#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2e4m n GLN 3 N 0.00 0.00 -1.78 4.33 -0.06 -1.26 -4.82 117.38 113.79 2e4m n GLN 3 Ca 0.00 0.00 -0.41 0.00 -2.00 0.00 0.00 57.00 54.59 2e4m n GLN 3 Cb 0.00 0.00 -0.00 0.00 -4.06 0.00 0.00 30.24 26.18 2e4m n GLN 3 CO 0.00 0.00 0.00 -0.08 -0.20 0.00 0.00 177.06 176.78 2e4m s THR 4 N 0.00 2.01 -2.17 1.69 -1.32 -1.26 -4.90 115.64 109.69 2e4m s THR 4 Ca 0.00 0.01 0.18 0.00 -1.21 0.00 0.00 61.69 60.67 2e4m s THR 4 Cb 0.00 -3.01 0.43 0.00 -1.51 0.00 0.00 72.50 68.41 2e4m s THR 4 CO 0.00 0.00 1.51 -0.46 -2.21 0.00 0.00 174.62 173.46 2e4m n ASN 5 N 0.60 1.31 0.21 8.08 0.23 -1.26 -4.44 115.26 119.99 2e4m n ASN 5 Ca 0.02 -1.71 0.15 0.00 -0.53 0.00 0.00 54.58 52.51 2e4m n ASN 5 Cb 0.39 -0.10 0.61 0.00 -2.08 0.00 0.00 39.78 38.60 2e4m n ASN 5 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 2e4m h ALA 6 N 3.86 1.00 -0.41 -2.53 0.00 -1.96 -2.26 119.26 116.95 2e4m h ALA 6 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2e4m h ALA 6 Cb 0.37 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.16 2e4m h ALA 6 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 179.25 179.34 2e4m n ASN 7 N -2.67 2.93 -4.72 0.00 5.03 -1.26 -4.58 115.26 109.98 2e4m n ASN 7 Ca 0.01 -1.93 -0.35 0.00 0.87 0.00 0.00 54.58 53.18 2e4m n ASN 7 Cb 0.26 -0.27 0.09 0.00 -1.02 0.00 0.00 39.78 38.84 2e4m n ASN 7 CO 0.00 0.00 0.00 -1.81 -1.83 0.00 0.00 177.26 173.62 2e4m s ASP 8 N -1.32 4.18 -0.56 6.41 -0.00 -0.85 -4.73 116.67 119.79 2e4m s ASP 8 Ca 0.37 2.43 -0.07 0.00 -0.00 0.00 0.00 52.55 55.28 2e4m s ASP 8 Cb 0.21 -2.60 -0.20 0.00 -0.00 0.00 0.00 42.92 40.33 2e4m s ASP 8 CO 0.28 -2.28 3.31 0.18 -0.00 0.00 0.00 175.17 176.66 2e4m n LEU 9 N -2.62 6.29 -4.77 1.23 7.99 -1.26 -4.94 117.00 118.91 2e4m n LEU 9 Ca 0.14 -3.51 -0.38 0.00 -0.01 0.00 0.00 56.01 52.26 2e4m n LEU 9 Cb 0.50 -1.43 -0.01 0.00 -0.11 0.00 0.00 43.42 42.37 2e4m n LEU 9 CO 0.47 1.75 0.84 -0.13 -1.51 0.00 0.00 177.39 178.82 2e4m s ARG 10 N 1.49 3.87 0.35 3.23 0.52 -1.26 -4.98 118.95 122.17 2e4m s ARG 10 Ca 0.66 1.83 -0.28 0.00 -0.52 0.00 0.00 55.73 57.41 2e4m s ARG 10 Cb 0.26 -2.52 -0.12 0.00 0.52 0.00 0.00 34.95 33.09 2e4m s ARG 10 CO -0.02 -0.47 1.38 -1.71 0.02 0.00 0.00 175.30 174.49 2e4m n ASN 11 N -0.26 3.21 -0.17 0.23 2.85 -1.26 -2.69 115.26 117.17 2e4m n ASN 11 Ca 0.06 1.22 -0.02 0.00 -0.11 0.00 0.00 54.58 55.72 2e4m n ASN 11 Cb 0.47 -1.54 -0.01 0.00 1.24 0.00 0.00 39.78 39.94 2e4m n ASN 11 CO 0.00 0.00 0.00 -3.20 -2.11 0.00 0.00 177.26 171.95 2e4m n ASN 12 N 0.67 -4.64 -4.93 1.20 5.15 0.16 -5.01 115.26 107.86 2e4m n ASN 12 Ca 0.03 0.05 -0.26 0.00 -0.60 0.00 0.00 54.58 53.81 2e4m n ASN 12 Cb 0.37 -2.34 -0.02 0.00 -0.53 0.00 0.00 39.78 37.26 2e4m n ASN 12 CO 0.00 0.00 0.00 -1.61 1.40 0.00 0.00 177.26 177.05 2e4m s GLU 13 N -1.48 3.54 -0.08 1.20 0.41 -1.10 -4.85 118.70 116.34 2e4m s GLU 13 Ca 0.00 -0.17 0.02 0.00 -0.41 0.00 0.00 54.97 54.41 2e4m s GLU 13 Cb 0.00 -2.64 -0.02 0.00 -1.78 0.00 0.00 34.13 29.69 2e4m s GLU 13 CO 0.00 0.15 -0.14 0.08 -0.49 0.00 0.00 175.26 174.86 2e4m s VAL 14 N -2.26 3.09 0.07 2.63 1.01 -1.26 -1.45 120.40 122.22 2e4m s VAL 14 Ca 0.42 -0.69 0.03 0.00 0.00 0.00 0.00 61.98 61.74 2e4m s VAL 14 Cb -0.10 -2.24 -0.03 0.00 0.00 0.00 0.00 36.38 34.01 2e4m s VAL 14 CO 0.35 0.57 -0.09 -0.36 0.00 0.00 0.00 175.10 175.56 2e4m s PHE 15 N -0.34 0.87 0.12 5.22 0.40 0.03 -1.53 117.98 122.75 2e4m s PHE 15 Ca 0.03 -0.59 -0.28 0.00 -0.60 0.00 0.00 56.93 55.50 2e4m s PHE 15 Cb -0.13 -0.50 -0.07 0.00 0.51 0.00 0.00 43.02 42.84 2e4m s PHE 15 CO 0.02 -0.05 0.88 -0.06 0.70 0.00 0.00 175.22 176.71 2e4m s PHE 16 N -1.91 3.83 -0.25 0.36 0.40 -0.21 -1.28 117.98 118.93 2e4m s PHE 16 Ca -0.02 1.70 -0.01 0.00 -0.60 0.00 0.00 56.93 58.00 2e4m s PHE 16 Cb -0.06 -2.94 0.03 0.00 0.51 0.00 0.00 43.02 40.56 2e4m s PHE 16 CO -0.00 0.31 -0.06 0.42 0.70 0.00 0.00 175.22 176.59 2e4m s ILE 17 N -0.37 2.80 0.13 0.64 1.01 -1.26 -1.33 121.20 122.81 2e4m s ILE 17 Ca 0.42 -1.10 0.11 0.00 0.00 0.00 0.00 60.65 60.07 2e4m s ILE 17 Cb -0.23 -2.45 -0.04 0.00 0.01 0.00 0.00 42.46 39.75 2e4m s ILE 17 CO 0.28 0.16 -0.26 -0.94 0.00 0.00 0.00 174.94 174.18 2e4m s SER 18 N 1.30 3.25 0.38 3.58 1.04 0.71 0.16 113.70 124.12 2e4m s SER 18 Ca -0.01 -0.74 -0.27 0.00 0.48 0.00 0.00 55.95 55.41 2e4m s SER 18 Cb -0.17 -0.22 -0.10 0.00 0.10 0.00 0.00 66.02 65.64 2e4m s SER 18 CO -0.05 0.17 1.34 -2.16 0.98 0.00 0.00 173.24 173.53 2e4m s PRO 19 N -2.02 4.12 0.62 4.02 0.04 -1.26 0.25 135.00 140.76 2e4m s PRO 19 Ca 0.13 2.25 0.34 0.00 0.04 0.00 0.00 61.00 63.77 2e4m s PRO 19 Cb -0.10 -2.90 2.00 0.00 0.04 0.00 0.00 34.50 33.54 2e4m s PRO 19 CO 0.06 -0.40 2.27 0.66 0.04 0.00 0.00 177.00 179.62 2e4m h SER 20 N 2.97 0.00 -0.01 6.66 4.64 -1.42 -2.43 113.55 123.96 2e4m h SER 20 Ca -0.50 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.82 2e4m h SER 20 Cb 1.24 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.33 2e4m h SER 20 CO 0.64 0.00 -0.02 -0.46 -0.87 0.00 0.00 176.83 176.12 2e4m n ASN 21 N -3.56 1.75 -3.19 4.97 2.04 -1.26 -4.75 115.26 111.25 2e4m n ASN 21 Ca -0.02 -1.56 0.01 0.00 -0.44 0.00 0.00 54.58 52.57 2e4m n ASN 21 Cb 0.12 0.01 -0.01 0.00 -2.53 0.00 0.00 39.78 37.37 2e4m n ASN 21 CO 0.00 0.00 0.00 0.21 -0.44 0.00 0.00 177.26 177.03 2e4m s ASN 22 N -2.03 -1.21 0.00 0.53 3.84 -0.92 -5.00 114.94 110.15 2e4m s ASN 22 Ca 0.35 -0.01 0.12 0.00 0.21 0.00 0.00 52.86 53.53 2e4m s ASN 22 Cb 0.21 1.84 0.55 0.00 -0.55 0.00 0.00 41.25 43.30 2e4m s ASN 22 CO 0.34 -0.30 1.36 0.41 -2.79 0.00 0.00 177.10 176.12 2e4m n THR 23 N 5.32 1.00 1.19 -5.21 -1.04 -1.26 -2.72 114.28 111.57 2e4m n THR 23 Ca 0.05 0.25 0.13 0.00 -2.04 0.00 0.00 64.05 62.43 2e4m n THR 23 Cb 0.53 -1.05 0.26 0.00 -1.82 0.00 0.00 70.33 68.25 2e4m n THR 23 CO 0.00 0.00 0.00 0.59 -0.64 0.00 0.00 175.07 175.02 2e4m n ASN 24 N -1.43 1.86 -4.59 8.00 3.02 -1.26 -4.89 115.26 115.97 2e4m n ASN 24 Ca 0.04 -1.46 -0.25 0.00 -0.03 0.00 0.00 54.58 52.87 2e4m n ASN 24 Cb 0.13 0.15 -0.09 0.00 -0.61 0.00 0.00 39.78 39.36 2e4m n ASN 24 CO 0.00 0.00 0.00 -0.54 -2.62 0.00 0.00 177.26 174.10 2e4m s LYS 25 N -2.25 2.14 0.05 3.52 1.02 -1.10 -1.28 119.74 121.83 2e4m s LYS 25 Ca 0.27 -1.33 -0.05 0.00 0.02 0.00 0.00 55.97 54.88 2e4m s LYS 25 Cb 0.20 -2.16 -0.01 0.00 -0.52 0.00 0.00 37.83 35.34 2e4m s LYS 25 CO 0.43 0.41 0.09 0.14 -0.92 0.00 0.00 175.35 175.50 2e4m s VAL 26 N -1.93 0.15 0.09 3.17 -7.23 -0.25 -4.24 120.40 110.15 2e4m s VAL 26 Ca 0.27 -1.21 -0.31 0.00 -1.81 0.00 0.00 61.98 58.92 2e4m s VAL 26 Cb -0.08 -1.05 -0.09 0.00 0.56 0.00 0.00 36.38 35.72 2e4m s VAL 26 CO 0.17 -0.67 1.74 -0.22 -0.31 0.00 0.00 175.10 175.81 2e4m s LEU 27 N -2.34 4.38 -0.07 1.32 2.96 0.12 -1.38 118.68 123.67 2e4m s LEU 27 Ca -0.02 2.60 0.01 0.00 -0.22 0.00 0.00 54.13 56.50 2e4m s LEU 27 Cb 0.01 -3.56 0.02 0.00 0.50 0.00 0.00 46.19 43.16 2e4m s LEU 27 CO -0.06 -0.95 -0.06 -0.62 -1.32 0.00 0.00 176.35 173.34 2e4m s ASP 28 N 2.67 1.55 -0.53 3.68 3.68 0.42 -4.46 116.67 123.68 2e4m s ASP 28 Ca 0.78 -0.21 -0.28 0.00 2.13 0.00 0.00 52.55 54.97 2e4m s ASP 28 Cb -0.42 -0.64 0.03 0.00 -1.45 0.00 0.00 42.92 40.44 2e4m s ASP 28 CO 0.34 -0.07 1.12 -0.75 0.13 0.00 0.00 175.17 175.95 2e4m s LYS 29 N 1.21 3.57 0.01 4.34 2.20 -0.16 -0.76 119.74 130.16 2e4m s LYS 29 Ca -0.06 0.30 0.23 0.00 -0.36 0.00 0.00 55.97 56.09 2e4m s LYS 29 Cb -0.14 -3.97 0.19 0.00 -1.51 0.00 0.00 37.83 32.40 2e4m s LYS 29 CO -0.02 -1.51 1.18 0.44 -0.36 0.00 0.00 175.35 175.08 2e4m n ILE 30 N 6.67 0.05 -3.42 5.43 -5.35 -0.23 -4.88 119.36 117.61 2e4m n ILE 30 Ca 0.09 -0.06 -0.04 0.00 -0.27 0.00 0.00 62.75 62.46 2e4m n ILE 30 Cb 0.49 0.44 0.01 0.00 -1.74 0.00 0.00 39.64 38.84 2e4m n ILE 30 CO 0.00 0.00 0.00 -1.54 -1.76 0.00 0.00 176.55 173.25 2e4m n SER 31 N -1.62 -0.84 0.05 7.28 3.41 -1.20 -4.96 113.62 115.73 2e4m n SER 31 Ca 0.04 -1.67 0.08 0.00 -0.26 0.00 0.00 58.87 57.05 2e4m n SER 31 Cb 0.36 1.43 0.33 0.00 -0.26 0.00 0.00 64.21 66.07 2e4m n SER 31 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2e4m n GLN 32 N -0.22 0.06 0.00 4.33 10.64 -1.26 -3.83 117.38 127.10 2e4m n GLN 32 Ca -0.03 0.36 0.00 0.00 -1.83 0.00 0.00 57.00 55.51 2e4m n GLN 32 Cb 0.24 -1.63 0.00 0.00 -0.86 0.00 0.00 30.24 27.99 2e4m n GLN 32 CO 0.00 0.00 0.00 -1.13 -1.83 0.00 0.00 177.06 174.10 2e4m n SER 33 N -1.75 0.85 -4.40 2.61 3.41 -1.26 -4.72 113.62 108.36 2e4m n SER 33 Ca 0.02 -0.08 -0.31 0.00 -0.26 0.00 0.00 58.87 58.24 2e4m n SER 33 Cb 0.15 0.34 -0.14 0.00 -0.26 0.00 0.00 64.21 64.30 2e4m n SER 33 CO 0.00 0.00 0.00 -0.70 -0.16 0.00 0.00 175.04 174.18 2e4m s GLU 34 N -0.51 2.11 0.18 4.33 2.12 -1.25 -1.54 118.70 124.14 2e4m s GLU 34 Ca 0.00 -0.94 0.11 0.00 0.36 0.00 0.00 54.97 54.49 2e4m s GLU 34 Cb 0.00 -2.15 -0.04 0.00 0.26 0.00 0.00 34.13 32.20 2e4m s GLU 34 CO 0.00 0.56 -0.20 0.14 -0.54 0.00 0.00 175.26 175.21 2e4m s VAL 35 N -0.79 2.59 0.06 3.70 -7.23 -1.26 -1.07 120.40 116.39 2e4m s VAL 35 Ca 0.12 -1.87 -0.20 0.00 -1.81 0.00 0.00 61.98 58.22 2e4m s VAL 35 Cb -0.10 -2.24 0.05 0.00 0.56 0.00 0.00 36.38 34.65 2e4m s VAL 35 CO 0.02 -0.07 0.48 -0.75 -0.31 0.00 0.00 175.10 174.47 2e4m s LYS 36 N -2.60 1.02 0.35 4.82 2.20 0.06 -4.54 119.74 121.05 2e4m s LYS 36 Ca 0.21 -0.33 -0.28 0.00 -0.36 0.00 0.00 55.97 55.20 2e4m s LYS 36 Cb -0.09 0.46 -0.10 0.00 -1.51 0.00 0.00 37.83 36.60 2e4m s LYS 36 CO 0.11 -0.37 1.26 -0.51 -0.36 0.00 0.00 175.35 175.48 2e4m s LEU 37 N -2.11 4.37 0.05 5.43 1.02 -0.20 -0.44 118.68 126.80 2e4m s LEU 37 Ca -0.04 2.59 -0.08 0.00 0.02 0.00 0.00 54.13 56.61 2e4m s LEU 37 Cb -0.00 -3.74 -0.00 0.00 0.02 0.00 0.00 46.19 42.46 2e4m s LEU 37 CO -0.04 -0.57 0.17 0.86 0.02 0.00 0.00 176.35 176.79 2e4m s TRP 38 N -1.20 0.13 0.44 0.29 -0.11 -0.48 -4.90 118.94 113.10 2e4m s TRP 38 Ca 0.51 -0.43 -0.25 0.00 1.22 0.00 0.00 56.10 57.15 2e4m s TRP 38 Cb -0.37 -0.07 -0.09 0.00 -1.50 0.00 0.00 33.47 31.43 2e4m s TRP 38 CO 0.49 -0.45 1.23 0.27 -4.62 0.00 0.00 176.95 173.88 2e4m n ASN 39 N 0.48 2.34 -4.70 5.86 6.94 -1.26 -1.09 115.26 123.83 2e4m n ASN 39 Ca -0.18 1.08 -0.42 0.00 -0.02 0.00 0.00 54.58 55.04 2e4m n ASN 39 Cb 0.60 -1.48 -0.03 0.00 -2.36 0.00 0.00 39.78 36.51 2e4m n ASN 39 CO 0.00 0.00 0.00 -0.75 -1.03 0.00 0.00 177.26 175.48 2e4m s LYS 40 N -2.25 4.36 0.00 -3.83 2.20 -0.41 -4.74 119.74 115.07 2e4m s LYS 40 Ca 0.63 1.84 0.00 0.00 -0.36 0.00 0.00 55.97 58.07 2e4m s LYS 40 Cb -0.50 -3.43 0.00 0.00 -1.51 0.00 0.00 37.83 32.38 2e4m s LYS 40 CO 0.57 -0.40 0.21 1.28 -0.36 0.00 0.00 175.35 176.65 2e4m n LEU 41 N 4.55 0.41 -2.32 5.43 4.77 -1.26 -5.00 117.00 123.57 2e4m n LEU 41 Ca 0.11 -0.55 -0.15 0.00 -0.03 0.00 0.00 56.01 55.38 2e4m n LEU 41 Cb 0.45 0.00 -0.01 0.00 -2.33 0.00 0.00 43.42 41.53 2e4m n LEU 41 CO 0.57 0.10 -0.19 -1.20 -1.33 0.00 0.00 177.39 175.34 2e4m n SER 42 N -0.29 -4.51 -4.83 -1.43 7.64 -1.26 -5.00 113.62 103.95 2e4m n SER 42 Ca 0.00 0.15 -0.30 0.00 1.01 0.00 0.00 58.87 59.73 2e4m n SER 42 Cb 0.04 -3.83 0.06 0.00 -1.01 0.00 0.00 64.21 59.47 2e4m n SER 42 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 2e4m s GLY 43 N -2.06 1.64 0.48 0.23 0.00 -1.26 -4.97 107.32 101.38 2e4m s GLY 43 Ca 0.00 -0.12 0.23 0.00 0.00 0.00 0.00 44.72 44.83 2e4m s GLY 43 CO 0.00 0.25 1.99 0.00 0.00 0.00 0.00 173.10 175.34 2e4m h ALA 44 N -0.84 1.31 0.00 3.20 0.00 -1.94 -1.90 119.26 119.08 2e4m h ALA 44 Ca -0.45 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.29 2e4m h ALA 44 Cb 1.24 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.00 2e4m h ALA 44 CO 0.59 0.23 0.00 0.27 0.00 0.00 0.00 179.25 180.34 2e4m n ASN 45 N -3.76 0.00 -0.76 0.00 6.94 -1.26 -2.47 115.26 113.95 2e4m n ASN 45 Ca -0.02 -0.96 0.07 0.00 -0.02 0.00 0.00 54.58 53.65 2e4m n ASN 45 Cb 0.29 -0.01 0.19 0.00 -2.36 0.00 0.00 39.78 37.90 2e4m n ASN 45 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 2e4m n GLN 46 N -1.01 2.92 -5.24 -3.83 6.02 -0.72 -0.99 117.38 114.54 2e4m n GLN 46 Ca 0.23 -2.30 -0.31 0.00 -0.01 0.00 0.00 57.00 54.61 2e4m n GLN 46 Cb 0.11 -1.45 -0.16 0.00 1.02 0.00 0.00 30.24 29.76 2e4m n GLN 46 CO 0.00 0.00 0.00 0.15 -1.01 0.00 0.00 177.06 176.20 2e4m s LYS 47 N -1.50 2.45 -0.09 -1.09 1.02 -1.03 -4.40 119.74 115.10 2e4m s LYS 47 Ca 0.30 -0.89 -0.01 0.00 0.02 0.00 0.00 55.97 55.38 2e4m s LYS 47 Cb 0.19 -2.16 0.03 0.00 -0.52 0.00 0.00 37.83 35.37 2e4m s LYS 47 CO 0.15 0.44 -0.01 -1.58 -0.92 0.00 0.00 175.35 173.43 2e4m s TRP 48 N -0.31 0.86 0.01 3.18 0.52 -0.40 -1.32 118.94 121.48 2e4m s TRP 48 Ca 0.01 -0.34 -0.23 0.00 0.02 0.00 0.00 56.10 55.56 2e4m s TRP 48 Cb -0.13 -0.91 -0.05 0.00 -1.15 0.00 0.00 33.47 31.24 2e4m s TRP 48 CO 0.02 -0.39 0.70 0.50 0.02 0.00 0.00 176.95 177.80 2e4m s ARG 49 N 1.91 4.43 -0.16 4.98 3.52 0.43 -0.79 118.95 133.26 2e4m s ARG 49 Ca 0.05 0.93 -0.16 0.00 -0.13 0.00 0.00 55.73 56.41 2e4m s ARG 49 Cb -0.13 -3.37 -0.04 0.00 -1.56 0.00 0.00 34.95 29.85 2e4m s ARG 49 CO -0.06 0.28 0.41 -0.51 -0.81 0.00 0.00 175.30 174.61 2e4m s LEU 50 N 0.03 4.22 -0.17 -0.88 1.02 -0.53 -0.84 118.68 121.52 2e4m s LEU 50 Ca 0.36 0.63 0.00 0.00 0.02 0.00 0.00 54.13 55.14 2e4m s LEU 50 Cb -0.19 -2.56 0.04 0.00 0.02 0.00 0.00 46.19 43.50 2e4m s LEU 50 CO 0.20 -0.02 -0.10 -0.63 0.02 0.00 0.00 176.35 175.83 2e4m s ILE 51 N 0.91 1.42 0.10 -0.59 1.01 -0.57 0.37 121.20 123.85 2e4m s ILE 51 Ca 0.21 -0.74 -0.24 0.00 0.00 0.00 0.00 60.65 59.89 2e4m s ILE 51 Cb -0.14 -1.47 -0.07 0.00 0.01 0.00 0.00 42.46 40.78 2e4m s ILE 51 CO 0.08 0.25 0.72 -0.47 0.00 0.00 0.00 174.94 175.51 2e4m s TYR 52 N 1.51 3.83 -0.32 3.97 6.14 -1.26 -0.46 117.35 130.76 2e4m s TYR 52 Ca 0.01 1.49 -0.06 0.00 0.64 0.00 0.00 57.07 59.15 2e4m s TYR 52 Cb -0.15 -2.71 0.03 0.00 0.42 0.00 0.00 41.96 39.55 2e4m s TYR 52 CO -0.09 0.46 0.09 0.34 0.64 0.00 0.00 175.55 177.00 2e4m s ASP 53 N -0.81 5.22 0.41 4.32 -1.08 0.38 -4.97 116.67 120.14 2e4m s ASP 53 Ca 0.35 -0.98 0.12 0.00 -0.52 0.00 0.00 52.55 51.52 2e4m s ASP 53 Cb -0.21 -1.87 0.85 0.00 -1.46 0.00 0.00 42.92 40.23 2e4m s ASP 53 CO 0.23 -0.27 1.93 0.74 0.52 0.00 0.00 175.17 178.31 2e4m h THR 54 N 6.06 1.18 -0.18 1.71 2.02 -1.97 0.25 112.91 121.97 2e4m h THR 54 Ca -0.26 -0.81 -0.12 0.00 0.77 0.00 0.00 66.41 65.98 2e4m h THR 54 Cb 1.10 1.35 0.00 0.00 -1.74 0.00 0.00 68.15 68.86 2e4m h THR 54 CO 0.60 0.24 -0.36 0.78 0.37 0.00 0.00 175.52 177.16 2e4m h ASN 55 N 0.10 0.63 1.36 4.18 -0.26 -1.95 -3.22 115.58 116.42 2e4m h ASN 55 Ca 0.02 -0.55 -0.10 0.00 -0.56 0.00 0.00 56.30 55.11 2e4m h ASN 55 Cb 0.41 -0.18 -0.01 0.00 -1.06 0.00 0.00 38.32 37.47 2e4m h ASN 55 CO 0.03 1.06 -0.49 0.11 -1.06 0.00 0.00 177.43 177.07 2e4m h LYS 56 N 0.23 0.00 -6.14 0.81 1.57 -1.92 -3.47 116.57 107.64 2e4m h LYS 56 Ca 0.01 0.00 -0.45 0.00 -1.87 0.00 0.00 60.65 58.34 2e4m h LYS 56 Cb 0.95 0.00 0.02 0.00 0.08 0.00 0.00 32.23 33.29 2e4m h LYS 56 CO 0.08 0.49 -0.74 1.04 -0.57 0.00 0.00 179.45 179.76 2e4m n GLN 57 N -3.28 -6.28 -4.10 3.15 6.02 0.84 -5.00 117.38 108.73 2e4m n GLN 57 Ca 0.02 0.67 -0.11 0.00 -0.01 0.00 0.00 57.00 57.57 2e4m n GLN 57 Cb 0.70 -5.60 -0.08 0.00 1.02 0.00 0.00 30.24 26.28 2e4m n GLN 57 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2e4m s ALA 58 N -3.33 0.53 0.09 -1.58 0.00 -1.17 -4.69 121.76 111.62 2e4m s ALA 58 Ca 0.60 -1.32 0.08 0.00 0.00 0.00 0.00 51.96 51.32 2e4m s ALA 58 Cb -0.29 1.20 -0.03 0.00 0.00 0.00 0.00 23.12 24.00 2e4m s ALA 58 CO 0.80 -0.69 -0.21 0.71 0.00 0.00 0.00 175.76 176.37 2e4m s TYR 59 N -4.09 1.81 0.23 0.00 2.02 0.87 -0.47 117.35 117.72 2e4m s TYR 59 Ca 0.30 -0.41 -0.12 0.00 -0.37 0.00 0.00 57.07 56.48 2e4m s TYR 59 Cb 0.04 -1.01 -0.08 0.00 -0.40 0.00 0.00 41.96 40.52 2e4m s TYR 59 CO 0.09 0.19 0.59 0.95 -1.57 0.00 0.00 175.55 175.80 2e4m s THR 60 N -1.09 4.86 -0.24 -0.71 -4.23 0.39 -0.54 115.64 114.08 2e4m s THR 60 Ca 0.07 0.65 0.01 0.00 -1.18 0.00 0.00 61.69 61.24 2e4m s THR 60 Cb -0.10 -3.65 0.06 0.00 1.34 0.00 0.00 72.50 70.16 2e4m s THR 60 CO 0.04 -0.02 -0.04 -0.63 -0.54 0.00 0.00 174.62 173.42 2e4m s ILE 61 N -1.77 1.57 -0.15 2.99 1.01 -1.26 -1.51 121.20 122.07 2e4m s ILE 61 Ca 0.47 -1.31 -0.01 0.00 0.00 0.00 0.00 60.65 59.80 2e4m s ILE 61 Cb -0.12 -1.86 -0.01 0.00 0.01 0.00 0.00 42.46 40.48 2e4m s ILE 61 CO 0.20 -0.15 -0.11 -0.75 0.00 0.00 0.00 174.94 174.13 2e4m s LYS 62 N 1.37 3.39 0.58 2.79 2.20 -0.02 -1.12 119.74 128.91 2e4m s LYS 62 Ca -0.04 -0.67 -0.18 0.00 -0.36 0.00 0.00 55.97 54.72 2e4m s LYS 62 Cb -0.19 -2.74 -0.04 0.00 -1.51 0.00 0.00 37.83 33.36 2e4m s LYS 62 CO -0.07 0.10 1.13 0.54 -0.36 0.00 0.00 175.35 176.70 2e4m s VAL 63 N 0.66 3.11 -0.22 4.02 0.11 -0.02 -0.43 120.40 127.62 2e4m s VAL 63 Ca -0.06 0.64 0.13 0.00 -2.93 0.00 0.00 61.98 59.77 2e4m s VAL 63 Cb -0.15 -3.22 0.49 0.00 -1.53 0.00 0.00 36.38 31.97 2e4m s VAL 63 CO 0.02 -0.20 1.41 0.23 -3.33 0.00 0.00 175.10 173.24 2e4m n MET 64 N -1.64 2.25 -1.01 1.54 0.00 -0.44 -4.21 117.12 113.61 2e4m n MET 64 Ca 0.12 -2.97 -0.13 0.00 0.00 0.00 0.00 57.70 54.71 2e4m n MET 64 Cb 0.51 -1.79 0.22 0.00 0.00 0.00 0.00 33.22 32.16 2e4m n MET 64 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 175.97 175.57 2e4m n ASP 65 N -0.89 4.15 -1.31 7.83 5.75 -1.19 -2.09 116.55 128.80 2e4m n ASP 65 Ca 0.26 -3.25 -0.13 0.00 -0.01 0.00 0.00 54.79 51.66 2e4m n ASP 65 Cb 0.93 -0.76 -0.02 0.00 -1.03 0.00 0.00 41.12 40.23 2e4m n ASP 65 CO 0.00 0.00 0.00 -3.20 -0.11 0.00 0.00 177.20 173.89 2e4m n ASN 66 N -0.51 -4.27 -0.00 -1.12 2.85 -0.38 -4.89 115.26 106.94 2e4m n ASN 66 Ca 0.45 0.11 0.04 0.00 -0.11 0.00 0.00 54.58 55.08 2e4m n ASN 66 Cb 1.42 -3.26 -0.06 0.00 1.24 0.00 0.00 39.78 39.12 2e4m n ASN 66 CO 0.00 0.00 0.00 1.07 -2.11 0.00 0.00 177.26 176.22 2e4m n THR 67 N -3.49 0.00 -1.46 -0.44 5.66 -1.26 -5.01 114.28 108.28 2e4m n THR 67 Ca -0.15 -0.23 -0.16 0.00 -3.05 0.00 0.00 64.05 60.46 2e4m n THR 67 Cb 0.55 0.50 -0.07 0.00 -1.55 0.00 0.00 70.33 69.76 2e4m n THR 67 CO 0.00 0.00 0.00 -1.20 -3.05 0.00 0.00 175.07 170.82 2e4m n SER 68 N -1.64 -5.34 -4.80 1.09 7.64 -1.26 -4.97 113.62 104.33 2e4m n SER 68 Ca -0.01 0.39 -0.34 0.00 1.01 0.00 0.00 58.87 59.92 2e4m n SER 68 Cb 0.21 -4.24 -0.07 0.00 -1.01 0.00 0.00 64.21 59.11 2e4m n SER 68 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 2e4m s LEU 69 N -3.60 4.07 0.09 -3.43 1.43 -1.26 -4.43 118.68 111.55 2e4m s LEU 69 Ca 0.00 1.76 0.08 0.00 -1.03 0.00 0.00 54.13 54.95 2e4m s LEU 69 Cb 0.00 -4.36 -0.03 0.00 0.03 0.00 0.00 46.19 41.83 2e4m s LEU 69 CO 0.00 -0.30 -0.22 0.27 0.23 0.00 0.00 176.35 176.34 2e4m s ILE 70 N -1.97 1.76 0.14 -0.59 -4.36 -0.27 -0.84 121.20 115.08 2e4m s ILE 70 Ca 0.58 -1.49 -0.31 0.00 -0.26 0.00 0.00 60.65 59.17 2e4m s ILE 70 Cb -0.13 -1.58 -0.10 0.00 1.25 0.00 0.00 42.46 41.89 2e4m s ILE 70 CO 0.17 0.01 1.75 -0.22 0.24 0.00 0.00 174.94 176.90 2e4m s LEU 71 N -1.77 4.38 -0.02 0.37 2.96 -0.28 -1.69 118.68 122.64 2e4m s LEU 71 Ca 0.07 2.74 0.01 0.00 -0.22 0.00 0.00 54.13 56.73 2e4m s LEU 71 Cb -0.10 -3.58 0.01 0.00 0.50 0.00 0.00 46.19 43.03 2e4m s LEU 71 CO 0.04 -0.96 -0.02 -0.89 -1.32 0.00 0.00 176.35 173.19 2e4m s THR 72 N 2.16 0.29 -0.17 3.68 2.01 0.39 -4.62 115.64 119.38 2e4m s THR 72 Ca 0.77 -0.06 -0.23 0.00 0.31 0.00 0.00 61.69 62.48 2e4m s THR 72 Cb -0.46 -0.31 -0.02 0.00 0.01 0.00 0.00 72.50 71.71 2e4m s THR 72 CO 0.34 0.13 0.73 0.86 -0.69 0.00 0.00 174.62 175.99 2e4m s TRP 73 N 0.51 3.42 -1.40 4.92 -0.00 -0.75 -0.14 118.94 125.51 2e4m s TRP 73 Ca -0.05 1.12 -0.07 0.00 -0.00 0.00 0.00 56.10 57.10 2e4m s TRP 73 Cb -0.09 -2.90 0.06 0.00 -0.00 0.00 0.00 33.47 30.55 2e4m s TRP 73 CO -0.01 -0.17 2.55 -0.25 -0.00 0.00 0.00 176.95 179.08 2e4m n ASP 74 N 4.97 8.25 -4.66 5.86 8.00 0.01 -4.84 116.55 134.13 2e4m n ASP 74 Ca 0.01 -2.98 -0.45 0.00 0.71 0.00 0.00 54.79 52.08 2e4m n ASP 74 Cb 0.49 -1.41 -0.03 0.00 -0.02 0.00 0.00 41.12 40.15 2e4m n ASP 74 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2e4m n ALA 75 N 2.23 0.97 0.46 2.24 0.00 -1.26 -1.17 120.51 123.98 2e4m n ALA 75 Ca 0.67 0.42 0.08 0.00 0.00 0.00 0.00 53.44 54.62 2e4m n ALA 75 Cb 0.24 -2.26 0.23 0.00 0.00 0.00 0.00 19.45 17.66 2e4m n ALA 75 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 2e4m n PRO 76 N 2.24 2.15 -1.48 0.00 -0.04 -1.26 -5.11 135.00 131.50 2e4m n PRO 76 Ca 0.13 -1.78 -0.29 0.00 -0.04 0.00 0.00 63.50 61.52 2e4m n PRO 76 Cb 0.30 -1.40 0.16 0.00 -0.04 0.00 0.00 33.50 32.52 2e4m n PRO 76 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 2e4m s LEU 77 N -1.07 1.86 0.00 1.53 1.43 -0.32 -4.98 118.68 117.13 2e4m s LEU 77 Ca 0.34 0.86 0.24 0.00 -1.03 0.00 0.00 54.13 54.54 2e4m s LEU 77 Cb 0.18 -3.06 0.57 0.00 0.03 0.00 0.00 46.19 43.91 2e4m s LEU 77 CO 0.24 -2.85 1.47 -1.54 0.23 0.00 0.00 176.35 173.90 2e4m n SER 78 N -3.94 2.50 -4.90 2.29 3.41 -1.26 -4.60 113.62 107.12 2e4m n SER 78 Ca 0.08 -1.83 -0.28 0.00 -0.26 0.00 0.00 58.87 56.58 2e4m n SER 78 Cb 0.59 -0.10 0.02 0.00 -0.26 0.00 0.00 64.21 64.46 2e4m n SER 78 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 2e4m s SER 79 N -1.73 5.88 0.18 4.04 1.04 -1.26 -1.20 113.70 120.64 2e4m s SER 79 Ca 0.34 0.98 0.10 0.00 0.48 0.00 0.00 55.95 57.85 2e4m s SER 79 Cb 0.20 -2.05 -0.04 0.00 0.10 0.00 0.00 66.02 64.24 2e4m s SER 79 CO 0.30 -0.94 -0.21 0.68 0.98 0.00 0.00 173.24 174.06 2e4m s VAL 80 N -3.02 2.04 0.33 5.02 -7.23 -1.26 -0.81 120.40 115.48 2e4m s VAL 80 Ca 0.53 -1.96 0.04 0.00 -1.81 0.00 0.00 61.98 58.79 2e4m s VAL 80 Cb -0.11 -1.95 -0.02 0.00 0.56 0.00 0.00 36.38 34.87 2e4m s VAL 80 CO 0.48 -0.22 0.34 -1.54 -0.31 0.00 0.00 175.10 173.85 2e4m n SER 81 N 0.30 -0.90 -4.67 4.85 3.41 0.81 -4.69 113.62 112.73 2e4m n SER 81 Ca -0.13 -3.03 -0.33 0.00 -0.26 0.00 0.00 58.87 55.12 2e4m n SER 81 Cb 0.56 1.91 -0.09 0.00 -0.26 0.00 0.00 64.21 66.33 2e4m n SER 81 CO 0.00 0.00 0.00 0.68 -0.16 0.00 0.00 175.04 175.56 2e4m s VAL 82 N -3.14 4.11 0.27 -3.33 -7.23 -0.59 -0.46 120.40 110.03 2e4m s VAL 82 Ca 0.35 -0.54 -0.17 0.00 -1.81 0.00 0.00 61.98 59.82 2e4m s VAL 82 Cb 0.01 -2.80 0.01 0.00 0.56 0.00 0.00 36.38 34.16 2e4m s VAL 82 CO 0.25 0.44 0.62 -1.59 -0.31 0.00 0.00 175.10 174.51 2e4m s LYS 83 N -1.36 1.71 0.42 4.82 -2.85 -0.68 -4.40 119.74 117.39 2e4m s LYS 83 Ca 0.18 -1.13 -0.25 0.00 -1.00 0.00 0.00 55.97 53.77 2e4m s LYS 83 Cb -0.11 0.55 -0.10 0.00 -2.06 0.00 0.00 37.83 36.10 2e4m s LYS 83 CO 0.08 -0.75 1.13 -2.37 0.10 0.00 0.00 175.35 173.53 2e4m n THR 84 N -0.43 2.49 -1.95 3.79 5.66 -1.26 -1.11 114.28 121.46 2e4m n THR 84 Ca -0.03 -0.50 -0.40 0.00 -3.05 0.00 0.00 64.05 60.07 2e4m n THR 84 Cb 0.60 -1.33 -0.03 0.00 -1.55 0.00 0.00 70.33 68.02 2e4m n THR 84 CO 0.00 0.00 0.00 -0.62 -3.05 0.00 0.00 175.07 171.40 2e4m s ASP 85 N -0.65 5.34 0.00 1.09 -1.08 -1.26 -4.83 116.67 115.28 2e4m s ASP 85 Ca 0.62 0.75 0.22 0.00 -0.52 0.00 0.00 52.55 53.62 2e4m s ASP 85 Cb -0.54 -2.52 0.42 0.00 -1.46 0.00 0.00 42.92 38.82 2e4m s ASP 85 CO 0.57 -2.24 1.38 0.35 0.52 0.00 0.00 175.17 175.75 2e4m n THR 86 N 7.39 0.57 -3.86 1.71 -2.24 -1.26 -4.99 114.28 111.59 2e4m n THR 86 Ca 0.24 -0.78 -0.25 0.00 -2.27 0.00 0.00 64.05 60.98 2e4m n THR 86 Cb 0.51 0.92 -0.00 0.00 -2.10 0.00 0.00 70.33 69.66 2e4m n THR 86 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 2e4m n ASN 87 N 1.41 -0.99 -4.61 3.42 5.15 -1.26 -4.99 115.26 113.39 2e4m n ASN 87 Ca 0.19 -0.96 -0.28 0.00 -0.60 0.00 0.00 54.58 52.93 2e4m n ASN 87 Cb 0.58 -3.34 -0.09 0.00 -0.53 0.00 0.00 39.78 36.41 2e4m n ASN 87 CO 0.00 0.00 0.00 0.42 1.40 0.00 0.00 177.26 179.08 2e4m s THR 88 N -3.84 3.46 0.51 -0.44 -4.23 -1.26 -5.04 115.64 104.80 2e4m s THR 88 Ca 0.05 -1.45 0.20 0.00 -1.18 0.00 0.00 61.69 59.30 2e4m s THR 88 Cb -0.02 -2.70 0.34 0.00 1.34 0.00 0.00 72.50 71.46 2e4m s THR 88 CO 0.87 -0.05 2.05 0.78 -0.54 0.00 0.00 174.62 177.73 2e4m h ASN 89 N 3.03 0.07 0.32 3.99 -0.26 -1.97 -1.41 115.58 119.36 2e4m h ASN 89 Ca -0.47 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 55.27 2e4m h ASN 89 Cb 1.19 -0.01 0.00 0.00 -1.06 0.00 0.00 38.32 38.44 2e4m h ASN 89 CO 0.55 0.04 0.00 -0.46 -1.06 0.00 0.00 177.43 176.51 2e4m n ASN 90 N -4.45 0.00 -1.18 5.81 2.04 -1.26 -2.34 115.26 113.88 2e4m n ASN 90 Ca 0.05 0.08 0.11 0.00 -0.44 0.00 0.00 54.58 54.38 2e4m n ASN 90 Cb 0.37 -0.30 0.27 0.00 -2.53 0.00 0.00 39.78 37.58 2e4m n ASN 90 CO 0.00 0.00 0.00 0.00 -0.44 0.00 0.00 177.26 176.82 2e4m n GLN 91 N -1.30 2.65 -4.76 -3.83 6.02 -0.53 -1.82 117.38 113.82 2e4m n GLN 91 Ca 0.07 -2.45 -0.30 0.00 -0.01 0.00 0.00 57.00 54.31 2e4m n GLN 91 Cb 0.13 -1.50 -0.14 0.00 1.02 0.00 0.00 30.24 29.76 2e4m n GLN 91 CO 0.00 0.00 0.00 0.71 -1.01 0.00 0.00 177.06 176.76 2e4m s TYR 92 N -1.10 2.42 -0.04 1.08 2.02 -0.99 -4.45 117.35 116.29 2e4m s TYR 92 Ca 0.42 -0.35 -0.00 0.00 -0.37 0.00 0.00 57.07 56.77 2e4m s TYR 92 Cb 0.22 -1.41 0.03 0.00 -0.40 0.00 0.00 41.96 40.40 2e4m s TYR 92 CO 0.30 0.20 0.00 -1.58 -1.57 0.00 0.00 175.55 172.90 2e4m s TRP 93 N -0.88 0.40 0.20 2.71 0.52 0.30 -0.90 118.94 121.30 2e4m s TRP 93 Ca 0.13 -0.02 -0.31 0.00 0.02 0.00 0.00 56.10 55.92 2e4m s TRP 93 Cb -0.10 -0.53 -0.10 0.00 -1.15 0.00 0.00 33.47 31.59 2e4m s TRP 93 CO 0.04 -0.19 1.45 0.71 0.02 0.00 0.00 176.95 178.97 2e4m s TYR 94 N 1.39 3.09 -0.37 -1.98 1.51 0.53 -0.09 117.35 121.43 2e4m s TYR 94 Ca -0.04 0.95 -0.03 0.00 -1.01 0.00 0.00 57.07 56.94 2e4m s TYR 94 Cb -0.13 -3.80 0.09 0.00 -0.11 0.00 0.00 41.96 38.01 2e4m s TYR 94 CO -0.03 -2.70 0.14 -0.51 -1.11 0.00 0.00 175.55 171.34 2e4m s LEU 95 N 0.21 4.81 -0.17 -1.29 1.43 -1.26 -0.91 118.68 121.50 2e4m s LEU 95 Ca 0.62 -1.76 0.00 0.00 -1.03 0.00 0.00 54.13 51.96 2e4m s LEU 95 Cb -0.41 -1.80 0.01 0.00 0.03 0.00 0.00 46.19 44.02 2e4m s LEU 95 CO 0.38 -0.45 -0.16 -0.76 0.23 0.00 0.00 176.35 175.59 2e4m s LEU 96 N 1.18 2.35 -0.00 1.79 1.43 -1.00 -4.97 118.68 119.46 2e4m s LEU 96 Ca 0.04 -0.54 0.08 0.00 -1.03 0.00 0.00 54.13 52.67 2e4m s LEU 96 Cb -0.22 -1.54 -0.02 0.00 0.03 0.00 0.00 46.19 44.44 2e4m s LEU 96 CO -0.03 0.04 -0.23 -1.58 0.23 0.00 0.00 176.35 174.78 2e4m s GLN 97 N 1.06 2.10 -0.21 1.70 0.74 -1.26 -1.66 119.66 122.13 2e4m s GLN 97 Ca -0.01 -0.94 -0.25 0.00 0.05 0.00 0.00 55.36 54.21 2e4m s GLN 97 Cb -0.14 -2.09 -0.01 0.00 1.10 0.00 0.00 33.01 31.86 2e4m s GLN 97 CO -0.05 0.56 0.84 0.34 -0.55 0.00 0.00 175.29 176.43 2e4m s ASP 98 N -0.85 6.90 0.19 6.67 -1.08 0.19 -4.99 116.67 123.69 2e4m s ASP 98 Ca 0.11 1.11 -0.12 0.00 -0.52 0.00 0.00 52.55 53.13 2e4m s ASP 98 Cb -0.10 -2.45 0.18 0.00 -1.46 0.00 0.00 42.92 39.09 2e4m s ASP 98 CO 0.01 -0.47 1.75 0.22 0.52 0.00 0.00 175.17 177.19 2e4m h TYR 99 N 7.51 0.32 0.06 -5.34 3.20 -1.96 -1.20 116.97 119.57 2e4m h TYR 99 Ca -0.26 0.03 -0.12 0.00 3.14 0.00 0.00 58.73 61.51 2e4m h TYR 99 Cb 1.11 -0.07 0.00 0.00 1.54 0.00 0.00 36.73 39.31 2e4m h TYR 99 CO 0.74 0.11 -0.60 0.82 -1.64 0.00 0.00 178.16 177.58 2e4m h ILE 100 N 0.36 1.51 0.00 1.81 2.04 -1.97 -3.33 117.51 117.93 2e4m h ILE 100 Ca 0.24 -2.41 -0.04 0.00 1.00 0.00 0.00 64.86 63.66 2e4m h ILE 100 Cb 0.26 3.12 -0.01 0.00 -0.74 0.00 0.00 36.82 39.46 2e4m h ILE 100 CO -0.25 0.63 -0.19 0.77 0.00 0.00 0.00 178.15 179.12 2e4m h SER 101 N -0.69 0.00 0.00 1.72 4.64 -2.01 -3.47 113.55 113.74 2e4m h SER 101 Ca -0.13 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.19 2e4m h SER 101 Cb 1.36 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.45 2e4m h SER 101 CO 0.04 0.19 0.00 0.54 -0.87 0.00 0.00 176.83 176.73 2e4m n ARG 102 N -3.25 -0.94 -2.12 4.77 5.12 -0.45 -5.00 116.66 114.78 2e4m n ARG 102 Ca 0.01 0.24 -0.38 0.00 -1.93 0.00 0.00 57.85 55.79 2e4m n ARG 102 Cb 0.48 -4.24 0.00 0.00 -1.16 0.00 0.00 32.46 27.54 2e4m n ARG 102 CO 0.00 0.00 0.00 -0.80 -1.93 0.00 0.00 177.63 174.90 2e4m s ASN 103 N -2.10 6.05 -0.03 0.55 0.02 -1.25 -4.68 114.94 113.50 2e4m s ASN 103 Ca 0.00 2.47 0.03 0.00 -1.02 0.00 0.00 52.86 54.34 2e4m s ASN 103 Cb 0.00 -2.62 0.00 0.00 0.02 0.00 0.00 41.25 38.65 2e4m s ASN 103 CO 0.00 -1.01 -0.11 -0.69 0.02 0.00 0.00 177.10 175.31 2e4m s VAL 104 N -1.42 0.95 0.06 1.60 1.01 0.03 -0.64 120.40 121.99 2e4m s VAL 104 Ca 0.63 -0.45 -0.09 0.00 0.00 0.00 0.00 61.98 62.08 2e4m s VAL 104 Cb -0.33 -0.84 -0.05 0.00 0.00 0.00 0.00 36.38 35.15 2e4m s VAL 104 CO 0.41 0.29 0.36 0.27 0.00 0.00 0.00 175.10 176.43 2e4m s ILE 105 N 0.20 5.15 -0.41 2.22 -4.36 -0.67 -1.05 121.20 122.29 2e4m s ILE 105 Ca -0.04 0.37 -0.09 0.00 -0.26 0.00 0.00 60.65 60.63 2e4m s ILE 105 Cb -0.10 -3.62 0.08 0.00 1.25 0.00 0.00 42.46 40.06 2e4m s ILE 105 CO 0.01 0.31 0.25 -0.76 0.24 0.00 0.00 174.94 174.99 2e4m s LEU 106 N -1.87 5.09 -0.23 0.37 1.02 -1.26 -2.37 118.68 119.43 2e4m s LEU 106 Ca 0.31 -1.49 -0.06 0.00 0.02 0.00 0.00 54.13 52.91 2e4m s LEU 106 Cb -0.14 -1.97 -0.03 0.00 0.02 0.00 0.00 46.19 44.07 2e4m s LEU 106 CO 0.18 -0.52 0.04 -0.60 0.02 0.00 0.00 176.35 175.46 2e4m s ARG 107 N 1.42 3.63 0.18 1.70 3.52 -0.08 -0.74 118.95 128.57 2e4m s ARG 107 Ca 0.03 -0.50 -0.30 0.00 -0.13 0.00 0.00 55.73 54.83 2e4m s ARG 107 Cb -0.23 -3.22 -0.09 0.00 -1.56 0.00 0.00 34.95 29.85 2e4m s ARG 107 CO 0.02 -0.12 1.36 1.21 -0.81 0.00 0.00 175.30 176.96 2e4m s ASN 108 N 1.40 6.83 0.22 -2.12 3.84 0.00 -0.35 114.94 124.76 2e4m s ASN 108 Ca 0.05 2.43 -0.06 0.00 0.21 0.00 0.00 52.86 55.49 2e4m s ASN 108 Cb -0.15 -2.60 0.19 0.00 -0.55 0.00 0.00 41.25 38.14 2e4m s ASN 108 CO 0.02 -0.60 1.72 0.22 -2.79 0.00 0.00 177.10 175.67 2e4m h TYR 109 N 5.77 1.07 -0.58 0.43 3.20 -1.17 -1.72 116.97 123.96 2e4m h TYR 109 Ca -0.44 -0.14 -0.03 0.00 3.14 0.00 0.00 58.73 61.26 2e4m h TYR 109 Cb 1.21 -0.30 -0.03 0.00 1.54 0.00 0.00 36.73 39.16 2e4m h TYR 109 CO 0.63 0.91 0.26 1.98 -1.64 0.00 0.00 178.16 180.30 2e4m h MET 110 N 0.95 0.84 -2.08 1.82 4.05 -1.73 -3.38 114.93 115.40 2e4m h MET 110 Ca 0.19 -0.12 -0.44 0.00 -0.28 0.00 0.00 59.70 59.05 2e4m h MET 110 Cb 0.43 -0.15 -0.33 0.00 -0.80 0.00 0.00 31.60 30.75 2e4m h MET 110 CO 0.01 0.67 -0.76 1.21 0.23 0.00 0.00 176.91 178.27 2e4m s ASN 111 N -6.53 1.35 0.00 1.39 3.04 -1.14 -5.01 114.94 108.04 2e4m s ASN 111 Ca -0.10 -2.02 0.09 0.00 0.04 0.00 0.00 52.86 50.87 2e4m s ASN 111 Cb 0.16 0.29 0.45 0.00 -1.54 0.00 0.00 41.25 40.61 2e4m s ASN 111 CO 0.79 -0.23 1.11 -0.81 -3.04 0.00 0.00 177.10 174.91 2e4m n PRO 112 N 3.81 0.15 0.30 0.43 -0.04 -0.66 -0.53 135.00 138.46 2e4m n PRO 112 Ca 0.16 0.16 0.18 0.00 -0.04 0.00 0.00 63.50 63.96 2e4m n PRO 112 Cb 0.45 -1.50 0.98 0.00 -0.04 0.00 0.00 33.50 33.38 2e4m n PRO 112 CO 0.00 0.00 0.00 -0.91 -0.04 0.00 0.00 175.50 174.55 2e4m h ASN 113 N 0.00 0.00 -3.18 3.54 2.35 -1.96 -3.44 115.58 112.89 2e4m h ASN 113 Ca 0.00 0.00 -0.61 0.00 -0.55 0.00 0.00 56.30 55.14 2e4m h ASN 113 Cb 0.06 0.00 -0.11 0.00 0.05 0.00 0.00 38.32 38.32 2e4m h ASN 113 CO 0.00 0.03 -0.48 -0.76 -1.65 0.00 0.00 177.43 174.57 2e4m s LEU 114 N -6.82 4.24 0.21 1.61 1.43 0.31 -3.85 118.68 115.81 2e4m s LEU 114 Ca -0.04 0.28 0.10 0.00 -1.03 0.00 0.00 54.13 53.45 2e4m s LEU 114 Cb 0.13 -2.10 -0.05 0.00 0.03 0.00 0.00 46.19 44.20 2e4m s LEU 114 CO 0.50 0.21 -0.20 0.68 0.23 0.00 0.00 176.35 177.77 2e4m s VAL 115 N 0.15 2.19 0.33 -1.59 -7.23 -0.34 -0.82 120.40 113.10 2e4m s VAL 115 Ca 0.10 -2.13 -0.29 0.00 -1.81 0.00 0.00 61.98 57.85 2e4m s VAL 115 Cb -0.11 -2.09 -0.11 0.00 0.56 0.00 0.00 36.38 34.63 2e4m s VAL 115 CO -0.01 -0.30 1.40 -0.22 -0.31 0.00 0.00 175.10 175.67 2e4m s LEU 116 N -2.97 4.38 0.00 1.32 2.96 0.08 -1.35 118.68 123.10 2e4m s LEU 116 Ca 0.22 2.82 0.01 0.00 -0.22 0.00 0.00 54.13 56.96 2e4m s LEU 116 Cb -0.06 -3.65 -0.00 0.00 0.50 0.00 0.00 46.19 42.98 2e4m s LEU 116 CO 0.10 -0.69 -0.03 -1.58 -1.32 0.00 0.00 176.35 172.83 2e4m s GLN 117 N -1.64 0.20 -0.13 1.98 0.74 0.13 -4.56 119.66 116.39 2e4m s GLN 117 Ca 0.52 -0.17 -0.04 0.00 0.05 0.00 0.00 55.36 55.72 2e4m s GLN 117 Cb -0.43 -0.15 -0.04 0.00 1.10 0.00 0.00 33.01 33.50 2e4m s GLN 117 CO 0.55 0.04 0.03 1.52 -0.55 0.00 0.00 175.29 176.87 2e4m s TYR 118 N -0.27 3.21 0.49 1.67 -0.85 -0.72 -1.09 117.35 119.78 2e4m s TYR 118 Ca -0.01 0.11 0.02 0.00 -0.52 0.00 0.00 57.07 56.67 2e4m s TYR 118 Cb -0.02 -1.92 0.02 0.00 0.38 0.00 0.00 41.96 40.41 2e4m s TYR 118 CO -0.00 0.31 0.69 -0.80 -1.52 0.00 0.00 175.55 174.23 2e4m s ASN 119 N -0.29 5.54 0.53 -0.18 0.01 -0.57 -4.80 114.94 115.17 2e4m s ASN 119 Ca 0.07 -0.00 0.18 0.00 -0.71 0.00 0.00 52.86 52.40 2e4m s ASN 119 Cb -0.12 -1.06 1.32 0.00 0.41 0.00 0.00 41.25 41.80 2e4m s ASN 119 CO 0.02 -0.90 2.13 0.74 -1.51 0.00 0.00 177.10 177.58 2e4m h THR 120 N 0.31 0.93 -0.03 1.60 2.02 -2.00 -0.22 112.91 115.52 2e4m h THR 120 Ca -0.43 0.00 0.00 0.00 0.77 0.00 0.00 66.41 66.75 2e4m h THR 120 Cb 1.28 0.96 0.00 0.00 -1.74 0.00 0.00 68.15 68.65 2e4m h THR 120 CO 0.53 0.00 0.00 -0.90 0.37 0.00 0.00 175.52 175.52 2e4m n ASP 121 N -4.47 0.39 0.00 4.18 3.85 -1.26 -4.87 116.55 114.37 2e4m n ASP 121 Ca -0.01 -1.40 0.00 0.00 -0.71 0.00 0.00 54.79 52.67 2e4m n ASP 121 Cb 0.16 -0.02 0.00 0.00 -1.35 0.00 0.00 41.12 39.91 2e4m n ASP 121 CO 0.00 0.00 0.00 0.47 -1.01 0.00 0.00 177.20 176.66 2e4m n ASP 122 N -0.57 -3.33 -4.88 -1.12 8.00 -0.09 -4.98 116.55 109.58 2e4m n ASP 122 Ca 0.16 0.00 -0.30 0.00 0.71 0.00 0.00 54.79 55.36 2e4m n ASP 122 Cb 0.14 -1.05 0.01 0.00 -0.02 0.00 0.00 41.12 40.20 2e4m n ASP 122 CO 0.00 0.00 0.00 0.42 -0.39 0.00 0.00 177.20 177.23 2e4m s THR 123 N -1.92 4.57 -0.07 -3.53 -4.23 -1.26 -1.04 115.64 108.16 2e4m s THR 123 Ca 0.00 0.73 0.02 0.00 -1.18 0.00 0.00 61.69 61.26 2e4m s THR 123 Cb 0.00 -3.81 -0.03 0.00 1.34 0.00 0.00 72.50 70.00 2e4m s THR 123 CO 0.00 -1.04 -0.11 -0.76 -0.54 0.00 0.00 174.62 172.17 2e4m s LEU 124 N -5.14 2.92 0.12 4.79 1.43 -1.26 -1.51 118.68 120.02 2e4m s LEU 124 Ca 0.54 -0.15 -0.02 0.00 -1.03 0.00 0.00 54.13 53.47 2e4m s LEU 124 Cb -0.11 -1.62 -0.03 0.00 0.03 0.00 0.00 46.19 44.45 2e4m s LEU 124 CO 0.52 0.31 0.08 -0.51 0.23 0.00 0.00 176.35 176.99 2e4m s ILE 125 N -0.53 0.11 0.04 -0.59 1.10 -0.25 -4.09 121.20 116.99 2e4m s ILE 125 Ca 0.08 -1.81 0.00 0.00 -0.51 0.00 0.00 60.65 58.41 2e4m s ILE 125 Cb -0.12 -1.93 -0.04 0.00 0.15 0.00 0.00 42.46 40.52 2e4m s ILE 125 CO 0.02 -0.52 0.13 0.68 -2.11 0.00 0.00 174.94 173.14 2e4m s VAL 126 N -4.02 4.93 0.04 4.00 -7.23 -0.34 0.20 120.40 117.98 2e4m s VAL 126 Ca 0.20 -0.49 -0.17 0.00 -1.81 0.00 0.00 61.98 59.72 2e4m s VAL 126 Cb 0.07 -3.34 0.03 0.00 0.56 0.00 0.00 36.38 33.70 2e4m s VAL 126 CO -0.00 0.22 0.38 -0.55 -0.31 0.00 0.00 175.10 174.84 2e4m s SER 127 N -2.17 -0.24 0.92 4.85 0.15 -0.46 -4.85 113.70 111.90 2e4m s SER 127 Ca 0.29 -0.03 -0.11 0.00 0.70 0.00 0.00 55.95 56.79 2e4m s SER 127 Cb -0.12 0.40 0.14 0.00 -1.71 0.00 0.00 66.02 64.73 2e4m s SER 127 CO 0.21 -0.64 1.11 0.42 1.20 0.00 0.00 173.24 175.54 2e4m s THR 128 N -2.41 2.44 0.06 6.45 -4.23 -1.26 -1.19 115.64 115.50 2e4m s THR 128 Ca -0.06 0.14 -0.21 0.00 -1.18 0.00 0.00 61.69 60.38 2e4m s THR 128 Cb -0.01 -2.35 -0.06 0.00 1.34 0.00 0.00 72.50 71.42 2e4m s THR 128 CO -0.02 -0.19 0.63 -1.10 -0.54 0.00 0.00 174.62 173.40 2e4m s GLN 129 N -4.73 4.33 0.41 3.99 -0.21 -1.25 -4.84 119.66 117.36 2e4m s GLN 129 Ca 0.65 0.84 0.03 0.00 0.02 0.00 0.00 55.36 56.90 2e4m s GLN 129 Cb -0.21 -3.28 -0.01 0.00 1.00 0.00 0.00 33.01 30.50 2e4m s GLN 129 CO 0.58 0.51 0.12 0.25 -2.12 0.00 0.00 175.29 174.63 2e4m n THR 130 N 2.10 0.00 1.26 -0.19 -2.24 -1.26 -5.04 114.28 108.91 2e4m n THR 130 Ca -0.08 -2.30 0.08 0.00 -2.27 0.00 0.00 64.05 59.49 2e4m n THR 130 Cb 0.50 0.76 0.31 0.00 -2.10 0.00 0.00 70.33 69.80 2e4m n THR 130 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 2e4m n ASN 131 N -1.50 1.43 -4.76 3.42 4.13 -1.26 -4.96 115.26 111.76 2e4m n ASN 131 Ca -0.08 -1.78 -0.39 0.00 1.68 0.00 0.00 54.58 54.01 2e4m n ASN 131 Cb 0.60 -0.13 -0.06 0.00 -1.54 0.00 0.00 39.78 38.65 2e4m n ASN 131 CO 0.00 0.00 0.00 -0.55 0.28 0.00 0.00 177.26 176.99 2e4m s SER 132 N -1.36 7.51 0.00 6.41 0.15 -1.26 -4.92 113.70 120.23 2e4m s SER 132 Ca 0.27 1.90 0.09 0.00 0.70 0.00 0.00 55.95 58.91 2e4m s SER 132 Cb 0.14 -2.60 0.43 0.00 -1.71 0.00 0.00 66.02 62.29 2e4m s SER 132 CO 0.21 0.06 1.18 -0.46 1.20 0.00 0.00 173.24 175.42 2e4m n ASN 133 N 1.07 0.00 0.00 5.45 0.23 -1.26 -2.61 115.26 118.14 2e4m n ASN 133 Ca -0.00 0.22 0.08 0.00 -0.53 0.00 0.00 54.58 54.35 2e4m n ASN 133 Cb 0.48 -0.32 0.49 0.00 -2.08 0.00 0.00 39.78 38.35 2e4m n ASN 133 CO 0.00 0.00 0.00 -0.46 -0.93 0.00 0.00 177.26 175.87 2e4m n ASN 134 N -1.32 0.00 -0.28 0.53 2.04 -1.26 -1.87 115.26 113.09 2e4m n ASN 134 Ca 0.04 -0.98 0.03 0.00 -0.44 0.00 0.00 54.58 53.22 2e4m n ASN 134 Cb 0.08 0.00 0.04 0.00 -2.53 0.00 0.00 39.78 37.37 2e4m n ASN 134 CO 0.00 0.00 0.00 0.00 -0.44 0.00 0.00 177.26 176.82 2e4m n GLN 135 N -0.84 0.80 -4.29 -3.83 6.02 -1.07 -1.75 117.38 112.41 2e4m n GLN 135 Ca 0.12 -1.16 -0.35 0.00 -0.01 0.00 0.00 57.00 55.61 2e4m n GLN 135 Cb 0.06 -1.13 -0.10 0.00 1.02 0.00 0.00 30.24 30.09 2e4m n GLN 135 CO 0.00 0.00 0.00 -0.06 -1.01 0.00 0.00 177.06 175.99 2e4m s PHE 136 N -0.66 3.17 0.16 1.08 2.99 -0.78 -4.43 117.98 119.51 2e4m s PHE 136 Ca 0.09 0.10 0.08 0.00 0.00 0.00 0.00 56.93 57.20 2e4m s PHE 136 Cb 0.06 -1.88 -0.04 0.00 0.00 0.00 0.00 43.02 41.16 2e4m s PHE 136 CO 0.08 0.33 -0.17 -0.06 -0.00 0.00 0.00 175.22 175.40 2e4m s PHE 137 N -0.44 1.75 0.10 0.36 0.40 -0.21 -1.31 117.98 118.63 2e4m s PHE 137 Ca 0.08 -0.49 0.07 0.00 -0.60 0.00 0.00 56.93 55.99 2e4m s PHE 137 Cb -0.12 -0.87 -0.04 0.00 0.51 0.00 0.00 43.02 42.50 2e4m s PHE 137 CO 0.02 0.30 -0.11 0.15 0.70 0.00 0.00 175.22 176.28 2e4m s LYS 138 N -2.85 2.09 -0.11 0.44 1.02 0.14 -0.79 119.74 119.67 2e4m s LYS 138 Ca 0.15 -1.04 0.03 0.00 0.02 0.00 0.00 55.97 55.13 2e4m s LYS 138 Cb -0.05 -2.28 0.01 0.00 -0.52 0.00 0.00 37.83 34.98 2e4m s LYS 138 CO 0.06 0.51 -0.20 -0.06 -0.92 0.00 0.00 175.35 174.74 2e4m s PHE 139 N -1.20 2.32 -0.10 3.18 0.40 -1.26 -0.20 117.98 121.12 2e4m s PHE 139 Ca 0.21 -1.06 0.00 0.00 -0.60 0.00 0.00 56.93 55.48 2e4m s PHE 139 Cb -0.11 -1.60 0.02 0.00 0.51 0.00 0.00 43.02 41.84 2e4m s PHE 139 CO 0.13 -0.48 -0.09 -1.12 0.70 0.00 0.00 175.22 174.36 2e4m s SER 140 N 0.69 2.06 -0.04 1.36 0.01 -0.44 -4.90 113.70 112.45 2e4m s SER 140 Ca -0.12 -0.31 -0.30 0.00 1.31 0.00 0.00 55.95 56.54 2e4m s SER 140 Cb -0.16 -0.84 -0.06 0.00 0.21 0.00 0.00 66.02 65.17 2e4m s SER 140 CO 0.02 -0.07 1.64 0.21 0.41 0.00 0.00 173.24 175.44 2e4m s ASN 141 N 1.40 6.68 0.15 2.44 3.84 -1.26 -1.04 114.94 127.14 2e4m s ASN 141 Ca -0.01 2.25 -0.16 0.00 0.21 0.00 0.00 52.86 55.15 2e4m s ASN 141 Cb -0.13 -2.54 0.01 0.00 -0.55 0.00 0.00 41.25 38.03 2e4m s ASN 141 CO -0.05 -0.91 1.80 0.00 -2.79 0.00 0.00 177.10 175.15 2e4m h ILE 143 N 0.52 1.30 -0.63 0.00 2.04 -1.91 -1.78 117.51 117.05 2e4m h ILE 143 Ca 0.14 -1.43 -0.00 0.00 1.00 0.00 0.00 64.86 64.57 2e4m h ILE 143 Cb -0.03 1.58 -0.03 0.00 -0.74 0.00 0.00 36.82 37.59 2e4m h ILE 143 CO -0.03 0.46 0.39 0.22 0.00 0.00 0.00 178.15 179.19 2e4m h TYR 144 N 0.43 0.83 -0.49 1.37 5.03 -1.92 0.10 116.97 122.32 2e4m h TYR 144 Ca 0.05 0.00 0.04 0.00 2.58 0.00 0.00 58.73 61.40 2e4m h TYR 144 Cb 0.84 -0.27 -0.04 0.00 1.55 0.00 0.00 36.73 38.80 2e4m h TYR 144 CO 0.07 0.56 0.25 1.49 -1.32 0.00 0.00 178.16 179.21 2e4m h GLU 145 N 0.86 0.48 0.13 1.82 4.81 -1.18 -2.36 114.58 119.14 2e4m h GLU 145 Ca 0.23 -0.03 -0.28 0.00 -0.13 0.00 0.00 59.36 59.14 2e4m h GLU 145 Cb -0.03 -0.11 0.02 0.00 0.63 0.00 0.00 28.75 29.25 2e4m h GLU 145 CO -0.04 0.32 -1.25 0.00 -0.73 0.00 0.00 179.01 177.31 2e4m h ALA 146 N 1.26 0.07 0.00 2.92 0.00 -0.87 -3.40 119.26 119.23 2e4m h ALA 146 Ca 0.21 -0.83 -0.00 0.00 0.00 0.00 0.00 54.91 54.28 2e4m h ALA 146 Cb 0.11 0.06 -0.00 0.00 0.00 0.00 0.00 17.79 17.95 2e4m h ALA 146 CO -0.14 0.84 -1.42 1.28 0.00 0.00 0.00 179.25 179.81 2e4m n LEU 147 N -3.65 0.00 -4.73 0.00 4.77 0.31 -4.94 117.00 108.76 2e4m n LEU 147 Ca -0.11 0.00 -0.42 0.00 -0.03 0.00 0.00 56.01 55.45 2e4m n LEU 147 Cb 1.01 0.01 -0.03 0.00 -2.33 0.00 0.00 43.42 42.07 2e4m n LEU 147 CO 0.56 0.01 1.29 0.21 -1.33 0.00 0.00 177.39 178.13 2e4m s ASN 148 N -3.07 6.46 -1.90 -1.43 2.47 -0.89 -1.73 114.94 114.85 2e4m s ASN 148 Ca -0.03 2.79 0.00 0.00 0.42 0.00 0.00 52.86 56.04 2e4m s ASN 148 Cb 0.06 -2.60 0.00 0.00 -1.45 0.00 0.00 41.25 37.25 2e4m s ASN 148 CO 0.37 -0.90 0.00 0.59 -3.72 0.00 0.00 177.10 173.44 2e4m n ASN 149 N 3.61 -5.49 -4.78 -4.21 3.02 0.10 -5.00 115.26 102.52 2e4m n ASN 149 Ca 0.14 0.25 -0.33 0.00 -0.03 0.00 0.00 54.58 54.60 2e4m n ASN 149 Cb 0.37 -4.63 -0.07 0.00 -0.61 0.00 0.00 39.78 34.84 2e4m n ASN 149 CO 0.00 0.00 0.00 -0.13 -2.62 0.00 0.00 177.26 174.51 2e4m s ARG 150 N -4.28 3.07 -0.21 3.52 1.81 -0.71 -4.89 118.95 117.26 2e4m s ARG 150 Ca 0.00 -0.47 -0.24 0.00 -1.72 0.00 0.00 55.73 53.30 2e4m s ARG 150 Cb 0.00 -2.86 -0.01 0.00 -0.45 0.00 0.00 34.95 31.62 2e4m s ARG 150 CO 0.00 0.65 0.78 1.21 -0.68 0.00 0.00 175.30 177.27 2e4m s ASN 151 N -1.68 6.83 0.16 0.23 2.47 -1.26 -1.17 114.94 120.51 2e4m s ASN 151 Ca 0.22 1.03 0.06 0.00 0.42 0.00 0.00 52.86 54.59 2e4m s ASN 151 Cb -0.12 -2.42 -0.04 0.00 -1.45 0.00 0.00 41.25 37.22 2e4m s ASN 151 CO 0.13 -0.43 -0.13 0.00 -3.72 0.00 0.00 177.10 172.95 2e4m s LYS 153 N -3.23 2.24 -0.22 0.00 -2.85 -0.02 -0.62 119.74 115.03 2e4m s LYS 153 Ca 0.15 -0.89 0.01 0.00 -1.00 0.00 0.00 55.97 54.24 2e4m s LYS 153 Cb -0.02 -2.28 0.05 0.00 -2.06 0.00 0.00 37.83 33.52 2e4m s LYS 153 CO 0.04 0.56 -0.07 -0.51 0.10 0.00 0.00 175.35 175.47 2e4m s LEU 154 N -1.34 2.45 0.13 2.77 1.02 -1.26 -1.57 118.68 120.88 2e4m s LEU 154 Ca 0.15 -1.07 -0.19 0.00 0.02 0.00 0.00 54.13 53.03 2e4m s LEU 154 Cb -0.11 -1.19 -0.07 0.00 0.02 0.00 0.00 46.19 44.84 2e4m s LEU 154 CO 0.05 -0.21 0.63 -1.10 0.02 0.00 0.00 176.35 175.74 2e4m s GLN 155 N 1.40 4.23 0.32 1.70 -0.21 -0.13 -0.84 119.66 126.14 2e4m s GLN 155 Ca -0.04 0.79 -0.28 0.00 0.02 0.00 0.00 55.36 55.84 2e4m s GLN 155 Cb -0.18 -3.12 -0.09 0.00 1.00 0.00 0.00 33.01 30.61 2e4m s GLN 155 CO -0.07 0.56 1.16 -0.08 -2.12 0.00 0.00 175.29 174.74 2e4m s THR 156 N -1.25 3.23 0.67 -0.19 -1.32 -0.58 -1.18 115.64 115.01 2e4m s THR 156 Ca 0.34 1.18 0.44 0.00 -1.21 0.00 0.00 61.69 62.44 2e4m s THR 156 Cb -0.19 -3.73 0.45 0.00 -1.51 0.00 0.00 72.50 67.52 2e4m s THR 156 CO 0.21 0.24 2.37 -0.61 -2.21 0.00 0.00 174.62 174.61 2e4m h GLN 157 N 3.39 0.00 -0.20 7.08 5.75 -1.45 -2.82 115.11 126.85 2e4m h GLN 157 Ca -0.48 0.00 -0.04 0.00 -0.15 0.00 0.00 58.65 57.98 2e4m h GLN 157 Cb 1.22 0.00 -0.01 0.00 1.07 0.00 0.00 27.48 29.76 2e4m h GLN 157 CO 0.65 0.00 -0.06 -0.07 -2.65 0.00 0.00 178.83 176.71 2e4m h LEU 158 N 0.00 0.29 -6.95 -2.39 3.38 -1.83 -3.44 115.31 104.36 2e4m h LEU 158 Ca 0.00 -0.05 0.07 0.00 0.09 0.00 0.00 57.88 57.99 2e4m h LEU 158 Cb 0.02 -0.07 -0.22 0.00 0.09 0.00 0.00 40.66 40.47 2e4m h LEU 158 CO -0.00 0.39 0.03 0.21 0.09 0.00 0.00 178.44 179.16 2e4m s ASN 159 N -6.84 -0.93 0.52 -0.43 3.84 -1.06 -5.05 114.94 104.97 2e4m s ASN 159 Ca -0.06 1.38 0.35 0.00 0.21 0.00 0.00 52.86 54.74 2e4m s ASN 159 Cb 0.16 1.75 1.78 0.00 -0.55 0.00 0.00 41.25 44.39 2e4m s ASN 159 CO 0.73 -0.20 2.06 0.77 -2.79 0.00 0.00 177.10 177.67 2e4m h SER 160 N 7.32 0.00 -0.54 -4.21 4.64 -1.86 -1.73 113.55 117.17 2e4m h SER 160 Ca -0.24 0.00 -0.37 0.00 -0.47 0.00 0.00 61.79 60.72 2e4m h SER 160 Cb 1.16 0.00 -0.24 0.00 -0.31 0.00 0.00 62.40 63.01 2e4m h SER 160 CO 0.13 0.00 -0.30 -0.67 -0.87 0.00 0.00 176.83 175.12 2e4m n ASP 161 N -2.79 3.99 -4.00 4.97 2.03 -1.26 -4.94 116.55 114.56 2e4m n ASP 161 Ca -0.01 -3.80 -0.30 0.00 0.52 0.00 0.00 54.79 51.20 2e4m n ASP 161 Cb 0.12 -0.55 -0.16 0.00 -0.72 0.00 0.00 41.12 39.80 2e4m n ASP 161 CO 0.00 0.00 0.00 -0.13 -1.92 0.00 0.00 177.20 175.15 2e4m s ARG 162 N -3.46 2.16 0.14 -0.67 1.81 -0.65 -3.61 118.95 114.67 2e4m s ARG 162 Ca 0.49 -0.55 0.10 0.00 -1.72 0.00 0.00 55.73 54.06 2e4m s ARG 162 Cb 0.42 -2.07 -0.04 0.00 -0.45 0.00 0.00 34.95 32.81 2e4m s ARG 162 CO 0.00 -0.26 -0.24 -0.06 -0.68 0.00 0.00 175.30 174.06 2e4m s PHE 163 N 1.51 2.17 -0.04 -0.53 0.40 -0.30 -1.52 117.98 119.67 2e4m s PHE 163 Ca 0.04 -0.39 -0.30 0.00 -0.60 0.00 0.00 56.93 55.69 2e4m s PHE 163 Cb -0.13 -1.14 -0.06 0.00 0.51 0.00 0.00 43.02 42.19 2e4m s PHE 163 CO -0.10 0.35 1.76 -1.17 0.70 0.00 0.00 175.22 176.76 2e4m s LEU 164 N -2.23 4.31 -0.06 -0.37 2.96 -0.02 -1.85 118.68 121.42 2e4m s LEU 164 Ca 0.14 2.33 -0.02 0.00 -0.22 0.00 0.00 54.13 56.36 2e4m s LEU 164 Cb -0.09 -3.53 0.04 0.00 0.50 0.00 0.00 46.19 43.10 2e4m s LEU 164 CO 0.07 -1.01 0.11 -0.44 -1.32 0.00 0.00 176.35 173.76 2e4m s SER 165 N 3.86 0.31 0.22 3.68 0.01 0.25 -4.53 113.70 117.50 2e4m s SER 165 Ca 0.79 0.22 -0.31 0.00 1.31 0.00 0.00 55.95 57.95 2e4m s SER 165 Cb -0.36 0.10 -0.11 0.00 0.21 0.00 0.00 66.02 65.87 2e4m s SER 165 CO 0.33 -0.18 1.57 -0.75 0.41 0.00 0.00 173.24 174.62 2e4m s LYS 166 N 1.56 4.19 0.56 12.44 2.20 -0.28 -0.47 119.74 139.94 2e4m s LYS 166 Ca -0.04 2.43 -0.20 0.00 -0.36 0.00 0.00 55.97 57.79 2e4m s LYS 166 Cb -0.12 -3.10 -0.04 0.00 -1.51 0.00 0.00 37.83 33.05 2e4m s LYS 166 CO -0.05 -0.59 1.28 1.21 -0.36 0.00 0.00 175.35 176.84 2e4m s ASN 167 N 0.83 5.25 0.22 1.43 3.04 -0.10 -4.85 114.94 120.76 2e4m s ASN 167 Ca 0.67 2.58 -0.31 0.00 0.04 0.00 0.00 52.86 55.84 2e4m s ASN 167 Cb -0.45 -2.62 -0.11 0.00 -1.54 0.00 0.00 41.25 36.53 2e4m s ASN 167 CO 0.38 -1.57 1.64 -0.22 -3.04 0.00 0.00 177.10 174.29 2e4m s LEU 168 N -3.75 4.37 -1.49 3.21 0.20 -1.26 -3.20 118.68 116.76 2e4m s LEU 168 Ca 0.74 2.82 0.00 0.00 0.69 0.00 0.00 54.13 58.38 2e4m s LEU 168 Cb -0.36 -3.61 0.00 0.00 -0.43 0.00 0.00 46.19 41.80 2e4m s LEU 168 CO 0.41 -0.91 0.00 0.59 -0.29 0.00 0.00 176.35 176.15 2e4m n ASN 169 N 3.51 -4.99 -3.72 3.68 5.03 -1.26 -4.96 115.26 112.55 2e4m n ASN 169 Ca 0.13 0.10 -0.11 0.00 0.87 0.00 0.00 54.58 55.57 2e4m n ASN 169 Cb 0.37 -4.21 -0.07 0.00 -1.02 0.00 0.00 39.78 34.85 2e4m n ASN 169 CO 0.00 0.00 0.00 -0.55 -1.83 0.00 0.00 177.26 174.88 2e4m s SER 170 N -2.07 -0.16 0.04 6.41 0.15 -1.19 -5.03 113.70 111.84 2e4m s SER 170 Ca 0.00 -0.20 0.27 0.00 0.70 0.00 0.00 55.95 56.72 2e4m s SER 170 Cb 0.00 0.39 0.92 0.00 -1.71 0.00 0.00 66.02 65.62 2e4m s SER 170 CO 0.00 -0.67 1.73 0.00 1.20 0.00 0.00 173.24 175.49 2e4m n GLN 171 N 0.38 0.06 -2.30 5.44 1.13 -1.26 -4.27 117.38 116.56 2e4m n GLN 171 Ca -0.18 0.03 -0.40 0.00 -1.94 0.00 0.00 57.00 54.51 2e4m n GLN 171 Cb 0.60 -1.55 -0.03 0.00 0.11 0.00 0.00 30.24 29.37 2e4m n GLN 171 CO 0.00 0.00 0.00 0.42 -1.44 0.00 0.00 177.06 176.04 2e4m s ILE 172 N -3.03 3.10 -0.15 5.09 1.01 -1.26 -0.69 121.20 125.28 2e4m s ILE 172 Ca 0.12 1.11 -0.05 0.00 0.00 0.00 0.00 60.65 61.83 2e4m s ILE 172 Cb 0.17 -3.70 -0.04 0.00 0.01 0.00 0.00 42.46 38.90 2e4m s ILE 172 CO 0.60 0.26 0.02 -0.63 0.00 0.00 0.00 174.94 175.20 2e4m s ILE 173 N -1.16 4.48 0.30 2.92 1.01 -0.73 -0.92 121.20 127.09 2e4m s ILE 173 Ca 0.47 -0.16 0.05 0.00 0.00 0.00 0.00 60.65 61.01 2e4m s ILE 173 Cb -0.36 -2.97 -0.03 0.00 0.01 0.00 0.00 42.46 39.11 2e4m s ILE 173 CO 0.47 0.51 0.23 0.68 0.00 0.00 0.00 174.94 176.83 2e4m s VAL 174 N -0.03 0.04 0.14 2.92 -7.23 0.38 -2.34 120.40 114.28 2e4m s VAL 174 Ca 0.04 -2.00 -0.20 0.00 -1.81 0.00 0.00 61.98 58.01 2e4m s VAL 174 Cb -0.13 -2.50 -0.07 0.00 0.56 0.00 0.00 36.38 34.24 2e4m s VAL 174 CO 0.02 0.00 0.65 -0.76 -0.31 0.00 0.00 175.10 174.70 2e4m s LEU 175 N -3.32 4.48 -0.08 1.32 1.02 -0.56 -0.58 118.68 120.95 2e4m s LEU 175 Ca 0.40 1.37 -0.18 0.00 0.02 0.00 0.00 54.13 55.74 2e4m s LEU 175 Cb 0.04 -3.21 0.04 0.00 0.02 0.00 0.00 46.19 43.08 2e4m s LEU 175 CO 0.23 0.18 0.42 0.86 0.02 0.00 0.00 176.35 178.05 2e4m s TRP 176 N -1.27 -0.38 0.63 0.29 -0.11 -0.77 -0.30 118.94 117.04 2e4m s TRP 176 Ca 0.35 0.76 -0.18 0.00 1.22 0.00 0.00 56.10 58.26 2e4m s TRP 176 Cb -0.19 0.17 -0.05 0.00 -1.50 0.00 0.00 33.47 31.90 2e4m s TRP 176 CO 0.21 -0.36 0.78 1.04 -4.62 0.00 0.00 176.95 174.00 2e4m n GLN 177 N 1.84 0.64 -1.91 5.86 6.02 -1.24 -1.15 117.38 127.44 2e4m n GLN 177 Ca -0.18 0.26 -0.42 0.00 -0.01 0.00 0.00 57.00 56.65 2e4m n GLN 177 Cb 0.57 -2.00 -0.03 0.00 1.02 0.00 0.00 30.24 29.79 2e4m n GLN 177 CO 0.00 0.00 0.00 -0.46 -1.01 0.00 0.00 177.06 175.59 2e4m s TRP 178 N -1.67 2.30 -0.07 1.08 -0.11 -1.26 -4.84 118.94 114.38 2e4m s TRP 178 Ca 0.73 0.25 0.10 0.00 1.22 0.00 0.00 56.10 58.39 2e4m s TRP 178 Cb -0.40 -3.98 0.15 0.00 -1.50 0.00 0.00 33.47 27.73 2e4m s TRP 178 CO 0.50 -3.99 1.04 1.19 -4.62 0.00 0.00 176.95 171.07 2e4m n PHE 179 N 5.88 0.00 -2.37 5.86 3.72 -1.26 -4.99 117.46 124.29 2e4m n PHE 179 Ca 0.16 -0.57 -0.20 0.00 -0.05 0.00 0.00 57.45 56.79 2e4m n PHE 179 Cb 0.41 -0.10 -0.01 0.00 -0.94 0.00 0.00 39.48 38.84 2e4m n PHE 179 CO 0.00 0.00 0.00 -3.47 -0.05 0.00 0.00 176.76 173.24 2e4m n ASP 180 N -0.79 -5.75 -4.79 4.37 4.64 -1.26 -4.97 116.55 108.00 2e4m n ASP 180 Ca 0.08 0.02 -0.36 0.00 -1.38 0.00 0.00 54.79 53.15 2e4m n ASP 180 Cb 0.60 -4.80 -0.06 0.00 -1.04 0.00 0.00 41.12 35.82 2e4m n ASP 180 CO 0.00 0.00 0.00 -0.55 -0.82 0.00 0.00 177.20 175.83 2e4m s SER 181 N -2.07 7.17 0.61 1.67 0.15 -1.26 -4.93 113.70 115.03 2e4m s SER 181 Ca 0.00 1.84 0.36 0.00 0.70 0.00 0.00 55.95 58.84 2e4m s SER 181 Cb 0.00 -2.57 1.97 0.00 -1.71 0.00 0.00 66.02 63.71 2e4m s SER 181 CO 0.00 -0.19 2.25 0.77 1.20 0.00 0.00 173.24 177.27 2e4m h SER 182 N 2.81 0.00 0.41 5.45 4.64 -1.94 -0.43 113.55 124.48 2e4m h SER 182 Ca -0.47 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.85 2e4m h SER 182 Cb 1.19 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.28 2e4m h SER 182 CO 0.64 0.02 0.00 0.54 -0.87 0.00 0.00 176.83 177.16 2e4m n ARG 183 N -3.45 0.06 -0.14 4.77 1.74 -1.26 -2.27 116.66 116.11 2e4m n ARG 183 Ca -0.03 0.38 0.04 0.00 -0.77 0.00 0.00 57.85 57.48 2e4m n ARG 183 Cb 0.12 -1.63 0.11 0.00 -1.02 0.00 0.00 32.46 30.04 2e4m n ARG 183 CO 0.00 0.00 0.00 1.04 -1.52 0.00 0.00 177.63 177.15 2e4m n GLN 184 N -1.75 2.75 -4.78 5.56 6.02 -0.17 -1.13 117.38 123.88 2e4m n GLN 184 Ca 0.02 -2.01 -0.29 0.00 -0.01 0.00 0.00 57.00 54.70 2e4m n GLN 184 Cb 0.14 -1.27 -0.17 0.00 1.02 0.00 0.00 30.24 29.96 2e4m n GLN 184 CO 0.00 0.00 0.00 0.15 -1.01 0.00 0.00 177.06 176.20 2e4m s LYS 185 N -1.44 2.51 -0.13 -1.09 1.02 -1.16 -4.59 119.74 114.86 2e4m s LYS 185 Ca 0.18 -0.68 -0.00 0.00 0.02 0.00 0.00 55.97 55.49 2e4m s LYS 185 Cb 0.12 -2.01 0.03 0.00 -0.52 0.00 0.00 37.83 35.45 2e4m s LYS 185 CO 0.08 0.05 -0.08 -1.58 -0.92 0.00 0.00 175.35 172.89 2e4m s TRP 186 N 0.67 1.60 -0.31 3.18 0.52 0.21 -0.92 118.94 123.89 2e4m s TRP 186 Ca -0.13 -0.86 -0.25 0.00 0.02 0.00 0.00 56.10 54.89 2e4m s TRP 186 Cb -0.16 -1.29 0.01 0.00 -1.15 0.00 0.00 33.47 30.87 2e4m s TRP 186 CO 0.03 -0.55 0.88 0.99 0.02 0.00 0.00 176.95 178.32 2e4m s THR 187 N 1.67 4.70 -0.22 2.01 2.01 0.04 -0.09 115.64 125.75 2e4m s THR 187 Ca 0.04 1.33 -0.18 0.00 0.31 0.00 0.00 61.69 63.20 2e4m s THR 187 Cb -0.13 -4.24 -0.03 0.00 0.01 0.00 0.00 72.50 68.11 2e4m s THR 187 CO -0.08 -0.33 0.49 -0.63 -0.69 0.00 0.00 174.62 173.37 2e4m s ILE 188 N 3.18 5.11 -0.02 1.82 1.01 -0.32 -0.92 121.20 131.06 2e4m s ILE 188 Ca 0.36 0.87 0.00 0.00 0.00 0.00 0.00 60.65 61.88 2e4m s ILE 188 Cb -0.13 -3.81 0.02 0.00 0.01 0.00 0.00 42.46 38.55 2e4m s ILE 188 CO 0.14 0.16 0.01 -1.61 0.00 0.00 0.00 174.94 173.63 2e4m s GLU 189 N 1.82 0.11 -0.00 2.79 2.02 -0.36 0.03 118.70 125.11 2e4m s GLU 189 Ca 0.22 0.09 -0.26 0.00 0.02 0.00 0.00 54.97 55.04 2e4m s GLU 189 Cb -0.15 -0.29 -0.04 0.00 0.10 0.00 0.00 34.13 33.75 2e4m s GLU 189 CO 0.09 -0.11 0.80 -0.47 0.02 0.00 0.00 175.26 175.60 2e4m s TYR 190 N 0.76 3.66 -0.34 1.61 6.14 -1.26 -0.75 117.35 127.17 2e4m s TYR 190 Ca -0.07 1.46 -0.12 0.00 0.64 0.00 0.00 57.07 58.98 2e4m s TYR 190 Cb -0.10 -2.90 -0.01 0.00 0.42 0.00 0.00 41.96 39.37 2e4m s TYR 190 CO -0.02 0.13 0.22 1.21 0.64 0.00 0.00 175.55 177.73 2e4m s ASN 191 N 0.53 5.89 0.23 4.32 3.84 0.58 -4.96 114.94 125.37 2e4m s ASN 191 Ca 0.42 -0.55 -0.06 0.00 0.21 0.00 0.00 52.86 52.87 2e4m s ASN 191 Cb -0.20 -2.09 0.32 0.00 -0.55 0.00 0.00 41.25 38.73 2e4m s ASN 191 CO 0.23 -0.26 1.83 -0.33 -2.79 0.00 0.00 177.10 175.78 2e4m h GLU 192 N 8.46 0.82 -0.26 0.43 4.39 -1.96 0.61 114.58 127.07 2e4m h GLU 192 Ca -0.31 -0.05 -0.14 0.00 0.34 0.00 0.00 59.36 59.21 2e4m h GLU 192 Cb 1.15 -0.19 -0.01 0.00 -0.10 0.00 0.00 28.75 29.60 2e4m h GLU 192 CO 0.64 0.55 -0.40 1.79 -1.16 0.00 0.00 179.01 180.43 2e4m h THR 193 N 0.85 1.30 0.00 1.13 1.35 -1.95 -2.98 112.91 112.60 2e4m h THR 193 Ca 0.35 -1.57 0.00 0.00 -0.55 0.00 0.00 66.41 64.65 2e4m h THR 193 Cb 0.21 1.53 0.00 0.00 -1.73 0.00 0.00 68.15 68.16 2e4m h THR 193 CO -0.19 0.50 -0.44 0.29 -0.25 0.00 0.00 175.52 175.43 2e4m n LYS 194 N -4.03 0.25 -4.05 4.72 4.76 -1.12 -4.95 118.16 113.73 2e4m n LYS 194 Ca -0.02 0.11 -0.29 0.00 -2.87 0.00 0.00 58.31 55.24 2e4m n LYS 194 Cb 0.52 -1.69 -0.03 0.00 -1.84 0.00 0.00 35.03 31.99 2e4m n LYS 194 CO 0.00 0.00 0.00 0.43 -1.37 0.00 0.00 177.40 176.46 2e4m n SER 195 N -2.07 -1.05 -3.64 4.39 7.64 0.19 -4.96 113.62 114.12 2e4m n SER 195 Ca 0.04 -1.02 -0.08 0.00 1.01 0.00 0.00 58.87 58.82 2e4m n SER 195 Cb 0.42 -2.89 -0.01 0.00 -1.01 0.00 0.00 64.21 60.72 2e4m n SER 195 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2e4m s ALA 196 N -3.81 -0.98 0.10 -0.43 0.00 -1.16 -4.93 121.76 110.54 2e4m s ALA 196 Ca 0.20 -0.49 0.04 0.00 0.00 0.00 0.00 51.96 51.71 2e4m s ALA 196 Cb -0.11 0.84 -0.04 0.00 0.00 0.00 0.00 23.12 23.81 2e4m s ALA 196 CO 0.91 -1.01 0.05 0.71 0.00 0.00 0.00 175.76 176.42 2e4m s TYR 197 N -3.54 3.08 0.24 0.00 1.51 0.38 -0.31 117.35 118.71 2e4m s TYR 197 Ca 0.13 0.01 0.07 0.00 -1.01 0.00 0.00 57.07 56.27 2e4m s TYR 197 Cb -0.05 -1.55 -0.04 0.00 -0.11 0.00 0.00 41.96 40.21 2e4m s TYR 197 CO 0.08 0.50 0.15 0.95 -1.11 0.00 0.00 175.55 176.13 2e4m s THR 198 N -1.43 4.25 -0.17 -0.71 -4.23 0.07 -0.34 115.64 113.08 2e4m s THR 198 Ca 0.28 -1.45 -0.01 0.00 -1.18 0.00 0.00 61.69 59.33 2e4m s THR 198 Cb -0.11 -3.27 0.05 0.00 1.34 0.00 0.00 72.50 70.50 2e4m s THR 198 CO 0.20 -0.31 -0.03 -0.76 -0.54 0.00 0.00 174.62 173.18 2e4m s LEU 199 N -3.68 1.57 -0.28 4.79 1.02 -1.25 -1.23 118.68 119.62 2e4m s LEU 199 Ca 0.32 -0.71 -0.10 0.00 0.02 0.00 0.00 54.13 53.66 2e4m s LEU 199 Cb -0.08 -0.85 -0.05 0.00 0.02 0.00 0.00 46.19 45.24 2e4m s LEU 199 CO 0.24 -0.21 0.17 -0.75 0.02 0.00 0.00 176.35 175.81 2e4m s LYS 200 N 1.67 3.89 0.10 1.70 2.20 -0.10 -0.86 119.74 128.34 2e4m s LYS 200 Ca -0.00 -0.36 -0.31 0.00 -0.36 0.00 0.00 55.97 54.94 2e4m s LYS 200 Cb -0.16 -3.61 -0.08 0.00 -1.51 0.00 0.00 37.83 32.47 2e4m s LYS 200 CO -0.07 -0.19 1.51 0.00 -0.36 0.00 0.00 175.35 176.24 2e4m h GLN 202 N 7.35 0.38 -0.47 0.00 4.15 -0.99 -0.92 115.11 124.60 2e4m h GLN 202 Ca -0.42 -0.04 0.00 0.00 0.77 0.00 0.00 58.65 58.97 2e4m h GLN 202 Cb 1.20 -0.08 -0.02 0.00 0.21 0.00 0.00 27.48 28.79 2e4m h GLN 202 CO 0.90 0.31 0.31 1.49 -1.93 0.00 0.00 178.83 179.92 2e4m h GLU 203 N 0.39 0.62 0.00 1.69 4.81 -1.73 -3.36 114.58 117.01 2e4m h GLU 203 Ca 0.10 -0.04 0.00 0.00 -0.13 0.00 0.00 59.36 59.29 2e4m h GLU 203 Cb 0.06 -0.14 0.00 0.00 0.63 0.00 0.00 28.75 29.30 2e4m h GLU 203 CO -0.01 0.41 0.00 0.27 -0.73 0.00 0.00 179.01 178.95 2e4m n ASN 204 N -4.76 0.77 -2.13 1.04 6.94 -1.22 -5.02 115.26 110.88 2e4m n ASN 204 Ca 0.02 -1.19 -0.21 0.00 -0.02 0.00 0.00 54.58 53.18 2e4m n ASN 204 Cb 0.02 0.00 -0.04 0.00 -2.36 0.00 0.00 39.78 37.40 2e4m n ASN 204 CO 0.00 0.00 0.00 0.59 -1.03 0.00 0.00 177.26 176.82 2e4m n ASN 205 N -0.09 -5.81 -4.73 0.53 5.03 -0.35 -4.99 115.26 104.83 2e4m n ASN 205 Ca 0.00 0.16 -0.24 0.00 0.87 0.00 0.00 54.58 55.37 2e4m n ASN 205 Cb 0.19 -4.93 -0.07 0.00 -1.02 0.00 0.00 39.78 33.94 2e4m n ASN 205 CO 0.00 0.00 0.00 -0.13 -1.83 0.00 0.00 177.26 175.30 2e4m s ARG 206 N -4.62 2.25 -0.01 3.52 0.52 -1.25 -4.86 118.95 114.50 2e4m s ARG 206 Ca 0.00 -1.77 0.05 0.00 -0.52 0.00 0.00 55.73 53.48 2e4m s ARG 206 Cb 0.00 -2.03 -0.03 0.00 0.52 0.00 0.00 34.95 33.41 2e4m s ARG 206 CO 0.00 -0.06 -0.14 0.71 0.02 0.00 0.00 175.30 175.84 2e4m s TYR 207 N -2.56 2.70 -0.34 -0.53 2.02 -0.00 -0.46 117.35 118.18 2e4m s TYR 207 Ca 0.40 -0.16 -0.36 0.00 -0.37 0.00 0.00 57.07 56.58 2e4m s TYR 207 Cb 0.02 -1.57 -0.12 0.00 -0.40 0.00 0.00 41.96 39.89 2e4m s TYR 207 CO 0.22 0.26 2.13 -0.11 -1.57 0.00 0.00 175.55 176.48 2e4m n LEU 208 N 1.86 2.14 -3.81 -1.29 7.94 -0.04 -0.81 117.00 122.99 2e4m n LEU 208 Ca -0.16 0.51 -0.14 0.00 -1.11 0.00 0.00 56.01 55.11 2e4m n LEU 208 Cb 0.52 -1.24 -0.15 0.00 0.53 0.00 0.00 43.42 43.09 2e4m n LEU 208 CO 0.27 -0.67 -0.33 -0.89 -1.11 0.00 0.00 177.39 174.66 2e4m s THR 209 N 6.74 -0.03 -0.15 1.96 2.01 -0.38 -4.62 115.64 121.17 2e4m s THR 209 Ca 1.08 0.13 -0.29 0.00 0.31 0.00 0.00 61.69 62.92 2e4m s THR 209 Cb -0.91 -0.08 -0.03 0.00 0.01 0.00 0.00 72.50 71.49 2e4m s THR 209 CO 0.52 0.05 1.53 0.86 -0.69 0.00 0.00 174.62 176.88 2e4m s TRP 210 N 0.66 2.27 -0.34 4.92 -0.00 -0.75 -0.95 118.94 124.75 2e4m s TRP 210 Ca -0.05 0.55 -0.16 0.00 -0.00 0.00 0.00 56.10 56.44 2e4m s TRP 210 Cb -0.08 -3.84 -0.01 0.00 -0.00 0.00 0.00 33.47 29.54 2e4m s TRP 210 CO -0.02 -2.88 0.40 0.42 -0.00 0.00 0.00 176.95 174.87 2e4m s ILE 211 N 4.34 5.13 -0.53 5.86 -1.09 -0.48 -4.88 121.20 129.56 2e4m s ILE 211 Ca 0.67 0.13 -0.21 0.00 -2.23 0.00 0.00 60.65 59.01 2e4m s ILE 211 Cb -0.27 -3.85 0.05 0.00 -1.58 0.00 0.00 42.46 36.81 2e4m s ILE 211 CO 0.25 -0.12 0.77 -1.10 -1.23 0.00 0.00 174.94 173.52 2e4m s GLN 212 N 2.11 3.21 0.05 2.79 -0.21 -1.26 -3.82 119.66 122.53 2e4m s GLN 212 Ca 0.14 -0.64 -0.05 0.00 0.02 0.00 0.00 55.36 54.83 2e4m s GLN 212 Cb -0.16 -4.09 0.02 0.00 1.00 0.00 0.00 33.01 29.78 2e4m s GLN 212 CO 0.12 -1.36 0.23 0.27 -2.12 0.00 0.00 175.29 172.43 2e4m n ASN 213 N 6.76 -0.44 0.27 5.90 0.23 -1.26 -4.99 115.26 121.73 2e4m n ASN 213 Ca -0.03 -1.25 0.09 0.00 -0.53 0.00 0.00 54.58 52.86 2e4m n ASN 213 Cb 0.46 0.71 0.68 0.00 -2.08 0.00 0.00 39.78 39.55 2e4m n ASN 213 CO 0.00 0.00 0.00 0.77 -0.93 0.00 0.00 177.26 177.10 2e4m h SER 214 N 0.46 0.00 0.59 0.53 4.64 -2.04 -2.00 113.55 115.74 2e4m h SER 214 Ca -0.07 0.00 -0.21 0.00 -0.47 0.00 0.00 61.79 61.04 2e4m h SER 214 Cb 0.28 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.36 2e4m h SER 214 CO 0.09 0.00 -0.96 0.78 -0.87 0.00 0.00 176.83 175.87 2e4m h ASN 215 N 0.00 0.30 -5.43 4.97 -0.26 -1.96 -3.48 115.58 109.72 2e4m h ASN 215 Ca -0.00 -0.26 -0.41 0.00 -0.56 0.00 0.00 56.30 55.07 2e4m h ASN 215 Cb 0.00 -0.09 -0.03 0.00 -1.06 0.00 0.00 38.32 37.14 2e4m h ASN 215 CO 0.00 1.10 -0.62 0.59 -1.06 0.00 0.00 177.43 177.43 2e4m n ASN 216 N -3.62 -4.64 -4.78 5.81 5.03 -0.75 -4.86 115.26 107.44 2e4m n ASN 216 Ca -0.04 -0.47 -0.34 0.00 0.87 0.00 0.00 54.58 54.60 2e4m n ASN 216 Cb 0.86 -3.77 0.00 0.00 -1.02 0.00 0.00 39.78 35.85 2e4m n ASN 216 CO 0.00 0.00 0.00 -0.31 -1.83 0.00 0.00 177.26 175.12 2e4m s TYR 217 N -3.09 2.74 0.15 3.10 4.12 -1.25 -1.22 117.35 121.90 2e4m s TYR 217 Ca 0.45 1.55 -0.21 0.00 0.02 0.00 0.00 57.07 58.87 2e4m s TYR 217 Cb -0.22 -3.21 -0.08 0.00 -1.52 0.00 0.00 41.96 36.93 2e4m s TYR 217 CO 0.55 -1.42 0.68 0.14 0.02 0.00 0.00 175.55 175.52 2e4m s VAL 218 N -1.95 4.57 0.12 0.71 -7.23 -0.85 -1.38 120.40 114.38 2e4m s VAL 218 Ca 0.70 1.39 0.02 0.00 -1.81 0.00 0.00 61.98 62.28 2e4m s VAL 218 Cb -0.21 -3.97 -0.04 0.00 0.56 0.00 0.00 36.38 32.72 2e4m s VAL 218 CO 0.29 0.44 -0.04 -1.61 -0.31 0.00 0.00 175.10 173.87 2e4m s GLU 219 N -1.39 0.91 0.04 4.82 2.02 -0.13 -1.77 118.70 123.20 2e4m s GLU 219 Ca 0.35 -1.39 -0.30 0.00 0.02 0.00 0.00 54.97 53.65 2e4m s GLU 219 Cb -0.20 -0.19 -0.05 0.00 0.10 0.00 0.00 34.13 33.79 2e4m s GLU 219 CO 0.22 -0.06 1.20 0.95 0.02 0.00 0.00 175.26 177.59 2e4m s THR 220 N -3.66 4.08 0.09 3.63 -4.23 0.14 -1.24 115.64 114.44 2e4m s THR 220 Ca 0.16 1.48 0.04 0.00 -1.18 0.00 0.00 61.69 62.19 2e4m s THR 220 Cb 0.06 -3.95 -0.03 0.00 1.34 0.00 0.00 72.50 69.91 2e4m s THR 220 CO -0.02 0.09 -0.10 -0.47 -0.54 0.00 0.00 174.62 173.58 2e4m s TYR 221 N 1.28 1.02 0.85 3.99 6.14 0.01 -4.78 117.35 125.85 2e4m s TYR 221 Ca 0.58 -0.62 -0.12 0.00 0.64 0.00 0.00 57.07 57.56 2e4m s TYR 221 Cb -0.29 -0.57 0.10 0.00 0.42 0.00 0.00 41.96 41.63 2e4m s TYR 221 CO 0.28 -0.01 1.14 1.04 0.64 0.00 0.00 175.55 178.64 2e4m n GLN 222 N 0.77 -0.07 -1.57 4.97 3.00 -1.26 -0.82 117.38 122.40 2e4m n GLN 222 Ca -0.18 0.06 -0.53 0.00 -0.01 0.00 0.00 57.00 56.34 2e4m n GLN 222 Cb 0.57 -2.39 -0.06 0.00 0.00 0.00 0.00 30.24 28.36 2e4m n GLN 222 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.06 177.51 2e4m n SER 223 N -3.51 1.33 -3.83 1.08 2.88 -1.26 -4.81 113.62 105.50 2e4m n SER 223 Ca 0.13 1.13 -0.11 0.00 -1.33 0.00 0.00 58.87 58.69 2e4m n SER 223 Cb 0.51 -1.15 -0.08 0.00 -0.75 0.00 0.00 64.21 62.74 2e4m n SER 223 CO 0.00 0.00 0.00 0.28 -1.23 0.00 0.00 175.04 174.09 2e4m s THR 224 N 0.32 0.11 -1.04 2.46 -1.32 -1.26 -5.02 115.64 109.89 2e4m s THR 224 Ca 0.84 -0.87 0.29 0.00 -1.21 0.00 0.00 61.69 60.74 2e4m s THR 224 Cb -0.99 -0.92 0.25 0.00 -1.51 0.00 0.00 72.50 69.33 2e4m s THR 224 CO 0.49 -0.48 1.91 0.47 -2.21 0.00 0.00 174.62 174.80 2e4m n ASP 225 N 0.66 0.03 -4.75 8.08 8.00 -1.26 -4.90 116.55 122.42 2e4m n ASP 225 Ca -0.19 0.40 -0.41 0.00 0.71 0.00 0.00 54.79 55.30 2e4m n ASP 225 Cb 0.59 -0.44 -0.02 0.00 -0.02 0.00 0.00 41.12 41.23 2e4m n ASP 225 CO 0.00 0.00 0.00 -0.55 -0.39 0.00 0.00 177.20 176.26 2e4m s SER 226 N -2.97 6.55 0.65 -2.24 0.15 -1.26 -4.87 113.70 109.71 2e4m s SER 226 Ca 0.15 2.77 0.36 0.00 0.70 0.00 0.00 55.95 59.93 2e4m s SER 226 Cb 0.19 -2.63 1.99 0.00 -1.71 0.00 0.00 66.02 63.87 2e4m s SER 226 CO 0.53 -0.78 2.15 -0.07 1.20 0.00 0.00 173.24 176.27 2e4m h LEU 227 N 5.06 0.00 -2.59 3.45 3.38 -1.94 -2.38 115.31 120.28 2e4m h LEU 227 Ca -0.46 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.51 2e4m h LEU 227 Cb 1.22 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.97 2e4m h LEU 227 CO 0.79 0.00 0.10 0.16 0.09 0.00 0.00 178.44 179.58 2e4m h ILE 228 N 0.00 0.00 -0.03 1.22 3.07 -1.90 -2.07 117.51 117.80 2e4m h ILE 228 Ca 0.01 0.00 0.00 0.00 1.55 0.00 0.00 64.86 66.42 2e4m h ILE 228 Cb 0.34 0.86 0.00 0.00 -0.27 0.00 0.00 36.82 37.76 2e4m h ILE 228 CO -0.00 0.00 -0.05 1.67 -1.05 0.00 0.00 178.15 178.72 2e4m n GLN 229 N -2.97 2.15 -4.68 0.16 7.27 -0.90 -1.81 117.38 116.61 2e4m n GLN 229 Ca -0.03 -1.74 -0.32 0.00 0.07 0.00 0.00 57.00 54.98 2e4m n GLN 229 Cb 0.16 -1.46 -0.12 0.00 2.41 0.00 0.00 30.24 31.23 2e4m n GLN 229 CO 0.00 0.00 0.00 0.71 0.07 0.00 0.00 177.06 177.84 2e4m s TYR 230 N -2.05 2.71 -0.04 3.69 1.51 -0.79 -4.53 117.35 117.85 2e4m s TYR 230 Ca 0.28 -0.15 0.01 0.00 -1.01 0.00 0.00 57.07 56.20 2e4m s TYR 230 Cb 0.20 -1.57 0.02 0.00 -0.11 0.00 0.00 41.96 40.50 2e4m s TYR 230 CO 0.33 0.27 -0.05 -1.58 -1.11 0.00 0.00 175.55 173.41 2e4m s TRP 231 N -0.88 0.79 -0.75 2.71 0.52 0.54 -1.45 118.94 120.42 2e4m s TRP 231 Ca 0.14 -0.22 -0.27 0.00 0.02 0.00 0.00 56.10 55.77 2e4m s TRP 231 Cb -0.11 -0.68 0.03 0.00 -1.15 0.00 0.00 33.47 31.56 2e4m s TRP 231 CO 0.04 -0.19 1.28 1.21 0.02 0.00 0.00 176.95 179.32 2e4m s ASN 232 N 0.84 6.18 -0.31 2.95 3.04 0.32 -0.47 114.94 127.49 2e4m s ASN 232 Ca -0.12 -0.50 -0.28 0.00 0.04 0.00 0.00 52.86 52.00 2e4m s ASN 232 Cb -0.14 -2.56 0.01 0.00 -1.54 0.00 0.00 41.25 37.02 2e4m s ASN 232 CO 0.01 -1.82 1.02 -0.63 -3.04 0.00 0.00 177.10 172.64 2e4m s ILE 233 N 5.69 4.58 0.20 -5.21 1.01 -1.26 -1.61 121.20 124.60 2e4m s ILE 233 Ca 0.35 1.68 0.01 0.00 0.00 0.00 0.00 60.65 62.69 2e4m s ILE 233 Cb -0.08 -4.36 -0.05 0.00 0.01 0.00 0.00 42.46 37.99 2e4m s ILE 233 CO 0.14 -0.41 0.06 0.21 0.00 0.00 0.00 174.94 174.94 2e4m s ASN 234 N 1.59 0.98 0.52 3.58 3.84 -0.40 -4.99 114.94 120.06 2e4m s ASN 234 Ca 0.43 -1.28 -0.13 0.00 0.21 0.00 0.00 52.86 52.08 2e4m s ASN 234 Cb -0.13 0.19 -0.06 0.00 -0.55 0.00 0.00 41.25 40.69 2e4m s ASN 234 CO 0.14 -0.68 0.94 -0.31 -2.79 0.00 0.00 177.10 174.40 2e4m s TYR 235 N -3.80 3.50 0.43 0.43 4.12 -1.26 -1.06 117.35 119.71 2e4m s TYR 235 Ca 0.31 1.31 -0.22 0.00 0.02 0.00 0.00 57.07 58.48 2e4m s TYR 235 Cb 0.07 -2.68 -0.12 0.00 -1.52 0.00 0.00 41.96 37.71 2e4m s TYR 235 CO 0.08 -0.39 0.61 1.28 0.02 0.00 0.00 175.55 177.15 2e4m n LEU 236 N -1.84 0.37 0.00 -1.29 4.77 -0.69 -4.60 117.00 113.72 2e4m n LEU 236 Ca 0.05 0.92 0.00 0.00 -0.03 0.00 0.00 56.01 56.95 2e4m n LEU 236 Cb 0.54 -1.15 0.00 0.00 -2.33 0.00 0.00 43.42 40.48 2e4m n LEU 236 CO 0.50 -2.71 0.00 -0.67 -1.33 0.00 0.00 177.39 173.18 2e4m n ASP 237 N 1.13 0.00 -0.25 -1.43 -0.08 -1.26 -2.30 116.55 112.36 2e4m n ASP 237 Ca 0.11 0.00 0.03 0.00 -1.51 0.00 0.00 54.79 53.42 2e4m n ASP 237 Cb 0.40 0.00 0.03 0.00 2.34 0.00 0.00 41.12 43.89 2e4m n ASP 237 CO 0.00 0.00 0.00 0.59 0.12 0.00 0.00 177.20 177.91 2e4m n ASN 238 N -2.47 1.67 -3.74 1.67 3.02 -1.26 -4.98 115.26 109.18 2e4m n ASN 238 Ca 0.00 -1.39 -0.28 0.00 -0.03 0.00 0.00 54.58 52.89 2e4m n ASN 238 Cb 0.00 -0.02 -0.16 0.00 -0.61 0.00 0.00 39.78 38.98 2e4m n ASN 238 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 2e4m s ASP 239 N -0.58 2.88 0.00 6.41 2.15 -0.97 -1.25 116.67 125.31 2e4m s ASP 239 Ca 0.08 -0.80 0.16 0.00 0.43 0.00 0.00 52.55 52.42 2e4m s ASP 239 Cb 0.05 -0.61 0.95 0.00 -0.30 0.00 0.00 42.92 43.01 2e4m s ASP 239 CO 0.07 -0.30 1.52 0.00 -0.17 0.00 0.00 175.17 176.30 2e4m n ALA 240 N 5.04 2.47 1.19 3.66 0.00 -0.89 -3.24 120.51 128.75 2e4m n ALA 240 Ca -0.09 -0.10 0.13 0.00 0.00 0.00 0.00 53.44 53.38 2e4m n ALA 240 Cb 0.47 -1.26 0.32 0.00 0.00 0.00 0.00 19.45 18.98 2e4m n ALA 240 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 2e4m n SER 241 N -0.78 1.08 -4.08 0.00 3.41 -1.26 -4.94 113.62 107.04 2e4m n SER 241 Ca 0.12 -0.90 -0.13 0.00 -0.26 0.00 0.00 58.87 57.70 2e4m n SER 241 Cb 0.05 0.19 -0.11 0.00 -0.26 0.00 0.00 64.21 64.09 2e4m n SER 241 CO 0.00 0.00 0.00 -0.54 -0.16 0.00 0.00 175.04 174.34 2e4m s LYS 242 N -2.55 0.59 0.12 4.33 1.02 -1.21 -4.88 119.74 117.15 2e4m s LYS 242 Ca 0.22 -0.86 0.09 0.00 0.02 0.00 0.00 55.97 55.44 2e4m s LYS 242 Cb 0.19 -0.29 -0.04 0.00 -0.52 0.00 0.00 37.83 37.17 2e4m s LYS 242 CO 0.55 0.04 -0.19 0.71 -0.92 0.00 0.00 175.35 175.54 2e4m s TYR 243 N -1.77 2.52 -0.08 3.18 2.02 0.12 -1.71 117.35 121.62 2e4m s TYR 243 Ca -0.06 -0.27 0.03 0.00 -0.37 0.00 0.00 57.07 56.40 2e4m s TYR 243 Cb -0.07 -1.34 -0.02 0.00 -0.40 0.00 0.00 41.96 40.13 2e4m s TYR 243 CO -0.00 0.38 -0.18 0.42 -1.57 0.00 0.00 175.55 174.59 2e4m s ILE 244 N -1.13 2.64 -0.41 2.71 -1.09 -0.23 -0.50 121.20 123.20 2e4m s ILE 244 Ca 0.17 -0.84 -0.05 0.00 -2.23 0.00 0.00 60.65 57.70 2e4m s ILE 244 Cb -0.11 -2.04 0.10 0.00 -1.58 0.00 0.00 42.46 38.84 2e4m s ILE 244 CO 0.10 0.56 0.22 -0.76 -1.23 0.00 0.00 174.94 173.83 2e4m s LEU 245 N -0.12 5.16 -0.05 2.97 1.02 -1.26 -1.27 118.68 125.12 2e4m s LEU 245 Ca -0.03 -1.80 -0.26 0.00 0.02 0.00 0.00 54.13 52.05 2e4m s LEU 245 Cb -0.14 -1.88 -0.03 0.00 0.02 0.00 0.00 46.19 44.16 2e4m s LEU 245 CO 0.04 -0.54 0.83 -0.31 0.02 0.00 0.00 176.35 176.39 2e4m s TYR 246 N 1.26 3.59 0.09 0.29 2.02 -0.63 -0.87 117.35 123.09 2e4m s TYR 246 Ca 0.05 1.43 -0.30 0.00 -0.37 0.00 0.00 57.07 57.88 2e4m s TYR 246 Cb -0.23 -2.96 -0.05 0.00 -0.40 0.00 0.00 41.96 38.32 2e4m s TYR 246 CO -0.02 0.01 0.97 1.21 -1.57 0.00 0.00 175.55 176.15 2e4m s ASN 247 N 0.92 7.47 0.43 2.29 2.47 -0.16 -0.52 114.94 127.85 2e4m s ASN 247 Ca 0.43 1.78 0.21 0.00 0.42 0.00 0.00 52.86 55.71 2e4m s ASN 247 Cb -0.19 -2.59 0.99 0.00 -1.45 0.00 0.00 41.25 38.01 2e4m s ASN 247 CO 0.21 -0.11 1.88 -0.07 -3.72 0.00 0.00 177.10 175.30 2e4m h LEU 248 N 5.78 0.00 -1.59 3.21 4.07 -1.35 -2.14 115.31 123.29 2e4m h LEU 248 Ca -0.43 0.00 0.06 0.00 0.08 0.00 0.00 57.88 57.59 2e4m h LEU 248 Cb 1.21 0.00 -0.03 0.00 1.08 0.00 0.00 40.66 42.92 2e4m h LEU 248 CO 0.72 0.26 0.36 -0.61 -1.08 0.00 0.00 178.44 178.10 2e4m h GLN 249 N 0.00 0.49 -1.33 1.13 5.75 -1.79 -3.39 115.11 115.96 2e4m h GLN 249 Ca -0.00 -0.03 -0.07 0.00 -0.15 0.00 0.00 58.65 58.40 2e4m h GLN 249 Cb 0.63 -0.11 -0.25 0.00 1.07 0.00 0.00 27.48 28.82 2e4m h GLN 249 CO 0.03 0.32 -0.44 0.34 -2.65 0.00 0.00 178.83 176.43 2e4m s ASP 250 N -6.40 -0.69 0.00 -0.69 -1.08 -0.84 -5.03 116.67 101.94 2e4m s ASP 250 Ca -0.08 -0.01 0.27 0.00 -0.52 0.00 0.00 52.55 52.22 2e4m s ASP 250 Cb 0.19 1.62 1.62 0.00 -1.46 0.00 0.00 42.92 44.88 2e4m s ASP 250 CO 0.74 -0.32 1.98 0.35 0.52 0.00 0.00 175.17 178.45 2e4m n THR 251 N 5.39 0.02 1.92 1.71 -2.24 -0.99 -0.95 114.28 119.14 2e4m n THR 251 Ca 0.02 0.00 0.16 0.00 -2.27 0.00 0.00 64.05 61.97 2e4m n THR 251 Cb 0.52 -0.57 0.91 0.00 -2.10 0.00 0.00 70.33 69.08 2e4m n THR 251 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 2e4m n ASN 252 N -1.03 0.08 -4.28 3.42 5.03 -1.26 -4.81 115.26 112.42 2e4m n ASN 252 Ca 0.20 -0.95 -0.26 0.00 0.87 0.00 0.00 54.58 54.44 2e4m n ASN 252 Cb 0.11 -0.02 -0.14 0.00 -1.02 0.00 0.00 39.78 38.71 2e4m n ASN 252 CO 0.00 0.00 0.00 -0.13 -1.83 0.00 0.00 177.26 175.30 2e4m s ARG 253 N -2.05 1.33 0.05 3.52 0.52 -0.12 -0.49 118.95 121.71 2e4m s ARG 253 Ca 0.46 -1.05 -0.02 0.00 -0.52 0.00 0.00 55.73 54.60 2e4m s ARG 253 Cb 0.22 -1.53 -0.04 0.00 0.52 0.00 0.00 34.95 34.13 2e4m s ARG 253 CO 0.38 0.38 -0.01 0.14 0.02 0.00 0.00 175.30 176.20 2e4m s VAL 254 N -0.94 0.21 0.11 3.52 -7.23 -0.34 -0.99 120.40 114.74 2e4m s VAL 254 Ca 0.08 -1.72 -0.31 0.00 -1.81 0.00 0.00 61.98 58.22 2e4m s VAL 254 Cb -0.09 -1.46 -0.10 0.00 0.56 0.00 0.00 36.38 35.29 2e4m s VAL 254 CO 0.03 -0.95 1.72 -0.22 -0.31 0.00 0.00 175.10 175.37 2e4m s LEU 255 N -2.86 4.38 -0.11 1.32 2.96 -0.05 -1.80 118.68 122.51 2e4m s LEU 255 Ca 0.06 2.64 -0.06 0.00 -0.22 0.00 0.00 54.13 56.54 2e4m s LEU 255 Cb 0.07 -3.57 0.05 0.00 0.50 0.00 0.00 46.19 43.24 2e4m s LEU 255 CO -0.10 -0.94 0.27 -0.62 -1.32 0.00 0.00 176.35 173.65 2e4m s ASP 256 N 2.35 -0.30 -0.22 3.68 3.68 0.30 -4.56 116.67 121.61 2e4m s ASP 256 Ca 0.77 0.58 -0.24 0.00 2.13 0.00 0.00 52.55 55.79 2e4m s ASP 256 Cb -0.43 0.47 -0.01 0.00 -1.45 0.00 0.00 42.92 41.49 2e4m s ASP 256 CO 0.34 -0.16 0.77 -0.69 0.13 0.00 0.00 175.17 175.55 2e4m s VAL 257 N 1.20 4.90 -0.05 1.11 1.01 -0.28 -0.78 120.40 127.51 2e4m s VAL 257 Ca -0.09 1.46 -0.29 0.00 0.00 0.00 0.00 61.98 63.06 2e4m s VAL 257 Cb -0.09 -4.07 -0.08 0.00 0.00 0.00 0.00 36.38 32.14 2e4m s VAL 257 CO -0.09 -0.00 2.06 -0.47 0.00 0.00 0.00 175.10 176.60 2e4m s TYR 258 N 2.45 1.23 -1.67 5.22 6.14 -0.56 -1.92 117.35 128.25 2e4m s TYR 258 Ca 0.34 -0.13 0.00 0.00 0.64 0.00 0.00 57.07 57.92 2e4m s TYR 258 Cb -0.16 -4.14 0.00 0.00 0.42 0.00 0.00 41.96 38.08 2e4m s TYR 258 CO 0.09 -5.08 0.00 0.09 0.64 0.00 0.00 175.55 171.29 2e4m n ASN 259 N 8.97 -4.96 -2.02 4.32 3.02 -1.26 -2.33 115.26 121.01 2e4m n ASN 259 Ca 0.23 0.22 -0.15 0.00 -0.03 0.00 0.00 54.58 54.86 2e4m n ASN 259 Cb 0.42 -4.27 -0.03 0.00 -0.61 0.00 0.00 39.78 35.29 2e4m n ASN 259 CO 0.00 0.00 0.00 -1.20 -2.62 0.00 0.00 177.26 173.44 2e4m n SER 260 N -1.55 -4.20 -4.79 6.41 7.64 -0.81 -4.98 113.62 111.35 2e4m n SER 260 Ca -0.20 0.23 -0.34 0.00 1.01 0.00 0.00 58.87 59.57 2e4m n SER 260 Cb 0.63 -3.66 -0.01 0.00 -1.01 0.00 0.00 64.21 60.16 2e4m n SER 260 CO 0.00 0.00 0.00 -1.10 -3.01 0.00 0.00 175.04 170.93 2e4m s GLN 261 N -4.31 3.49 0.00 1.43 -1.52 -0.98 -4.99 119.66 112.77 2e4m s GLN 261 Ca 0.00 1.38 0.00 0.00 -1.95 0.00 0.00 55.36 54.79 2e4m s GLN 261 Cb 0.00 -2.05 0.00 0.00 -0.22 0.00 0.00 33.01 30.74 2e4m s GLN 261 CO 0.00 -0.70 0.16 0.25 -0.25 0.00 0.00 175.29 174.76 2e4m n THR 262 N -1.45 0.00 -1.84 -0.19 -2.24 -1.26 -4.80 114.28 102.50 2e4m n THR 262 Ca 0.10 -0.47 -0.37 0.00 -2.27 0.00 0.00 64.05 61.03 2e4m n THR 262 Cb 0.52 1.02 0.05 0.00 -2.10 0.00 0.00 70.33 69.82 2e4m n THR 262 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2e4m s ALA 263 N -0.62 2.60 0.11 6.98 0.00 -1.26 -4.89 121.76 124.68 2e4m s ALA 263 Ca 0.00 1.20 -0.36 0.00 0.00 0.00 0.00 51.96 52.81 2e4m s ALA 263 Cb 0.00 -3.53 -0.16 0.00 0.00 0.00 0.00 23.12 19.43 2e4m s ALA 263 CO 0.00 -1.38 1.37 0.09 0.00 0.00 0.00 175.76 175.84 2e4m n ASN 264 N -1.45 1.94 0.00 0.00 5.03 -1.26 -1.56 115.26 117.95 2e4m n ASN 264 Ca 0.13 1.11 0.00 0.00 0.87 0.00 0.00 54.58 56.69 2e4m n ASN 264 Cb 0.47 -1.25 0.00 0.00 -1.02 0.00 0.00 39.78 37.99 2e4m n ASN 264 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 2e4m n GLY 265 N 2.65 0.72 3.69 7.41 0.00 0.59 -5.01 105.19 115.24 2e4m n GLY 265 Ca 0.18 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.75 2e4m n GLY 265 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 2e4m n THR 266 N -2.00 0.48 -2.29 2.61 -1.04 -0.60 -4.71 114.28 106.72 2e4m n THR 266 Ca 0.00 -0.12 -0.41 0.00 -2.04 0.00 0.00 64.05 61.48 2e4m n THR 266 Cb 0.00 -1.65 -0.03 0.00 -1.82 0.00 0.00 70.33 66.83 2e4m n THR 266 CO 0.00 0.00 0.00 -1.00 -0.64 0.00 0.00 175.07 173.43 2e4m s HIS 267 N 0.47 3.32 -0.11 -1.42 3.76 -1.26 -1.49 115.29 118.56 2e4m s HIS 267 Ca 0.72 1.51 -0.07 0.00 -0.15 0.00 0.00 55.06 57.07 2e4m s HIS 267 Cb -0.62 -3.49 -0.04 0.00 1.11 0.00 0.00 32.58 29.54 2e4m s HIS 267 CO 0.43 -1.28 0.15 0.08 -0.85 0.00 0.00 174.74 173.26 2e4m s VAL 268 N -0.91 5.49 0.24 -0.90 1.01 -0.99 -1.50 120.40 122.86 2e4m s VAL 268 Ca 0.48 0.22 0.02 0.00 0.00 0.00 0.00 61.98 62.70 2e4m s VAL 268 Cb -0.36 -3.41 -0.04 0.00 0.00 0.00 0.00 36.38 32.57 2e4m s VAL 268 CO 0.45 0.61 0.17 0.27 0.00 0.00 0.00 175.10 176.60 2e4m s ILE 269 N -1.04 0.05 -0.21 2.22 -4.36 0.04 -2.00 121.20 115.90 2e4m s ILE 269 Ca 0.16 -2.00 -0.06 0.00 -0.26 0.00 0.00 60.65 58.49 2e4m s ILE 269 Cb -0.12 -2.51 -0.03 0.00 1.25 0.00 0.00 42.46 41.06 2e4m s ILE 269 CO 0.05 0.00 0.02 -0.69 0.24 0.00 0.00 174.94 174.56 2e4m s VAL 270 N -3.92 4.05 0.19 8.37 1.01 -0.36 -0.53 120.40 129.21 2e4m s VAL 270 Ca 0.39 -0.27 -0.07 0.00 0.00 0.00 0.00 61.98 62.03 2e4m s VAL 270 Cb 0.06 -2.85 -0.02 0.00 0.00 0.00 0.00 36.38 33.57 2e4m s VAL 270 CO 0.17 0.41 0.27 -0.62 0.00 0.00 0.00 175.10 175.32 2e4m s ASP 271 N 1.14 0.06 0.21 3.32 2.15 -0.75 -4.87 116.67 117.95 2e4m s ASP 271 Ca 0.03 -1.05 -0.32 0.00 0.43 0.00 0.00 52.55 51.63 2e4m s ASP 271 Cb -0.14 0.45 -0.13 0.00 -0.30 0.00 0.00 42.92 42.79 2e4m s ASP 271 CO 0.02 -0.93 1.51 -1.20 -0.17 0.00 0.00 175.17 174.40 2e4m n SER 272 N -0.26 3.05 -4.74 -0.34 7.64 -1.26 -1.20 113.62 116.51 2e4m n SER 272 Ca -0.03 1.12 -0.42 0.00 1.01 0.00 0.00 58.87 60.55 2e4m n SER 272 Cb 0.64 -1.45 -0.02 0.00 -1.01 0.00 0.00 64.21 62.36 2e4m n SER 272 CO 0.00 0.00 0.00 -0.47 -3.01 0.00 0.00 175.04 171.56 2e4m s TYR 273 N 0.39 2.96 0.00 1.43 5.04 0.36 -4.83 117.35 122.70 2e4m s TYR 273 Ca 0.72 0.88 0.00 0.00 -2.44 0.00 0.00 57.07 56.24 2e4m s TYR 273 Cb -0.64 -3.91 0.00 0.00 0.35 0.00 0.00 41.96 37.76 2e4m s TYR 273 CO 0.44 -3.05 0.00 -2.39 -1.34 0.00 0.00 175.55 169.21 2e4m n HIS 274 N 2.61 0.00 -0.88 4.97 1.44 -1.26 -5.04 115.22 117.07 2e4m n HIS 274 Ca 0.08 0.00 0.00 0.00 -2.01 0.00 0.00 57.72 55.79 2e4m n HIS 274 Cb 0.39 0.00 0.00 0.00 0.12 0.00 0.00 29.99 30.50 2e4m n HIS 274 CO 0.00 0.00 0.00 0.41 -2.81 0.00 0.00 176.34 173.94 2e4m n GLY 275 N 0.75 0.66 3.50 -1.39 0.00 -1.26 -5.05 105.19 102.41 2e4m n GLY 275 Ca 0.00 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.74 2e4m n GLY 275 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2e4m s ASN 276 N -2.26 1.08 0.29 1.61 0.01 -1.26 -4.82 114.94 109.59 2e4m s ASN 276 Ca 0.00 1.57 0.04 0.00 -0.71 0.00 0.00 52.86 53.76 2e4m s ASN 276 Cb 0.00 -2.32 0.72 0.00 0.41 0.00 0.00 41.25 40.05 2e4m s ASN 276 CO 0.00 -4.15 1.73 0.74 -1.51 0.00 0.00 177.10 173.91 2e4m h THR 277 N -2.59 0.57 0.00 1.60 2.02 -1.96 0.48 112.91 113.03 2e4m h THR 277 Ca -0.60 -0.18 0.00 0.00 0.77 0.00 0.00 66.41 66.40 2e4m h THR 277 Cb 1.33 -0.00 0.00 0.00 -1.74 0.00 0.00 68.15 67.74 2e4m h THR 277 CO 0.50 0.10 0.00 -0.46 0.37 0.00 0.00 175.52 176.02 2e4m n ASN 278 N -4.94 0.00 -0.81 4.18 2.04 -1.26 -1.89 115.26 112.58 2e4m n ASN 278 Ca 0.22 0.17 0.09 0.00 -0.44 0.00 0.00 54.58 54.62 2e4m n ASN 278 Cb 0.61 -0.33 0.13 0.00 -2.53 0.00 0.00 39.78 37.67 2e4m n ASN 278 CO 0.00 0.00 0.00 0.00 -0.44 0.00 0.00 177.26 176.82 2e4m n GLN 279 N -1.33 1.92 -3.89 -3.83 6.02 0.16 -1.12 117.38 115.31 2e4m n GLN 279 Ca 0.06 -1.84 -0.35 0.00 -0.01 0.00 0.00 57.00 54.86 2e4m n GLN 279 Cb 0.12 -1.37 -0.08 0.00 1.02 0.00 0.00 30.24 29.93 2e4m n GLN 279 CO 0.00 0.00 0.00 -0.65 -1.01 0.00 0.00 177.06 175.40 2e4m s GLN 280 N -1.30 3.87 0.03 -1.09 -0.21 -0.79 -4.53 119.66 115.64 2e4m s GLN 280 Ca 0.26 -0.25 0.07 0.00 0.02 0.00 0.00 55.36 55.46 2e4m s GLN 280 Cb 0.16 -3.27 -0.02 0.00 1.00 0.00 0.00 33.01 30.88 2e4m s GLN 280 CO 0.23 0.43 -0.20 -1.58 -2.12 0.00 0.00 175.29 172.06 2e4m s TRP 281 N -0.05 1.73 -0.27 0.91 0.52 0.35 -1.46 118.94 120.67 2e4m s TRP 281 Ca 0.09 -0.36 -0.01 0.00 0.02 0.00 0.00 56.10 55.83 2e4m s TRP 281 Cb -0.12 -1.05 0.04 0.00 -1.15 0.00 0.00 33.47 31.19 2e4m s TRP 281 CO 0.00 0.06 -0.04 0.42 0.02 0.00 0.00 176.95 177.41 2e4m s ILE 282 N -0.73 2.87 -0.15 2.03 1.09 -0.33 0.15 121.20 126.13 2e4m s ILE 282 Ca 0.07 -1.20 -0.04 0.00 -1.10 0.00 0.00 60.65 58.38 2e4m s ILE 282 Cb -0.08 -2.54 -0.03 0.00 -1.06 0.00 0.00 42.46 38.74 2e4m s ILE 282 CO 0.01 0.07 -0.03 -0.63 -0.10 0.00 0.00 174.94 174.26 2e4m s ILE 283 N 1.28 3.98 0.04 2.92 1.01 -1.26 -0.95 121.20 128.22 2e4m s ILE 283 Ca -0.02 -0.33 0.00 0.00 0.00 0.00 0.00 60.65 60.30 2e4m s ILE 283 Cb -0.18 -2.74 -0.03 0.00 0.01 0.00 0.00 42.46 39.52 2e4m s ILE 283 CO -0.03 0.50 -0.04 0.20 0.00 0.00 0.00 174.94 175.57 2e4m s ASN 284 N 0.23 0.43 0.52 3.58 0.01 -0.61 -5.00 114.94 114.10 2e4m s ASN 284 Ca -0.02 -0.67 -0.22 0.00 -0.71 0.00 0.00 52.86 51.23 2e4m s ASN 284 Cb -0.14 0.12 -0.06 0.00 0.41 0.00 0.00 41.25 41.59 2e4m s ASN 284 CO 0.03 -0.38 1.33 -0.76 -1.51 0.00 0.00 177.10 175.80 2e4m s LEU 285 N -1.97 3.92 0.00 0.60 1.43 -1.26 -0.84 118.68 120.55 2e4m s LEU 285 Ca -0.07 2.69 0.29 0.00 -1.03 0.00 0.00 54.13 56.01 2e4m s LEU 285 Cb -0.04 -4.23 1.71 0.00 0.03 0.00 0.00 46.19 43.67 2e4m s LEU 285 CO -0.04 -1.39 2.05 0.00 0.23 0.00 0.00 176.35 177.20