#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 -1.40 -4.16 0.00 3.41 -1.26 -4.95 113.62 105.26 1rh8 n SER 4636Ca 0.00 -0.17 -0.39 0.00 -0.26 0.00 0.00 58.87 58.04 1rh8 n SER 4636Cb 0.00 0.00 -0.04 0.00 -0.26 0.00 0.00 64.21 63.91 1rh8 n SER 4636CO 0.00 0.00 0.00 1.57 -0.16 0.00 0.00 175.04 176.45 1rh8 n HIS 4637N -2.55 4.45 -2.57 7.33 -0.00 -1.26 -5.06 115.22 115.56 1rh8 n HIS 4637Ca 0.00 -3.96 -0.35 0.00 -0.00 0.00 0.00 57.72 53.41 1rh8 n HIS 4637Cb 0.00 -1.32 -0.04 0.00 -0.00 0.00 0.00 29.99 28.63 1rh8 n HIS 4637CO 0.00 0.00 0.00 -1.25 -0.00 0.00 0.00 176.34 175.09 1rh8 s PRO 4638N -1.49 4.01 -0.36 1.57 0.04 -1.26 -5.02 135.00 132.50 1rh8 s PRO 4638Ca 0.29 1.41 -0.19 0.00 0.04 0.00 0.00 61.00 62.55 1rh8 s PRO 4638Cb -0.07 -2.31 0.00 0.00 0.04 0.00 0.00 34.50 32.16 1rh8 s PRO 4638CO -0.09 -0.26 0.56 0.42 0.04 0.00 0.00 177.00 177.67 1rh8 s ILE 4639N -1.85 4.96 0.34 0.56 -1.09 -1.26 -4.53 121.20 118.33 1rh8 s ILE 4639Ca 0.62 0.37 0.05 0.00 -2.23 0.00 0.00 60.65 59.46 1rh8 s ILE 4639Cb -0.18 -4.03 -0.03 0.00 -1.58 0.00 0.00 42.46 36.64 1rh8 s ILE 4639CO 0.23 -0.29 0.22 0.42 -1.23 0.00 0.00 174.94 174.28 1rh8 s THR 4640N 2.52 0.17 0.00 2.92 -4.23 -1.26 -4.77 115.64 110.99 1rh8 s THR 4640Ca 0.21 -2.00 0.00 0.00 -1.18 0.00 0.00 61.69 58.72 1rh8 s THR 4640Cb -0.15 -2.46 0.00 0.00 1.34 0.00 0.00 72.50 71.23 1rh8 s THR 4640CO 0.14 0.00 0.00 0.61 -0.54 0.00 0.00 174.62 174.83 1rh8 n GLY 4641N -0.66 -0.20 3.54 3.99 0.00 0.20 -3.99 105.19 108.06 1rh8 n GLY 4641Ca 0.03 -1.75 -0.25 0.00 0.00 0.00 0.00 46.02 44.05 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 -2.18 1.83 -0.02 1.61 2.02 0.14 -2.67 118.70 119.44 1rh8 s GLU 4642Ca 0.00 -2.06 0.06 0.00 0.02 0.00 0.00 54.97 52.98 1rh8 s GLU 4642Cb 0.00 -1.07 -0.01 0.00 0.10 0.00 0.00 34.13 33.14 1rh8 s GLU 4642CO 0.00 -0.23 -0.19 -1.50 0.02 0.00 0.00 175.26 173.37 1rh8 s ILE 4643N -3.10 1.51 -0.20 -1.63 2.07 0.11 -0.74 121.20 119.22 1rh8 s ILE 4643Ca 0.30 -0.80 -0.07 0.00 -1.41 0.00 0.00 60.65 58.67 1rh8 s ILE 4643Cb 0.07 -1.26 -0.04 0.00 0.13 0.00 0.00 42.46 41.36 1rh8 s ILE 4643CO 0.14 0.43 0.05 -1.58 -1.91 0.00 0.00 174.94 172.07 1rh8 s GLN 4644N -0.32 3.85 0.12 3.50 0.74 0.32 0.12 119.66 127.98 1rh8 s GLN 4644Ca 0.04 -0.40 -0.05 0.00 0.05 0.00 0.00 55.36 55.00 1rh8 s GLN 4644Cb -0.09 -3.21 -0.02 0.00 1.10 0.00 0.00 33.01 30.79 1rh8 s GLN 4644CO 0.00 0.14 0.14 -0.51 -0.55 0.00 0.00 175.29 174.51 1rh8 s LEU 4645N 0.72 1.58 -0.28 3.68 1.43 -0.88 0.11 118.68 125.06 1rh8 s LEU 4645Ca 0.03 -0.95 0.02 0.00 -1.03 0.00 0.00 54.13 52.19 1rh8 s LEU 4645Cb -0.13 0.71 0.08 0.00 0.03 0.00 0.00 46.19 46.87 1rh8 s LEU 4645CO 0.02 -0.75 -0.01 -1.58 0.23 0.00 0.00 176.35 174.26 1rh8 s GLN 4646N -3.96 1.49 0.23 1.70 0.74 0.69 -2.15 119.66 118.40 1rh8 s GLN 4646Ca 0.15 -1.26 -0.19 0.00 0.05 0.00 0.00 55.36 54.10 1rh8 s GLN 4646Cb 0.06 -2.67 -0.08 0.00 1.10 0.00 0.00 33.01 31.41 1rh8 s GLN 4646CO -0.04 -0.75 0.72 0.42 -0.55 0.00 0.00 175.29 175.10 1rh8 s ILE 4647N 1.28 4.58 -0.29 -2.34 -1.09 -1.18 -1.19 121.20 120.98 1rh8 s ILE 4647Ca 0.01 1.24 -0.16 0.00 -2.23 0.00 0.00 60.65 59.51 1rh8 s ILE 4647Cb -0.19 -3.83 0.13 0.00 -1.58 0.00 0.00 42.46 36.99 1rh8 s ILE 4647CO -0.10 0.17 0.89 0.21 -1.23 0.00 0.00 174.94 174.88 1rh8 s ASN 4648N -1.71 -0.65 -0.09 3.58 2.47 0.40 -1.76 114.94 117.17 1rh8 s ASN 4648Ca 0.44 1.02 0.03 0.00 0.42 0.00 0.00 52.86 54.78 1rh8 s ASN 4648Cb -0.16 1.33 -0.01 0.00 -1.45 0.00 0.00 41.25 40.96 1rh8 s ASN 4648CO 0.21 -0.16 -0.20 -0.47 -3.72 0.00 0.00 177.10 172.76 1rh8 s TYR 4649N 1.55 2.62 0.03 0.43 6.14 -1.26 0.12 117.35 126.99 1rh8 s TYR 4649Ca -0.09 -0.76 -0.17 0.00 0.64 0.00 0.00 57.07 56.70 1rh8 s TYR 4649Cb -0.04 -1.72 0.03 0.00 0.42 0.00 0.00 41.96 40.65 1rh8 s TYR 4649CO -0.17 -0.25 0.38 -0.51 0.64 0.00 0.00 175.55 175.65 1rh8 s ASP 4650N 0.11 -0.24 -1.46 4.32 1.01 0.79 -4.92 116.67 116.28 1rh8 s ASP 4650Ca -0.10 -0.02 -0.12 0.00 0.71 0.00 0.00 52.55 53.02 1rh8 s ASP 4650Cb -0.16 0.39 0.09 0.00 1.01 0.00 0.00 42.92 44.26 1rh8 s ASP 4650CO 0.06 -0.62 0.71 -0.11 0.21 0.00 0.00 175.17 175.42 1rh8 n LEU 4651N 0.65 -1.96 -0.41 1.23 -0.00 -1.26 0.83 117.00 116.08 1rh8 n LEU 4651Ca -0.19 -0.62 -0.05 0.00 -0.00 0.00 0.00 56.01 55.14 1rh8 n LEU 4651Cb 0.59 -2.31 -0.02 0.00 -0.00 0.00 0.00 43.42 41.68 1rh8 n LEU 4651CO 0.21 0.29 -0.05 0.61 -0.00 0.00 0.00 177.39 178.44 1rh8 n GLY 4652N -1.40 0.66 3.26 -3.96 0.00 -1.26 -4.82 105.19 97.66 1rh8 n GLY 4652Ca 0.02 -0.14 -0.32 0.00 0.00 0.00 0.00 46.02 45.57 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 -2.33 3.33 -0.18 1.61 0.01 0.24 -1.33 114.94 116.29 1rh8 s ASN 4653Ca 0.00 -0.50 -0.24 0.00 -0.71 0.00 0.00 52.86 51.41 1rh8 s ASN 4653Cb 0.00 -1.46 -0.02 0.00 0.41 0.00 0.00 41.25 40.18 1rh8 s ASN 4653CO 0.00 0.16 0.77 -0.22 -1.51 0.00 0.00 177.10 176.30 1rh8 s LEU 4654N 0.37 4.16 -0.08 0.60 2.96 -0.95 -0.15 118.68 125.58 1rh8 s LEU 4654Ca -0.16 1.07 0.02 0.00 -0.22 0.00 0.00 54.13 54.83 1rh8 s LEU 4654Cb -0.17 -3.13 -0.02 0.00 0.50 0.00 0.00 46.19 43.36 1rh8 s LEU 4654CO 0.08 -0.37 -0.11 -0.63 -1.32 0.00 0.00 176.35 173.99 1rh8 s ILE 4655N 2.12 3.29 -0.04 6.68 1.09 0.33 0.11 121.20 134.78 1rh8 s ILE 4655Ca 0.35 -0.62 0.01 0.00 -1.10 0.00 0.00 60.65 59.29 1rh8 s ILE 4655Cb -0.16 -2.33 0.02 0.00 -1.06 0.00 0.00 42.46 38.92 1rh8 s ILE 4655CO 0.11 0.57 -0.05 -0.63 -0.10 0.00 0.00 174.94 174.84 1rh8 s ILE 4656N -0.46 0.58 -0.25 2.92 1.09 0.51 -0.46 121.20 125.14 1rh8 s ILE 4656Ca 0.06 -0.17 -0.03 0.00 -1.10 0.00 0.00 60.65 59.42 1rh8 s ILE 4656Cb -0.12 -0.58 0.02 0.00 -1.06 0.00 0.00 42.46 40.72 1rh8 s ILE 4656CO 0.02 0.22 -0.04 -1.00 -0.10 0.00 0.00 174.94 174.04 1rh8 s HIS 4657N 0.76 3.06 -0.45 3.97 3.76 -0.33 0.61 115.29 126.67 1rh8 s HIS 4657Ca -0.10 -1.40 -0.25 0.00 -0.15 0.00 0.00 55.06 53.16 1rh8 s HIS 4657Cb -0.13 -2.09 0.03 0.00 1.11 0.00 0.00 32.58 31.49 1rh8 s HIS 4657CO 0.00 -0.69 0.88 0.42 -0.85 0.00 0.00 174.74 174.51 1rh8 s ILE 4658N 1.37 4.54 0.00 0.60 1.09 -0.68 -0.23 121.20 127.89 1rh8 s ILE 4658Ca 0.01 0.67 0.00 0.00 -1.10 0.00 0.00 60.65 60.23 1rh8 s ILE 4658Cb -0.16 -4.39 0.00 0.00 -1.06 0.00 0.00 42.46 36.85 1rh8 s ILE 4658CO -0.03 -0.77 0.00 0.18 -0.10 0.00 0.00 174.94 174.21 1rh8 n LEU 4659N 6.99 0.83 -3.62 2.97 4.77 0.12 -0.39 117.00 128.67 1rh8 n LEU 4659Ca 0.05 0.00 -0.15 0.00 -0.03 0.00 0.00 56.01 55.88 1rh8 n LEU 4659Cb 0.48 0.00 -0.07 0.00 -2.33 0.00 0.00 43.42 41.51 1rh8 n LEU 4659CO 0.62 0.00 0.25 -1.58 -1.33 0.00 0.00 177.39 175.34 1rh8 s GLN 4660N 0.00 0.92 0.11 3.23 0.74 -0.99 0.15 119.66 123.82 1rh8 s GLN 4660Ca 0.00 -0.05 0.08 0.00 0.05 0.00 0.00 55.36 55.44 1rh8 s GLN 4660Cb 0.00 0.42 -0.04 0.00 1.10 0.00 0.00 33.01 34.49 1rh8 s GLN 4660CO 0.00 -0.29 -0.12 0.00 -0.55 0.00 0.00 175.29 174.33 1rh8 s ALA 4661N -1.63 2.88 0.17 1.58 0.00 -0.41 0.12 121.76 124.47 1rh8 s ALA 4661Ca -0.10 -1.29 0.01 0.00 0.00 0.00 0.00 51.96 50.58 1rh8 s ALA 4661Cb -0.02 -0.82 -0.05 0.00 0.00 0.00 0.00 23.12 22.24 1rh8 s ALA 4661CO 0.04 0.62 0.02 -0.98 0.00 0.00 0.00 175.76 175.46 1rh8 s ARG 4662N -2.24 1.11 -1.48 0.00 1.70 0.08 -2.77 118.95 115.35 1rh8 s ARG 4662Ca 0.21 -1.54 -0.01 0.00 -0.47 0.00 0.00 55.73 53.92 1rh8 s ARG 4662Cb -0.11 -0.17 0.00 0.00 -0.57 0.00 0.00 34.95 34.10 1rh8 s ARG 4662CO 0.13 -0.17 0.12 0.09 -1.08 0.00 0.00 175.30 174.39 1rh8 n ASN 4663N -0.24 -5.28 -4.10 -2.89 4.13 -1.14 0.27 115.26 106.01 1rh8 n ASN 4663Ca -0.06 -0.07 -0.30 0.00 1.68 0.00 0.00 54.58 55.84 1rh8 n ASN 4663Cb 0.64 -4.30 0.21 0.00 -1.54 0.00 0.00 39.78 34.79 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 -5.29 1.33 -0.41 3.41 1.43 -1.04 0.62 118.68 118.73 1rh8 s LEU 4664Ca 0.06 0.68 -0.29 0.00 -1.03 0.00 0.00 54.13 53.55 1rh8 s LEU 4664Cb -0.03 -2.59 0.02 0.00 0.03 0.00 0.00 46.19 43.62 1rh8 s LEU 4664CO 0.07 -3.56 1.20 0.54 0.23 0.00 0.00 176.35 174.84 1rh8 s VAL 4665N -3.19 4.19 0.47 -1.59 0.11 -1.26 -4.75 120.40 114.38 1rh8 s VAL 4665Ca 0.70 1.26 -0.20 0.00 -2.93 0.00 0.00 61.98 60.81 1rh8 s VAL 4665Cb -0.10 -4.44 -0.09 0.00 -1.53 0.00 0.00 36.38 30.22 1rh8 s VAL 4665CO 0.55 -0.80 0.99 -2.16 -3.33 0.00 0.00 175.10 170.35 1rh8 s PRO 4666N 4.38 3.98 -0.05 1.54 0.04 -1.25 -4.86 135.00 138.78 1rh8 s PRO 4666Ca 0.51 1.17 -0.03 0.00 0.04 0.00 0.00 61.00 62.70 1rh8 s PRO 4666Cb -0.10 -2.13 0.03 0.00 0.04 0.00 0.00 34.50 32.33 1rh8 s PRO 4666CO 0.28 -0.26 0.12 -0.98 0.04 0.00 0.00 177.00 176.20 1rh8 s ARG 4667N -3.42 0.09 0.75 4.56 1.70 -1.26 -5.06 118.95 116.31 1rh8 s ARG 4667Ca 0.63 0.27 -0.15 0.00 -0.47 0.00 0.00 55.73 56.02 1rh8 s ARG 4667Cb -0.12 -0.10 0.05 0.00 -0.57 0.00 0.00 34.95 34.21 1rh8 s ARG 4667CO 0.20 -0.11 1.23 0.16 -1.08 0.00 0.00 175.30 175.70 1rh8 s ASP 4668N 0.77 3.93 -1.10 -2.89 -4.77 -1.26 -3.71 116.67 107.64 1rh8 s ASP 4668Ca -0.06 2.45 -0.07 0.00 -3.30 0.00 0.00 52.55 51.57 1rh8 s ASP 4668Cb -0.08 -2.60 -0.05 0.00 -1.09 0.00 0.00 42.92 39.10 1rh8 s ASP 4668CO -0.04 -2.45 0.90 -3.20 0.70 0.00 0.00 175.17 171.09 1rh8 n ASN 4669N -2.84 -5.55 -4.31 2.11 5.15 -1.26 -5.02 115.26 103.55 1rh8 n ASN 4669Ca 0.14 -0.75 -0.31 0.00 -0.60 0.00 0.00 54.58 53.06 1rh8 n ASN 4669Cb 0.50 -4.86 -0.16 0.00 -0.53 0.00 0.00 39.78 34.73 1rh8 n ASN 4669CO 0.00 0.00 0.00 0.21 1.40 0.00 0.00 177.26 178.87 1rh8 s ASN 4670N -3.58 3.01 0.00 1.20 3.84 -1.24 -4.98 114.94 113.19 1rh8 s ASN 4670Ca 0.38 -0.47 0.00 0.00 0.21 0.00 0.00 52.86 52.97 1rh8 s ASN 4670Cb -0.07 -0.33 0.00 0.00 -0.55 0.00 0.00 41.25 40.30 1rh8 s ASN 4670CO 0.76 0.31 0.00 0.61 -2.79 0.00 0.00 177.10 175.99 1rh8 n GLY 4671N 2.40 -0.91 1.26 1.21 0.00 -1.26 -4.88 105.19 103.01 1rh8 n GLY 4671Ca -0.16 0.20 0.00 0.00 0.00 0.00 0.00 46.02 46.06 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 0.00 -1.58 -3.17 1.61 4.11 -1.26 -5.07 117.16 111.80 1rh8 n TYR 4672Ca 0.00 0.00 -0.39 0.00 -0.00 0.00 0.00 57.90 57.51 1rh8 n TYR 4672Cb 0.00 0.32 -0.06 0.00 -0.00 0.00 0.00 39.34 39.60 1rh8 n TYR 4672CO 0.00 0.00 0.00 0.45 -0.00 0.00 0.00 176.86 177.31 1rh8 s SER 4673N -1.90 7.02 -0.15 9.48 0.15 -1.26 -5.07 113.70 121.98 1rh8 s SER 4673Ca 0.00 1.22 -0.04 0.00 0.70 0.00 0.00 55.95 57.83 1rh8 s SER 4673Cb 0.00 -2.38 -0.03 0.00 -1.71 0.00 0.00 66.02 61.90 1rh8 s SER 4673CO 0.00 0.10 -0.03 -1.81 1.20 0.00 0.00 173.24 172.70 1rh8 s ASP 4674N -0.24 4.86 0.43 5.45 1.11 -1.26 -4.95 116.67 122.07 1rh8 s ASP 4674Ca 0.32 -0.10 -0.23 0.00 0.18 0.00 0.00 52.55 52.73 1rh8 s ASP 4674Cb -0.19 -1.74 -0.08 0.00 1.07 0.00 0.00 42.92 41.98 1rh8 s ASP 4674CO 0.18 0.19 1.08 -2.16 1.18 0.00 0.00 175.17 175.64 1rh8 s PRO 4675N 0.22 3.99 0.35 8.23 0.04 -1.26 -4.31 135.00 142.25 1rh8 s PRO 4675Ca -0.02 1.55 0.05 0.00 0.04 0.00 0.00 61.00 62.63 1rh8 s PRO 4675Cb -0.14 -2.42 -0.07 0.00 0.04 0.00 0.00 34.50 31.91 1rh8 s PRO 4675CO 0.03 -0.30 0.02 -0.59 0.04 0.00 0.00 177.00 176.19 1rh8 s PHE 4676N -1.69 2.16 0.18 0.56 -0.71 0.13 -4.97 117.98 113.64 1rh8 s PHE 4676Ca 0.61 -0.81 0.10 0.00 -1.04 0.00 0.00 56.93 55.80 1rh8 s PHE 4676Cb -0.23 -1.42 -0.04 0.00 -1.21 0.00 0.00 43.02 40.12 1rh8 s PHE 4676CO 0.28 0.22 -0.18 0.08 -1.34 0.00 0.00 175.22 174.27 1rh8 s VAL 4677N -3.04 2.70 -0.11 -2.49 1.01 -1.26 0.14 120.40 117.35 1rh8 s VAL 4677Ca 0.35 -1.84 -0.01 0.00 0.00 0.00 0.00 61.98 60.47 1rh8 s VAL 4677Cb 0.08 -2.30 0.03 0.00 0.00 0.00 0.00 36.38 34.19 1rh8 s VAL 4677CO 0.16 -0.09 -0.01 -0.54 0.00 0.00 0.00 175.10 174.62 1rh8 s LYS 4678N -2.67 0.83 -0.12 2.72 1.02 0.27 -2.06 119.74 119.73 1rh8 s LYS 4678Ca 0.22 -0.10 0.01 0.00 0.02 0.00 0.00 55.97 56.12 1rh8 s LYS 4678Cb -0.08 -1.38 0.02 0.00 -0.52 0.00 0.00 37.83 35.86 1rh8 s LYS 4678CO 0.12 -0.38 -0.16 0.08 -0.92 0.00 0.00 175.35 174.09 1rh8 s VAL 4679N 1.88 1.62 0.06 3.17 1.01 -0.57 -0.51 120.40 127.07 1rh8 s VAL 4679Ca 0.03 -0.70 -0.06 0.00 0.00 0.00 0.00 61.98 61.25 1rh8 s VAL 4679Cb -0.13 -1.48 -0.01 0.00 0.00 0.00 0.00 36.38 34.75 1rh8 s VAL 4679CO -0.06 0.47 0.12 -0.72 0.00 0.00 0.00 175.10 174.90 1rh8 s TYR 4680N 1.08 0.22 0.13 5.22 -0.85 -1.20 -2.57 117.35 119.38 1rh8 s TYR 4680Ca -0.04 -0.61 -0.24 0.00 -0.52 0.00 0.00 57.07 55.66 1rh8 s TYR 4680Cb -0.14 -0.14 -0.07 0.00 0.38 0.00 0.00 41.96 41.98 1rh8 s TYR 4680CO -0.04 -0.44 0.74 -0.51 -1.52 0.00 0.00 175.55 173.78 1rh8 s LEU 4681N -2.55 4.56 0.13 -3.49 2.01 -1.26 -2.38 118.68 115.70 1rh8 s LEU 4681Ca 0.01 1.55 -0.20 0.00 0.01 0.00 0.00 54.13 55.50 1rh8 s LEU 4681Cb 0.03 -3.22 -0.04 0.00 0.01 0.00 0.00 46.19 42.97 1rh8 s LEU 4681CO -0.08 0.19 1.72 -0.07 1.01 0.00 0.00 176.35 179.11 1rh8 h LEU 4682N 4.59 -0.12 -4.26 1.79 3.38 -1.79 -2.82 115.31 116.08 1rh8 h LEU 4682Ca -0.47 0.05 -0.49 0.00 0.09 0.00 0.00 57.88 57.06 1rh8 h LEU 4682Cb 1.21 0.09 -0.18 0.00 0.09 0.00 0.00 40.66 41.87 1rh8 h LEU 4682CO 0.66 -0.03 0.48 -0.81 0.09 0.00 0.00 178.44 178.83 1rh8 n PRO 4683N -5.16 2.29 -4.21 1.13 -0.05 -1.26 -4.94 135.00 122.81 1rh8 n PRO 4683Ca -0.03 -2.30 -0.25 0.00 -0.05 0.00 0.00 63.50 60.87 1rh8 n PRO 4683Cb 0.11 -2.03 -0.08 0.00 -0.05 0.00 0.00 33.50 31.45 1rh8 n PRO 4683CO 0.00 0.00 0.00 0.20 -0.05 0.00 0.00 175.50 175.65 1rh8 s GLY 4684N 0.05 2.37 0.57 0.55 0.00 -1.07 -5.00 107.32 104.80 1rh8 s GLY 4684Ca 0.52 -2.12 0.27 0.00 0.00 0.00 0.00 44.72 43.39 1rh8 s GLY 4684CO -0.17 -1.94 2.02 0.07 0.00 0.00 0.00 173.10 173.08 1rh8 h ARG 4685N 1.47 0.00 0.00 2.90 -0.00 -1.92 -3.45 114.38 113.39 1rh8 h ARG 4685Ca -0.43 0.00 0.00 0.00 -0.00 0.00 0.00 59.98 59.55 1rh8 h ARG 4685Cb 1.25 0.00 0.00 0.00 -0.00 0.00 0.00 29.97 31.22 1rh8 h ARG 4685CO 0.72 0.00 0.00 0.41 -0.00 0.00 0.00 179.97 181.10 1rh8 n GLY 4686N -1.49 1.00 3.32 0.08 0.00 -1.26 -5.10 105.19 101.73 1rh8 n GLY 4686Ca 0.05 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.65 1rh8 n GLY 4686CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1rh8 s GLN 4687N 0.00 2.75 -0.25 1.61 0.74 -1.26 -5.06 119.66 118.20 1rh8 s GLN 4687Ca 0.00 -1.41 -0.22 0.00 0.05 0.00 0.00 55.36 53.78 1rh8 s GLN 4687Cb 0.00 -3.92 -0.01 0.00 1.10 0.00 0.00 33.01 30.18 1rh8 s GLN 4687CO 0.00 -0.98 0.70 0.54 -0.55 0.00 0.00 175.29 175.00 1rh8 s VAL 4688N 1.51 4.93 -0.24 1.34 0.11 -1.26 -4.65 120.40 122.14 1rh8 s VAL 4688Ca 0.03 1.29 -0.11 0.00 -2.93 0.00 0.00 61.98 60.26 1rh8 s VAL 4688Cb -0.23 -4.00 -0.05 0.00 -1.53 0.00 0.00 36.38 30.57 1rh8 s VAL 4688CO 0.04 -0.01 0.19 -0.32 -3.33 0.00 0.00 175.10 171.67 1rh8 s MET 4689N 2.61 4.06 0.42 1.54 1.75 -1.06 -4.91 119.30 123.71 1rh8 s MET 4689Ca 0.29 -0.23 -0.03 0.00 -1.25 0.00 0.00 55.69 54.47 1rh8 s MET 4689Cb -0.15 -3.56 -0.04 0.00 2.84 0.00 0.00 34.83 33.92 1rh8 s MET 4689CO 0.08 0.02 0.68 0.08 -0.65 0.00 0.00 175.02 175.23 1rh8 s VAL 4690N 1.18 4.98 0.28 10.11 1.01 -1.26 -1.51 120.40 135.20 1rh8 s VAL 4690Ca 0.09 -0.02 -0.12 0.00 0.00 0.00 0.00 61.98 61.92 1rh8 s VAL 4690Cb -0.14 -3.85 -0.08 0.00 0.00 0.00 0.00 36.38 32.31 1rh8 s VAL 4690CO 0.06 -0.69 0.65 -0.69 0.00 0.00 0.00 175.10 174.42 1rh8 s VAL 4691N -2.53 4.80 0.61 2.92 1.01 -0.88 -4.98 120.40 121.36 1rh8 s VAL 4691Ca 0.45 0.71 -0.00 0.00 0.00 0.00 0.00 61.98 63.13 1rh8 s VAL 4691Cb -0.10 -3.62 0.06 0.00 0.00 0.00 0.00 36.38 32.72 1rh8 s VAL 4691CO 0.40 -0.15 0.86 -1.10 0.00 0.00 0.00 175.10 175.11 1rh8 s GLN 4692N -2.95 2.29 0.49 2.72 -0.21 -1.26 -4.78 119.66 115.97 1rh8 s GLN 4692Ca 0.51 -0.79 -0.03 0.00 0.02 0.00 0.00 55.36 55.07 1rh8 s GLN 4692Cb -0.11 -2.41 -0.01 0.00 1.00 0.00 0.00 33.01 31.49 1rh8 s GLN 4692CO 0.20 -0.96 0.76 1.21 -2.12 0.00 0.00 175.29 174.38 1rh8 s ASN 4693N -4.51 5.90 0.35 5.90 3.84 -1.26 -4.84 114.94 120.32 1rh8 s ASN 4693Ca 0.60 0.59 0.00 0.00 0.21 0.00 0.00 52.86 54.26 1rh8 s ASN 4693Cb -0.09 -1.80 0.00 0.00 -0.55 0.00 0.00 41.25 38.81 1rh8 s ASN 4693CO 0.41 -0.75 0.02 0.00 -2.79 0.00 0.00 177.10 173.99 1rh8 n ALA 4694N -2.25 0.31 -1.51 1.71 0.00 -1.26 -5.01 120.51 112.51 1rh8 n ALA 4694Ca 0.02 -1.56 -0.33 0.00 0.00 0.00 0.00 53.44 51.57 1rh8 n ALA 4694Cb 0.57 0.84 -0.16 0.00 0.00 0.00 0.00 19.45 20.69 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 -1.26 -0.08 -0.24 0.00 2.88 -1.26 -4.71 113.62 108.95 1rh8 n SER 4695Ca -0.14 -0.18 0.32 0.00 -1.33 0.00 0.00 58.87 57.55 1rh8 n SER 4695Cb 0.44 -0.87 0.72 0.00 -0.75 0.00 0.00 64.21 63.75 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 12.25 2.94 -1.00 -1.46 0.00 -1.97 0.13 119.26 130.15 1rh8 h ALA 4696Ca -0.03 -0.04 0.14 0.00 0.00 0.00 0.00 54.91 54.98 1rh8 h ALA 4696Cb 1.24 0.08 -0.09 0.00 0.00 0.00 0.00 17.79 19.01 1rh8 h ALA 4696CO 1.44 -1.37 0.63 1.05 0.00 0.00 0.00 179.25 180.99 1rh8 h GLU 4697N 0.00 0.89 0.00 0.00 4.11 -2.00 0.83 114.58 118.42 1rh8 h GLU 4697Ca 0.50 -0.05 -0.23 0.00 0.07 0.00 0.00 59.36 59.65 1rh8 h GLU 4697Cb 2.16 -0.20 -0.04 0.00 0.50 0.00 0.00 28.75 31.17 1rh8 h GLU 4697CO -0.01 0.59 -1.69 2.48 0.07 0.00 0.00 179.01 180.46 1rh8 n TYR 4698N -4.65 0.78 -0.09 2.06 0.18 0.40 -4.06 117.16 111.78 1rh8 n TYR 4698Ca 0.20 0.27 -0.12 0.00 1.88 0.00 0.00 57.90 60.13 1rh8 n TYR 4698Cb 0.42 -1.07 -0.05 0.00 -0.38 0.00 0.00 39.34 38.26 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 0.52 -0.44 -3.48 1.79 -0.72 -2.55 116.57 111.69 1rh8 h LYS 4699Ca -0.25 -0.23 0.13 0.00 -2.18 0.00 0.00 60.65 58.12 1rh8 h LYS 4699Cb 1.78 -0.02 -0.02 0.00 -1.58 0.00 0.00 32.23 32.40 1rh8 h LYS 4699CO 0.05 0.78 0.43 0.00 -1.08 0.00 0.00 179.45 179.63 1rh8 h ARG 4700N 0.24 0.00 -0.01 3.15 2.47 0.49 1.19 114.38 121.92 1rh8 h ARG 4700Ca 0.06 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.78 1rh8 h ARG 4700Cb 0.62 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.94 1rh8 h ARG 4700CO 0.04 0.00 -0.03 0.54 0.56 0.00 0.00 179.97 181.08 1rh8 n ARG 4701N -3.85 1.19 -1.20 0.04 1.74 -0.96 -3.51 116.66 110.11 1rh8 n ARG 4701Ca 0.08 -0.44 -0.21 0.00 -0.77 0.00 0.00 57.85 56.51 1rh8 n ARG 4701Cb 0.62 -1.49 0.15 0.00 -1.02 0.00 0.00 32.46 30.72 1rh8 n ARG 4701CO 0.00 0.00 0.00 0.25 -1.52 0.00 0.00 177.63 176.36 1rh8 n THR 4702N -0.52 3.08 0.00 0.55 -2.24 0.41 -4.40 114.28 111.17 1rh8 n THR 4702Ca 0.20 -2.53 0.10 0.00 -2.27 0.00 0.00 64.05 59.55 1rh8 n THR 4702Cb 0.25 -0.62 -0.16 0.00 -2.10 0.00 0.00 70.33 67.69 1rh8 n THR 4702CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 1rh8 n LYS 4703N -1.07 0.62 0.00 -0.78 5.02 -1.23 -0.17 118.16 120.55 1rh8 n LYS 4703Ca 0.52 -0.19 0.00 0.00 -2.02 0.00 0.00 58.31 56.63 1rh8 n LYS 4703Cb 1.24 -1.49 0.00 0.00 -0.02 0.00 0.00 35.03 34.76 1rh8 n LYS 4703CO 0.00 0.00 0.00 2.48 -0.52 0.00 0.00 177.40 179.36 1rh8 n TYR 4704N -2.21 0.00 -0.13 2.13 4.11 -1.26 -4.37 117.16 115.43 1rh8 n TYR 4704Ca -0.04 0.00 -0.27 0.00 -0.00 0.00 0.00 57.90 57.60 1rh8 n TYR 4704Cb 0.54 -0.31 -0.10 0.00 -0.00 0.00 0.00 39.34 39.47 1rh8 n TYR 4704CO 0.00 0.00 0.00 1.33 -0.00 0.00 0.00 176.86 178.19 1rh8 n VAL 4705N -1.79 1.53 0.23 -3.48 0.24 -1.26 -4.40 118.33 109.40 1rh8 n VAL 4705Ca 0.00 -0.27 0.16 0.00 -2.04 0.00 0.00 64.34 62.18 1rh8 n VAL 4705Cb 0.00 -1.95 0.83 0.00 -1.47 0.00 0.00 33.84 31.25 1rh8 n VAL 4705CO 0.00 0.00 0.00 1.56 -2.14 0.00 0.00 176.83 176.25 1rh8 h GLN 4706N -1.00 0.00 0.06 7.34 4.20 -1.82 -1.96 115.11 121.93 1rh8 h GLN 4706Ca -0.58 0.00 -0.00 0.00 0.06 0.00 0.00 58.65 58.13 1rh8 h GLN 4706Cb 1.50 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 29.28 1rh8 h GLN 4706CO -0.35 0.00 -0.05 -0.22 -0.67 0.00 0.00 178.83 177.54 1rh8 h LYS 4707N 0.00 -0.10 -0.65 1.46 1.63 -0.77 -2.58 116.57 115.56 1rh8 h LYS 4707Ca 0.00 0.01 0.00 0.00 -0.85 0.00 0.00 60.65 59.81 1rh8 h LYS 4707Cb 0.00 0.02 0.00 0.00 -0.60 0.00 0.00 32.23 31.66 1rh8 h LYS 4707CO 0.00 -0.07 0.00 0.45 -3.45 0.00 0.00 179.45 176.38 1rh8 n SER 4708N -2.49 3.76 -0.06 4.20 2.88 -1.22 -4.46 113.62 116.23 1rh8 n SER 4708Ca -0.01 -2.00 -0.13 0.00 -1.33 0.00 0.00 58.87 55.40 1rh8 n SER 4708Cb 0.05 -0.43 -0.04 0.00 -0.75 0.00 0.00 64.21 63.03 1rh8 n SER 4708CO 0.00 0.00 0.00 0.18 -1.23 0.00 0.00 175.04 173.99 1rh8 n LEU 4709N 1.46 1.18 -3.42 2.46 4.77 -0.74 -3.76 117.00 118.95 1rh8 n LEU 4709Ca 0.22 0.20 -0.21 0.00 -0.03 0.00 0.00 56.01 56.19 1rh8 n LEU 4709Cb 0.59 -0.47 -0.10 0.00 -2.33 0.00 0.00 43.42 41.11 1rh8 n LEU 4709CO 0.15 0.09 -0.21 0.20 -1.33 0.00 0.00 177.39 176.29 1rh8 s ASN 4710N -6.23 2.00 -0.04 -1.43 0.01 -0.99 -2.49 114.94 105.76 1rh8 s ASN 4710Ca -0.19 -1.31 -0.20 0.00 -0.71 0.00 0.00 52.86 50.45 1rh8 s ASN 4710Cb 0.06 0.26 -0.05 0.00 0.41 0.00 0.00 41.25 41.94 1rh8 s ASN 4710CO 0.25 -0.35 0.58 -2.16 -1.51 0.00 0.00 177.10 173.91 1rh8 s PRO 4711N 1.84 4.33 0.47 -0.60 0.04 -1.10 -4.56 135.00 135.42 1rh8 s PRO 4711Ca 0.13 0.68 0.06 0.00 0.04 0.00 0.00 61.00 61.90 1rh8 s PRO 4711Cb -0.16 -3.38 -0.02 0.00 0.04 0.00 0.00 34.50 30.98 1rh8 s PRO 4711CO -0.19 0.28 0.22 -1.83 0.04 0.00 0.00 177.00 175.51 1rh8 s GLU 4712N 0.15 2.24 0.00 4.56 1.03 -1.26 -1.29 118.70 124.12 1rh8 s GLU 4712Ca 0.31 -1.99 0.00 0.00 0.03 0.00 0.00 54.97 53.32 1rh8 s GLU 4712Cb -0.17 -1.95 0.00 0.00 -0.80 0.00 0.00 34.13 31.21 1rh8 s GLU 4712CO 0.15 -0.31 0.00 0.91 -1.33 0.00 0.00 175.26 174.68 1rh8 n TRP 4713N -1.41 -0.81 -3.71 4.83 8.01 0.39 -4.93 117.44 119.81 1rh8 n TRP 4713Ca -0.04 0.00 -0.23 0.00 -1.31 0.00 0.00 57.50 55.92 1rh8 n TRP 4713Cb 0.65 0.26 0.04 0.00 -2.01 0.00 0.00 31.31 30.25 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 -2.02 -2.08 -4.90 -0.99 3.02 0.48 -4.47 115.26 104.29 1rh8 n ASN 4714Ca 0.00 -0.79 -0.25 0.00 -0.03 0.00 0.00 54.58 53.51 1rh8 n ASN 4714Cb 0.00 -4.15 -0.01 0.00 -0.61 0.00 0.00 39.78 35.02 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 -6.06 2.29 -0.05 3.52 -1.52 -0.25 -4.94 119.66 112.64 1rh8 s GLN 4715Ca 0.14 -1.92 -0.04 0.00 -1.95 0.00 0.00 55.36 51.59 1rh8 s GLN 4715Cb -0.07 -2.17 0.02 0.00 -0.22 0.00 0.00 33.01 30.57 1rh8 s GLN 4715CO 0.81 -0.56 0.14 0.99 -0.25 0.00 0.00 175.29 176.42 1rh8 s THR 4716N -2.72 -0.01 0.21 -0.19 2.01 -1.26 -1.68 115.64 112.00 1rh8 s THR 4716Ca 0.38 0.04 0.06 0.00 0.31 0.00 0.00 61.69 62.48 1rh8 s THR 4716Cb -0.02 -0.21 -0.05 0.00 0.01 0.00 0.00 72.50 72.23 1rh8 s THR 4716CO 0.23 0.02 -0.10 -0.69 -0.69 0.00 0.00 174.62 173.39 1rh8 s VAL 4717N 0.30 1.50 0.01 3.82 1.01 0.20 -4.96 120.40 122.28 1rh8 s VAL 4717Ca -0.02 -2.14 -0.02 0.00 0.00 0.00 0.00 61.98 59.81 1rh8 s VAL 4717Cb -0.03 -2.10 -0.01 0.00 0.00 0.00 0.00 36.38 34.23 1rh8 s VAL 4717CO -0.01 -0.55 0.01 -0.63 0.00 0.00 0.00 175.10 173.92 1rh8 s ILE 4718N -3.12 0.08 -0.59 2.22 1.01 -1.26 -0.36 121.20 119.18 1rh8 s ILE 4718Ca 0.23 -0.69 0.05 0.00 0.00 0.00 0.00 60.65 60.24 1rh8 s ILE 4718Cb 0.02 -0.25 0.17 0.00 0.01 0.00 0.00 42.46 42.41 1rh8 s ILE 4718CO 0.06 -0.38 0.44 -1.22 0.00 0.00 0.00 174.94 173.85 1rh8 n TYR 4719N 1.87 1.65 -1.82 3.97 4.01 0.31 -4.93 117.16 122.21 1rh8 n TYR 4719Ca -0.21 -3.93 -0.34 0.00 -0.16 0.00 0.00 57.90 53.26 1rh8 n TYR 4719Cb 0.56 -0.28 0.05 0.00 -0.31 0.00 0.00 39.34 39.35 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 -0.90 2.77 0.00 -0.72 3.01 -1.26 -2.25 119.74 120.38 1rh8 s LYS 4720Ca 0.28 1.63 0.00 0.00 -1.01 0.00 0.00 55.97 56.87 1rh8 s LYS 4720Cb -0.01 -1.92 0.00 0.00 -1.01 0.00 0.00 37.83 34.89 1rh8 s LYS 4720CO -0.18 -1.32 0.00 0.43 0.51 0.00 0.00 175.35 174.79 1rh8 n SER 4721N -2.10 -0.98 -3.73 2.83 7.64 -1.17 -4.95 113.62 111.16 1rh8 n SER 4721Ca 0.12 0.00 -0.25 0.00 1.01 0.00 0.00 58.87 59.76 1rh8 n SER 4721Cb 0.51 -0.37 -0.17 0.00 -1.01 0.00 0.00 64.21 63.17 1rh8 n SER 4721CO 0.00 0.00 0.00 -0.63 -3.01 0.00 0.00 175.04 171.40 1rh8 s ILE 4722N -2.00 0.31 0.26 0.44 1.01 -0.44 -5.06 121.20 115.71 1rh8 s ILE 4722Ca 0.00 -0.10 0.08 0.00 0.00 0.00 0.00 60.65 60.62 1rh8 s ILE 4722Cb 0.00 -0.66 -0.04 0.00 0.01 0.00 0.00 42.46 41.77 1rh8 s ILE 4722CO 0.00 0.03 0.16 -0.55 0.00 0.00 0.00 174.94 174.59 1rh8 s SER 4723N 1.98 5.34 0.61 3.58 0.15 -1.26 -3.95 113.70 120.15 1rh8 s SER 4723Ca 0.03 -0.33 0.26 0.00 0.70 0.00 0.00 55.95 56.61 1rh8 s SER 4723Cb -0.14 -1.29 1.26 0.00 -1.71 0.00 0.00 66.02 64.14 1rh8 s SER 4723CO -0.06 -0.04 1.69 -0.03 1.20 0.00 0.00 173.24 175.99 1rh8 h MET 4724N 1.55 0.00 0.15 5.44 4.05 -1.94 1.10 114.93 125.29 1rh8 h MET 4724Ca -0.48 0.00 0.01 0.00 -0.28 0.00 0.00 59.70 58.95 1rh8 h MET 4724Cb 1.24 0.00 -0.02 0.00 -0.80 0.00 0.00 31.60 32.02 1rh8 h MET 4724CO 0.61 0.00 -0.21 1.05 0.23 0.00 0.00 176.91 178.59 1rh8 h GLU 4725N 0.00 -0.40 0.00 0.39 4.11 -2.00 -1.38 114.58 115.31 1rh8 h GLU 4725Ca 0.24 0.03 -0.34 0.00 0.07 0.00 0.00 59.36 59.35 1rh8 h GLU 4725Cb 1.60 0.09 -0.06 0.00 0.50 0.00 0.00 28.75 30.88 1rh8 h GLU 4725CO -0.00 -0.27 -2.11 1.04 0.07 0.00 0.00 179.01 177.74 1rh8 n GLN 4726N -5.33 0.67 -0.09 1.06 6.02 -0.20 -4.35 117.38 115.15 1rh8 n GLN 4726Ca -0.07 0.13 -0.06 0.00 -0.01 0.00 0.00 57.00 56.98 1rh8 n GLN 4726Cb 0.25 -1.63 0.00 0.00 1.02 0.00 0.00 30.24 29.87 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 -0.26 -2.12 1.08 5.85 0.12 0.92 115.31 120.90 1rh8 h LEU 4727Ca -0.44 0.09 0.08 0.00 0.84 0.00 0.00 57.88 58.45 1rh8 h LEU 4727Cb 2.14 0.18 -0.01 0.00 0.37 0.00 0.00 40.66 43.34 1rh8 h LEU 4727CO 0.05 -0.09 0.26 0.24 -0.34 0.00 0.00 178.44 178.56 1rh8 h MET 4728N 0.02 0.00 0.00 1.25 2.86 -1.44 0.38 114.93 118.00 1rh8 h MET 4728Ca 0.16 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.80 1rh8 h MET 4728Cb 0.23 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.89 1rh8 h MET 4728CO -0.32 0.00 -0.38 0.87 1.06 0.00 0.00 176.91 178.14 1rh8 h LYS 4729N 0.00 0.00 -6.14 1.72 1.57 -1.05 -2.97 116.57 109.70 1rh8 h LYS 4729Ca 0.13 0.00 -0.54 0.00 -1.87 0.00 0.00 60.65 58.37 1rh8 h LYS 4729Cb 0.65 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.94 1rh8 h LYS 4729CO -0.00 0.00 -0.39 0.15 -0.57 0.00 0.00 179.45 178.64 1rh8 s LYS 4730N -3.15 3.49 -0.08 3.15 1.02 0.13 -4.86 119.74 119.45 1rh8 s LYS 4730Ca 0.08 -0.43 0.03 0.00 0.02 0.00 0.00 55.97 55.67 1rh8 s LYS 4730Cb 0.13 -2.89 0.01 0.00 -0.52 0.00 0.00 37.83 34.55 1rh8 s LYS 4730CO 0.67 0.45 -0.18 0.99 -0.92 0.00 0.00 175.35 176.37 1rh8 s THR 4731N -1.80 1.57 -0.40 2.17 2.01 -1.26 -2.55 115.64 115.37 1rh8 s THR 4731Ca 0.37 -0.73 -0.29 0.00 0.31 0.00 0.00 61.69 61.35 1rh8 s THR 4731Cb -0.11 -1.39 0.02 0.00 0.01 0.00 0.00 72.50 71.03 1rh8 s THR 4731CO 0.29 0.45 1.12 -0.22 -0.69 0.00 0.00 174.62 175.57 1rh8 s LEU 4732N 0.53 3.78 -0.40 4.42 2.96 0.42 -2.08 118.68 128.30 1rh8 s LEU 4732Ca -0.16 0.76 -0.10 0.00 -0.22 0.00 0.00 54.13 54.40 1rh8 s LEU 4732Cb -0.17 -3.55 0.05 0.00 0.50 0.00 0.00 46.19 43.03 1rh8 s LEU 4732CO 0.06 -1.08 0.24 -0.70 -1.32 0.00 0.00 176.35 173.55 1rh8 s GLU 4733N 4.09 2.74 -0.10 1.98 2.12 -1.00 0.55 118.70 129.08 1rh8 s GLU 4733Ca 0.47 -1.25 -0.22 0.00 0.36 0.00 0.00 54.97 54.33 1rh8 s GLU 4733Cb -0.10 -3.77 -0.04 0.00 0.26 0.00 0.00 34.13 30.48 1rh8 s GLU 4733CO 0.24 -0.82 0.63 0.08 -0.54 0.00 0.00 175.26 174.85 1rh8 s VAL 4734N 1.51 5.08 -0.09 3.70 1.01 0.13 -3.26 120.40 128.48 1rh8 s VAL 4734Ca 0.02 1.28 0.00 0.00 0.00 0.00 0.00 61.98 63.29 1rh8 s VAL 4734Cb -0.21 -3.97 0.02 0.00 0.00 0.00 0.00 36.38 32.22 1rh8 s VAL 4734CO 0.05 0.24 -0.08 0.42 0.00 0.00 0.00 175.10 175.73 1rh8 s THR 4735N 0.96 0.95 -0.20 3.92 -4.23 0.34 0.98 115.64 118.36 1rh8 s THR 4735Ca 0.33 -0.29 -0.15 0.00 -1.18 0.00 0.00 61.69 60.40 1rh8 s THR 4735Cb -0.17 -0.95 -0.04 0.00 1.34 0.00 0.00 72.50 72.68 1rh8 s THR 4735CO 0.15 0.34 0.35 -0.69 -0.54 0.00 0.00 174.62 174.23 1rh8 s VAL 4736N 1.36 5.24 -0.04 2.29 1.01 0.30 0.98 120.40 131.53 1rh8 s VAL 4736Ca -0.02 0.62 0.05 0.00 0.00 0.00 0.00 61.98 62.62 1rh8 s VAL 4736Cb -0.14 -3.69 -0.01 0.00 0.00 0.00 0.00 36.38 32.55 1rh8 s VAL 4736CO -0.04 0.28 -0.18 0.26 0.00 0.00 0.00 175.10 175.42 1rh8 s TRP 4737N 1.15 1.74 -0.11 5.22 0.52 0.12 0.46 118.94 128.05 1rh8 s TRP 4737Ca 0.17 -0.45 -0.02 0.00 0.02 0.00 0.00 56.10 55.82 1rh8 s TRP 4737Cb -0.14 -1.16 -0.03 0.00 -1.15 0.00 0.00 33.47 30.99 1rh8 s TRP 4737CO 0.07 -0.13 -0.05 0.34 0.02 0.00 0.00 176.95 177.20 1rh8 s ASP 4738N -0.12 4.76 -0.06 2.95 2.15 0.74 0.17 116.67 127.25 1rh8 s ASP 4738Ca -0.00 -0.06 -0.30 0.00 0.43 0.00 0.00 52.55 52.61 1rh8 s ASP 4738Cb -0.10 -1.51 -0.04 0.00 -0.30 0.00 0.00 42.92 40.97 1rh8 s ASP 4738CO 0.01 0.27 1.44 -0.31 -0.17 0.00 0.00 175.17 176.41 1rh8 s TYR 4739N -0.23 2.58 1.07 -5.34 2.02 -1.26 0.78 117.35 116.96 1rh8 s TYR 4739Ca 0.04 0.68 -0.18 0.00 -0.37 0.00 0.00 57.07 57.24 1rh8 s TYR 4739Cb -0.13 -3.70 0.27 0.00 -0.40 0.00 0.00 41.96 38.01 1rh8 s TYR 4739CO 0.02 -2.67 0.86 -3.47 -1.57 0.00 0.00 175.55 168.72 1rh8 n ASP 4740N 6.25 -2.39 0.04 2.29 2.03 0.20 -4.86 116.55 120.11 1rh8 n ASP 4740Ca 0.15 -0.97 -0.12 0.00 0.52 0.00 0.00 54.79 54.37 1rh8 n ASP 4740Cb 0.44 -0.83 -0.13 0.00 -0.72 0.00 0.00 41.12 39.87 1rh8 n ASP 4740CO 0.00 0.00 0.00 0.03 -1.92 0.00 0.00 177.20 175.31 1rh8 h ARG 4741N 0.00 0.11 0.57 -0.67 2.47 -1.95 -3.38 114.38 111.54 1rh8 h ARG 4741Ca -0.34 -0.19 -0.03 0.00 -1.26 0.00 0.00 59.98 58.16 1rh8 h ARG 4741Cb 1.06 0.07 0.01 0.00 -1.65 0.00 0.00 29.97 29.45 1rh8 h ARG 4741CO 0.22 0.93 -0.28 0.74 0.56 0.00 0.00 179.97 182.14 1rh8 h PHE 4742N 0.03 -0.71 0.00 3.04 0.04 -2.03 -3.48 116.94 113.82 1rh8 h PHE 4742Ca -0.18 -0.02 0.00 0.00 2.80 0.00 0.00 57.97 60.57 1rh8 h PHE 4742Cb 1.94 0.24 0.00 0.00 2.20 0.00 0.00 35.95 40.33 1rh8 h PHE 4742CO 0.03 -0.44 0.00 -1.13 -0.60 0.00 0.00 178.31 176.16 1rh8 n SER 4743N -5.22 0.00 -3.08 2.17 3.41 -1.26 -5.15 113.62 104.49 1rh8 n SER 4743Ca -0.10 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.51 1rh8 n SER 4743Cb 0.30 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.25 1rh8 n SER 4743CO 0.00 0.00 0.00 -0.24 -0.16 0.00 0.00 175.04 174.64 1rh8 n SER 4744N 0.00 -1.80 -4.10 4.04 2.88 -1.26 -4.54 113.62 108.84 1rh8 n SER 4744Ca 0.00 0.00 -0.17 0.00 -1.33 0.00 0.00 58.87 57.37 1rh8 n SER 4744Cb 0.00 0.00 -0.13 0.00 -0.75 0.00 0.00 64.21 63.33 1rh8 n SER 4744CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 1rh8 s ASN 4745N -1.98 1.32 -0.01 -3.46 2.20 -1.26 -0.63 114.94 111.11 1rh8 s ASN 4745Ca 0.00 -0.46 0.02 0.00 -0.94 0.00 0.00 52.86 51.49 1rh8 s ASN 4745Cb 0.00 -0.06 -0.03 0.00 -2.00 0.00 0.00 41.25 39.16 1rh8 s ASN 4745CO 0.00 -0.04 -0.05 -0.62 -2.94 0.00 0.00 177.10 173.45 1rh8 s ASP 4746N -1.20 4.73 0.77 3.54 2.15 0.23 -4.84 116.67 122.05 1rh8 s ASP 4746Ca -0.02 -0.10 -0.15 0.00 0.43 0.00 0.00 52.55 52.72 1rh8 s ASP 4746Cb -0.08 -1.15 0.05 0.00 -0.30 0.00 0.00 42.92 41.45 1rh8 s ASP 4746CO 0.01 0.30 1.17 0.33 -0.17 0.00 0.00 175.17 176.81 1rh8 n PHE 4747N 1.64 1.27 0.00 -5.34 7.35 -1.26 -0.18 117.46 120.94 1rh8 n PHE 4747Ca -0.16 0.40 0.00 0.00 -0.76 0.00 0.00 57.45 56.94 1rh8 n PHE 4747Cb 0.53 -2.13 0.00 0.00 0.35 0.00 0.00 39.48 38.23 1rh8 n PHE 4747CO 0.00 0.00 0.00 1.28 -0.76 0.00 0.00 176.76 177.28 1rh8 n LEU 4748N -2.76 0.15 -3.64 -2.13 4.77 0.17 -4.65 117.00 108.92 1rh8 n LEU 4748Ca 0.14 0.00 -0.02 0.00 -0.03 0.00 0.00 56.01 56.10 1rh8 n LEU 4748Cb 0.50 0.00 -0.04 0.00 -2.33 0.00 0.00 43.42 41.54 1rh8 n LEU 4748CO 0.48 0.03 1.15 -0.83 -1.33 0.00 0.00 177.39 176.89 1rh8 s GLY 4749N -1.90 0.11 -0.03 -0.72 0.00 -0.89 -4.46 107.32 99.43 1rh8 s GLY 4749Ca 0.00 2.90 0.00 0.00 0.00 0.00 0.00 44.72 47.62 1rh8 s GLY 4749CO 0.00 1.20 0.00 1.85 0.00 0.00 0.00 173.10 176.15 1rh8 s GLU 4750N -0.90 0.30 0.04 2.90 2.12 -1.02 0.11 118.70 122.24 1rh8 s GLU 4750Ca 0.08 0.09 0.06 0.00 0.36 0.00 0.00 54.97 55.56 1rh8 s GLU 4750Cb -0.01 -0.50 -0.02 0.00 0.26 0.00 0.00 34.13 33.86 1rh8 s GLU 4750CO -0.09 -0.15 -0.17 0.08 -0.54 0.00 0.00 175.26 174.40 1rh8 s VAL 4751N 1.08 1.32 -0.18 3.70 1.01 0.28 0.61 120.40 128.22 1rh8 s VAL 4751Ca -0.09 -1.06 -0.01 0.00 0.00 0.00 0.00 61.98 60.82 1rh8 s VAL 4751Cb -0.13 -1.17 0.00 0.00 0.00 0.00 0.00 36.38 35.07 1rh8 s VAL 4751CO -0.02 0.09 -0.14 -0.76 0.00 0.00 0.00 175.10 174.28 1rh8 s LEU 4752N -1.12 2.48 -0.34 3.92 1.43 -1.26 0.19 118.68 123.98 1rh8 s LEU 4752Ca 0.04 -0.50 0.03 0.00 -1.03 0.00 0.00 54.13 52.67 1rh8 s LEU 4752Cb -0.08 -1.58 0.10 0.00 0.03 0.00 0.00 46.19 44.65 1rh8 s LEU 4752CO 0.01 0.03 0.05 -0.63 0.23 0.00 0.00 176.35 176.05 1rh8 s ILE 4753N 1.12 2.38 -0.07 -0.59 1.01 0.19 -4.98 121.20 120.27 1rh8 s ILE 4753Ca 0.01 -2.24 -0.29 0.00 0.00 0.00 0.00 60.65 58.12 1rh8 s ILE 4753Cb -0.14 -2.71 -0.06 0.00 0.01 0.00 0.00 42.46 39.55 1rh8 s ILE 4753CO -0.05 -0.55 1.81 -1.81 0.00 0.00 0.00 174.94 174.34 1rh8 s ASP 4754N 1.02 6.42 0.00 3.58 1.01 -1.26 -0.44 116.67 127.00 1rh8 s ASP 4754Ca 0.09 2.25 0.24 0.00 0.71 0.00 0.00 52.55 55.84 1rh8 s ASP 4754Cb -0.19 -2.53 1.19 0.00 1.01 0.00 0.00 42.92 42.40 1rh8 s ASP 4754CO -0.07 -1.13 1.78 0.18 0.21 0.00 0.00 175.17 176.14 1rh8 n LEU 4755N 7.95 0.00 0.28 1.23 4.77 -1.06 -2.40 117.00 127.78 1rh8 n LEU 4755Ca 0.20 0.29 0.18 0.00 -0.03 0.00 0.00 56.01 56.65 1rh8 n LEU 4755Cb 0.43 -0.29 0.74 0.00 -2.33 0.00 0.00 43.42 41.97 1rh8 n LEU 4755CO 0.65 -0.06 1.02 0.77 -1.33 0.00 0.00 177.39 178.43 1rh8 h SER 4756N 0.00 0.00 0.00 -1.43 4.64 -1.71 -3.26 113.55 111.79 1rh8 h SER 4756Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1rh8 h SER 4756Cb 0.23 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.32 1rh8 h SER 4756CO 0.00 0.00 -0.27 -0.24 -0.87 0.00 0.00 176.83 175.45 1rh8 n SER 4757N -3.09 0.00 -4.52 4.97 2.88 -1.17 -4.97 113.62 107.72 1rh8 n SER 4757Ca 0.00 -1.54 -0.17 0.00 -1.33 0.00 0.00 58.87 55.83 1rh8 n SER 4757Cb 0.28 -0.11 -0.14 0.00 -0.75 0.00 0.00 64.21 63.49 1rh8 n SER 4757CO 0.00 0.00 0.00 1.07 -1.23 0.00 0.00 175.04 174.88 1rh8 n THR 4758N 0.00 0.00 0.79 2.46 5.66 -1.01 -4.69 114.28 117.49 1rh8 n THR 4758Ca 0.00 -0.48 0.10 0.00 -3.05 0.00 0.00 64.05 60.62 1rh8 n THR 4758Cb 0.61 -1.06 0.46 0.00 -1.55 0.00 0.00 70.33 68.79 1rh8 n THR 4758CO 0.00 0.00 0.00 -1.20 -3.05 0.00 0.00 175.07 170.82 1rh8 n SER 4759N 12.55 0.00 -1.03 1.09 7.64 -1.26 -2.68 113.62 129.93 1rh8 n SER 4759Ca 0.54 0.34 0.05 0.00 1.01 0.00 0.00 58.87 60.81 1rh8 n SER 4759Cb 0.31 -0.43 0.20 0.00 -1.01 0.00 0.00 64.21 63.27 1rh8 n SER 4759CO 0.00 0.00 0.00 1.41 -3.01 0.00 0.00 175.04 173.44 1rh8 n HIS 4760N -1.43 0.87 -0.29 1.43 8.25 -1.26 -4.24 115.22 118.54 1rh8 n HIS 4760Ca 0.06 -0.34 -0.06 0.00 -0.26 0.00 0.00 57.72 57.13 1rh8 n HIS 4760Cb 0.21 -0.19 0.07 0.00 1.12 0.00 0.00 29.99 31.21 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 2.21 1.11 -4.53 2.41 3.38 -1.59 -2.79 115.31 115.51 1rh8 h LEU 4761Ca 0.00 -0.17 -0.10 0.00 0.09 0.00 0.00 57.88 57.69 1rh8 h LEU 4761Cb 0.97 -0.29 -0.03 0.00 0.09 0.00 0.00 40.66 41.40 1rh8 h LEU 4761CO 0.15 0.98 0.13 0.47 0.09 0.00 0.00 178.44 180.26 1rh8 n ASP 4762N -4.27 2.68 -3.96 -0.43 9.92 -1.25 -3.23 116.55 116.00 1rh8 n ASP 4762Ca 0.07 -2.00 -0.34 0.00 -0.53 0.00 0.00 54.79 51.99 1rh8 n ASP 4762Cb 0.19 -0.72 -0.00 0.00 -0.64 0.00 0.00 41.12 39.95 1rh8 n ASP 4762CO 0.00 0.00 0.00 -3.20 0.13 0.00 0.00 177.20 174.13 1rh8 n ASN 4763N 2.80 -2.69 -4.29 -2.24 5.15 -0.72 -4.93 115.26 108.34 1rh8 n ASN 4763Ca 0.22 -1.13 -0.40 0.00 -0.60 0.00 0.00 54.58 52.67 1rh8 n ASN 4763Cb 0.45 -2.56 -0.10 0.00 -0.53 0.00 0.00 39.78 37.03 1rh8 n ASN 4763CO 0.00 0.00 0.00 -0.89 1.40 0.00 0.00 177.26 177.77 1rh8 s THR 4764N -3.75 4.26 -0.39 -0.44 2.01 -1.06 -4.93 115.64 111.34 1rh8 s THR 4764Ca 0.28 -1.28 -0.29 0.00 0.31 0.00 0.00 61.69 60.72 1rh8 s THR 4764Cb -0.13 -3.55 0.00 0.00 0.01 0.00 0.00 72.50 68.84 1rh8 s THR 4764CO 0.92 -0.43 1.46 -2.16 -0.69 0.00 0.00 174.62 173.72 1rh8 s PRO 4765N 1.45 3.58 0.21 4.92 0.04 -1.26 -4.32 135.00 139.61 1rh8 s PRO 4765Ca 0.02 1.05 0.04 0.00 0.04 0.00 0.00 61.00 62.16 1rh8 s PRO 4765Cb -0.22 -4.04 -0.05 0.00 0.04 0.00 0.00 34.50 30.23 1rh8 s PRO 4765CO 0.03 -1.56 -0.05 1.03 0.04 0.00 0.00 177.00 176.49 1rh8 s ARG 4766N 4.96 1.27 -0.24 4.56 1.81 -0.91 -4.93 118.95 125.47 1rh8 s ARG 4766Ca 0.64 -1.61 -0.13 0.00 -1.72 0.00 0.00 55.73 52.91 1rh8 s ARG 4766Cb -0.15 -0.72 -0.05 0.00 -0.45 0.00 0.00 34.95 33.58 1rh8 s ARG 4766CO 0.32 -0.01 0.26 -1.58 -0.68 0.00 0.00 175.30 173.61 1rh8 s TRP 4767N -3.31 3.31 -0.16 -0.53 0.52 -1.26 -2.06 118.94 115.45 1rh8 s TRP 4767Ca 0.24 0.35 -0.06 0.00 0.02 0.00 0.00 56.10 56.66 1rh8 s TRP 4767Cb 0.04 -2.40 -0.04 0.00 -1.15 0.00 0.00 33.47 29.93 1rh8 s TRP 4767CO 0.06 -0.02 0.03 0.71 0.02 0.00 0.00 176.95 177.75 1rh8 s TYR 4768N 1.36 3.19 0.06 -1.98 1.51 0.32 -4.87 117.35 116.94 1rh8 s TYR 4768Ca 0.12 0.02 -0.31 0.00 -1.01 0.00 0.00 57.07 55.89 1rh8 s TYR 4768Cb -0.14 -1.99 -0.07 0.00 -0.11 0.00 0.00 41.96 39.65 1rh8 s TYR 4768CO 0.07 0.18 1.36 -1.25 -1.11 0.00 0.00 175.55 174.81 1rh8 s PRO 4769N 0.10 4.32 0.40 -1.71 0.04 -1.26 0.09 135.00 136.98 1rh8 s PRO 4769Ca 0.03 1.98 -0.11 0.00 0.04 0.00 0.00 61.00 62.94 1rh8 s PRO 4769Cb -0.13 -3.40 -0.07 0.00 0.04 0.00 0.00 34.50 30.95 1rh8 s PRO 4769CO 0.01 -0.46 0.77 -0.51 0.04 0.00 0.00 177.00 176.85 1rh8 s LEU 4770N 1.63 3.84 0.52 -3.56 1.43 -1.09 -4.57 118.68 116.88 1rh8 s LEU 4770Ca 0.63 1.15 0.01 0.00 -1.03 0.00 0.00 54.13 54.89 1rh8 s LEU 4770Cb -0.33 -4.03 -0.00 0.00 0.03 0.00 0.00 46.19 41.86 1rh8 s LEU 4770CO 0.28 -0.39 0.02 -0.54 0.23 0.00 0.00 176.35 175.95 1rh8 s LYS 4771N -3.80 2.21 0.31 1.70 1.02 0.20 -4.79 119.74 116.59 1rh8 s LYS 4771Ca 0.51 -2.43 0.03 0.00 0.02 0.00 0.00 55.97 54.11 1rh8 s LYS 4771Cb -0.10 -1.42 -0.03 0.00 -0.52 0.00 0.00 37.83 35.77 1rh8 s LYS 4771CO 0.31 -0.43 0.48 -1.21 -0.92 0.00 0.00 175.35 173.58 1rh8 s GLU 4772N -3.88 3.37 -0.21 1.68 2.02 -1.26 -2.44 118.70 117.98 1rh8 s GLU 4772Ca 0.03 -0.62 -0.13 0.00 0.02 0.00 0.00 54.97 54.27 1rh8 s GLU 4772Cb 0.00 -2.76 -0.04 0.00 0.10 0.00 0.00 34.13 31.42 1rh8 s GLU 4772CO 0.02 0.20 0.27 -0.65 0.02 0.00 0.00 175.26 175.13 1rh8 s GLN 4773N -4.19 4.14 0.46 1.61 -0.21 -1.26 -4.91 119.66 115.30 1rh8 s GLN 4773Ca 0.39 -0.03 -0.23 0.00 0.02 0.00 0.00 55.36 55.52 1rh8 s GLN 4773Cb -0.09 -3.52 -0.07 0.00 1.00 0.00 0.00 33.01 30.32 1rh8 s GLN 4773CO 0.33 0.05 1.16 0.99 -2.12 0.00 0.00 175.29 175.69 1rh8 s THR 4774N 1.06 3.16 -0.47 -0.19 2.01 -1.26 -5.00 115.64 114.95 1rh8 s THR 4774Ca 0.13 0.86 -0.12 0.00 0.31 0.00 0.00 61.69 62.88 1rh8 s THR 4774Cb -0.14 -3.44 0.10 0.00 0.01 0.00 0.00 72.50 69.03 1rh8 s THR 4774CO 0.06 -0.01 0.36 -1.61 -0.69 0.00 0.00 174.62 172.72 1rh8 s GLU 4775N -2.70 2.74 0.00 4.92 2.02 -1.26 -5.28 118.70 119.14 1rh8 s GLU 4775Ca 0.63 -1.57 0.00 0.00 0.02 0.00 0.00 54.97 54.05 1rh8 s GLU 4775Cb -0.28 -4.01 0.00 0.00 0.10 0.00 0.00 34.13 29.94 1rh8 s GLU 4775CO 0.34 -1.11 0.00 0.45 0.02 0.00 0.00 175.26 174.95