#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1rpq s PRO 5 N 0.00 4.02 -0.11 1.64 0.04 -1.26 -5.00 135.00 134.33 1rpq s PRO 5 Ca 0.00 0.97 -0.05 0.00 0.04 0.00 0.00 61.00 61.95 1rpq s PRO 5 Cb 0.00 -2.17 0.05 0.00 0.04 0.00 0.00 34.50 32.42 1rpq s PRO 5 CO 0.00 -0.18 0.26 0.21 0.04 0.00 0.00 177.00 177.33 1rpq s LYS 6 N -3.80 0.21 0.27 4.56 2.20 -1.26 -4.17 119.74 117.75 1rpq s LYS 6 Ca 0.59 0.59 -0.29 0.00 -0.36 0.00 0.00 55.97 56.51 1rpq s LYS 6 Cb -0.10 -0.10 -0.09 0.00 -1.51 0.00 0.00 37.83 36.03 1rpq s LYS 6 CO 0.26 -0.19 0.94 0.08 -0.36 0.00 0.00 175.35 176.09 1rpq s VAL 7 N 1.50 4.10 0.07 4.02 1.01 -1.26 -1.32 120.40 128.53 1rpq s VAL 7 Ca -0.07 1.99 0.04 0.00 0.00 0.00 0.00 61.98 63.94 1rpq s VAL 7 Cb -0.11 -4.21 -0.03 0.00 0.00 0.00 0.00 36.38 32.03 1rpq s VAL 7 CO -0.09 0.37 -0.12 -0.94 0.00 0.00 0.00 175.10 174.32 1rpq s SER 8 N -1.32 1.48 0.09 3.32 1.04 0.33 -4.93 113.70 113.70 1rpq s SER 8 Ca 0.44 -0.64 0.05 0.00 0.48 0.00 0.00 55.95 56.28 1rpq s SER 8 Cb -0.24 -0.02 -0.04 0.00 0.10 0.00 0.00 66.02 65.82 1rpq s SER 8 CO 0.29 -0.14 -0.02 -0.76 0.98 0.00 0.00 173.24 173.60 1rpq s LEU 9 N -1.86 3.38 -0.25 2.42 1.43 -1.26 0.10 118.68 122.65 1rpq s LEU 9 Ca -0.02 -0.21 -0.02 0.00 -1.03 0.00 0.00 54.13 52.85 1rpq s LEU 9 Cb -0.09 -2.12 0.12 0.00 0.03 0.00 0.00 46.19 44.14 1rpq s LEU 9 CO 0.02 0.18 0.30 0.21 0.23 0.00 0.00 176.35 177.29 1rpq s ASN 10 N -2.27 1.04 0.89 2.29 2.47 -0.76 -3.03 114.94 115.56 1rpq s ASN 10 Ca 0.25 -0.24 -0.11 0.00 0.42 0.00 0.00 52.86 53.18 1rpq s ASN 10 Cb -0.12 0.70 0.13 0.00 -1.45 0.00 0.00 41.25 40.51 1rpq s ASN 10 CO 0.17 -0.34 1.16 -2.84 -3.72 0.00 0.00 177.10 171.53 1rpq s PRO 11 N 2.42 1.17 0.00 0.43 0.02 -1.26 -2.38 135.00 135.40 1rpq s PRO 11 Ca 0.10 1.58 0.04 0.00 0.02 0.00 0.00 61.00 62.74 1rpq s PRO 11 Cb -0.15 -1.74 0.20 0.00 0.02 0.00 0.00 34.50 32.83 1rpq s PRO 11 CO -0.20 -2.53 1.02 -2.30 -0.33 0.00 0.00 177.00 172.66 1rpq n PRO 12 N -4.04 0.04 -2.25 5.54 -0.02 -1.17 -4.78 135.00 128.32 1rpq n PRO 12 Ca 0.12 0.31 -0.43 0.00 -2.02 0.00 0.00 63.50 61.48 1rpq n PRO 12 Cb 0.52 -1.50 -0.02 0.00 -0.02 0.00 0.00 33.50 32.47 1rpq n PRO 12 CO 0.00 0.00 0.00 -1.58 1.98 0.00 0.00 175.50 175.90 1rpq s TRP 13 N -2.72 2.30 -0.21 6.00 0.23 -1.26 -4.77 118.94 118.51 1rpq s TRP 13 Ca 0.03 0.68 0.24 0.00 -2.03 0.00 0.00 56.10 55.02 1rpq s TRP 13 Cb 0.03 -4.09 0.60 0.00 0.03 0.00 0.00 33.47 30.04 1rpq s TRP 13 CO 0.07 -2.33 1.69 -2.95 0.96 0.00 0.00 176.95 174.39 1rpq h ASN 14 N 10.66 0.00 -3.33 2.95 -1.07 -1.86 -3.41 115.58 119.51 1rpq h ASN 14 Ca -0.30 0.00 -0.61 0.00 0.07 0.00 0.00 56.30 55.46 1rpq h ASN 14 Cb 1.13 0.00 -0.15 0.00 -2.07 0.00 0.00 38.32 37.23 1rpq h ASN 14 CO 1.04 0.10 -0.54 -0.13 0.07 0.00 0.00 177.43 177.98 1rpq s ARG 15 N -3.33 4.04 0.20 4.14 0.52 -1.26 -0.47 118.95 122.79 1rpq s ARG 15 Ca 0.04 -0.30 -0.09 0.00 -0.52 0.00 0.00 55.73 54.86 1rpq s ARG 15 Cb 0.07 -3.31 -0.01 0.00 0.52 0.00 0.00 34.95 32.21 1rpq s ARG 15 CO 0.65 0.24 0.32 0.96 0.02 0.00 0.00 175.30 177.49 1rpq s ILE 16 N 0.49 0.03 0.45 1.52 -4.36 -0.60 -4.90 121.20 113.83 1rpq s ILE 16 Ca 0.05 -1.54 -0.08 0.00 -0.26 0.00 0.00 60.65 58.82 1rpq s ILE 16 Cb -0.12 -2.13 -0.05 0.00 1.25 0.00 0.00 42.46 41.41 1rpq s ILE 16 CO 0.00 -0.12 0.79 -0.36 0.24 0.00 0.00 174.94 175.49 1rpq s PHE 17 N -4.03 3.52 -0.07 1.37 2.99 -1.26 -0.14 117.98 120.36 1rpq s PHE 17 Ca 0.24 0.94 -0.30 0.00 0.00 0.00 0.00 56.93 57.82 1rpq s PHE 17 Cb 0.03 -2.39 -0.06 0.00 0.00 0.00 0.00 43.02 40.60 1rpq s PHE 17 CO 0.06 -0.22 1.72 0.21 -0.00 0.00 0.00 175.22 177.00 1rpq s LYS 18 N -4.34 4.08 0.00 0.44 2.20 0.44 -1.77 119.74 120.79 1rpq s LYS 18 Ca 0.49 2.18 0.00 0.00 -0.36 0.00 0.00 55.97 58.28 1rpq s LYS 18 Cb -0.10 -4.04 0.00 0.00 -1.51 0.00 0.00 37.83 32.18 1rpq s LYS 18 CO 0.39 -0.98 0.00 0.41 -0.36 0.00 0.00 175.35 174.81 1rpq n GLY 19 N 4.34 1.30 3.94 5.54 0.00 0.64 -4.92 105.19 116.04 1rpq n GLY 19 Ca 0.18 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.92 1rpq n GLY 19 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1rpq s GLU 20 N -0.43 0.97 0.06 1.61 2.02 -0.73 -3.93 118.70 118.26 1rpq s GLU 20 Ca 0.00 -0.49 0.08 0.00 0.02 0.00 0.00 54.97 54.58 1rpq s GLU 20 Cb 0.00 -1.95 -0.03 0.00 0.10 0.00 0.00 34.13 32.25 1rpq s GLU 20 CO 0.00 -2.15 -0.24 -0.80 0.02 0.00 0.00 175.26 172.10 1rpq s ASN 21 N -4.83 2.83 0.01 -0.19 0.01 -1.26 -1.21 114.94 110.31 1rpq s ASN 21 Ca 0.71 -0.58 -0.13 0.00 -0.71 0.00 0.00 52.86 52.16 1rpq s ASN 21 Cb -0.05 -0.24 0.02 0.00 0.41 0.00 0.00 41.25 41.39 1rpq s ASN 21 CO 0.51 0.20 0.27 0.54 -1.51 0.00 0.00 177.10 177.10 1rpq s VAL 22 N -0.85 0.08 -0.14 1.60 0.11 -0.77 -4.68 120.40 115.75 1rpq s VAL 22 Ca 0.10 -0.63 -0.01 0.00 -2.93 0.00 0.00 61.98 58.51 1rpq s VAL 22 Cb -0.09 -0.73 0.04 0.00 -1.53 0.00 0.00 36.38 34.06 1rpq s VAL 22 CO 0.02 -0.35 -0.03 -0.89 -3.33 0.00 0.00 175.10 170.53 1rpq s THR 23 N -1.89 0.83 -0.09 5.04 2.01 -1.00 -0.19 115.64 120.35 1rpq s THR 23 Ca -0.10 -0.39 -0.19 0.00 0.31 0.00 0.00 61.69 61.32 1rpq s THR 23 Cb -0.04 -1.03 -0.04 0.00 0.01 0.00 0.00 72.50 71.40 1rpq s THR 23 CO 0.00 0.15 0.52 -0.76 -0.69 0.00 0.00 174.62 173.84 1rpq s LEU 24 N 1.76 4.30 -0.09 4.42 1.43 -0.42 -1.84 118.68 128.24 1rpq s LEU 24 Ca 0.02 0.92 0.03 0.00 -1.03 0.00 0.00 54.13 54.06 1rpq s LEU 24 Cb -0.14 -2.78 -0.01 0.00 0.03 0.00 0.00 46.19 43.28 1rpq s LEU 24 CO -0.07 0.00 -0.18 -0.89 0.23 0.00 0.00 176.35 175.44 1rpq s THR 25 N 0.52 2.68 -0.05 5.49 2.01 0.12 -0.56 115.64 125.84 1rpq s THR 25 Ca 0.28 -0.82 -0.19 0.00 0.31 0.00 0.00 61.69 61.27 1rpq s THR 25 Cb -0.16 -2.06 -0.05 0.00 0.01 0.00 0.00 72.50 70.24 1rpq s THR 25 CO 0.12 0.55 0.55 0.00 -0.69 0.00 0.00 174.62 175.16 1rpq n ASN 27 N 3.07 0.00 -4.55 0.00 5.15 -0.43 -4.72 115.26 113.77 1rpq n ASN 27 Ca -0.07 0.00 -0.37 0.00 -0.60 0.00 0.00 54.58 53.54 1rpq n ASN 27 Cb 0.51 0.00 -0.03 0.00 -0.53 0.00 0.00 39.78 39.73 1rpq n ASN 27 CO 0.00 0.00 0.00 -0.83 1.40 0.00 0.00 177.26 177.83 1rpq s GLY 28 N 0.00 -0.22 -0.31 8.20 0.00 -1.26 -4.91 107.32 108.82 1rpq s GLY 28 Ca 0.00 -0.06 -0.00 0.00 0.00 0.00 0.00 44.72 44.66 1rpq s GLY 28 CO 0.00 3.96 0.09 -1.31 0.00 0.00 0.00 173.10 175.83 1rpq s ASN 29 N 10.98 4.10 -0.02 1.64 0.01 -1.26 -5.00 114.94 125.39 1rpq s ASN 29 Ca 0.91 -1.68 0.00 0.00 -0.71 0.00 0.00 52.86 51.38 1rpq s ASN 29 Cb -0.17 -0.96 0.04 0.00 0.41 0.00 0.00 41.25 40.56 1rpq s ASN 29 CO 0.26 -0.41 0.94 0.59 -1.51 0.00 0.00 177.10 176.97 1rpq n ASN 30 N 4.77 2.62 -4.57 -1.22 3.02 -1.26 -4.83 115.26 113.79 1rpq n ASN 30 Ca -0.02 -2.08 -0.42 0.00 -0.03 0.00 0.00 54.58 52.04 1rpq n ASN 30 Cb 0.42 -0.52 -0.06 0.00 -0.61 0.00 0.00 39.78 39.02 1rpq n ASN 30 CO 0.00 0.00 0.00 0.72 -2.62 0.00 0.00 177.26 175.36 1rpq s PHE 31 N -0.39 3.11 -0.77 3.10 -0.12 -1.26 -5.18 117.98 116.48 1rpq s PHE 31 Ca 0.03 0.43 -0.17 0.00 -0.05 0.00 0.00 56.93 57.17 1rpq s PHE 31 Cb 0.02 -3.34 -0.19 0.00 -0.63 0.00 0.00 43.02 38.89 1rpq s PHE 31 CO 0.01 -0.73 2.01 1.97 -0.05 0.00 0.00 175.22 178.43 1rpq n PHE 32 N 6.32 0.60 0.00 3.49 1.16 -1.26 -5.14 117.46 122.62 1rpq n PHE 32 Ca 0.01 -0.05 0.00 0.00 -1.87 0.00 0.00 57.45 55.55 1rpq n PHE 32 Cb 0.48 -1.72 0.00 0.00 -1.61 0.00 0.00 39.48 36.64 1rpq n PHE 32 CO 0.00 0.00 0.00 0.28 -1.87 0.00 0.00 176.76 175.17 1rpq n VAL 34 N 7.29 0.00 0.00 1.97 0.31 -1.26 -5.30 118.33 121.34 1rpq n VAL 34 Ca 0.41 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.74 1rpq n VAL 34 Cb 0.38 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 33.31 1rpq n VAL 34 CO 0.00 0.00 0.00 -1.54 -1.32 0.00 0.00 176.83 173.97 1rpq n SER 35 N 0.00 0.00 -3.59 4.52 3.41 -1.26 -5.17 113.62 111.53 1rpq n SER 35 Ca 0.00 0.00 -0.04 0.00 -0.26 0.00 0.00 58.87 58.57 1rpq n SER 35 Cb 0.00 0.32 -0.02 0.00 -0.26 0.00 0.00 64.21 64.25 1rpq n SER 35 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 1rpq s SER 36 N -0.72 -0.16 -0.03 4.04 1.04 -1.26 -5.15 113.70 111.46 1rpq s SER 36 Ca 0.00 -0.03 -0.01 0.00 0.48 0.00 0.00 55.95 56.39 1rpq s SER 36 Cb 0.00 0.19 0.03 0.00 0.10 0.00 0.00 66.02 66.34 1rpq s SER 36 CO 0.00 -0.31 0.05 -0.89 0.98 0.00 0.00 173.24 173.07 1rpq s THR 37 N -2.55 -0.09 -0.17 2.02 2.01 -0.85 -4.60 115.64 111.42 1rpq s THR 37 Ca 0.09 0.36 -0.12 0.00 0.31 0.00 0.00 61.69 62.34 1rpq s THR 37 Cb -0.00 -0.13 -0.05 0.00 0.01 0.00 0.00 72.50 72.33 1rpq s THR 37 CO -0.05 0.15 0.21 -0.54 -0.69 0.00 0.00 174.62 173.70 1rpq s LYS 38 N 1.83 4.14 -0.16 4.92 1.02 0.42 -4.12 119.74 127.78 1rpq s LYS 38 Ca 0.01 -0.05 -0.01 0.00 0.02 0.00 0.00 55.97 55.93 1rpq s LYS 38 Cb -0.12 -3.39 -0.01 0.00 -0.52 0.00 0.00 37.83 33.78 1rpq s LYS 38 CO -0.03 0.33 -0.11 -1.58 -0.92 0.00 0.00 175.35 173.05 1rpq s TRP 39 N 0.22 2.86 -0.29 3.18 0.52 -1.26 -0.09 118.94 124.09 1rpq s TRP 39 Ca 0.13 -0.82 -0.03 0.00 0.02 0.00 0.00 56.10 55.40 1rpq s TRP 39 Cb -0.12 -1.94 0.04 0.00 -1.15 0.00 0.00 33.47 30.30 1rpq s TRP 39 CO 0.02 -0.37 0.00 -0.06 0.02 0.00 0.00 176.95 176.56 1rpq s PHE 40 N 0.81 3.19 -0.39 -1.98 0.40 0.79 0.94 117.98 121.74 1rpq s PHE 40 Ca -0.04 -1.64 -0.09 0.00 -0.60 0.00 0.00 56.93 54.56 1rpq s PHE 40 Cb -0.15 -2.12 0.06 0.00 0.51 0.00 0.00 43.02 41.31 1rpq s PHE 40 CO 0.01 -0.75 0.22 -1.58 0.70 0.00 0.00 175.22 173.82 1rpq s HIS 41 N 1.31 3.30 -1.10 0.36 2.46 0.32 -1.85 115.29 120.08 1rpq s HIS 41 Ca -0.03 -1.36 -0.02 0.00 0.47 0.00 0.00 55.06 54.12 1rpq s HIS 41 Cb -0.19 -2.70 0.00 0.00 -0.13 0.00 0.00 32.58 29.56 1rpq s HIS 41 CO -0.01 -0.78 0.24 0.09 -2.47 0.00 0.00 174.74 171.81 1rpq n ASN 42 N 4.92 -4.48 0.00 9.88 3.02 -0.40 -2.77 115.26 125.44 1rpq n ASN 42 Ca -0.11 -0.12 0.00 0.00 -0.03 0.00 0.00 54.58 54.32 1rpq n ASN 42 Cb 0.44 -3.47 0.00 0.00 -0.61 0.00 0.00 39.78 36.14 1rpq n ASN 42 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1rpq n GLY 43 N -1.17 2.79 3.79 7.41 0.00 -1.26 -5.03 105.19 111.72 1rpq n GLY 43 Ca -0.11 -0.03 -0.36 0.00 0.00 0.00 0.00 46.02 45.52 1rpq n GLY 43 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1rpq s SER 44 N 0.59 6.95 -0.09 1.61 0.01 -1.11 -4.96 113.70 116.69 1rpq s SER 44 Ca 0.00 1.89 -0.29 0.00 1.31 0.00 0.00 55.95 58.87 1rpq s SER 44 Cb 0.00 -2.57 -0.02 0.00 0.21 0.00 0.00 66.02 63.64 1rpq s SER 44 CO 0.00 -0.35 0.96 -0.22 0.41 0.00 0.00 173.24 174.04 1rpq s LEU 45 N -2.63 4.26 0.38 2.44 2.96 -1.26 -0.52 118.68 124.30 1rpq s LEU 45 Ca 0.57 1.48 -0.12 0.00 -0.22 0.00 0.00 54.13 55.85 1rpq s LEU 45 Cb -0.18 -3.48 -0.07 0.00 0.50 0.00 0.00 46.19 42.96 1rpq s LEU 45 CO 0.23 -0.39 0.76 -0.55 -1.32 0.00 0.00 176.35 175.08 1rpq s SER 46 N 1.07 6.59 0.00 3.68 0.15 0.27 -4.92 113.70 120.54 1rpq s SER 46 Ca 0.47 1.17 0.00 0.00 0.70 0.00 0.00 55.95 58.29 1rpq s SER 46 Cb -0.18 -2.33 0.00 0.00 -1.71 0.00 0.00 66.02 61.79 1rpq s SER 46 CO 0.19 -0.34 0.62 -0.62 1.20 0.00 0.00 173.24 174.29 1rpq n GLU 47 N -1.02 0.70 -3.41 5.44 1.02 -1.26 -4.54 120.64 117.56 1rpq n GLU 47 Ca 0.03 0.00 -0.38 0.00 -0.02 0.00 0.00 57.16 56.78 1rpq n GLU 47 Cb 0.54 -1.08 -0.06 0.00 -0.02 0.00 0.00 31.44 30.82 1rpq n GLU 47 CO 0.00 0.00 0.00 -2.00 1.18 0.00 0.00 177.13 176.31 1rpq s GLU 48 N -1.78 4.03 -0.00 3.49 2.56 -1.26 -4.98 118.70 120.76 1rpq s GLU 48 Ca 0.00 0.54 0.01 0.00 0.00 0.00 0.00 54.97 55.52 1rpq s GLU 48 Cb 0.00 -3.23 -0.01 0.00 2.00 0.00 0.00 34.13 32.89 1rpq s GLU 48 CO 0.00 0.67 0.02 0.25 -0.56 0.00 0.00 175.26 175.64 1rpq n THR 49 N 1.77 0.00 -1.35 -1.70 -2.24 -1.26 -4.12 114.28 105.38 1rpq n THR 49 Ca -0.12 -0.05 -0.30 0.00 -2.27 0.00 0.00 64.05 61.31 1rpq n THR 49 Cb 0.52 0.52 0.11 0.00 -2.10 0.00 0.00 70.33 69.38 1rpq n THR 49 CO 0.00 0.00 0.00 0.20 -0.57 0.00 0.00 175.07 174.70 1rpq s ASN 50 N -2.01 4.00 0.00 3.42 0.01 -1.26 -2.00 114.94 117.10 1rpq s ASN 50 Ca -0.00 1.45 0.21 0.00 -0.71 0.00 0.00 52.86 53.81 1rpq s ASN 50 Cb 0.00 -2.16 1.03 0.00 0.41 0.00 0.00 41.25 40.54 1rpq s ASN 50 CO 0.03 -2.30 1.69 -1.54 -1.51 0.00 0.00 177.10 173.47 1rpq n SER 51 N -3.66 0.00 -3.89 -1.22 3.41 -1.26 -4.56 113.62 102.44 1rpq n SER 51 Ca 0.07 0.14 -0.28 0.00 -0.26 0.00 0.00 58.87 58.54 1rpq n SER 51 Cb 0.55 -0.35 -0.17 0.00 -0.26 0.00 0.00 64.21 63.99 1rpq n SER 51 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 1rpq s SER 52 N -2.70 2.69 -0.27 4.04 0.01 -1.26 0.96 113.70 117.17 1rpq s SER 52 Ca 0.17 -0.59 -0.16 0.00 1.31 0.00 0.00 55.95 56.69 1rpq s SER 52 Cb 0.14 -0.89 -0.03 0.00 0.21 0.00 0.00 66.02 65.45 1rpq s SER 52 CO 0.35 -0.17 0.44 -0.22 0.41 0.00 0.00 173.24 174.04 1rpq s LEU 53 N 1.65 4.05 -0.31 2.44 2.96 0.27 -4.94 118.68 124.81 1rpq s LEU 53 Ca 0.02 0.38 -0.15 0.00 -0.22 0.00 0.00 54.13 54.16 1rpq s LEU 53 Cb -0.15 -2.53 -0.03 0.00 0.50 0.00 0.00 46.19 43.99 1rpq s LEU 53 CO -0.08 -0.23 0.36 0.20 -1.32 0.00 0.00 176.35 175.28 1rpq s ASN 54 N 1.60 6.20 -0.22 3.68 0.01 -1.26 -1.30 114.94 123.64 1rpq s ASN 54 Ca 0.18 0.02 -0.11 0.00 -0.71 0.00 0.00 52.86 52.24 1rpq s ASN 54 Cb -0.16 -2.20 -0.05 0.00 0.41 0.00 0.00 41.25 39.25 1rpq s ASN 54 CO 0.10 -0.25 0.16 -0.63 -1.51 0.00 0.00 177.10 174.96 1rpq s ILE 55 N 2.04 5.37 0.00 0.60 1.01 0.73 -5.01 121.20 125.94 1rpq s ILE 55 Ca 0.13 0.20 0.06 0.00 0.00 0.00 0.00 60.65 61.04 1rpq s ILE 55 Cb -0.16 -3.50 -0.02 0.00 0.01 0.00 0.00 42.46 38.79 1rpq s ILE 55 CO 0.11 0.38 -0.18 -0.69 0.00 0.00 0.00 174.94 174.56 1rpq s VAL 56 N 0.81 1.43 -1.59 2.92 1.01 -1.26 -1.85 120.40 121.87 1rpq s VAL 56 Ca 0.08 -0.87 -0.15 0.00 0.00 0.00 0.00 61.98 61.03 1rpq s VAL 56 Cb -0.13 -1.21 0.11 0.00 0.00 0.00 0.00 36.38 35.15 1rpq s VAL 56 CO 0.02 0.32 0.93 0.59 0.00 0.00 0.00 175.10 176.96 1rpq n ASN 57 N 2.41 -4.35 -1.63 3.32 3.02 -1.12 -4.74 115.26 112.16 1rpq n ASN 57 Ca -0.16 -0.85 -0.22 0.00 -0.03 0.00 0.00 54.58 53.32 1rpq n ASN 57 Cb 0.54 -3.52 -0.03 0.00 -0.61 0.00 0.00 39.78 36.16 1rpq n ASN 57 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1rpq n ALA 58 N -4.59 -1.48 -2.58 5.41 0.00 -0.35 -4.07 120.51 112.85 1rpq n ALA 58 Ca 0.05 0.21 -0.23 0.00 0.00 0.00 0.00 53.44 53.47 1rpq n ALA 58 Cb 0.51 -0.64 -0.07 0.00 0.00 0.00 0.00 19.45 19.25 1rpq n ALA 58 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 1rpq s LYS 59 N 0.15 2.27 0.28 0.00 1.02 -1.26 -0.26 119.74 121.93 1rpq s LYS 59 Ca 0.33 -1.52 0.00 0.00 0.02 0.00 0.00 55.97 54.80 1rpq s LYS 59 Cb -0.47 -2.12 0.52 0.00 -0.52 0.00 0.00 37.83 35.25 1rpq s LYS 59 CO 0.22 0.25 1.84 0.74 -0.92 0.00 0.00 175.35 177.47 1rpq h PHE 60 N 1.78 1.12 -1.05 3.18 -1.00 -1.93 -0.22 116.94 118.81 1rpq h PHE 60 Ca -0.44 0.03 0.28 0.00 2.81 0.00 0.00 57.97 60.66 1rpq h PHE 60 Cb 1.25 -0.36 -0.08 0.00 3.61 0.00 0.00 35.95 40.38 1rpq h PHE 60 CO 0.67 0.46 0.71 0.93 -1.61 0.00 0.00 178.31 179.47 1rpq h GLU 61 N 0.99 0.25 0.00 1.51 3.07 -1.96 0.14 114.58 118.58 1rpq h GLU 61 Ca 0.48 -0.02 0.00 0.00 -0.50 0.00 0.00 59.36 59.33 1rpq h GLU 61 Cb 0.44 -0.06 0.00 0.00 -0.84 0.00 0.00 28.75 28.30 1rpq h GLU 61 CO -0.26 0.17 0.00 -0.25 -1.40 0.00 0.00 179.01 177.27 1rpq n ASP 62 N -4.48 0.08 -4.67 1.42 8.00 -0.09 -4.77 116.55 112.04 1rpq n ASP 62 Ca 0.24 0.52 -0.30 0.00 0.71 0.00 0.00 54.79 55.96 1rpq n ASP 62 Cb 0.97 -0.54 0.16 0.00 -0.02 0.00 0.00 41.12 41.69 1rpq n ASP 62 CO 0.00 0.00 0.00 -0.44 -0.39 0.00 0.00 177.20 176.37 1rpq s SER 63 N -3.15 3.03 0.00 -2.24 0.01 0.48 -4.90 113.70 106.92 1rpq s SER 63 Ca 0.06 1.78 0.00 0.00 1.31 0.00 0.00 55.95 59.10 1rpq s SER 63 Cb 0.09 -2.39 0.00 0.00 0.21 0.00 0.00 66.02 63.93 1rpq s SER 63 CO 0.25 -2.96 0.00 0.61 0.41 0.00 0.00 173.24 171.55 1rpq n GLY 64 N -0.37 0.66 3.77 3.44 0.00 0.58 -4.94 105.19 108.33 1rpq n GLY 64 Ca 0.08 -2.16 -0.39 0.00 0.00 0.00 0.00 46.02 43.56 1rpq n GLY 64 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1rpq s GLU 65 N -0.87 4.32 -0.02 1.61 2.12 -1.26 -0.92 118.70 123.68 1rpq s GLU 65 Ca 0.00 0.78 0.05 0.00 0.36 0.00 0.00 54.97 56.15 1rpq s GLU 65 Cb 0.00 -3.32 -0.01 0.00 0.26 0.00 0.00 34.13 31.06 1rpq s GLU 65 CO 0.00 0.42 -0.15 0.71 -0.54 0.00 0.00 175.26 175.70 1rpq s TYR 66 N -0.38 1.37 0.01 5.30 1.51 0.29 -1.27 117.35 124.19 1rpq s TYR 66 Ca 0.31 -0.28 -0.05 0.00 -1.01 0.00 0.00 57.07 56.05 1rpq s TYR 66 Cb -0.19 -0.89 -0.01 0.00 -0.11 0.00 0.00 41.96 40.77 1rpq s TYR 66 CO 0.18 -0.04 0.08 0.15 -1.11 0.00 0.00 175.55 174.81 1rpq s LYS 67 N -0.29 0.45 0.09 -0.62 1.02 -0.77 -1.69 119.74 117.92 1rpq s LYS 67 Ca 0.04 -0.52 0.07 0.00 0.02 0.00 0.00 55.97 55.58 1rpq s LYS 67 Cb -0.07 0.18 -0.03 0.00 -0.52 0.00 0.00 37.83 37.39 1rpq s LYS 67 CO -0.00 -0.10 -0.17 0.00 -0.92 0.00 0.00 175.35 174.15 1rpq s GLN 69 N -1.81 0.89 0.00 0.00 0.74 0.87 -1.86 119.66 118.49 1rpq s GLN 69 Ca 0.02 -0.20 0.00 0.00 0.05 0.00 0.00 55.36 55.23 1rpq s GLN 69 Cb -0.10 -0.85 0.00 0.00 1.10 0.00 0.00 33.01 33.16 1rpq s GLN 69 CO 0.03 0.02 0.00 0.72 -0.55 0.00 0.00 175.29 175.51 1rpq n HIS 70 N 3.64 0.00 -4.23 1.67 8.25 -1.26 -0.44 115.22 122.84 1rpq n HIS 70 Ca -0.21 0.00 -0.35 0.00 -0.26 0.00 0.00 57.72 56.89 1rpq n HIS 70 Cb 0.53 0.00 -0.08 0.00 1.12 0.00 0.00 29.99 31.55 1rpq n HIS 70 CO 0.00 0.00 0.00 -0.65 0.64 0.00 0.00 176.34 176.33 1rpq s GLN 71 N -0.84 3.10 -1.07 -0.41 -0.21 -1.26 -4.77 119.66 114.19 1rpq s GLN 71 Ca 0.00 -0.35 -0.24 0.00 0.02 0.00 0.00 55.36 54.79 1rpq s GLN 71 Cb 0.00 -2.89 -0.11 0.00 1.00 0.00 0.00 33.01 31.00 1rpq s GLN 71 CO 0.00 0.72 2.02 -0.65 -2.12 0.00 0.00 175.29 175.25 1rpq s GLN 72 N -1.00 2.15 0.26 2.91 -0.21 -1.26 -3.61 119.66 118.90 1rpq s GLN 72 Ca 0.15 -0.70 0.00 0.00 0.02 0.00 0.00 55.36 54.83 1rpq s GLN 72 Cb -0.12 -5.11 0.00 0.00 1.00 0.00 0.00 33.01 28.78 1rpq s GLN 72 CO 0.04 -4.24 0.00 0.28 -2.12 0.00 0.00 175.29 169.25 1rpq n VAL 73 N 8.17 0.00 -3.81 1.09 0.31 -1.26 -5.14 118.33 117.69 1rpq n VAL 73 Ca 0.43 0.00 -0.12 0.00 -0.01 0.00 0.00 64.34 64.64 1rpq n VAL 73 Cb 0.46 -0.21 -0.10 0.00 -0.91 0.00 0.00 33.84 33.09 1rpq n VAL 73 CO 0.00 0.00 0.00 0.20 -1.32 0.00 0.00 176.83 175.71 1rpq s ASN 74 N -3.52 -0.11 0.64 4.52 0.01 -1.24 -5.17 114.94 110.07 1rpq s ASN 74 Ca 0.00 0.04 -0.04 0.00 -0.71 0.00 0.00 52.86 52.16 1rpq s ASN 74 Cb 0.00 0.31 0.05 0.00 0.41 0.00 0.00 41.25 42.01 1rpq s ASN 74 CO 0.00 -0.34 0.92 -1.61 -1.51 0.00 0.00 177.10 174.55 1rpq s GLU 75 N -1.07 2.39 0.65 -0.60 2.02 -1.26 -4.62 118.70 116.21 1rpq s GLU 75 Ca -0.11 -0.42 -0.10 0.00 0.02 0.00 0.00 54.97 54.36 1rpq s GLU 75 Cb -0.06 -2.29 -0.00 0.00 0.10 0.00 0.00 34.13 31.88 1rpq s GLU 75 CO 0.02 -0.99 1.02 -1.54 0.02 0.00 0.00 175.26 173.79 1rpq s SER 76 N -4.46 5.70 0.47 -0.19 1.04 -0.77 -4.69 113.70 110.79 1rpq s SER 76 Ca 0.58 1.08 -0.22 0.00 0.48 0.00 0.00 55.95 57.87 1rpq s SER 76 Cb -0.11 -2.01 -0.07 0.00 0.10 0.00 0.00 66.02 63.93 1rpq s SER 76 CO 0.42 -1.13 1.15 -1.61 0.98 0.00 0.00 173.24 173.06 1rpq s GLU 77 N -5.20 3.71 0.50 4.02 0.41 -1.26 -4.73 118.70 116.15 1rpq s GLU 77 Ca 0.56 1.73 -0.23 0.00 -0.41 0.00 0.00 54.97 56.62 1rpq s GLU 77 Cb -0.11 -2.34 -0.06 0.00 -1.78 0.00 0.00 34.13 29.84 1rpq s GLU 77 CO 0.50 -0.58 1.32 -2.14 -0.49 0.00 0.00 175.26 173.87 1rpq s PRO 78 N -2.80 3.40 -0.10 0.39 0.02 -1.26 -4.66 135.00 129.99 1rpq s PRO 78 Ca 0.65 2.15 0.00 0.00 0.02 0.00 0.00 61.00 63.82 1rpq s PRO 78 Cb -0.27 -2.38 0.02 0.00 0.02 0.00 0.00 34.50 31.90 1rpq s PRO 78 CO 0.33 -0.95 -0.08 0.08 -0.33 0.00 0.00 177.00 176.04 1rpq s VAL 79 N -1.34 1.04 -0.19 3.83 1.01 -0.68 -4.95 120.40 119.11 1rpq s VAL 79 Ca 0.67 -0.32 -0.11 0.00 0.00 0.00 0.00 61.98 62.22 1rpq s VAL 79 Cb -0.38 -1.04 -0.05 0.00 0.00 0.00 0.00 36.38 34.91 1rpq s VAL 79 CO 0.46 0.36 0.18 -0.31 0.00 0.00 0.00 175.10 175.79 1rpq s TYR 80 N 1.51 3.41 -0.11 5.22 1.51 -1.26 -0.54 117.35 127.09 1rpq s TYR 80 Ca 0.01 0.39 0.02 0.00 -1.01 0.00 0.00 57.07 56.48 1rpq s TYR 80 Cb -0.13 -2.22 -0.01 0.00 -0.11 0.00 0.00 41.96 39.49 1rpq s TYR 80 CO -0.06 0.25 -0.18 -1.17 -1.11 0.00 0.00 175.55 173.28 1rpq s LEU 81 N 0.46 2.43 -0.09 -1.29 2.96 -0.10 -4.80 118.68 118.26 1rpq s LEU 81 Ca 0.10 -0.42 0.03 0.00 -0.22 0.00 0.00 54.13 53.62 1rpq s LEU 81 Cb -0.12 -1.51 0.01 0.00 0.50 0.00 0.00 46.19 45.07 1rpq s LEU 81 CO 0.00 0.18 -0.18 -0.70 -1.32 0.00 0.00 176.35 174.33 1rpq s GLU 82 N 0.27 2.35 -0.27 1.98 2.12 0.38 -0.31 118.70 125.22 1rpq s GLU 82 Ca -0.13 -0.63 -0.10 0.00 0.36 0.00 0.00 54.97 54.47 1rpq s GLU 82 Cb -0.16 -1.86 -0.05 0.00 0.26 0.00 0.00 34.13 32.32 1rpq s GLU 82 CO 0.07 0.08 0.16 0.08 -0.54 0.00 0.00 175.26 175.11 1rpq s VAL 83 N 0.57 5.10 0.42 3.70 1.01 -1.26 -1.55 120.40 128.38 1rpq s VAL 83 Ca -0.15 0.10 0.07 0.00 0.00 0.00 0.00 61.98 62.00 1rpq s VAL 83 Cb -0.17 -3.42 -0.03 0.00 0.00 0.00 0.00 36.38 32.77 1rpq s VAL 83 CO 0.05 0.27 0.30 -0.36 0.00 0.00 0.00 175.10 175.36 1rpq s PHE 84 N 1.69 2.62 -0.44 5.22 0.40 0.80 -4.83 117.98 123.44 1rpq s PHE 84 Ca 0.07 -0.55 0.07 0.00 -0.60 0.00 0.00 56.93 55.92 1rpq s PHE 84 Cb -0.16 -2.08 0.24 0.00 0.51 0.00 0.00 43.02 41.54 1rpq s PHE 84 CO 0.09 -0.01 0.71 0.45 0.70 0.00 0.00 175.22 177.16 1rpq n SER 85 N -1.43 -1.49 -4.27 1.36 2.88 -1.26 -0.42 113.62 108.99 1rpq n SER 85 Ca 0.01 -3.00 -0.28 0.00 -1.33 0.00 0.00 58.87 54.27 1rpq n SER 85 Cb 0.63 0.67 -0.08 0.00 -0.75 0.00 0.00 64.21 64.69 1rpq n SER 85 CO 0.00 0.00 0.00 -0.62 -1.23 0.00 0.00 175.04 173.19 1rpq s ASP 86 N -1.36 3.22 0.04 -3.46 -1.08 -1.26 -5.07 116.67 107.70 1rpq s ASP 86 Ca 0.33 -1.70 -0.16 0.00 -0.52 0.00 0.00 52.55 50.51 1rpq s ASP 86 Cb 0.19 0.57 -0.28 0.00 -1.46 0.00 0.00 42.92 41.94 1rpq s ASP 86 CO -0.18 -0.94 1.09 -0.50 0.52 0.00 0.00 175.17 175.16 1rpq h TRP 87 N 1.63 0.96 -4.17 -5.34 4.06 -1.94 -3.40 115.95 107.74 1rpq h TRP 87 Ca -0.37 -0.60 -0.50 0.00 2.06 0.00 0.00 58.89 59.48 1rpq h TRP 87 Cb 1.29 -0.08 -0.27 0.00 -1.00 0.00 0.00 29.16 29.09 1rpq h TRP 87 CO 1.60 1.44 -0.82 -0.51 -3.56 0.00 0.00 178.44 176.60 1rpq s LEU 88 N -7.94 2.09 -0.07 -4.49 1.43 -1.26 -0.72 118.68 107.73 1rpq s LEU 88 Ca -0.10 -0.37 -0.01 0.00 -1.03 0.00 0.00 54.13 52.62 1rpq s LEU 88 Cb 0.05 -0.76 0.03 0.00 0.03 0.00 0.00 46.19 45.54 1rpq s LEU 88 CO 0.92 0.14 0.00 -0.22 0.23 0.00 0.00 176.35 177.42 1rpq s LEU 89 N -0.72 0.59 -0.21 1.79 2.96 0.78 -4.40 118.68 119.47 1rpq s LEU 89 Ca 0.05 -0.09 -0.29 0.00 -0.22 0.00 0.00 54.13 53.58 1rpq s LEU 89 Cb -0.07 -0.44 -0.00 0.00 0.50 0.00 0.00 46.19 46.17 1rpq s LEU 89 CO 0.00 -0.19 1.18 -0.22 -1.32 0.00 0.00 176.35 175.80 1rpq s LEU 90 N 1.97 4.10 -0.05 -0.68 2.96 -1.26 -1.55 118.68 124.17 1rpq s LEU 90 Ca 0.05 1.49 -0.01 0.00 -0.22 0.00 0.00 54.13 55.44 1rpq s LEU 90 Cb -0.12 -3.54 -0.04 0.00 0.50 0.00 0.00 46.19 42.99 1rpq s LEU 90 CO -0.05 -0.78 0.02 -1.10 -1.32 0.00 0.00 176.35 173.12 1rpq s GLN 91 N 3.49 2.95 -0.01 1.98 -0.21 0.62 -4.94 119.66 123.54 1rpq s GLN 91 Ca 0.51 -0.48 0.05 0.00 0.02 0.00 0.00 55.36 55.46 1rpq s GLN 91 Cb -0.18 -2.78 -0.01 0.00 1.00 0.00 0.00 33.01 31.04 1rpq s GLN 91 CO 0.13 0.67 -0.17 0.00 -2.12 0.00 0.00 175.29 173.80 1rpq s ALA 92 N -1.01 1.39 0.55 6.09 0.00 -1.26 -0.80 121.76 126.72 1rpq s ALA 92 Ca 0.17 -0.72 0.29 0.00 0.00 0.00 0.00 51.96 51.69 1rpq s ALA 92 Cb -0.12 -0.35 1.72 0.00 0.00 0.00 0.00 23.12 24.37 1rpq s ALA 92 CO 0.07 0.34 2.21 0.66 0.00 0.00 0.00 175.76 179.04 1rpq h SER 93 N 5.72 0.00 -3.14 0.00 4.64 -1.08 -3.40 113.55 116.29 1rpq h SER 93 Ca -0.36 0.00 0.12 0.00 -0.47 0.00 0.00 61.79 61.08 1rpq h SER 93 Cb 1.15 0.00 -0.27 0.00 -0.31 0.00 0.00 62.40 62.97 1rpq h SER 93 CO 0.48 0.03 0.65 0.00 -0.87 0.00 0.00 176.83 177.13 1rpq s ALA 94 N -4.53 -2.05 -0.34 5.18 0.00 -1.26 -4.86 121.76 113.91 1rpq s ALA 94 Ca -0.04 1.76 0.23 0.00 0.00 0.00 0.00 51.96 53.90 1rpq s ALA 94 Cb 0.15 -1.36 0.01 0.00 0.00 0.00 0.00 23.12 21.91 1rpq s ALA 94 CO 0.56 -0.22 1.01 0.39 0.00 0.00 0.00 175.76 177.50 1rpq n GLU 95 N 1.47 0.51 -3.91 0.00 4.71 -1.26 -4.72 120.64 117.44 1rpq n GLU 95 Ca -0.10 0.05 -0.30 0.00 -0.01 0.00 0.00 57.16 56.80 1rpq n GLU 95 Cb 0.57 -1.72 -0.15 0.00 -1.01 0.00 0.00 31.44 29.12 1rpq n GLU 95 CO 0.00 0.00 0.00 0.08 0.09 0.00 0.00 177.13 177.30 1rpq s VAL 96 N -3.32 1.47 -0.08 2.62 1.01 -1.26 -1.09 120.40 119.75 1rpq s VAL 96 Ca 0.00 -1.34 0.03 0.00 0.00 0.00 0.00 61.98 60.67 1rpq s VAL 96 Cb 0.12 -1.84 -0.02 0.00 0.00 0.00 0.00 36.38 34.64 1rpq s VAL 96 CO 0.80 -0.24 -0.16 -0.69 0.00 0.00 0.00 175.10 174.81 1rpq s VAL 97 N 1.40 2.88 0.07 2.92 1.01 0.43 -5.01 120.40 124.09 1rpq s VAL 97 Ca -0.01 -0.76 -0.24 0.00 0.00 0.00 0.00 61.98 60.96 1rpq s VAL 97 Cb -0.19 -2.14 -0.06 0.00 0.00 0.00 0.00 36.38 33.99 1rpq s VAL 97 CO -0.09 0.57 0.74 -0.04 0.00 0.00 0.00 175.10 176.27 1rpq s MET 98 N -0.28 4.47 -0.34 2.72 -1.94 -1.26 -0.80 119.30 121.86 1rpq s MET 98 Ca 0.02 1.03 -0.37 0.00 -1.71 0.00 0.00 55.69 54.65 1rpq s MET 98 Cb -0.13 -3.33 -0.13 0.00 2.01 0.00 0.00 34.83 33.25 1rpq s MET 98 CO 0.03 0.37 2.08 -1.91 -0.01 0.00 0.00 175.02 175.58 1rpq n GLU 99 N 2.48 1.00 0.00 2.03 2.13 0.17 -2.06 120.64 126.39 1rpq n GLU 99 Ca -0.04 0.30 0.00 0.00 0.66 0.00 0.00 57.16 58.08 1rpq n GLU 99 Cb 0.50 -2.27 0.00 0.00 0.27 0.00 0.00 31.44 29.94 1rpq n GLU 99 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1rpq n GLY 100 N 6.13 1.46 3.96 8.31 0.00 -0.64 -4.97 105.19 119.44 1rpq n GLY 100 Ca 0.39 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 46.19 1rpq n GLY 100 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 1rpq s GLN 101 N 0.00 3.16 0.53 1.61 -2.07 -0.87 -4.48 119.66 117.53 1rpq s GLN 101 Ca 0.00 -0.61 -0.19 0.00 -1.82 0.00 0.00 55.36 52.74 1rpq s GLN 101 Cb 0.00 -2.66 -0.07 0.00 -1.09 0.00 0.00 33.01 29.20 1rpq s GLN 101 CO 0.00 -0.09 1.05 -1.25 -1.32 0.00 0.00 175.29 173.69 1rpq s PRO 102 N -4.39 3.60 -0.09 9.60 0.04 -1.23 -1.57 135.00 140.95 1rpq s PRO 102 Ca 0.45 1.33 0.01 0.00 0.04 0.00 0.00 61.00 62.83 1rpq s PRO 102 Cb -0.10 -2.07 0.02 0.00 0.04 0.00 0.00 34.50 32.40 1rpq s PRO 102 CO 0.35 -0.59 -0.10 -1.17 0.04 0.00 0.00 177.00 175.53 1rpq s LEU 103 N -3.85 1.42 -0.12 -3.56 2.96 -0.13 -4.93 118.68 110.47 1rpq s LEU 103 Ca 0.67 -0.31 0.02 0.00 -0.22 0.00 0.00 54.13 54.28 1rpq s LEU 103 Cb -0.17 -0.86 -0.01 0.00 0.50 0.00 0.00 46.19 45.66 1rpq s LEU 103 CO 0.26 -0.05 -0.18 -0.36 -1.32 0.00 0.00 176.35 174.71 1rpq s PHE 104 N 1.23 2.71 0.00 5.38 0.40 -1.26 -0.40 117.98 126.04 1rpq s PHE 104 Ca -0.04 -0.88 0.08 0.00 -0.60 0.00 0.00 56.93 55.49 1rpq s PHE 104 Cb -0.14 -1.80 -0.02 0.00 0.51 0.00 0.00 43.02 41.57 1rpq s PHE 104 CO -0.03 -0.34 -0.25 -0.51 0.70 0.00 0.00 175.22 174.79 1rpq s LEU 105 N 0.44 2.09 -0.05 -0.37 1.43 -0.26 -0.47 118.68 121.48 1rpq s LEU 105 Ca -0.13 -0.49 -0.01 0.00 -1.03 0.00 0.00 54.13 52.48 1rpq s LEU 105 Cb -0.17 -1.24 0.03 0.00 0.03 0.00 0.00 46.19 44.84 1rpq s LEU 105 CO 0.06 0.28 0.01 -0.60 0.23 0.00 0.00 176.35 176.33 1rpq s ARG 106 N -0.79 0.38 -1.25 1.70 3.52 0.02 -0.81 118.95 121.72 1rpq s ARG 106 Ca 0.10 0.14 -0.12 0.00 -0.13 0.00 0.00 55.73 55.71 1rpq s ARG 106 Cb -0.09 -0.72 0.16 0.00 -1.56 0.00 0.00 34.95 32.74 1rpq s ARG 106 CO 0.00 -0.24 1.63 0.00 -0.81 0.00 0.00 175.30 175.88 1rpq s HIS 108 N 1.38 3.04 -0.06 0.00 2.46 -0.60 -4.81 115.29 116.71 1rpq s HIS 108 Ca 0.43 0.78 -0.09 0.00 0.47 0.00 0.00 55.06 56.65 1rpq s HIS 108 Cb 0.02 -3.77 -0.05 0.00 -0.13 0.00 0.00 32.58 28.66 1rpq s HIS 108 CO 0.01 -2.81 0.23 0.20 -2.47 0.00 0.00 174.74 169.89 1rpq s GLY 109 N 1.39 2.26 0.13 1.59 0.00 -1.26 -0.16 107.32 111.27 1rpq s GLY 109 Ca 0.67 -0.52 -0.35 0.00 0.00 0.00 0.00 44.72 44.52 1rpq s GLY 109 CO 0.30 -0.25 1.24 1.87 0.00 0.00 0.00 173.10 176.26 1rpq n TRP 110 N 1.77 1.36 -1.31 1.90 -0.00 0.10 -0.18 117.44 121.08 1rpq n TRP 110 Ca -0.17 0.67 -0.11 0.00 -0.00 0.00 0.00 57.50 57.90 1rpq n TRP 110 Cb 0.54 -2.30 -0.05 0.00 -0.00 0.00 0.00 31.31 29.51 1rpq n TRP 110 CO 0.00 0.00 0.00 0.54 -0.00 0.00 0.00 177.69 178.23 1rpq n ARG 111 N 2.11 -1.66 -1.00 5.87 1.74 -1.26 -1.36 116.66 121.10 1rpq n ARG 111 Ca 0.17 0.87 0.00 0.00 -0.77 0.00 0.00 57.85 58.12 1rpq n ARG 111 Cb 0.21 -5.27 0.00 0.00 -1.02 0.00 0.00 32.46 26.38 1rpq n ARG 111 CO 0.00 0.00 0.00 -1.71 -1.52 0.00 0.00 177.63 174.40 1rpq n ASN 112 N -1.13 -4.36 -4.67 0.55 2.85 0.75 -4.97 115.26 104.28 1rpq n ASN 112 Ca -0.11 0.00 -0.40 0.00 -0.11 0.00 0.00 54.58 53.97 1rpq n ASN 112 Cb 0.58 -1.88 0.03 0.00 1.24 0.00 0.00 39.78 39.75 1rpq n ASN 112 CO 0.00 0.00 0.00 0.79 -2.11 0.00 0.00 177.26 175.94 1rpq n TRP 113 N -2.54 1.65 -1.77 1.20 8.01 -0.46 -4.88 117.44 118.65 1rpq n TRP 113 Ca 0.00 0.48 -0.41 0.00 -1.31 0.00 0.00 57.50 56.26 1rpq n TRP 113 Cb 0.23 -2.28 -0.00 0.00 -2.01 0.00 0.00 31.31 27.24 1rpq n TRP 113 CO 0.00 0.00 0.00 -0.25 -1.01 0.00 0.00 177.69 176.43 1rpq n ASP 114 N -0.28 3.81 -4.25 -0.99 8.00 -1.26 -4.50 116.55 117.09 1rpq n ASP 114 Ca 0.10 1.21 -0.32 0.00 0.71 0.00 0.00 54.79 56.48 1rpq n ASP 114 Cb 0.43 -1.61 -0.16 0.00 -0.02 0.00 0.00 41.12 39.75 1rpq n ASP 114 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 1rpq s VAL 115 N -0.83 2.29 0.38 2.53 1.01 -1.25 -4.43 120.40 120.09 1rpq s VAL 115 Ca 0.56 -0.94 0.08 0.00 0.00 0.00 0.00 61.98 61.69 1rpq s VAL 115 Cb -0.48 -1.90 -0.06 0.00 0.00 0.00 0.00 36.38 33.94 1rpq s VAL 115 CO 0.60 0.55 0.02 -0.31 0.00 0.00 0.00 175.10 175.96 1rpq s TYR 116 N 0.36 2.52 -1.33 5.22 1.51 0.26 -2.50 117.35 123.39 1rpq s TYR 116 Ca -0.17 -0.55 -0.00 0.00 -1.01 0.00 0.00 57.07 55.34 1rpq s TYR 116 Cb -0.17 -1.64 -0.00 0.00 -0.11 0.00 0.00 41.96 40.03 1rpq s TYR 116 CO 0.08 0.43 0.62 1.63 -1.11 0.00 0.00 175.55 177.21 1rpq n LYS 117 N -0.98 -4.44 -2.64 -0.62 4.76 -0.21 -0.42 118.16 113.61 1rpq n LYS 117 Ca -0.04 0.56 -0.42 0.00 -2.87 0.00 0.00 58.31 55.54 1rpq n LYS 117 Cb 0.64 -5.00 -0.03 0.00 -1.84 0.00 0.00 35.03 28.81 1rpq n LYS 117 CO 0.00 0.00 0.00 0.08 -1.37 0.00 0.00 177.40 176.11 1rpq s VAL 118 N -3.74 4.68 -0.07 -0.18 1.01 -0.76 -4.18 120.40 117.16 1rpq s VAL 118 Ca 0.01 1.94 0.03 0.00 0.00 0.00 0.00 61.98 63.96 1rpq s VAL 118 Cb -0.00 -4.24 0.01 0.00 0.00 0.00 0.00 36.38 32.14 1rpq s VAL 118 CO 0.83 0.06 -0.16 -0.63 0.00 0.00 0.00 175.10 175.20 1rpq s ILE 119 N 1.67 1.41 -0.19 2.22 1.01 -0.48 -1.50 121.20 125.34 1rpq s ILE 119 Ca 0.51 -0.65 -0.08 0.00 0.00 0.00 0.00 60.65 60.44 1rpq s ILE 119 Cb -0.21 -1.25 -0.04 0.00 0.01 0.00 0.00 42.46 40.97 1rpq s ILE 119 CO 0.22 0.41 0.08 -0.31 0.00 0.00 0.00 174.94 175.34 1rpq s TYR 120 N 0.48 3.26 0.16 3.97 1.51 -0.76 -1.24 117.35 124.73 1rpq s TYR 120 Ca -0.14 0.07 0.08 0.00 -1.01 0.00 0.00 57.07 56.08 1rpq s TYR 120 Cb -0.16 -2.11 -0.04 0.00 -0.11 0.00 0.00 41.96 39.54 1rpq s TYR 120 CO 0.05 0.12 -0.07 0.71 -1.11 0.00 0.00 175.55 175.25 1rpq s TYR 121 N 0.51 2.71 -0.08 2.71 1.51 0.20 0.39 117.35 125.30 1rpq s TYR 121 Ca 0.04 -0.18 -0.02 0.00 -1.01 0.00 0.00 57.07 55.89 1rpq s TYR 121 Cb -0.13 -1.34 0.03 0.00 -0.11 0.00 0.00 41.96 40.42 1rpq s TYR 121 CO 0.01 0.49 0.04 0.21 -1.11 0.00 0.00 175.55 175.19 1rpq s LYS 122 N -2.72 0.27 -1.47 -0.62 2.20 0.68 -1.63 119.74 116.46 1rpq s LYS 122 Ca 0.25 0.16 -0.05 0.00 -0.36 0.00 0.00 55.97 55.96 1rpq s LYS 122 Cb -0.09 -0.97 0.02 0.00 -1.51 0.00 0.00 37.83 35.28 1rpq s LYS 122 CO 0.16 -0.38 0.51 -0.25 -0.36 0.00 0.00 175.35 175.02 1rpq n ASP 123 N 5.22 -5.31 0.00 1.43 8.00 0.31 -1.24 116.55 124.96 1rpq n ASP 123 Ca -0.06 -0.27 0.00 0.00 0.71 0.00 0.00 54.79 55.17 1rpq n ASP 123 Cb 0.50 -4.33 0.00 0.00 -0.02 0.00 0.00 41.12 37.27 1rpq n ASP 123 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1rpq n GLY 124 N -1.36 1.41 3.77 0.44 0.00 -1.26 -5.04 105.19 103.15 1rpq n GLY 124 Ca -0.09 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.57 1rpq n GLY 124 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1rpq s GLU 125 N -0.53 3.83 -0.27 1.61 2.02 -0.37 -5.05 118.70 119.93 1rpq s GLU 125 Ca 0.00 -0.22 -0.29 0.00 0.02 0.00 0.00 54.97 54.48 1rpq s GLU 125 Cb 0.00 -3.27 -0.02 0.00 0.10 0.00 0.00 34.13 30.94 1rpq s GLU 125 CO 0.00 0.49 1.55 0.00 0.02 0.00 0.00 175.26 177.32 1rpq s ALA 126 N -0.20 3.23 -0.16 5.21 0.00 -1.26 -0.23 121.76 128.35 1rpq s ALA 126 Ca 0.10 0.31 -0.22 0.00 0.00 0.00 0.00 51.96 52.15 1rpq s ALA 126 Cb -0.12 -3.86 -0.19 0.00 0.00 0.00 0.00 23.12 18.95 1rpq s ALA 126 CO 0.01 -2.03 0.43 -0.07 0.00 0.00 0.00 175.76 174.10 1rpq h LEU 127 N 11.78 0.00 -8.09 0.00 3.38 -0.41 -3.48 115.31 118.48 1rpq h LEU 127 Ca -0.31 -0.65 -0.11 0.00 0.09 0.00 0.00 57.88 56.90 1rpq h LEU 127 Cb 1.14 0.00 -0.15 0.00 0.09 0.00 0.00 40.66 41.74 1rpq h LEU 127 CO 1.02 1.08 -0.57 -0.54 0.09 0.00 0.00 178.44 179.51 1rpq s LYS 128 N -2.19 0.69 -0.03 1.13 1.02 -1.20 -5.00 119.74 114.16 1rpq s LYS 128 Ca -0.20 -1.12 -0.01 0.00 0.02 0.00 0.00 55.97 54.66 1rpq s LYS 128 Cb 0.01 0.25 0.03 0.00 -0.52 0.00 0.00 37.83 37.60 1rpq s LYS 128 CO 0.54 -0.16 0.05 -0.47 -0.92 0.00 0.00 175.35 174.39 1rpq s TYR 129 N -3.86 0.04 -0.11 3.18 6.04 -1.26 -1.82 117.35 119.56 1rpq s TYR 129 Ca 0.06 0.20 -0.01 0.00 0.04 0.00 0.00 57.07 57.36 1rpq s TYR 129 Cb 0.07 -0.35 0.03 0.00 -1.04 0.00 0.00 41.96 40.67 1rpq s TYR 129 CO -0.10 -0.14 -0.00 -1.58 -1.54 0.00 0.00 175.55 172.18 1rpq s TRP 130 N 1.61 0.90 0.24 4.97 0.51 -0.56 -5.00 118.94 121.62 1rpq s TRP 130 Ca -0.02 -0.43 -0.05 0.00 -2.12 0.00 0.00 56.10 53.48 1rpq s TRP 130 Cb -0.12 -0.93 0.46 0.00 -0.81 0.00 0.00 33.47 32.06 1rpq s TRP 130 CO -0.03 -0.43 1.70 -0.92 -0.51 0.00 0.00 176.95 176.77 1rpq h TYR 131 N 8.28 0.37 -2.73 -1.98 3.20 -1.94 -2.01 116.97 120.16 1rpq h TYR 131 Ca -0.21 0.04 -0.66 0.00 3.14 0.00 0.00 58.73 61.04 1rpq h TYR 131 Cb 1.12 -0.05 -0.07 0.00 1.54 0.00 0.00 36.73 39.27 1rpq h TYR 131 CO 0.44 -0.03 -0.46 -1.21 -1.64 0.00 0.00 178.16 175.26 1rpq s GLU 132 N -6.03 3.55 0.12 1.82 0.41 -1.26 -1.05 118.70 116.26 1rpq s GLU 132 Ca -0.13 -0.10 -0.35 0.00 -0.41 0.00 0.00 54.97 53.99 1rpq s GLU 132 Cb 0.21 -3.21 -0.15 0.00 -1.78 0.00 0.00 34.13 29.19 1rpq s GLU 132 CO 0.76 0.73 1.43 -1.71 -0.49 0.00 0.00 175.26 175.98 1rpq n ASN 133 N 2.12 2.25 -3.77 -0.19 2.85 -1.04 -4.85 115.26 112.63 1rpq n ASN 133 Ca -0.19 1.11 -0.13 0.00 -0.11 0.00 0.00 54.58 55.26 1rpq n ASN 133 Cb 0.55 -1.29 -0.12 0.00 1.24 0.00 0.00 39.78 40.15 1rpq n ASN 133 CO 0.00 0.00 0.00 -2.28 -2.11 0.00 0.00 177.26 172.87 1rpq s HIS 134 N 0.62 -0.28 0.67 1.20 5.65 -1.26 -5.08 115.29 116.81 1rpq s HIS 134 Ca 0.81 0.68 -0.14 0.00 0.25 0.00 0.00 55.06 56.67 1rpq s HIS 134 Cb -0.83 0.07 0.00 0.00 -1.18 0.00 0.00 32.58 30.64 1rpq s HIS 134 CO 0.43 -0.17 1.08 -0.80 -0.65 0.00 0.00 174.74 174.64 1rpq s ASN 135 N 0.61 5.20 -0.15 9.88 -0.87 -1.26 -4.77 114.94 123.58 1rpq s ASN 135 Ca -0.04 1.86 -0.03 0.00 -1.57 0.00 0.00 52.86 53.07 1rpq s ASN 135 Cb -0.05 -2.53 -0.03 0.00 -0.02 0.00 0.00 41.25 38.62 1rpq s ASN 135 CO -0.03 -1.56 -0.04 -0.51 -2.57 0.00 0.00 177.10 172.38 1rpq s ILE 136 N -2.59 3.87 -0.17 0.60 2.07 0.01 -5.00 121.20 119.99 1rpq s ILE 136 Ca 0.63 -0.37 0.00 0.00 -1.41 0.00 0.00 60.65 59.51 1rpq s ILE 136 Cb -0.18 -2.69 0.03 0.00 0.13 0.00 0.00 42.46 39.75 1rpq s ILE 136 CO 0.45 0.50 -0.11 -0.55 -1.91 0.00 0.00 174.94 173.32 1rpq s SER 137 N 0.33 2.96 -0.74 4.50 0.15 -1.26 -1.10 113.70 118.53 1rpq s SER 137 Ca -0.04 -0.66 -0.17 0.00 0.70 0.00 0.00 55.95 55.78 1rpq s SER 137 Cb -0.14 -1.15 0.15 0.00 -1.71 0.00 0.00 66.02 63.17 1rpq s SER 137 CO 0.03 -0.11 0.79 -0.63 1.20 0.00 0.00 173.24 174.52 1rpq s ILE 138 N 1.48 5.13 0.18 6.45 1.01 0.46 -4.95 121.20 130.96 1rpq s ILE 138 Ca 0.02 -1.71 -0.14 0.00 0.00 0.00 0.00 60.65 58.82 1rpq s ILE 138 Cb -0.14 -4.53 0.08 0.00 0.01 0.00 0.00 42.46 37.88 1rpq s ILE 138 CO -0.09 -1.14 1.72 0.71 0.00 0.00 0.00 174.94 176.14 1rpq h THR 139 N 5.49 0.76 -3.50 2.92 1.35 -1.90 -0.32 112.91 117.71 1rpq h THR 139 Ca -0.06 -0.08 -0.64 0.00 -0.55 0.00 0.00 66.41 65.09 1rpq h THR 139 Cb 1.06 0.51 -0.40 0.00 -1.73 0.00 0.00 68.15 67.59 1rpq h THR 139 CO 0.97 0.04 -0.72 0.21 -0.25 0.00 0.00 175.52 175.78 1rpq s ASN 140 N -5.32 4.50 0.24 5.36 2.47 -1.26 -3.53 114.94 117.40 1rpq s ASN 140 Ca -0.13 -2.21 -0.31 0.00 0.42 0.00 0.00 52.86 50.63 1rpq s ASN 140 Cb 0.14 -1.45 -0.11 0.00 -1.45 0.00 0.00 41.25 38.38 1rpq s ASN 140 CO 0.72 -0.36 1.65 0.00 -3.72 0.00 0.00 177.10 175.39 1rpq s ALA 141 N 0.84 3.83 0.19 1.71 0.00 -0.61 -4.81 121.76 122.91 1rpq s ALA 141 Ca 0.12 1.56 0.11 0.00 0.00 0.00 0.00 51.96 53.75 1rpq s ALA 141 Cb -0.20 -3.67 -0.04 0.00 0.00 0.00 0.00 23.12 19.21 1rpq s ALA 141 CO -0.10 -0.94 -0.24 0.99 0.00 0.00 0.00 175.76 175.48 1rpq s THR 142 N 0.61 2.32 0.54 0.00 2.01 -1.26 -1.63 115.64 118.23 1rpq s THR 142 Ca 0.69 -2.03 0.20 0.00 0.31 0.00 0.00 61.69 60.86 1rpq s THR 142 Cb -0.48 -2.11 0.30 0.00 0.01 0.00 0.00 72.50 70.22 1rpq s THR 142 CO 0.39 -0.13 2.15 1.62 -0.69 0.00 0.00 174.62 177.96 1rpq h VAL 143 N 3.20 0.87 -0.06 3.82 3.04 -1.88 0.15 116.25 125.39 1rpq h VAL 143 Ca -0.46 0.00 -0.05 0.00 -1.01 0.00 0.00 66.70 65.18 1rpq h VAL 143 Cb 1.21 0.97 -0.01 0.00 -2.01 0.00 0.00 31.29 31.45 1rpq h VAL 143 CO 0.48 0.00 -0.17 -0.33 -1.01 0.00 0.00 177.57 176.54 1rpq h GLU 144 N 0.00 0.10 0.00 4.17 5.08 -1.95 -2.25 114.58 119.73 1rpq h GLU 144 Ca 0.03 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.37 1rpq h GLU 144 Cb 0.13 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.36 1rpq h GLU 144 CO -0.00 0.28 0.00 -0.25 -1.00 0.00 0.00 179.01 178.04 1rpq n ASP 145 N -4.29 0.00 -4.80 1.42 8.00 0.53 -4.76 116.55 112.66 1rpq n ASP 145 Ca -0.02 -0.37 -0.30 0.00 0.71 0.00 0.00 54.79 54.81 1rpq n ASP 145 Cb 0.26 -0.00 0.08 0.00 -0.02 0.00 0.00 41.12 41.44 1rpq n ASP 145 CO 0.00 0.00 0.00 -0.44 -0.39 0.00 0.00 177.20 176.37 1rpq s SER 146 N -2.00 4.75 0.00 -2.24 0.01 -0.85 -4.84 113.70 108.53 1rpq s SER 146 Ca 0.18 1.46 0.00 0.00 1.31 0.00 0.00 55.95 58.89 1rpq s SER 146 Cb 0.08 -2.24 0.00 0.00 0.21 0.00 0.00 66.02 64.07 1rpq s SER 146 CO 0.14 -1.83 0.00 0.61 0.41 0.00 0.00 173.24 172.57 1rpq n GLY 147 N -1.95 1.63 3.58 3.44 0.00 -0.15 -4.99 105.19 106.76 1rpq n GLY 147 Ca 0.07 -1.94 -0.39 0.00 0.00 0.00 0.00 46.02 43.76 1rpq n GLY 147 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1rpq s THR 148 N -1.29 5.25 0.22 2.61 -4.23 -1.26 -1.31 115.64 115.62 1rpq s THR 148 Ca 0.00 0.23 0.05 0.00 -1.18 0.00 0.00 61.69 60.79 1rpq s THR 148 Cb 0.00 -3.64 -0.03 0.00 1.34 0.00 0.00 72.50 70.16 1rpq s THR 148 CO 0.00 0.14 0.26 -0.31 -0.54 0.00 0.00 174.62 174.17 1rpq s TYR 149 N 1.89 3.29 0.08 3.99 1.51 -0.19 -0.53 117.35 127.38 1rpq s TYR 149 Ca 0.10 -0.03 -0.27 0.00 -1.01 0.00 0.00 57.07 55.86 1rpq s TYR 149 Cb -0.16 -1.51 0.08 0.00 -0.11 0.00 0.00 41.96 40.26 1rpq s TYR 149 CO 0.11 0.49 0.96 1.52 -1.11 0.00 0.00 175.55 177.52 1rpq s TYR 150 N -1.97 -0.20 0.12 2.71 -0.85 -0.65 -0.44 117.35 116.06 1rpq s TYR 150 Ca 0.33 -0.02 -0.01 0.00 -0.52 0.00 0.00 57.07 56.86 1rpq s TYR 150 Cb -0.09 0.59 -0.04 0.00 0.38 0.00 0.00 41.96 42.80 1rpq s TYR 150 CO 0.27 -0.67 0.03 0.00 -1.52 0.00 0.00 175.55 173.65 1rpq s THR 152 N -3.96 0.82 0.13 0.00 -4.23 -0.37 -1.25 115.64 106.78 1rpq s THR 152 Ca 0.20 -1.58 -0.18 0.00 -1.18 0.00 0.00 61.69 58.95 1rpq s THR 152 Cb 0.07 -1.27 0.06 0.00 1.34 0.00 0.00 72.50 72.71 1rpq s THR 152 CO -0.01 -0.58 0.84 0.61 -0.54 0.00 0.00 174.62 174.95 1rpq n GLY 153 N 0.64 0.69 3.20 3.99 0.00 -0.79 -1.38 105.19 111.54 1rpq n GLY 153 Ca -0.17 -1.09 -0.29 0.00 0.00 0.00 0.00 46.02 44.47 1rpq n GLY 153 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1rpq s LYS 154 N -2.04 2.30 -0.08 1.61 1.02 0.45 -1.45 119.74 121.55 1rpq s LYS 154 Ca 0.19 -0.76 0.01 0.00 0.02 0.00 0.00 55.97 55.42 1rpq s LYS 154 Cb -0.02 -1.92 0.02 0.00 -0.52 0.00 0.00 37.83 35.39 1rpq s LYS 154 CO 0.04 0.28 -0.08 0.08 -0.92 0.00 0.00 175.35 174.74 1rpq s VAL 155 N 0.04 0.91 -1.41 3.17 1.01 -0.24 -0.58 120.40 123.31 1rpq s VAL 155 Ca -0.07 -0.29 -0.08 0.00 0.00 0.00 0.00 61.98 61.54 1rpq s VAL 155 Cb -0.14 -0.90 0.05 0.00 0.00 0.00 0.00 36.38 35.40 1rpq s VAL 155 CO 0.04 0.32 0.60 0.79 0.00 0.00 0.00 175.10 176.85 1rpq n TRP 156 N 4.32 -1.93 -1.01 5.22 7.02 -1.26 -0.94 117.44 128.86 1rpq n TRP 156 Ca -0.19 0.55 -0.00 0.00 -1.02 0.00 0.00 57.50 56.84 1rpq n TRP 156 Cb 0.51 -3.64 -0.00 0.00 -2.42 0.00 0.00 31.31 25.76 1rpq n TRP 156 CO 0.00 0.00 0.00 1.04 -2.02 0.00 0.00 177.69 176.71 1rpq n GLN 157 N -3.97 -0.88 -4.18 -0.99 6.02 -1.26 -5.02 117.38 107.09 1rpq n GLN 157 Ca -0.04 0.24 -0.28 0.00 -0.01 0.00 0.00 57.00 56.92 1rpq n GLN 157 Cb 0.57 -3.92 -0.08 0.00 1.02 0.00 0.00 30.24 27.83 1rpq n GLN 157 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 1rpq s LEU 158 N -0.08 3.34 0.09 1.08 1.43 -0.11 -5.07 118.68 119.36 1rpq s LEU 158 Ca 0.00 -0.34 -0.20 0.00 -1.03 0.00 0.00 54.13 52.56 1rpq s LEU 158 Cb 0.00 -2.02 -0.07 0.00 0.03 0.00 0.00 46.19 44.13 1rpq s LEU 158 CO 0.00 0.11 0.60 -1.81 0.23 0.00 0.00 176.35 175.48 1rpq s ASP 159 N -2.76 7.11 0.01 2.29 1.01 -1.26 -1.08 116.67 121.99 1rpq s ASP 159 Ca 0.27 1.32 -0.12 0.00 0.71 0.00 0.00 52.55 54.72 1rpq s ASP 159 Cb -0.10 -2.38 0.01 0.00 1.01 0.00 0.00 42.92 41.47 1rpq s ASP 159 CO 0.18 0.27 0.25 -0.31 0.21 0.00 0.00 175.17 175.77 1rpq s TYR 160 N -1.11 -0.08 0.14 4.23 1.51 -0.53 -4.99 117.35 116.52 1rpq s TYR 160 Ca 0.30 0.04 0.11 0.00 -1.01 0.00 0.00 57.07 56.51 1rpq s TYR 160 Cb -0.20 0.04 -0.04 0.00 -0.11 0.00 0.00 41.96 41.65 1rpq s TYR 160 CO 0.20 -0.38 -0.26 -2.00 -1.11 0.00 0.00 175.55 172.00 1rpq s GLU 161 N -1.68 1.39 0.16 -0.62 2.12 -1.26 -1.89 118.70 116.92 1rpq s GLU 161 Ca -0.12 -1.36 0.03 0.00 0.36 0.00 0.00 54.97 53.88 1rpq s GLU 161 Cb -0.05 -1.82 -0.04 0.00 0.26 0.00 0.00 34.13 32.49 1rpq s GLU 161 CO 0.01 0.42 0.27 -1.54 -0.54 0.00 0.00 175.26 173.89 1rpq s SER 162 N -2.17 6.24 0.48 -1.70 1.04 -0.38 -4.62 113.70 112.59 1rpq s SER 162 Ca 0.14 0.13 -0.23 0.00 0.48 0.00 0.00 55.95 56.47 1rpq s SER 162 Cb -0.09 -1.85 -0.07 0.00 0.10 0.00 0.00 66.02 64.11 1rpq s SER 162 CO 0.07 0.05 1.31 -1.61 0.98 0.00 0.00 173.24 174.03 1rpq s GLU 163 N -3.27 3.52 0.68 4.02 0.41 -1.26 -4.58 118.70 118.23 1rpq s GLU 163 Ca 0.34 2.14 -0.13 0.00 -0.41 0.00 0.00 54.97 56.91 1rpq s GLU 163 Cb -0.11 -2.45 0.01 0.00 -1.78 0.00 0.00 34.13 29.80 1rpq s GLU 163 CO 0.28 -0.85 1.08 -1.25 -0.49 0.00 0.00 175.26 174.02 1rpq s PRO 164 N -2.66 2.86 -0.03 0.39 0.04 -1.26 -4.61 135.00 129.72 1rpq s PRO 164 Ca 0.65 1.15 -0.01 0.00 0.04 0.00 0.00 61.00 62.83 1rpq s PRO 164 Cb -0.38 -1.97 0.03 0.00 0.04 0.00 0.00 34.50 32.22 1rpq s PRO 164 CO 0.46 -1.18 0.04 -1.17 0.04 0.00 0.00 177.00 175.19 1rpq s LEU 165 N -5.23 0.64 -0.10 -3.56 2.96 0.41 -4.97 118.68 108.82 1rpq s LEU 165 Ca 0.62 0.04 -0.30 0.00 -0.22 0.00 0.00 54.13 54.27 1rpq s LEU 165 Cb -0.16 -0.14 -0.01 0.00 0.50 0.00 0.00 46.19 46.37 1rpq s LEU 165 CO 0.48 -0.18 1.02 0.20 -1.32 0.00 0.00 176.35 176.55 1rpq s ASN 166 N 1.61 7.23 -0.10 3.68 0.01 -1.26 -1.03 114.94 125.08 1rpq s ASN 166 Ca -0.02 1.55 0.03 0.00 -0.71 0.00 0.00 52.86 53.70 1rpq s ASN 166 Cb -0.13 -2.56 0.01 0.00 0.41 0.00 0.00 41.25 38.99 1rpq s ASN 166 CO -0.03 -0.46 -0.18 -0.63 -1.51 0.00 0.00 177.10 174.29 1rpq s ILE 167 N 2.05 1.65 -0.08 0.60 1.01 -0.43 -4.88 121.20 121.12 1rpq s ILE 167 Ca 0.49 -0.76 0.04 0.00 0.00 0.00 0.00 60.65 60.42 1rpq s ILE 167 Cb -0.19 -1.48 -0.00 0.00 0.01 0.00 0.00 42.46 40.81 1rpq s ILE 167 CO 0.18 0.47 -0.22 -0.89 0.00 0.00 0.00 174.94 174.48 1rpq s THR 168 N 0.73 1.90 -0.34 2.92 2.01 -0.25 -0.97 115.64 121.64 1rpq s THR 168 Ca -0.12 -0.94 -0.03 0.00 0.31 0.00 0.00 61.69 60.91 1rpq s THR 168 Cb -0.16 -1.64 0.06 0.00 0.01 0.00 0.00 72.50 70.77 1rpq s THR 168 CO 0.02 0.53 0.08 -0.69 -0.69 0.00 0.00 174.62 173.86 1rpq s VAL 169 N 0.26 3.29 0.33 3.82 1.01 -1.25 -0.43 120.40 127.43 1rpq s VAL 169 Ca -0.14 -1.45 0.02 0.00 0.00 0.00 0.00 61.98 60.41 1rpq s VAL 169 Cb -0.16 -2.96 0.06 0.00 0.00 0.00 0.00 36.38 33.32 1rpq s VAL 169 CO 0.07 -0.25 0.46 2.30 0.00 0.00 0.00 175.10 177.67 1rpq n ILE 170 N 4.68 0.00 1.37 2.22 -5.35 0.02 -4.33 119.36 117.96 1rpq n ILE 170 Ca -0.11 -0.85 0.13 0.00 -0.27 0.00 0.00 62.75 61.65 1rpq n ILE 170 Cb 0.43 -0.98 0.41 0.00 -1.74 0.00 0.00 39.64 37.77 1rpq n ILE 170 CO 0.00 0.00 0.00 1.17 -1.76 0.00 0.00 176.55 175.96