#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1rzh s GLU 2 N 0.00 3.54 0.15 0.00 2.02 -1.26 -5.05 118.70 118.10 1rzh s GLU 2 Ca 0.00 -0.27 -0.32 0.00 0.02 0.00 0.00 54.97 54.40 1rzh s GLU 2 Cb 0.00 -2.90 -0.12 0.00 0.10 0.00 0.00 34.13 31.21 1rzh s GLU 2 CO 0.00 0.49 1.75 0.98 0.02 0.00 0.00 175.26 178.50 1rzh n TYR 3 N -0.07 2.59 1.05 1.61 9.36 -1.26 -4.91 117.16 125.54 1rzh n TYR 3 Ca -0.04 0.00 0.11 0.00 3.32 0.00 0.00 57.90 61.30 1rzh n TYR 3 Cb 0.52 -2.67 0.11 0.00 -0.63 0.00 0.00 39.34 36.66 1rzh n TYR 3 CO 0.00 0.00 0.00 1.04 0.22 0.00 0.00 176.86 178.12 1rzh n GLN 4 N 4.68 0.43 -3.11 2.98 1.13 -1.26 -4.99 117.38 117.25 1rzh n GLN 4 Ca 0.17 -0.32 -0.20 0.00 -1.94 0.00 0.00 57.00 54.71 1rzh n GLN 4 Cb 0.34 -1.49 0.04 0.00 0.11 0.00 0.00 30.24 29.24 1rzh n GLN 4 CO 0.00 0.00 0.00 -1.71 -1.44 0.00 0.00 177.06 173.91 1rzh n ASN 5 N -1.01 -5.73 -0.01 1.08 5.15 -1.26 -4.90 115.26 108.58 1rzh n ASN 5 Ca 0.07 -0.33 -0.16 0.00 -0.60 0.00 0.00 54.58 53.56 1rzh n ASN 5 Cb 0.37 -4.49 -0.14 0.00 -0.53 0.00 0.00 39.78 34.99 1rzh n ASN 5 CO 0.00 0.00 0.00 -0.38 1.40 0.00 0.00 177.26 178.28 1rzh n ILE 6 N -4.50 1.70 -4.61 -1.44 2.08 -1.26 -4.87 119.36 106.46 1rzh n ILE 6 Ca -0.07 -0.71 -0.23 0.00 0.56 0.00 0.00 62.75 62.30 1rzh n ILE 6 Cb 0.59 -1.43 -0.14 0.00 -0.75 0.00 0.00 39.64 37.90 1rzh n ILE 6 CO 0.00 0.00 0.00 -0.36 0.56 0.00 0.00 176.55 176.75 1rzh s PHE 7 N -2.57 1.44 0.59 1.39 0.08 -1.26 -4.79 117.98 112.86 1rzh s PHE 7 Ca -0.16 -0.31 -0.18 0.00 0.12 0.00 0.00 56.93 56.40 1rzh s PHE 7 Cb 0.07 -0.89 -0.04 0.00 -0.57 0.00 0.00 43.02 41.59 1rzh s PHE 7 CO 0.79 0.02 1.12 -1.12 -0.10 0.00 0.00 175.22 175.92 1rzh s SER 8 N -0.75 5.50 -0.03 1.36 0.01 -0.21 -4.96 113.70 114.61 1rzh s SER 8 Ca 0.05 2.09 -0.04 0.00 1.31 0.00 0.00 55.95 59.36 1rzh s SER 8 Cb -0.07 -2.57 -0.28 0.00 0.21 0.00 0.00 66.02 63.31 1rzh s SER 8 CO 0.00 -1.37 0.73 1.56 0.41 0.00 0.00 173.24 174.57 1rzh h GLN 9 N 0.72 0.27 -3.69 12.44 4.20 -1.98 -3.47 115.11 123.60 1rzh h GLN 9 Ca -0.49 -0.45 -0.24 0.00 0.06 0.00 0.00 58.65 57.53 1rzh h GLN 9 Cb 1.25 0.17 -0.29 0.00 0.30 0.00 0.00 27.48 28.91 1rzh h GLN 9 CO 0.56 1.12 -0.72 0.54 -0.67 0.00 0.00 178.83 179.66 1rzh s VAL 10 N -2.60 -0.01 -0.06 -0.54 0.11 -1.26 -5.15 120.40 110.89 1rzh s VAL 10 Ca -0.12 0.03 -0.02 0.00 -2.93 0.00 0.00 61.98 58.93 1rzh s VAL 10 Cb 0.07 -0.02 -0.04 0.00 -1.53 0.00 0.00 36.38 34.85 1rzh s VAL 10 CO 0.84 0.01 0.06 -1.10 -3.33 0.00 0.00 175.10 171.58 1rzh s GLN 11 N 0.15 3.10 0.09 1.54 -0.21 -1.26 -5.11 119.66 117.96 1rzh s GLN 11 Ca -0.01 -0.38 0.08 0.00 0.02 0.00 0.00 55.36 55.07 1rzh s GLN 11 Cb -0.02 -2.89 -0.03 0.00 1.00 0.00 0.00 33.01 31.07 1rzh s GLN 11 CO -0.00 0.70 -0.22 0.14 -2.12 0.00 0.00 175.29 173.79 1rzh s VAL 12 N -1.02 1.78 0.00 1.09 -7.23 -1.26 -5.14 120.40 108.62 1rzh s VAL 12 Ca 0.17 -1.50 -0.01 0.00 -1.81 0.00 0.00 61.98 58.84 1rzh s VAL 12 Cb -0.12 -1.60 -0.01 0.00 0.56 0.00 0.00 36.38 35.22 1rzh s VAL 12 CO 0.07 0.02 0.01 -0.60 -0.31 0.00 0.00 175.10 174.28 1rzh s ARG 13 N -1.76 0.14 0.00 4.82 3.52 -1.26 -5.03 118.95 119.38 1rzh s ARG 13 Ca 0.08 -0.21 0.00 0.00 -0.13 0.00 0.00 55.73 55.46 1rzh s ARG 13 Cb -0.10 0.05 0.00 0.00 -1.56 0.00 0.00 34.95 33.35 1rzh s ARG 13 CO 0.04 -0.02 0.00 0.41 -0.81 0.00 0.00 175.30 174.91 1rzh n GLY 14 N 2.49 5.40 3.72 8.12 0.00 -1.26 -5.12 105.19 118.55 1rzh n GLY 14 Ca -0.17 -1.94 -0.35 0.00 0.00 0.00 0.00 46.02 43.56 1rzh n GLY 14 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 1rzh s PRO 15 N -0.67 2.24 0.18 1.61 0.02 -1.26 -4.86 135.00 132.25 1rzh s PRO 15 Ca 0.00 1.86 -0.33 0.00 0.02 0.00 0.00 61.00 62.55 1rzh s PRO 15 Cb 0.00 -1.83 -0.14 0.00 0.02 0.00 0.00 34.50 32.54 1rzh s PRO 15 CO 0.00 -1.78 1.42 0.00 -0.33 0.00 0.00 177.00 176.30 1rzh n ALA 16 N -2.48 0.57 -2.55 -1.55 0.00 -1.26 -4.90 120.51 108.34 1rzh n ALA 16 Ca 0.14 0.45 -0.43 0.00 0.00 0.00 0.00 53.44 53.60 1rzh n ALA 16 Cb 0.50 -2.23 -0.05 0.00 0.00 0.00 0.00 19.45 17.66 1rzh n ALA 16 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1rzh s ASP 17 N 0.49 6.45 0.00 0.00 -1.08 -1.26 -4.91 116.67 116.36 1rzh s ASP 17 Ca 0.75 0.01 0.30 0.00 -0.52 0.00 0.00 52.55 53.09 1rzh s ASP 17 Cb -0.74 -2.40 1.39 0.00 -1.46 0.00 0.00 42.92 39.71 1rzh s ASP 17 CO 0.46 -0.92 1.97 0.18 0.52 0.00 0.00 175.17 177.38 1rzh n LEU 18 N 6.77 0.17 0.00 -1.34 4.77 -1.26 -4.68 117.00 121.43 1rzh n LEU 18 Ca 0.03 0.19 0.00 0.00 -0.03 0.00 0.00 56.01 56.20 1rzh n LEU 18 Cb 0.48 -0.26 0.00 0.00 -2.33 0.00 0.00 43.42 41.32 1rzh n LEU 18 CO 0.59 0.03 0.00 0.61 -1.33 0.00 0.00 177.39 177.29 1rzh n GLY 19 N 1.30 -2.29 3.80 -0.72 0.00 -1.26 -4.94 105.19 101.09 1rzh n GLY 19 Ca 0.14 -1.54 -0.34 0.00 0.00 0.00 0.00 46.02 44.28 1rzh n GLY 19 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1rzh s MET 20 N -0.75 4.26 -0.18 1.61 -1.94 -1.26 -5.02 119.30 116.03 1rzh s MET 20 Ca 0.00 1.23 -0.14 0.00 -1.71 0.00 0.00 55.69 55.07 1rzh s MET 20 Cb 0.00 -2.35 -0.08 0.00 2.01 0.00 0.00 34.83 34.41 1rzh s MET 20 CO 0.00 -0.01 -0.15 2.41 -0.01 0.00 0.00 175.02 177.26 1rzh n THR 21 N -0.33 1.47 -0.21 2.05 -1.04 -1.26 -4.92 114.28 110.04 1rzh n THR 21 Ca 0.06 0.08 0.00 0.00 -2.04 0.00 0.00 64.05 62.15 1rzh n THR 21 Cb 0.52 -2.25 0.00 0.00 -1.82 0.00 0.00 70.33 66.78 1rzh n THR 21 CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 1rzh n GLU 22 N -4.50 0.00 -0.68 -2.82 -0.58 -1.26 -0.86 120.64 109.93 1rzh n GLU 22 Ca -0.19 0.00 0.06 0.00 -0.42 0.00 0.00 57.16 56.61 1rzh n GLU 22 Cb 0.48 0.00 0.33 0.00 -0.57 0.00 0.00 31.44 31.68 1rzh n GLU 22 CO 0.00 0.00 0.00 -0.25 -0.48 0.00 0.00 177.13 176.40 1rzh n ASP 23 N 1.02 4.69 -4.75 1.62 8.00 -0.40 -4.97 116.55 121.77 1rzh n ASP 23 Ca 0.00 -2.65 -0.40 0.00 0.71 0.00 0.00 54.79 52.45 1rzh n ASP 23 Cb 0.00 -0.62 -0.04 0.00 -0.02 0.00 0.00 41.12 40.44 1rzh n ASP 23 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 1rzh s VAL 24 N -2.26 3.59 -0.86 2.53 1.01 -0.04 -4.89 120.40 119.47 1rzh s VAL 24 Ca 0.45 1.54 -0.25 0.00 0.00 0.00 0.00 61.98 63.72 1rzh s VAL 24 Cb 0.33 -3.98 0.04 0.00 0.00 0.00 0.00 36.38 32.76 1rzh s VAL 24 CO 0.16 0.34 1.36 0.21 0.00 0.00 0.00 175.10 177.17 1rzh s ASN 25 N -0.70 6.30 0.62 3.32 3.84 -1.26 -4.84 114.94 122.21 1rzh s ASN 25 Ca 0.46 -0.89 0.30 0.00 0.21 0.00 0.00 52.86 52.94 1rzh s ASN 25 Cb -0.31 -2.56 1.65 0.00 -0.55 0.00 0.00 41.25 39.48 1rzh s ASN 25 CO 0.39 -1.70 2.00 -0.07 -2.79 0.00 0.00 177.10 174.93 1rzh h LEU 26 N 12.97 0.00 -1.96 3.21 4.07 -1.93 -0.29 115.31 131.38 1rzh h LEU 26 Ca -0.07 0.00 -0.02 0.00 0.08 0.00 0.00 57.88 57.87 1rzh h LEU 26 Cb 1.03 0.00 -0.00 0.00 1.08 0.00 0.00 40.66 42.77 1rzh h LEU 26 CO 1.35 0.00 -0.10 0.00 -1.08 0.00 0.00 178.44 178.61 1rzh h ALA 27 N 1.54 1.57 -0.21 1.53 0.00 -2.02 -1.86 119.26 119.81 1rzh h ALA 27 Ca 0.09 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1rzh h ALA 27 Cb 0.72 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.49 1rzh h ALA 27 CO -0.00 0.12 0.00 0.09 0.00 0.00 0.00 179.25 179.46 1rzh n ASN 28 N -4.03 2.16 -4.76 0.00 3.02 -0.12 -4.87 115.26 106.66 1rzh n ASN 28 Ca -0.02 -1.78 -0.36 0.00 -0.03 0.00 0.00 54.58 52.38 1rzh n ASN 28 Cb 0.19 -0.13 -0.07 0.00 -0.61 0.00 0.00 39.78 39.15 1rzh n ASN 28 CO 0.00 0.00 0.00 -0.60 -2.62 0.00 0.00 177.26 174.04 1rzh s ARG 29 N -1.74 4.06 0.60 3.52 3.52 -0.70 -0.38 118.95 127.82 1rzh s ARG 29 Ca 0.34 -0.06 -0.10 0.00 -0.13 0.00 0.00 55.73 55.78 1rzh s ARG 29 Cb 0.19 -3.37 0.14 0.00 -1.56 0.00 0.00 34.95 30.35 1rzh s ARG 29 CO 0.28 0.39 0.71 -1.13 -0.81 0.00 0.00 175.30 174.74 1rzh n SER 30 N 3.16 -0.48 -4.72 -2.12 3.41 0.06 -4.96 113.62 107.97 1rzh n SER 30 Ca -0.15 -1.14 -0.25 0.00 -0.26 0.00 0.00 58.87 57.07 1rzh n SER 30 Cb 0.53 -0.57 0.10 0.00 -0.26 0.00 0.00 64.21 64.00 1rzh n SER 30 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 1rzh s GLY 31 N -4.31 1.76 0.41 5.00 0.00 -1.26 -4.55 107.32 104.36 1rzh s GLY 31 Ca 0.42 -1.36 -0.25 0.00 0.00 0.00 0.00 44.72 43.53 1rzh s GLY 31 CO 0.30 -0.86 1.14 0.54 0.00 0.00 0.00 173.10 174.22 1rzh s VAL 32 N -3.21 3.30 0.00 1.40 0.11 -1.26 -4.20 120.40 116.53 1rzh s VAL 32 Ca 0.64 1.05 0.00 0.00 -2.93 0.00 0.00 61.98 60.74 1rzh s VAL 32 Cb -0.07 -3.57 0.00 0.00 -1.53 0.00 0.00 36.38 31.21 1rzh s VAL 32 CO 0.45 0.06 0.00 0.61 -3.33 0.00 0.00 175.10 172.88 1rzh n GLY 33 N 0.54 0.07 3.79 6.54 0.00 0.15 -4.93 105.19 111.35 1rzh n GLY 33 Ca 0.05 -1.80 -0.29 0.00 0.00 0.00 0.00 46.02 43.98 1rzh n GLY 33 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1rzh s PRO 34 N -0.68 0.62 -0.12 1.61 0.04 -1.26 -4.61 135.00 130.60 1rzh s PRO 34 Ca 0.00 0.06 -0.02 0.00 0.04 0.00 0.00 61.00 61.08 1rzh s PRO 34 Cb 0.00 -1.80 -0.03 0.00 0.04 0.00 0.00 34.50 32.71 1rzh s PRO 34 CO 0.00 -2.50 -0.05 -0.06 0.04 0.00 0.00 177.00 174.43 1rzh s PHE 35 N -3.38 3.00 -0.37 0.56 0.40 -1.26 -2.27 117.98 114.66 1rzh s PHE 35 Ca 0.67 -0.19 -0.08 0.00 -0.60 0.00 0.00 56.93 56.73 1rzh s PHE 35 Cb -0.11 -1.87 0.05 0.00 0.51 0.00 0.00 43.02 41.60 1rzh s PHE 35 CO 0.54 0.10 0.17 0.45 0.70 0.00 0.00 175.22 177.18 1rzh s SER 36 N -0.07 5.48 0.43 1.36 0.15 0.69 -4.93 113.70 116.81 1rzh s SER 36 Ca 0.01 -1.27 0.12 0.00 0.70 0.00 0.00 55.95 55.51 1rzh s SER 36 Cb -0.13 -1.93 0.93 0.00 -1.71 0.00 0.00 66.02 63.17 1rzh s SER 36 CO 0.03 -0.41 1.99 0.74 1.20 0.00 0.00 173.24 176.78 1rzh h THR 37 N 6.10 1.13 0.62 6.45 2.02 -1.98 -0.31 112.91 126.95 1rzh h THR 37 Ca -0.23 -0.56 -0.03 0.00 0.77 0.00 0.00 66.41 66.36 1rzh h THR 37 Cb 1.08 1.14 0.01 0.00 -1.74 0.00 0.00 68.15 68.64 1rzh h THR 37 CO 0.67 0.17 -0.30 0.25 0.37 0.00 0.00 175.52 176.68 1rzh h LEU 38 N 0.16 -0.71 -1.16 2.58 5.85 -1.96 -2.69 115.31 117.38 1rzh h LEU 38 Ca 0.04 0.02 -0.01 0.00 0.84 0.00 0.00 57.88 58.77 1rzh h LEU 38 Cb 0.26 0.18 -0.03 0.00 0.37 0.00 0.00 40.66 41.44 1rzh h LEU 38 CO 0.01 -0.50 0.39 -0.07 -0.34 0.00 0.00 178.44 177.93 1rzh h LEU 39 N -0.84 0.86 -2.06 2.25 3.38 -1.81 -2.70 115.31 114.39 1rzh h LEU 39 Ca -0.09 -0.06 0.00 0.00 0.09 0.00 0.00 57.88 57.82 1rzh h LEU 39 Cb 0.64 -0.22 0.00 0.00 0.09 0.00 0.00 40.66 41.17 1rzh h LEU 39 CO 0.14 0.69 0.17 1.23 0.09 0.00 0.00 178.44 180.76 1rzh h GLY 40 N 1.02 0.00 2.00 0.83 0.00 -0.73 0.63 103.07 106.83 1rzh h GLY 40 Ca 0.25 0.00 -0.05 0.00 0.00 0.00 0.00 47.33 47.53 1rzh h GLY 40 CO -0.04 0.00 -0.26 1.49 0.00 0.00 0.00 176.54 177.73 1rzh h TRP 41 N 0.00 0.00 0.00 5.60 4.06 -1.34 -3.37 115.95 120.90 1rzh h TRP 41 Ca 0.00 0.00 -0.27 0.00 2.06 0.00 0.00 58.89 60.68 1rzh h TRP 41 Cb 0.35 0.00 -0.04 0.00 -1.00 0.00 0.00 29.16 28.47 1rzh h TRP 41 CO 0.00 0.26 -1.93 0.34 -3.56 0.00 0.00 178.44 173.54 1rzh n PHE 42 N -3.26 0.00 -1.88 0.49 7.35 -0.01 -1.05 117.46 119.10 1rzh n PHE 42 Ca 0.01 0.00 0.00 0.00 -0.76 0.00 0.00 57.45 56.70 1rzh n PHE 42 Cb 0.54 -0.61 0.00 0.00 0.35 0.00 0.00 39.48 39.75 1rzh n PHE 42 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 1rzh n GLY 43 N 2.31 5.38 3.77 7.13 0.00 0.01 -4.90 105.19 118.88 1rzh n GLY 43 Ca -0.31 -1.11 -0.41 0.00 0.00 0.00 0.00 46.02 44.19 1rzh n GLY 43 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1rzh s ASN 44 N 1.04 6.72 0.28 1.61 0.01 -1.26 -3.85 114.94 119.49 1rzh s ASN 44 Ca 0.00 2.72 0.23 0.00 -0.71 0.00 0.00 52.86 55.09 1rzh s ASN 44 Cb 0.00 -2.65 0.12 0.00 0.41 0.00 0.00 41.25 39.13 1rzh s ASN 44 CO 0.00 -0.59 1.24 0.00 -1.51 0.00 0.00 177.10 176.24 1rzh h ALA 45 N 3.57 0.67 -2.50 0.60 0.00 -1.84 -3.36 119.26 116.39 1rzh h ALA 45 Ca -0.49 0.00 -0.53 0.00 0.00 0.00 0.00 54.91 53.89 1rzh h ALA 45 Cb 1.23 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 19.02 1rzh h ALA 45 CO 0.67 0.00 0.51 -1.14 0.00 0.00 0.00 179.25 179.29 1rzh s GLN 46 N -3.31 4.48 -0.13 0.00 0.74 -1.26 -0.22 119.66 119.96 1rzh s GLN 46 Ca 0.02 1.69 -0.03 0.00 0.05 0.00 0.00 55.36 57.09 1rzh s GLN 46 Cb 0.08 -3.36 -0.03 0.00 1.10 0.00 0.00 33.01 30.80 1rzh s GLN 46 CO 0.75 -0.16 -0.03 -0.51 -0.55 0.00 0.00 175.29 174.79 1rzh s LEU 47 N 0.82 3.35 0.00 3.68 1.02 -0.96 -4.97 118.68 121.61 1rzh s LEU 47 Ca 0.56 -0.05 0.00 0.00 0.02 0.00 0.00 54.13 54.66 1rzh s LEU 47 Cb -0.28 -1.79 0.00 0.00 0.02 0.00 0.00 46.19 44.14 1rzh s LEU 47 CO 0.30 0.24 0.00 0.61 0.02 0.00 0.00 176.35 177.51 1rzh n GLY 48 N 3.09 -2.02 3.73 -3.19 0.00 -1.26 0.30 105.19 105.85 1rzh n GLY 48 Ca -0.18 -1.36 -0.29 0.00 0.00 0.00 0.00 46.02 44.19 1rzh n GLY 48 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1rzh s PRO 49 N -1.11 0.41 0.11 1.61 0.04 -1.26 -4.60 135.00 130.20 1rzh s PRO 49 Ca 0.00 0.20 0.07 0.00 0.04 0.00 0.00 61.00 61.32 1rzh s PRO 49 Cb 0.00 -1.76 -0.04 0.00 0.04 0.00 0.00 34.50 32.74 1rzh s PRO 49 CO 0.00 -2.67 -0.18 -1.50 0.04 0.00 0.00 177.00 172.69 1rzh s ILE 50 N -3.20 1.58 -0.20 0.56 2.07 -1.26 -4.93 121.20 115.82 1rzh s ILE 50 Ca 0.67 -1.61 -0.11 0.00 -1.41 0.00 0.00 60.65 58.18 1rzh s ILE 50 Cb -0.14 -1.54 -0.05 0.00 0.13 0.00 0.00 42.46 40.87 1rzh s ILE 50 CO 0.55 -0.20 0.18 -0.47 -1.91 0.00 0.00 174.94 173.09 1rzh s TYR 51 N -1.52 3.41 -0.36 3.50 6.14 -1.26 -0.76 117.35 126.50 1rzh s TYR 51 Ca 0.07 0.39 0.01 0.00 0.64 0.00 0.00 57.07 58.18 1rzh s TYR 51 Cb -0.08 -2.22 0.15 0.00 0.42 0.00 0.00 41.96 40.22 1rzh s TYR 51 CO 0.04 0.24 0.24 -0.51 0.64 0.00 0.00 175.55 176.20 1rzh s LEU 52 N 0.49 1.05 0.00 6.97 1.43 0.49 -4.96 118.68 124.15 1rzh s LEU 52 Ca 0.10 -2.36 0.00 0.00 -1.03 0.00 0.00 54.13 50.85 1rzh s LEU 52 Cb -0.12 -0.40 0.00 0.00 0.03 0.00 0.00 46.19 45.70 1rzh s LEU 52 CO 0.00 -0.28 0.00 0.61 0.23 0.00 0.00 176.35 176.91 1rzh n GLY 53 N 3.81 0.38 0.07 -3.19 0.00 -1.26 -4.80 105.19 100.20 1rzh n GLY 53 Ca 0.16 -1.83 -0.13 0.00 0.00 0.00 0.00 46.02 44.22 1rzh n GLY 53 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 1rzh h SER 54 N 0.00 -0.07 -0.97 1.61 0.02 -1.99 -1.86 113.55 110.30 1rzh h SER 54 Ca 0.00 -0.08 0.11 0.00 -0.84 0.00 0.00 61.79 60.99 1rzh h SER 54 Cb 0.00 0.02 -0.08 0.00 0.14 0.00 0.00 62.40 62.47 1rzh h SER 54 CO 0.00 0.04 0.60 0.25 -1.14 0.00 0.00 176.83 176.57 1rzh h LEU 55 N -0.17 0.87 -0.63 5.07 5.85 -1.96 -0.31 115.31 124.03 1rzh h LEU 55 Ca -0.01 0.05 -0.12 0.00 0.84 0.00 0.00 57.88 58.64 1rzh h LEU 55 Cb 0.14 -0.12 -0.01 0.00 0.37 0.00 0.00 40.66 41.03 1rzh h LEU 55 CO 0.01 0.47 -0.20 1.23 -0.34 0.00 0.00 178.44 179.62 1rzh h GLY 56 N 0.95 0.94 1.19 3.75 0.00 -1.84 -0.90 103.07 107.17 1rzh h GLY 56 Ca 0.48 -0.80 -0.10 0.00 0.00 0.00 0.00 47.33 46.91 1rzh h GLY 56 CO -0.26 0.73 -0.06 -2.08 0.00 0.00 0.00 176.54 174.87 1rzh h VAL 57 N 0.76 1.26 -0.00 4.60 2.07 -0.45 -1.23 116.25 123.26 1rzh h VAL 57 Ca 0.11 -1.18 -0.00 0.00 0.82 0.00 0.00 66.70 66.45 1rzh h VAL 57 Cb 0.73 0.91 -0.00 0.00 -1.52 0.00 0.00 31.29 31.41 1rzh h VAL 57 CO 0.06 0.42 0.00 0.25 0.02 0.00 0.00 177.57 178.32 1rzh h LEU 58 N 0.87 0.01 -0.23 2.57 5.85 -0.86 -0.11 115.31 123.40 1rzh h LEU 58 Ca 0.15 -0.12 0.02 0.00 0.84 0.00 0.00 57.88 58.77 1rzh h LEU 58 Cb 0.59 -0.00 -0.03 0.00 0.37 0.00 0.00 40.66 41.60 1rzh h LEU 58 CO 0.04 0.13 0.07 -1.28 -0.34 0.00 0.00 178.44 177.05 1rzh h SER 59 N -0.12 0.07 -0.70 1.25 0.87 -0.99 0.80 113.55 114.73 1rzh h SER 59 Ca 0.00 0.03 -0.05 0.00 -1.23 0.00 0.00 61.79 60.54 1rzh h SER 59 Cb 0.12 0.02 -0.03 0.00 -0.44 0.00 0.00 62.40 62.08 1rzh h SER 59 CO -0.00 0.07 0.24 -0.07 -0.53 0.00 0.00 176.83 176.54 1rzh h LEU 60 N 0.17 1.01 0.10 2.23 3.38 -1.15 0.14 115.31 121.19 1rzh h LEU 60 Ca 0.10 -0.17 -0.01 0.00 0.09 0.00 0.00 57.88 57.89 1rzh h LEU 60 Cb 0.08 -0.26 0.00 0.00 0.09 0.00 0.00 40.66 40.56 1rzh h LEU 60 CO -0.11 0.93 -0.05 0.15 0.09 0.00 0.00 178.44 179.45 1rzh h PHE 61 N 1.05 -0.13 -0.36 1.13 3.57 -0.51 -0.73 116.94 120.98 1rzh h PHE 61 Ca 0.24 -0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.73 1rzh h PHE 61 Cb 0.26 0.04 -0.02 0.00 2.79 0.00 0.00 35.95 39.03 1rzh h PHE 61 CO 0.02 0.08 0.23 0.77 -2.23 0.00 0.00 178.31 177.18 1rzh h SER 62 N -0.32 0.42 -0.67 0.41 0.02 -0.71 -0.03 113.55 112.67 1rzh h SER 62 Ca -0.01 -0.03 0.05 0.00 -0.84 0.00 0.00 61.79 60.95 1rzh h SER 62 Cb 0.26 -0.11 -0.05 0.00 0.14 0.00 0.00 62.40 62.65 1rzh h SER 62 CO 0.02 0.33 0.39 1.23 -1.14 0.00 0.00 176.83 177.66 1rzh h GLY 63 N 0.47 0.98 1.04 -3.77 0.00 -0.66 0.95 103.07 102.09 1rzh h GLY 63 Ca 0.13 -0.28 -0.10 0.00 0.00 0.00 0.00 47.33 47.08 1rzh h GLY 63 CO -0.03 0.20 -0.07 1.41 0.00 0.00 0.00 176.54 178.05 1rzh h LEU 64 N 0.74 0.93 -1.17 3.11 3.38 -0.80 -1.63 115.31 119.86 1rzh h LEU 64 Ca 0.29 -0.34 -0.03 0.00 0.09 0.00 0.00 57.88 57.88 1rzh h LEU 64 Cb 0.12 -0.25 -0.03 0.00 0.09 0.00 0.00 40.66 40.60 1rzh h LEU 64 CO -0.15 1.05 0.18 0.24 0.09 0.00 0.00 178.44 179.85 1rzh h MET 65 N 0.79 0.76 0.12 1.13 2.86 -0.42 0.40 114.93 120.57 1rzh h MET 65 Ca 0.13 -0.12 -0.01 0.00 -2.06 0.00 0.00 59.70 57.64 1rzh h MET 65 Cb 0.61 -0.13 0.00 0.00 0.06 0.00 0.00 31.60 32.14 1rzh h MET 65 CO 0.04 0.65 -0.06 2.35 1.06 0.00 0.00 176.91 180.95 1rzh h TRP 66 N 0.75 -0.15 -0.41 -0.22 7.01 -0.51 0.12 115.95 122.54 1rzh h TRP 66 Ca 0.18 -0.00 0.02 0.00 2.11 0.00 0.00 58.89 61.19 1rzh h TRP 66 Cb 0.19 0.05 -0.03 0.00 -2.10 0.00 0.00 29.16 27.27 1rzh h TRP 66 CO 0.01 -0.01 0.24 0.35 -2.79 0.00 0.00 178.44 176.25 1rzh h PHE 67 N -0.26 0.46 -0.38 2.65 3.57 -0.71 -2.61 116.94 119.66 1rzh h PHE 67 Ca -0.02 0.01 -0.11 0.00 3.53 0.00 0.00 57.97 61.39 1rzh h PHE 67 Cb 0.21 -0.15 -0.01 0.00 2.79 0.00 0.00 35.95 38.79 1rzh h PHE 67 CO -0.04 0.27 -0.21 0.74 -2.23 0.00 0.00 178.31 176.84 1rzh h PHE 68 N 0.50 0.82 -0.21 0.41 0.05 -0.09 -0.75 116.94 117.67 1rzh h PHE 68 Ca 0.16 -0.18 -0.00 0.00 3.82 0.00 0.00 57.97 61.77 1rzh h PHE 68 Cb 0.00 -0.20 -0.01 0.00 2.00 0.00 0.00 35.95 37.74 1rzh h PHE 68 CO -0.07 0.88 0.13 1.15 -0.18 0.00 0.00 178.31 180.21 1rzh h THR 69 N 0.64 1.08 -0.46 -1.55 2.02 -0.56 0.37 112.91 114.45 1rzh h THR 69 Ca 0.09 -0.18 -0.03 0.00 0.77 0.00 0.00 66.41 67.07 1rzh h THR 69 Cb 0.70 0.83 -0.02 0.00 -1.74 0.00 0.00 68.15 67.91 1rzh h THR 69 CO 0.05 0.07 0.18 0.40 0.37 0.00 0.00 175.52 176.60 1rzh h ILE 70 N 0.26 1.21 -0.58 3.11 2.04 -1.37 -2.67 117.51 119.50 1rzh h ILE 70 Ca 0.07 -0.64 -0.02 0.00 1.00 0.00 0.00 64.86 65.27 1rzh h ILE 70 Cb 0.01 0.76 -0.03 0.00 -0.74 0.00 0.00 36.82 36.83 1rzh h ILE 70 CO -0.01 0.24 0.27 1.23 0.00 0.00 0.00 178.15 179.88 1rzh h GLY 71 N 0.61 0.91 1.19 5.37 0.00 -0.70 -0.91 103.07 109.54 1rzh h GLY 71 Ca 0.15 -0.46 -0.01 0.00 0.00 0.00 0.00 47.33 47.01 1rzh h GLY 71 CO -0.01 0.44 0.46 1.19 0.00 0.00 0.00 176.54 178.61 1rzh h ILE 72 N 0.80 1.22 -0.62 2.60 6.09 -0.20 -0.62 117.51 126.79 1rzh h ILE 72 Ca 0.20 -0.52 -0.08 0.00 -1.37 0.00 0.00 64.86 63.09 1rzh h ILE 72 Cb 0.14 0.13 -0.02 0.00 0.47 0.00 0.00 36.82 37.54 1rzh h ILE 72 CO -0.02 0.24 0.06 -0.25 -3.07 0.00 0.00 178.15 175.11 1rzh h TRP 73 N 1.09 1.11 -0.69 2.19 2.91 -1.09 -1.73 115.95 119.73 1rzh h TRP 73 Ca 0.28 -0.16 -0.04 0.00 1.13 0.00 0.00 58.89 60.10 1rzh h TRP 73 Cb -0.02 -0.30 -0.03 0.00 -0.51 0.00 0.00 29.16 28.30 1rzh h TRP 73 CO 0.01 0.95 0.29 0.74 -1.03 0.00 0.00 178.44 179.40 1rzh h PHE 74 N 0.96 1.04 -0.66 2.65 -1.00 -0.13 -1.33 116.94 118.47 1rzh h PHE 74 Ca 0.18 -0.07 -0.04 0.00 2.81 0.00 0.00 57.97 60.85 1rzh h PHE 74 Cb 0.47 -0.31 -0.03 0.00 3.61 0.00 0.00 35.95 39.69 1rzh h PHE 74 CO 0.03 0.80 0.26 -1.49 -1.61 0.00 0.00 178.31 176.30 1rzh h TRP 75 N 0.98 1.01 0.20 -0.55 4.06 -0.86 -1.38 115.95 119.41 1rzh h TRP 75 Ca 0.23 -0.08 0.01 0.00 2.06 0.00 0.00 58.89 61.11 1rzh h TRP 75 Cb 0.19 -0.30 -0.03 0.00 -1.00 0.00 0.00 29.16 28.01 1rzh h TRP 75 CO 0.01 0.79 -0.29 -0.92 -3.56 0.00 0.00 178.44 174.48 1rzh h TYR 76 N 0.94 -0.77 -0.31 0.49 3.20 -0.87 0.15 116.97 119.79 1rzh h TYR 76 Ca 0.22 0.01 0.09 0.00 3.14 0.00 0.00 58.73 62.19 1rzh h TYR 76 Cb 0.22 0.31 -0.01 0.00 1.54 0.00 0.00 36.73 38.79 1rzh h TYR 76 CO 0.01 -0.40 0.24 1.96 -1.64 0.00 0.00 178.16 178.33 1rzh h GLN 77 N -0.55 0.00 -0.01 1.82 4.20 -1.03 0.40 115.11 119.94 1rzh h GLN 77 Ca 0.01 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.72 1rzh h GLN 77 Cb 0.54 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.32 1rzh h GLN 77 CO -0.12 0.00 0.00 0.00 -0.67 0.00 0.00 178.83 178.04 1rzh n ALA 78 N -2.55 2.65 -2.11 3.87 0.00 -0.40 -4.88 120.51 117.09 1rzh n ALA 78 Ca 0.05 -0.28 -0.13 0.00 0.00 0.00 0.00 53.44 53.08 1rzh n ALA 78 Cb 0.41 -1.39 -0.01 0.00 0.00 0.00 0.00 19.45 18.45 1rzh n ALA 78 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1rzh n GLY 79 N 1.04 0.08 2.56 0.00 0.00 0.14 -2.13 105.19 106.89 1rzh n GLY 79 Ca 0.22 -0.34 -0.20 0.00 0.00 0.00 0.00 46.02 45.69 1rzh n GLY 79 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 1rzh n TRP 80 N -3.78 -0.04 -3.38 1.61 7.02 0.40 -4.95 117.44 114.32 1rzh n TRP 80 Ca -0.15 0.00 -0.41 0.00 -1.02 0.00 0.00 57.50 55.91 1rzh n TRP 80 Cb 0.59 -3.44 -0.09 0.00 -2.42 0.00 0.00 31.31 25.95 1rzh n TRP 80 CO 0.00 0.00 0.00 1.21 -2.02 0.00 0.00 177.69 176.88 1rzh s ASN 81 N -2.72 6.19 0.24 -0.99 3.84 -0.90 -4.98 114.94 115.61 1rzh s ASN 81 Ca 0.00 -0.30 -0.05 0.00 0.21 0.00 0.00 52.86 52.71 1rzh s ASN 81 Cb 0.00 -2.20 0.43 0.00 -0.55 0.00 0.00 41.25 38.93 1rzh s ASN 81 CO 0.00 -0.38 1.71 -0.65 -2.79 0.00 0.00 177.10 174.98 1rzh h PRO 82 N 8.51 0.33 -0.75 0.43 0.11 -1.92 0.49 132.00 139.19 1rzh h PRO 82 Ca -0.29 -0.02 -0.06 0.00 0.11 0.00 0.00 66.00 65.74 1rzh h PRO 82 Cb 1.14 -0.07 -0.03 0.00 0.11 0.00 0.00 31.00 32.14 1rzh h PRO 82 CO 0.71 0.22 0.24 0.00 -0.21 0.00 0.00 178.00 178.96 1rzh h ALA 83 N 1.56 0.99 -0.23 -0.75 0.00 -1.95 -2.58 119.26 116.30 1rzh h ALA 83 Ca 0.40 -0.23 -0.16 0.00 0.00 0.00 0.00 54.91 54.92 1rzh h ALA 83 Cb 0.64 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 18.13 1rzh h ALA 83 CO -0.45 0.67 -0.51 0.28 0.00 0.00 0.00 179.25 179.24 1rzh h VAL 84 N 1.12 1.31 -0.39 0.00 2.07 -1.65 -2.00 116.25 116.70 1rzh h VAL 84 Ca 0.24 -1.73 0.07 0.00 0.82 0.00 0.00 66.70 66.10 1rzh h VAL 84 Cb 0.31 1.68 -0.06 0.00 -1.52 0.00 0.00 31.29 31.70 1rzh h VAL 84 CO -0.01 0.55 0.01 0.15 0.02 0.00 0.00 177.57 178.29 1rzh h PHE 85 N 0.50 0.00 -0.10 1.57 3.57 -0.60 -0.61 116.94 121.27 1rzh h PHE 85 Ca 0.02 0.03 -0.19 0.00 3.53 0.00 0.00 57.97 61.36 1rzh h PHE 85 Cb 1.07 0.06 -0.00 0.00 2.79 0.00 0.00 35.95 39.86 1rzh h PHE 85 CO 0.05 -0.06 -0.71 -0.07 -2.23 0.00 0.00 178.31 175.29 1rzh h LEU 86 N 0.12 0.57 -0.00 0.59 3.38 -1.44 -1.41 115.31 117.11 1rzh h LEU 86 Ca 0.19 -0.36 -0.00 0.00 0.09 0.00 0.00 57.88 57.80 1rzh h LEU 86 Cb 0.27 -0.17 -0.00 0.00 0.09 0.00 0.00 40.66 40.85 1rzh h LEU 86 CO -0.31 1.10 0.00 -0.09 0.09 0.00 0.00 178.44 179.24 1rzh h ARG 87 N 0.33 0.01 -0.50 1.13 2.43 -0.80 -3.21 114.38 113.78 1rzh h ARG 87 Ca -0.03 -0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.14 1rzh h ARG 87 Cb 1.29 -0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.84 1rzh h ARG 87 CO 0.13 0.12 0.00 -0.25 -1.51 0.00 0.00 179.97 178.46 1rzh n ASP 88 N -5.03 4.86 -0.28 -3.80 8.00 -0.29 -4.71 116.55 115.30 1rzh n ASP 88 Ca -0.07 -2.79 0.07 0.00 0.71 0.00 0.00 54.79 52.70 1rzh n ASP 88 Cb 0.08 -0.60 0.17 0.00 -0.02 0.00 0.00 41.12 40.76 1rzh n ASP 88 CO 0.00 0.00 0.00 0.25 -0.39 0.00 0.00 177.20 177.06 1rzh h LEU 89 N 3.32 -0.45 -0.17 0.64 5.85 -1.25 0.40 115.31 123.64 1rzh h LEU 89 Ca 0.00 0.22 0.00 0.00 0.84 0.00 0.00 57.88 58.94 1rzh h LEU 89 Cb 1.64 0.40 0.00 0.00 0.37 0.00 0.00 40.66 43.08 1rzh h LEU 89 CO 0.33 -0.23 0.00 0.49 -0.34 0.00 0.00 178.44 178.69 1rzh n PHE 90 N -5.41 0.43 0.05 1.25 3.01 -1.26 -3.35 117.46 112.18 1rzh n PHE 90 Ca 0.15 0.14 0.08 0.00 1.01 0.00 0.00 57.45 58.84 1rzh n PHE 90 Cb 0.52 -0.73 -0.07 0.00 -0.01 0.00 0.00 39.48 39.19 1rzh n PHE 90 CO 0.00 0.00 0.00 1.19 1.01 0.00 0.00 176.76 178.96 1rzh n PHE 91 N -1.87 0.67 -1.44 1.38 3.01 0.13 -1.80 117.46 117.55 1rzh n PHE 91 Ca 0.05 0.20 -0.33 0.00 1.01 0.00 0.00 57.45 58.38 1rzh n PHE 91 Cb 0.29 -0.86 0.08 0.00 -0.01 0.00 0.00 39.48 38.98 1rzh n PHE 91 CO 0.00 0.00 0.00 -0.06 1.01 0.00 0.00 176.76 177.71 1rzh s PHE 92 N -3.29 2.30 -0.28 1.38 0.08 -0.86 -4.83 117.98 112.48 1rzh s PHE 92 Ca -0.03 1.60 -0.20 0.00 0.12 0.00 0.00 56.93 58.41 1rzh s PHE 92 Cb 0.10 -3.28 0.09 0.00 -0.57 0.00 0.00 43.02 39.37 1rzh s PHE 92 CO 0.83 -2.16 0.79 0.45 -0.10 0.00 0.00 175.22 175.03 1rzh s SER 93 N -2.52 -0.75 -0.53 1.36 0.15 -1.26 -4.29 113.70 105.85 1rzh s SER 93 Ca 0.69 1.30 -0.17 0.00 0.70 0.00 0.00 55.95 58.46 1rzh s SER 93 Cb -0.23 1.31 0.10 0.00 -1.71 0.00 0.00 66.02 65.49 1rzh s SER 93 CO 0.47 -0.21 0.54 -0.22 1.20 0.00 0.00 173.24 175.02 1rzh s LEU 94 N 0.99 5.70 0.35 3.45 0.20 -0.17 -4.93 118.68 124.27 1rzh s LEU 94 Ca -0.05 -1.48 -0.12 0.00 0.69 0.00 0.00 54.13 53.17 1rzh s LEU 94 Cb -0.05 -2.26 -0.07 0.00 -0.43 0.00 0.00 46.19 43.38 1rzh s LEU 94 CO -0.11 -0.88 0.73 -1.61 -0.29 0.00 0.00 176.35 174.20 1rzh s GLU 95 N 2.02 3.87 0.95 1.98 0.41 -1.26 -1.46 118.70 125.21 1rzh s GLU 95 Ca 0.07 0.53 -0.14 0.00 -0.41 0.00 0.00 54.97 55.02 1rzh s GLU 95 Cb -0.26 -2.43 0.16 0.00 -1.78 0.00 0.00 34.13 29.82 1rzh s GLU 95 CO 0.06 0.08 1.16 -2.14 -0.49 0.00 0.00 175.26 173.92 1rzh s PRO 96 N -3.40 0.79 0.64 0.39 0.02 -1.26 -4.15 135.00 128.03 1rzh s PRO 96 Ca 0.52 0.15 -0.17 0.00 0.02 0.00 0.00 61.00 61.52 1rzh s PRO 96 Cb -0.10 -1.81 -0.01 0.00 0.02 0.00 0.00 34.50 32.60 1rzh s PRO 96 CO 0.25 -2.41 1.20 -2.14 -0.33 0.00 0.00 177.00 173.57 1rzh s PRO 97 N -5.38 2.68 0.81 5.54 0.02 -1.26 -4.48 135.00 132.93 1rzh s PRO 97 Ca 0.66 1.76 -0.11 0.00 0.02 0.00 0.00 61.00 63.33 1rzh s PRO 97 Cb -0.13 -1.90 0.08 0.00 0.02 0.00 0.00 34.50 32.57 1rzh s PRO 97 CO 0.54 -1.42 1.11 0.00 -0.33 0.00 0.00 177.00 176.90 1rzh s ALA 98 N -1.80 2.02 0.36 -1.55 0.00 -1.26 -2.94 121.76 116.59 1rzh s ALA 98 Ca 0.75 0.40 0.13 0.00 0.00 0.00 0.00 51.96 53.25 1rzh s ALA 98 Cb -0.29 -3.34 0.96 0.00 0.00 0.00 0.00 23.12 20.45 1rzh s ALA 98 CO 0.38 -2.06 1.78 -1.35 0.00 0.00 0.00 175.76 174.52 1rzh h PRO 99 N -1.27 0.52 -0.80 0.00 0.11 -1.93 -2.09 132.00 126.54 1rzh h PRO 99 Ca -0.44 -0.03 0.18 0.00 0.11 0.00 0.00 66.00 65.82 1rzh h PRO 99 Cb 1.25 -0.12 -0.15 0.00 0.11 0.00 0.00 31.00 32.09 1rzh h PRO 99 CO 0.48 0.35 -0.08 0.93 -0.21 0.00 0.00 178.00 179.47 1rzh h GLU 100 N 0.54 0.05 0.00 1.05 5.08 -1.99 0.17 114.58 119.47 1rzh h GLU 100 Ca 0.57 -0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.93 1rzh h GLU 100 Cb 1.21 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 30.45 1rzh h GLU 100 CO -0.32 0.03 0.00 0.66 -1.00 0.00 0.00 179.01 178.38 1rzh n TYR 101 N -5.44 0.00 0.00 4.33 4.01 -0.79 -4.95 117.16 114.33 1rzh n TYR 101 Ca 0.14 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.88 1rzh n TYR 101 Cb 0.48 -0.33 0.00 0.00 -0.31 0.00 0.00 39.34 39.18 1rzh n TYR 101 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1rzh n GLY 102 N 0.06 3.06 1.42 2.72 0.00 0.59 -1.17 105.19 111.87 1rzh n GLY 102 Ca 0.07 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.18 1rzh n GLY 102 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1rzh n LEU 103 N 0.00 4.41 -4.81 0.99 4.77 -1.24 -1.89 117.00 119.23 1rzh n LEU 103 Ca 0.00 -2.36 -0.30 0.00 -0.03 0.00 0.00 56.01 53.32 1rzh n LEU 103 Cb 0.00 -0.53 0.22 0.00 -2.33 0.00 0.00 43.42 40.78 1rzh n LEU 103 CO 0.00 0.83 0.79 -0.94 -1.33 0.00 0.00 177.39 176.74 1rzh s SER 104 N -1.00 2.12 -0.11 -1.43 1.04 -0.31 -4.97 113.70 109.04 1rzh s SER 104 Ca 0.48 0.33 0.16 0.00 0.48 0.00 0.00 55.95 57.40 1rzh s SER 104 Cb 0.30 -0.38 0.25 0.00 0.10 0.00 0.00 66.02 66.29 1rzh s SER 104 CO 0.24 -3.36 1.13 0.49 0.98 0.00 0.00 173.24 172.73 1rzh n PHE 105 N -4.19 0.00 0.91 5.02 3.72 -1.26 -4.72 117.46 116.94 1rzh n PHE 105 Ca 0.16 -0.86 0.13 0.00 -0.05 0.00 0.00 57.45 56.83 1rzh n PHE 105 Cb 0.59 -0.14 0.48 0.00 -0.94 0.00 0.00 39.48 39.48 1rzh n PHE 105 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1rzh n ALA 106 N -1.24 2.60 -1.73 4.37 0.00 -1.26 -4.90 120.51 118.36 1rzh n ALA 106 Ca 0.14 -0.15 -0.42 0.00 0.00 0.00 0.00 53.44 53.01 1rzh n ALA 106 Cb 0.65 -1.38 -0.01 0.00 0.00 0.00 0.00 19.45 18.71 1rzh n ALA 106 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1rzh n ALA 107 N -1.57 1.90 -1.33 0.00 0.00 -1.26 -4.93 120.51 113.32 1rzh n ALA 107 Ca 0.06 0.37 -0.35 0.00 0.00 0.00 0.00 53.44 53.52 1rzh n ALA 107 Cb 0.36 -2.36 0.10 0.00 0.00 0.00 0.00 19.45 17.55 1rzh n ALA 107 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 1rzh n PRO 108 N 1.12 0.50 -0.19 0.00 -0.02 -1.26 -3.60 135.00 131.55 1rzh n PRO 108 Ca 0.06 0.23 -0.00 0.00 -2.02 0.00 0.00 63.50 61.77 1rzh n PRO 108 Cb 0.36 -2.36 0.10 0.00 -0.02 0.00 0.00 33.50 31.58 1rzh n PRO 108 CO 0.00 0.00 0.00 -0.07 1.98 0.00 0.00 175.50 177.41 1rzh h LEU 109 N -0.35 0.06 0.00 2.45 3.38 -1.91 0.13 115.31 119.06 1rzh h LEU 109 Ca -0.48 0.10 0.00 0.00 0.09 0.00 0.00 57.88 57.59 1rzh h LEU 109 Cb 1.32 0.12 0.00 0.00 0.09 0.00 0.00 40.66 42.20 1rzh h LEU 109 CO 0.48 0.04 0.00 0.29 0.09 0.00 0.00 178.44 179.34 1rzh n LYS 110 N -5.09 0.31 -2.45 1.13 5.02 -1.26 -1.25 118.16 114.57 1rzh n LYS 110 Ca 0.08 0.04 -0.17 0.00 -2.02 0.00 0.00 58.31 56.24 1rzh n LYS 110 Cb 0.30 -1.50 0.02 0.00 -0.02 0.00 0.00 35.03 33.83 1rzh n LYS 110 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 1rzh n GLU 111 N -1.33 2.67 0.00 1.97 1.02 -0.06 -4.93 120.64 119.99 1rzh n GLU 111 Ca 0.11 -3.95 0.00 0.00 -0.02 0.00 0.00 57.16 53.31 1rzh n GLU 111 Cb 0.23 -1.92 0.00 0.00 -0.02 0.00 0.00 31.44 29.73 1rzh n GLU 111 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1rzh n GLY 112 N -0.49 2.86 0.25 0.62 0.00 -1.06 -4.33 105.19 103.04 1rzh n GLY 112 Ca 0.28 -0.73 -0.04 0.00 0.00 0.00 0.00 46.02 45.54 1rzh n GLY 112 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1rzh h GLY 113 N 0.00 0.91 1.71 -0.02 0.00 -0.88 -1.43 103.07 103.36 1rzh h GLY 113 Ca 0.00 -0.28 -0.08 0.00 0.00 0.00 0.00 47.33 46.97 1rzh h GLY 113 CO 0.00 0.22 -0.22 -2.00 0.00 0.00 0.00 176.54 174.54 1rzh h LEU 114 N 0.74 0.34 -0.62 3.11 5.85 -1.38 -1.00 115.31 122.34 1rzh h LEU 114 Ca 0.26 -0.10 -0.11 0.00 0.84 0.00 0.00 57.88 58.77 1rzh h LEU 114 Cb 0.06 -0.09 -0.02 0.00 0.37 0.00 0.00 40.66 40.98 1rzh h LEU 114 CO -0.12 0.57 -0.11 -0.25 -0.34 0.00 0.00 178.44 178.19 1rzh h TRP 115 N 0.31 1.08 -0.55 1.25 7.01 -1.64 -0.72 115.95 122.70 1rzh h TRP 115 Ca 0.05 -0.22 -0.11 0.00 2.11 0.00 0.00 58.89 60.73 1rzh h TRP 115 Cb 0.57 -0.27 -0.02 0.00 -2.10 0.00 0.00 29.16 27.34 1rzh h TRP 115 CO 0.01 1.01 -0.08 -0.07 -2.79 0.00 0.00 178.44 176.53 1rzh h LEU 116 N 0.87 1.01 0.23 0.65 3.38 -0.72 -0.35 115.31 120.37 1rzh h LEU 116 Ca 0.14 -0.34 -0.01 0.00 0.09 0.00 0.00 57.88 57.76 1rzh h LEU 116 Cb 0.66 -0.27 0.00 0.00 0.09 0.00 0.00 40.66 41.14 1rzh h LEU 116 CO 0.05 1.11 -0.11 0.40 0.09 0.00 0.00 178.44 179.98 1rzh h ILE 117 N 0.89 0.84 -0.70 1.22 2.04 -1.00 -0.59 117.51 120.20 1rzh h ILE 117 Ca 0.15 -0.37 0.10 0.00 1.00 0.00 0.00 64.86 65.73 1rzh h ILE 117 Cb 0.64 1.05 -0.07 0.00 -0.74 0.00 0.00 36.82 37.70 1rzh h ILE 117 CO 0.04 0.08 0.34 0.00 0.00 0.00 0.00 178.15 178.61 1rzh h ALA 118 N 0.24 0.97 -0.61 1.87 0.00 -1.07 -1.34 119.26 119.32 1rzh h ALA 118 Ca -0.03 0.06 -0.04 0.00 0.00 0.00 0.00 54.91 54.90 1rzh h ALA 118 Cb 0.37 -0.03 -0.03 0.00 0.00 0.00 0.00 17.79 18.10 1rzh h ALA 118 CO 0.05 -0.07 0.20 0.77 0.00 0.00 0.00 179.25 180.19 1rzh h SER 119 N 0.57 0.84 -0.40 0.00 0.02 -0.87 -1.26 113.55 112.46 1rzh h SER 119 Ca 0.35 -0.13 -0.01 0.00 -0.84 0.00 0.00 61.79 61.16 1rzh h SER 119 Cb 0.39 -0.22 -0.02 0.00 0.14 0.00 0.00 62.40 62.69 1rzh h SER 119 CO -0.28 0.79 0.22 0.15 -1.14 0.00 0.00 176.83 176.56 1rzh h PHE 120 N 0.88 0.54 -0.85 3.45 3.57 -0.00 0.41 116.94 124.94 1rzh h PHE 120 Ca 0.20 -0.01 -0.03 0.00 3.53 0.00 0.00 57.97 61.66 1rzh h PHE 120 Cb 0.24 -0.17 -0.04 0.00 2.79 0.00 0.00 35.95 38.77 1rzh h PHE 120 CO 0.02 0.42 0.41 0.74 -2.23 0.00 0.00 178.31 177.66 1rzh h PHE 121 N 0.51 1.22 -0.59 0.41 0.04 -1.01 -1.52 116.94 115.99 1rzh h PHE 121 Ca 0.14 -0.06 -0.09 0.00 2.80 0.00 0.00 57.97 60.76 1rzh h PHE 121 Cb 0.05 -0.38 -0.02 0.00 2.20 0.00 0.00 35.95 37.80 1rzh h PHE 121 CO -0.03 0.88 0.02 1.98 -0.60 0.00 0.00 178.31 180.57 1rzh h MET 122 N 1.21 1.02 -0.47 1.51 4.05 -0.83 -0.06 114.93 121.35 1rzh h MET 122 Ca 0.29 -0.30 0.00 0.00 -0.28 0.00 0.00 59.70 59.41 1rzh h MET 122 Cb 0.11 -0.10 -0.02 0.00 -0.80 0.00 0.00 31.60 30.78 1rzh h MET 122 CO -0.04 0.98 0.30 0.35 0.23 0.00 0.00 176.91 178.74 1rzh h PHE 123 N 0.94 0.61 -0.27 1.39 3.57 -0.38 -0.47 116.94 122.32 1rzh h PHE 123 Ca 0.17 0.01 -0.07 0.00 3.53 0.00 0.00 57.97 61.61 1rzh h PHE 123 Cb 0.51 -0.20 -0.01 0.00 2.79 0.00 0.00 35.95 39.04 1rzh h PHE 123 CO 0.03 0.40 -0.12 0.28 -2.23 0.00 0.00 178.31 176.67 1rzh h VAL 124 N 0.64 1.29 -0.45 1.41 2.07 -1.09 -2.26 116.25 117.86 1rzh h VAL 124 Ca 0.17 -1.20 0.00 0.00 0.82 0.00 0.00 66.70 66.50 1rzh h VAL 124 Cb -0.05 1.50 -0.02 0.00 -1.52 0.00 0.00 31.29 31.20 1rzh h VAL 124 CO -0.04 0.38 0.30 0.00 0.02 0.00 0.00 177.57 178.23 1rzh h ALA 125 N 0.75 0.57 -0.12 1.67 0.00 -0.78 -0.88 119.26 120.47 1rzh h ALA 125 Ca 0.06 -0.03 -0.05 0.00 0.00 0.00 0.00 54.91 54.89 1rzh h ALA 125 Cb 0.63 -0.18 -0.00 0.00 0.00 0.00 0.00 17.79 18.23 1rzh h ALA 125 CO 0.04 0.03 -0.11 0.28 0.00 0.00 0.00 179.25 179.48 1rzh h VAL 126 N 0.61 1.35 -0.17 0.00 2.07 -1.10 -1.92 116.25 117.09 1rzh h VAL 126 Ca 0.17 -1.26 -0.10 0.00 0.82 0.00 0.00 66.70 66.33 1rzh h VAL 126 Cb -0.07 1.92 -0.01 0.00 -1.52 0.00 0.00 31.29 31.61 1rzh h VAL 126 CO -0.04 0.36 -0.33 -0.50 0.02 0.00 0.00 177.57 177.09 1rzh h TRP 127 N -0.10 0.40 -0.04 1.57 4.06 -1.39 -0.54 115.95 119.91 1rzh h TRP 127 Ca 0.02 -0.10 -0.14 0.00 2.06 0.00 0.00 58.89 60.74 1rzh h TRP 127 Cb 0.63 -0.09 -0.01 0.00 -1.00 0.00 0.00 29.16 28.68 1rzh h TRP 127 CO 0.08 0.65 -0.61 0.66 -3.56 0.00 0.00 178.44 175.66 1rzh h SER 128 N 0.31 0.15 -0.21 -3.49 4.64 -1.19 -1.94 113.55 111.82 1rzh h SER 128 Ca 0.04 -0.09 -0.13 0.00 -0.47 0.00 0.00 61.79 61.14 1rzh h SER 128 Cb 0.73 -0.04 -0.01 0.00 -0.31 0.00 0.00 62.40 62.77 1rzh h SER 128 CO 0.06 0.73 -0.34 -0.25 -0.87 0.00 0.00 176.83 176.15 1rzh h TRP 129 N 0.10 0.86 -0.42 4.77 2.91 -0.83 -1.85 115.95 121.48 1rzh h TRP 129 Ca -0.01 -0.23 -0.01 0.00 1.13 0.00 0.00 58.89 59.77 1rzh h TRP 129 Cb 1.10 -0.19 -0.02 0.00 -0.51 0.00 0.00 29.16 29.54 1rzh h TRP 129 CO 0.01 0.97 0.23 2.35 -1.03 0.00 0.00 178.44 180.97 1rzh h TRP 130 N 0.61 0.58 -0.99 2.65 7.01 -0.80 -0.74 115.95 124.28 1rzh h TRP 130 Ca 0.06 -0.01 0.07 0.00 2.11 0.00 0.00 58.89 61.12 1rzh h TRP 130 Cb 0.87 -0.19 -0.07 0.00 -2.10 0.00 0.00 29.16 27.67 1rzh h TRP 130 CO 0.04 0.44 0.64 0.78 -2.79 0.00 0.00 178.44 177.55 1rzh h GLY 131 N 0.55 1.50 1.01 2.65 0.00 -1.11 -1.54 103.07 106.12 1rzh h GLY 131 Ca 0.15 -0.46 -0.00 0.00 0.00 0.00 0.00 47.33 47.01 1rzh h GLY 131 CO -0.02 0.32 0.44 -0.09 0.00 0.00 0.00 176.54 177.19 1rzh h ARG 132 N 1.15 0.99 -0.15 4.80 2.43 -0.47 0.22 114.38 123.34 1rzh h ARG 132 Ca 0.43 -0.09 -0.06 0.00 -0.81 0.00 0.00 59.98 59.45 1rzh h ARG 132 Cb 0.19 -0.21 -0.01 0.00 -0.42 0.00 0.00 29.97 29.52 1rzh h ARG 132 CO -0.17 0.70 -0.18 1.79 -1.51 0.00 0.00 179.97 180.59 1rzh h THR 133 N 0.99 1.21 -0.01 0.20 1.35 -0.19 -0.08 112.91 116.39 1rzh h THR 133 Ca 0.26 -0.94 -0.01 0.00 -0.55 0.00 0.00 66.41 65.17 1rzh h THR 133 Cb -0.04 1.30 0.00 0.00 -1.73 0.00 0.00 68.15 67.68 1rzh h THR 133 CO -0.05 0.29 -0.05 0.22 -0.25 0.00 0.00 175.52 175.68 1rzh h TYR 134 N 0.23 0.07 -0.40 4.73 3.20 -0.75 -3.21 116.97 120.83 1rzh h TYR 134 Ca 0.04 -0.03 -0.09 0.00 3.14 0.00 0.00 58.73 61.79 1rzh h TYR 134 Cb 0.47 -0.01 -0.02 0.00 1.54 0.00 0.00 36.73 38.71 1rzh h TYR 134 CO 0.01 0.73 -0.12 -0.07 -1.64 0.00 0.00 178.16 177.07 1rzh h LEU 135 N -0.62 0.70 -1.16 2.82 3.38 -0.43 -1.25 115.31 118.74 1rzh h LEU 135 Ca -0.00 -0.20 -0.08 0.00 0.09 0.00 0.00 57.88 57.68 1rzh h LEU 135 Cb 0.74 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 41.29 1rzh h LEU 135 CO 0.01 0.84 -0.30 0.03 0.09 0.00 0.00 178.44 179.12 1rzh h ARG 136 N 0.65 0.20 -0.04 1.13 2.47 -1.14 -1.08 114.38 116.57 1rzh h ARG 136 Ca 0.11 -0.07 -0.18 0.00 -1.26 0.00 0.00 59.98 58.57 1rzh h ARG 136 Cb 0.57 -0.01 0.01 0.00 -1.65 0.00 0.00 29.97 28.89 1rzh h ARG 136 CO 0.04 0.49 -0.69 0.00 0.56 0.00 0.00 179.97 180.36 1rzh h ALA 137 N 1.52 0.14 -0.66 0.04 0.00 -1.50 -3.19 119.26 115.60 1rzh h ALA 137 Ca 0.03 -0.59 0.01 0.00 0.00 0.00 0.00 54.91 54.36 1rzh h ALA 137 Cb 0.62 0.02 -0.03 0.00 0.00 0.00 0.00 17.79 18.41 1rzh h ALA 137 CO 0.05 0.46 0.44 0.37 0.00 0.00 0.00 179.25 180.57 1rzh h GLN 138 N 0.12 0.87 0.00 0.00 4.15 -0.98 -0.14 115.11 119.13 1rzh h GLN 138 Ca -0.08 -0.05 -0.01 0.00 0.77 0.00 0.00 58.65 59.28 1rzh h GLN 138 Cb 1.37 -0.20 -0.00 0.00 0.21 0.00 0.00 27.48 28.86 1rzh h GLN 138 CO 0.14 0.58 -0.04 0.00 -1.93 0.00 0.00 178.83 177.57 1rzh h ALA 139 N 1.24 1.16 -0.23 3.38 0.00 -1.27 -1.31 119.26 122.24 1rzh h ALA 139 Ca 0.24 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.12 1rzh h ALA 139 Cb -0.10 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.68 1rzh h ALA 139 CO -0.05 0.05 0.00 1.28 0.00 0.00 0.00 179.25 180.53 1rzh n LEU 140 N -3.36 3.14 -0.60 0.00 4.77 -0.71 -1.27 117.00 118.96 1rzh n LEU 140 Ca -0.02 -1.30 -0.08 0.00 -0.03 0.00 0.00 56.01 54.58 1rzh n LEU 140 Cb 0.17 -0.14 -0.03 0.00 -2.33 0.00 0.00 43.42 41.09 1rzh n LEU 140 CO 0.26 0.62 -0.07 0.61 -1.33 0.00 0.00 177.39 177.47 1rzh n GLY 141 N 1.32 0.96 3.92 -0.72 0.00 -0.49 -4.95 105.19 105.22 1rzh n GLY 141 Ca 0.16 -0.49 -0.26 0.00 0.00 0.00 0.00 46.02 45.43 1rzh n GLY 141 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1rzh s MET 142 N -2.45 3.23 1.04 1.61 1.00 -0.15 -5.00 119.30 118.58 1rzh s MET 142 Ca 0.00 -0.06 -0.12 0.00 0.00 0.00 0.00 55.69 55.51 1rzh s MET 142 Cb 0.00 -2.40 0.21 0.00 0.00 0.00 0.00 34.83 32.64 1rzh s MET 142 CO 0.00 -0.36 1.07 0.20 0.00 0.00 0.00 175.02 175.94 1rzh s GLY 143 N -4.19 1.59 -0.35 -0.03 0.00 -1.26 -4.43 107.32 98.65 1rzh s GLY 143 Ca 0.49 -0.04 0.09 0.00 0.00 0.00 0.00 44.72 45.26 1rzh s GLY 143 CO 0.43 0.57 1.81 0.28 0.00 0.00 0.00 173.10 176.18 1rzh n LYS 144 N -4.46 3.28 -0.36 2.90 4.76 -1.26 -4.66 118.16 118.35 1rzh n LYS 144 Ca 0.06 -3.08 0.07 0.00 -2.87 0.00 0.00 58.31 52.49 1rzh n LYS 144 Cb 0.55 -2.18 0.23 0.00 -1.84 0.00 0.00 35.03 31.79 1rzh n LYS 144 CO 0.00 0.00 0.00 0.45 -1.37 0.00 0.00 177.40 176.48 1rzh h HIS 145 N 2.18 1.14 -0.17 2.13 3.86 -1.97 -1.84 115.15 120.49 1rzh h HIS 145 Ca 0.34 0.03 -0.00 0.00 -1.16 0.00 0.00 60.37 59.58 1rzh h HIS 145 Cb 2.40 -0.36 -0.01 0.00 1.06 0.00 0.00 27.41 30.50 1rzh h HIS 145 CO 1.32 0.46 0.09 1.15 0.86 0.00 0.00 177.93 181.81 1rzh h THR 146 N 1.00 1.11 -0.74 2.45 2.02 -1.92 0.15 112.91 116.97 1rzh h THR 146 Ca 0.49 -0.29 -0.02 0.00 0.77 0.00 0.00 66.41 67.36 1rzh h THR 146 Cb 0.46 1.00 -0.04 0.00 -1.74 0.00 0.00 68.15 67.83 1rzh h THR 146 CO -0.26 0.10 0.38 0.00 0.37 0.00 0.00 175.52 176.11 1rzh h ALA 147 N 0.98 1.27 -0.20 6.16 0.00 -1.68 0.52 119.26 126.31 1rzh h ALA 147 Ca 0.06 -0.13 -0.16 0.00 0.00 0.00 0.00 54.91 54.68 1rzh h ALA 147 Cb 0.08 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 17.56 1rzh h ALA 147 CO -0.01 0.58 -0.53 -1.49 0.00 0.00 0.00 179.25 177.79 1rzh h TRP 148 N 1.05 0.74 -0.40 0.00 -0.00 -1.06 -1.80 115.95 114.48 1rzh h TRP 148 Ca 0.26 -0.26 -0.16 0.00 -0.00 0.00 0.00 58.89 58.74 1rzh h TRP 148 Cb 0.07 -0.14 -0.01 0.00 -0.00 0.00 0.00 29.16 29.08 1rzh h TRP 148 CO 0.01 1.00 -0.36 0.00 -0.00 0.00 0.00 178.44 179.09 1rzh h ALA 149 N 0.95 0.59 -0.48 1.49 0.00 -0.55 -2.81 119.26 118.45 1rzh h ALA 149 Ca 0.01 -0.45 -0.01 0.00 0.00 0.00 0.00 54.91 54.46 1rzh h ALA 149 Cb 1.08 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 18.72 1rzh h ALA 149 CO 0.10 0.68 0.24 0.35 0.00 0.00 0.00 179.25 180.62 1rzh h PHE 150 N 0.79 0.64 -0.10 0.00 3.57 -0.81 -1.57 116.94 119.46 1rzh h PHE 150 Ca 0.07 -0.01 -0.01 0.00 3.53 0.00 0.00 57.97 61.55 1rzh h PHE 150 Cb 0.96 -0.21 -0.01 0.00 2.79 0.00 0.00 35.95 39.48 1rzh h PHE 150 CO 0.06 0.47 0.02 1.25 -2.23 0.00 0.00 178.31 177.88 1rzh h LEU 151 N 0.66 0.12 -0.51 0.59 5.85 -1.05 -0.69 115.31 120.28 1rzh h LEU 151 Ca 0.17 -0.01 -0.08 0.00 0.84 0.00 0.00 57.88 58.80 1rzh h LEU 151 Cb 0.05 -0.03 -0.02 0.00 0.37 0.00 0.00 40.66 41.04 1rzh h LEU 151 CO -0.02 0.13 0.00 -1.28 -0.34 0.00 0.00 178.44 176.93 1rzh h SER 152 N 0.14 0.88 -0.39 1.25 0.87 -1.25 -0.11 113.55 114.95 1rzh h SER 152 Ca 0.04 -0.31 -0.09 0.00 -1.23 0.00 0.00 61.79 60.20 1rzh h SER 152 Cb 0.06 -0.24 -0.01 0.00 -0.44 0.00 0.00 62.40 61.77 1rzh h SER 152 CO -0.00 0.97 -0.10 0.00 -0.53 0.00 0.00 176.83 177.17 1rzh h ALA 153 N 0.94 0.53 -0.50 6.23 0.00 -1.35 -2.67 119.26 122.45 1rzh h ALA 153 Ca 0.14 -0.31 0.04 0.00 0.00 0.00 0.00 54.91 54.78 1rzh h ALA 153 Cb 0.52 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 18.14 1rzh h ALA 153 CO 0.03 0.40 0.33 0.82 0.00 0.00 0.00 179.25 180.83 1rzh h ILE 154 N 0.56 1.03 -0.03 0.00 2.04 -0.92 -2.52 117.51 117.68 1rzh h ILE 154 Ca 0.10 -0.18 0.02 0.00 1.00 0.00 0.00 64.86 65.79 1rzh h ILE 154 Cb 0.62 0.45 -0.02 0.00 -0.74 0.00 0.00 36.82 37.13 1rzh h ILE 154 CO 0.04 0.10 -0.08 -0.25 0.00 0.00 0.00 178.15 177.95 1rzh h TRP 155 N 0.53 -0.20 -0.48 1.37 -0.00 -0.66 0.36 115.95 116.88 1rzh h TRP 155 Ca 0.21 0.01 -0.03 0.00 -0.00 0.00 0.00 58.89 59.08 1rzh h TRP 155 Cb 0.16 0.10 -0.02 0.00 -0.00 0.00 0.00 29.16 29.39 1rzh h TRP 155 CO -0.00 -0.13 0.19 1.25 -0.00 0.00 0.00 178.44 179.76 1rzh h LEU 156 N -0.13 0.66 -0.58 0.65 5.85 -1.42 0.06 115.31 120.40 1rzh h LEU 156 Ca 0.04 -0.17 0.01 0.00 0.84 0.00 0.00 57.88 58.60 1rzh h LEU 156 Cb 0.19 -0.17 -0.03 0.00 0.37 0.00 0.00 40.66 41.02 1rzh h LEU 156 CO -0.10 0.65 0.38 -0.25 -0.34 0.00 0.00 178.44 178.78 1rzh h TRP 157 N 0.63 0.73 -0.49 1.25 7.01 -1.21 -0.38 115.95 123.49 1rzh h TRP 157 Ca 0.16 0.02 -0.06 0.00 2.11 0.00 0.00 58.89 61.12 1rzh h TRP 157 Cb 0.19 -0.25 -0.02 0.00 -2.10 0.00 0.00 29.16 26.98 1rzh h TRP 157 CO 0.00 0.46 0.09 0.52 -2.79 0.00 0.00 178.44 176.72 1rzh h MET 158 N 0.79 0.81 -0.24 2.65 2.86 0.00 -2.28 114.93 119.53 1rzh h MET 158 Ca 0.21 -0.22 0.01 0.00 -2.06 0.00 0.00 59.70 57.64 1rzh h MET 158 Cb -0.09 -0.10 -0.01 0.00 0.06 0.00 0.00 31.60 31.46 1rzh h MET 158 CO -0.05 0.81 0.15 0.28 1.06 0.00 0.00 176.91 179.16 1rzh h VAL 159 N 0.69 1.05 -0.11 -2.22 2.07 -0.67 0.16 116.25 117.22 1rzh h VAL 159 Ca 0.15 -0.10 -0.00 0.00 0.82 0.00 0.00 66.70 67.57 1rzh h VAL 159 Cb 0.39 0.71 -0.01 0.00 -1.52 0.00 0.00 31.29 30.86 1rzh h VAL 159 CO 0.01 0.06 0.07 -0.07 0.02 0.00 0.00 177.57 177.65 1rzh h LEU 160 N 0.31 0.13 -0.87 2.57 3.38 -0.90 -0.99 115.31 118.94 1rzh h LEU 160 Ca 0.09 -0.05 0.00 0.00 0.09 0.00 0.00 57.88 58.01 1rzh h LEU 160 Cb -0.02 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 40.69 1rzh h LEU 160 CO -0.03 0.14 -0.34 0.61 0.09 0.00 0.00 178.44 178.91 1rzh n GLY 161 N -1.01 -0.06 1.62 0.83 0.00 -0.87 -4.24 105.19 101.47 1rzh n GLY 161 Ca -0.05 -0.46 0.00 0.00 0.00 0.00 0.00 46.02 45.51 1rzh n GLY 161 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 1rzh n PHE 162 N -0.15 -1.17 0.14 1.61 -0.00 0.05 -4.79 117.46 113.15 1rzh n PHE 162 Ca 0.07 0.21 -0.14 0.00 -0.00 0.00 0.00 57.45 57.58 1rzh n PHE 162 Cb 0.34 0.35 -0.08 0.00 -0.00 0.00 0.00 39.48 40.08 1rzh n PHE 162 CO 0.00 0.00 0.00 0.82 -0.00 0.00 0.00 176.76 177.58 1rzh h ILE 163 N 0.00 0.82 -0.13 -2.13 2.04 -0.89 -1.73 117.51 115.49 1rzh h ILE 163 Ca 0.00 -0.20 -0.01 0.00 1.00 0.00 0.00 64.86 65.66 1rzh h ILE 163 Cb 0.00 0.94 -0.01 0.00 -0.74 0.00 0.00 36.82 37.01 1rzh h ILE 163 CO 0.00 0.05 0.06 -0.09 0.00 0.00 0.00 178.15 178.16 1rzh h ARG 164 N -0.39 0.19 -0.85 2.37 2.43 -1.37 -1.32 114.38 115.43 1rzh h ARG 164 Ca -0.03 -0.03 0.09 0.00 -0.81 0.00 0.00 59.98 59.20 1rzh h ARG 164 Cb 0.30 -0.03 -0.07 0.00 -0.42 0.00 0.00 29.97 29.75 1rzh h ARG 164 CO 0.05 0.28 0.50 -1.35 -1.51 0.00 0.00 179.97 177.94 1rzh h PRO 165 N 0.06 0.82 -0.30 0.20 0.11 -1.74 0.30 132.00 131.45 1rzh h PRO 165 Ca 0.04 -0.05 -0.02 0.00 0.11 0.00 0.00 66.00 66.08 1rzh h PRO 165 Cb 0.15 -0.19 -0.01 0.00 0.11 0.00 0.00 31.00 31.07 1rzh h PRO 165 CO -0.00 0.55 0.10 0.82 -0.21 0.00 0.00 178.00 179.25 1rzh h ILE 166 N 0.85 1.20 -0.01 4.15 2.04 -1.09 0.36 117.51 125.01 1rzh h ILE 166 Ca 0.41 -0.64 -0.07 0.00 1.00 0.00 0.00 64.86 65.57 1rzh h ILE 166 Cb 0.35 1.05 -0.01 0.00 -0.74 0.00 0.00 36.82 37.47 1rzh h ILE 166 CO -0.24 0.21 -0.30 -0.07 0.00 0.00 0.00 178.15 177.75 1rzh h LEU 167 N 0.33 0.02 0.00 1.44 3.38 -0.52 -2.05 115.31 117.92 1rzh h LEU 167 Ca 0.10 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.06 1rzh h LEU 167 Cb 0.24 -0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.98 1rzh h LEU 167 CO -0.00 0.32 -0.02 0.24 0.09 0.00 0.00 178.44 179.07 1rzh h MET 168 N 0.02 0.00 0.00 1.13 2.86 -0.01 -3.48 114.93 115.44 1rzh h MET 168 Ca -0.00 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 1rzh h MET 168 Cb 0.55 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.21 1rzh h MET 168 CO 0.04 0.00 0.00 0.41 1.06 0.00 0.00 176.91 178.42 1rzh n GLY 169 N 1.26 0.78 3.60 8.32 0.00 0.01 -5.06 105.19 114.10 1rzh n GLY 169 Ca 0.05 -0.09 -0.11 0.00 0.00 0.00 0.00 46.02 45.87 1rzh n GLY 169 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1rzh s SER 170 N -2.08 -0.49 0.57 1.61 1.04 -0.58 -3.70 113.70 110.08 1rzh s SER 170 Ca 0.00 0.78 0.36 0.00 0.48 0.00 0.00 55.95 57.57 1rzh s SER 170 Cb 0.00 0.74 1.61 0.00 0.10 0.00 0.00 66.02 68.46 1rzh s SER 170 CO 0.00 -0.28 2.07 -0.50 0.98 0.00 0.00 173.24 175.52 1rzh h TRP 171 N 3.65 0.00 -0.01 5.02 -0.00 -1.62 -2.77 115.95 120.22 1rzh h TRP 171 Ca -0.25 0.00 0.00 0.00 -0.00 0.00 0.00 58.89 58.64 1rzh h TRP 171 Cb 1.17 0.00 -0.00 0.00 -0.00 0.00 0.00 29.16 30.32 1rzh h TRP 171 CO 0.33 0.01 0.06 0.66 -0.00 0.00 0.00 178.44 179.50 1rzh h SER 172 N 0.00 0.00 1.39 -3.49 4.64 -1.78 -0.77 113.55 113.54 1rzh h SER 172 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1rzh h SER 172 Cb 0.40 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.49 1rzh h SER 172 CO 0.00 0.00 0.00 -0.33 -0.87 0.00 0.00 176.83 175.63 1rzh h GLU 173 N 0.00 0.00 -7.47 4.77 4.39 -1.80 -3.47 114.58 111.00 1rzh h GLU 173 Ca 0.00 0.00 -0.44 0.00 0.34 0.00 0.00 59.36 59.26 1rzh h GLU 173 Cb 0.12 0.00 0.16 0.00 -0.10 0.00 0.00 28.75 28.93 1rzh h GLU 173 CO -0.00 0.00 0.24 0.00 -1.16 0.00 0.00 179.01 178.09 1rzh s ALA 174 N -3.25 1.29 0.05 3.43 0.00 -0.30 -4.87 121.76 118.12 1rzh s ALA 174 Ca 0.07 -0.66 -0.21 0.00 0.00 0.00 0.00 51.96 51.16 1rzh s ALA 174 Cb 0.09 -2.99 -0.06 0.00 0.00 0.00 0.00 23.12 20.16 1rzh s ALA 174 CO 0.57 -2.79 0.63 0.08 0.00 0.00 0.00 175.76 174.24 1rzh s VAL 175 N -3.19 4.75 0.55 0.00 1.01 -1.26 -4.89 120.40 117.38 1rzh s VAL 175 Ca 0.67 1.33 -0.14 0.00 0.00 0.00 0.00 61.98 63.84 1rzh s VAL 175 Cb -0.13 -3.96 -0.06 0.00 0.00 0.00 0.00 36.38 32.22 1rzh s VAL 175 CO 0.55 0.48 1.00 -2.16 0.00 0.00 0.00 175.10 174.97 1rzh s PRO 176 N -0.67 3.81 -0.62 2.72 0.04 -1.26 -4.84 135.00 134.18 1rzh s PRO 176 Ca 0.32 0.86 -0.18 0.00 0.04 0.00 0.00 61.00 62.04 1rzh s PRO 176 Cb -0.20 -2.12 0.12 0.00 0.04 0.00 0.00 34.50 32.34 1rzh s PRO 176 CO 0.20 -0.38 0.71 0.71 0.04 0.00 0.00 177.00 178.27 1rzh s TYR 177 N -2.84 3.09 -0.22 0.56 2.02 -0.54 -4.40 117.35 115.02 1rzh s TYR 177 Ca 0.57 -1.10 -0.29 0.00 -0.37 0.00 0.00 57.07 55.88 1rzh s TYR 177 Cb -0.10 -3.99 0.16 0.00 -0.40 0.00 0.00 41.96 37.62 1rzh s TYR 177 CO 0.40 -1.26 1.16 0.20 -1.57 0.00 0.00 175.55 174.49 1rzh s GLY 178 N 3.52 -0.09 0.02 0.71 0.00 -1.26 -1.00 107.32 109.22 1rzh s GLY 178 Ca 0.12 2.45 -0.18 0.00 0.00 0.00 0.00 44.72 47.11 1rzh s GLY 178 CO 0.04 1.15 1.10 -2.22 0.00 0.00 0.00 173.10 173.16 1rzh h ILE 179 N 2.44 0.00 -0.22 0.90 1.08 -1.75 -2.37 117.51 117.60 1rzh h ILE 179 Ca -0.15 -0.10 -0.17 0.00 -0.39 0.00 0.00 64.86 64.04 1rzh h ILE 179 Cb 1.17 0.00 -0.00 0.00 -3.07 0.00 0.00 36.82 34.92 1rzh h ILE 179 CO 0.26 0.00 -0.57 -0.26 -0.69 0.00 0.00 178.15 176.89 1rzh h PHE 180 N -0.75 0.86 -0.94 1.37 0.04 -1.66 -3.24 116.94 112.61 1rzh h PHE 180 Ca -0.07 -0.31 0.02 0.00 2.80 0.00 0.00 57.97 60.41 1rzh h PHE 180 Cb 0.50 -0.16 -0.05 0.00 2.20 0.00 0.00 35.95 38.44 1rzh h PHE 180 CO 0.08 1.09 0.62 0.66 -0.60 0.00 0.00 178.31 180.16 1rzh h SER 181 N 0.52 1.06 1.14 2.17 4.64 -1.78 0.37 113.55 121.67 1rzh h SER 181 Ca 0.01 -0.02 -0.03 0.00 -0.47 0.00 0.00 61.79 61.28 1rzh h SER 181 Cb 1.14 -0.26 -0.00 0.00 -0.31 0.00 0.00 62.40 62.97 1rzh h SER 181 CO 0.11 0.75 -0.12 1.12 -0.87 0.00 0.00 176.83 177.82 1rzh h HIS 182 N 1.24 0.00 -0.04 4.77 2.07 -1.46 -0.26 115.15 121.47 1rzh h HIS 182 Ca 0.36 0.00 -0.06 0.00 -2.85 0.00 0.00 60.37 57.82 1rzh h HIS 182 Cb -0.08 0.00 0.00 0.00 2.57 0.00 0.00 27.41 29.90 1rzh h HIS 182 CO -0.00 0.12 -0.20 -0.07 -3.07 0.00 0.00 177.93 174.71 1rzh h LEU 183 N 0.00 0.24 -1.12 6.12 3.38 -1.26 -2.10 115.31 120.57 1rzh h LEU 183 Ca -0.00 -0.67 0.06 0.00 0.09 0.00 0.00 57.88 57.36 1rzh h LEU 183 Cb 0.72 -0.07 -0.06 0.00 0.09 0.00 0.00 40.66 41.34 1rzh h LEU 183 CO 0.02 0.87 0.60 0.44 0.09 0.00 0.00 178.44 180.45 1rzh h ASP 184 N -0.37 0.95 -0.69 -0.43 3.32 -0.65 -1.02 116.42 117.52 1rzh h ASP 184 Ca -0.01 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.04 1rzh h ASP 184 Cb 0.86 -0.20 -0.03 0.00 0.22 0.00 0.00 39.33 40.18 1rzh h ASP 184 CO 0.04 0.62 0.45 -0.25 -1.72 0.00 0.00 179.24 178.38 1rzh h TRP 185 N 1.08 0.89 -0.28 4.55 7.01 -0.98 -0.05 115.95 128.17 1rzh h TRP 185 Ca 0.39 0.01 -0.02 0.00 2.11 0.00 0.00 58.89 61.37 1rzh h TRP 185 Cb 0.14 -0.30 -0.01 0.00 -2.10 0.00 0.00 29.16 26.89 1rzh h TRP 185 CO -0.00 0.58 0.08 1.15 -2.79 0.00 0.00 178.44 177.46 1rzh h THR 186 N 0.94 1.21 0.05 2.65 2.02 -0.52 0.05 112.91 119.31 1rzh h THR 186 Ca 0.25 -0.67 -0.00 0.00 0.77 0.00 0.00 66.41 66.76 1rzh h THR 186 Cb -0.08 1.11 0.00 0.00 -1.74 0.00 0.00 68.15 67.44 1rzh h THR 186 CO -0.05 0.22 -0.02 -1.13 0.37 0.00 0.00 175.52 174.90 1rzh h ASN 187 N 0.30 -0.06 -0.86 4.18 -1.24 -1.03 -2.87 115.58 113.99 1rzh h ASN 187 Ca 0.09 -0.10 0.08 0.00 0.71 0.00 0.00 56.30 57.09 1rzh h ASN 187 Cb 0.26 0.02 -0.07 0.00 0.73 0.00 0.00 38.32 39.25 1rzh h ASN 187 CO -0.00 0.06 0.52 -1.13 -1.29 0.00 0.00 177.43 175.59 1rzh h ASN 188 N -0.18 0.78 -0.87 1.15 -1.24 -0.90 -1.59 115.58 112.72 1rzh h ASN 188 Ca -0.01 0.03 0.07 0.00 0.71 0.00 0.00 56.30 57.11 1rzh h ASN 188 Cb 0.15 -0.12 -0.07 0.00 0.73 0.00 0.00 38.32 39.02 1rzh h ASN 188 CO 0.01 0.46 0.54 0.15 -1.29 0.00 0.00 177.43 177.30 1rzh h PHE 189 N 0.90 0.99 -0.21 0.67 3.04 -0.81 0.66 116.94 122.18 1rzh h PHE 189 Ca 0.40 0.03 -0.08 0.00 3.98 0.00 0.00 57.97 62.30 1rzh h PHE 189 Cb 0.30 -0.32 -0.00 0.00 2.56 0.00 0.00 35.95 38.49 1rzh h PHE 189 CO -0.04 0.48 -0.19 1.03 -2.02 0.00 0.00 178.31 177.57 1rzh h SER 190 N 0.96 0.53 -0.40 0.41 0.87 -1.14 -2.45 113.55 112.32 1rzh h SER 190 Ca 0.39 -0.47 0.03 0.00 -1.23 0.00 0.00 61.79 60.51 1rzh h SER 190 Cb 0.22 -0.15 -0.03 0.00 -0.44 0.00 0.00 62.40 62.00 1rzh h SER 190 CO -0.19 0.89 0.21 -0.07 -0.53 0.00 0.00 176.83 177.13 1rzh h LEU 191 N 0.17 0.31 -1.41 2.23 3.38 -0.78 0.50 115.31 119.70 1rzh h LEU 191 Ca 0.03 0.02 -0.06 0.00 0.09 0.00 0.00 57.88 57.96 1rzh h LEU 191 Cb 0.73 -0.04 -0.01 0.00 0.09 0.00 0.00 40.66 41.43 1rzh h LEU 191 CO 0.05 0.22 -0.29 0.58 0.09 0.00 0.00 178.44 179.09 1rzh h VAL 192 N 0.42 1.06 -0.79 1.22 2.07 -0.90 -3.14 116.25 116.19 1rzh h VAL 192 Ca 0.17 -1.05 -0.40 0.00 0.82 0.00 0.00 66.70 66.24 1rzh h VAL 192 Cb 0.07 1.59 -0.24 0.00 -1.52 0.00 0.00 31.29 31.19 1rzh h VAL 192 CO -0.11 0.29 0.42 1.41 0.02 0.00 0.00 177.57 179.59 1rzh n HIS 193 N -3.97 2.45 -1.98 1.57 8.25 -0.93 -4.83 115.22 115.78 1rzh n HIS 193 Ca -0.02 -1.73 -0.11 0.00 -0.26 0.00 0.00 57.72 55.60 1rzh n HIS 193 Cb 0.36 -0.80 -0.02 0.00 1.12 0.00 0.00 29.99 30.65 1rzh n HIS 193 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1rzh n GLY 194 N -1.07 0.25 1.33 -1.41 0.00 -1.14 -0.92 105.19 102.23 1rzh n GLY 194 Ca 0.51 -0.45 0.00 0.00 0.00 0.00 0.00 46.02 46.08 1rzh n GLY 194 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1rzh n ASN 195 N -0.03 -1.77 0.19 1.61 4.05 0.13 -3.03 115.26 116.42 1rzh n ASN 195 Ca -0.13 0.00 0.12 0.00 0.45 0.00 0.00 54.58 55.02 1rzh n ASN 195 Cb 0.54 -0.89 0.62 0.00 1.23 0.00 0.00 39.78 41.28 1rzh n ASN 195 CO 0.00 0.00 0.00 -0.07 -3.05 0.00 0.00 177.26 174.14 1rzh h LEU 196 N 0.00 0.00 -2.09 1.20 3.38 -1.82 -0.90 115.31 115.08 1rzh h LEU 196 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1rzh h LEU 196 Cb 0.00 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.75 1rzh h LEU 196 CO 0.00 0.00 0.00 -0.26 0.09 0.00 0.00 178.44 178.27 1rzh h PHE 197 N 0.00 0.00 -0.01 1.13 0.04 -1.95 0.38 116.94 116.53 1rzh h PHE 197 Ca 0.00 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.77 1rzh h PHE 197 Cb 0.17 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.32 1rzh h PHE 197 CO 0.00 0.00 -0.30 0.66 -0.60 0.00 0.00 178.31 178.07 1rzh n TYR 198 N -2.75 0.00 -2.79 -0.55 4.01 -0.34 -4.78 117.16 109.95 1rzh n TYR 198 Ca -0.02 0.00 -0.43 0.00 -0.16 0.00 0.00 57.90 57.30 1rzh n TYR 198 Cb 0.11 -0.11 -0.04 0.00 -0.31 0.00 0.00 39.34 38.99 1rzh n TYR 198 CO 0.00 0.00 0.00 1.21 -0.46 0.00 0.00 176.86 177.61 1rzh s ASN 199 N -2.53 6.65 0.41 7.72 3.84 0.12 -4.78 114.94 126.37 1rzh s ASN 199 Ca 0.23 0.50 0.12 0.00 0.21 0.00 0.00 52.86 53.93 1rzh s ASN 199 Cb 0.19 -2.47 0.96 0.00 -0.55 0.00 0.00 41.25 39.37 1rzh s ASN 199 CO 0.54 -0.92 1.94 1.55 -2.79 0.00 0.00 177.10 177.41 1rzh h PRO 200 N 8.63 0.50 0.00 0.43 0.13 -1.86 -0.44 132.00 139.38 1rzh h PRO 200 Ca -0.23 -0.03 -0.06 0.00 -0.87 0.00 0.00 66.00 64.81 1rzh h PRO 200 Cb 1.08 -0.11 -0.01 0.00 0.13 0.00 0.00 31.00 32.08 1rzh h PRO 200 CO 1.00 0.33 -0.29 0.74 -0.23 0.00 0.00 178.00 179.55 1rzh h PHE 201 N 0.51 0.00 -0.03 1.56 0.04 -1.92 -1.07 116.94 116.04 1rzh h PHE 201 Ca 0.34 0.00 -0.25 0.00 2.80 0.00 0.00 57.97 60.86 1rzh h PHE 201 Cb 0.61 0.00 0.01 0.00 2.20 0.00 0.00 35.95 38.78 1rzh h PHE 201 CO -0.00 0.29 -0.97 1.25 -0.60 0.00 0.00 178.31 178.28 1rzh h HIS 202 N 0.00 0.94 -0.71 -0.55 2.76 -1.38 -0.30 115.15 115.92 1rzh h HIS 202 Ca -0.00 -0.49 -0.06 0.00 -2.20 0.00 0.00 60.37 57.61 1rzh h HIS 202 Cb 0.86 -0.11 -0.03 0.00 1.55 0.00 0.00 27.41 29.68 1rzh h HIS 202 CO 0.00 1.33 0.20 0.78 -1.30 0.00 0.00 177.93 178.94 1rzh h GLY 203 N 0.64 1.20 0.87 5.26 0.00 -1.06 -0.73 103.07 109.24 1rzh h GLY 203 Ca -0.10 -0.72 -0.07 0.00 0.00 0.00 0.00 47.33 46.44 1rzh h GLY 203 CO 0.19 0.68 -0.09 1.41 0.00 0.00 0.00 176.54 178.72 1rzh h LEU 204 N 1.07 0.55 -0.85 3.11 3.38 -1.17 -1.36 115.31 120.03 1rzh h LEU 204 Ca 0.23 -0.38 0.07 0.00 0.09 0.00 0.00 57.88 57.89 1rzh h LEU 204 Cb 0.33 -0.15 -0.07 0.00 0.09 0.00 0.00 40.66 40.87 1rzh h LEU 204 CO -0.00 0.81 0.52 -1.28 0.09 0.00 0.00 178.44 178.57 1rzh h SER 205 N 0.28 0.80 -0.57 -0.43 0.87 -0.73 -0.62 113.55 113.14 1rzh h SER 205 Ca 0.06 0.03 -0.08 0.00 -1.23 0.00 0.00 61.79 60.57 1rzh h SER 205 Cb 0.58 -0.14 -0.02 0.00 -0.44 0.00 0.00 62.40 62.38 1rzh h SER 205 CO 0.03 0.49 0.04 0.40 -0.53 0.00 0.00 176.83 177.27 1rzh h ILE 206 N 0.92 1.26 -0.83 2.23 2.04 -0.96 -0.96 117.51 121.22 1rzh h ILE 206 Ca 0.38 -1.07 0.05 0.00 1.00 0.00 0.00 64.86 65.23 1rzh h ILE 206 Cb 0.23 0.82 -0.06 0.00 -0.74 0.00 0.00 36.82 37.08 1rzh h ILE 206 CO -0.20 0.39 0.52 0.00 0.00 0.00 0.00 178.15 178.86 1rzh h ALA 207 N 0.99 1.13 0.00 1.87 0.00 -0.03 0.18 119.26 123.39 1rzh h ALA 207 Ca 0.17 -0.02 -0.11 0.00 0.00 0.00 0.00 54.91 54.95 1rzh h ALA 207 Cb 0.49 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 18.02 1rzh h ALA 207 CO 0.02 0.29 -0.54 0.74 0.00 0.00 0.00 179.25 179.76 1rzh h PHE 208 N 0.97 0.00 -0.07 0.00 0.04 -0.91 0.26 116.94 117.24 1rzh h PHE 208 Ca 0.35 0.00 -0.07 0.00 2.80 0.00 0.00 57.97 61.05 1rzh h PHE 208 Cb 0.12 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.27 1rzh h PHE 208 CO -0.03 0.54 -0.23 1.25 -0.60 0.00 0.00 178.31 179.24 1rzh h LEU 209 N 0.00 0.32 -0.42 1.54 5.85 -0.39 0.14 115.31 122.35 1rzh h LEU 209 Ca -0.01 -0.62 -0.04 0.00 0.84 0.00 0.00 57.88 58.05 1rzh h LEU 209 Cb 1.19 -0.09 -0.02 0.00 0.37 0.00 0.00 40.66 42.10 1rzh h LEU 209 CO 0.07 0.89 0.10 1.88 -0.34 0.00 0.00 178.44 181.03 1rzh h TYR 210 N -0.23 0.70 -0.33 1.25 0.05 -1.01 -2.76 116.97 114.65 1rzh h TYR 210 Ca -0.01 -0.09 0.03 0.00 0.05 0.00 0.00 58.73 58.72 1rzh h TYR 210 Cb 0.86 -0.20 -0.02 0.00 1.01 0.00 0.00 36.73 38.38 1rzh h TYR 210 CO 0.13 0.67 0.22 0.78 -1.05 0.00 0.00 178.16 178.91 1rzh h GLY 211 N 0.54 0.37 1.39 3.88 0.00 -0.39 0.50 103.07 109.36 1rzh h GLY 211 Ca 0.13 -0.13 -0.13 0.00 0.00 0.00 0.00 47.33 47.20 1rzh h GLY 211 CO 0.00 0.11 -0.32 1.76 0.00 0.00 0.00 176.54 178.09 1rzh h SER 212 N 0.33 0.71 0.06 0.19 0.02 -0.44 0.16 113.55 114.59 1rzh h SER 212 Ca 0.14 -0.29 -0.22 0.00 -0.84 0.00 0.00 61.79 60.58 1rzh h SER 212 Cb 0.14 -0.20 0.01 0.00 0.14 0.00 0.00 62.40 62.48 1rzh h SER 212 CO -0.03 0.98 -0.82 0.00 -1.14 0.00 0.00 176.83 175.82 1rzh h ALA 213 N 1.06 0.38 0.18 3.77 0.00 -1.05 -0.16 119.26 123.44 1rzh h ALA 213 Ca 0.06 -0.63 -0.01 0.00 0.00 0.00 0.00 54.91 54.33 1rzh h ALA 213 Cb 0.84 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.61 1rzh h ALA 213 CO 0.07 0.73 -0.09 1.25 0.00 0.00 0.00 179.25 181.21 1rzh h LEU 214 N 0.40 -0.20 -0.42 0.00 5.85 -0.78 -1.26 115.31 118.90 1rzh h LEU 214 Ca -0.06 -0.02 -0.06 0.00 0.84 0.00 0.00 57.88 58.58 1rzh h LEU 214 Cb 1.44 0.05 -0.02 0.00 0.37 0.00 0.00 40.66 42.51 1rzh h LEU 214 CO 0.16 -0.12 0.02 0.25 -0.34 0.00 0.00 178.44 178.41 1rzh h LEU 215 N -0.27 0.70 -1.02 2.25 5.85 -0.66 0.35 115.31 122.51 1rzh h LEU 215 Ca -0.02 -0.29 -0.10 0.00 0.84 0.00 0.00 57.88 58.30 1rzh h LEU 215 Cb 0.21 -0.19 -0.01 0.00 0.37 0.00 0.00 40.66 41.04 1rzh h LEU 215 CO 0.04 0.82 -0.49 0.15 -0.34 0.00 0.00 178.44 178.62 1rzh h PHE 216 N 0.56 0.00 -0.29 1.25 3.04 -1.03 0.33 116.94 120.80 1rzh h PHE 216 Ca 0.12 0.00 -0.07 0.00 3.98 0.00 0.00 57.97 62.00 1rzh h PHE 216 Cb 0.45 0.00 -0.01 0.00 2.56 0.00 0.00 35.95 38.95 1rzh h PHE 216 CO 0.03 0.49 -0.08 0.00 -2.02 0.00 0.00 178.31 176.73 1rzh h ALA 217 N 1.51 0.40 0.23 2.41 0.00 -0.96 0.18 119.26 123.02 1rzh h ALA 217 Ca -0.00 -0.29 -0.01 0.00 0.00 0.00 0.00 54.91 54.61 1rzh h ALA 217 Cb 0.87 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.56 1rzh h ALA 217 CO 0.06 0.23 -0.11 0.52 0.00 0.00 0.00 179.25 179.96 1rzh h MET 218 N 0.32 -0.29 -0.29 0.00 2.86 -0.48 -2.04 114.93 115.01 1rzh h MET 218 Ca 0.07 0.02 -0.04 0.00 -2.06 0.00 0.00 59.70 57.69 1rzh h MET 218 Cb 0.57 0.07 -0.01 0.00 0.06 0.00 0.00 31.60 32.29 1rzh h MET 218 CO 0.03 -0.13 0.01 1.25 1.06 0.00 0.00 176.91 179.13 1rzh h HIS 219 N -0.38 0.55 -0.42 -0.22 -0.00 -0.33 -0.95 115.15 113.40 1rzh h HIS 219 Ca -0.03 -0.09 0.00 0.00 -0.00 0.00 0.00 60.37 60.25 1rzh h HIS 219 Cb 0.29 -0.14 -0.02 0.00 -0.00 0.00 0.00 27.41 27.54 1rzh h HIS 219 CO -0.04 0.64 0.27 0.78 -0.00 0.00 0.00 177.93 179.58 1rzh h GLY 220 N 0.30 0.59 1.05 5.26 0.00 -0.68 -1.00 103.07 108.58 1rzh h GLY 220 Ca 0.08 -0.22 -0.07 0.00 0.00 0.00 0.00 47.33 47.13 1rzh h GLY 220 CO 0.01 0.22 0.17 0.00 0.00 0.00 0.00 176.54 176.94 1rzh h ALA 221 N 1.15 0.89 0.24 3.60 0.00 -1.32 -1.65 119.26 122.16 1rzh h ALA 221 Ca 0.15 -0.24 -0.01 0.00 0.00 0.00 0.00 54.91 54.81 1rzh h ALA 221 Cb -0.06 -0.26 0.00 0.00 0.00 0.00 0.00 17.79 17.47 1rzh h ALA 221 CO -0.03 0.61 -0.11 1.15 0.00 0.00 0.00 179.25 180.86 1rzh h THR 222 N 1.01 0.79 -0.71 0.00 2.02 -0.86 0.18 112.91 115.34 1rzh h THR 222 Ca 0.21 -0.14 0.01 0.00 0.77 0.00 0.00 66.41 67.26 1rzh h THR 222 Cb 0.36 0.88 -0.04 0.00 -1.74 0.00 0.00 68.15 67.62 1rzh h THR 222 CO 0.00 0.03 0.47 0.40 0.37 0.00 0.00 175.52 176.79 1rzh h ILE 223 N -0.39 1.19 -0.65 3.11 1.08 -1.14 -1.00 117.51 119.71 1rzh h ILE 223 Ca -0.03 -0.35 -0.05 0.00 -0.39 0.00 0.00 64.86 64.03 1rzh h ILE 223 Cb 0.30 0.14 -0.03 0.00 -3.07 0.00 0.00 36.82 34.16 1rzh h ILE 223 CO 0.05 0.18 0.19 -0.07 -0.69 0.00 0.00 178.15 177.82 1rzh h LEU 224 N 0.97 0.93 -1.63 1.44 3.38 -1.11 0.27 115.31 119.56 1rzh h LEU 224 Ca 0.26 -0.17 -0.04 0.00 0.09 0.00 0.00 57.88 58.03 1rzh h LEU 224 Cb -0.10 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 40.40 1rzh h LEU 224 CO -0.06 0.88 -0.15 0.00 0.09 0.00 0.00 178.44 179.20 1rzh h ALA 225 N 1.25 1.69 -0.36 1.53 0.00 0.33 -2.58 119.26 121.12 1rzh h ALA 225 Ca 0.21 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.97 1rzh h ALA 225 Cb 0.29 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.04 1rzh h ALA 225 CO -0.01 0.23 0.00 1.33 0.00 0.00 0.00 179.25 180.80 1rzh n VAL 226 N -4.34 1.72 0.30 0.00 0.24 -0.47 -4.49 118.33 111.29 1rzh n VAL 226 Ca -0.02 -1.42 0.18 0.00 -2.04 0.00 0.00 64.34 61.04 1rzh n VAL 226 Cb 0.23 0.10 0.76 0.00 -1.47 0.00 0.00 33.84 33.47 1rzh n VAL 226 CO 0.00 0.00 0.00 0.77 -2.14 0.00 0.00 176.83 175.46 1rzh h SER 227 N 2.29 0.00 0.40 -1.34 4.64 -0.53 -0.68 113.55 118.34 1rzh h SER 227 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1rzh h SER 227 Cb 1.18 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.27 1rzh h SER 227 CO 0.14 0.00 0.00 -2.11 -0.87 0.00 0.00 176.83 173.99 1rzh n ARG 228 N -2.95 0.00 -0.08 4.77 1.85 -1.26 -1.33 116.66 117.66 1rzh n ARG 228 Ca 0.00 0.30 0.09 0.00 -1.00 0.00 0.00 57.85 57.24 1rzh n ARG 228 Cb 0.24 -1.50 0.13 0.00 -1.05 0.00 0.00 32.46 30.28 1rzh n ARG 228 CO 0.00 0.00 0.00 1.19 -0.01 0.00 0.00 177.63 178.81 1rzh n PHE 229 N -1.51 0.05 -1.88 2.89 3.72 -0.36 -4.96 117.46 115.41 1rzh n PHE 229 Ca 0.03 -0.92 -0.08 0.00 -0.05 0.00 0.00 57.45 56.43 1rzh n PHE 229 Cb 0.14 -0.14 -0.01 0.00 -0.94 0.00 0.00 39.48 38.52 1rzh n PHE 229 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1rzh n GLY 230 N -1.26 0.32 0.28 1.37 0.00 -0.44 -4.50 105.19 100.97 1rzh n GLY 230 Ca 0.14 -0.60 0.12 0.00 0.00 0.00 0.00 46.02 45.68 1rzh n GLY 230 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1rzh h GLY 231 N 0.00 0.00 2.00 -0.02 0.00 -1.44 -1.53 103.07 102.09 1rzh h GLY 231 Ca -0.18 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.15 1rzh h GLY 231 CO 0.22 0.00 0.00 -1.84 0.00 0.00 0.00 176.54 174.92 1rzh n GLU 232 N -4.22 0.14 -1.81 4.80 0.00 -1.26 -3.77 120.64 114.53 1rzh n GLU 232 Ca -0.03 0.33 -0.42 0.00 0.00 0.00 0.00 57.16 57.05 1rzh n GLU 232 Cb 0.11 -1.74 -0.00 0.00 0.00 0.00 0.00 31.44 29.80 1rzh n GLU 232 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 1rzh h GLU 234 N 5.85 0.49 -0.71 0.00 5.08 -1.83 -1.53 114.58 121.92 1rzh h GLU 234 Ca 0.57 -0.03 -0.01 0.00 -1.00 0.00 0.00 59.36 58.88 1rzh h GLU 234 Cb 0.60 -0.11 -0.03 0.00 0.50 0.00 0.00 28.75 29.71 1rzh h GLU 234 CO 1.83 0.32 0.40 -0.07 -1.00 0.00 0.00 179.01 180.49 1rzh h LEU 235 N 0.50 0.87 -0.68 1.33 3.38 -1.94 -0.57 115.31 118.21 1rzh h LEU 235 Ca 0.14 -0.07 -0.09 0.00 0.09 0.00 0.00 57.88 57.96 1rzh h LEU 235 Cb -0.05 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 40.45 1rzh h LEU 235 CO -0.03 0.70 0.07 -0.08 0.09 0.00 0.00 178.44 179.19 1rzh h GLU 236 N 0.99 1.09 0.00 1.13 4.81 -1.88 -1.94 114.58 118.78 1rzh h GLU 236 Ca 0.25 -0.31 -0.09 0.00 -0.13 0.00 0.00 59.36 59.08 1rzh h GLU 236 Cb 0.02 -0.12 -0.01 0.00 0.63 0.00 0.00 28.75 29.26 1rzh h GLU 236 CO -0.04 1.02 -0.44 1.96 -0.73 0.00 0.00 179.01 180.78 1rzh h GLN 237 N 1.01 0.00 -0.13 1.92 1.08 -0.60 0.47 115.11 118.87 1rzh h GLN 237 Ca 0.19 0.00 -0.08 0.00 -1.45 0.00 0.00 58.65 57.31 1rzh h GLN 237 Cb 0.48 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.91 1rzh h GLN 237 CO 0.02 0.44 -0.23 0.82 -0.95 0.00 0.00 178.83 178.93 1rzh h ILE 238 N 0.00 1.37 0.00 2.54 2.04 -0.83 -2.20 117.51 120.44 1rzh h ILE 238 Ca -0.00 -1.48 -0.10 0.00 1.00 0.00 0.00 64.86 64.27 1rzh h ILE 238 Cb 0.87 2.03 -0.01 0.00 -0.74 0.00 0.00 36.82 38.96 1rzh h ILE 238 CO 0.06 0.43 -0.47 0.00 0.00 0.00 0.00 178.15 178.18 1rzh h ALA 239 N 0.54 0.99 -1.49 1.87 0.00 -1.19 -3.39 119.26 116.59 1rzh h ALA 239 Ca 0.01 -0.42 -0.30 0.00 0.00 0.00 0.00 54.91 54.20 1rzh h ALA 239 Cb 0.81 -0.07 -0.24 0.00 0.00 0.00 0.00 17.79 18.28 1rzh h ALA 239 CO 0.05 0.58 -0.65 0.34 0.00 0.00 0.00 179.25 179.57 1rzh s ASP 240 N -6.60 -0.39 -0.17 0.00 -1.08 0.14 -5.10 116.67 103.48 1rzh s ASP 240 Ca -0.00 -2.08 -0.42 0.00 -0.52 0.00 0.00 52.55 49.53 1rzh s ASP 240 Cb 0.12 1.09 -0.19 0.00 -1.46 0.00 0.00 42.92 42.48 1rzh s ASP 240 CO 0.72 -0.11 1.32 -1.14 0.52 0.00 0.00 175.17 176.48 1rzh n ARG 241 N 3.09 0.23 -4.16 4.34 0.63 -0.83 -4.46 116.66 115.51 1rzh n ARG 241 Ca 0.21 0.08 -0.29 0.00 -0.92 0.00 0.00 57.85 56.94 1rzh n ARG 241 Cb 0.53 -1.62 -0.02 0.00 0.45 0.00 0.00 32.46 31.80 1rzh n ARG 241 CO 0.00 0.00 0.00 0.20 -2.51 0.00 0.00 177.63 175.32 1rzh s GLY 242 N 1.28 2.59 0.55 5.14 0.00 -1.26 -5.01 107.32 110.61 1rzh s GLY 242 Ca 0.95 -0.91 0.30 0.00 0.00 0.00 0.00 44.72 45.06 1rzh s GLY 242 CO 0.64 -2.03 2.13 0.00 0.00 0.00 0.00 173.10 173.85 1rzh h THR 243 N 0.90 0.48 0.08 0.90 1.03 -1.93 -2.19 112.91 112.18 1rzh h THR 243 Ca -0.39 -0.37 -0.00 0.00 -0.01 0.00 0.00 66.41 65.64 1rzh h THR 243 Cb 1.31 1.25 0.00 0.00 -1.07 0.00 0.00 68.15 69.64 1rzh h THR 243 CO 0.62 0.08 -0.04 0.00 -0.01 0.00 0.00 175.52 176.17 1rzh h ALA 244 N 1.92 -0.11 -0.39 0.00 0.00 -1.89 -0.54 119.26 118.25 1rzh h ALA 244 Ca -0.00 -0.04 -0.08 0.00 0.00 0.00 0.00 54.91 54.79 1rzh h ALA 244 Cb 0.24 0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.06 1rzh h ALA 244 CO 0.01 -0.55 -0.09 0.00 0.00 0.00 0.00 179.25 178.62 1rzh h ALA 245 N 0.78 1.11 -0.28 0.00 0.00 -1.79 -1.50 119.26 117.58 1rzh h ALA 245 Ca -0.01 -0.29 -0.09 0.00 0.00 0.00 0.00 54.91 54.52 1rzh h ALA 245 Cb 0.11 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.73 1rzh h ALA 245 CO 0.02 0.56 -0.17 0.93 0.00 0.00 0.00 179.25 180.58 1rzh h GLU 246 N 0.63 0.62 -0.34 0.00 5.08 -1.23 -1.69 114.58 117.64 1rzh h GLU 246 Ca 0.11 -0.29 -0.11 0.00 -1.00 0.00 0.00 59.36 58.08 1rzh h GLU 246 Cb 0.52 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.75 1rzh h GLU 246 CO 0.03 0.87 -0.23 0.00 -1.00 0.00 0.00 179.01 178.68 1rzh h ARG 247 N 0.36 0.67 0.01 2.33 3.08 -1.01 0.10 114.38 119.93 1rzh h ARG 247 Ca 0.06 -0.26 -0.00 0.00 0.07 0.00 0.00 59.98 59.85 1rzh h ARG 247 Cb 0.71 -0.03 0.00 0.00 0.08 0.00 0.00 29.97 30.72 1rzh h ARG 247 CO 0.05 0.84 -0.01 0.00 -1.07 0.00 0.00 179.97 179.78 1rzh h ALA 248 N 1.16 -0.02 -0.68 0.04 0.00 -1.22 0.70 119.26 119.23 1rzh h ALA 248 Ca 0.08 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.96 1rzh h ALA 248 Cb 0.71 0.01 -0.03 0.00 0.00 0.00 0.00 17.79 18.47 1rzh h ALA 248 CO 0.05 -0.47 0.43 0.00 0.00 0.00 0.00 179.25 179.26 1rzh h ALA 249 N 0.90 0.87 0.00 0.00 0.00 -1.09 -2.75 119.26 117.18 1rzh h ALA 249 Ca -0.00 -0.06 -0.11 0.00 0.00 0.00 0.00 54.91 54.73 1rzh h ALA 249 Cb 0.08 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 17.58 1rzh h ALA 249 CO 0.00 0.32 -0.54 -0.07 0.00 0.00 0.00 179.25 178.97 1rzh h LEU 250 N 0.93 0.00 -0.05 0.00 3.38 -0.75 0.60 115.31 119.43 1rzh h LEU 250 Ca 0.25 0.00 0.01 0.00 0.09 0.00 0.00 57.88 58.23 1rzh h LEU 250 Cb -0.07 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.67 1rzh h LEU 250 CO -0.05 0.54 -0.02 0.15 0.09 0.00 0.00 178.44 179.14 1rzh h PHE 251 N 0.00 -0.05 -0.34 1.13 3.57 -0.57 -0.16 116.94 120.53 1rzh h PHE 251 Ca -0.01 0.01 -0.17 0.00 3.53 0.00 0.00 57.97 61.33 1rzh h PHE 251 Cb 0.97 0.03 -0.00 0.00 2.79 0.00 0.00 35.95 39.74 1rzh h PHE 251 CO 0.00 -0.03 -0.45 -1.49 -2.23 0.00 0.00 178.31 174.11 1rzh h TRP 252 N -0.01 1.06 -0.56 0.41 4.06 -1.37 -1.08 115.95 118.47 1rzh h TRP 252 Ca 0.03 -0.34 -0.01 0.00 2.06 0.00 0.00 58.89 60.63 1rzh h TRP 252 Cb 0.06 -0.22 -0.03 0.00 -1.00 0.00 0.00 29.16 27.97 1rzh h TRP 252 CO -0.12 1.16 0.32 -0.09 -3.56 0.00 0.00 178.44 176.14 1rzh h ARG 253 N 0.70 0.77 0.00 0.49 2.43 -0.73 0.26 114.38 118.30 1rzh h ARG 253 Ca 0.04 -0.08 -0.10 0.00 -0.81 0.00 0.00 59.98 59.03 1rzh h ARG 253 Cb 1.04 -0.15 -0.01 0.00 -0.42 0.00 0.00 29.97 30.42 1rzh h ARG 253 CO 0.10 0.58 -0.49 -1.49 -1.51 0.00 0.00 179.97 177.16 1rzh h TRP 254 N 0.75 0.00 0.01 2.20 6.55 -0.97 0.82 115.95 125.30 1rzh h TRP 254 Ca 0.20 0.00 -0.00 0.00 0.95 0.00 0.00 58.89 60.04 1rzh h TRP 254 Cb 0.02 0.00 0.00 0.00 -0.86 0.00 0.00 29.16 28.32 1rzh h TRP 254 CO -0.02 0.49 -0.01 1.15 -1.05 0.00 0.00 178.44 179.00 1rzh h THR 255 N 0.00 1.12 -0.07 1.49 2.02 -0.68 -3.41 112.91 113.38 1rzh h THR 255 Ca -0.00 -1.80 0.00 0.00 0.77 0.00 0.00 66.41 65.38 1rzh h THR 255 Cb 0.87 2.10 0.00 0.00 -1.74 0.00 0.00 68.15 69.38 1rzh h THR 255 CO 0.06 0.37 0.00 1.15 0.37 0.00 0.00 175.52 177.48 1rzh n MET 256 N -4.69 2.81 -0.29 6.66 0.00 0.88 -5.01 117.12 117.48 1rzh n MET 256 Ca -0.06 -1.57 0.00 0.00 0.00 0.00 0.00 57.70 56.07 1rzh n MET 256 Cb 0.30 -1.06 0.00 0.00 0.00 0.00 0.00 33.22 32.47 1rzh n MET 256 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 1rzh n GLY 257 N -0.27 1.33 3.77 3.17 0.00 0.28 -5.00 105.19 108.47 1rzh n GLY 257 Ca 0.02 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 45.97 1rzh n GLY 257 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1rzh s PHE 258 N -2.89 0.00 0.23 1.61 -0.71 -1.25 -4.93 117.98 110.04 1rzh s PHE 258 Ca 0.00 -0.43 -0.06 0.00 -1.04 0.00 0.00 56.93 55.40 1rzh s PHE 258 Cb 0.00 0.53 0.02 0.00 -1.21 0.00 0.00 43.02 42.36 1rzh s PHE 258 CO 0.00 -1.16 0.40 0.27 -1.34 0.00 0.00 175.22 173.40 1rzh n ASN 259 N -0.44 -1.16 -1.74 1.98 6.94 -1.26 -3.04 115.26 116.53 1rzh n ASN 259 Ca -0.03 -2.03 0.00 0.00 -0.02 0.00 0.00 54.58 52.50 1rzh n ASN 259 Cb 0.60 2.00 0.00 0.00 -2.36 0.00 0.00 39.78 40.02 1rzh n ASN 259 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1rzh n ALA 260 N -1.57 0.00 -2.48 -2.53 0.00 -1.26 -5.05 120.51 107.63 1rzh n ALA 260 Ca -0.09 0.00 -0.23 0.00 0.00 0.00 0.00 53.44 53.11 1rzh n ALA 260 Cb 0.36 0.00 -0.10 0.00 0.00 0.00 0.00 19.45 19.70 1rzh n ALA 260 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 1rzh s THR 261 N -0.69 1.87 0.36 0.00 -4.23 -1.26 -4.76 115.64 106.94 1rzh s THR 261 Ca 0.00 -2.15 0.05 0.00 -1.18 0.00 0.00 61.69 58.41 1rzh s THR 261 Cb 0.00 -2.54 0.29 0.00 1.34 0.00 0.00 72.50 71.58 1rzh s THR 261 CO 0.00 -0.25 1.98 -0.03 -0.54 0.00 0.00 174.62 175.78 1rzh h MET 262 N 2.17 0.74 0.12 3.99 4.05 -1.91 -1.16 114.93 122.93 1rzh h MET 262 Ca -0.41 -0.04 -0.17 0.00 -0.28 0.00 0.00 59.70 58.79 1rzh h MET 262 Cb 1.24 -0.17 0.02 0.00 -0.80 0.00 0.00 31.60 31.89 1rzh h MET 262 CO 0.69 0.49 -0.78 1.49 0.23 0.00 0.00 176.91 179.02 1rzh h GLU 263 N 0.76 0.26 -0.63 0.39 4.81 -1.94 -3.37 114.58 114.87 1rzh h GLU 263 Ca 0.28 -0.45 0.06 0.00 -0.13 0.00 0.00 59.36 59.13 1rzh h GLU 263 Cb 0.16 0.17 -0.04 0.00 0.63 0.00 0.00 28.75 29.67 1rzh h GLU 263 CO -0.09 1.21 0.41 0.78 -0.73 0.00 0.00 179.01 180.60 1rzh h GLY 264 N -0.41 0.77 1.93 1.92 0.00 -1.87 -1.93 103.07 103.49 1rzh h GLY 264 Ca -0.14 -0.25 -0.02 0.00 0.00 0.00 0.00 47.33 46.91 1rzh h GLY 264 CO 0.13 0.19 -0.08 1.19 0.00 0.00 0.00 176.54 177.96 1rzh h ILE 265 N 0.62 1.10 0.00 2.60 6.09 -1.38 -0.49 117.51 126.04 1rzh h ILE 265 Ca 0.27 -0.42 0.00 0.00 -1.37 0.00 0.00 64.86 63.34 1rzh h ILE 265 Cb 0.28 1.14 0.00 0.00 0.47 0.00 0.00 36.82 38.71 1rzh h ILE 265 CO -0.08 0.13 0.00 0.45 -3.07 0.00 0.00 178.15 175.58 1rzh h HIS 266 N 0.09 0.00 0.21 2.19 3.86 -1.53 -0.04 115.15 119.93 1rzh h HIS 266 Ca 0.02 0.00 -0.32 0.00 -1.16 0.00 0.00 60.37 58.91 1rzh h HIS 266 Cb 0.20 0.00 0.03 0.00 1.06 0.00 0.00 27.41 28.70 1rzh h HIS 266 CO 0.00 0.00 -1.42 0.00 0.86 0.00 0.00 177.93 177.37 1rzh h ARG 267 N 0.00 0.44 -0.56 2.45 3.08 -1.13 -1.30 114.38 117.37 1rzh h ARG 267 Ca 0.00 -0.76 -0.01 0.00 0.07 0.00 0.00 59.98 59.28 1rzh h ARG 267 Cb 0.72 0.28 -0.03 0.00 0.08 0.00 0.00 29.97 31.02 1rzh h ARG 267 CO 0.00 1.36 0.30 -1.49 -1.07 0.00 0.00 179.97 179.07 1rzh h TRP 268 N 0.12 0.77 0.16 3.04 4.06 -0.98 -2.37 115.95 120.75 1rzh h TRP 268 Ca -0.22 -0.02 -0.01 0.00 2.06 0.00 0.00 58.89 60.70 1rzh h TRP 268 Cb 2.11 -0.24 0.00 0.00 -1.00 0.00 0.00 29.16 30.02 1rzh h TRP 268 CO 0.11 0.57 -0.08 0.00 -3.56 0.00 0.00 178.44 175.47 1rzh h ALA 269 N 1.13 -0.22 -0.71 1.49 0.00 -1.00 -0.19 119.26 119.77 1rzh h ALA 269 Ca 0.20 -0.08 -0.03 0.00 0.00 0.00 0.00 54.91 55.00 1rzh h ALA 269 Cb 0.06 0.08 -0.03 0.00 0.00 0.00 0.00 17.79 17.90 1rzh h ALA 269 CO -0.03 -0.59 0.32 0.97 0.00 0.00 0.00 179.25 179.93 1rzh h ILE 270 N -0.29 1.23 -0.10 0.00 2.10 -1.19 -2.40 117.51 116.85 1rzh h ILE 270 Ca -0.02 -0.67 -0.20 0.00 1.08 0.00 0.00 64.86 65.05 1rzh h ILE 270 Cb 0.23 0.34 0.01 0.00 -1.09 0.00 0.00 36.82 36.31 1rzh h ILE 270 CO 0.04 0.28 -0.71 -0.50 -1.08 0.00 0.00 178.15 176.17 1rzh h TRP 271 N 1.01 0.90 -0.55 2.19 4.06 -1.34 -0.96 115.95 121.26 1rzh h TRP 271 Ca 0.24 -0.42 0.08 0.00 2.06 0.00 0.00 58.89 60.85 1rzh h TRP 271 Cb 0.13 -0.13 -0.06 0.00 -1.00 0.00 0.00 29.16 28.09 1rzh h TRP 271 CO 0.01 1.24 0.21 1.98 -3.56 0.00 0.00 178.44 178.32 1rzh h MET 272 N 0.32 0.38 -0.05 0.49 4.05 -0.88 0.34 114.93 119.57 1rzh h MET 272 Ca -0.06 -0.02 -0.04 0.00 -0.28 0.00 0.00 59.70 59.30 1rzh h MET 272 Cb 1.36 -0.09 0.00 0.00 -0.80 0.00 0.00 31.60 32.07 1rzh h MET 272 CO 0.14 0.25 -0.12 0.00 0.23 0.00 0.00 176.91 177.42 1rzh h ALA 273 N 1.36 0.08 -0.77 0.39 0.00 -1.44 -3.26 119.26 115.63 1rzh h ALA 273 Ca 0.27 -0.34 0.05 0.00 0.00 0.00 0.00 54.91 54.89 1rzh h ALA 273 Cb 0.29 -0.01 -0.05 0.00 0.00 0.00 0.00 17.79 18.02 1rzh h ALA 273 CO -0.26 -0.03 0.50 0.28 0.00 0.00 0.00 179.25 179.74 1rzh h VAL 274 N -0.35 1.07 0.00 0.00 2.07 -0.95 -1.56 116.25 116.53 1rzh h VAL 274 Ca -0.00 -0.30 -0.00 0.00 0.82 0.00 0.00 66.70 67.22 1rzh h VAL 274 Cb 0.71 0.13 -0.00 0.00 -1.52 0.00 0.00 31.29 30.60 1rzh h VAL 274 CO 0.03 0.16 -0.01 -0.07 0.02 0.00 0.00 177.57 177.69 1rzh h LEU 275 N 0.87 0.00 0.49 2.57 3.38 -0.97 -2.26 115.31 119.38 1rzh h LEU 275 Ca 0.32 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.28 1rzh h LEU 275 Cb 0.17 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.90 1rzh h LEU 275 CO -0.10 0.01 -0.35 0.58 0.09 0.00 0.00 178.44 178.66 1rzh h VAL 276 N 0.00 0.28 0.00 1.22 2.07 -1.33 -2.04 116.25 116.45 1rzh h VAL 276 Ca -0.00 0.00 -0.06 0.00 0.82 0.00 0.00 66.70 67.46 1rzh h VAL 276 Cb 0.32 0.28 -0.01 0.00 -1.52 0.00 0.00 31.29 30.36 1rzh h VAL 276 CO 0.00 0.00 -0.36 0.71 0.02 0.00 0.00 177.57 177.94 1rzh h THR 277 N -0.82 0.41 0.41 2.57 1.35 -1.68 -1.97 112.91 113.19 1rzh h THR 277 Ca -0.05 -1.60 -0.02 0.00 -0.55 0.00 0.00 66.41 64.19 1rzh h THR 277 Cb 0.69 2.16 0.00 0.00 -1.73 0.00 0.00 68.15 69.27 1rzh h THR 277 CO 0.02 0.23 -0.20 0.25 -0.25 0.00 0.00 175.52 175.58 1rzh h LEU 278 N 0.00 -0.47 -0.70 3.87 5.85 -1.36 0.89 115.31 123.38 1rzh h LEU 278 Ca -0.01 -0.11 -0.07 0.00 0.84 0.00 0.00 57.88 58.52 1rzh h LEU 278 Cb 1.20 0.12 -0.03 0.00 0.37 0.00 0.00 40.66 42.33 1rzh h LEU 278 CO 0.03 -0.10 0.15 0.71 -0.34 0.00 0.00 178.44 178.88 1rzh h THR 279 N -0.89 1.26 -0.07 1.05 1.35 -1.47 -2.72 112.91 111.42 1rzh h THR 279 Ca -0.06 -1.01 0.03 0.00 -0.55 0.00 0.00 66.41 64.82 1rzh h THR 279 Cb 0.56 0.56 -0.03 0.00 -1.73 0.00 0.00 68.15 67.51 1rzh h THR 279 CO 0.09 0.38 -0.09 1.23 -0.25 0.00 0.00 175.52 176.89 1rzh h GLY 280 N 1.08 -0.05 0.88 5.82 0.00 -1.32 -0.11 103.07 109.37 1rzh h GLY 280 Ca 0.22 0.11 0.05 0.00 0.00 0.00 0.00 47.33 47.71 1rzh h GLY 280 CO 0.01 -0.10 0.61 -1.33 0.00 0.00 0.00 176.54 175.72 1rzh h GLY 281 N -0.13 1.36 0.85 4.60 0.00 -0.69 -0.98 103.07 108.08 1rzh h GLY 281 Ca 0.06 -0.44 -0.02 0.00 0.00 0.00 0.00 47.33 46.92 1rzh h GLY 281 CO -0.14 0.35 0.04 -2.22 0.00 0.00 0.00 176.54 174.57 1rzh h ILE 282 N 1.11 1.21 -0.72 2.60 2.04 -1.12 -0.19 117.51 122.43 1rzh h ILE 282 Ca 0.39 -0.70 0.06 0.00 1.00 0.00 0.00 64.86 65.61 1rzh h ILE 282 Cb 0.12 1.28 -0.06 0.00 -0.74 0.00 0.00 36.82 37.42 1rzh h ILE 282 CO -0.14 0.22 0.42 1.23 0.00 0.00 0.00 178.15 179.88 1rzh h GLY 283 N 0.14 1.07 0.81 5.37 0.00 -0.31 -1.81 103.07 108.34 1rzh h GLY 283 Ca 0.06 -0.30 -0.09 0.00 0.00 0.00 0.00 47.33 47.01 1rzh h GLY 283 CO 0.00 0.19 -0.23 -2.22 0.00 0.00 0.00 176.54 174.28 1rzh h ILE 284 N 0.77 1.34 -0.68 2.60 1.08 -1.09 -3.12 117.51 118.42 1rzh h ILE 284 Ca 0.32 -1.44 0.04 0.00 -0.39 0.00 0.00 64.86 63.40 1rzh h ILE 284 Cb 0.18 1.87 -0.04 0.00 -3.07 0.00 0.00 36.82 35.77 1rzh h ILE 284 CO -0.18 0.43 0.45 0.25 -0.69 0.00 0.00 178.15 178.41 1rzh h LEU 285 N 0.11 0.67 -0.37 1.44 5.85 -0.74 -1.04 115.31 121.22 1rzh h LEU 285 Ca 0.02 -0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.74 1rzh h LEU 285 Cb 0.80 -0.15 0.00 0.00 0.37 0.00 0.00 40.66 41.68 1rzh h LEU 285 CO 0.05 0.45 0.00 -0.07 -0.34 0.00 0.00 178.44 178.54 1rzh h LEU 286 N 0.77 0.00 -8.87 2.25 3.38 -1.36 -3.40 115.31 108.09 1rzh h LEU 286 Ca 0.28 0.00 -0.57 0.00 0.09 0.00 0.00 57.88 57.68 1rzh h LEU 286 Cb 0.13 0.00 -0.06 0.00 0.09 0.00 0.00 40.66 40.82 1rzh h LEU 286 CO -0.08 0.00 0.92 -0.44 0.09 0.00 0.00 178.44 178.93 1rzh s SER 287 N -4.78 6.73 0.00 -0.43 0.01 -0.39 -1.13 113.70 113.71 1rzh s SER 287 Ca 0.07 0.88 0.00 0.00 1.31 0.00 0.00 55.95 58.21 1rzh s SER 287 Cb 0.10 -2.54 0.00 0.00 0.21 0.00 0.00 66.02 63.79 1rzh s SER 287 CO 0.54 -1.09 0.00 0.61 0.41 0.00 0.00 173.24 173.71 1rzh n GLY 288 N 4.38 3.09 0.11 3.44 0.00 0.10 -4.80 105.19 111.51 1rzh n GLY 288 Ca 0.13 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.93 1rzh n GLY 288 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 1rzh h THR 289 N 0.00 0.85 0.00 2.61 1.35 -1.76 -3.44 112.91 112.52 1rzh h THR 289 Ca 0.00 -2.22 -0.08 0.00 -0.55 0.00 0.00 66.41 63.56 1rzh h THR 289 Cb 0.00 2.29 -0.02 0.00 -1.73 0.00 0.00 68.15 68.69 1rzh h THR 289 CO 0.00 0.45 -1.31 0.52 -0.25 0.00 0.00 175.52 174.92 1rzh n VAL 290 N -4.22 0.31 -3.99 6.82 0.31 -0.89 -4.98 118.33 111.70 1rzh n VAL 290 Ca -0.32 -0.16 -0.30 0.00 -0.01 0.00 0.00 64.34 63.54 1rzh n VAL 290 Cb 0.77 -0.81 -0.16 0.00 -0.91 0.00 0.00 33.84 32.72 1rzh n VAL 290 CO 0.00 0.00 0.00 -0.69 -1.32 0.00 0.00 176.83 174.82 1rzh s VAL 291 N -2.11 1.58 -0.08 2.52 1.01 -0.29 -5.00 120.40 118.04 1rzh s VAL 291 Ca -0.04 -0.93 0.14 0.00 0.00 0.00 0.00 61.98 61.14 1rzh s VAL 291 Cb 0.02 -1.65 -0.07 0.00 0.00 0.00 0.00 36.38 34.67 1rzh s VAL 291 CO 0.16 0.20 1.18 0.44 0.00 0.00 0.00 175.10 177.08 1rzh h ASP 292 N 8.00 0.00 -2.63 3.32 3.32 -1.87 0.30 116.42 126.86 1rzh h ASP 292 Ca -0.28 0.00 -0.30 0.00 0.02 0.00 0.00 57.03 56.47 1rzh h ASP 292 Cb 1.10 0.00 -0.35 0.00 0.22 0.00 0.00 39.33 40.30 1rzh h ASP 292 CO 0.47 0.67 -0.61 0.21 -1.72 0.00 0.00 179.24 178.26 1rzh s ASN 293 N -6.30 1.15 0.26 6.45 3.84 -1.26 -4.28 114.94 114.80 1rzh s ASN 293 Ca 0.01 -0.04 -0.01 0.00 0.21 0.00 0.00 52.86 53.03 1rzh s ASN 293 Cb 0.08 0.42 0.34 0.00 -0.55 0.00 0.00 41.25 41.54 1rzh s ASN 293 CO 0.79 -0.30 1.73 -0.50 -2.79 0.00 0.00 177.10 176.02 1rzh h TRP 294 N 8.31 0.75 -0.39 0.43 4.06 -1.21 -0.99 115.95 126.92 1rzh h TRP 294 Ca -0.16 -0.13 0.01 0.00 2.06 0.00 0.00 58.89 60.67 1rzh h TRP 294 Cb 1.14 -0.20 -0.02 0.00 -1.00 0.00 0.00 29.16 29.08 1rzh h TRP 294 CO 0.20 0.78 0.23 -0.92 -3.56 0.00 0.00 178.44 175.17 1rzh h TYR 295 N 0.63 0.44 -0.21 0.49 3.20 -1.78 0.42 116.97 120.17 1rzh h TYR 295 Ca 0.11 0.01 -0.00 0.00 3.14 0.00 0.00 58.73 61.99 1rzh h TYR 295 Cb 0.57 -0.14 -0.01 0.00 1.54 0.00 0.00 36.73 38.68 1rzh h TYR 295 CO 0.03 0.26 0.11 0.28 -1.64 0.00 0.00 178.16 177.20 1rzh h VAL 296 N 0.48 1.11 -0.72 1.81 2.07 -1.83 -2.46 116.25 116.70 1rzh h VAL 296 Ca 0.15 -0.31 0.06 0.00 0.82 0.00 0.00 66.70 67.42 1rzh h VAL 296 Cb -0.01 0.94 -0.06 0.00 -1.52 0.00 0.00 31.29 30.65 1rzh h VAL 296 CO -0.06 0.11 0.42 -0.25 0.02 0.00 0.00 177.57 177.81 1rzh h TRP 297 N 0.22 0.78 0.00 1.57 7.01 -0.84 -0.96 115.95 123.74 1rzh h TRP 297 Ca 0.07 0.03 -0.02 0.00 2.11 0.00 0.00 58.89 61.08 1rzh h TRP 297 Cb 0.08 -0.25 -0.00 0.00 -2.10 0.00 0.00 29.16 26.89 1rzh h TRP 297 CO -0.03 0.39 -0.07 0.78 -2.79 0.00 0.00 178.44 176.71 1rzh h GLY 298 N 0.78 0.00 2.00 2.65 0.00 -0.60 -1.36 103.07 106.54 1rzh h GLY 298 Ca 0.32 0.00 -0.10 0.00 0.00 0.00 0.00 47.33 47.55 1rzh h GLY 298 CO -0.17 0.00 -0.46 1.46 0.00 0.00 0.00 176.54 177.36 1rzh h GLN 299 N 0.00 0.00 -0.01 4.80 1.08 -0.72 -3.16 115.11 117.11 1rzh h GLN 299 Ca -0.00 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.20 1rzh h GLN 299 Cb 0.22 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.65 1rzh h GLN 299 CO 0.01 0.46 -0.67 0.09 -0.95 0.00 0.00 178.83 177.77 1rzh n ASN 300 N -3.48 1.21 0.00 1.46 5.03 -0.58 -5.13 115.26 113.77 1rzh n ASN 300 Ca 0.00 -1.00 0.00 0.00 0.87 0.00 0.00 54.58 54.45 1rzh n ASN 300 Cb 0.59 0.61 0.00 0.00 -1.02 0.00 0.00 39.78 39.97 1rzh n ASN 300 CO 0.00 0.00 0.00 1.41 -1.83 0.00 0.00 177.26 176.84