.00 31.60 32.13 1ivr h MET 57 CO 0.03 0.96 -0.34 0.82 1.06 0.00 0.00 176.91 179.43 1ivr h ILE 58 N 0.02 1.28 0.50 -1.22 2.04 -1.42 -1.02 117.51 117.69 1ivr h ILE 58 Ca -0.03 -1.49 -0.02 0.00 1.00 0.00 0.00 64.86 64.32 1ivr h ILE 58 Cb 1.65 1.40 0.00 0.00 -0.74 0.00 0.00 36.82 39.13 1ivr h ILE 58 CO 0.13 0.48 -0.24 0.00 0.00 0.00 0.00 178.15 178.52 1ivr h ALA 59 N 1.02 -0.67 -0.53 1.87 0.00 -1.30 -2.67 119.26 116.97 1ivr h ALA 59 Ca 0.06 -0.19 -0.03 0.00 0.00 0.00 0.00 54.91 54.75 1ivr h ALA 59 Cb 0.86 0.26 -0.03 0.00 0.00 0.00 0.00 17.79 18.89 1ivr h ALA 59 CO 0.08 -0.77 0.20 0.00 0.00 0.00 0.00 179.25 178.75 1ivr h ALA 60 N -0.52 1.35 0.00 0.00 0.00 -1.28 -0.89 119.26 117.92 1ivr h ALA 60 Ca -0.07 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 54.69 1ivr h ALA 60 Cb 0.60 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 18.17 1ivr h ALA 60 CO 0.11 0.48 0.00 -0.22 0.00 0.00 0.00 179.25 179.63 1ivr h LYS 61 N 0.76 0.00 -5.50 0.00 3.64 -1.08 -3.47 116.57 110.91 1ivr h LYS 61 Ca 0.18 0.00 -0.27 0.00 -1.27 0.00 0.00 60.65 59.29 1ivr h LYS 61 Cb 0.18 0.00 0.19 0.00 -0.41 0.00 0.00 32.23 32.19 1ivr h LYS 61 CO -0.01 0.00 -0.83 1.63 -2.27 0.00 0.00 179.45 177.96 1ivr n LYS 62 N -3.00 -3.50 -2.30 1.90 4.76 -0.34 -4.95 118.16 110.74 1ivr n LYS 62 Ca 0.00 0.86 -0.33 0.00 -2.87 0.00 0.00 58.31 55.98 1ivr n LYS 62 Cb 0.28 -5.84 -0.02 0.00 -1.84 0.00 0.00 35.03 27.61 1ivr n LYS 62 CO 0.00 0.00 0.00 -1.64 -1.37 0.00 0.00 177.40 174.39 1ivr s MET 63 N -4.66 3.71 0.99 1.97 -1.94 -1.08 -5.06 119.30 113.23 1ivr s MET 63 Ca 0.33 1.09 -0.17 0.00 -1.71 0.00 0.00 55.69 55.23 1ivr s MET 63 Cb -0.04 -2.10 0.24 0.00 2.01 0.00 0.00 34.83 34.95 1ivr s MET 63 CO 0.74 -0.47 0.95 -0.40 -0.01 0.00 0.00 175.02 175.82 1ivr n ASP 64 N -1.64 -1.56 -1.02 3.03 5.68 -1.26 -4.99 116.55 114.78 1ivr n ASP 64 Ca 0.08 -1.12 0.04 0.00 -0.50 0.00 0.00 54.79 53.29 1ivr n ASP 64 Cb 0.53 -0.84 0.07 0.00 -1.14 0.00 0.00 41.12 39.74 1ivr n ASP 64 CO 0.00 0.00 0.00 0.29 -1.33 0.00 0.00 177.20 176.16 1ivr n LYS 65 N -4.13 0.45 -2.12 0.11 5.02 -1.26 -5.09 118.16 111.13 1ivr n LYS 65 Ca 0.13 -2.15 -0.37 0.00 -2.02 0.00 0.00 58.31 53.90 1ivr n LYS 65 Cb 0.49 -0.56 0.01 0.00 -0.02 0.00 0.00 35.03 34.95 1ivr n LYS 65 CO 0.00 0.00 0.00 -1.21 -0.52 0.00 0.00 177.40 175.67 1ivr s GLU 66 N -0.93 3.48 0.31 1.97 0.41 -1.26 -4.93 118.70 117.76 1ivr s GLU 66 Ca 0.29 1.87 -0.26 0.00 -0.41 0.00 0.00 54.97 56.46 1ivr s GLU 66 Cb 0.31 -2.27 -0.15 0.00 -1.78 0.00 0.00 34.13 30.24 1ivr s GLU 66 CO -0.10 -0.80 0.62 0.66 -0.49 0.00 0.00 175.26 175.15 1ivr n TYR 67 N -0.82 -0.15 -3.48 1.61 4.01 -1.26 -5.00 117.16 112.06 1ivr n TYR 67 Ca 0.09 0.75 -0.27 0.00 -0.16 0.00 0.00 57.90 58.31 1ivr n TYR 67 Cb 0.48 -2.03 -0.03 0.00 -0.31 0.00 0.00 39.34 37.45 1ivr n TYR 67 CO 0.00 0.00 0.00 -1.17 -0.46 0.00 0.00 176.86 175.23 1ivr s LEU 68 N 2.04 4.11 1.01 7.72 2.96 -1.26 -5.06 118.68 130.20 1ivr s LEU 68 Ca 0.62 0.56 -0.13 0.00 -0.22 0.00 0.00 54.13 54.96 1ivr s LEU 68 Cb -0.74 -3.36 0.14 0.00 0.50 0.00 0.00 46.19 42.72 1ivr s LEU 68 CO 0.58 -0.15 0.74 -2.65 -1.32 0.00 0.00 176.35 173.55 1ivr n PRO 69 N -0.96 -0.95 0.18 0.98 -0.02 -1.26 -4.77 135.00 128.21 1ivr n PRO 69 Ca -0.03 -0.23 0.06 0.00 -2.02 0.00 0.00 63.50 61.28 1ivr n PRO 69 Cb 0.54 -2.09 0.53 0.00 -0.02 0.00 0.00 33.50 32.47 1ivr n PRO 69 CO 0.00 0.00 0.00 0.82 1.98 0.00 0.00 175.50 178.30 1ivr h ILE 70 N -1.97 1.07 -0.01 4.25 2.04 -1.97 -1.04 117.51 119.88 1ivr h ILE 70 Ca -0.48 -0.28 0.00 0.00 1.00 0.00 0.00 64.86 65.10 1ivr h ILE 70 Cb 1.30 1.00 0.00 0.00 -0.74 0.00 0.00 36.82 38.38 1ivr h ILE 70 CO 0.40 0.09 -0.14 0.00 0.00 0.00 0.00 178.15 178.51 1ivr n ALA 71 N -2.51 2.84 0.00 1.87 0.00 -1.26 -4.57 120.51 116.88 1ivr n ALA 71 Ca -0.01 -0.40 0.00 0.00 0.00 0.00 0.00 53.44 53.03 1ivr n ALA 71 Cb 0.14 -1.18 0.00 0.00 0.00 0.00 0.00 19.45 18.41 1ivr n ALA 71 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ivr n GLY 72 N 1.26 -1.08 3.66 0.00 0.00 -0.39 0.42 105.19 109.05 1ivr n GLY 72 Ca 0.15 -2.21 -0.43 0.00 0.00 0.00 0.00 46.02 43.54 1ivr n GLY 72 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1ivr s LEU 73 N 0.00 4.25 0.39 0.99 2.96 -1.26 -4.26 118.68 121.75 1ivr s LEU 73 Ca 0.00 1.92 0.15 0.00 -0.22 0.00 0.00 54.13 55.98 1ivr s LEU 73 Cb 0.00 -3.54 1.01 0.00 0.50 0.00 0.00 46.19 44.16 1ivr s LEU 73 CO 0.00 -0.80 1.82 0.00 -1.32 0.00 0.00 176.35 176.05 1ivr h ALA 74 N 8.54 2.10 0.00 5.97 0.00 -1.99 0.12 119.26 134.01 1ivr h ALA 74 Ca -0.32 0.04 -0.13 0.00 0.00 0.00 0.00 54.91 54.50 1ivr h ALA 74 Cb 1.14 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 18.88 1ivr h ALA 74 CO 0.95 -0.43 -0.62 -0.44 0.00 0.00 0.00 179.25 178.72 1ivr h ASP 75 N 0.48 0.00 0.19 0.00 5.19 -1.97 0.14 116.42 120.46 1ivr h ASP 75 Ca 0.52 0.00 -0.29 0.00 -0.62 0.00 0.00 57.03 56.64 1ivr h ASP 75 Cb 1.18 0.00 0.02 0.00 0.18 0.00 0.00 39.33 40.72 1ivr h ASP 75 CO -0.24 0.62 -1.33 0.15 -3.12 0.00 0.00 179.24 175.32 1ivr h PHE 76 N 0.00 0.74 -0.14 4.55 3.04 -1.41 -0.62 116.94 123.10 1ivr h PHE 76 Ca -0.01 -0.54 0.05 0.00 3.98 0.00 0.00 57.97 61.45 1ivr h PHE 76 Cb 1.13 -0.03 -0.05 0.00 2.56 0.00 0.00 35.95 39.56 1ivr h PHE 76 CO 0.00 1.51 -0.20 1.15 -2.02 0.00 0.00 178.31 178.75 1ivr h THR 77 N -0.07 0.49 -0.50 4.41 2.02 -0.38 -2.15 112.91 116.72 1ivr h THR 77 Ca -0.25 0.00 -0.08 0.00 0.77 0.00 0.00 66.41 66.85 1ivr h THR 77 Cb 1.95 0.49 -0.02 0.00 -1.74 0.00 0.00 68.15 68.83 1ivr h THR 77 CO 0.19 0.00 -0.02 -0.09 0.37 0.00 0.00 175.52 175.97 1ivr h ARG 78 N -0.25 0.86 -0.14 6.66 2.43 -0.85 -2.86 114.38 120.23 1ivr h ARG 78 Ca 0.10 -0.25 -0.06 0.00 -0.81 0.00 0.00 59.98 58.96 1ivr h ARG 78 Cb 0.40 -0.09 -0.01 0.00 -0.42 0.00 0.00 29.97 29.85 1ivr h ARG 78 CO -0.29 0.87 -0.19 0.00 -1.51 0.00 0.00 179.97 178.86 1ivr h ALA 79 N 1.18 1.44 0.02 2.80 0.00 -0.47 -2.40 119.26 121.82 1ivr h ALA 79 Ca 0.15 -0.25 -0.17 0.00 0.00 0.00 0.00 54.91 54.64 1ivr h ALA 79 Cb 0.51 -0.08 0.01 0.00 0.00 0.00 0.00 17.79 18.23 1ivr h ALA 79 CO 0.03 0.40 -0.68 0.77 0.00 0.00 0.00 179.25 179.76 1ivr h SER 80 N 0.21 0.56 0.28 0.00 0.02 -1.48 -0.82 113.55 112.31 1ivr h SER 80 Ca 0.04 -0.79 0.00 0.00 -0.84 0.00 0.00 61.79 60.20 1ivr h SER 80 Cb 0.46 -0.17 -0.04 0.00 0.14 0.00 0.00 62.40 62.79 1ivr h SER 80 CO 0.03 1.28 -0.49 0.00 -1.14 0.00 0.00 176.83 176.50 1ivr h ALA 81 N 0.29 -1.00 -0.37 3.77 0.00 -1.43 0.34 119.26 120.87 1ivr h ALA 81 Ca -0.09 -0.14 0.05 0.00 0.00 0.00 0.00 54.91 54.73 1ivr h ALA 81 Cb 1.40 0.78 -0.04 0.00 0.00 0.00 0.00 17.79 19.93 1ivr h ALA 81 CO 0.13 -1.12 0.11 1.49 0.00 0.00 0.00 179.25 179.86 1ivr h GLU 82 N -0.84 0.24 -0.62 0.00 4.81 -1.48 -1.07 114.58 115.62 1ivr h GLU 82 Ca -0.02 -0.01 0.00 0.00 -0.13 0.00 0.00 59.36 59.19 1ivr h GLU 82 Cb 0.79 -0.05 -0.03 0.00 0.63 0.00 0.00 28.75 30.09 1ivr h GLU 82 CO -0.18 0.16 0.39 1.25 -0.73 0.00 0.00 179.01 179.90 1ivr h LEU 83 N 0.25 0.72 0.07 1.64 5.85 -0.62 -0.56 115.31 122.66 1ivr h LEU 83 Ca 0.17 -0.03 -0.00 0.00 0.84 0.00 0.00 57.88 58.86 1ivr h LEU 83 Cb 0.17 -0.18 0.00 0.00 0.37 0.00 0.00 40.66 41.02 1ivr h LEU 83 CO -0.20 0.54 -0.03 0.00 -0.34 0.00 0.00 178.44 178.41 1ivr h ALA 84 N 1.59 -0.09 0.00 1.25 0.00 0.64 -3.39 119.26 119.25 1ivr h ALA 84 Ca 0.22 -0.29 -0.11 0.00 0.00 0.00 0.00 54.91 54.74 1ivr h ALA 84 Cb -0.06 0.04 -0.02 0.00 0.00 0.00 0.00 17.79 17.75 1ivr h ALA 84 CO -0.05 -0.21 -0.51 -0.07 0.00 0.00 0.00 179.25 178.41 1ivr h LEU 85 N -0.77 0.00 0.00 0.00 4.07 -1.20 -3.45 115.31 113.96 1ivr h LEU 85 Ca -0.01 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.95 1ivr h LEU 85 Cb 0.61 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.35 1ivr h LEU 85 CO 0.02 0.51 0.00 0.61 -1.08 0.00 0.00 178.44 178.49 1ivr n GLY 86 N 0.80 -0.66 0.19 0.83 0.00 -0.22 -4.51 105.19 101.61 1ivr n GLY 86 Ca 0.01 -1.44 0.05 0.00 0.00 0.00 0.00 46.02 44.64 1ivr n GLY 86 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 173.32 174.37 1ivr h GLU 87 N 0.00 0.00 0.00 1.61 4.11 -1.97 -3.16 114.58 115.17 1ivr h GLU 87 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.43 1ivr h GLU 87 Cb 0.00 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.25 1ivr h GLU 87 CO 0.00 0.38 0.00 -0.91 0.07 0.00 0.00 179.01 178.55 1ivr h ASN 88 N 0.00 0.00 -1.57 3.06 4.21 -1.97 -3.43 115.58 115.89 1ivr h ASN 88 Ca -0.00 0.00 -0.69 0.00 1.21 0.00 0.00 56.30 56.82 1ivr h ASN 88 Cb 0.80 0.00 0.07 0.00 -1.12 0.00 0.00 38.32 38.08 1ivr h ASN 88 CO 0.05 0.00 0.13 -0.24 -1.29 0.00 0.00 177.43 176.08 1ivr n SER 89 N -2.47 0.70 -0.12 5.81 2.88 -1.20 -4.85 113.62 114.38 1ivr n SER 89 Ca 0.04 1.14 -0.13 0.00 -1.33 0.00 0.00 58.87 58.60 1ivr n SER 89 Cb 0.41 -1.11 -0.03 0.00 -0.75 0.00 0.00 64.21 62.74 1ivr n SER 89 CO 0.00 0.00 0.00 -0.08 -1.23 0.00 0.00 175.04 173.73 1ivr h GLU 90 N 3.07 0.82 -0.11 -1.46 4.22 -1.91 0.24 114.58 119.45 1ivr h GLU 90 Ca -0.43 -0.40 0.03 0.00 0.08 0.00 0.00 59.36 58.64 1ivr h GLU 90 Cb 1.38 -0.00 -0.04 0.00 0.50 0.00 0.00 28.75 30.58 1ivr h GLU 90 CO 0.68 1.03 -0.12 0.00 -2.18 0.00 0.00 179.01 178.42 1ivr h ALA 91 N 0.77 -0.04 0.69 2.92 0.00 -1.95 0.12 119.26 121.76 1ivr h ALA 91 Ca 0.07 0.04 -0.03 0.00 0.00 0.00 0.00 54.91 54.99 1ivr h ALA 91 Cb 0.84 0.24 0.01 0.00 0.00 0.00 0.00 17.79 18.88 1ivr h ALA 91 CO 0.07 -0.58 -0.33 0.35 0.00 0.00 0.00 179.25 178.76 1ivr h PHE 92 N -0.15 -0.86 0.00 0.00 3.57 -1.89 -1.46 116.94 116.15 1ivr h PHE 92 Ca 0.08 -0.02 -0.01 0.00 3.53 0.00 0.00 57.97 61.55 1ivr h PHE 92 Cb 0.27 0.29 -0.00 0.00 2.79 0.00 0.00 35.95 39.29 1ivr h PHE 92 CO -0.23 -0.51 -0.03 0.87 -2.23 0.00 0.00 178.31 176.18 1ivr h LYS 93 N -1.14 0.00 0.00 1.11 6.56 -0.42 0.01 116.57 122.69 1ivr h LYS 93 Ca -0.10 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.49 1ivr h LYS 93 Cb 0.74 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 32.40 1ivr h LYS 93 CO 0.16 0.03 -0.71 -1.13 -2.06 0.00 0.00 179.45 175.74 1ivr n SER 94 N -3.47 0.61 -0.32 0.86 3.41 0.39 -4.96 113.62 110.15 1ivr n SER 94 Ca -0.02 -0.24 -0.04 0.00 -0.26 0.00 0.00 58.87 58.30 1ivr n SER 94 Cb 0.14 0.45 -0.02 0.00 -0.26 0.00 0.00 64.21 64.52 1ivr n SER 94 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1ivr n GLY 95 N 1.44 0.64 1.60 5.00 0.00 -0.01 -4.56 105.19 109.29 1ivr n GLY 95 Ca 0.04 -0.26 -0.01 0.00 0.00 0.00 0.00 46.02 45.78 1ivr n GLY 95 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1ivr n ARG 96 N -1.85 1.04 -4.24 1.61 1.74 -1.00 -4.40 116.66 109.56 1ivr n ARG 96 Ca -0.04 -0.12 -0.15 0.00 -0.77 0.00 0.00 57.85 56.78 1ivr n ARG 96 Cb 0.27 -1.15 -0.10 0.00 -1.02 0.00 0.00 32.46 30.45 1ivr n ARG 96 CO 0.00 0.00 0.00 1.52 -1.52 0.00 0.00 177.63 177.63 1ivr s TYR 97 N 0.27 1.25 -0.11 -1.55 1.13 -1.26 -1.54 117.35 115.54 1ivr s TYR 97 Ca 0.08 -0.73 -0.04 0.00 -1.41 0.00 0.00 57.07 54.97 1ivr s TYR 97 Cb 0.04 -0.64 0.06 0.00 -1.10 0.00 0.00 41.96 40.31 1ivr s TYR 97 CO 0.00 0.08 0.21 0.54 -2.51 0.00 0.00 175.55 173.87 1ivr s VAL 98 N -3.11 -0.34 -0.10 -3.49 0.11 -0.79 -4.88 120.40 107.80 1ivr s VAL 98 Ca 0.15 0.28 0.02 0.00 -2.93 0.00 0.00 61.98 59.50 1ivr s VAL 98 Cb 0.01 -0.39 -0.01 0.00 -1.53 0.00 0.00 36.38 34.46 1ivr s VAL 98 CO 0.01 0.10 -0.17 -0.89 -3.33 0.00 0.00 175.10 170.83 1ivr s THR 99 N 2.35 2.76 -0.06 5.04 2.01 -1.26 0.50 115.64 126.98 1ivr s THR 99 Ca 0.03 -0.78 0.04 0.00 0.31 0.00 0.00 61.69 61.28 1ivr s THR 99 Cb -0.12 -2.11 0.00 0.00 0.01 0.00 0.00 72.50 70.28 1ivr s THR 99 CO -0.08 0.55 -0.16 0.54 -0.69 0.00 0.00 174.62 174.78 1ivr s VAL 100 N 0.11 1.40 0.33 3.82 0.11 0.10 -4.92 120.40 121.35 1ivr s VAL 100 Ca -0.08 -0.67 -0.29 0.00 -2.93 0.00 0.00 61.98 58.01 1ivr s VAL 100 Cb -0.15 -1.23 -0.11 0.00 -1.53 0.00 0.00 36.38 33.36 1ivr s VAL 100 CO 0.05 0.41 1.45 -1.58 -3.33 0.00 0.00 175.10 172.10 1ivr s GLN 101 N 0.30 4.20 0.30 1.54 0.74 0.17 -0.72 119.66 126.19 1ivr s GLN 101 Ca -0.10 2.44 0.02 0.00 0.05 0.00 0.00 55.36 57.77 1ivr s GLN 101 Cb -0.14 -3.03 -0.05 0.00 1.10 0.00 0.00 33.01 30.90 1ivr s GLN 101 CO 0.04 -0.44 0.11 0.20 -0.55 0.00 0.00 175.29 174.65 1ivr s GLY 102 N -0.06 1.97 -1.42 2.59 0.00 -0.98 -4.72 107.32 104.69 1ivr s GLY 102 Ca 0.54 -1.80 -0.10 0.00 0.00 0.00 0.00 44.72 43.36 1ivr s GLY 102 CO 0.55 -1.65 2.34 1.39 0.00 0.00 0.00 173.10 175.73 1ivr n ILE 103 N -0.58 4.27 -4.64 0.90 5.41 -1.26 -2.41 119.36 121.05 1ivr n ILE 103 Ca -0.01 -3.57 0.00 0.00 1.00 0.00 0.00 62.75 60.18 1ivr n ILE 103 Cb 0.66 -2.43 0.00 0.00 -0.71 0.00 0.00 39.64 37.16 1ivr n ILE 103 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 176.55 176.31 1ivr n SER 104 N 3.99 -2.87 -0.01 4.38 2.88 -1.26 -1.58 113.62 119.16 1ivr n SER 104 Ca 0.57 0.00 -0.10 0.00 -1.33 0.00 0.00 58.87 58.01 1ivr n SER 104 Cb 0.32 0.00 -0.04 0.00 -0.75 0.00 0.00 64.21 63.74 1ivr n SER 104 CO 0.00 0.00 0.00 1.23 -1.23 0.00 0.00 175.04 175.04 1ivr h GLY 105 N 0.00 0.05 0.40 0.46 0.00 -1.81 1.24 103.07 103.41 1ivr h GLY 105 Ca 0.00 0.08 0.04 0.00 0.00 0.00 0.00 47.33 47.45 1ivr h GLY 105 CO 0.00 -0.08 -0.22 -0.84 0.00 0.00 0.00 176.54 175.40 1ivr h THR 106 N -0.05 0.47 -0.82 4.70 2.02 -1.92 -0.27 112.91 117.04 1ivr h THR 106 Ca 0.07 0.00 -0.02 0.00 0.77 0.00 0.00 66.41 67.23 1ivr h THR 106 Cb 0.16 0.47 -0.04 0.00 -1.74 0.00 0.00 68.15 67.00 1ivr h THR 106 CO -0.16 0.00 0.42 1.23 0.37 0.00 0.00 175.52 177.38 1ivr h GLY 107 N -0.31 1.25 1.39 2.16 0.00 -1.04 -1.19 103.07 105.33 1ivr h GLY 107 Ca 0.08 -0.60 -0.11 0.00 0.00 0.00 0.00 47.33 46.70 1ivr h GLY 107 CO -0.25 0.57 -0.24 1.76 0.00 0.00 0.00 176.54 178.38 1ivr h SER 108 N 1.15 0.72 -0.23 0.19 0.02 0.26 -1.48 113.55 114.18 1ivr h SER 108 Ca 0.28 -0.26 0.06 0.00 -0.84 0.00 0.00 61.79 61.03 1ivr h SER 108 Cb 0.08 -0.20 -0.06 0.00 0.14 0.00 0.00 62.40 62.37 1ivr h SER 108 CO -0.04 0.93 -0.15 0.25 -1.14 0.00 0.00 176.83 176.68 1ivr h LEU 109 N 0.61 -0.50 -0.06 5.07 5.85 -0.90 -1.41 115.31 123.98 1ivr h LEU 109 Ca 0.08 0.11 -0.01 0.00 0.84 0.00 0.00 57.88 58.90 1ivr h LEU 109 Cb 0.73 0.26 -0.00 0.00 0.37 0.00 0.00 40.66 42.02 1ivr h LEU 109 CO 0.06 -0.19 -0.02 -0.09 -0.34 0.00 0.00 178.44 177.85 1ivr h ARG 110 N -0.15 0.11 -0.98 1.25 9.65 -1.06 0.96 114.38 124.17 1ivr h ARG 110 Ca 0.13 -0.05 0.14 0.00 -1.10 0.00 0.00 59.98 59.10 1ivr h ARG 110 Cb 0.34 -0.01 -0.09 0.00 -1.39 0.00 0.00 29.97 28.82 1ivr h ARG 110 CO -0.32 0.47 0.60 0.28 2.80 0.00 0.00 179.97 183.81 1ivr h VAL 111 N -0.25 0.86 -0.24 0.20 2.07 -1.19 0.17 116.25 117.86 1ivr h VAL 111 Ca 0.01 -0.31 -0.01 0.00 0.82 0.00 0.00 66.70 67.22 1ivr h VAL 111 Cb 0.43 -0.13 -0.01 0.00 -1.52 0.00 0.00 31.29 30.06 1ivr h VAL 111 CO 0.01 0.17 0.13 1.23 0.02 0.00 0.00 177.57 179.12 1ivr h GLY 112 N 0.91 0.36 1.16 2.17 0.00 -0.95 0.11 103.07 106.82 1ivr h GLY 112 Ca 0.51 -0.17 -0.05 0.00 0.00 0.00 0.00 47.33 47.63 1ivr h GLY 112 CO -0.30 0.16 0.26 0.00 0.00 0.00 0.00 176.54 176.67 1ivr h ALA 113 N 1.01 1.12 -0.03 3.60 0.00 -0.27 0.92 119.26 125.61 1ivr h ALA 113 Ca 0.08 -0.19 -0.14 0.00 0.00 0.00 0.00 54.91 54.66 1ivr h ALA 113 Cb 0.07 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 17.57 1ivr h ALA 113 CO -0.01 0.62 -0.64 -0.91 0.00 0.00 0.00 179.25 178.30 1ivr h ASN 114 N 1.04 0.13 -0.12 0.00 4.21 -0.50 0.17 115.58 120.51 1ivr h ASN 114 Ca 0.24 -0.08 -0.03 0.00 1.21 0.00 0.00 56.30 57.64 1ivr h ASN 114 Cb 0.23 -0.04 -0.00 0.00 -1.12 0.00 0.00 38.32 37.39 1ivr h ASN 114 CO -0.02 0.74 -0.04 0.15 -1.29 0.00 0.00 177.43 176.97 1ivr h PHE 115 N 0.08 0.26 -0.52 1.19 3.57 0.18 -2.72 116.94 118.98 1ivr h PHE 115 Ca -0.01 -0.06 -0.06 0.00 3.53 0.00 0.00 57.97 61.37 1ivr h PHE 115 Cb 1.15 -0.06 -0.02 0.00 2.79 0.00 0.00 35.95 39.81 1ivr h PHE 115 CO 0.01 0.55 0.08 -0.07 -2.23 0.00 0.00 178.31 176.65 1ivr h LEU 116 N -0.09 0.83 -0.26 0.59 3.38 0.12 0.39 115.31 120.27 1ivr h LEU 116 Ca 0.03 -0.26 0.06 0.00 0.09 0.00 0.00 57.88 57.80 1ivr h LEU 116 Cb 0.46 -0.22 -0.07 0.00 0.09 0.00 0.00 40.66 40.93 1ivr h LEU 116 CO 0.01 0.88 -0.19 -0.61 0.09 0.00 0.00 178.44 178.62 1ivr h GLN 117 N 0.75 -0.18 -0.12 1.13 -0.00 -0.62 -1.25 115.11 114.82 1ivr h GLN 117 Ca 0.16 0.01 -0.04 0.00 -0.00 0.00 0.00 58.65 58.78 1ivr h GLN 117 Cb 0.41 0.04 -0.00 0.00 0.00 0.00 0.00 27.48 27.92 1ivr h GLN 117 CO 0.01 -0.12 -0.08 -0.09 0.00 0.00 0.00 178.83 178.55 1ivr h ARG 118 N -0.19 0.26 -0.01 1.69 2.43 -1.19 -3.40 114.38 113.98 1ivr h ARG 118 Ca 0.14 -0.13 0.00 0.00 -0.81 0.00 0.00 59.98 59.19 1ivr h ARG 118 Cb 0.40 -0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.95 1ivr h ARG 118 CO -0.37 0.64 -0.12 1.19 -1.51 0.00 0.00 179.97 179.80 1ivr n PHE 119 N -4.66 0.00 -2.86 2.20 3.72 0.13 -4.85 117.46 111.15 1ivr n PHE 119 Ca -0.06 0.00 -0.44 0.00 -0.05 0.00 0.00 57.45 56.90 1ivr n PHE 119 Cb 0.31 0.00 -0.00 0.00 -0.94 0.00 0.00 39.48 38.84 1ivr n PHE 119 CO 0.00 0.00 0.00 0.12 -0.05 0.00 0.00 176.76 176.83 1ivr s PHE 120 N -1.13 3.28 -0.52 1.38 5.36 -0.48 -4.84 117.98 121.03 1ivr s PHE 120 Ca 0.09 -1.89 0.20 0.00 -0.96 0.00 0.00 56.93 54.37 1ivr s PHE 120 Cb 0.08 -4.41 0.90 0.00 -0.34 0.00 0.00 43.02 39.25 1ivr s PHE 120 CO 0.20 -1.51 1.60 0.36 -1.46 0.00 0.00 175.22 174.41 1ivr n LYS 121 N 6.40 0.14 -0.11 10.12 2.85 -1.26 -3.67 118.16 132.63 1ivr n LYS 121 Ca 0.37 0.46 0.11 0.00 -1.05 0.00 0.00 58.31 58.21 1ivr n LYS 121 Cb 0.45 -1.81 0.29 0.00 -0.65 0.00 0.00 35.03 33.31 1ivr n LYS 121 CO 0.00 0.00 0.00 1.19 -0.05 0.00 0.00 177.40 178.54 1ivr n PHE 122 N -2.08 0.28 0.00 5.58 3.72 -1.26 -5.03 117.46 118.67 1ivr n PHE 122 Ca 0.01 -0.14 0.00 0.00 -0.05 0.00 0.00 57.45 57.27 1ivr n PHE 122 Cb 0.15 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 38.69 1ivr n PHE 122 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 176.76 177.16 1ivr n SER 123 N 0.88 0.00 -0.09 4.37 2.88 -1.24 -4.69 113.62 115.73 1ivr n SER 123 Ca 0.17 0.00 0.01 0.00 -1.33 0.00 0.00 58.87 57.72 1ivr n SER 123 Cb 0.47 0.00 0.02 0.00 -0.75 0.00 0.00 64.21 63.95 1ivr n SER 123 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 1ivr n ARG 124 N -0.36 0.86 -3.41 -1.46 5.12 -1.26 -4.93 116.66 111.21 1ivr n ARG 124 Ca 0.00 -1.03 -0.38 0.00 -1.93 0.00 0.00 57.85 54.51 1ivr n ARG 124 Cb 0.00 -1.04 -0.07 0.00 -1.16 0.00 0.00 32.46 30.19 1ivr n ARG 124 CO 0.00 0.00 0.00 -0.51 -1.93 0.00 0.00 177.63 175.19 1ivr s ASP 125 N -0.52 6.44 -0.15 0.55 1.01 -1.26 0.20 116.67 122.94 1ivr s ASP 125 Ca 0.03 0.52 0.02 0.00 0.71 0.00 0.00 52.55 53.82 1ivr s ASP 125 Cb 0.02 -2.22 0.02 0.00 1.01 0.00 0.00 42.92 41.74 1ivr s ASP 125 CO 0.03 -0.05 -0.19 -0.69 0.21 0.00 0.00 175.17 174.48 1ivr s VAL 126 N 1.16 1.87 -0.29 -1.27 1.01 -0.85 -2.70 120.40 119.33 1ivr s VAL 126 Ca 0.19 -0.84 -0.14 0.00 0.00 0.00 0.00 61.98 61.19 1ivr s VAL 126 Cb -0.14 -1.69 -0.04 0.00 0.00 0.00 0.00 36.38 34.51 1ivr s VAL 126 CO 0.07 0.51 0.31 -0.31 0.00 0.00 0.00 175.10 175.68 1ivr s TYR 127 N 1.11 3.23 0.07 5.22 1.51 -0.37 -0.69 117.35 127.43 1ivr s TYR 127 Ca -0.01 0.21 0.02 0.00 -1.01 0.00 0.00 57.07 56.28 1ivr s TYR 127 Cb -0.14 -2.53 -0.04 0.00 -0.11 0.00 0.00 41.96 39.14 1ivr s TYR 127 CO -0.07 -0.25 0.12 -0.51 -1.11 0.00 0.00 175.55 173.72 1ivr s LEU 128 N 1.95 3.97 1.01 -1.29 1.43 0.01 -0.48 118.68 125.28 1ivr s LEU 128 Ca 0.11 0.08 -0.12 0.00 -1.03 0.00 0.00 54.13 53.17 1ivr s LEU 128 Cb -0.16 -2.61 0.19 0.00 0.03 0.00 0.00 46.19 43.64 1ivr s LEU 128 CO 0.11 0.18 1.08 -2.16 0.23 0.00 0.00 176.35 175.78 1ivr s PRO 129 N -2.39 0.34 -0.40 1.29 0.04 -1.26 -1.61 135.00 131.01 1ivr s PRO 129 Ca 0.31 0.77 -0.06 0.00 0.04 0.00 0.00 61.00 62.06 1ivr s PRO 129 Cb -0.12 -1.71 0.09 0.00 0.04 0.00 0.00 34.50 32.80 1ivr s PRO 129 CO 0.23 -2.86 0.20 0.15 0.04 0.00 0.00 177.00 174.77 1ivr s LYS 130 N -4.79 2.34 0.63 4.56 1.02 -0.30 -3.64 119.74 119.56 1ivr s LYS 130 Ca 0.66 -1.59 0.04 0.00 0.02 0.00 0.00 55.97 55.10 1ivr s LYS 130 Cb -0.20 -3.62 0.09 0.00 -0.52 0.00 0.00 37.83 33.58 1ivr s LYS 130 CO 0.59 -0.96 0.87 -1.25 -0.92 0.00 0.00 175.35 173.68 1ivr s PRO 131 N 1.28 2.07 0.16 -1.68 0.04 -1.26 -0.30 135.00 135.31 1ivr s PRO 131 Ca 0.04 -1.28 -0.01 0.00 0.04 0.00 0.00 61.00 59.79 1ivr s PRO 131 Cb -0.23 -2.49 -0.04 0.00 0.04 0.00 0.00 34.50 31.78 1ivr s PRO 131 CO -0.01 -1.08 0.08 0.45 0.04 0.00 0.00 177.00 176.48 1ivr s SER 132 N -4.65 0.30 -0.30 6.66 0.15 -1.24 -4.67 113.70 109.94 1ivr s SER 132 Ca 0.63 -1.27 -0.36 0.00 0.70 0.00 0.00 55.95 55.65 1ivr s SER 132 Cb -0.06 0.32 -0.12 0.00 -1.71 0.00 0.00 66.02 64.44 1ivr s SER 132 CO 0.41 -0.76 2.05 1.87 1.20 0.00 0.00 173.24 178.01 1ivr n TRP 133 N -0.16 1.80 -0.33 3.44 -0.00 -0.98 -4.59 117.44 116.63 1ivr n TRP 133 Ca -0.03 0.30 0.29 0.00 -0.00 0.00 0.00 57.50 58.06 1ivr n TRP 133 Cb 0.64 -2.53 0.62 0.00 -0.00 0.00 0.00 31.31 30.04 1ivr n TRP 133 CO 0.00 0.00 0.00 0.78 -0.00 0.00 0.00 177.69 178.47 1ivr h GLY 134 N 10.72 0.72 2.00 5.87 0.00 -1.99 -1.20 103.07 119.19 1ivr h GLY 134 Ca -0.34 -0.12 -0.01 0.00 0.00 0.00 0.00 47.33 46.87 1ivr h GLY 134 CO 1.00 -0.10 -0.04 -0.57 0.00 0.00 0.00 176.54 176.83 1ivr h ASN 135 N 0.21 0.00 -0.80 0.19 -1.24 -2.02 -3.08 115.58 108.84 1ivr h ASN 135 Ca 0.59 0.00 0.08 0.00 0.71 0.00 0.00 56.30 57.69 1ivr h ASN 135 Cb 1.87 0.00 -0.05 0.00 0.73 0.00 0.00 38.32 40.87 1ivr h ASN 135 CO -0.19 0.04 0.52 0.45 -1.29 0.00 0.00 177.43 176.96 1ivr h HIS 136 N 0.00 0.83 0.76 0.67 3.86 -1.58 -1.62 115.15 118.06 1ivr h HIS 136 Ca -0.00 0.02 -0.04 0.00 -1.16 0.00 0.00 60.37 59.19 1ivr h HIS 136 Cb 0.45 -0.27 0.01 0.00 1.06 0.00 0.00 27.41 28.65 1ivr h HIS 136 CO 0.00 0.41 -0.36 1.15 0.86 0.00 0.00 177.93 179.99 1ivr h THR 137 N 0.79 0.16 -0.19 2.45 2.02 -1.74 -3.10 112.91 113.31 1ivr h THR 137 Ca 0.36 -0.16 0.00 0.00 0.77 0.00 0.00 66.41 67.38 1ivr h THR 137 Cb 0.35 0.19 -0.01 0.00 -1.74 0.00 0.00 68.15 66.94 1ivr h THR 137 CO -0.13 0.01 0.12 1.55 0.37 0.00 0.00 175.52 177.44 1ivr h PRO 138 N -1.15 0.25 0.07 6.66 0.13 -1.77 0.23 132.00 136.42 1ivr h PRO 138 Ca -0.10 -0.02 0.02 0.00 -0.87 0.00 0.00 66.00 65.03 1ivr h PRO 138 Cb 0.80 -0.06 -0.03 0.00 0.13 0.00 0.00 31.00 31.84 1ivr h PRO 138 CO 0.17 0.17 -0.23 0.82 -0.23 0.00 0.00 178.00 178.70 1ivr h ILE 139 N 0.26 0.48 -0.05 -3.56 2.04 -1.26 0.33 117.51 115.74 1ivr h ILE 139 Ca 0.07 0.00 -0.23 0.00 1.00 0.00 0.00 64.86 65.70 1ivr h ILE 139 Cb -0.03 0.48 0.02 0.00 -0.74 0.00 0.00 36.82 36.55 1ivr h ILE 139 CO -0.01 0.00 -0.88 -0.26 0.00 0.00 0.00 178.15 176.99 1ivr h PHE 140 N -0.40 0.98 -0.38 1.37 0.04 -1.39 -2.99 116.94 114.17 1ivr h PHE 140 Ca 0.04 -0.50 -0.14 0.00 2.80 0.00 0.00 57.97 60.17 1ivr h PHE 140 Cb 0.45 -0.13 -0.01 0.00 2.20 0.00 0.00 35.95 38.46 1ivr h PHE 140 CO -0.24 1.33 -0.33 -0.09 -0.60 0.00 0.00 178.31 178.38 1ivr h ARG 141 N 0.36 0.86 0.00 1.51 2.43 -0.49 -0.48 114.38 118.56 1ivr h ARG 141 Ca -0.10 -0.42 -0.10 0.00 -0.81 0.00 0.00 59.98 58.56 1ivr h ARG 141 Cb 1.54 -0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 31.07 1ivr h ARG 141 CO 0.18 1.06 -0.46 -0.44 -1.51 0.00 0.00 179.97 178.79 1ivr h ASP 142 N 0.72 0.00 0.46 -3.80 5.19 -1.03 -3.14 116.42 114.82 1ivr h ASP 142 Ca 0.07 0.00 -0.03 0.00 -0.62 0.00 0.00 57.03 56.46 1ivr h ASP 142 Cb 0.90 0.00 -0.00 0.00 0.18 0.00 0.00 39.33 40.40 1ivr h ASP 142 CO 0.08 0.46 -0.13 0.00 -3.12 0.00 0.00 179.24 176.54 1ivr h ALA 143 N 1.54 1.23 0.00 3.45 0.00 -1.42 -3.47 119.26 120.58 1ivr h ALA 143 Ca -0.00 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.79 1ivr h ALA 143 Cb 0.99 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.76 1ivr h ALA 143 CO 0.06 0.16 0.00 0.41 0.00 0.00 0.00 179.25 179.88 1ivr n GLY 144 N -0.55 1.24 3.99 0.00 0.00 -1.15 -4.76 105.19 103.95 1ivr n GLY 144 Ca -0.01 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.78 1ivr n GLY 144 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1ivr s LEU 145 N 0.00 2.95 0.05 0.99 1.43 -0.20 -5.00 118.68 118.89 1ivr s LEU 145 Ca 0.00 -1.00 -0.01 0.00 -1.03 0.00 0.00 54.13 52.10 1ivr s LEU 145 Cb 0.00 -1.46 -0.04 0.00 0.03 0.00 0.00 46.19 44.72 1ivr s LEU 145 CO 0.00 -1.26 0.21 -1.10 0.23 0.00 0.00 176.35 174.43 1ivr s GLN 146 N -4.53 3.44 -0.10 1.70 -0.21 0.54 -4.35 119.66 116.16 1ivr s GLN 146 Ca 0.52 -0.41 -0.02 0.00 0.02 0.00 0.00 55.36 55.47 1ivr s GLN 146 Cb -0.04 -3.05 -0.03 0.00 1.00 0.00 0.00 33.01 30.89 1ivr s GLN 146 CO 0.32 0.62 -0.01 -0.51 -2.12 0.00 0.00 175.29 173.59 1ivr s LEU 147 N -2.40 3.48 0.32 2.90 1.43 -1.26 -2.01 118.68 121.14 1ivr s LEU 147 Ca 0.34 0.08 0.06 0.00 -1.03 0.00 0.00 54.13 53.57 1ivr s LEU 147 Cb -0.13 -1.80 -0.03 0.00 0.03 0.00 0.00 46.19 44.26 1ivr s LEU 147 CO 0.26 0.34 0.23 -1.10 0.23 0.00 0.00 176.35 176.32 1ivr s GLN 148 N -0.66 1.69 0.04 1.70 -1.52 0.13 -4.91 119.66 116.13 1ivr s GLN 148 Ca 0.10 -1.98 -0.03 0.00 -1.95 0.00 0.00 55.36 51.51 1ivr s GLN 148 Cb -0.12 0.19 -0.02 0.00 -0.22 0.00 0.00 33.01 32.84 1ivr s GLN 148 CO 0.02 -0.58 0.03 0.00 -0.25 0.00 0.00 175.29 174.50 1ivr s ALA 149 N -3.53 0.13 0.04 6.09 0.00 -1.26 -0.81 121.76 122.43 1ivr s ALA 149 Ca 0.38 -0.73 0.05 0.00 0.00 0.00 0.00 51.96 51.67 1ivr s ALA 149 Cb 0.03 0.22 -0.02 0.00 0.00 0.00 0.00 23.12 23.35 1ivr s ALA 149 CO 0.23 -0.28 -0.14 1.52 0.00 0.00 0.00 175.76 177.09 1ivr s TYR 150 N -2.59 1.26 0.28 0.00 -0.85 -0.63 -4.87 117.35 109.94 1ivr s TYR 150 Ca -0.05 -0.37 -0.30 0.00 -0.52 0.00 0.00 57.07 55.83 1ivr s TYR 150 Cb -0.01 -0.74 -0.11 0.00 0.38 0.00 0.00 41.96 41.48 1ivr s TYR 150 CO -0.05 0.04 1.48 1.03 -1.52 0.00 0.00 175.55 176.53 1ivr s ARG 151 N -1.23 4.22 0.14 -3.49 0.52 -1.26 -1.15 118.95 116.69 1ivr s ARG 151 Ca 0.01 2.40 0.00 0.00 -0.52 0.00 0.00 55.73 57.63 1ivr s ARG 151 Cb -0.08 -3.07 0.00 0.00 0.52 0.00 0.00 34.95 32.32 1ivr s ARG 151 CO 0.01 -0.47 0.00 0.98 0.02 0.00 0.00 175.30 175.84 1ivr n TYR 152 N 1.94 -1.20 -3.59 -0.53 9.36 -1.12 -3.89 117.16 118.12 1ivr n TYR 152 Ca 0.06 0.21 -0.31 0.00 3.32 0.00 0.00 57.90 61.18 1ivr n TYR 152 Cb 0.39 0.54 -0.05 0.00 -0.63 0.00 0.00 39.34 39.60 1ivr n TYR 152 CO 0.00 0.00 0.00 -0.47 0.22 0.00 0.00 176.86 176.61 1ivr s TYR 153 N -2.00 3.46 -0.35 2.98 5.04 0.59 -0.33 117.35 126.76 1ivr s TYR 153 Ca 0.00 0.61 0.02 0.00 -2.44 0.00 0.00 57.07 55.26 1ivr s TYR 153 Cb 0.00 -2.05 0.11 0.00 0.35 0.00 0.00 41.96 40.36 1ivr s TYR 153 CO 0.00 0.37 0.10 0.34 -1.34 0.00 0.00 175.55 175.02 1ivr s ASP 154 N -2.55 4.30 0.28 4.32 2.15 0.10 -4.68 116.67 120.60 1ivr s ASP 154 Ca 0.42 -2.01 0.13 0.00 0.43 0.00 0.00 52.55 51.52 1ivr s ASP 154 Cb -0.12 -1.22 0.36 0.00 -0.30 0.00 0.00 42.92 41.64 1ivr s ASP 154 CO 0.25 -0.38 1.59 1.55 -0.17 0.00 0.00 175.17 178.01 1ivr h PRO 155 N 7.68 0.00 -0.10 4.34 0.13 -1.97 0.86 132.00 142.94 1ivr h PRO 155 Ca -0.08 0.00 -0.07 0.00 -0.87 0.00 0.00 66.00 64.98 1ivr h PRO 155 Cb 1.00 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.12 1ivr h PRO 155 CO 0.50 0.59 -0.24 0.87 -0.23 0.00 0.00 178.00 179.49 1ivr h LYS 156 N 0.00 0.18 0.03 0.86 1.57 -1.94 -3.29 116.57 113.97 1ivr h LYS 156 Ca -0.01 -0.05 -0.35 0.00 -1.87 0.00 0.00 60.65 58.37 1ivr h LYS 156 Cb 1.15 -0.02 -0.05 0.00 0.08 0.00 0.00 32.23 33.39 1ivr h LYS 156 CO 0.08 0.42 -2.12 2.41 -0.57 0.00 0.00 179.45 179.67 1ivr n THR 157 N -4.19 1.57 -2.37 -0.16 -1.04 -1.17 -5.04 114.28 101.88 1ivr n THR 157 Ca -0.01 -0.73 -0.03 0.00 -2.04 0.00 0.00 64.05 61.24 1ivr n THR 157 Cb 0.34 -1.14 0.01 0.00 -1.82 0.00 0.00 70.33 67.72 1ivr n THR 157 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1ivr n SER 159 N -0.39 -2.04 -4.74 0.00 3.41 -0.79 -5.00 113.62 104.07 1ivr n SER 159 Ca -0.02 -2.31 -0.42 0.00 -0.26 0.00 0.00 58.87 55.86 1ivr n SER 159 Cb 0.52 3.37 -0.00 0.00 -0.26 0.00 0.00 64.21 67.83 1ivr n SER 159 CO 0.00 0.00 0.00 -0.11 -0.16 0.00 0.00 175.04 174.77 1ivr n LEU 160 N 0.00 4.20 -4.25 1.04 7.94 -1.26 0.00 117.00 124.67 1ivr n LEU 160 Ca -0.06 1.22 -0.44 0.00 -1.11 0.00 0.00 56.01 55.62 1ivr n LEU 160 Cb 0.57 -1.56 -0.00 0.00 0.53 0.00 0.00 43.42 42.96 1ivr n LEU 160 CO 0.25 -0.14 0.82 -0.67 -1.11 0.00 0.00 177.39 176.53 1ivr n ASP 161 N 0.63 5.59 -0.04 1.96 -0.08 0.56 -4.72 116.55 120.45 1ivr n ASP 161 Ca 0.03 -3.12 -0.11 0.00 -1.51 0.00 0.00 54.79 50.08 1ivr n ASP 161 Cb 0.37 -1.33 -0.05 0.00 2.34 0.00 0.00 41.12 42.45 1ivr n ASP 161 CO 0.00 0.00 0.00 0.15 0.12 0.00 0.00 177.20 177.47 1ivr h PHE 162 N 6.34 0.24 -0.54 -0.67 3.57 -1.92 0.27 116.94 124.23 1ivr h PHE 162 Ca 0.18 -0.02 0.10 0.00 3.53 0.00 0.00 57.97 61.76 1ivr h PHE 162 Cb 0.81 -0.07 -0.08 0.00 2.79 0.00 0.00 35.95 39.41 1ivr h PHE 162 CO 0.80 0.32 0.10 1.15 -2.23 0.00 0.00 178.31 178.44 1ivr h THR 163 N 0.10 0.68 -0.07 4.41 2.02 -1.99 -1.34 112.91 116.72 1ivr h THR 163 Ca 0.05 -0.08 -0.12 0.00 0.77 0.00 0.00 66.41 67.04 1ivr h THR 163 Cb 0.18 0.43 -0.01 0.00 -1.74 0.00 0.00 68.15 67.00 1ivr h THR 163 CO -0.00 0.04 -0.49 1.23 0.37 0.00 0.00 175.52 176.67 1ivr h GLY 164 N 0.23 0.19 0.71 2.16 0.00 -1.89 -0.35 103.07 104.12 1ivr h GLY 164 Ca 0.27 -0.19 -0.02 0.00 0.00 0.00 0.00 47.33 47.39 1ivr h GLY 164 CO -0.36 0.17 -0.01 0.00 0.00 0.00 0.00 176.54 176.34 1ivr h ALA 165 N 1.36 0.11 0.00 3.60 0.00 0.29 -2.58 119.26 122.04 1ivr h ALA 165 Ca 0.01 -0.20 -0.04 0.00 0.00 0.00 0.00 54.91 54.67 1ivr h ALA 165 Cb 0.91 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.67 1ivr h ALA 165 CO 0.07 -0.18 -0.21 0.52 0.00 0.00 0.00 179.25 179.45 1ivr h MET 166 N -0.17 0.00 0.11 0.00 0.00 -1.21 0.30 114.93 113.95 1ivr h MET 166 Ca 0.02 0.00 -0.01 0.00 0.00 0.00 0.00 59.70 59.71 1ivr h MET 166 Cb 0.40 0.00 0.00 0.00 0.00 0.00 0.00 31.60 32.00 1ivr h MET 166 CO 0.01 0.21 -0.05 0.93 0.00 0.00 0.00 176.91 178.00 1ivr h GLU 167 N 0.00 -0.14 0.06 1.72 5.08 -0.80 -1.21 114.58 119.29 1ivr h GLU 167 Ca -0.00 0.01 0.01 0.00 -1.00 0.00 0.00 59.36 58.38 1ivr h GLU 167 Cb 1.04 0.03 -0.02 0.00 0.50 0.00 0.00 28.75 30.31 1ivr h GLU 167 CO 0.03 0.18 -0.13 -0.44 -1.00 0.00 0.00 179.01 177.65 1ivr h ASP 168 N -0.48 -0.36 -0.80 1.42 3.32 -1.37 -3.07 116.42 115.09 1ivr h ASP 168 Ca -0.02 0.05 0.08 0.00 0.02 0.00 0.00 57.03 57.16 1ivr h ASP 168 Cb 0.39 0.14 -0.07 0.00 0.22 0.00 0.00 39.33 40.01 1ivr h ASP 168 CO 0.03 -0.19 0.46 0.40 -1.72 0.00 0.00 179.24 178.21 1ivr h ILE 169 N -0.25 0.93 0.00 0.35 2.04 -0.40 -2.29 117.51 117.90 1ivr h ILE 169 Ca 0.03 -0.27 0.00 0.00 1.00 0.00 0.00 64.86 65.62 1ivr h ILE 169 Cb 0.27 0.08 0.00 0.00 -0.74 0.00 0.00 36.82 36.43 1ivr h ILE 169 CO -0.08 0.14 0.00 -1.54 0.00 0.00 0.00 178.15 176.67 1ivr n SER 170 N -4.74 0.00 -0.32 1.72 3.41 -0.46 -2.48 113.62 110.76 1ivr n SER 170 Ca 0.12 0.00 0.04 0.00 -0.26 0.00 0.00 58.87 58.77 1ivr n SER 170 Cb 0.25 -0.27 0.05 0.00 -0.26 0.00 0.00 64.21 63.97 1ivr n SER 170 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 1ivr n LYS 171 N -1.27 0.82 -2.50 4.33 5.02 -0.88 -4.98 118.16 118.71 1ivr n LYS 171 Ca 0.09 -1.19 -0.41 0.00 -2.02 0.00 0.00 58.31 54.78 1ivr n LYS 171 Cb 0.14 -1.15 -0.04 0.00 -0.02 0.00 0.00 35.03 33.96 1ivr n LYS 171 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 1ivr s ILE 172 N -0.71 3.68 0.38 -0.18 1.01 -1.03 -4.97 121.20 119.38 1ivr s ILE 172 Ca 0.10 1.56 -0.27 0.00 0.00 0.00 0.00 60.65 62.04 1ivr s ILE 172 Cb 0.06 -3.99 -0.11 0.00 0.01 0.00 0.00 42.46 38.43 1ivr s ILE 172 CO 0.09 0.32 1.39 -2.65 0.00 0.00 0.00 174.94 174.09 1ivr n PRO 173 N 1.83 2.36 -1.53 2.79 -0.02 -1.26 -4.97 135.00 134.20 1ivr n PRO 173 Ca 0.01 0.83 -0.40 0.00 -2.02 0.00 0.00 63.50 61.92 1ivr n PRO 173 Cb 0.45 -2.52 0.02 0.00 -0.02 0.00 0.00 33.50 31.43 1ivr n PRO 173 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 1ivr n GLU 174 N 0.34 0.84 -1.09 -0.52 1.02 -1.26 -2.83 120.64 117.15 1ivr n GLU 174 Ca 0.03 0.31 -0.03 0.00 -0.02 0.00 0.00 57.16 57.46 1ivr n GLU 174 Cb 0.38 -1.82 -0.01 0.00 -0.02 0.00 0.00 31.44 29.97 1ivr n GLU 174 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 1ivr n LYS 175 N 0.04 -1.68 -1.68 3.49 5.02 0.13 -4.97 118.16 118.51 1ivr n LYS 175 Ca 0.11 0.56 -0.30 0.00 -2.02 0.00 0.00 58.31 56.66 1ivr n LYS 175 Cb 0.43 -4.87 0.17 0.00 -0.02 0.00 0.00 35.03 30.74 1ivr n LYS 175 CO 0.00 0.00 0.00 -1.12 -0.52 0.00 0.00 177.40 175.76 1ivr s SER 176 N -2.13 2.97 -0.11 4.39 0.01 -1.13 -4.41 113.70 113.29 1ivr s SER 176 Ca 0.00 0.56 -0.01 0.00 1.31 0.00 0.00 55.95 57.81 1ivr s SER 176 Cb 0.00 -0.81 -0.02 0.00 0.21 0.00 0.00 66.02 65.39 1ivr s SER 176 CO 0.00 -2.85 -0.08 -0.63 0.41 0.00 0.00 173.24 170.09 1ivr s ILE 177 N -3.55 3.52 -0.07 1.44 1.01 -1.10 -0.39 121.20 122.06 1ivr s ILE 177 Ca 0.70 -0.51 0.02 0.00 0.00 0.00 0.00 60.65 60.85 1ivr s ILE 177 Cb -0.08 -2.48 0.02 0.00 0.01 0.00 0.00 42.46 39.92 1ivr s ILE 177 CO 0.53 0.54 -0.12 -0.51 0.00 0.00 0.00 174.94 175.39 1ivr s ILE 178 N -0.06 1.12 -0.08 2.92 2.07 0.18 -1.23 121.20 126.11 1ivr s ILE 178 Ca -0.00 -0.45 -0.18 0.00 -1.41 0.00 0.00 60.65 58.61 1ivr s ILE 178 Cb -0.13 -1.04 -0.05 0.00 0.13 0.00 0.00 42.46 41.37 1ivr s ILE 178 CO 0.03 0.36 0.48 -0.22 -1.91 0.00 0.00 174.94 173.68 1ivr s LEU 179 N 0.84 4.33 0.01 8.50 0.20 0.37 0.02 118.68 132.94 1ivr s LEU 179 Ca -0.11 0.89 0.02 0.00 0.69 0.00 0.00 54.13 55.62 1ivr s LEU 179 Cb -0.15 -2.71 -0.01 0.00 -0.43 0.00 0.00 46.19 42.88 1ivr s LEU 179 CO 0.02 0.07 -0.07 -0.76 -0.29 0.00 0.00 176.35 175.31 1ivr s LEU 180 N 0.24 2.08 -0.11 -0.68 1.43 0.18 -4.44 118.68 117.38 1ivr s LEU 180 Ca 0.26 -0.23 -0.18 0.00 -1.03 0.00 0.00 54.13 52.95 1ivr s LEU 180 Cb -0.16 -0.31 -0.04 0.00 0.03 0.00 0.00 46.19 45.71 1ivr s LEU 180 CO 0.12 0.01 0.47 -1.00 0.23 0.00 0.00 176.35 176.18 1ivr s HIS 181 N -0.47 3.53 0.13 0.29 3.76 -1.26 -1.78 115.29 119.49 1ivr s HIS 181 Ca -0.00 0.90 -0.33 0.00 -0.15 0.00 0.00 55.06 55.48 1ivr s HIS 181 Cb -0.04 -2.53 -0.10 0.00 1.11 0.00 0.00 32.58 31.01 1ivr s HIS 181 CO 0.00 0.21 1.55 0.00 -0.85 0.00 0.00 174.74 175.65 1ivr h ALA 182 N 6.55 -0.78 -2.21 -1.40 0.00 -1.21 -3.46 119.26 116.75 1ivr h ALA 182 Ca -0.42 -0.01 0.02 0.00 0.00 0.00 0.00 54.91 54.51 1ivr h ALA 182 Cb 1.18 1.10 -0.17 0.00 0.00 0.00 0.00 17.79 19.90 1ivr h ALA 182 CO 0.74 -1.05 0.34 0.00 0.00 0.00 0.00 179.25 179.29 1ivr n ALA 184 N 0.28 -2.00 -1.64 0.00 0.00 -1.26 -4.39 120.51 111.49 1ivr n ALA 184 Ca -0.14 0.07 -0.47 0.00 0.00 0.00 0.00 53.44 52.90 1ivr n ALA 184 Cb 0.60 -4.16 -0.04 0.00 0.00 0.00 0.00 19.45 15.86 1ivr n ALA 184 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 177.50 179.08 1ivr n HIS 185 N -3.07 1.97 -3.95 0.00 -0.00 -1.26 -4.74 115.22 104.17 1ivr n HIS 185 Ca -0.10 0.44 -0.35 0.00 0.46 0.00 0.00 57.72 58.17 1ivr n HIS 185 Cb 0.61 -2.44 -0.13 0.00 -0.12 0.00 0.00 29.99 27.90 1ivr n HIS 185 CO 0.00 0.00 0.00 1.21 0.46 0.00 0.00 176.34 178.01 1ivr s ASN 186 N 0.51 4.56 0.00 0.26 3.84 -1.26 0.11 114.94 122.96 1ivr s ASN 186 Ca 0.76 -0.31 0.23 0.00 0.21 0.00 0.00 52.86 53.74 1ivr s ASN 186 Cb -0.74 -1.79 0.57 0.00 -0.55 0.00 0.00 41.25 38.75 1ivr s ASN 186 CO 0.45 0.00 1.47 -0.81 -2.79 0.00 0.00 177.10 175.43 1ivr n PRO 187 N 4.64 2.11 0.09 0.43 -0.04 -1.26 -2.33 135.00 138.63 1ivr n PRO 187 Ca -0.18 -1.66 -0.07 0.00 -0.04 0.00 0.00 63.50 61.56 1ivr n PRO 187 Cb 0.51 -1.46 0.06 0.00 -0.04 0.00 0.00 33.50 32.58 1ivr n PRO 187 CO 0.00 0.00 0.00 1.15 -0.04 0.00 0.00 175.50 176.61 1ivr h THR 188 N 3.45 1.44 -1.74 0.52 2.02 -1.91 -3.38 112.91 113.30 1ivr h THR 188 Ca 0.00 -2.28 -0.40 0.00 0.77 0.00 0.00 66.41 64.51 1ivr h THR 188 Cb 0.75 2.21 -0.10 0.00 -1.74 0.00 0.00 68.15 69.28 1ivr h THR 188 CO 0.00 0.67 -0.42 0.61 0.37 0.00 0.00 175.52 176.74 1ivr n GLY 189 N 0.54 0.88 3.20 2.16 0.00 0.31 -4.61 105.19 107.67 1ivr n GLY 189 Ca -0.03 -0.07 -0.34 0.00 0.00 0.00 0.00 46.02 45.58 1ivr n GLY 189 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1ivr s VAL 190 N -2.84 2.75 0.08 1.61 1.01 -1.26 -1.44 120.40 120.32 1ivr s VAL 190 Ca 0.00 -0.88 0.06 0.00 0.00 0.00 0.00 61.98 61.16 1ivr s VAL 190 Cb 0.00 -2.31 -0.04 0.00 0.00 0.00 0.00 36.38 34.04 1ivr s VAL 190 CO 0.00 0.35 -0.09 -1.81 0.00 0.00 0.00 175.10 173.54 1ivr s ASP 191 N 1.35 4.43 0.48 3.32 1.01 -1.26 -4.54 116.67 121.46 1ivr s ASP 191 Ca 0.03 -0.33 -0.21 0.00 0.71 0.00 0.00 52.55 52.75 1ivr s ASP 191 Cb -0.15 -0.89 -0.11 0.00 1.01 0.00 0.00 42.92 42.78 1ivr s ASP 191 CO -0.07 0.21 0.57 -2.65 0.21 0.00 0.00 175.17 173.44 1ivr n PRO 192 N 0.94 0.61 -2.79 8.23 -0.02 -1.26 -4.95 135.00 135.75 1ivr n PRO 192 Ca -0.14 0.23 -0.35 0.00 -2.02 0.00 0.00 63.50 61.22 1ivr n PRO 192 Cb 0.52 -1.62 -0.07 0.00 -0.02 0.00 0.00 33.50 32.32 1ivr n PRO 192 CO 0.00 0.00 0.00 1.03 1.98 0.00 0.00 175.50 178.51 1ivr s ARG 193 N -1.80 4.38 0.38 -0.52 0.52 -1.26 -4.79 118.95 115.86 1ivr s ARG 193 Ca 0.65 1.22 0.25 0.00 -0.52 0.00 0.00 55.73 57.33 1ivr s ARG 193 Cb -0.54 -2.46 1.32 0.00 0.52 0.00 0.00 34.95 33.80 1ivr s ARG 193 CO 0.57 0.10 1.45 0.94 0.02 0.00 0.00 175.30 178.38 1ivr n GLN 194 N -0.11 -0.04 0.18 3.54 7.27 -1.26 0.19 117.38 127.15 1ivr n GLN 194 Ca 0.05 1.21 -0.14 0.00 0.07 0.00 0.00 57.00 58.19 1ivr n GLN 194 Cb 0.52 -2.29 -0.08 0.00 2.41 0.00 0.00 30.24 30.80 1ivr n GLN 194 CO 0.00 0.00 0.00 0.93 0.07 0.00 0.00 177.06 178.06 1ivr h GLU 195 N 0.00 -0.40 -0.73 3.69 3.07 -1.99 0.77 114.58 118.98 1ivr h GLU 195 Ca 0.80 0.03 -0.00 0.00 -0.50 0.00 0.00 59.36 59.69 1ivr h GLU 195 Cb 2.38 0.09 -0.04 0.00 -0.84 0.00 0.00 28.75 30.34 1ivr h GLU 195 CO -0.56 -0.18 0.44 1.96 -1.40 0.00 0.00 179.01 179.27 1ivr h GLN 196 N -0.55 1.00 -0.53 2.33 4.20 0.18 -1.88 115.11 119.85 1ivr h GLN 196 Ca -0.04 -0.09 -0.01 0.00 0.06 0.00 0.00 58.65 58.57 1ivr h GLN 196 Cb 0.40 -0.21 -0.03 0.00 0.30 0.00 0.00 27.48 27.95 1ivr h GLN 196 CO 0.07 0.71 0.31 -1.49 -0.67 0.00 0.00 178.83 177.76 1ivr h TRP 197 N 1.00 0.71 0.00 2.96 4.06 -0.80 -2.00 115.95 121.89 1ivr h TRP 197 Ca 0.26 -0.01 -0.03 0.00 2.06 0.00 0.00 58.89 61.17 1ivr h TRP 197 Cb -0.03 -0.23 -0.00 0.00 -1.00 0.00 0.00 29.16 27.89 1ivr h TRP 197 CO -0.01 0.50 -0.16 0.87 -3.56 0.00 0.00 178.44 176.08 1ivr h LYS 198 N 0.72 0.00 -0.23 0.49 1.57 -0.01 -1.87 116.57 117.24 1ivr h LYS 198 Ca 0.19 0.00 -0.16 0.00 -1.87 0.00 0.00 60.65 58.81 1ivr h LYS 198 Cb 0.01 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.32 1ivr h LYS 198 CO -0.03 0.16 -0.50 1.49 -0.57 0.00 0.00 179.45 180.00 1ivr h GLU 199 N 0.00 0.74 -0.63 3.15 4.57 -1.17 -3.13 114.58 118.11 1ivr h GLU 199 Ca -0.00 -0.49 -0.03 0.00 -1.18 0.00 0.00 59.36 57.66 1ivr h GLU 199 Cb 0.30 0.07 -0.03 0.00 -0.16 0.00 0.00 28.75 28.93 1ivr h GLU 199 CO 0.02 1.11 0.28 -0.07 -1.18 0.00 0.00 179.01 179.17 1ivr h LEU 200 N 0.46 0.84 -0.51 1.64 3.38 -1.00 -2.39 115.31 117.73 1ivr h LEU 200 Ca 0.00 -0.15 0.10 0.00 0.09 0.00 0.00 57.88 57.93 1ivr h LEU 200 Cb 1.11 -0.22 -0.10 0.00 0.09 0.00 0.00 40.66 41.54 1ivr h LEU 200 CO 0.11 0.75 -0.23 0.00 0.09 0.00 0.00 178.44 179.16 1ivr h ALA 201 N 1.12 0.14 0.10 1.53 0.00 -1.35 0.24 119.26 121.04 1ivr h ALA 201 Ca 0.21 0.18 0.02 0.00 0.00 0.00 0.00 54.91 55.32 1ivr h ALA 201 Cb 0.15 0.57 -0.03 0.00 0.00 0.00 0.00 17.79 18.48 1ivr h ALA 201 CO -0.02 -0.56 -0.25 0.77 0.00 0.00 0.00 179.25 179.19 1ivr h SER 202 N -0.11 -0.71 -0.60 0.00 0.02 -1.39 -0.64 113.55 110.11 1ivr h SER 202 Ca 0.24 0.08 -0.06 0.00 -0.84 0.00 0.00 61.79 61.22 1ivr h SER 202 Cb 0.48 0.27 -0.02 0.00 0.14 0.00 0.00 62.40 63.27 1ivr h SER 202 CO -0.58 -0.34 0.16 0.58 -1.14 0.00 0.00 176.83 175.51 1ivr h VAL 203 N -0.45 1.25 -0.18 2.27 2.07 -0.89 0.16 116.25 120.47 1ivr h VAL 203 Ca 0.03 -0.88 0.00 0.00 0.82 0.00 0.00 66.70 66.67 1ivr h VAL 203 Cb 0.48 0.68 -0.01 0.00 -1.52 0.00 0.00 31.29 30.92 1ivr h VAL 203 CO -0.15 0.33 0.11 0.58 0.02 0.00 0.00 177.57 178.46 1ivr h VAL 204 N 0.87 1.06 -0.02 2.57 2.07 -0.69 0.32 116.25 122.42 1ivr h VAL 204 Ca 0.19 -0.12 -0.00 0.00 0.82 0.00 0.00 66.70 67.59 1ivr h VAL 204 Cb 0.33 0.82 -0.00 0.00 -1.52 0.00 0.00 31.29 30.92 1ivr h VAL 204 CO -0.00 0.06 0.01 0.50 0.02 0.00 0.00 177.57 178.16 1ivr h LYS 205 N 0.23 0.03 -0.73 1.57 1.63 -1.01 -0.16 116.57 118.14 1ivr h LYS 205 Ca 0.07 -0.00 -0.01 0.00 -0.85 0.00 0.00 60.65 59.85 1ivr h LYS 205 Cb -0.01 -0.01 -0.03 0.00 -0.60 0.00 0.00 32.23 31.58 1ivr h LYS 205 CO -0.01 0.08 0.40 -0.22 -3.45 0.00 0.00 179.45 176.24 1ivr h LYS 206 N -0.02 1.00 -0.01 1.90 1.63 -0.40 -2.26 116.57 118.41 1ivr h LYS 206 Ca 0.01 -0.11 0.00 0.00 -0.85 0.00 0.00 60.65 59.70 1ivr h LYS 206 Cb 0.05 -0.20 0.00 0.00 -0.60 0.00 0.00 32.23 31.48 1ivr h LYS 206 CO -0.00 0.73 -0.23 0.54 -3.45 0.00 0.00 179.45 177.04 1ivr n ARG 207 N -4.36 0.71 -3.21 1.90 5.12 0.11 -4.96 116.66 111.96 1ivr n ARG 207 Ca 0.07 -0.37 -0.15 0.00 -1.93 0.00 0.00 57.85 55.48 1ivr n ARG 207 Cb 0.09 -1.49 0.08 0.00 -1.16 0.00 0.00 32.46 29.98 1ivr n ARG 207 CO 0.00 0.00 0.00 -1.71 -1.93 0.00 0.00 177.63 173.99 1ivr n ASN 208 N -0.83 -3.12 -4.91 0.55 4.05 -0.10 -3.17 115.26 107.72 1ivr n ASN 208 Ca 0.12 -0.57 -0.30 0.00 0.45 0.00 0.00 54.58 54.28 1ivr n ASN 208 Cb 0.33 -4.64 -0.04 0.00 1.23 0.00 0.00 39.78 36.66 1ivr n ASN 208 CO 0.00 0.00 0.00 -0.76 -3.05 0.00 0.00 177.26 173.45 1ivr s LEU 209 N -5.68 4.27 -0.33 1.20 1.43 -0.99 0.21 118.68 118.79 1ivr s LEU 209 Ca 0.11 0.44 -0.25 0.00 -1.03 0.00 0.00 54.13 53.40 1ivr s LEU 209 Cb -0.01 -3.18 0.01 0.00 0.03 0.00 0.00 46.19 43.03 1ivr s LEU 209 CO 0.65 0.03 0.88 -0.22 0.23 0.00 0.00 176.35 177.93 1ivr s LEU 210 N -2.92 4.04 -0.24 1.79 2.96 0.47 -4.84 118.68 119.95 1ivr s LEU 210 Ca 0.39 0.71 -0.18 0.00 -0.22 0.00 0.00 54.13 54.83 1ivr s LEU 210 Cb -0.12 -3.22 -0.03 0.00 0.50 0.00 0.00 46.19 43.33 1ivr s LEU 210 CO 0.27 -0.73 0.51 0.00 -1.32 0.00 0.00 176.35 175.08 1ivr s ALA 211 N 3.23 3.58 -0.24 5.97 0.00 -1.26 -0.65 121.76 132.39 1ivr s ALA 211 Ca 0.36 -0.54 -0.01 0.00 0.00 0.00 0.00 51.96 51.78 1ivr s ALA 211 Cb -0.13 -2.86 0.03 0.00 0.00 0.00 0.00 23.12 20.16 1ivr s ALA 211 CO 0.15 -0.64 -0.08 -0.47 0.00 0.00 0.00 175.76 174.71 1ivr s TYR 212 N 2.09 3.05 -0.18 0.00 6.14 0.10 -1.71 117.35 126.85 1ivr s TYR 212 Ca 0.22 -1.64 -0.16 0.00 0.64 0.00 0.00 57.07 56.13 1ivr s TYR 212 Cb -0.16 -2.03 -0.04 0.00 0.42 0.00 0.00 41.96 40.15 1ivr s TYR 212 CO 0.09 -0.75 0.40 -0.06 0.64 0.00 0.00 175.55 175.87 1ivr s PHE 213 N 1.30 3.42 -0.28 4.97 0.08 -0.77 0.49 117.98 127.18 1ivr s PHE 213 Ca -0.00 0.68 -0.08 0.00 0.12 0.00 0.00 56.93 57.64 1ivr s PHE 213 Cb -0.17 -2.51 -0.01 0.00 -0.57 0.00 0.00 43.02 39.76 1ivr s PHE 213 CO -0.05 0.06 0.11 0.34 -0.10 0.00 0.00 175.22 175.58 1ivr s ASP 214 N 0.86 5.33 -0.59 1.36 2.15 -0.73 -0.97 116.67 124.07 1ivr s ASP 214 Ca 0.20 -0.41 0.05 0.00 0.43 0.00 0.00 52.55 52.83 1ivr s ASP 214 Cb -0.15 -1.95 0.18 0.00 -0.30 0.00 0.00 42.92 40.70 1ivr s ASP 214 CO 0.08 -0.12 0.47 0.80 -0.17 0.00 0.00 175.17 176.23 1ivr n MET 215 N 4.94 1.32 0.04 4.34 0.00 0.25 -0.58 117.12 127.43 1ivr n MET 215 Ca -0.15 -4.03 0.11 0.00 -0.00 0.00 0.00 57.70 53.64 1ivr n MET 215 Cb 0.50 -2.03 -0.04 0.00 0.00 0.00 0.00 33.22 31.64 1ivr n MET 215 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 1ivr n ALA 216 N 2.10 3.05 -1.27 -5.12 0.00 -1.26 -3.17 120.51 114.84 1ivr n ALA 216 Ca 0.24 -0.40 0.05 0.00 0.00 0.00 0.00 53.44 53.33 1ivr n ALA 216 Cb 0.41 -0.94 0.20 0.00 0.00 0.00 0.00 19.45 19.12 1ivr n ALA 216 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1ivr n TYR 217 N -2.22 0.51 -1.53 0.00 4.01 -1.26 -4.63 117.16 112.05 1ivr n TYR 217 Ca -0.00 -1.24 -0.44 0.00 -0.16 0.00 0.00 57.90 56.06 1ivr n TYR 217 Cb 0.50 -0.30 -0.05 0.00 -0.31 0.00 0.00 39.34 39.18 1ivr n TYR 217 CO 0.00 0.00 0.00 0.94 -0.46 0.00 0.00 176.86 177.34 1ivr n GLN 218 N -1.07 1.32 0.00 -0.72 7.27 -1.26 -0.67 117.38 122.24 1ivr n GLN 218 Ca 0.23 0.29 0.00 0.00 0.07 0.00 0.00 57.00 57.59 1ivr n GLN 218 Cb 0.82 -2.90 0.00 0.00 2.41 0.00 0.00 30.24 30.57 1ivr n GLN 218 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 1ivr n GLY 219 N 6.15 0.79 0.00 1.69 0.00 -1.26 -4.75 105.19 107.82 1ivr n GLY 219 Ca 0.38 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.49 1ivr n GLY 219 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1ivr n PHE 220 N -1.56 0.00 0.07 1.61 3.72 0.15 -3.25 117.46 118.21 1ivr n PHE 220 Ca 0.00 0.00 -0.23 0.00 -0.05 0.00 0.00 57.45 57.17 1ivr n PHE 220 Cb 0.00 -0.20 -0.15 0.00 -0.94 0.00 0.00 39.48 38.19 1ivr n PHE 220 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1ivr h ALA 221 N 2.07 0.15 0.00 4.37 0.00 -1.93 -3.21 119.26 120.71 1ivr h ALA 221 Ca 0.00 -1.14 0.00 0.00 0.00 0.00 0.00 54.91 53.77 1ivr h ALA 221 Cb 0.62 0.46 0.00 0.00 0.00 0.00 0.00 17.79 18.86 1ivr h ALA 221 CO 0.00 1.02 -0.05 -1.13 0.00 0.00 0.00 179.25 179.09 1ivr n SER 222 N -3.59 0.25 0.00 0.00 3.41 -1.26 -4.63 113.62 107.79 1ivr n SER 222 Ca -0.25 -0.22 0.00 0.00 -0.26 0.00 0.00 58.87 58.14 1ivr n SER 222 Cb 1.08 0.49 0.00 0.00 -0.26 0.00 0.00 64.21 65.52 1ivr n SER 222 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1ivr n GLY 223 N 0.57 0.74 2.99 5.00 0.00 -1.20 -5.04 105.19 108.24 1ivr n GLY 223 Ca 0.00 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.74 1ivr n GLY 223 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1ivr s ASP 224 N -2.39 2.44 0.04 1.61 -1.08 -1.26 -4.27 116.67 111.76 1ivr s ASP 224 Ca 0.00 -0.41 -0.23 0.00 -0.52 0.00 0.00 52.55 51.39 1ivr s ASP 224 Cb 0.00 -1.04 -0.16 0.00 -1.46 0.00 0.00 42.92 40.26 1ivr s ASP 224 CO 0.00 -0.06 1.47 0.16 0.52 0.00 0.00 175.17 177.26 1ivr h ILE 225 N 6.07 1.24 -0.44 4.11 3.07 -1.90 -2.25 117.51 127.41 1ivr h ILE 225 Ca -0.34 -0.75 0.02 0.00 1.55 0.00 0.00 64.86 65.34 1ivr h ILE 225 Cb 1.14 1.63 -0.03 0.00 -0.27 0.00 0.00 36.82 39.30 1ivr h ILE 225 CO 0.48 0.21 0.27 0.78 -1.05 0.00 0.00 178.15 178.84 1ivr h ASN 226 N -0.18 0.44 -0.46 2.16 4.21 -1.97 -0.46 115.58 119.32 1ivr h ASN 226 Ca 0.02 0.00 0.01 0.00 1.21 0.00 0.00 56.30 57.54 1ivr h ASN 226 Cb 0.32 -0.09 -0.02 0.00 -1.12 0.00 0.00 38.32 37.41 1ivr h ASN 226 CO 0.00 0.32 0.31 -0.09 -1.29 0.00 0.00 177.43 176.68 1ivr h ARG 227 N 0.54 0.58 0.00 0.81 2.43 -1.99 -2.29 114.38 114.46 1ivr h ARG 227 Ca 0.17 -0.03 0.00 0.00 -0.81 0.00 0.00 59.98 59.31 1ivr h ARG 227 Cb -0.00 -0.13 0.00 0.00 -0.42 0.00 0.00 29.97 29.42 1ivr h ARG 227 CO -0.07 0.38 0.00 -0.44 -1.51 0.00 0.00 179.97 178.33 1ivr h ASP 228 N 0.60 0.00 -0.39 -3.80 5.19 -0.49 -2.90 116.42 114.63 1ivr h ASP 228 Ca 0.17 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.58 1ivr h ASP 228 Cb -0.03 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.48 1ivr h ASP 228 CO -0.04 0.00 0.00 0.00 -3.12 0.00 0.00 179.24 176.08 1ivr n ALA 229 N -1.96 2.43 -0.16 3.45 0.00 -0.70 -4.54 120.51 119.02 1ivr n ALA 229 Ca 0.03 -0.95 -0.08 0.00 0.00 0.00 0.00 53.44 52.44 1ivr n ALA 229 Cb 0.39 -0.91 -0.03 0.00 0.00 0.00 0.00 19.45 18.90 1ivr n ALA 229 CO 0.00 0.00 0.00 2.35 0.00 0.00 0.00 177.50 179.85 1ivr h TRP 230 N 4.15 -1.17 -0.62 0.00 7.01 -1.30 -2.29 115.95 121.74 1ivr h TRP 230 Ca 0.00 0.07 0.08 0.00 2.11 0.00 0.00 58.89 61.15 1ivr h TRP 230 Cb 0.92 0.58 -0.06 0.00 -2.10 0.00 0.00 29.16 28.50 1ivr h TRP 230 CO 0.25 -0.42 0.28 0.00 -2.79 0.00 0.00 178.44 175.76 1ivr h ALA 231 N 0.62 0.81 -0.12 2.65 0.00 -1.83 2.10 119.26 123.49 1ivr h ALA 231 Ca 0.17 0.05 -0.04 0.00 0.00 0.00 0.00 54.91 55.09 1ivr h ALA 231 Cb 0.57 -0.02 -0.00 0.00 0.00 0.00 0.00 17.79 18.33 1ivr h ALA 231 CO -0.63 -0.10 -0.08 1.25 0.00 0.00 0.00 179.25 179.69 1ivr h LEU 232 N 0.51 0.28 -1.10 0.00 5.85 -1.85 -2.54 115.31 116.47 1ivr h LEU 232 Ca 0.30 -0.44 -0.09 0.00 0.84 0.00 0.00 57.88 58.49 1ivr h LEU 232 Cb 0.29 -0.08 -0.01 0.00 0.37 0.00 0.00 40.66 41.23 1ivr h LEU 232 CO -0.25 0.66 -0.43 0.03 -0.34 0.00 0.00 178.44 178.12 1ivr h ARG 233 N -0.09 0.00 -0.22 1.25 3.08 -0.84 -1.85 114.38 115.70 1ivr h ARG 233 Ca 0.02 0.00 -0.08 0.00 0.07 0.00 0.00 59.98 60.00 1ivr h ARG 233 Cb 0.57 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.60 1ivr h ARG 233 CO 0.02 0.43 -0.20 1.25 -1.07 0.00 0.00 179.97 180.40 1ivr h HIS 234 N 0.00 0.43 -0.11 3.04 2.76 0.37 -0.99 115.15 120.65 1ivr h HIS 234 Ca -0.00 -0.08 -0.01 0.00 -2.20 0.00 0.00 60.37 58.08 1ivr h HIS 234 Cb 0.81 -0.11 -0.00 0.00 1.55 0.00 0.00 27.41 29.65 1ivr h HIS 234 CO 0.00 0.58 0.04 0.74 -1.30 0.00 0.00 177.93 177.99 1ivr h PHE 235 N 0.36 0.17 -0.47 5.26 -1.00 -0.93 -1.91 116.94 118.42 1ivr h PHE 235 Ca 0.06 -0.01 -0.08 0.00 2.81 0.00 0.00 57.97 60.74 1ivr h PHE 235 Cb 0.57 -0.05 -0.02 0.00 3.61 0.00 0.00 35.95 40.06 1ivr h PHE 235 CO 0.02 0.28 -0.03 0.82 -1.61 0.00 0.00 178.31 177.79 1ivr h ILE 236 N 0.02 1.27 0.00 -0.55 2.04 -1.41 0.33 117.51 119.21 1ivr h ILE 236 Ca 0.04 -1.10 0.00 0.00 1.00 0.00 0.00 64.86 64.79 1ivr h ILE 236 Cb 0.18 1.04 0.00 0.00 -0.74 0.00 0.00 36.82 37.30 1ivr h ILE 236 CO -0.00 0.38 0.00 1.05 0.00 0.00 0.00 178.15 179.58 1ivr h GLU 237 N 0.69 0.00 0.00 2.37 4.11 -1.06 -0.59 114.58 120.10 1ivr h GLU 237 Ca 0.13 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.56 1ivr h GLU 237 Cb 0.54 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.79 1ivr h GLU 237 CO 0.03 0.00 0.00 1.04 0.07 0.00 0.00 179.01 180.15 1ivr n GLN 238 N -2.57 0.09 -0.01 1.06 1.13 -0.73 -4.88 117.38 111.47 1ivr n GLN 238 Ca 0.01 0.12 0.00 0.00 -1.94 0.00 0.00 57.00 55.20 1ivr n GLN 238 Cb 0.25 -1.62 0.00 0.00 0.11 0.00 0.00 30.24 28.99 1ivr n GLN 238 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1ivr n GLY 239 N 1.15 0.99 3.65 1.08 0.00 -0.23 -5.06 105.19 106.76 1ivr n GLY 239 Ca 0.06 -0.01 -0.39 0.00 0.00 0.00 0.00 46.02 45.68 1ivr n GLY 239 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1ivr s ILE 240 N -2.00 5.16 -0.49 -0.61 1.01 0.05 -5.01 121.20 119.30 1ivr s ILE 240 Ca 0.00 0.75 -0.18 0.00 0.00 0.00 0.00 60.65 61.22 1ivr s ILE 240 Cb 0.00 -3.76 0.05 0.00 0.01 0.00 0.00 42.46 38.77 1ivr s ILE 240 CO 0.00 0.20 0.56 -1.81 0.00 0.00 0.00 174.94 173.89 1ivr s ASP 241 N 1.25 6.21 0.49 3.58 1.01 -1.26 -3.61 116.67 124.33 1ivr s ASP 241 Ca 0.19 -0.93 0.07 0.00 0.71 0.00 0.00 52.55 52.59 1ivr s ASP 241 Cb -0.15 -2.26 0.02 0.00 1.01 0.00 0.00 42.92 41.53 1ivr s ASP 241 CO 0.09 -0.81 0.46 0.68 0.21 0.00 0.00 175.17 175.80 1ivr s VAL 242 N 2.40 2.25 0.22 -1.27 -7.23 -1.26 -4.46 120.40 111.05 1ivr s VAL 242 Ca 0.13 -1.32 0.10 0.00 -1.81 0.00 0.00 61.98 59.07 1ivr s VAL 242 Cb -0.20 -2.57 -0.05 0.00 0.56 0.00 0.00 36.38 34.12 1ivr s VAL 242 CO 0.11 0.00 -0.18 0.68 -0.31 0.00 0.00 175.10 175.40 1ivr s VAL 243 N -2.60 2.06 0.08 1.32 -7.23 -0.69 -2.28 120.40 111.05 1ivr s VAL 243 Ca 0.46 -2.18 -0.12 0.00 -1.81 0.00 0.00 61.98 58.33 1ivr s VAL 243 Cb -0.03 -2.08 0.01 0.00 0.56 0.00 0.00 36.38 34.84 1ivr s VAL 243 CO 0.28 -0.41 0.27 -0.22 -0.31 0.00 0.00 175.10 174.70 1ivr s LEU 244 N -3.15 1.03 -0.08 1.32 2.96 0.94 -1.85 118.68 119.85 1ivr s LEU 244 Ca 0.23 -0.41 0.03 0.00 -0.22 0.00 0.00 54.13 53.76 1ivr s LEU 244 Cb -0.04 1.30 0.01 0.00 0.50 0.00 0.00 46.19 47.96 1ivr s LEU 244 CO 0.10 -0.70 -0.15 -0.55 -1.32 0.00 0.00 176.35 173.72 1ivr s SER 245 N -2.52 2.20 0.00 3.68 0.15 -0.15 -0.67 113.70 116.40 1ivr s SER 245 Ca 0.00 -0.38 0.07 0.00 0.70 0.00 0.00 55.95 56.34 1ivr s SER 245 Cb 0.02 -1.01 -0.02 0.00 -1.71 0.00 0.00 66.02 63.30 1ivr s SER 245 CO -0.08 0.06 -0.22 -1.10 1.20 0.00 0.00 173.24 173.10 1ivr s GLN 246 N 0.66 1.67 -0.05 5.44 -0.21 -0.74 -0.58 119.66 125.85 1ivr s GLN 246 Ca -0.14 -0.85 0.06 0.00 0.02 0.00 0.00 55.36 54.45 1ivr s GLN 246 Cb -0.16 -1.68 -0.01 0.00 1.00 0.00 0.00 33.01 32.16 1ivr s GLN 246 CO 0.04 0.45 -0.22 0.45 -2.12 0.00 0.00 175.29 173.89 1ivr s SER 247 N -0.74 2.67 0.00 5.90 0.15 -1.19 -0.25 113.70 120.23 1ivr s SER 247 Ca 0.08 -0.44 0.11 0.00 0.70 0.00 0.00 55.95 56.41 1ivr s SER 247 Cb -0.09 -0.66 0.28 0.00 -1.71 0.00 0.00 66.02 63.85 1ivr s SER 247 CO 0.00 0.22 1.21 -1.22 1.20 0.00 0.00 173.24 174.65 1ivr n TYR 248 N 2.94 0.41 -0.11 3.44 4.01 -1.06 -4.66 117.16 122.13 1ivr n TYR 248 Ca -0.17 -0.43 -0.07 0.00 -0.16 0.00 0.00 57.90 57.07 1ivr n TYR 248 Cb 0.52 -0.02 0.01 0.00 -0.31 0.00 0.00 39.34 39.54 1ivr n TYR 248 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1ivr h ALA 249 N 2.10 0.45 0.00 -0.72 0.00 -1.84 -2.32 119.26 116.92 1ivr h ALA 249 Ca 0.00 0.02 -0.09 0.00 0.00 0.00 0.00 54.91 54.84 1ivr h ALA 249 Cb 0.70 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.45 1ivr h ALA 249 CO 0.00 -0.21 -0.78 0.87 0.00 0.00 0.00 179.25 179.13 1ivr h LYS 250 N 0.35 0.00 0.00 0.00 6.56 -1.83 -2.21 116.57 119.45 1ivr h LYS 250 Ca 0.16 0.00 -0.05 0.00 -1.06 0.00 0.00 60.65 59.70 1ivr h LYS 250 Cb 0.09 0.00 -0.01 0.00 -0.57 0.00 0.00 32.23 31.74 1ivr h LYS 250 CO -0.13 0.41 -0.24 -2.95 -2.06 0.00 0.00 179.45 174.48 1ivr h ASN 251 N -1.00 0.00 -0.01 0.86 7.08 -1.83 -2.95 115.58 117.74 1ivr h ASN 251 Ca -0.14 0.00 0.00 0.00 -3.08 0.00 0.00 56.30 53.08 1ivr h ASN 251 Cb 0.81 0.00 0.00 0.00 -2.08 0.00 0.00 38.32 37.05 1ivr h ASN 251 CO -0.08 0.24 -0.14 0.23 -2.08 0.00 0.00 177.43 175.60 1ivr n MET 252 N -3.92 1.44 -3.67 4.14 2.81 -0.88 -4.86 117.12 112.18 1ivr n MET 252 Ca -0.02 -0.92 -0.25 0.00 -1.81 0.00 0.00 57.70 54.70 1ivr n MET 252 Cb 0.32 -1.19 0.06 0.00 -0.71 0.00 0.00 33.22 31.71 1ivr n MET 252 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1ivr n GLY 253 N 0.86 -0.50 1.62 3.03 0.00 -0.85 -4.65 105.19 104.70 1ivr n GLY 253 Ca 0.06 0.22 0.06 0.00 0.00 0.00 0.00 46.02 46.36 1ivr n GLY 253 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1ivr n LEU 254 N -4.80 4.81 0.00 0.99 4.77 -1.10 -4.86 117.00 116.81 1ivr n LEU 254 Ca -0.03 -2.44 0.00 0.00 -0.03 0.00 0.00 56.01 53.51 1ivr n LEU 254 Cb 0.57 -0.63 0.00 0.00 -2.33 0.00 0.00 43.42 41.03 1ivr n LEU 254 CO 0.68 0.60 0.03 -1.22 -1.33 0.00 0.00 177.39 176.15 1ivr n TYR 255 N 0.62 0.00 1.93 -1.77 4.01 -1.21 -1.83 117.16 118.91 1ivr n TYR 255 Ca 0.23 0.00 0.11 0.00 -0.16 0.00 0.00 57.90 58.08 1ivr n TYR 255 Cb 0.99 0.00 0.64 0.00 -0.31 0.00 0.00 39.34 40.66 1ivr n TYR 255 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1ivr n GLY 256 N -0.51 -0.96 0.14 2.72 0.00 -1.26 -2.99 105.19 102.32 1ivr n GLY 256 Ca 0.00 -0.14 0.12 0.00 0.00 0.00 0.00 46.02 46.00 1ivr n GLY 256 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1ivr h GLU 257 N 0.00 0.00 -5.56 1.61 4.39 -1.75 -3.50 114.58 109.77 1ivr h GLU 257 Ca 0.00 0.00 -0.08 0.00 0.34 0.00 0.00 59.36 59.62 1ivr h GLU 257 Cb 0.00 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.65 1ivr h GLU 257 CO 0.00 0.00 -0.61 0.54 -1.16 0.00 0.00 179.01 177.78 1ivr n ARG 258 N -2.67 -2.20 -5.10 2.33 5.12 -1.15 -4.43 116.66 108.55 1ivr n ARG 258 Ca 0.02 1.92 -0.32 0.00 -1.93 0.00 0.00 57.85 57.54 1ivr n ARG 258 Cb 0.51 -4.94 -0.16 0.00 -1.16 0.00 0.00 32.46 26.72 1ivr n ARG 258 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 1ivr s ALA 259 N -2.43 2.31 0.18 7.54 0.00 -1.26 -4.13 121.76 123.97 1ivr s ALA 259 Ca 0.25 -0.97 -0.14 0.00 0.00 0.00 0.00 51.96 51.10 1ivr s ALA 259 Cb -0.06 -0.88 0.05 0.00 0.00 0.00 0.00 23.12 22.23 1ivr s ALA 259 CO 0.79 0.33 0.70 0.41 0.00 0.00 0.00 175.76 177.99 1ivr n GLY 260 N 3.29 0.94 3.32 0.00 0.00 -1.01 -2.58 105.19 109.14 1ivr n GLY 260 Ca -0.18 -1.12 -0.14 0.00 0.00 0.00 0.00 46.02 44.57 1ivr n GLY 260 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ivr s ALA 261 N -1.77 -1.06 -0.11 4.61 0.00 0.66 -2.31 121.76 121.79 1ivr s ALA 261 Ca 0.15 0.73 0.03 0.00 0.00 0.00 0.00 51.96 52.88 1ivr s ALA 261 Cb -0.03 -0.12 -0.00 0.00 0.00 0.00 0.00 23.12 22.97 1ivr s ALA 261 CO 0.06 -0.27 -0.22 0.12 0.00 0.00 0.00 175.76 175.45 1ivr s PHE 262 N -0.95 2.61 0.01 0.00 5.36 0.10 -1.79 117.98 123.32 1ivr s PHE 262 Ca -0.10 -1.01 0.08 0.00 -0.96 0.00 0.00 56.93 54.95 1ivr s PHE 262 Cb -0.04 -1.74 -0.02 0.00 -0.34 0.00 0.00 43.02 40.88 1ivr s PHE 262 CO 0.05 -0.40 -0.26 0.99 -1.46 0.00 0.00 175.22 174.14 1ivr s THR 263 N 0.39 2.05 -0.13 0.12 2.01 0.15 0.02 115.64 120.25 1ivr s THR 263 Ca -0.16 -1.22 0.02 0.00 0.31 0.00 0.00 61.69 60.64 1ivr s THR 263 Cb -0.17 -1.73 0.01 0.00 0.01 0.00 0.00 72.50 70.62 1ivr s THR 263 CO 0.07 0.47 -0.19 -0.69 -0.69 0.00 0.00 174.62 173.59 1ivr s VAL 264 N -0.69 1.83 -0.28 3.82 1.01 0.18 -0.04 120.40 126.23 1ivr s VAL 264 Ca 0.11 -0.84 -0.23 0.00 0.00 0.00 0.00 61.98 61.01 1ivr s VAL 264 Cb -0.10 -1.64 -0.01 0.00 0.00 0.00 0.00 36.38 34.64 1ivr s VAL 264 CO 0.00 0.51 0.75 -0.63 0.00 0.00 0.00 175.10 175.73 1ivr s ILE 265 N 0.89 4.85 0.52 2.22 -1.09 -0.97 -1.88 121.20 125.74 1ivr s ILE 265 Ca -0.07 1.23 0.05 0.00 -2.23 0.00 0.00 60.65 59.63 1ivr s ILE 265 Cb -0.15 -4.09 0.02 0.00 -1.58 0.00 0.00 42.46 36.66 1ivr s ILE 265 CO -0.02 -0.15 0.30 0.00 -1.23 0.00 0.00 174.94 173.84 1ivr h ARG 267 N 0.95 0.44 0.00 0.00 1.12 -1.95 -3.45 114.38 111.50 1ivr h ARG 267 Ca -0.39 -0.73 -0.24 0.00 -1.11 0.00 0.00 59.98 57.52 1ivr h ARG 267 Cb 1.30 0.27 -0.06 0.00 -0.01 0.00 0.00 29.97 31.46 1ivr h ARG 267 CO 0.62 1.34 -0.19 -0.25 -3.11 0.00 0.00 179.97 178.38 1ivr n ASP 268 N -3.66 -0.69 0.03 -3.80 9.92 -1.26 -4.96 116.55 112.13 1ivr n ASP 268 Ca -0.13 -2.31 -0.12 0.00 -0.53 0.00 0.00 54.79 51.70 1ivr n ASP 268 Cb 1.05 1.39 -0.00 0.00 -0.64 0.00 0.00 41.12 42.93 1ivr n ASP 268 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1ivr h ALA 269 N 1.76 0.51 -0.20 2.24 0.00 -1.80 -3.18 119.26 118.60 1ivr h ALA 269 Ca -0.16 -0.61 -0.06 0.00 0.00 0.00 0.00 54.91 54.08 1ivr h ALA 269 Cb 0.77 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.51 1ivr h ALA 269 CO 0.23 0.74 -0.10 1.49 0.00 0.00 0.00 179.25 181.62 1ivr h GLU 270 N 0.35 0.41 -0.48 0.00 4.57 -1.96 -1.04 114.58 116.43 1ivr h GLU 270 Ca -0.04 -0.18 -0.04 0.00 -1.18 0.00 0.00 59.36 57.92 1ivr h GLU 270 Cb 1.34 -0.01 -0.02 0.00 -0.16 0.00 0.00 28.75 29.90 1ivr h GLU 270 CO 0.14 0.71 0.14 1.49 -1.18 0.00 0.00 179.01 180.30 1ivr h GLU 271 N 0.11 0.72 0.01 1.92 4.81 -1.96 -1.87 114.58 118.32 1ivr h GLU 271 Ca 0.04 -0.13 -0.00 0.00 -0.13 0.00 0.00 59.36 59.15 1ivr h GLU 271 Cb 0.58 -0.12 0.00 0.00 0.63 0.00 0.00 28.75 29.84 1ivr h GLU 271 CO 0.03 0.64 -0.01 0.00 -0.73 0.00 0.00 179.01 178.94 1ivr h ALA 272 N 1.45 -0.02 -0.82 2.92 0.00 -1.50 0.27 119.26 121.57 1ivr h ALA 272 Ca 0.16 -0.02 0.07 0.00 0.00 0.00 0.00 54.91 55.12 1ivr h ALA 272 Cb 0.23 0.01 -0.05 0.00 0.00 0.00 0.00 17.79 17.97 1ivr h ALA 272 CO -0.01 -0.49 0.54 0.87 0.00 0.00 0.00 179.25 180.16 1ivr h LYS 273 N -0.05 0.87 0.00 0.00 1.57 -0.34 -2.60 116.57 116.03 1ivr h LYS 273 Ca -0.00 -0.05 -0.19 0.00 -1.87 0.00 0.00 60.65 58.53 1ivr h LYS 273 Cb 0.05 -0.20 -0.03 0.00 0.08 0.00 0.00 32.23 32.13 1ivr h LYS 273 CO 0.00 0.58 -1.00 0.00 -0.57 0.00 0.00 179.45 178.46 1ivr h ARG 274 N 0.90 0.00 0.00 3.15 3.08 -1.21 -3.26 114.38 117.03 1ivr h ARG 274 Ca 0.36 0.00 -0.09 0.00 0.07 0.00 0.00 59.98 60.31 1ivr h ARG 274 Cb 0.24 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.28 1ivr h ARG 274 CO -0.13 0.78 -0.45 0.28 -1.07 0.00 0.00 179.97 179.38 1ivr h VAL 275 N 0.00 0.98 -0.19 2.04 2.07 -0.67 -3.07 116.25 117.41 1ivr h VAL 275 Ca -0.05 -1.76 -0.03 0.00 0.82 0.00 0.00 66.70 65.68 1ivr h VAL 275 Cb 1.70 2.05 -0.01 0.00 -1.52 0.00 0.00 31.29 33.52 1ivr h VAL 275 CO 0.10 0.44 -0.01 -0.08 0.02 0.00 0.00 177.57 178.04 1ivr h GLU 276 N 0.00 0.35 -0.38 1.57 4.57 -1.53 -1.91 114.58 117.25 1ivr h GLU 276 Ca -0.00 -0.12 0.02 0.00 -1.18 0.00 0.00 59.36 58.07 1ivr h GLU 276 Cb 1.02 -0.03 -0.03 0.00 -0.16 0.00 0.00 28.75 29.55 1ivr h GLU 276 CO 0.06 0.57 0.22 0.66 -1.18 0.00 0.00 179.01 179.34 1ivr h SER 277 N 0.10 0.35 0.90 1.04 4.64 -1.59 -1.13 113.55 117.85 1ivr h SER 277 Ca 0.05 0.01 -0.09 0.00 -0.47 0.00 0.00 61.79 61.29 1ivr h SER 277 Cb 0.42 -0.07 -0.01 0.00 -0.31 0.00 0.00 62.40 62.43 1ivr h SER 277 CO 0.01 0.25 -0.44 1.56 -0.87 0.00 0.00 176.83 177.35 1ivr h GLN 278 N 0.44 0.00 -0.00 4.77 1.08 -1.53 -2.40 115.11 117.47 1ivr h GLN 278 Ca 0.15 0.00 -0.19 0.00 -1.45 0.00 0.00 58.65 57.16 1ivr h GLN 278 Cb 0.01 0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 27.43 1ivr h GLN 278 CO -0.08 0.44 -0.84 -0.07 -0.95 0.00 0.00 178.83 177.33 1ivr h LEU 279 N 0.00 0.19 -0.03 1.46 3.38 -0.38 -3.14 115.31 116.78 1ivr h LEU 279 Ca -0.00 -0.15 -0.01 0.00 0.09 0.00 0.00 57.88 57.81 1ivr h LEU 279 Cb 1.00 -0.06 -0.00 0.00 0.09 0.00 0.00 40.66 41.70 1ivr h LEU 279 CO 0.06 0.94 -0.01 0.11 0.09 0.00 0.00 178.44 179.63 1ivr h LYS 280 N 0.08 0.06 -0.76 1.13 1.57 -1.34 -1.28 116.57 116.03 1ivr h LYS 280 Ca -0.03 -0.02 0.07 0.00 -1.87 0.00 0.00 60.65 58.79 1ivr h LYS 280 Cb 1.46 -0.00 -0.05 0.00 0.08 0.00 0.00 32.23 33.72 1ivr h LYS 280 CO 0.12 0.43 0.50 0.82 -0.57 0.00 0.00 179.45 180.75 1ivr h ILE 281 N -0.31 1.02 -0.22 1.86 2.04 -1.49 0.60 117.51 121.01 1ivr h ILE 281 Ca 0.01 -0.28 -0.08 0.00 1.00 0.00 0.00 64.86 65.51 1ivr h ILE 281 Cb 0.41 0.15 -0.00 0.00 -0.74 0.00 0.00 36.82 36.63 1ivr h ILE 281 CO 0.00 0.15 -0.17 0.25 0.00 0.00 0.00 178.15 178.38 1ivr h LEU 282 N 0.80 0.53 0.16 1.44 7.12 -1.48 -3.33 115.31 120.54 1ivr h LEU 282 Ca 0.33 -0.45 -0.30 0.00 0.13 0.00 0.00 57.88 57.59 1ivr h LEU 282 Cb 0.26 -0.15 0.02 0.00 -0.53 0.00 0.00 40.66 40.27 1ivr h LEU 282 CO -0.11 0.87 -1.32 0.40 -0.13 0.00 0.00 178.44 178.14 1ivr h ILE 283 N 0.19 1.38 -0.49 4.05 2.04 -0.60 -3.36 117.51 120.73 1ivr h ILE 283 Ca 0.04 -2.80 0.10 0.00 1.00 0.00 0.00 64.86 63.20 1ivr h ILE 283 Cb 0.70 2.92 -0.09 0.00 -0.74 0.00 0.00 36.82 39.61 1ivr h ILE 283 CO 0.04 0.83 -0.06 -0.09 0.00 0.00 0.00 178.15 178.88 1ivr h ARG 284 N 0.14 0.05 -0.16 2.37 9.65 0.08 -2.72 114.38 123.78 1ivr h ARG 284 Ca -0.19 -0.00 0.00 0.00 -1.10 0.00 0.00 59.98 58.69 1ivr h ARG 284 Cb 2.02 -0.01 0.00 0.00 -1.39 0.00 0.00 29.97 30.59 1ivr h ARG 284 CO 0.24 0.04 0.00 -0.35 2.80 0.00 0.00 179.97 182.69 1ivr n PRO 285 N -5.29 0.94 -0.02 0.20 -0.05 -1.26 -2.50 135.00 127.03 1ivr n PRO 285 Ca 0.05 0.00 -0.02 0.00 -0.05 0.00 0.00 63.50 63.48 1ivr n PRO 285 Cb 0.26 -1.08 -0.01 0.00 -0.05 0.00 0.00 33.50 32.63 1ivr n PRO 285 CO 0.00 0.00 0.00 -1.33 -0.05 0.00 0.00 175.50 174.12 1ivr n MET 286 N -0.41 0.11 0.00 0.54 2.81 -1.04 -4.93 117.12 114.21 1ivr n MET 286 Ca 0.00 0.04 0.00 0.00 -1.81 0.00 0.00 57.70 55.93 1ivr n MET 286 Cb 0.04 -0.68 0.00 0.00 -0.71 0.00 0.00 33.22 31.88 1ivr n MET 286 CO 0.00 0.00 0.00 2.48 1.51 0.00 0.00 175.97 179.96 1ivr n TYR 287 N -2.91 0.00 0.00 2.03 0.18 -1.16 -5.07 117.16 110.23 1ivr n TYR 287 Ca -0.03 0.00 0.00 0.00 1.88 0.00 0.00 57.90 59.75 1ivr n TYR 287 Cb 0.11 0.07 0.00 0.00 -0.38 0.00 0.00 39.34 39.14 1ivr n TYR 287 CO 0.00 0.00 0.00 0.45 -2.08 0.00 0.00 176.86 175.23 1ivr n SER 288 N 0.00 0.00 -3.90 9.48 2.88 -1.04 -4.64 113.62 116.40 1ivr n SER 288 Ca 0.00 0.00 -0.08 0.00 -1.33 0.00 0.00 58.87 57.46 1ivr n SER 288 Cb 0.43 0.00 -0.08 0.00 -0.75 0.00 0.00 64.21 63.81 1ivr n SER 288 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 1ivr s ASN 289 N 0.00 0.19 0.28 -3.46 2.20 -1.26 -4.35 114.94 108.54 1ivr s ASN 289 Ca 0.00 -0.71 -0.01 0.00 -0.94 0.00 0.00 52.86 51.19 1ivr s ASN 289 Cb 0.00 0.31 -0.04 0.00 -2.00 0.00 0.00 41.25 39.52 1ivr s ASN 289 CO 0.00 -0.70 0.50 -2.16 -2.94 0.00 0.00 177.10 171.80 1ivr s PRO 290 N -3.84 3.54 -0.20 3.55 0.04 -1.26 -5.04 135.00 131.78 1ivr s PRO 290 Ca 0.05 -0.25 -0.32 0.00 0.04 0.00 0.00 61.00 60.53 1ivr s PRO 290 Cb 0.05 -2.72 -0.09 0.00 0.04 0.00 0.00 34.50 31.79 1ivr s PRO 290 CO -0.11 0.25 2.11 -0.35 0.04 0.00 0.00 177.00 178.95 1ivr n PRO 291 N -1.18 1.87 0.09 0.56 -0.04 -1.26 -4.78 135.00 130.27 1ivr n PRO 291 Ca -0.04 0.59 -0.03 0.00 -0.04 0.00 0.00 63.50 63.98 1ivr n PRO 291 Cb 0.55 -2.88 0.19 0.00 -0.04 0.00 0.00 33.50 31.32 1ivr n PRO 291 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1ivr h MET 292 N 12.57 0.23 -0.22 0.54 -0.00 -1.94 -3.38 114.93 122.75 1ivr h MET 292 Ca -0.40 -0.13 -0.01 0.00 -0.00 0.00 0.00 59.70 59.16 1ivr h MET 292 Cb 1.27 0.01 -0.01 0.00 -0.00 0.00 0.00 31.60 32.87 1ivr h MET 292 CO 0.97 0.67 0.08 -0.97 -0.00 0.00 0.00 176.91 177.66 1ivr h ASN 293 N 0.19 0.30 -0.30 -0.10 -0.00 -1.92 -1.97 115.58 111.77 1ivr h ASN 293 Ca 0.01 -0.17 -0.02 0.00 -0.00 0.00 0.00 56.30 56.12 1ivr h ASN 293 Cb 0.91 -0.08 -0.01 0.00 -0.00 0.00 0.00 38.32 39.14 1ivr h ASN 293 CO 0.07 0.39 0.10 1.23 -0.00 0.00 0.00 177.43 179.22 1ivr h GLY 294 N 0.19 0.50 0.63 1.57 0.00 -1.77 -1.26 103.07 102.92 1ivr h GLY 294 Ca 0.07 -0.29 0.08 0.00 0.00 0.00 0.00 47.33 47.19 1ivr h GLY 294 CO -0.01 0.27 0.51 0.00 0.00 0.00 0.00 176.54 177.31 1ivr h ALA 295 N 0.94 1.18 0.08 3.60 0.00 -1.73 0.14 119.26 123.47 1ivr h ALA 295 Ca 0.10 0.01 -0.26 0.00 0.00 0.00 0.00 54.91 54.76 1ivr h ALA 295 Cb 0.23 -0.19 0.01 0.00 0.00 0.00 0.00 17.79 17.84 1ivr h ALA 295 CO -0.00 0.19 -1.12 0.00 0.00 0.00 0.00 179.25 178.31 1ivr h ARG 296 N 0.89 0.41 -0.03 0.00 3.08 -1.13 -2.39 114.38 115.21 1ivr h ARG 296 Ca 0.39 -0.54 -0.01 0.00 0.07 0.00 0.00 59.98 59.88 1ivr h ARG 296 Cb 0.27 0.18 -0.00 0.00 0.08 0.00 0.00 29.97 30.50 1ivr h ARG 296 CO -0.21 1.21 -0.03 0.82 -1.07 0.00 0.00 179.97 180.69 1ivr h ILE 297 N 0.18 1.40 -0.04 2.04 2.04 -0.92 -2.96 117.51 119.26 1ivr h ILE 297 Ca -0.13 -1.25 0.01 0.00 1.00 0.00 0.00 64.86 64.50 1ivr h ILE 297 Cb 1.80 2.19 -0.01 0.00 -0.74 0.00 0.00 36.82 40.05 1ivr h ILE 297 CO 0.20 0.33 -0.03 0.00 0.00 0.00 0.00 178.15 178.65 1ivr h ALA 298 N 0.50 0.00 0.64 1.87 0.00 -1.10 -2.89 119.26 118.28 1ivr h ALA 298 Ca 0.00 0.02 -0.03 0.00 0.00 0.00 0.00 54.91 54.90 1ivr h ALA 298 Cb 0.56 0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.41 1ivr h ALA 298 CO 0.01 -0.52 -0.45 1.03 0.00 0.00 0.00 179.25 179.33 1ivr h SER 299 N -0.04 -1.15 -0.97 0.00 0.87 -1.51 0.10 113.55 110.85 1ivr h SER 299 Ca 0.03 0.07 0.25 0.00 -1.23 0.00 0.00 61.79 60.91 1ivr h SER 299 Cb 0.08 0.35 -0.13 0.00 -0.44 0.00 0.00 62.40 62.26 1ivr h SER 299 CO -0.06 -0.66 0.52 0.25 -0.53 0.00 0.00 176.83 176.36 1ivr h LEU 300 N -1.03 0.53 0.17 2.23 5.85 -1.49 0.16 115.31 121.73 1ivr h LEU 300 Ca -0.09 0.15 -0.01 0.00 0.84 0.00 0.00 57.88 58.78 1ivr h LEU 300 Cb 0.85 0.08 0.00 0.00 0.37 0.00 0.00 40.66 41.96 1ivr h LEU 300 CO 0.05 0.03 -0.08 0.40 -0.34 0.00 0.00 178.44 178.50 1ivr h ILE 301 N 0.48 0.84 -0.53 4.05 2.04 -1.28 -2.58 117.51 120.53 1ivr h ILE 301 Ca 0.63 -1.10 0.08 0.00 1.00 0.00 0.00 64.86 65.47 1ivr h ILE 301 Cb 1.25 1.40 -0.06 0.00 -0.74 0.00 0.00 36.82 38.66 1ivr h ILE 301 CO -0.52 0.21 0.18 -0.07 0.00 0.00 0.00 178.15 177.96 1ivr h LEU 302 N -0.85 0.17 -1.25 1.44 3.38 -0.20 -1.80 115.31 116.19 1ivr h LEU 302 Ca -0.02 0.07 0.00 0.00 0.09 0.00 0.00 57.88 58.02 1ivr h LEU 302 Cb 0.52 0.06 0.00 0.00 0.09 0.00 0.00 40.66 41.33 1ivr h LEU 302 CO 0.04 0.12 0.00 0.59 0.09 0.00 0.00 178.44 179.28 1ivr n ASN 303 N -5.02 1.90 -3.96 -0.43 3.02 0.51 -4.74 115.26 106.54 1ivr n ASN 303 Ca 0.06 -1.71 -0.31 0.00 -0.03 0.00 0.00 54.58 52.59 1ivr n ASN 303 Cb 0.23 -0.10 -0.15 0.00 -0.61 0.00 0.00 39.78 39.15 1ivr n ASN 303 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 1ivr s THR 304 N -1.81 1.84 0.10 3.41 2.01 -0.97 -5.01 115.64 115.22 1ivr s THR 304 Ca 0.34 -1.76 -0.01 0.00 0.31 0.00 0.00 61.69 60.57 1ivr s THR 304 Cb 0.19 -2.21 0.15 0.00 0.01 0.00 0.00 72.50 70.64 1ivr s THR 304 CO 0.28 -0.36 0.55 -2.65 -0.69 0.00 0.00 174.62 171.75 1ivr n PRO 305 N 4.49 -0.03 0.20 4.92 -0.02 -1.26 0.17 135.00 143.48 1ivr n PRO 305 Ca -0.05 0.54 0.09 0.00 -2.02 0.00 0.00 63.50 62.06 1ivr n PRO 305 Cb 0.43 -0.83 0.20 0.00 -0.02 0.00 0.00 33.50 33.28 1ivr n PRO 305 CO 0.00 0.00 0.00 0.93 1.98 0.00 0.00 175.50 178.41 1ivr h GLU 306 N 0.00 0.00 0.09 -0.52 3.07 -1.95 -1.91 114.58 113.35 1ivr h GLU 306 Ca 0.19 0.00 -0.29 0.00 -0.50 0.00 0.00 59.36 58.77 1ivr h GLU 306 Cb 0.36 0.00 -0.02 0.00 -0.84 0.00 0.00 28.75 28.25 1ivr h GLU 306 CO -0.35 0.18 -1.53 -0.07 -1.40 0.00 0.00 179.01 175.84 1ivr h LEU 307 N 0.00 0.29 -0.76 1.33 3.38 0.16 -2.23 115.31 117.48 1ivr h LEU 307 Ca -0.00 -0.80 0.07 0.00 0.09 0.00 0.00 57.88 57.25 1ivr h LEU 307 Cb 1.05 -0.09 -0.06 0.00 0.09 0.00 0.00 40.66 41.64 1ivr h LEU 307 CO 0.02 1.65 0.43 -0.09 0.09 0.00 0.00 178.44 180.55 1ivr h ARG 308 N -0.38 0.74 0.09 1.13 2.43 0.27 -1.06 114.38 117.60 1ivr h ARG 308 Ca -0.35 -0.04 -0.00 0.00 -0.81 0.00 0.00 59.98 58.77 1ivr h ARG 308 Cb 1.71 -0.17 0.00 0.00 -0.42 0.00 0.00 29.97 31.10 1ivr h ARG 308 CO -0.00 0.49 -0.04 0.87 -1.51 0.00 0.00 179.97 179.78 1ivr h LYS 309 N 0.77 -0.11 -0.36 0.20 1.57 -1.47 -1.56 116.57 115.60 1ivr h LYS 309 Ca 0.35 0.01 0.05 0.00 -1.87 0.00 0.00 60.65 59.18 1ivr h LYS 309 Cb 0.26 0.03 -0.04 0.00 0.08 0.00 0.00 32.23 32.55 1ivr h LYS 309 CO -0.21 0.03 0.11 1.49 -0.57 0.00 0.00 179.45 180.30 1ivr h GLU 310 N -0.24 0.25 -0.96 3.15 4.81 -0.91 -1.37 114.58 119.31 1ivr h GLU 310 Ca -0.01 -0.01 0.12 0.00 -0.13 0.00 0.00 59.36 59.33 1ivr h GLU 310 Cb 0.20 -0.06 -0.08 0.00 0.63 0.00 0.00 28.75 29.45 1ivr h GLU 310 CO 0.02 0.16 0.61 2.35 -0.73 0.00 0.00 179.01 181.42 1ivr h TRP 311 N 0.25 1.03 0.00 0.92 7.01 -1.00 -1.64 115.95 122.52 1ivr h TRP 311 Ca 0.17 0.03 -0.08 0.00 2.11 0.00 0.00 58.89 61.11 1ivr h TRP 311 Cb 0.16 -0.33 -0.01 0.00 -2.10 0.00 0.00 29.16 26.88 1ivr h TRP 311 CO -0.16 0.41 -0.39 -0.07 -2.79 0.00 0.00 178.44 175.44 1ivr h LEU 312 N 0.90 0.00 -0.10 0.65 3.38 -0.26 -2.11 115.31 117.76 1ivr h LEU 312 Ca 0.47 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.43 1ivr h LEU 312 Cb 0.54 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.28 1ivr h LEU 312 CO -0.24 0.39 0.01 0.58 0.09 0.00 0.00 178.44 179.28 1ivr h VAL 313 N 0.00 1.23 -0.06 1.22 2.07 -0.44 -3.05 116.25 117.23 1ivr h VAL 313 Ca -0.00 -0.74 -0.05 0.00 0.82 0.00 0.00 66.70 66.73 1ivr h VAL 313 Cb 1.15 1.53 -0.01 0.00 -1.52 0.00 0.00 31.29 32.44 1ivr h VAL 313 CO 0.05 0.21 -0.18 -0.33 0.02 0.00 0.00 177.57 177.34 1ivr h GLU 314 N -0.07 0.10 -0.29 1.57 5.08 -1.28 -1.83 114.58 117.84 1ivr h GLU 314 Ca 0.03 -0.02 -0.12 0.00 -1.00 0.00 0.00 59.36 58.24 1ivr h GLU 314 Cb 0.32 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.55 1ivr h GLU 314 CO 0.00 0.29 -0.33 0.28 -1.00 0.00 0.00 179.01 178.25 1ivr h VAL 315 N 0.09 1.29 -0.28 3.13 2.07 -1.36 -2.87 116.25 118.31 1ivr h VAL 315 Ca 0.02 -1.46 -0.18 0.00 0.82 0.00 0.00 66.70 65.89 1ivr h VAL 315 Cb 0.39 1.42 -0.00 0.00 -1.52 0.00 0.00 31.29 31.57 1ivr h VAL 315 CO 0.03 0.47 -0.54 0.50 0.02 0.00 0.00 177.57 178.05 1ivr h LYS 316 N 0.54 0.84 -0.79 1.57 3.64 -1.39 -1.60 116.57 119.38 1ivr h LYS 316 Ca 0.06 -0.53 -0.04 0.00 -1.27 0.00 0.00 60.65 58.87 1ivr h LYS 316 Cb 0.83 0.06 -0.04 0.00 -0.41 0.00 0.00 32.23 32.67 1ivr h LYS 316 CO 0.07 1.16 0.34 0.78 -2.27 0.00 0.00 179.45 179.54 1ivr h GLY 317 N 0.75 1.24 0.47 5.01 0.00 -1.18 -1.04 103.07 108.31 1ivr h GLY 317 Ca 0.02 -0.65 -0.00 0.00 0.00 0.00 0.00 47.33 46.70 1ivr h GLY 317 CO 0.12 0.61 -0.01 -0.33 0.00 0.00 0.00 176.54 176.93 1ivr h MET 318 N 1.13 -0.04 -0.15 4.80 2.86 -1.49 -2.18 114.93 119.86 1ivr h MET 318 Ca 0.27 0.00 0.01 0.00 -2.06 0.00 0.00 59.70 57.92 1ivr h MET 318 Cb 0.17 0.01 -0.01 0.00 0.06 0.00 0.00 31.60 31.82 1ivr h MET 318 CO -0.03 0.48 0.06 0.00 1.06 0.00 0.00 176.91 178.48 1ivr h ALA 319 N 0.37 0.17 -0.48 6.32 0.00 -1.23 -2.68 119.26 121.72 1ivr h ALA 319 Ca -0.00 0.01 0.06 0.00 0.00 0.00 0.00 54.91 54.98 1ivr h ALA 319 Cb 0.53 -0.01 -0.05 0.00 0.00 0.00 0.00 17.79 18.26 1ivr h ALA 319 CO 0.01 -0.38 0.19 -0.44 0.00 0.00 0.00 179.25 178.62 1ivr h ASP 320 N 0.14 0.21 -0.88 0.00 3.32 -1.24 -1.80 116.42 116.17 1ivr h ASP 320 Ca 0.06 0.05 -0.01 0.00 0.02 0.00 0.00 57.03 57.15 1ivr h ASP 320 Cb 0.03 0.02 -0.04 0.00 0.22 0.00 0.00 39.33 39.56 1ivr h ASP 320 CO -0.06 0.15 0.51 -0.09 -1.72 0.00 0.00 179.24 178.04 1ivr h ARG 321 N 0.37 1.21 -0.75 3.56 2.43 -1.26 0.10 114.38 120.05 1ivr h ARG 321 Ca 0.22 -0.12 -0.02 0.00 -0.81 0.00 0.00 59.98 59.25 1ivr h ARG 321 Cb 0.21 -0.25 -0.03 0.00 -0.42 0.00 0.00 29.97 29.48 1ivr h ARG 321 CO -0.21 0.87 0.39 0.82 -1.51 0.00 0.00 179.97 180.32 1ivr h ILE 322 N 1.22 1.23 -0.50 1.20 2.04 -1.11 -1.61 117.51 119.98 1ivr h ILE 322 Ca 0.31 -0.61 0.06 0.00 1.00 0.00 0.00 64.86 65.63 1ivr h ILE 322 Cb -0.02 0.27 -0.05 0.00 -0.74 0.00 0.00 36.82 36.28 1ivr h ILE 322 CO -0.06 0.26 0.21 0.40 0.00 0.00 0.00 178.15 178.97 1ivr h ILE 323 N 1.04 0.87 0.00 -0.67 2.04 -0.65 -1.32 117.51 118.82 1ivr h ILE 323 Ca 0.26 -0.14 -0.01 0.00 1.00 0.00 0.00 64.86 65.97 1ivr h ILE 323 Cb 0.07 0.43 -0.00 0.00 -0.74 0.00 0.00 36.82 36.58 1ivr h ILE 323 CO -0.04 0.07 -0.06 -1.28 0.00 0.00 0.00 178.15 176.84 1ivr h SER 324 N 0.41 0.00 0.85 1.72 0.87 -0.32 -2.04 113.55 115.04 1ivr h SER 324 Ca 0.23 0.00 -0.22 0.00 -1.23 0.00 0.00 61.79 60.58 1ivr h SER 324 Cb 0.21 0.00 -0.03 0.00 -0.44 0.00 0.00 62.40 62.14 1ivr h SER 324 CO -0.21 0.06 -1.23 0.24 -0.53 0.00 0.00 176.83 175.16 1ivr h MET 325 N 0.00 0.00 0.66 2.24 2.86 -0.52 -1.34 114.93 118.83 1ivr h MET 325 Ca -0.00 0.00 -0.03 0.00 -2.06 0.00 0.00 59.70 57.61 1ivr h MET 325 Cb 0.11 0.00 0.01 0.00 0.06 0.00 0.00 31.60 31.78 1ivr h MET 325 CO 0.01 0.67 -0.32 0.00 1.06 0.00 0.00 176.91 178.33 1ivr h ARG 326 N 0.00 -0.85 -0.08 1.72 3.08 -0.58 0.69 114.38 118.37 1ivr h ARG 326 Ca -0.12 0.06 0.01 0.00 0.07 0.00 0.00 59.98 60.00 1ivr h ARG 326 Cb 1.78 0.19 -0.02 0.00 0.08 0.00 0.00 29.97 32.00 1ivr h ARG 326 CO 0.09 -0.56 -0.16 1.15 -1.07 0.00 0.00 179.97 179.42 1ivr h THR 327 N -0.90 0.00 -0.78 2.04 2.02 -1.54 0.71 112.91 114.46 1ivr h THR 327 Ca -0.09 0.00 0.15 0.00 0.77 0.00 0.00 66.41 67.24 1ivr h THR 327 Cb 0.68 0.00 -0.05 0.00 -1.74 0.00 0.00 68.15 67.04 1ivr h THR 327 CO 0.15 0.00 0.52 1.56 0.37 0.00 0.00 175.52 178.12 1ivr h GLN 328 N -0.15 0.44 -0.02 6.66 4.20 -1.26 -2.16 115.11 122.82 1ivr h GLN 328 Ca 0.01 -0.03 -0.00 0.00 0.06 0.00 0.00 58.65 58.70 1ivr h GLN 328 Cb 0.19 -0.10 -0.00 0.00 0.30 0.00 0.00 27.48 27.87 1ivr h GLN 328 CO -0.15 0.29 0.00 1.25 -0.67 0.00 0.00 178.83 179.55 1ivr h LEU 329 N 0.45 0.03 -1.56 1.46 5.85 0.14 -2.57 115.31 119.11 1ivr h LEU 329 Ca 0.39 -0.24 0.00 0.00 0.84 0.00 0.00 57.88 58.87 1ivr h LEU 329 Cb 0.85 -0.01 -0.02 0.00 0.37 0.00 0.00 40.66 41.85 1ivr h LEU 329 CO -0.13 0.27 0.28 0.58 -0.34 0.00 0.00 178.44 179.10 1ivr h VAL 330 N -0.20 1.11 -0.14 1.05 2.07 -0.60 -0.54 116.25 119.01 1ivr h VAL 330 Ca 0.01 -0.22 -0.22 0.00 0.82 0.00 0.00 66.70 67.09 1ivr h VAL 330 Cb 0.25 0.48 0.01 0.00 -1.52 0.00 0.00 31.29 30.51 1ivr h VAL 330 CO 0.00 0.11 -0.77 -1.28 0.02 0.00 0.00 177.57 175.65 1ivr h SER 331 N 0.59 0.84 1.02 0.57 0.87 -1.45 -1.22 113.55 114.77 1ivr h SER 331 Ca 0.16 -0.55 -0.13 0.00 -1.23 0.00 0.00 61.79 60.04 1ivr h SER 331 Cb -0.06 -0.25 -0.02 0.00 -0.44 0.00 0.00 62.40 61.64 1ivr h SER 331 CO -0.03 1.34 -0.62 0.78 -0.53 0.00 0.00 176.83 177.76 1ivr h ASN 332 N 0.48 0.00 0.05 6.23 4.21 -0.97 -2.59 115.58 123.00 1ivr h ASN 332 Ca -0.05 0.00 -0.00 0.00 1.21 0.00 0.00 56.30 57.46 1ivr h ASN 332 Cb 1.39 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 38.59 1ivr h ASN 332 CO 0.15 0.62 -0.03 -0.07 -1.29 0.00 0.00 177.43 176.82 1ivr h LEU 333 N 0.00 -0.06 -0.43 1.61 3.38 -0.81 0.22 115.31 119.22 1ivr h LEU 333 Ca -0.01 -0.02 0.06 0.00 0.09 0.00 0.00 57.88 58.01 1ivr h LEU 333 Cb 1.30 0.02 -0.06 0.00 0.09 0.00 0.00 40.66 42.01 1ivr h LEU 333 CO 0.08 -0.02 0.10 0.11 0.09 0.00 0.00 178.44 178.81 1ivr h LYS 334 N -0.10 0.24 -0.84 1.13 1.57 -0.91 0.13 116.57 117.79 1ivr h LYS 334 Ca -0.01 -0.01 0.09 0.00 -1.87 0.00 0.00 60.65 58.85 1ivr h LYS 334 Cb 0.08 -0.05 -0.07 0.00 0.08 0.00 0.00 32.23 32.26 1ivr h LYS 334 CO 0.01 0.16 0.49 -0.22 -0.57 0.00 0.00 179.45 179.32 1ivr h LYS 335 N 0.24 0.80 0.00 3.15 3.11 -1.29 -1.12 116.57 121.47 1ivr h LYS 335 Ca 0.21 -0.05 -0.01 0.00 -2.81 0.00 0.00 60.65 57.99 1ivr h LYS 335 Cb 0.24 -0.18 -0.00 0.00 -1.00 0.00 0.00 32.23 31.29 1ivr h LYS 335 CO -0.26 0.53 -0.05 0.93 -2.81 0.00 0.00 179.45 177.79 1ivr h GLU 336 N 0.83 0.00 -0.04 1.90 4.39 0.43 -3.47 114.58 118.63 1ivr h GLU 336 Ca 0.40 0.00 0.00 0.00 0.34 0.00 0.00 59.36 60.10 1ivr h GLU 336 Cb 0.34 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.99 1ivr h GLU 336 CO -0.24 0.05 0.00 0.41 -1.16 0.00 0.00 179.01 178.08 1ivr n GLY 337 N 0.50 1.09 3.77 -3.84 0.00 -0.42 -5.08 105.19 101.20 1ivr n GLY 337 Ca 0.02 -0.03 -0.37 0.00 0.00 0.00 0.00 46.02 45.64 1ivr n GLY 337 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1ivr s SER 338 N -2.04 6.09 0.02 1.61 0.15 0.35 -4.89 113.70 114.98 1ivr s SER 338 Ca 0.00 2.38 0.22 0.00 0.70 0.00 0.00 55.95 59.25 1ivr s SER 338 Cb 0.00 -2.61 -0.08 0.00 -1.71 0.00 0.00 66.02 61.62 1ivr s SER 338 CO 0.00 -0.98 0.92 -0.24 1.20 0.00 0.00 173.24 174.14 1ivr n SER 339 N -0.49 0.64 -4.78 5.45 2.88 -1.26 -4.72 113.62 111.35 1ivr n SER 339 Ca 0.07 -0.46 -0.31 0.00 -1.33 0.00 0.00 58.87 56.85 1ivr n SER 339 Cb 0.47 1.02 0.09 0.00 -0.75 0.00 0.00 64.21 65.04 1ivr n SER 339 CO 0.00 0.00 0.00 -1.00 -1.23 0.00 0.00 175.04 172.81 1ivr s HIS 340 N -3.16 2.71 -0.37 0.66 3.76 -1.26 -5.01 115.29 112.62 1ivr s HIS 340 Ca 0.04 1.37 -0.23 0.00 -0.15 0.00 0.00 55.06 56.09 1ivr s HIS 340 Cb 0.15 -3.04 0.01 0.00 1.11 0.00 0.00 32.58 30.81 1ivr s HIS 340 CO 0.84 -1.77 0.77 1.21 -0.85 0.00 0.00 174.74 174.93 1ivr s ASN 341 N -3.61 6.53 -0.07 1.40 3.84 -1.26 -4.93 114.94 116.85 1ivr s ASN 341 Ca 0.61 0.31 0.10 0.00 0.21 0.00 0.00 52.86 54.09 1ivr s ASN 341 Cb -0.16 -2.39 0.24 0.00 -0.55 0.00 0.00 41.25 38.39 1ivr s ASN 341 CO 0.56 -0.73 1.17 0.79 -2.79 0.00 0.00 177.10 176.09 1ivr n TRP 342 N 6.41 0.27 0.28 0.43 7.02 -1.26 -4.77 117.44 125.81 1ivr n TRP 342 Ca 0.03 -0.70 0.18 0.00 -1.02 0.00 0.00 57.50 55.99 1ivr n TRP 342 Cb 0.48 -0.12 0.88 0.00 -2.42 0.00 0.00 31.31 30.14 1ivr n TRP 342 CO 0.00 0.00 0.00 0.37 -2.02 0.00 0.00 177.69 176.04 1ivr h GLN 343 N 0.76 0.00 0.00 -0.99 4.15 -2.00 -1.63 115.11 115.41 1ivr h GLN 343 Ca 0.00 0.00 -0.08 0.00 0.77 0.00 0.00 58.65 59.34 1ivr h GLN 343 Cb 0.85 0.00 -0.01 0.00 0.21 0.00 0.00 27.48 28.53 1ivr h GLN 343 CO 0.04 0.00 -0.40 1.12 -1.93 0.00 0.00 178.83 177.66 1ivr h HIS 344 N 0.00 0.00 0.12 3.99 2.07 -1.95 -0.70 115.15 118.68 1ivr h HIS 344 Ca 0.04 0.00 0.02 0.00 -2.85 0.00 0.00 60.37 57.58 1ivr h HIS 344 Cb 0.58 0.00 -0.05 0.00 2.57 0.00 0.00 27.41 30.51 1ivr h HIS 344 CO 0.00 0.40 -0.50 0.82 -3.07 0.00 0.00 177.93 175.58 1ivr h ILE 345 N 0.00 0.05 0.00 6.12 2.04 -1.67 -0.17 117.51 123.88 1ivr h ILE 345 Ca -0.00 0.00 -0.08 0.00 1.00 0.00 0.00 64.86 65.78 1ivr h ILE 345 Cb 0.77 0.05 -0.01 0.00 -0.74 0.00 0.00 36.82 36.88 1ivr h ILE 345 CO 0.05 0.00 -0.38 0.71 0.00 0.00 0.00 178.15 178.53 1ivr h THR 346 N -0.72 0.99 -0.10 -0.27 1.35 -1.72 -3.32 112.91 109.12 1ivr h THR 346 Ca 0.00 -1.47 -0.20 0.00 -0.55 0.00 0.00 66.41 64.19 1ivr h THR 346 Cb 0.74 1.86 0.01 0.00 -1.73 0.00 0.00 68.15 69.03 1ivr h THR 346 CO -0.28 0.38 -0.73 0.44 -0.25 0.00 0.00 175.52 175.07 1ivr h ASP 347 N 0.00 0.82 -4.17 5.36 3.32 -0.48 -3.47 116.42 117.80 1ivr h ASP 347 Ca -0.00 -0.66 -0.53 0.00 0.02 0.00 0.00 57.03 55.86 1ivr h ASP 347 Cb 0.83 -0.24 0.13 0.00 0.22 0.00 0.00 39.33 40.27 1ivr h ASP 347 CO 0.05 1.36 0.40 -1.10 -1.72 0.00 0.00 179.24 178.23 1ivr s GLN 348 N -3.61 2.46 0.13 3.56 -0.21 -0.14 -5.03 119.66 116.82 1ivr s GLN 348 Ca -0.11 1.67 0.05 0.00 0.02 0.00 0.00 55.36 56.99 1ivr s GLN 348 Cb 0.07 -1.88 -0.04 0.00 1.00 0.00 0.00 33.01 32.16 1ivr s GLN 348 CO 0.88 -1.57 -0.12 0.96 -2.12 0.00 0.00 175.29 173.31 1ivr s ILE 349 N -2.01 1.23 0.00 1.08 -5.25 -0.52 -4.97 121.20 110.76 1ivr s ILE 349 Ca 0.73 -1.79 0.00 0.00 -0.99 0.00 0.00 60.65 58.59 1ivr s ILE 349 Cb -0.27 -1.58 0.00 0.00 2.95 0.00 0.00 42.46 43.56 1ivr s ILE 349 CO 0.42 -0.52 0.00 0.61 -1.79 0.00 0.00 174.94 173.66 1ivr n GLY 350 N 0.34 -1.21 0.23 6.27 0.00 -1.21 -4.40 105.19 105.21 1ivr n GLY 350 Ca -0.14 -2.10 0.12 0.00 0.00 0.00 0.00 46.02 43.90 1ivr n GLY 350 CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 173.32 172.99 1ivr h MET 351 N 0.63 0.00 -5.57 1.61 2.86 -1.95 -3.48 114.93 109.03 1ivr h MET 351 Ca 0.00 0.00 -0.63 0.00 -2.06 0.00 0.00 59.70 57.01 1ivr h MET 351 Cb 0.00 0.00 -0.09 0.00 0.06 0.00 0.00 31.60 31.57 1ivr h MET 351 CO 0.00 0.11 -0.43 -0.06 1.06 0.00 0.00 176.91 177.60 1ivr s PHE 352 N -3.44 1.83 -0.06 -0.22 0.08 -1.26 -1.06 117.98 113.85 1ivr s PHE 352 Ca 0.03 -0.87 -0.03 0.00 0.12 0.00 0.00 56.93 56.18 1ivr s PHE 352 Cb 0.08 -1.77 0.04 0.00 -0.57 0.00 0.00 43.02 40.80 1ivr s PHE 352 CO 0.63 -0.07 0.13 0.00 -0.10 0.00 0.00 175.22 175.81 1ivr n PHE 354 N 4.71 3.26 -0.16 0.00 7.35 -1.26 -0.37 117.46 131.00 1ivr n PHE 354 Ca -0.17 -2.95 0.09 0.00 -0.76 0.00 0.00 57.45 53.66 1ivr n PHE 354 Cb 0.51 -1.63 0.41 0.00 0.35 0.00 0.00 39.48 39.11 1ivr n PHE 354 CO 0.00 0.00 0.00 1.79 -0.76 0.00 0.00 176.76 177.79 1ivr h THR 355 N 3.68 0.96 0.00 -2.13 1.35 -1.92 -3.47 112.91 111.38 1ivr h THR 355 Ca 0.26 -0.22 0.00 0.00 -0.55 0.00 0.00 66.41 65.91 1ivr h THR 355 Cb 0.69 0.27 0.00 0.00 -1.73 0.00 0.00 68.15 67.38 1ivr h THR 355 CO 1.35 0.11 0.00 0.61 -0.25 0.00 0.00 175.52 177.35 1ivr n GLY 356 N -1.47 0.31 3.65 5.82 0.00 -1.26 -5.05 105.19 107.19 1ivr n GLY 356 Ca 0.11 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.74 1ivr n GLY 356 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1ivr n LEU 357 N 0.00 4.02 -5.00 0.99 4.77 -1.26 -5.00 117.00 115.52 1ivr n LEU 357 Ca 0.00 0.90 -0.20 0.00 -0.03 0.00 0.00 56.01 56.69 1ivr n LEU 357 Cb 0.00 -1.44 0.04 0.00 -2.33 0.00 0.00 43.42 39.69 1ivr n LEU 357 CO 0.00 -1.40 0.31 -0.54 -1.33 0.00 0.00 177.39 174.44 1ivr s LYS 358 N -2.64 2.48 0.58 3.23 1.02 -1.26 -4.36 119.74 118.78 1ivr s LYS 358 Ca 0.72 -1.13 0.30 0.00 0.02 0.00 0.00 55.97 55.89 1ivr s LYS 358 Cb -0.45 -2.59 1.79 0.00 -0.52 0.00 0.00 37.83 36.07 1ivr s LYS 358 CO 0.50 -0.69 2.22 -1.35 -0.92 0.00 0.00 175.35 175.11 1ivr h PRO 359 N 0.20 0.00 -0.00 -1.68 0.11 -1.95 -1.74 132.00 126.94 1ivr h PRO 359 Ca -0.38 0.00 -0.24 0.00 0.11 0.00 0.00 66.00 65.49 1ivr h PRO 359 Cb 1.29 0.00 0.01 0.00 0.11 0.00 0.00 31.00 32.40 1ivr h PRO 359 CO 0.46 0.03 -0.97 0.93 -0.21 0.00 0.00 178.00 178.24 1ivr h GLU 360 N 0.00 0.50 -0.20 1.05 3.07 -1.97 -2.38 114.58 114.64 1ivr h GLU 360 Ca -0.00 -0.53 -0.16 0.00 -0.50 0.00 0.00 59.36 58.16 1ivr h GLU 360 Cb 0.08 0.15 0.00 0.00 -0.84 0.00 0.00 28.75 28.15 1ivr h GLU 360 CO 0.00 1.17 -0.51 1.96 -1.40 0.00 0.00 179.01 180.23 1ivr h GLN 361 N 0.28 0.71 -0.36 2.33 1.08 -1.80 -0.32 115.11 117.02 1ivr h GLN 361 Ca -0.09 -0.49 -0.02 0.00 -1.45 0.00 0.00 58.65 56.60 1ivr h GLN 361 Cb 1.61 0.07 -0.02 0.00 -0.05 0.00 0.00 27.48 29.10 1ivr h GLN 361 CO 0.17 1.11 0.17 0.28 -0.95 0.00 0.00 178.83 179.61 1ivr h VAL 362 N 0.41 1.17 -0.25 -0.54 2.07 -1.33 -2.05 116.25 115.73 1ivr h VAL 362 Ca -0.01 -0.51 -0.01 0.00 0.82 0.00 0.00 66.70 66.99 1ivr h VAL 362 Cb 1.13 0.84 -0.01 0.00 -1.52 0.00 0.00 31.29 31.72 1ivr h VAL 362 CO 0.11 0.19 0.11 -0.08 0.02 0.00 0.00 177.57 177.92 1ivr h GLU 363 N 0.45 0.37 0.00 1.57 4.81 -1.44 -2.16 114.58 118.19 1ivr h GLU 363 Ca 0.12 -0.06 -0.10 0.00 -0.13 0.00 0.00 59.36 59.19 1ivr h GLU 363 Cb 0.14 -0.06 -0.01 0.00 0.63 0.00 0.00 28.75 29.45 1ivr h GLU 363 CO -0.01 0.40 -0.46 0.00 -0.73 0.00 0.00 179.01 178.20 1ivr h ARG 364 N 0.26 0.00 -0.74 1.92 3.08 -0.98 -2.60 114.38 115.32 1ivr h ARG 364 Ca 0.08 0.00 -0.00 0.00 0.07 0.00 0.00 59.98 60.13 1ivr h ARG 364 Cb 0.16 0.00 -0.04 0.00 0.08 0.00 0.00 29.97 30.17 1ivr h ARG 364 CO -0.01 0.46 0.45 -0.07 -1.07 0.00 0.00 179.97 179.74 1ivr h LEU 365 N 0.00 0.89 0.26 3.04 -0.00 -1.00 0.74 115.31 119.24 1ivr h LEU 365 Ca -0.00 -0.06 -0.01 0.00 -0.00 0.00 0.00 57.88 57.80 1ivr h LEU 365 Cb 1.12 -0.22 0.00 0.00 -0.00 0.00 0.00 40.66 41.56 1ivr h LEU 365 CO 0.06 0.69 -0.12 0.74 -0.00 0.00 0.00 178.44 179.80 1ivr h THR 366 N 1.01 0.78 -0.00 0.22 2.02 -1.22 -1.86 112.91 113.86 1ivr h THR 366 Ca 0.27 -0.30 -0.01 0.00 0.77 0.00 0.00 66.41 67.13 1ivr h THR 366 Cb -0.04 0.96 0.00 0.00 -1.74 0.00 0.00 68.15 67.33 1ivr h THR 366 CO -0.05 0.07 -0.05 0.50 0.37 0.00 0.00 175.52 176.35 1ivr h LYS 367 N -0.50 0.04 0.00 6.66 3.64 -1.44 -1.32 116.57 123.65 1ivr h LYS 367 Ca -0.04 -0.04 -0.15 0.00 -1.27 0.00 0.00 60.65 59.15 1ivr h LYS 367 Cb 0.37 0.01 -0.02 0.00 -0.41 0.00 0.00 32.23 32.18 1ivr h LYS 367 CO 0.06 0.77 -0.85 0.93 -2.27 0.00 0.00 179.45 178.10 1ivr h GLU 368 N -0.67 0.00 -0.00 1.90 5.08 0.38 -3.40 114.58 117.86 1ivr h GLU 368 Ca -0.01 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.35 1ivr h GLU 368 Cb 0.79 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.04 1ivr h GLU 368 CO 0.01 0.59 -0.12 1.19 -1.00 0.00 0.00 179.01 179.68 1ivr n PHE 369 N -3.19 0.00 -3.18 4.33 3.72 -0.76 -5.04 117.46 113.35 1ivr n PHE 369 Ca -0.01 0.00 -0.21 0.00 -0.05 0.00 0.00 57.45 57.18 1ivr n PHE 369 Cb 0.82 0.00 0.05 0.00 -0.94 0.00 0.00 39.48 39.41 1ivr n PHE 369 CO 0.00 0.00 0.00 0.43 -0.05 0.00 0.00 176.76 177.14 1ivr n SER 370 N -0.60 -5.77 -4.27 4.37 7.64 -0.50 -4.67 113.62 109.83 1ivr n SER 370 Ca 0.01 -0.36 -0.40 0.00 1.01 0.00 0.00 58.87 59.13 1ivr n SER 370 Cb 0.08 -4.50 -0.10 0.00 -1.01 0.00 0.00 64.21 58.68 1ivr n SER 370 CO 0.00 0.00 0.00 -0.63 -3.01 0.00 0.00 175.04 171.40 1ivr s ILE 371 N -3.19 4.26 -0.15 0.44 1.01 -0.93 -0.92 121.20 121.72 1ivr s ILE 371 Ca 0.38 -1.42 -0.18 0.00 0.00 0.00 0.00 60.65 59.43 1ivr s ILE 371 Cb -0.17 -3.63 -0.04 0.00 0.01 0.00 0.00 42.46 38.64 1ivr s ILE 371 CO 0.48 -0.53 0.49 -0.31 0.00 0.00 0.00 174.94 175.06 1ivr s TYR 372 N 1.43 3.46 0.26 3.97 1.51 -1.08 -2.79 117.35 124.11 1ivr s TYR 372 Ca 0.03 0.84 -0.15 0.00 -1.01 0.00 0.00 57.07 56.78 1ivr s TYR 372 Cb -0.23 -2.59 0.00 0.00 -0.11 0.00 0.00 41.96 39.03 1ivr s TYR 372 CO 0.02 0.07 0.56 0.00 -1.11 0.00 0.00 175.55 175.09 1ivr s MET 373 N 1.00 1.65 0.53 -0.62 0.23 -1.26 -0.91 119.30 119.91 1ivr s MET 373 Ca 0.25 -1.19 -0.16 0.00 -1.03 0.00 0.00 55.69 53.56 1ivr s MET 373 Cb -0.15 0.52 -0.07 0.00 -1.53 0.00 0.00 34.83 33.59 1ivr s MET 373 CO 0.10 -0.71 1.00 0.95 -2.03 0.00 0.00 175.02 174.32 1ivr s THR 374 N -3.93 4.48 -2.00 3.16 -4.23 -1.20 -4.85 115.64 107.08 1ivr s THR 374 Ca 0.19 1.16 0.12 0.00 -1.18 0.00 0.00 61.69 61.98 1ivr s THR 374 Cb -0.02 -3.70 0.34 0.00 1.34 0.00 0.00 72.50 70.46 1ivr s THR 374 CO 0.09 -0.71 1.15 0.29 -0.54 0.00 0.00 174.62 174.90 1ivr n LYS 375 N -1.71 0.49 -0.05 3.99 4.76 -1.26 -2.68 118.16 121.69 1ivr n LYS 375 Ca 0.07 0.00 0.12 0.00 -2.87 0.00 0.00 58.31 55.63 1ivr n LYS 375 Cb 0.54 -1.38 0.31 0.00 -1.84 0.00 0.00 35.03 32.65 1ivr n LYS 375 CO 0.00 0.00 0.00 -0.40 -1.37 0.00 0.00 177.40 175.63 1ivr n ASP 376 N -0.88 2.36 0.00 4.39 5.68 -1.26 -4.65 116.55 122.19 1ivr n ASP 376 Ca 0.09 -1.79 0.00 0.00 -0.50 0.00 0.00 54.79 52.59 1ivr n ASP 376 Cb 0.04 -0.07 0.00 0.00 -1.14 0.00 0.00 41.12 39.95 1ivr n ASP 376 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1ivr n GLY 377 N 1.28 0.78 3.72 6.12 0.00 -1.09 -4.79 105.19 111.21 1ivr n GLY 377 Ca 0.17 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.77 1ivr n GLY 377 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1ivr s ARG 378 N -0.57 4.43 0.21 1.61 3.52 -1.25 -3.38 118.95 123.53 1ivr s ARG 378 Ca 0.00 1.85 0.08 0.00 -0.13 0.00 0.00 55.73 57.54 1ivr s ARG 378 Cb 0.00 -3.30 -0.05 0.00 -1.56 0.00 0.00 34.95 30.05 1ivr s ARG 378 CO 0.00 -0.23 -0.16 0.96 -0.81 0.00 0.00 175.30 175.06 1ivr s ILE 379 N 0.73 1.85 -0.46 4.11 -0.00 0.51 -3.26 121.20 124.67 1ivr s ILE 379 Ca 0.58 -2.21 -0.13 0.00 -0.00 0.00 0.00 60.65 58.89 1ivr s ILE 379 Cb -0.32 -2.06 0.09 0.00 -0.00 0.00 0.00 42.46 40.17 1ivr s ILE 379 CO 0.32 -0.54 0.36 -0.55 -0.00 0.00 0.00 174.94 174.52 1ivr s SER 380 N -3.28 5.93 0.27 4.36 0.15 0.11 -1.79 113.70 119.47 1ivr s SER 380 Ca 0.23 -1.52 0.26 0.00 0.70 0.00 0.00 55.95 55.61 1ivr s SER 380 Cb -0.02 -2.10 0.79 0.00 -1.71 0.00 0.00 66.02 62.98 1ivr s SER 380 CO 0.08 -0.65 1.75 1.62 1.20 0.00 0.00 173.24 177.24 1ivr h VAL 381 N 5.92 0.00 -0.92 4.45 3.04 -1.41 -2.93 116.25 124.40 1ivr h VAL 381 Ca -0.26 -0.52 0.12 0.00 -1.01 0.00 0.00 66.70 65.03 1ivr h VAL 381 Cb 1.10 1.47 -0.07 0.00 -2.01 0.00 0.00 31.29 31.78 1ivr h VAL 381 CO 0.86 0.00 0.59 0.00 -1.01 0.00 0.00 177.57 178.01 1ivr h ALA 382 N 2.37 1.66 -0.48 3.17 0.00 -1.78 -2.23 119.26 121.97 1ivr h ALA 382 Ca 0.00 0.01 -0.14 0.00 0.00 0.00 0.00 54.91 54.78 1ivr h ALA 382 Cb 0.70 -0.18 -0.08 0.00 0.00 0.00 0.00 17.79 18.23 1ivr h ALA 382 CO 0.00 0.12 0.17 0.41 0.00 0.00 0.00 179.25 179.96 1ivr n GLY 383 N -1.40 2.93 3.61 0.00 0.00 -1.11 -3.01 105.19 106.21 1ivr n GLY 383 Ca 0.17 -0.64 -0.33 0.00 0.00 0.00 0.00 46.02 45.22 1ivr n GLY 383 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1ivr s VAL 384 N -2.13 3.82 0.33 1.61 1.01 -0.84 -4.84 120.40 119.35 1ivr s VAL 384 Ca 0.36 -0.54 0.10 0.00 0.00 0.00 0.00 61.98 61.90 1ivr s VAL 384 Cb 0.28 -2.61 -0.06 0.00 0.00 0.00 0.00 36.38 34.00 1ivr s VAL 384 CO 0.09 0.52 -0.10 0.00 0.00 0.00 0.00 175.10 175.61 1ivr s ALA 385 N -0.90 2.87 0.39 5.51 0.00 -1.26 -4.85 121.76 123.52 1ivr s ALA 385 Ca 0.14 -2.05 0.18 0.00 0.00 0.00 0.00 51.96 50.24 1ivr s ALA 385 Cb -0.11 -0.05 1.09 0.00 0.00 0.00 0.00 23.12 24.05 1ivr s ALA 385 CO 0.04 0.09 1.77 0.77 0.00 0.00 0.00 175.76 178.43 1ivr h SER 386 N 2.08 0.46 0.63 0.00 0.02 -1.90 -0.44 113.55 114.40 1ivr h SER 386 Ca -0.42 0.08 0.00 0.00 -0.84 0.00 0.00 61.79 60.62 1ivr h SER 386 Cb 1.25 0.01 0.00 0.00 0.14 0.00 0.00 62.40 63.80 1ivr h SER 386 CO 0.69 0.09 -0.26 -1.54 -1.14 0.00 0.00 176.83 174.66 1ivr n SER 387 N -4.63 0.36 -0.07 3.07 3.41 -1.26 -4.00 113.62 110.49 1ivr n SER 387 Ca 0.25 -0.08 0.03 0.00 -0.26 0.00 0.00 58.87 58.81 1ivr n SER 387 Cb 0.87 -0.05 0.04 0.00 -0.26 0.00 0.00 64.21 64.80 1ivr n SER 387 CO 0.00 0.00 0.00 -0.46 -0.16 0.00 0.00 175.04 174.42 1ivr n ASN 388 N -1.38 1.56 -0.11 4.04 0.23 -0.22 -4.68 115.26 114.70 1ivr n ASN 388 Ca 0.08 -2.13 -0.09 0.00 -0.53 0.00 0.00 54.58 51.91 1ivr n ASN 388 Cb 0.33 -0.14 -0.01 0.00 -2.08 0.00 0.00 39.78 37.88 1ivr n ASN 388 CO 0.00 0.00 0.00 1.62 -0.93 0.00 0.00 177.26 177.95 1ivr h VAL 389 N 1.21 1.13 -0.19 3.53 3.04 -1.55 0.70 116.25 124.11 1ivr h VAL 389 Ca 0.00 -0.33 0.04 0.00 -1.01 0.00 0.00 66.70 65.40 1ivr h VAL 389 Cb 0.81 0.72 -0.03 0.00 -2.01 0.00 0.00 31.29 30.78 1ivr h VAL 389 CO 0.00 0.13 -0.03 1.23 -1.01 0.00 0.00 177.57 177.89 1ivr h GLY 390 N 0.44 0.16 0.62 3.17 0.00 -1.83 -1.78 103.07 103.85 1ivr h GLY 390 Ca 0.12 0.05 0.00 0.00 0.00 0.00 0.00 47.33 47.50 1ivr h GLY 390 CO -0.02 -0.06 -0.32 -1.82 0.00 0.00 0.00 176.54 174.32 1ivr h TYR 391 N 0.03 -0.86 -0.69 5.60 3.20 -1.61 -1.58 116.97 121.06 1ivr h TYR 391 Ca 0.09 0.01 0.13 0.00 3.14 0.00 0.00 58.73 62.10 1ivr h TYR 391 Cb 0.13 0.34 -0.09 0.00 1.54 0.00 0.00 36.73 38.65 1ivr h TYR 391 CO -0.20 -0.45 0.22 1.25 -1.64 0.00 0.00 178.16 177.34 1ivr h LEU 392 N -0.65 0.14 0.09 2.82 5.85 -0.40 -1.84 115.31 121.32 1ivr h LEU 392 Ca -0.01 0.11 -0.00 0.00 0.84 0.00 0.00 57.88 58.82 1ivr h LEU 392 Cb 0.60 0.12 0.00 0.00 0.37 0.00 0.00 40.66 41.76 1ivr h LEU 392 CO -0.08 0.05 -0.04 0.00 -0.34 0.00 0.00 178.44 178.03 1ivr h ALA 393 N 1.52 -0.12 -0.55 1.25 0.00 -1.06 0.57 119.26 120.87 1ivr h ALA 393 Ca 0.37 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.25 1ivr h ALA 393 Cb 0.56 0.05 -0.03 0.00 0.00 0.00 0.00 17.79 18.37 1ivr h ALA 393 CO -0.41 -0.56 0.35 1.25 0.00 0.00 0.00 179.25 179.88 1ivr h HIS 394 N -0.13 0.71 0.18 0.00 -0.00 -0.85 -1.62 115.15 113.45 1ivr h HIS 394 Ca -0.01 0.01 -0.01 0.00 -0.00 0.00 0.00 60.37 60.36 1ivr h HIS 394 Cb 0.10 -0.24 0.00 0.00 -0.00 0.00 0.00 27.41 27.27 1ivr h HIS 394 CO -0.07 0.46 -0.09 0.00 -0.00 0.00 0.00 177.93 178.23 1ivr h ALA 395 N 1.64 -0.24 -0.75 5.26 0.00 -0.42 0.92 119.26 125.66 1ivr h ALA 395 Ca 0.20 -0.20 0.15 0.00 0.00 0.00 0.00 54.91 55.06 1ivr h ALA 395 Cb -0.06 0.09 -0.10 0.00 0.00 0.00 0.00 17.79 17.72 1ivr h ALA 395 CO -0.04 -0.43 0.28 0.82 0.00 0.00 0.00 179.25 179.88 1ivr h ILE 396 N -0.66 0.63 -0.32 0.00 5.03 0.22 0.17 117.51 122.58 1ivr h ILE 396 Ca -0.02 -0.14 -0.02 0.00 -0.12 0.00 0.00 64.86 64.56 1ivr h ILE 396 Cb 0.48 0.19 -0.01 0.00 -3.03 0.00 0.00 36.82 34.44 1ivr h ILE 396 CO 0.04 0.07 0.13 -0.74 -0.68 0.00 0.00 178.15 176.98 1ivr h HIS 397 N 0.41 0.48 -0.08 1.37 2.76 -1.14 -2.74 115.15 116.20 1ivr h HIS 397 Ca 0.42 -0.03 -0.00 0.00 -2.20 0.00 0.00 60.37 58.55 1ivr h HIS 397 Cb 0.65 -0.15 -0.00 0.00 1.55 0.00 0.00 27.41 29.46 1ivr h HIS 397 CO -0.18 0.46 0.05 1.96 -1.30 0.00 0.00 177.93 178.91 1ivr h GLN 398 N 0.37 0.11 0.00 5.26 1.08 0.12 3.22 115.11 125.27 1ivr h GLN 398 Ca 0.11 -0.01 0.00 0.00 -1.45 0.00 0.00 58.65 57.30 1ivr h GLN 398 Cb 0.17 -0.02 0.00 0.00 -0.05 0.00 0.00 27.48 27.58 1ivr h GLN 398 CO -0.01 0.12 0.00 0.28 -0.95 0.00 0.00 178.83 178.27 1ivr n VAL 399 N -5.01 0.69 -0.03 -0.54 0.31 -0.76 -2.75 118.33 110.24 1ivr n VAL 399 Ca -0.06 0.08 -0.00 0.00 -0.01 0.00 0.00 64.34 64.35 1ivr n VAL 399 Cb 0.05 -0.90 -0.09 0.00 -0.91 0.00 0.00 33.84 31.99 1ivr n VAL 399 CO 0.00 0.00 0.00 0.41 -1.32 0.00 0.00 176.83 175.92 1ivr n THR 400 N -1.99 0.41 0.00 2.52 -1.04 -1.03 -4.84 114.28 108.32 1ivr n THR 400 Ca 0.04 -0.39 0.00 0.00 -2.04 0.00 0.00 64.05 61.66 1ivr n THR 400 Cb 0.28 -0.27 0.00 0.00 -1.82 0.00 0.00 70.33 68.52 1ivr n THR 400 CO 0.00 0.00 0.00 1.17 -0.64 0.00 0.00 175.07 175.60