#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1rh8 n SER 4636N 0.00 1.42 -4.25 0.00 2.88 -1.26 -4.96 113.62 107.46 1rh8 n SER 4636Ca 0.00 -3.08 -0.43 0.00 -1.33 0.00 0.00 58.87 54.04 1rh8 n SER 4636Cb 0.00 -0.42 -0.03 0.00 -0.75 0.00 0.00 64.21 63.00 1rh8 n SER 4636CO 0.00 0.00 0.00 -2.28 -1.23 0.00 0.00 175.04 171.53 1rh8 s HIS 4637N -1.91 3.93 0.53 0.66 5.65 -1.26 -5.07 115.29 117.81 1rh8 s HIS 4637Ca 0.34 -2.57 -0.18 0.00 0.25 0.00 0.00 55.06 52.90 1rh8 s HIS 4637Cb 0.35 -3.62 -0.07 0.00 -1.18 0.00 0.00 32.58 28.06 1rh8 s HIS 4637CO -0.09 -0.90 1.02 -1.25 -0.65 0.00 0.00 174.74 172.87 1rh8 s PRO 4638N -0.71 3.71 -0.37 2.88 0.04 -1.26 -5.03 135.00 134.27 1rh8 s PRO 4638Ca 0.24 1.17 -0.16 0.00 0.04 0.00 0.00 61.00 62.29 1rh8 s PRO 4638Cb -0.11 -2.09 -0.00 0.00 0.04 0.00 0.00 34.50 32.34 1rh8 s PRO 4638CO -0.09 -0.48 0.41 0.42 0.04 0.00 0.00 177.00 177.30 1rh8 s ILE 4639N -2.34 5.12 0.27 0.56 -1.09 -1.26 -4.56 121.20 117.90 1rh8 s ILE 4639Ca 0.63 -0.01 0.06 0.00 -2.23 0.00 0.00 60.65 59.10 1rh8 s ILE 4639Cb -0.14 -3.91 -0.02 0.00 -1.58 0.00 0.00 42.46 36.81 1rh8 s ILE 4639CO 0.28 -0.21 0.23 0.35 -1.23 0.00 0.00 174.94 174.36 1rh8 n THR 4640N 5.33 0.00 0.00 2.92 -2.24 -1.26 -4.81 114.28 114.23 1rh8 n THR 4640Ca -0.08 -1.95 0.00 0.00 -2.27 0.00 0.00 64.05 59.75 1rh8 n THR 4640Cb 0.49 0.98 0.00 0.00 -2.10 0.00 0.00 70.33 69.70 1rh8 n THR 4640CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1rh8 n GLY 4641N -0.51 -1.11 3.34 3.38 0.00 0.40 -4.05 105.19 106.63 1rh8 n GLY 4641Ca 0.06 -1.62 -0.21 0.00 0.00 0.00 0.00 46.02 44.24 1rh8 n GLY 4641CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1rh8 s GLU 4642N -2.17 1.29 -0.16 1.61 2.02 0.13 -2.26 118.70 119.16 1rh8 s GLU 4642Ca 0.00 -1.44 -0.01 0.00 0.02 0.00 0.00 54.97 53.54 1rh8 s GLU 4642Cb 0.00 -1.32 -0.01 0.00 0.10 0.00 0.00 34.13 32.90 1rh8 s GLU 4642CO 0.00 0.26 -0.10 -1.50 0.02 0.00 0.00 175.26 173.94 1rh8 s ILE 4643N -2.16 3.14 -0.14 -1.63 -1.16 0.12 -0.39 121.20 118.98 1rh8 s ILE 4643Ca 0.17 -0.61 -0.10 0.00 -0.51 0.00 0.00 60.65 59.60 1rh8 s ILE 4643Cb -0.05 -2.35 -0.05 0.00 0.61 0.00 0.00 42.46 40.62 1rh8 s ILE 4643CO 0.07 0.50 0.19 -1.58 -2.81 0.00 0.00 174.94 171.31 1rh8 s GLN 4644N 0.69 3.89 0.20 3.50 0.74 0.34 0.10 119.66 129.12 1rh8 s GLN 4644Ca -0.05 -0.06 -0.10 0.00 0.05 0.00 0.00 55.36 55.20 1rh8 s GLN 4644Cb -0.15 -3.31 -0.01 0.00 1.10 0.00 0.00 33.01 30.64 1rh8 s GLN 4644CO 0.02 0.51 0.35 -0.51 -0.55 0.00 0.00 175.29 175.11 1rh8 s LEU 4645N -0.29 0.71 -0.20 3.68 1.02 -0.97 -1.63 118.68 120.99 1rh8 s LEU 4645Ca 0.14 -0.93 0.01 0.00 0.02 0.00 0.00 54.13 53.37 1rh8 s LEU 4645Cb -0.12 1.35 0.04 0.00 0.02 0.00 0.00 46.19 47.48 1rh8 s LEU 4645CO 0.03 -0.98 -0.12 -1.58 0.02 0.00 0.00 176.35 173.72 1rh8 s GLN 4646N -4.00 2.22 0.06 1.70 0.74 0.85 -2.24 119.66 118.99 1rh8 s GLN 4646Ca 0.21 -0.92 -0.06 0.00 0.05 0.00 0.00 55.36 54.65 1rh8 s GLN 4646Cb 0.02 -2.51 -0.05 0.00 1.10 0.00 0.00 33.01 31.57 1rh8 s GLN 4646CO 0.04 -0.41 0.31 0.42 -0.55 0.00 0.00 175.29 175.10 1rh8 s ILE 4647N 1.33 5.25 -0.30 -2.34 -1.09 -1.26 0.70 121.20 123.50 1rh8 s ILE 4647Ca -0.01 0.09 -0.13 0.00 -2.23 0.00 0.00 60.65 58.37 1rh8 s ILE 4647Cb -0.16 -3.60 0.15 0.00 -1.58 0.00 0.00 42.46 37.27 1rh8 s ILE 4647CO -0.08 0.24 0.87 0.21 -1.23 0.00 0.00 174.94 174.94 1rh8 s ASN 4648N -2.01 -0.78 -0.15 3.58 2.47 0.13 -1.87 114.94 116.31 1rh8 s ASN 4648Ca 0.33 1.04 -0.03 0.00 0.42 0.00 0.00 52.86 54.62 1rh8 s ASN 4648Cb -0.13 1.88 -0.03 0.00 -1.45 0.00 0.00 41.25 41.52 1rh8 s ASN 4648CO 0.20 -0.15 -0.05 -0.47 -3.72 0.00 0.00 177.10 172.91 1rh8 s TYR 4649N 2.62 3.00 0.01 0.43 6.14 -1.26 0.71 117.35 129.00 1rh8 s TYR 4649Ca -0.03 -0.31 -0.18 0.00 0.64 0.00 0.00 57.07 57.19 1rh8 s TYR 4649Cb -0.08 -1.93 0.03 0.00 0.42 0.00 0.00 41.96 40.40 1rh8 s TYR 4649CO -0.18 -0.03 0.39 0.34 0.64 0.00 0.00 175.55 176.71 1rh8 s ASP 4650N 0.27 -0.27 -1.51 4.32 -1.08 0.11 -4.91 116.67 113.61 1rh8 s ASP 4650Ca -0.04 0.09 -0.14 0.00 -0.52 0.00 0.00 52.55 51.94 1rh8 s ASP 4650Cb -0.14 0.38 0.11 0.00 -1.46 0.00 0.00 42.92 41.81 1rh8 s ASP 4650CO 0.03 -0.57 0.75 0.18 0.52 0.00 0.00 175.17 176.08 1rh8 n LEU 4651N 0.85 -1.92 -1.08 -1.34 4.77 -1.26 0.11 117.00 117.12 1rh8 n LEU 4651Ca -0.20 -0.71 -0.14 0.00 -0.03 0.00 0.00 56.01 54.93 1rh8 n LEU 4651Cb 0.58 -2.26 -0.06 0.00 -2.33 0.00 0.00 43.42 39.35 1rh8 n LEU 4651CO 0.21 0.30 -0.13 0.61 -1.33 0.00 0.00 177.39 177.05 1rh8 n GLY 4652N -1.41 1.45 3.17 -0.72 0.00 -1.26 -4.80 105.19 101.63 1rh8 n GLY 4652Ca 0.03 -0.28 -0.30 0.00 0.00 0.00 0.00 46.02 45.47 1rh8 n GLY 4652CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1rh8 s ASN 4653N -2.78 2.80 -0.32 1.61 0.01 0.29 -0.32 114.94 116.23 1rh8 s ASN 4653Ca 0.00 -0.50 -0.21 0.00 -0.71 0.00 0.00 52.86 51.43 1rh8 s ASN 4653Cb 0.00 -1.28 -0.00 0.00 0.41 0.00 0.00 41.25 40.38 1rh8 s ASN 4653CO 0.00 0.13 0.69 -0.22 -1.51 0.00 0.00 177.10 176.19 1rh8 s LEU 4654N 0.42 4.15 -0.16 0.60 2.96 -0.95 0.07 118.68 125.77 1rh8 s LEU 4654Ca -0.18 0.44 -0.04 0.00 -0.22 0.00 0.00 54.13 54.13 1rh8 s LEU 4654Cb -0.17 -2.90 -0.03 0.00 0.50 0.00 0.00 46.19 43.59 1rh8 s LEU 4654CO 0.08 -0.56 -0.02 -0.63 -1.32 0.00 0.00 176.35 173.90 1rh8 s ILE 4655N 2.76 4.09 -0.07 6.68 1.09 0.22 0.10 121.20 136.07 1rh8 s ILE 4655Ca 0.27 -0.29 0.01 0.00 -1.10 0.00 0.00 60.65 59.54 1rh8 s ILE 4655Cb -0.14 -2.80 0.02 0.00 -1.06 0.00 0.00 42.46 38.48 1rh8 s ILE 4655CO 0.13 0.49 -0.07 -0.63 -0.10 0.00 0.00 174.94 174.76 1rh8 s ILE 4656N 0.28 0.83 -0.18 2.92 1.09 0.12 0.20 121.20 126.46 1rh8 s ILE 4656Ca -0.02 -0.24 -0.06 0.00 -1.10 0.00 0.00 60.65 59.23 1rh8 s ILE 4656Cb -0.14 -0.83 -0.04 0.00 -1.06 0.00 0.00 42.46 40.40 1rh8 s ILE 4656CO 0.02 0.31 0.03 -1.00 -0.10 0.00 0.00 174.94 174.20 1rh8 s HIS 4657N 1.19 3.16 -0.17 3.97 3.76 0.22 -0.81 115.29 126.61 1rh8 s HIS 4657Ca -0.06 -0.08 -0.20 0.00 -0.15 0.00 0.00 55.06 54.57 1rh8 s HIS 4657Cb -0.14 -2.04 -0.03 0.00 1.11 0.00 0.00 32.58 31.47 1rh8 s HIS 4657CO -0.02 0.06 0.56 0.42 -0.85 0.00 0.00 174.74 174.92 1rh8 s ILE 4658N 0.43 5.09 0.00 0.60 -1.09 0.15 -0.11 121.20 126.27 1rh8 s ILE 4658Ca 0.01 1.07 0.00 0.00 -2.23 0.00 0.00 60.65 59.50 1rh8 s ILE 4658Cb -0.13 -3.89 0.00 0.00 -1.58 0.00 0.00 42.46 36.86 1rh8 s ILE 4658CO 0.01 0.19 0.00 0.18 -1.23 0.00 0.00 174.94 174.10 1rh8 n LEU 4659N 4.55 0.00 -3.78 2.97 4.77 -0.65 0.12 117.00 124.98 1rh8 n LEU 4659Ca -0.04 0.00 -0.04 0.00 -0.03 0.00 0.00 56.01 55.90 1rh8 n LEU 4659Cb 0.50 0.00 -0.01 0.00 -2.33 0.00 0.00 43.42 41.58 1rh8 n LEU 4659CO 0.43 0.00 0.68 0.00 -1.33 0.00 0.00 177.39 177.17 1rh8 s GLN 4660N 0.00 1.32 0.08 3.23 -2.07 -1.06 0.25 119.66 121.40 1rh8 s GLN 4660Ca 0.00 -0.73 0.08 0.00 -1.82 0.00 0.00 55.36 52.89 1rh8 s GLN 4660Cb 0.00 0.45 -0.03 0.00 -1.09 0.00 0.00 33.01 32.34 1rh8 s GLN 4660CO 0.00 -0.60 -0.22 0.00 -1.32 0.00 0.00 175.29 173.15 1rh8 s ALA 4661N -3.37 1.88 0.18 2.60 0.00 0.08 0.13 121.76 123.26 1rh8 s ALA 4661Ca 0.12 -1.19 0.06 0.00 0.00 0.00 0.00 51.96 50.95 1rh8 s ALA 4661Cb -0.02 -0.32 -0.05 0.00 0.00 0.00 0.00 23.12 22.73 1rh8 s ALA 4661CO 0.03 0.41 -0.13 -0.98 0.00 0.00 0.00 175.76 175.09 1rh8 s ARG 4662N -1.57 1.22 -1.80 0.00 1.70 0.47 -3.22 118.95 115.76 1rh8 s ARG 4662Ca 0.08 -1.54 0.00 0.00 -0.47 0.00 0.00 55.73 53.80 1rh8 s ARG 4662Cb -0.09 -0.91 0.00 0.00 -0.57 0.00 0.00 34.95 33.37 1rh8 s ARG 4662CO 0.03 0.14 0.00 0.09 -1.08 0.00 0.00 175.30 174.48 1rh8 n ASN 4663N -0.31 -5.50 -4.70 -2.89 4.13 -1.25 0.22 115.26 104.96 1rh8 n ASN 4663Ca -0.09 0.15 -0.30 0.00 1.68 0.00 0.00 54.58 56.02 1rh8 n ASN 4663Cb 0.60 -4.60 0.14 0.00 -1.54 0.00 0.00 39.78 34.39 1rh8 n ASN 4663CO 0.00 0.00 0.00 -0.76 0.28 0.00 0.00 177.26 176.78 1rh8 s LEU 4664N -5.20 2.33 -0.27 3.41 1.43 -1.09 -0.45 118.68 118.84 1rh8 s LEU 4664Ca 0.00 1.64 -0.29 0.00 -1.03 0.00 0.00 54.13 54.46 1rh8 s LEU 4664Cb 0.00 -4.06 -0.03 0.00 0.03 0.00 0.00 46.19 42.13 1rh8 s LEU 4664CO 0.00 -2.75 1.85 0.54 0.23 0.00 0.00 176.35 176.22 1rh8 s VAL 4665N -2.84 3.41 0.57 -1.59 0.11 -1.26 -4.80 120.40 114.00 1rh8 s VAL 4665Ca 0.64 0.44 -0.20 0.00 -2.93 0.00 0.00 61.98 59.92 1rh8 s VAL 4665Cb -0.19 -3.51 -0.04 0.00 -1.53 0.00 0.00 36.38 31.11 1rh8 s VAL 4665CO 0.58 -0.29 1.26 -2.84 -3.33 0.00 0.00 175.10 170.47 1rh8 s PRO 4666N 5.52 3.08 -0.01 1.54 0.02 -1.26 -4.87 135.00 139.02 1rh8 s PRO 4666Ca 0.82 1.98 -0.02 0.00 0.02 0.00 0.00 61.00 63.81 1rh8 s PRO 4666Cb -0.26 -2.09 0.00 0.00 0.02 0.00 0.00 34.50 32.17 1rh8 s PRO 4666CO 0.33 -1.16 0.04 0.50 -0.33 0.00 0.00 177.00 176.39 1rh8 s ARG 4667N -3.10 0.07 -0.08 5.54 3.52 -1.26 -5.05 118.95 118.59 1rh8 s ARG 4667Ca 0.74 0.02 0.03 0.00 -0.13 0.00 0.00 55.73 56.39 1rh8 s ARG 4667Cb -0.34 0.03 -0.01 0.00 -1.56 0.00 0.00 34.95 33.06 1rh8 s ARG 4667CO 0.39 -0.01 -0.19 -0.51 -0.81 0.00 0.00 175.30 174.17 1rh8 s ASP 4668N -0.08 3.59 0.07 -2.12 1.01 -1.26 -4.90 116.67 112.98 1rh8 s ASP 4668Ca -0.01 -0.38 0.00 0.00 0.71 0.00 0.00 52.55 52.87 1rh8 s ASP 4668Cb -0.01 -1.11 0.00 0.00 1.01 0.00 0.00 42.92 42.81 1rh8 s ASP 4668CO 0.00 0.24 0.00 -0.46 0.21 0.00 0.00 175.17 175.16 1rh8 n ASN 4669N 3.00 -0.61 0.00 0.27 0.23 -1.26 -5.04 115.26 111.85 1rh8 n ASN 4669Ca -0.18 0.45 0.00 0.00 -0.53 0.00 0.00 54.58 54.32 1rh8 n ASN 4669Cb 0.52 0.90 0.00 0.00 -2.08 0.00 0.00 39.78 39.12 1rh8 n ASN 4669CO 0.00 0.00 0.00 0.59 -0.93 0.00 0.00 177.26 176.92 1rh8 n ASN 4670N -2.86 0.00 0.00 0.53 4.13 -1.26 -5.14 115.26 110.66 1rh8 n ASN 4670Ca 0.00 0.00 0.00 0.00 1.68 0.00 0.00 54.58 56.26 1rh8 n ASN 4670Cb 0.00 0.01 0.00 0.00 -1.54 0.00 0.00 39.78 38.25 1rh8 n ASN 4670CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1rh8 n GLY 4671N -0.90 1.86 0.16 7.41 0.00 -1.26 -5.10 105.19 107.36 1rh8 n GLY 4671Ca 0.00 -1.03 0.00 0.00 0.00 0.00 0.00 46.02 44.99 1rh8 n GLY 4671CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 173.32 174.90 1rh8 n TYR 4672N 1.58 -0.20 -2.12 1.61 4.11 -1.26 -5.11 117.16 115.77 1rh8 n TYR 4672Ca 0.00 0.00 -0.42 0.00 -0.00 0.00 0.00 57.90 57.48 1rh8 n TYR 4672Cb 0.00 0.04 -0.03 0.00 -0.00 0.00 0.00 39.34 39.35 1rh8 n TYR 4672CO 0.00 0.00 0.00 -1.54 -0.00 0.00 0.00 176.86 175.32 1rh8 s SER 4673N -1.19 6.75 -0.26 9.48 1.04 -1.26 -5.00 113.70 123.27 1rh8 s SER 4673Ca 0.00 2.16 -0.11 0.00 0.48 0.00 0.00 55.95 58.48 1rh8 s SER 4673Cb 0.00 -2.55 -0.05 0.00 0.10 0.00 0.00 66.02 63.52 1rh8 s SER 4673CO 0.00 -0.83 0.21 -1.81 0.98 0.00 0.00 173.24 171.79 1rh8 s ASP 4674N 2.55 6.10 0.13 7.02 1.01 -1.26 -4.87 116.67 127.36 1rh8 s ASP 4674Ca 0.68 0.10 -0.31 0.00 0.71 0.00 0.00 52.55 53.72 1rh8 s ASP 4674Cb -0.32 -2.13 -0.08 0.00 1.01 0.00 0.00 42.92 41.39 1rh8 s ASP 4674CO 0.27 -0.02 1.43 -2.84 0.21 0.00 0.00 175.17 174.22 1rh8 s PRO 4675N 1.50 4.30 0.40 8.23 0.02 -1.26 -4.50 135.00 143.68 1rh8 s PRO 4675Ca 0.09 2.15 0.07 0.00 0.02 0.00 0.00 61.00 63.33 1rh8 s PRO 4675Cb -0.15 -3.22 -0.06 0.00 0.02 0.00 0.00 34.50 31.09 1rh8 s PRO 4675CO 0.08 -0.47 0.10 -0.59 -0.33 0.00 0.00 177.00 175.79 1rh8 s PHE 4676N 1.06 2.57 0.15 6.54 -0.71 0.71 -4.94 117.98 123.36 1rh8 s PHE 4676Ca 0.65 -0.59 0.08 0.00 -1.04 0.00 0.00 56.93 56.04 1rh8 s PHE 4676Cb -0.39 -1.82 -0.04 0.00 -1.21 0.00 0.00 43.02 39.56 1rh8 s PHE 4676CO 0.31 0.32 -0.18 0.08 -1.34 0.00 0.00 175.22 174.40 1rh8 s VAL 4677N -2.62 1.76 -0.08 -2.49 1.01 -1.26 -0.10 120.40 116.62 1rh8 s VAL 4677Ca 0.38 -1.85 -0.01 0.00 0.00 0.00 0.00 61.98 60.51 1rh8 s VAL 4677Cb 0.05 -1.78 0.03 0.00 0.00 0.00 0.00 36.38 34.68 1rh8 s VAL 4677CO 0.21 -0.29 -0.02 -0.54 0.00 0.00 0.00 175.10 174.46 1rh8 s LYS 4678N -2.65 0.80 -0.12 2.72 1.02 0.15 -1.48 119.74 120.18 1rh8 s LYS 4678Ca 0.14 0.02 0.01 0.00 0.02 0.00 0.00 55.97 56.16 1rh8 s LYS 4678Cb -0.06 -1.09 0.02 0.00 -0.52 0.00 0.00 37.83 36.18 1rh8 s LYS 4678CO 0.06 -0.28 -0.13 0.08 -0.92 0.00 0.00 175.35 174.15 1rh8 s VAL 4679N 1.86 1.41 0.05 3.17 1.01 0.88 -0.65 120.40 128.13 1rh8 s VAL 4679Ca 0.04 -0.57 -0.07 0.00 0.00 0.00 0.00 61.98 61.39 1rh8 s VAL 4679Cb -0.12 -1.32 -0.01 0.00 0.00 0.00 0.00 36.38 34.92 1rh8 s VAL 4679CO -0.06 0.43 0.12 -0.72 0.00 0.00 0.00 175.10 174.88 1rh8 s TYR 4680N 1.24 0.18 0.32 5.22 -0.85 -1.16 -1.74 117.35 120.56 1rh8 s TYR 4680Ca -0.02 -0.50 -0.22 0.00 -0.52 0.00 0.00 57.07 55.81 1rh8 s TYR 4680Cb -0.14 -0.12 -0.10 0.00 0.38 0.00 0.00 41.96 41.98 1rh8 s TYR 4680CO -0.05 -0.41 0.87 -0.51 -1.52 0.00 0.00 175.55 173.93 1rh8 s LEU 4681N -2.28 4.22 0.08 -3.49 2.01 -1.26 -2.10 118.68 115.86 1rh8 s LEU 4681Ca -0.03 1.65 -0.30 0.00 0.01 0.00 0.00 54.13 55.46 1rh8 s LEU 4681Cb 0.00 -4.04 -0.17 0.00 0.01 0.00 0.00 46.19 41.99 1rh8 s LEU 4681CO -0.06 -0.12 1.65 -0.07 1.01 0.00 0.00 176.35 178.76 1rh8 h LEU 4682N 2.85 -0.63 0.00 1.79 3.38 -1.68 -3.43 115.31 117.60 1rh8 h LEU 4682Ca -0.48 0.03 0.00 0.00 0.09 0.00 0.00 57.88 57.52 1rh8 h LEU 4682Cb 1.19 0.18 0.00 0.00 0.09 0.00 0.00 40.66 42.11 1rh8 h LEU 4682CO 0.64 -0.42 0.00 -0.81 0.09 0.00 0.00 178.44 177.94 1rh8 n PRO 4683N -5.39 1.27 0.00 1.13 -0.05 -1.26 -4.82 135.00 125.88 1rh8 n PRO 4683Ca -0.11 0.00 0.00 0.00 -0.05 0.00 0.00 63.50 63.34 1rh8 n PRO 4683Cb 0.29 0.00 0.00 0.00 -0.05 0.00 0.00 33.50 33.74 1rh8 n PRO 4683CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 175.50 175.86 1rh8 n GLY 4684N 5.00 0.07 0.31 0.55 0.00 -1.26 -3.91 105.19 105.95 1rh8 n GLY 4684Ca 0.00 -0.96 -0.15 0.00 0.00 0.00 0.00 46.02 44.91 1rh8 n GLY 4684CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 1rh8 h ARG 4685N 0.00 -0.60 0.00 1.61 -0.00 -1.93 -3.47 114.38 109.99 1rh8 h ARG 4685Ca 0.00 0.04 0.00 0.00 -0.50 0.00 0.00 59.98 59.52 1rh8 h ARG 4685Cb 0.00 0.14 0.00 0.00 0.00 0.00 0.00 29.97 30.11 1rh8 h ARG 4685CO 0.00 -0.40 0.00 0.41 0.00 0.00 0.00 179.97 179.98 1rh8 n GLY 4686N -1.40 1.54 3.82 0.04 0.00 -1.25 -5.11 105.19 102.82 1rh8 n GLY 4686Ca -0.10 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.57 1rh8 n GLY 4686CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 1rh8 s GLN 4687N -0.36 4.25 -0.27 1.61 0.00 -1.26 -5.02 119.66 118.60 1rh8 s GLN 4687Ca 0.00 0.92 -0.15 0.00 -0.00 0.00 0.00 55.36 56.14 1rh8 s GLN 4687Cb 0.00 -2.71 -0.04 0.00 0.00 0.00 0.00 33.01 30.27 1rh8 s GLN 4687CO 0.00 0.29 0.36 0.54 0.00 0.00 0.00 175.29 176.48 1rh8 s VAL 4688N -1.70 5.18 -0.45 3.63 0.11 -1.26 -4.51 120.40 121.40 1rh8 s VAL 4688Ca 0.48 0.53 -0.18 0.00 -2.93 0.00 0.00 61.98 59.88 1rh8 s VAL 4688Cb -0.15 -3.70 0.04 0.00 -1.53 0.00 0.00 36.38 31.04 1rh8 s VAL 4688CO 0.20 0.15 0.50 -0.32 -3.33 0.00 0.00 175.10 172.30 1rh8 s MET 4689N 2.05 3.10 0.53 1.54 1.75 -0.71 -4.91 119.30 122.66 1rh8 s MET 4689Ca 0.14 -0.82 -0.10 0.00 -1.25 0.00 0.00 55.69 53.66 1rh8 s MET 4689Cb -0.16 -4.02 -0.05 0.00 2.84 0.00 0.00 34.83 33.45 1rh8 s MET 4689CO 0.10 -0.98 0.92 0.08 -0.65 0.00 0.00 175.02 174.50 1rh8 s VAL 4690N 2.26 4.74 -0.01 10.11 1.01 -1.26 -0.08 120.40 137.17 1rh8 s VAL 4690Ca 0.13 0.73 -0.07 0.00 0.00 0.00 0.00 61.98 62.77 1rh8 s VAL 4690Cb -0.18 -3.82 -0.05 0.00 0.00 0.00 0.00 36.38 32.33 1rh8 s VAL 4690CO 0.13 -0.90 0.26 -0.69 0.00 0.00 0.00 175.10 173.90 1rh8 s VAL 4691N -2.85 5.31 0.64 2.92 1.01 -0.55 -4.93 120.40 121.96 1rh8 s VAL 4691Ca 0.53 0.23 -0.02 0.00 0.00 0.00 0.00 61.98 62.72 1rh8 s VAL 4691Cb -0.11 -3.55 0.06 0.00 0.00 0.00 0.00 36.38 32.79 1rh8 s VAL 4691CO 0.44 0.43 0.90 -1.10 0.00 0.00 0.00 175.10 175.77 1rh8 s GLN 4692N -1.58 2.23 0.12 2.72 -1.52 -1.26 -4.72 119.66 115.66 1rh8 s GLN 4692Ca 0.25 -0.68 -0.03 0.00 -1.95 0.00 0.00 55.36 52.96 1rh8 s GLN 4692Cb -0.13 -2.35 -0.05 0.00 -0.22 0.00 0.00 33.01 30.26 1rh8 s GLN 4692CO 0.14 -1.05 0.32 -0.80 -0.25 0.00 0.00 175.29 173.66 1rh8 s ASN 4693N -4.52 6.43 0.57 5.90 -0.87 -1.26 -4.84 114.94 116.35 1rh8 s ASN 4693Ca 0.60 0.46 0.02 0.00 -1.57 0.00 0.00 52.86 52.37 1rh8 s ASN 4693Cb -0.09 -2.04 0.09 0.00 -0.02 0.00 0.00 41.25 39.19 1rh8 s ASN 4693CO 0.42 0.08 0.65 0.00 -2.57 0.00 0.00 177.10 175.68 1rh8 n ALA 4694N 0.05 0.33 -1.49 0.60 0.00 -1.26 -4.93 120.51 113.81 1rh8 n ALA 4694Ca -0.04 -1.38 -0.42 0.00 0.00 0.00 0.00 53.44 51.61 1rh8 n ALA 4694Cb 0.52 0.27 -0.12 0.00 0.00 0.00 0.00 19.45 20.12 1rh8 n ALA 4694CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1rh8 n SER 4695N -2.83 0.89 0.16 0.00 2.88 -1.26 -4.74 113.62 108.72 1rh8 n SER 4695Ca 0.11 0.07 0.18 0.00 -1.33 0.00 0.00 58.87 57.91 1rh8 n SER 4695Cb 0.41 -1.09 0.79 0.00 -0.75 0.00 0.00 64.21 63.57 1rh8 n SER 4695CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1rh8 h ALA 4696N 13.54 1.93 -0.83 -1.46 0.00 -1.98 -0.80 119.26 129.66 1rh8 h ALA 4696Ca -0.11 -0.01 0.11 0.00 0.00 0.00 0.00 54.91 54.90 1rh8 h ALA 4696Cb 1.31 0.02 -0.06 0.00 0.00 0.00 0.00 17.79 19.06 1rh8 h ALA 4696CO 1.29 -0.45 0.54 1.49 0.00 0.00 0.00 179.25 182.12 1rh8 h GLU 4697N 0.00 0.70 0.00 0.00 4.81 -2.00 0.85 114.58 118.95 1rh8 h GLU 4697Ca 0.13 -0.04 -0.25 0.00 -0.13 0.00 0.00 59.36 59.07 1rh8 h GLU 4697Cb 0.75 -0.16 -0.04 0.00 0.63 0.00 0.00 28.75 29.93 1rh8 h GLU 4697CO -0.00 0.47 -1.71 2.48 -0.73 0.00 0.00 179.01 179.51 1rh8 n TYR 4698N -4.52 0.81 -0.03 0.92 0.18 -0.34 -4.13 117.16 110.05 1rh8 n TYR 4698Ca 0.15 0.28 -0.14 0.00 1.88 0.00 0.00 57.90 60.07 1rh8 n TYR 4698Cb 0.37 -1.10 -0.10 0.00 -0.38 0.00 0.00 39.34 38.13 1rh8 n TYR 4698CO 0.00 0.00 0.00 0.87 -2.08 0.00 0.00 176.86 175.65 1rh8 h LYS 4699N 0.00 0.07 -0.96 -3.48 1.79 -0.97 -2.08 116.57 110.94 1rh8 h LYS 4699Ca -0.27 -0.05 0.28 0.00 -2.18 0.00 0.00 60.65 58.43 1rh8 h LYS 4699Cb 1.86 0.01 -0.04 0.00 -1.58 0.00 0.00 32.23 32.48 1rh8 h LYS 4699CO 0.06 0.68 0.78 0.00 -1.08 0.00 0.00 179.45 179.89 1rh8 h ARG 4700N -0.54 0.00 0.06 3.15 3.08 0.52 0.91 114.38 121.57 1rh8 h ARG 4700Ca -0.00 0.00 -0.31 0.00 0.07 0.00 0.00 59.98 59.74 1rh8 h ARG 4700Cb 0.69 0.00 -0.03 0.00 0.08 0.00 0.00 29.97 30.71 1rh8 h ARG 4700CO 0.01 0.00 -1.70 0.00 -1.07 0.00 0.00 179.97 177.21 1rh8 h ARG 4701N 0.00 0.13 -0.65 0.04 3.08 -1.69 -3.32 114.38 111.96 1rh8 h ARG 4701Ca 0.46 -0.22 0.00 0.00 0.07 0.00 0.00 59.98 60.28 1rh8 h ARG 4701Cb 2.01 0.08 0.00 0.00 0.08 0.00 0.00 29.97 32.15 1rh8 h ARG 4701CO -0.00 0.86 0.00 -2.37 -1.07 0.00 0.00 179.97 177.39 1rh8 n THR 4702N -3.28 1.77 0.70 2.04 5.66 0.18 -4.15 114.28 117.21 1rh8 n THR 4702Ca -0.20 -0.99 0.06 0.00 -3.05 0.00 0.00 64.05 59.88 1rh8 n THR 4702Cb 1.04 -0.15 0.18 0.00 -1.55 0.00 0.00 70.33 69.85 1rh8 n THR 4702CO 0.00 0.00 0.00 2.29 -3.05 0.00 0.00 175.07 174.31 1rh8 n LYS 4703N 0.65 1.97 0.00 1.09 -0.00 0.26 -3.48 118.16 118.66 1rh8 n LYS 4703Ca 0.21 -1.44 0.00 0.00 -0.00 0.00 0.00 58.31 57.08 1rh8 n LYS 4703Cb 0.85 -1.34 0.00 0.00 -0.00 0.00 0.00 35.03 34.54 1rh8 n LYS 4703CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.40 178.06 1rh8 n TYR 4704N 0.64 0.00 -0.09 5.58 4.01 -1.26 -4.27 117.16 121.78 1rh8 n TYR 4704Ca 0.13 0.00 -0.15 0.00 -0.16 0.00 0.00 57.90 57.73 1rh8 n TYR 4704Cb 0.35 -0.36 -0.14 0.00 -0.31 0.00 0.00 39.34 38.88 1rh8 n TYR 4704CO 0.00 0.00 0.00 1.33 -0.46 0.00 0.00 176.86 177.73 1rh8 n VAL 4705N -1.68 1.51 1.25 -0.72 0.24 -1.26 -4.27 118.33 113.40 1rh8 n VAL 4705Ca 0.00 -0.71 0.11 0.00 -2.04 0.00 0.00 64.34 61.70 1rh8 n VAL 4705Cb 0.00 -1.10 0.61 0.00 -1.47 0.00 0.00 33.84 31.89 1rh8 n VAL 4705CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1rh8 n GLN 4706N -3.09 0.57 0.00 7.34 1.13 -1.23 -1.74 117.38 120.35 1rh8 n GLN 4706Ca -0.36 0.03 -0.18 0.00 -1.94 0.00 0.00 57.00 54.54 1rh8 n GLN 4706Cb 1.06 -1.50 -0.14 0.00 0.11 0.00 0.00 30.24 29.77 1rh8 n GLN 4706CO 0.00 0.00 0.00 -0.22 -1.44 0.00 0.00 177.06 175.40 1rh8 h LYS 4707N 0.00 0.18 0.00 -1.09 3.64 -1.74 -0.98 116.57 116.58 1rh8 h LYS 4707Ca 0.00 -0.31 -0.24 0.00 -1.27 0.00 0.00 60.65 58.83 1rh8 h LYS 4707Cb 0.06 0.11 -0.05 0.00 -0.41 0.00 0.00 32.23 31.95 1rh8 h LYS 4707CO 0.00 1.15 -2.14 -1.13 -2.27 0.00 0.00 179.45 175.05 1rh8 n SER 4708N -4.31 0.57 -0.08 4.20 3.41 -1.22 -4.47 113.62 111.72 1rh8 n SER 4708Ca -0.13 0.00 -0.13 0.00 -0.26 0.00 0.00 58.87 58.35 1rh8 n SER 4708Cb 0.69 1.18 -0.07 0.00 -0.26 0.00 0.00 64.21 65.75 1rh8 n SER 4708CO 0.00 0.00 0.00 -0.07 -0.16 0.00 0.00 175.04 174.81 1rh8 h LEU 4709N 0.00 0.00 -6.64 1.04 3.38 -1.55 -3.40 115.31 108.13 1rh8 h LEU 4709Ca -0.36 -0.37 -0.51 0.00 0.09 0.00 0.00 57.88 56.72 1rh8 h LEU 4709Cb 1.80 0.00 -0.38 0.00 0.09 0.00 0.00 40.66 42.17 1rh8 h LEU 4709CO 0.02 1.08 -0.78 0.20 0.09 0.00 0.00 178.44 179.04 1rh8 s ASN 4710N -6.27 2.91 0.25 -0.43 0.01 -1.22 -2.68 114.94 107.53 1rh8 s ASN 4710Ca -0.20 -1.59 -0.21 0.00 -0.71 0.00 0.00 52.86 50.15 1rh8 s ASN 4710Cb 0.03 -0.19 -0.09 0.00 0.41 0.00 0.00 41.25 41.41 1rh8 s ASN 4710CO 0.43 -0.37 0.79 -2.16 -1.51 0.00 0.00 177.10 174.27 1rh8 s PRO 4711N 1.69 4.34 0.40 -0.60 0.04 -0.37 -4.34 135.00 136.16 1rh8 s PRO 4711Ca 0.13 0.99 0.07 0.00 0.04 0.00 0.00 61.00 62.24 1rh8 s PRO 4711Cb -0.18 -2.84 -0.07 0.00 0.04 0.00 0.00 34.50 31.45 1rh8 s PRO 4711CO -0.19 0.35 0.07 -1.83 0.04 0.00 0.00 177.00 175.43 1rh8 s GLU 4712N -2.04 2.06 0.00 4.56 1.03 -1.26 -0.74 118.70 122.31 1rh8 s GLU 4712Ca 0.45 -1.99 0.00 0.00 0.03 0.00 0.00 54.97 53.47 1rh8 s GLU 4712Cb -0.17 -1.78 0.00 0.00 -0.80 0.00 0.00 34.13 31.38 1rh8 s GLU 4712CO 0.22 -0.06 0.00 0.91 -1.33 0.00 0.00 175.26 175.00 1rh8 n TRP 4713N -1.06 -0.41 -3.92 4.83 8.01 0.68 -4.90 117.44 120.67 1rh8 n TRP 4713Ca -0.04 0.00 -0.25 0.00 -1.31 0.00 0.00 57.50 55.90 1rh8 n TRP 4713Cb 0.66 0.24 -0.01 0.00 -2.01 0.00 0.00 31.31 30.19 1rh8 n TRP 4713CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 177.69 176.77 1rh8 n ASN 4714N -1.99 -0.60 -4.86 -0.99 3.02 0.33 -4.28 115.26 105.89 1rh8 n ASN 4714Ca 0.00 -0.97 -0.23 0.00 -0.03 0.00 0.00 54.58 53.34 1rh8 n ASN 4714Cb 0.00 -3.21 -0.03 0.00 -0.61 0.00 0.00 39.78 35.93 1rh8 n ASN 4714CO 0.00 0.00 0.00 -1.10 -2.62 0.00 0.00 177.26 173.54 1rh8 s GLN 4715N -6.48 2.38 -0.07 3.52 -1.52 0.32 -4.89 119.66 112.93 1rh8 s GLN 4715Ca 0.04 -1.74 -0.04 0.00 -1.95 0.00 0.00 55.36 51.67 1rh8 s GLN 4715Cb -0.02 -2.22 0.03 0.00 -0.22 0.00 0.00 33.01 30.58 1rh8 s GLN 4715CO 0.88 -0.31 0.16 0.99 -0.25 0.00 0.00 175.29 176.75 1rh8 s THR 4716N -2.59 -0.03 0.06 -0.19 2.01 -1.26 0.29 115.64 113.94 1rh8 s THR 4716Ca 0.43 0.10 0.00 0.00 0.31 0.00 0.00 61.69 62.54 1rh8 s THR 4716Cb -0.01 -0.25 -0.04 0.00 0.01 0.00 0.00 72.50 72.21 1rh8 s THR 4716CO 0.25 0.04 -0.05 -0.69 -0.69 0.00 0.00 174.62 173.49 1rh8 s VAL 4717N 0.74 0.41 0.07 3.82 1.01 0.01 -4.98 120.40 121.48 1rh8 s VAL 4717Ca -0.05 -1.70 0.02 0.00 0.00 0.00 0.00 61.98 60.24 1rh8 s VAL 4717Cb -0.07 -1.38 -0.03 0.00 0.00 0.00 0.00 36.38 34.90 1rh8 s VAL 4717CO -0.04 -0.85 -0.07 -0.63 0.00 0.00 0.00 175.10 173.51 1rh8 s ILE 4718N -3.35 0.58 -0.62 2.22 1.09 -1.26 0.15 121.20 120.03 1rh8 s ILE 4718Ca 0.05 -1.48 0.05 0.00 -1.10 0.00 0.00 60.65 58.17 1rh8 s ILE 4718Cb 0.04 -1.10 0.18 0.00 -1.06 0.00 0.00 42.46 40.51 1rh8 s ILE 4718CO -0.06 -0.62 0.49 -1.22 -0.10 0.00 0.00 174.94 173.42 1rh8 n TYR 4719N 0.76 2.11 -1.93 3.97 4.01 0.29 -4.92 117.16 121.44 1rh8 n TYR 4719Ca -0.18 -4.02 -0.35 0.00 -0.16 0.00 0.00 57.90 53.19 1rh8 n TYR 4719Cb 0.58 -0.39 0.04 0.00 -0.31 0.00 0.00 39.34 39.26 1rh8 n TYR 4719CO 0.00 0.00 0.00 0.15 -0.46 0.00 0.00 176.86 176.55 1rh8 s LYS 4720N -1.19 2.90 0.00 -0.72 1.02 -1.26 -2.25 119.74 118.24 1rh8 s LYS 4720Ca 0.29 1.70 0.00 0.00 0.02 0.00 0.00 55.97 57.98 1rh8 s LYS 4720Cb 0.01 -1.93 0.00 0.00 -0.52 0.00 0.00 37.83 35.38 1rh8 s LYS 4720CO -0.16 -1.23 0.00 0.45 -0.92 0.00 0.00 175.35 173.49 1rh8 n SER 4721N -1.84 -0.85 -3.75 2.83 2.88 -1.13 -4.95 113.62 106.82 1rh8 n SER 4721Ca 0.13 0.00 -0.26 0.00 -1.33 0.00 0.00 58.87 57.41 1rh8 n SER 4721Cb 0.50 -0.39 -0.17 0.00 -0.75 0.00 0.00 64.21 63.40 1rh8 n SER 4721CO 0.00 0.00 0.00 -0.63 -1.23 0.00 0.00 175.04 173.18 1rh8 s ILE 4722N -2.07 0.46 0.22 2.46 1.01 0.56 -5.05 121.20 118.79 1rh8 s ILE 4722Ca 0.00 -0.30 0.07 0.00 0.00 0.00 0.00 60.65 60.42 1rh8 s ILE 4722Cb 0.00 -0.84 -0.04 0.00 0.01 0.00 0.00 42.46 41.59 1rh8 s ILE 4722CO 0.00 -0.04 0.14 -0.44 0.00 0.00 0.00 174.94 174.60 1rh8 s SER 4723N 1.91 5.32 0.59 3.58 0.01 -1.26 -3.69 113.70 120.16 1rh8 s SER 4723Ca 0.01 -0.28 0.32 0.00 1.31 0.00 0.00 55.95 57.31 1rh8 s SER 4723Cb -0.15 -1.30 1.27 0.00 0.21 0.00 0.00 66.02 66.04 1rh8 s SER 4723CO -0.07 0.01 1.57 -0.03 0.41 0.00 0.00 173.24 175.13 1rh8 h MET 4724N 1.90 0.00 0.10 12.44 4.05 -1.94 1.25 114.93 132.73 1rh8 h MET 4724Ca -0.48 0.00 0.02 0.00 -0.28 0.00 0.00 59.70 58.96 1rh8 h MET 4724Cb 1.23 0.00 -0.03 0.00 -0.80 0.00 0.00 31.60 32.00 1rh8 h MET 4724CO 0.61 0.00 -0.20 1.05 0.23 0.00 0.00 176.91 178.60 1rh8 h GLU 4725N 0.00 -0.36 0.00 0.39 4.11 -2.00 -1.35 114.58 115.38 1rh8 h GLU 4725Ca 0.47 0.02 -0.34 0.00 0.07 0.00 0.00 59.36 59.59 1rh8 h GLU 4725Cb 2.44 0.08 -0.06 0.00 0.50 0.00 0.00 28.75 31.71 1rh8 h GLU 4725CO -0.00 -0.24 -2.14 1.04 0.07 0.00 0.00 179.01 177.73 1rh8 n GLN 4726N -5.32 0.67 -0.06 1.06 6.02 0.33 -4.35 117.38 115.72 1rh8 n GLN 4726Ca -0.07 0.11 -0.08 0.00 -0.01 0.00 0.00 57.00 56.96 1rh8 n GLN 4726Cb 0.24 -1.62 -0.02 0.00 1.02 0.00 0.00 30.24 29.86 1rh8 n GLN 4726CO 0.00 0.00 0.00 1.25 -1.01 0.00 0.00 177.06 177.30 1rh8 h LEU 4727N 0.00 -0.21 -1.08 1.08 5.85 0.14 -1.55 115.31 119.54 1rh8 h LEU 4727Ca -0.45 0.07 0.13 0.00 0.84 0.00 0.00 57.88 58.47 1rh8 h LEU 4727Cb 2.15 0.15 -0.08 0.00 0.37 0.00 0.00 40.66 43.25 1rh8 h LEU 4727CO 0.04 -0.07 0.62 0.24 -0.34 0.00 0.00 178.44 178.93 1rh8 h MET 4728N 0.01 0.88 0.00 1.25 2.86 -1.43 0.10 114.93 118.60 1rh8 h MET 4728Ca 0.12 -0.05 0.00 0.00 -2.06 0.00 0.00 59.70 57.70 1rh8 h MET 4728Cb 0.18 -0.20 0.00 0.00 0.06 0.00 0.00 31.60 31.64 1rh8 h MET 4728CO -0.25 0.58 0.00 1.57 1.06 0.00 0.00 176.91 179.88 1rh8 h LYS 4729N 0.91 0.00 -6.16 1.72 2.10 -1.55 -1.48 116.57 112.10 1rh8 h LYS 4729Ca 0.49 0.00 -0.59 0.00 -2.00 0.00 0.00 60.65 58.55 1rh8 h LYS 4729Cb 0.56 0.00 -0.05 0.00 -0.90 0.00 0.00 32.23 31.85 1rh8 h LYS 4729CO -0.25 0.00 -0.11 0.15 -2.00 0.00 0.00 179.45 177.24 1rh8 s LYS 4730N -3.27 4.06 -0.14 0.07 -0.14 0.35 -4.79 119.74 115.89 1rh8 s LYS 4730Ca 0.07 0.58 -0.01 0.00 -1.36 0.00 0.00 55.97 55.24 1rh8 s LYS 4730Cb 0.09 -3.19 -0.02 0.00 -1.68 0.00 0.00 37.83 33.04 1rh8 s LYS 4730CO 0.57 0.64 -0.11 0.99 -0.76 0.00 0.00 175.35 176.68 1rh8 s THR 4731N -1.15 3.25 -0.46 2.17 2.01 -1.26 -2.65 115.64 117.55 1rh8 s THR 4731Ca 0.28 -0.59 -0.29 0.00 0.31 0.00 0.00 61.69 61.40 1rh8 s THR 4731Cb -0.18 -2.38 0.03 0.00 0.01 0.00 0.00 72.50 69.98 1rh8 s THR 4731CO 0.17 0.52 1.15 -0.22 -0.69 0.00 0.00 174.62 175.55 1rh8 s LEU 4732N 0.37 3.66 -0.42 4.42 2.96 0.12 -1.73 118.68 128.07 1rh8 s LEU 4732Ca -0.09 0.54 -0.12 0.00 -0.22 0.00 0.00 54.13 54.24 1rh8 s LEU 4732Cb -0.15 -3.55 0.05 0.00 0.50 0.00 0.00 46.19 43.04 1rh8 s LEU 4732CO 0.05 -1.24 0.28 -0.70 -1.32 0.00 0.00 176.35 173.42 1rh8 s GLU 4733N 4.42 2.81 -0.20 1.98 2.12 -0.89 0.36 118.70 129.30 1rh8 s GLU 4733Ca 0.49 -1.25 -0.17 0.00 0.36 0.00 0.00 54.97 54.39 1rh8 s GLU 4733Cb -0.08 -3.87 -0.04 0.00 0.26 0.00 0.00 34.13 30.41 1rh8 s GLU 4733CO 0.31 -0.86 0.47 0.08 -0.54 0.00 0.00 175.26 174.72 1rh8 s VAL 4734N 1.55 5.14 -0.08 3.70 1.01 0.20 -2.99 120.40 128.93 1rh8 s VAL 4734Ca 0.03 0.86 0.01 0.00 0.00 0.00 0.00 61.98 62.88 1rh8 s VAL 4734Cb -0.22 -3.80 0.02 0.00 0.00 0.00 0.00 36.38 32.38 1rh8 s VAL 4734CO 0.06 0.21 -0.11 0.42 0.00 0.00 0.00 175.10 175.68 1rh8 s THR 4735N 1.47 1.12 -0.04 3.92 -4.23 0.17 0.11 115.64 118.17 1rh8 s THR 4735Ca 0.22 -0.43 -0.11 0.00 -1.18 0.00 0.00 61.69 60.19 1rh8 s THR 4735Cb -0.15 -1.06 -0.05 0.00 1.34 0.00 0.00 72.50 72.58 1rh8 s THR 4735CO 0.09 0.36 0.30 -0.69 -0.54 0.00 0.00 174.62 174.15 1rh8 s VAL 4736N 1.02 5.22 0.01 2.29 1.01 0.31 0.34 120.40 130.59 1rh8 s VAL 4736Ca -0.08 0.55 -0.00 0.00 0.00 0.00 0.00 61.98 62.45 1rh8 s VAL 4736Cb -0.15 -3.59 -0.01 0.00 0.00 0.00 0.00 36.38 32.64 1rh8 s VAL 4736CO -0.01 0.56 -0.01 0.26 0.00 0.00 0.00 175.10 175.91 1rh8 s TRP 4737N -1.09 0.09 -0.03 5.22 0.52 0.86 -0.53 118.94 123.98 1rh8 s TRP 4737Ca 0.21 -0.19 0.06 0.00 0.02 0.00 0.00 56.10 56.21 1rh8 s TRP 4737Cb -0.15 -0.07 -0.01 0.00 -1.15 0.00 0.00 33.47 32.09 1rh8 s TRP 4737CO 0.10 -0.07 -0.22 0.34 0.02 0.00 0.00 176.95 177.12 1rh8 s ASP 4738N -0.53 2.66 -0.14 2.95 2.15 0.28 -0.21 116.67 123.83 1rh8 s ASP 4738Ca -0.06 -0.42 -0.29 0.00 0.43 0.00 0.00 52.55 52.21 1rh8 s ASP 4738Cb -0.04 -0.49 -0.03 0.00 -0.30 0.00 0.00 42.92 42.06 1rh8 s ASP 4738CO -0.00 0.25 1.50 -0.31 -0.17 0.00 0.00 175.17 176.43 1rh8 s TYR 4739N -0.33 2.33 0.83 -5.34 2.02 -1.26 0.11 117.35 115.71 1rh8 s TYR 4739Ca 0.03 0.58 -0.14 0.00 -0.37 0.00 0.00 57.07 57.17 1rh8 s TYR 4739Cb -0.10 -3.79 0.21 0.00 -0.40 0.00 0.00 41.96 37.87 1rh8 s TYR 4739CO 0.01 -2.82 0.67 -0.40 -1.57 0.00 0.00 175.55 171.44 1rh8 n ASP 4740N 7.28 -2.11 0.15 2.29 5.68 -1.07 -4.77 116.55 124.00 1rh8 n ASP 4740Ca 0.16 -0.85 0.09 0.00 -0.50 0.00 0.00 54.79 53.69 1rh8 n ASP 4740Cb 0.44 -0.65 0.06 0.00 -1.14 0.00 0.00 41.12 39.83 1rh8 n ASP 4740CO 0.00 0.00 0.00 0.03 -1.33 0.00 0.00 177.20 175.90 1rh8 h ARG 4741N 0.00 0.00 0.34 0.11 3.08 -1.95 -3.37 114.38 112.60 1rh8 h ARG 4741Ca -0.26 0.00 -0.02 0.00 0.07 0.00 0.00 59.98 59.77 1rh8 h ARG 4741Cb 0.82 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.88 1rh8 h ARG 4741CO 0.17 0.13 -0.17 0.74 -1.07 0.00 0.00 179.97 179.78 1rh8 h PHE 4742N 0.00 -0.43 0.00 3.04 -1.00 -2.02 -3.49 116.94 113.04 1rh8 h PHE 4742Ca -0.02 -0.01 0.00 0.00 2.81 0.00 0.00 57.97 60.75 1rh8 h PHE 4742Cb 1.15 0.14 0.00 0.00 3.61 0.00 0.00 35.95 40.85 1rh8 h PHE 4742CO 0.00 -0.27 0.00 -1.13 -1.61 0.00 0.00 178.31 175.30 1rh8 n SER 4743N -4.24 0.00 -3.10 2.17 3.41 -1.26 -5.15 113.62 105.44 1rh8 n SER 4743Ca -0.06 0.00 -0.14 0.00 -0.26 0.00 0.00 58.87 58.41 1rh8 n SER 4743Cb 0.18 0.00 0.14 0.00 -0.26 0.00 0.00 64.21 64.27 1rh8 n SER 4743CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 1rh8 n SER 4744N 0.00 -3.04 -4.80 4.04 7.64 -1.26 -4.68 113.62 111.52 1rh8 n SER 4744Ca 0.00 -0.41 -0.29 0.00 1.01 0.00 0.00 58.87 59.18 1rh8 n SER 4744Cb 0.00 -0.47 -0.06 0.00 -1.01 0.00 0.00 64.21 62.67 1rh8 n SER 4744CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 1rh8 s ASN 4745N -2.51 5.62 0.13 6.43 4.22 -1.26 -2.58 114.94 124.99 1rh8 s ASN 4745Ca 0.32 -0.01 0.11 0.00 -2.14 0.00 0.00 52.86 51.13 1rh8 s ASN 4745Cb -0.06 -1.53 -0.04 0.00 1.28 0.00 0.00 41.25 40.91 1rh8 s ASN 4745CO 0.26 0.14 -0.25 -1.81 -2.04 0.00 0.00 177.10 173.40 1rh8 s ASP 4746N -2.64 3.46 0.67 3.54 1.01 0.31 -4.80 116.67 118.22 1rh8 s ASP 4746Ca 0.30 -0.71 -0.12 0.00 0.71 0.00 0.00 52.55 52.73 1rh8 s ASP 4746Cb -0.12 -0.30 -0.00 0.00 1.01 0.00 0.00 42.92 43.52 1rh8 s ASP 4746CO 0.23 0.18 1.06 0.12 0.21 0.00 0.00 175.17 176.97 1rh8 s PHE 4747N -1.10 3.02 0.00 4.23 5.36 -1.26 0.10 117.98 128.33 1rh8 s PHE 4747Ca 0.15 1.46 0.00 0.00 -0.96 0.00 0.00 56.93 57.58 1rh8 s PHE 4747Cb -0.10 -2.94 0.00 0.00 -0.34 0.00 0.00 43.02 39.64 1rh8 s PHE 4747CO 0.07 -1.25 0.00 -0.11 -1.46 0.00 0.00 175.22 172.47 1rh8 n LEU 4748N -2.82 0.00 -3.61 6.12 0.00 0.31 -4.53 117.00 112.48 1rh8 n LEU 4748Ca 0.08 0.00 -0.06 0.00 0.00 0.00 0.00 56.01 56.03 1rh8 n LEU 4748Cb 0.53 0.00 -0.04 0.00 0.00 0.00 0.00 43.42 43.91 1rh8 n LEU 4748CO 0.53 0.00 0.97 -0.83 0.00 0.00 0.00 177.39 178.05 1rh8 s GLY 4749N -1.68 -0.11 -0.05 -3.96 0.00 -1.01 -4.21 107.32 96.29 1rh8 s GLY 4749Ca 0.00 2.34 -0.02 0.00 0.00 0.00 0.00 44.72 47.05 1rh8 s GLY 4749CO 0.00 1.02 0.10 1.85 0.00 0.00 0.00 173.10 176.07 1rh8 s GLU 4750N -1.20 0.03 -0.02 2.90 2.12 -0.41 0.11 118.70 122.23 1rh8 s GLU 4750Ca 0.04 0.33 0.03 0.00 0.36 0.00 0.00 54.97 55.73 1rh8 s GLU 4750Cb -0.01 -0.23 -0.00 0.00 0.26 0.00 0.00 34.13 34.15 1rh8 s GLU 4750CO -0.03 -0.19 -0.12 0.08 -0.54 0.00 0.00 175.26 174.46 1rh8 s VAL 4751N 1.30 0.98 -0.26 3.70 1.01 0.30 0.98 120.40 128.40 1rh8 s VAL 4751Ca -0.07 -0.48 -0.02 0.00 0.00 0.00 0.00 61.98 61.40 1rh8 s VAL 4751Cb -0.12 -0.85 0.03 0.00 0.00 0.00 0.00 36.38 35.44 1rh8 s VAL 4751CO -0.05 0.29 -0.03 -0.76 0.00 0.00 0.00 175.10 174.55 1rh8 s LEU 4752N 0.03 3.39 -0.41 3.92 1.43 -1.26 0.62 118.68 126.40 1rh8 s LEU 4752Ca -0.01 -0.93 -0.07 0.00 -1.03 0.00 0.00 54.13 52.09 1rh8 s LEU 4752Cb -0.08 -1.70 0.09 0.00 0.03 0.00 0.00 46.19 44.53 1rh8 s LEU 4752CO 0.01 -0.16 0.23 -0.63 0.23 0.00 0.00 176.35 176.02 1rh8 s ILE 4753N 1.33 3.82 -0.05 -0.59 1.09 0.16 -4.95 121.20 122.00 1rh8 s ILE 4753Ca -0.01 -1.64 -0.30 0.00 -1.10 0.00 0.00 60.65 57.61 1rh8 s ILE 4753Cb -0.17 -3.42 -0.07 0.00 -1.06 0.00 0.00 42.46 37.74 1rh8 s ILE 4753CO -0.03 -0.55 1.84 -1.81 -0.10 0.00 0.00 174.94 174.29 1rh8 s ASP 4754N 2.02 6.43 0.28 3.58 1.11 -1.26 -0.70 116.67 128.12 1rh8 s ASP 4754Ca 0.04 2.32 0.25 0.00 0.18 0.00 0.00 52.55 55.34 1rh8 s ASP 4754Cb -0.23 -2.53 0.94 0.00 1.07 0.00 0.00 42.92 42.17 1rh8 s ASP 4754CO -0.00 -1.12 1.75 -0.07 1.18 0.00 0.00 175.17 176.91 1rh8 h LEU 4755N 11.02 0.00 -2.62 1.23 3.38 -1.69 -2.50 115.31 124.14 1rh8 h LEU 4755Ca -0.43 0.00 0.01 0.00 0.09 0.00 0.00 57.88 57.55 1rh8 h LEU 4755Cb 1.21 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.96 1rh8 h LEU 4755CO 0.95 0.00 0.06 -1.28 0.09 0.00 0.00 178.44 178.26 1rh8 h SER 4756N 0.00 0.00 0.00 -0.43 0.87 -1.47 -2.97 113.55 109.55 1rh8 h SER 4756Ca 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.56 1rh8 h SER 4756Cb 0.51 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.47 1rh8 h SER 4756CO 0.00 0.00 -0.22 -1.20 -0.53 0.00 0.00 176.83 174.88 1rh8 n SER 4757N -3.43 0.00 -4.53 6.23 7.64 -1.16 -4.96 113.62 113.40 1rh8 n SER 4757Ca -0.02 -1.45 -0.25 0.00 1.01 0.00 0.00 58.87 58.16 1rh8 n SER 4757Cb 0.14 -0.09 -0.12 0.00 -1.01 0.00 0.00 64.21 63.13 1rh8 n SER 4757CO 0.00 0.00 0.00 1.07 -3.01 0.00 0.00 175.04 173.10 1rh8 n THR 4758N 0.00 -0.02 0.36 0.44 5.66 -0.95 -4.71 114.28 115.06 1rh8 n THR 4758Ca 0.00 -0.47 0.14 0.00 -3.05 0.00 0.00 64.05 60.66 1rh8 n THR 4758Cb 0.59 -1.31 0.40 0.00 -1.55 0.00 0.00 70.33 68.47 1rh8 n THR 4758CO 0.00 0.00 0.00 0.77 -3.05 0.00 0.00 175.07 172.79 1rh8 h SER 4759N 13.42 0.00 0.27 1.09 4.64 -1.92 -3.03 113.55 128.03 1rh8 h SER 4759Ca -0.04 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.28 1rh8 h SER 4759Cb 1.14 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.23 1rh8 h SER 4759CO 1.29 0.00 0.00 1.41 -0.87 0.00 0.00 176.83 178.66 1rh8 n HIS 4760N -2.77 0.00 -0.34 4.77 8.25 -1.26 -3.69 115.22 120.18 1rh8 n HIS 4760Ca 0.03 0.00 0.22 0.00 -0.26 0.00 0.00 57.72 57.71 1rh8 n HIS 4760Cb 0.41 -0.22 0.45 0.00 1.12 0.00 0.00 29.99 31.75 1rh8 n HIS 4760CO 0.00 0.00 0.00 -0.07 0.64 0.00 0.00 176.34 176.91 1rh8 h LEU 4761N 0.00 0.57 -4.11 2.41 3.38 -1.64 -2.29 115.31 113.62 1rh8 h LEU 4761Ca 0.00 0.16 -0.05 0.00 0.09 0.00 0.00 57.88 58.08 1rh8 h LEU 4761Cb 0.14 0.09 -0.02 0.00 0.09 0.00 0.00 40.66 40.96 1rh8 h LEU 4761CO 0.00 -0.03 0.05 0.47 0.09 0.00 0.00 178.44 179.03 1rh8 n ASP 4762N -4.94 2.39 -3.47 -0.43 8.00 -1.24 -3.53 116.55 113.33 1rh8 n ASP 4762Ca 0.30 -1.81 -0.37 0.00 0.71 0.00 0.00 54.79 53.61 1rh8 n ASP 4762Cb 0.90 -0.58 0.04 0.00 -0.02 0.00 0.00 41.12 41.45 1rh8 n ASP 4762CO 0.00 0.00 0.00 -3.20 -0.39 0.00 0.00 177.20 173.61 1rh8 n ASN 4763N 2.33 -5.65 -3.63 -2.24 5.15 -0.78 -4.99 115.26 105.44 1rh8 n ASN 4763Ca 0.11 -0.11 -0.27 0.00 -0.60 0.00 0.00 54.58 53.71 1rh8 n ASN 4763Cb 0.33 -1.87 -0.16 0.00 -0.53 0.00 0.00 39.78 37.54 1rh8 n ASN 4763CO 0.00 0.00 0.00 0.42 1.40 0.00 0.00 177.26 179.08 1rh8 s THR 4764N -1.53 0.11 -0.35 -0.44 -4.23 -1.11 -4.98 115.64 103.11 1rh8 s THR 4764Ca 0.38 -0.43 -0.28 0.00 -1.18 0.00 0.00 61.69 60.17 1rh8 s THR 4764Cb -0.04 -0.81 -0.01 0.00 1.34 0.00 0.00 72.50 72.97 1rh8 s THR 4764CO 0.87 -0.37 1.74 -2.16 -0.54 0.00 0.00 174.62 174.17 1rh8 s PRO 4765N 2.04 3.36 0.17 3.99 0.04 -1.26 -4.43 135.00 138.91 1rh8 s PRO 4765Ca 0.03 1.35 0.07 0.00 0.04 0.00 0.00 61.00 62.49 1rh8 s PRO 4765Cb -0.16 -4.18 -0.04 0.00 0.04 0.00 0.00 34.50 30.16 1rh8 s PRO 4765CO -0.15 -1.83 -0.15 1.03 0.04 0.00 0.00 177.00 175.95 1rh8 s ARG 4766N 5.58 1.23 -0.18 4.56 1.81 -0.95 -4.93 118.95 126.07 1rh8 s ARG 4766Ca 0.77 -1.47 -0.25 0.00 -1.72 0.00 0.00 55.73 53.07 1rh8 s ARG 4766Cb -0.21 -1.09 -0.01 0.00 -0.45 0.00 0.00 34.95 33.18 1rh8 s ARG 4766CO 0.33 0.19 0.81 -1.58 -0.68 0.00 0.00 175.30 174.38 1rh8 s TRP 4767N -2.61 3.41 -0.34 -0.53 0.52 -1.26 -2.30 118.94 115.82 1rh8 s TRP 4767Ca 0.18 1.21 -0.09 0.00 0.02 0.00 0.00 56.10 57.42 1rh8 s TRP 4767Cb -0.03 -2.99 0.02 0.00 -1.15 0.00 0.00 33.47 29.32 1rh8 s TRP 4767CO 0.06 -0.25 0.15 0.71 0.02 0.00 0.00 176.95 177.64 1rh8 s TYR 4768N 2.18 3.22 0.23 -1.98 1.51 0.29 -4.90 117.35 117.89 1rh8 s TYR 4768Ca 0.37 -1.04 -0.31 0.00 -1.01 0.00 0.00 57.07 55.08 1rh8 s TYR 4768Cb -0.16 -2.35 -0.14 0.00 -0.11 0.00 0.00 41.96 39.19 1rh8 s TYR 4768CO 0.12 -0.63 1.27 -2.30 -1.11 0.00 0.00 175.55 172.89 1rh8 n PRO 4769N 4.92 1.64 -3.47 -1.71 -0.02 -1.26 0.15 135.00 135.25 1rh8 n PRO 4769Ca -0.13 0.58 -0.35 0.00 -2.02 0.00 0.00 63.50 61.59 1rh8 n PRO 4769Cb 0.46 -2.14 -0.06 0.00 -0.02 0.00 0.00 33.50 31.74 1rh8 n PRO 4769CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 1rh8 s LEU 4770N 0.29 4.33 0.26 2.45 1.43 -0.96 -4.51 118.68 121.96 1rh8 s LEU 4770Ca 0.68 0.93 0.06 0.00 -1.03 0.00 0.00 54.13 54.77 1rh8 s LEU 4770Cb -0.73 -3.17 -0.05 0.00 0.03 0.00 0.00 46.19 42.27 1rh8 s LEU 4770CO 0.52 0.12 -0.07 -1.59 0.23 0.00 0.00 176.35 175.57 1rh8 s LYS 4771N -2.01 1.47 0.33 1.70 -2.85 0.28 -4.77 119.74 113.90 1rh8 s LYS 4771Ca 0.36 -1.73 -0.26 0.00 -1.00 0.00 0.00 55.97 53.34 1rh8 s LYS 4771Cb -0.14 -1.07 -0.09 0.00 -2.06 0.00 0.00 37.83 34.47 1rh8 s LYS 4771CO 0.19 0.05 1.00 -1.21 0.10 0.00 0.00 175.35 175.48 1rh8 s GLU 4772N -3.73 4.48 0.00 1.78 2.02 -1.26 -1.29 118.70 120.71 1rh8 s GLU 4772Ca 0.28 1.46 -0.30 0.00 0.02 0.00 0.00 54.97 56.43 1rh8 s GLU 4772Cb 0.03 -2.81 -0.08 0.00 0.10 0.00 0.00 34.13 31.37 1rh8 s GLU 4772CO 0.10 0.16 1.98 1.14 0.02 0.00 0.00 175.26 178.66 1rh8 s GLN 4773N -2.04 4.03 -0.42 1.61 -2.07 -1.26 -4.88 119.66 114.63 1rh8 s GLN 4773Ca 0.51 2.52 -0.27 0.00 -1.82 0.00 0.00 55.36 56.29 1rh8 s GLN 4773Cb -0.22 -4.18 -0.03 0.00 -1.09 0.00 0.00 33.01 27.49 1rh8 s GLN 4773CO 0.28 -1.08 1.97 0.99 -1.32 0.00 0.00 175.29 176.13 1rh8 s THR 4774N 4.88 3.31 -0.46 3.63 2.01 -1.26 -4.94 115.64 122.80 1rh8 s THR 4774Ca 0.89 0.27 -0.20 0.00 0.31 0.00 0.00 61.69 62.96 1rh8 s THR 4774Cb -0.41 -3.54 0.04 0.00 0.01 0.00 0.00 72.50 68.60 1rh8 s THR 4774CO 0.40 -0.43 0.62 -0.70 -0.69 0.00 0.00 174.62 173.82 1rh8 s GLU 4775N 6.54 3.20 0.00 4.92 2.12 -1.26 -5.31 118.70 128.91 1rh8 s GLU 4775Ca 0.82 -0.60 0.29 0.00 0.36 0.00 0.00 54.97 55.84 1rh8 s GLU 4775Cb -0.20 -4.01 1.20 0.00 0.26 0.00 0.00 34.13 31.38 1rh8 s GLU 4775CO 0.29 -1.08 1.83 -1.13 -0.54 0.00 0.00 175.26 174.63