#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2h96 n ASN 8 N 0.00 1.28 -0.76 -2.24 0.23 -1.26 -4.76 115.26 107.75 2h96 n ASN 8 Ca 0.00 -1.87 -0.05 0.00 -0.53 0.00 0.00 54.58 52.13 2h96 n ASN 8 Cb 0.00 -0.47 0.00 0.00 -2.08 0.00 0.00 39.78 37.24 2h96 n ASN 8 CO 0.00 0.00 0.00 0.59 -0.93 0.00 0.00 177.26 176.92 2h96 n ASN 9 N 0.12 -2.42 0.00 0.53 4.13 -1.26 -4.98 115.26 111.38 2h96 n ASN 9 Ca 0.00 -0.04 0.00 0.00 1.68 0.00 0.00 54.58 56.22 2h96 n ASN 9 Cb 0.28 -1.54 0.00 0.00 -1.54 0.00 0.00 39.78 36.98 2h96 n ASN 9 CO 0.00 0.00 0.00 0.49 0.28 0.00 0.00 177.26 178.03 2h96 n PHE 10 N -3.72 0.00 0.00 3.10 0.99 -1.26 -3.93 117.46 112.64 2h96 n PHE 10 Ca -0.04 0.00 0.00 0.00 -0.00 0.00 0.00 57.45 57.41 2h96 n PHE 10 Cb 0.53 0.00 0.00 0.00 -1.00 0.00 0.00 39.48 39.01 2h96 n PHE 10 CO 0.00 0.00 0.00 2.48 -0.00 0.00 0.00 176.76 179.24 2h96 n TYR 11 N 0.00 0.00 -4.33 1.38 4.11 -1.16 -3.44 117.16 113.71 2h96 n TYR 11 Ca 0.00 0.00 -0.21 0.00 -0.00 0.00 0.00 57.90 57.69 2h96 n TYR 11 Cb 0.00 0.00 -0.11 0.00 -0.00 0.00 0.00 39.34 39.23 2h96 n TYR 11 CO 0.00 0.00 0.00 -1.12 -0.00 0.00 0.00 176.86 175.74 2h96 s SER 12 N 0.00 2.65 -0.02 9.48 0.01 -1.26 -1.17 113.70 123.40 2h96 s SER 12 Ca 0.00 -0.89 0.01 0.00 1.31 0.00 0.00 55.95 56.37 2h96 s SER 12 Cb 0.00 -0.15 0.01 0.00 0.21 0.00 0.00 66.02 66.09 2h96 s SER 12 CO 0.00 -0.06 -0.01 0.68 0.41 0.00 0.00 173.24 174.25 2h96 s VAL 13 N -2.23 0.22 -1.13 3.43 -7.23 -1.20 -4.94 120.40 107.31 2h96 s VAL 13 Ca 0.17 -0.02 -0.24 0.00 -1.81 0.00 0.00 61.98 60.08 2h96 s VAL 13 Cb -0.05 -0.25 -0.14 0.00 0.56 0.00 0.00 36.38 36.50 2h96 s VAL 13 CO 0.07 0.11 2.01 -1.83 -0.31 0.00 0.00 175.10 175.15 2h96 s GLU 14 N 0.54 2.01 -0.88 4.82 1.03 -1.26 -1.99 118.70 122.97 2h96 s GLU 14 Ca -0.05 -0.86 -0.25 0.00 0.03 0.00 0.00 54.97 53.84 2h96 s GLU 14 Cb -0.08 -5.14 0.01 0.00 -0.80 0.00 0.00 34.13 28.12 2h96 s GLU 14 CO -0.01 -4.52 1.61 0.42 -1.33 0.00 0.00 175.26 171.43 2h96 s ILE 15 N 13.21 3.68 0.00 1.83 -1.09 -0.24 -4.85 121.20 133.73 2h96 s ILE 15 Ca 0.73 -0.31 0.00 0.00 -2.23 0.00 0.00 60.65 58.85 2h96 s ILE 15 Cb -0.03 -4.60 0.00 0.00 -1.58 0.00 0.00 42.46 36.25 2h96 s ILE 15 CO 0.14 -1.52 0.00 0.61 -1.23 0.00 0.00 174.94 172.94 2h96 n GLY 16 N 6.44 0.48 0.14 6.18 0.00 -1.26 -1.12 105.19 116.05 2h96 n GLY 16 Ca 0.28 0.50 -0.24 0.00 0.00 0.00 0.00 46.02 46.56 2h96 n GLY 16 CO 0.00 0.00 0.00 -1.80 0.00 0.00 0.00 173.32 171.52 2h96 h ASP 17 N 0.00 0.69 -0.88 1.61 1.82 -2.00 -3.48 116.42 114.17 2h96 h ASP 17 Ca 0.00 -0.93 0.00 0.00 -0.39 0.00 0.00 57.03 55.71 2h96 h ASP 17 Cb 0.00 -0.22 0.00 0.00 0.68 0.00 0.00 39.33 39.79 2h96 h ASP 17 CO 0.00 1.74 0.00 -1.54 -1.61 0.00 0.00 179.24 177.83 2h96 n SER 18 N -3.69 1.71 -4.46 2.28 3.41 -0.28 -5.16 113.62 107.43 2h96 n SER 18 Ca -0.21 0.00 -0.29 0.00 -0.26 0.00 0.00 58.87 58.11 2h96 n SER 18 Cb 1.07 0.00 -0.12 0.00 -0.26 0.00 0.00 64.21 64.90 2h96 n SER 18 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 2h96 s THR 19 N 1.15 2.68 0.47 6.66 2.01 -1.26 -1.08 115.64 126.28 2h96 s THR 19 Ca 0.00 -1.62 0.04 0.00 0.31 0.00 0.00 61.69 60.42 2h96 s THR 19 Cb 0.00 -2.23 -0.03 0.00 0.01 0.00 0.00 72.50 70.25 2h96 s THR 19 CO 0.00 0.07 0.10 -0.36 -0.69 0.00 0.00 174.62 173.73 2h96 s PHE 20 N -1.20 2.13 -0.30 4.92 0.40 -0.84 -4.85 117.98 118.23 2h96 s PHE 20 Ca 0.18 -0.80 0.02 0.00 -0.60 0.00 0.00 56.93 55.73 2h96 s PHE 20 Cb -0.10 -1.76 0.19 0.00 0.51 0.00 0.00 43.02 41.86 2h96 s PHE 20 CO 0.09 0.17 0.61 0.99 0.70 0.00 0.00 175.22 177.78 2h96 s THR 21 N -2.77 -0.98 0.11 0.64 2.01 -1.25 -3.22 115.64 110.18 2h96 s THR 21 Ca 0.23 0.00 0.03 0.00 0.31 0.00 0.00 61.69 62.26 2h96 s THR 21 Cb 0.04 -0.99 -0.04 0.00 0.01 0.00 0.00 72.50 71.51 2h96 s THR 21 CO 0.13 0.00 -0.08 0.68 -0.69 0.00 0.00 174.62 174.66 2h96 s VAL 22 N 2.85 0.85 -0.02 3.82 -7.23 -0.32 -4.77 120.40 115.58 2h96 s VAL 22 Ca 0.15 -1.95 -0.31 0.00 -1.81 0.00 0.00 61.98 58.06 2h96 s VAL 22 Cb -0.12 -1.71 -0.10 0.00 0.56 0.00 0.00 36.38 35.01 2h96 s VAL 22 CO -0.23 -0.82 1.96 0.18 -0.31 0.00 0.00 175.10 175.88 2h96 n LEU 23 N -0.05 3.89 -0.05 1.32 4.77 -1.26 -3.01 117.00 122.61 2h96 n LEU 23 Ca -0.12 0.88 0.03 0.00 -0.03 0.00 0.00 56.01 56.77 2h96 n LEU 23 Cb 0.61 -1.48 0.05 0.00 -2.33 0.00 0.00 43.42 40.27 2h96 n LEU 23 CO 0.30 0.07 0.12 0.29 -1.33 0.00 0.00 177.39 176.85 2h96 n LYS 24 N 7.34 -0.01 -0.49 3.23 5.02 -1.22 -1.22 118.16 130.81 2h96 n LYS 24 Ca 0.22 0.20 0.41 0.00 -2.02 0.00 0.00 58.31 57.12 2h96 n LYS 24 Cb 0.37 -0.33 0.63 0.00 -0.02 0.00 0.00 35.03 35.69 2h96 n LYS 24 CO 0.00 0.00 0.00 2.89 -0.52 0.00 0.00 177.40 179.77 2h96 n ARG 25 N -3.76 0.01 -3.09 1.97 1.85 -1.26 -4.18 116.66 108.19 2h96 n ARG 25 Ca 0.04 1.00 -0.42 0.00 -1.00 0.00 0.00 57.85 57.46 2h96 n ARG 25 Cb 0.12 -2.37 -0.06 0.00 -1.05 0.00 0.00 32.46 29.10 2h96 n ARG 25 CO 0.00 0.00 0.00 0.71 -0.01 0.00 0.00 177.63 178.33 2h96 s TYR 26 N -4.57 3.09 0.25 2.89 2.02 -0.36 -0.19 117.35 120.48 2h96 s TYR 26 Ca -0.04 0.15 0.09 0.00 -0.37 0.00 0.00 57.07 56.90 2h96 s TYR 26 Cb 0.21 -3.30 -0.04 0.00 -0.40 0.00 0.00 41.96 38.42 2h96 s TYR 26 CO 0.69 -0.78 0.01 -0.65 -1.57 0.00 0.00 175.55 173.24 2h96 s GLN 27 N 2.83 2.35 -0.98 -0.62 -0.21 -1.18 -4.80 119.66 117.05 2h96 s GLN 27 Ca 0.24 -1.33 -0.11 0.00 0.02 0.00 0.00 55.36 54.18 2h96 s GLN 27 Cb -0.14 -2.22 -0.01 0.00 1.00 0.00 0.00 33.01 31.63 2h96 s GLN 27 CO 0.18 0.38 0.76 0.09 -2.12 0.00 0.00 175.29 174.58 2h96 n ASN 28 N -0.76 -5.99 -4.55 5.90 3.02 -1.26 -1.20 115.26 110.42 2h96 n ASN 28 Ca -0.07 -0.76 -0.40 0.00 -0.03 0.00 0.00 54.58 53.32 2h96 n ASN 28 Cb 0.58 -3.76 -0.03 0.00 -0.61 0.00 0.00 39.78 35.96 2h96 n ASN 28 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 2h96 s LEU 29 N -5.53 3.22 -0.09 3.41 2.01 -1.26 -4.47 118.68 115.97 2h96 s LEU 29 Ca 0.29 -0.49 -0.00 0.00 0.01 0.00 0.00 54.13 53.94 2h96 s LEU 29 Cb -0.09 -2.56 -0.03 0.00 0.01 0.00 0.00 46.19 43.52 2h96 s LEU 29 CO 0.83 -1.89 -0.07 -0.54 1.01 0.00 0.00 176.35 175.69 2h96 s LYS 30 N 5.84 3.01 0.77 1.70 1.02 -0.92 -4.93 119.74 126.24 2h96 s LYS 30 Ca 0.42 -0.56 -0.13 0.00 0.02 0.00 0.00 55.97 55.72 2h96 s LYS 30 Cb -0.07 -2.66 0.06 0.00 -0.52 0.00 0.00 37.83 34.64 2h96 s LYS 30 CO 0.12 0.52 1.15 -1.25 -0.92 0.00 0.00 175.35 174.98 2h96 s PRO 31 N -0.42 1.97 0.00 -1.68 0.04 -1.26 -0.22 135.00 133.42 2h96 s PRO 31 Ca 0.06 1.54 0.00 0.00 0.04 0.00 0.00 61.00 62.64 2h96 s PRO 31 Cb -0.12 -1.84 0.00 0.00 0.04 0.00 0.00 34.50 32.58 2h96 s PRO 31 CO 0.02 -1.92 0.00 0.44 0.04 0.00 0.00 177.00 175.59 2h96 n ILE 32 N -3.22 0.00 -4.03 0.56 -5.35 -1.07 -4.72 119.36 101.54 2h96 n ILE 32 Ca 0.12 0.00 -0.33 0.00 -0.27 0.00 0.00 62.75 62.27 2h96 n ILE 32 Cb 0.51 0.00 -0.15 0.00 -1.74 0.00 0.00 39.64 38.27 2h96 n ILE 32 CO 0.00 0.00 0.00 -0.83 -1.76 0.00 0.00 176.55 173.96 2h96 s GLY 33 N -0.74 1.71 -0.29 3.28 0.00 0.22 -4.97 107.32 106.53 2h96 s GLY 33 Ca 0.00 -1.85 0.01 0.00 0.00 0.00 0.00 44.72 42.88 2h96 s GLY 33 CO 0.00 0.66 -0.04 -0.45 0.00 0.00 0.00 173.10 173.27 2h96 s SER 34 N 1.13 4.67 0.00 1.64 0.15 -1.26 0.13 113.70 120.16 2h96 s SER 34 Ca -0.06 -1.44 0.00 0.00 0.70 0.00 0.00 55.95 55.15 2h96 s SER 34 Cb -0.20 -1.63 0.00 0.00 -1.71 0.00 0.00 66.02 62.48 2h96 s SER 34 CO -0.04 -0.25 0.00 0.61 1.20 0.00 0.00 173.24 174.76 2h96 n GLY 35 N 4.49 4.41 0.42 9.45 0.00 -1.24 -5.02 105.19 117.70 2h96 n GLY 35 Ca -0.12 -1.38 0.05 0.00 0.00 0.00 0.00 46.02 44.57 2h96 n GLY 35 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2h96 n ALA 36 N -3.00 2.48 -0.51 4.61 0.00 -1.26 -3.36 120.51 119.47 2h96 n ALA 36 Ca 0.00 -0.41 0.00 0.00 0.00 0.00 0.00 53.44 53.03 2h96 n ALA 36 Cb 0.00 -1.02 0.00 0.00 0.00 0.00 0.00 19.45 18.43 2h96 n ALA 36 CO 0.00 0.00 0.00 0.94 0.00 0.00 0.00 177.50 178.44 2h96 n GLN 37 N 0.14 0.50 0.00 0.00 7.27 -1.26 -4.99 117.38 119.04 2h96 n GLN 37 Ca 0.09 -0.62 0.00 0.00 0.07 0.00 0.00 57.00 56.54 2h96 n GLN 37 Cb 0.21 -0.74 0.00 0.00 2.41 0.00 0.00 30.24 32.11 2h96 n GLN 37 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 2h96 n GLY 38 N -0.12 2.72 3.75 1.69 0.00 -1.21 -1.80 105.19 110.21 2h96 n GLY 38 Ca 0.00 -1.99 -0.36 0.00 0.00 0.00 0.00 46.02 43.67 2h96 n GLY 38 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2h96 s ILE 39 N -2.75 2.45 -0.23 -0.61 1.01 -1.26 -3.69 121.20 116.12 2h96 s ILE 39 Ca 0.00 0.28 -0.04 0.00 0.00 0.00 0.00 60.65 60.89 2h96 s ILE 39 Cb 0.00 -3.08 0.09 0.00 0.01 0.00 0.00 42.46 39.48 2h96 s ILE 39 CO 0.00 -0.07 0.15 -0.69 0.00 0.00 0.00 174.94 174.34 2h96 s VAL 40 N -1.58 -0.17 0.25 2.92 1.01 0.35 -1.58 120.40 121.60 2h96 s VAL 40 Ca 0.78 -0.40 0.08 0.00 0.00 0.00 0.00 61.98 62.44 2h96 s VAL 40 Cb -0.32 -0.79 -0.04 0.00 0.00 0.00 0.00 36.38 35.23 2h96 s VAL 40 CO 0.36 -0.45 0.09 0.00 0.00 0.00 0.00 175.10 175.10 2h96 s ALA 42 N -2.17 3.34 0.14 0.00 0.00 0.69 -0.66 121.76 123.10 2h96 s ALA 42 Ca 0.32 -0.07 -0.14 0.00 0.00 0.00 0.00 51.96 52.07 2h96 s ALA 42 Cb -0.07 -2.73 0.02 0.00 0.00 0.00 0.00 23.12 20.33 2h96 s ALA 42 CO 0.22 0.19 0.36 0.00 0.00 0.00 0.00 175.76 176.53 2h96 s ALA 43 N -2.15 -0.63 -0.69 0.00 0.00 0.16 -2.16 121.76 116.29 2h96 s ALA 43 Ca 0.53 -0.33 -0.06 0.00 0.00 0.00 0.00 51.96 52.09 2h96 s ALA 43 Cb -0.10 0.70 0.18 0.00 0.00 0.00 0.00 23.12 23.90 2h96 s ALA 43 CO 0.24 -0.64 0.55 -0.47 0.00 0.00 0.00 175.76 175.43 2h96 s TYR 44 N -3.85 3.51 -0.18 0.00 5.04 -0.34 0.10 117.35 121.63 2h96 s TYR 44 Ca 0.07 -2.50 -0.29 0.00 -2.44 0.00 0.00 57.07 51.90 2h96 s TYR 44 Cb 0.02 -3.39 -0.06 0.00 0.35 0.00 0.00 41.96 38.88 2h96 s TYR 44 CO -0.08 -0.88 2.17 -3.47 -1.34 0.00 0.00 175.55 171.94 2h96 n ASP 45 N 3.61 3.36 0.00 4.32 -0.08 -1.12 -3.10 116.55 123.54 2h96 n ASP 45 Ca 0.10 0.36 0.00 0.00 -1.51 0.00 0.00 54.79 53.73 2h96 n ASP 45 Cb 0.41 -1.53 0.00 0.00 2.34 0.00 0.00 41.12 42.34 2h96 n ASP 45 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 2h96 n ALA 46 N 10.74 -0.48 -0.59 -1.67 0.00 0.73 -1.89 120.51 127.35 2h96 n ALA 46 Ca 0.29 0.00 0.45 0.00 0.00 0.00 0.00 53.44 54.18 2h96 n ALA 46 Cb 0.42 0.02 0.71 0.00 0.00 0.00 0.00 19.45 20.60 2h96 n ALA 46 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.50 176.61 2h96 n ILE 47 N -2.05 -0.06 0.08 0.00 5.41 -1.26 0.10 119.36 121.59 2h96 n ILE 47 Ca 0.00 1.41 -0.17 0.00 1.00 0.00 0.00 62.75 64.99 2h96 n ILE 47 Cb 0.00 -2.34 -0.14 0.00 -0.71 0.00 0.00 39.64 36.45 2h96 n ILE 47 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 176.55 176.48 2h96 h LEU 48 N 0.00 0.42 0.33 1.39 -0.00 -1.88 -3.48 115.31 112.09 2h96 h LEU 48 Ca 0.83 -0.52 -0.18 0.00 -0.00 0.00 0.00 57.88 58.01 2h96 h LEU 48 Cb 3.19 -0.14 0.02 0.00 -0.00 0.00 0.00 40.66 43.73 2h96 h LEU 48 CO -0.11 1.43 -0.26 -0.62 -0.00 0.00 0.00 178.44 178.87 2h96 n GLU 49 N -3.49 -1.93 -3.53 1.13 1.02 0.12 -5.01 120.64 108.94 2h96 n GLU 49 Ca -0.14 0.41 -0.13 0.00 -0.02 0.00 0.00 57.16 57.28 2h96 n GLU 49 Cb 1.04 -4.24 -0.04 0.00 -0.02 0.00 0.00 31.44 28.17 2h96 n GLU 49 CO 0.00 0.00 0.00 1.03 1.18 0.00 0.00 177.13 179.34 2h96 s ARG 50 N -4.94 1.12 0.43 3.49 0.52 -1.24 -5.10 118.95 113.23 2h96 s ARG 50 Ca 0.11 -0.31 -0.13 0.00 -0.52 0.00 0.00 55.73 54.89 2h96 s ARG 50 Cb -0.05 0.51 -0.07 0.00 0.52 0.00 0.00 34.95 35.86 2h96 s ARG 50 CO 0.14 -0.43 0.83 -0.80 0.02 0.00 0.00 175.30 175.06 2h96 s ASN 51 N -2.22 6.57 0.28 0.23 -0.87 -1.26 -2.79 114.94 114.87 2h96 s ASN 51 Ca -0.03 1.27 0.03 0.00 -1.57 0.00 0.00 52.86 52.56 2h96 s ASN 51 Cb -0.00 -2.38 -0.03 0.00 -0.02 0.00 0.00 41.25 38.81 2h96 s ASN 51 CO -0.05 -0.45 0.24 0.68 -2.57 0.00 0.00 177.10 174.95 2h96 s VAL 52 N -2.43 0.00 -0.03 1.60 -7.23 0.28 -4.31 120.40 108.29 2h96 s VAL 52 Ca 0.54 -1.96 0.07 0.00 -1.81 0.00 0.00 61.98 58.82 2h96 s VAL 52 Cb -0.10 -2.50 -0.02 0.00 0.56 0.00 0.00 36.38 34.32 2h96 s VAL 52 CO 0.31 0.00 -0.23 0.00 -0.31 0.00 0.00 175.10 174.87 2h96 s ALA 53 N -3.72 1.92 -0.11 1.32 0.00 -0.40 0.40 121.76 121.18 2h96 s ALA 53 Ca 0.39 -0.98 0.01 0.00 0.00 0.00 0.00 51.96 51.39 2h96 s ALA 53 Cb 0.04 -0.52 0.02 0.00 0.00 0.00 0.00 23.12 22.66 2h96 s ALA 53 CO 0.20 0.45 -0.14 0.42 0.00 0.00 0.00 175.76 176.68 2h96 s ILE 54 N -0.43 1.46 -0.09 0.00 1.01 0.17 -1.40 121.20 121.91 2h96 s ILE 54 Ca 0.06 -0.61 -0.02 0.00 0.00 0.00 0.00 60.65 60.08 2h96 s ILE 54 Cb -0.10 -1.34 -0.03 0.00 0.01 0.00 0.00 42.46 41.00 2h96 s ILE 54 CO 0.00 0.43 -0.01 -0.75 0.00 0.00 0.00 174.94 174.62 2h96 s LYS 55 N 1.06 3.03 -0.29 2.79 2.20 0.29 -1.39 119.74 127.42 2h96 s LYS 55 Ca -0.05 -0.42 -0.02 0.00 -0.36 0.00 0.00 55.97 55.12 2h96 s LYS 55 Cb -0.15 -2.79 0.05 0.00 -1.51 0.00 0.00 37.83 33.43 2h96 s LYS 55 CO -0.03 0.66 -0.01 0.21 -0.36 0.00 0.00 175.35 175.83 2h96 s LYS 56 N -0.77 2.48 0.03 4.03 2.20 -0.61 -0.47 119.74 126.62 2h96 s LYS 56 Ca 0.12 -1.23 -0.31 0.00 -0.36 0.00 0.00 55.97 54.19 2h96 s LYS 56 Cb -0.11 -3.15 -0.10 0.00 -1.51 0.00 0.00 37.83 32.96 2h96 s LYS 56 CO 0.02 -0.59 1.95 1.28 -0.36 0.00 0.00 175.35 177.65 2h96 n LEU 57 N 4.63 4.05 -4.60 5.43 4.32 -0.51 -4.01 117.00 126.31 2h96 n LEU 57 Ca -0.14 0.92 -0.43 0.00 -0.02 0.00 0.00 56.01 56.34 2h96 n LEU 57 Cb 0.44 -1.50 -0.03 0.00 -1.62 0.00 0.00 43.42 40.71 2h96 n LEU 57 CO 0.26 0.16 0.94 -0.44 -1.22 0.00 0.00 177.39 177.10 2h96 s SER 58 N 4.25 6.68 -0.59 -1.43 0.01 -0.74 -4.31 113.70 117.58 2h96 s SER 58 Ca 0.89 0.56 -0.18 0.00 1.31 0.00 0.00 55.95 58.53 2h96 s SER 58 Cb -0.48 -2.52 0.03 0.00 0.21 0.00 0.00 66.02 63.25 2h96 s SER 58 CO 0.43 -1.10 0.64 0.54 0.41 0.00 0.00 173.24 174.17 2h96 n ARG 59 N 7.41 -1.85 0.25 12.44 5.12 -1.26 -4.84 116.66 133.94 2h96 n ARG 59 Ca 0.11 1.44 0.14 0.00 -1.93 0.00 0.00 57.85 57.61 2h96 n ARG 59 Cb 0.48 -3.56 0.56 0.00 -1.16 0.00 0.00 32.46 28.78 2h96 n ARG 59 CO 0.00 0.00 0.00 -1.35 -1.93 0.00 0.00 177.63 174.35 2h96 h PRO 60 N 1.22 0.00 -0.08 5.56 0.11 -1.82 -3.17 132.00 133.82 2h96 h PRO 60 Ca -0.36 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.75 2h96 h PRO 60 Cb 1.25 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.36 2h96 h PRO 60 CO 0.27 0.08 0.00 1.19 -0.21 0.00 0.00 178.00 179.33 2h96 n PHE 61 N -3.19 0.13 -0.25 0.65 3.01 -1.26 -2.18 117.46 114.38 2h96 n PHE 61 Ca 0.01 -0.60 0.05 0.00 1.01 0.00 0.00 57.45 57.92 2h96 n PHE 61 Cb 0.37 -0.07 0.18 0.00 -0.01 0.00 0.00 39.48 39.94 2h96 n PHE 61 CO 0.00 0.00 0.00 0.37 1.01 0.00 0.00 176.76 178.14 2h96 h GLN 62 N 0.47 0.34 -5.02 -1.08 4.15 -1.91 -3.43 115.11 108.62 2h96 h GLN 62 Ca 0.00 -0.02 -0.32 0.00 0.77 0.00 0.00 58.65 59.08 2h96 h GLN 62 Cb 0.67 -0.08 -0.15 0.00 0.21 0.00 0.00 27.48 28.14 2h96 h GLN 62 CO 0.01 0.22 -0.70 1.21 -1.93 0.00 0.00 178.83 177.64 2h96 s ASN 63 N -5.29 1.72 0.49 -0.69 2.47 -1.26 -4.99 114.94 107.38 2h96 s ASN 63 Ca -0.13 -1.05 0.33 0.00 0.42 0.00 0.00 52.86 52.43 2h96 s ASN 63 Cb 0.21 0.01 1.72 0.00 -1.45 0.00 0.00 41.25 41.73 2h96 s ASN 63 CO 0.76 -0.38 2.01 -0.61 -3.72 0.00 0.00 177.10 175.15 2h96 h GLN 64 N 2.74 0.00 0.09 0.43 4.15 -1.92 -2.47 115.11 118.14 2h96 h GLN 64 Ca -0.37 0.00 -0.19 0.00 0.77 0.00 0.00 58.65 58.86 2h96 h GLN 64 Cb 1.19 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.89 2h96 h GLN 64 CO 0.64 0.00 -0.95 1.15 -1.93 0.00 0.00 178.83 177.73 2h96 h THR 65 N 0.00 1.32 -0.67 2.39 2.02 -1.95 -3.00 112.91 113.02 2h96 h THR 65 Ca 0.00 -2.42 0.11 0.00 0.77 0.00 0.00 66.41 64.87 2h96 h THR 65 Cb 0.08 2.95 -0.08 0.00 -1.74 0.00 0.00 68.15 69.37 2h96 h THR 65 CO 0.00 0.65 0.27 0.45 0.37 0.00 0.00 175.52 177.27 2h96 h HIS 66 N -0.51 0.48 -0.01 3.16 3.86 -1.70 0.56 115.15 120.98 2h96 h HIS 66 Ca -0.20 0.03 0.03 0.00 -1.16 0.00 0.00 60.37 59.07 2h96 h HIS 66 Cb 1.55 -0.11 -0.06 0.00 1.06 0.00 0.00 27.41 29.85 2h96 h HIS 66 CO 0.17 0.12 -0.48 0.00 0.86 0.00 0.00 177.93 178.60 2h96 h ALA 67 N 1.46 -0.80 -0.37 2.45 0.00 -1.21 1.21 119.26 122.00 2h96 h ALA 67 Ca 0.35 -0.06 0.11 0.00 0.00 0.00 0.00 54.91 55.30 2h96 h ALA 67 Cb 0.44 0.85 -0.01 0.00 0.00 0.00 0.00 17.79 19.07 2h96 h ALA 67 CO -0.33 -1.03 0.45 -0.22 0.00 0.00 0.00 179.25 178.13 2h96 h LYS 68 N -0.62 0.00 0.08 0.00 3.64 -0.89 -0.06 116.57 118.73 2h96 h LYS 68 Ca 0.03 0.00 -0.37 0.00 -1.27 0.00 0.00 60.65 59.05 2h96 h LYS 68 Cb 0.69 0.00 -0.03 0.00 -0.41 0.00 0.00 32.23 32.48 2h96 h LYS 68 CO -0.35 0.00 -2.09 0.54 -2.27 0.00 0.00 179.45 175.29 2h96 n ARG 69 N -3.59 0.72 -0.04 1.90 1.74 0.87 -3.11 116.66 115.15 2h96 n ARG 69 Ca 0.07 0.25 -0.09 0.00 -0.77 0.00 0.00 57.85 57.31 2h96 n ARG 69 Cb 0.62 -1.66 -0.03 0.00 -1.02 0.00 0.00 32.46 30.37 2h96 n ARG 69 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2h96 h ALA 70 N -0.01 0.20 0.55 7.54 0.00 0.21 0.49 119.26 128.24 2h96 h ALA 70 Ca -0.47 0.04 -0.02 0.00 0.00 0.00 0.00 54.91 54.47 2h96 h ALA 70 Cb 1.94 0.05 -0.02 0.00 0.00 0.00 0.00 17.79 19.77 2h96 h ALA 70 CO 0.01 -0.40 -0.49 -0.92 0.00 0.00 0.00 179.25 177.45 2h96 h TYR 71 N 0.11 -1.34 -0.72 0.00 3.20 -1.21 0.48 116.97 117.49 2h96 h TYR 71 Ca 0.09 0.00 0.12 0.00 3.14 0.00 0.00 58.73 62.08 2h96 h TYR 71 Cb 0.09 0.51 -0.08 0.00 1.54 0.00 0.00 36.73 38.79 2h96 h TYR 71 CO -0.15 -0.67 0.31 0.00 -1.64 0.00 0.00 178.16 176.02 2h96 h ARG 72 N -1.02 0.48 0.00 1.82 3.08 -1.45 0.18 114.38 117.48 2h96 h ARG 72 Ca -0.07 -0.03 0.00 0.00 0.07 0.00 0.00 59.98 59.95 2h96 h ARG 72 Cb 0.87 -0.11 0.00 0.00 0.08 0.00 0.00 29.97 30.82 2h96 h ARG 72 CO -0.03 0.32 0.00 -1.91 -1.07 0.00 0.00 179.97 177.28 2h96 n GLU 73 N -4.95 0.00 0.00 0.04 4.07 0.17 -0.03 120.64 119.95 2h96 n GLU 73 Ca 0.12 0.72 0.00 0.00 -0.06 0.00 0.00 57.16 57.95 2h96 n GLU 73 Cb 0.35 -1.43 0.00 0.00 -0.06 0.00 0.00 31.44 30.29 2h96 n GLU 73 CO 0.00 0.00 0.00 1.28 -0.06 0.00 0.00 177.13 178.35 2h96 n LEU 74 N -2.34 0.00 -0.05 4.31 7.99 0.11 -0.55 117.00 126.47 2h96 n LEU 74 Ca 0.00 0.60 -0.01 0.00 -0.01 0.00 0.00 56.01 56.59 2h96 n LEU 74 Cb 0.00 -0.10 -0.01 0.00 -0.11 0.00 0.00 43.42 43.20 2h96 n LEU 74 CO 0.00 -0.10 0.20 0.52 -1.51 0.00 0.00 177.39 176.50 2h96 n VAL 75 N -1.33 -0.08 0.01 4.08 0.31 0.56 0.99 118.33 122.88 2h96 n VAL 75 Ca 0.00 0.72 0.11 0.00 -0.01 0.00 0.00 64.34 65.17 2h96 n VAL 75 Cb 0.00 -0.94 0.55 0.00 -0.91 0.00 0.00 33.84 32.54 2h96 n VAL 75 CO 0.00 0.00 0.00 -0.07 -1.32 0.00 0.00 176.83 175.44 2h96 h LEU 76 N 0.00 0.25 -0.94 7.52 3.38 -0.13 0.27 115.31 125.66 2h96 h LEU 76 Ca 0.02 0.00 -0.07 0.00 0.09 0.00 0.00 57.88 57.93 2h96 h LEU 76 Cb 0.05 -0.05 -0.02 0.00 0.09 0.00 0.00 40.66 40.72 2h96 h LEU 76 CO -0.11 0.16 0.06 0.24 0.09 0.00 0.00 178.44 178.88 2h96 h MET 77 N 0.28 0.84 0.19 1.13 2.86 0.32 -2.98 114.93 117.57 2h96 h MET 77 Ca 0.20 -0.20 -0.01 0.00 -2.06 0.00 0.00 59.70 57.62 2h96 h MET 77 Cb 0.42 -0.11 0.00 0.00 0.06 0.00 0.00 31.60 31.98 2h96 h MET 77 CO -0.04 0.80 -0.09 -0.22 1.06 0.00 0.00 176.91 178.42 2h96 h LYS 78 N 0.79 -0.25 0.00 1.72 1.63 0.40 -3.37 116.57 117.50 2h96 h LYS 78 Ca 0.16 0.02 0.00 0.00 -0.85 0.00 0.00 60.65 59.98 2h96 h LYS 78 Cb 0.39 0.06 0.00 0.00 -0.60 0.00 0.00 32.23 32.08 2h96 h LYS 78 CO 0.01 -0.09 0.00 0.00 -3.45 0.00 0.00 179.45 175.92 2h96 s VAL 80 N -2.00 0.29 0.00 0.00 1.01 -1.13 -3.83 120.40 114.75 2h96 s VAL 80 Ca 0.14 0.15 0.04 0.00 0.00 0.00 0.00 61.98 62.31 2h96 s VAL 80 Cb 0.07 -0.44 -0.01 0.00 0.00 0.00 0.00 36.38 35.99 2h96 s VAL 80 CO 0.11 0.23 -0.12 0.20 0.00 0.00 0.00 175.10 175.53 2h96 s ASN 81 N 1.82 1.35 0.04 3.32 -0.87 -1.26 -4.88 114.94 114.46 2h96 s ASN 81 Ca 0.02 -0.27 -0.27 0.00 -1.57 0.00 0.00 52.86 50.77 2h96 s ASN 81 Cb -0.12 -0.13 0.09 0.00 -0.02 0.00 0.00 41.25 41.07 2h96 s ASN 81 CO -0.04 0.10 0.78 -2.28 -2.57 0.00 0.00 177.10 173.08 2h96 s HIS 82 N -0.44 -0.44 -1.36 2.20 2.46 -1.26 -4.99 115.29 111.46 2h96 s HIS 82 Ca 0.03 0.37 0.21 0.00 0.47 0.00 0.00 55.06 56.14 2h96 s HIS 82 Cb -0.05 0.53 1.05 0.00 -0.13 0.00 0.00 32.58 33.97 2h96 s HIS 82 CO -0.00 -0.64 1.68 0.36 -2.47 0.00 0.00 174.74 173.67 2h96 n LYS 83 N -0.12 0.25 -0.58 2.88 2.85 -1.26 -2.59 118.16 119.60 2h96 n LYS 83 Ca -0.13 0.09 0.03 0.00 -1.05 0.00 0.00 58.31 57.25 2h96 n LYS 83 Cb 0.62 -1.50 0.20 0.00 -0.65 0.00 0.00 35.03 33.70 2h96 n LYS 83 CO 0.00 0.00 0.00 0.09 -0.05 0.00 0.00 177.40 177.44 2h96 n ASN 84 N -1.32 2.41 -3.68 -5.58 5.03 -1.26 -4.85 115.26 106.00 2h96 n ASN 84 Ca 0.09 -3.61 -0.21 0.00 0.87 0.00 0.00 54.58 51.72 2h96 n ASN 84 Cb 0.18 -0.56 -0.18 0.00 -1.02 0.00 0.00 39.78 38.21 2h96 n ASN 84 CO 0.00 0.00 0.00 -0.63 -1.83 0.00 0.00 177.26 174.80 2h96 s ILE 85 N -3.13 -0.01 -0.35 2.41 -1.09 -1.07 -1.67 121.20 116.29 2h96 s ILE 85 Ca 0.40 0.28 -0.44 0.00 -2.23 0.00 0.00 60.65 58.67 2h96 s ILE 85 Cb 0.37 -0.29 -0.19 0.00 -1.58 0.00 0.00 42.46 40.77 2h96 s ILE 85 CO -0.01 0.13 1.56 0.00 -1.23 0.00 0.00 174.94 175.39 2h96 n ILE 86 N 5.26 0.08 -2.64 2.92 0.13 -0.94 -4.54 119.36 119.64 2h96 n ILE 86 Ca -0.04 -0.02 -0.41 0.00 -1.10 0.00 0.00 62.75 61.19 2h96 n ILE 86 Cb 0.50 -0.65 -0.05 0.00 -0.84 0.00 0.00 39.64 38.60 2h96 n ILE 86 CO 0.00 0.00 0.00 -0.83 2.80 0.00 0.00 176.55 178.52 2h96 s GLY 87 N 2.65 3.01 -0.64 4.50 0.00 -1.26 -4.95 107.32 110.63 2h96 s GLY 87 Ca 1.00 0.70 -0.28 0.00 0.00 0.00 0.00 44.72 46.15 2h96 s GLY 87 CO 0.73 1.43 1.23 -2.27 0.00 0.00 0.00 173.10 174.22 2h96 s LEU 88 N -0.72 3.33 0.12 0.66 2.96 -1.26 -2.28 118.68 121.50 2h96 s LEU 88 Ca 0.45 -0.11 0.01 0.00 -0.22 0.00 0.00 54.13 54.26 2h96 s LEU 88 Cb -0.27 -2.92 -0.14 0.00 0.50 0.00 0.00 46.19 43.36 2h96 s LEU 88 CO 0.34 -1.63 1.28 -0.07 -1.32 0.00 0.00 176.35 174.94 2h96 h LEU 89 N 12.40 0.28 0.00 -0.68 3.38 -0.90 -3.48 115.31 126.32 2h96 h LEU 89 Ca -0.26 -0.26 0.28 0.00 0.09 0.00 0.00 57.88 57.73 2h96 h LEU 89 Cb 1.05 -0.09 -0.05 0.00 0.09 0.00 0.00 40.66 41.66 2h96 h LEU 89 CO 1.22 1.13 0.80 -3.20 0.09 0.00 0.00 178.44 178.49 2h96 n ASN 90 N -3.57 -1.36 -3.59 -0.43 4.05 0.37 -4.97 115.26 105.77 2h96 n ASN 90 Ca -0.05 -1.46 -0.02 0.00 0.45 0.00 0.00 54.58 53.50 2h96 n ASN 90 Cb 0.90 2.15 -0.06 0.00 1.23 0.00 0.00 39.78 44.00 2h96 n ASN 90 CO 0.00 0.00 0.00 0.54 -3.05 0.00 0.00 177.26 174.75 2h96 s VAL 91 N -2.03 -0.29 0.24 3.44 0.11 -1.26 -0.59 120.40 120.03 2h96 s VAL 91 Ca 0.28 0.00 -0.06 0.00 -2.93 0.00 0.00 61.98 59.27 2h96 s VAL 91 Cb -0.01 -1.00 -0.02 0.00 -1.53 0.00 0.00 36.38 33.82 2h96 s VAL 91 CO 0.01 0.00 0.33 0.72 -3.33 0.00 0.00 175.10 172.84 2h96 s PHE 92 N 1.93 0.82 -0.02 1.54 -0.12 0.08 -3.75 117.98 118.46 2h96 s PHE 92 Ca -0.07 -1.09 -0.07 0.00 -0.05 0.00 0.00 56.93 55.65 2h96 s PHE 92 Cb -0.06 -0.18 0.00 0.00 -0.63 0.00 0.00 43.02 42.16 2h96 s PHE 92 CO -0.17 -0.87 0.14 -0.08 -0.05 0.00 0.00 175.22 174.19 2h96 s THR 93 N -3.93 0.06 -0.06 -4.49 -1.32 -1.26 -1.49 115.64 103.14 2h96 s THR 93 Ca 0.31 -0.49 -0.00 0.00 -1.21 0.00 0.00 61.69 60.29 2h96 s THR 93 Cb 0.03 -0.37 -0.26 0.00 -1.51 0.00 0.00 72.50 70.39 2h96 s THR 93 CO 0.12 -0.27 0.60 1.55 -2.21 0.00 0.00 174.62 174.42 2h96 h PRO 94 N 4.77 0.19 -6.67 7.08 0.13 -1.86 -3.47 132.00 132.17 2h96 h PRO 94 Ca -0.29 -0.33 -0.58 0.00 -0.87 0.00 0.00 66.00 63.93 2h96 h PRO 94 Cb 1.20 0.12 0.16 0.00 0.13 0.00 0.00 31.00 32.61 2h96 h PRO 94 CO 0.41 0.99 -0.11 1.04 -0.23 0.00 0.00 178.00 180.10 2h96 n GLN 95 N -3.36 0.74 0.06 0.86 3.00 -1.26 -4.94 117.38 112.48 2h96 n GLN 95 Ca -0.23 0.29 -0.23 0.00 -0.01 0.00 0.00 57.00 56.82 2h96 n GLN 95 Cb 1.05 -1.94 -0.15 0.00 0.00 0.00 0.00 30.24 29.20 2h96 n GLN 95 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.06 177.93 2h96 h LYS 96 N 0.43 0.37 -4.30 -1.09 6.56 -1.95 -3.46 116.57 113.14 2h96 h LYS 96 Ca -0.47 -0.63 -0.14 0.00 -1.06 0.00 0.00 60.65 58.35 2h96 h LYS 96 Cb 1.38 0.23 -0.16 0.00 -0.57 0.00 0.00 32.23 33.12 2h96 h LYS 96 CO 0.49 1.30 -0.69 0.45 -2.06 0.00 0.00 179.45 178.95 2h96 s SER 97 N -7.24 0.59 0.46 0.86 0.15 -1.26 -5.00 113.70 102.26 2h96 s SER 97 Ca -0.16 -0.96 0.39 0.00 0.70 0.00 0.00 55.95 55.92 2h96 s SER 97 Cb 0.05 0.17 1.49 0.00 -1.71 0.00 0.00 66.02 66.02 2h96 s SER 97 CO 0.84 -0.55 1.42 -0.11 1.20 0.00 0.00 173.24 176.04 2h96 n LEU 98 N 0.21 0.08 0.49 3.45 7.94 -1.26 0.37 117.00 128.28 2h96 n LEU 98 Ca -0.15 1.05 -0.19 0.00 -1.11 0.00 0.00 56.01 55.61 2h96 n LEU 98 Cb 0.60 -0.52 -0.09 0.00 0.53 0.00 0.00 43.42 43.94 2h96 n LEU 98 CO 0.28 -1.09 0.51 -0.08 -1.11 0.00 0.00 177.39 175.90 2h96 h GLU 99 N 0.00 -1.21 0.78 1.96 4.57 -2.01 -3.26 114.58 115.41 2h96 h GLU 99 Ca 0.84 0.08 -0.04 0.00 -1.18 0.00 0.00 59.36 59.06 2h96 h GLU 99 Cb 3.11 0.28 0.00 0.00 -0.16 0.00 0.00 28.75 31.98 2h96 h GLU 99 CO -0.18 -0.81 -0.40 1.49 -1.18 0.00 0.00 179.01 177.93 2h96 h GLU 100 N -1.30 -1.05 -1.19 1.92 4.81 -0.50 -3.46 114.58 113.81 2h96 h GLU 100 Ca -0.13 0.07 -0.16 0.00 -0.13 0.00 0.00 59.36 59.02 2h96 h GLU 100 Cb 0.96 0.24 0.01 0.00 0.63 0.00 0.00 28.75 30.59 2h96 h GLU 100 CO 0.21 -0.70 0.01 0.34 -0.73 0.00 0.00 179.01 178.14 2h96 n PHE 101 N -5.56 0.12 0.00 0.92 7.35 0.04 -4.81 117.46 115.52 2h96 n PHE 101 Ca -0.15 0.21 0.00 0.00 -0.76 0.00 0.00 57.45 56.75 2h96 n PHE 101 Cb 0.44 -0.42 0.00 0.00 0.35 0.00 0.00 39.48 39.86 2h96 n PHE 101 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 2h96 n GLN 102 N 0.30 0.00 -4.81 -4.13 0.00 -1.26 -4.96 117.38 102.51 2h96 n GLN 102 Ca 0.04 0.00 -0.32 0.00 0.00 0.00 0.00 57.00 56.72 2h96 n GLN 102 Cb 0.02 0.00 -0.17 0.00 0.00 0.00 0.00 30.24 30.09 2h96 n GLN 102 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.06 176.55 2h96 s ASP 103 N 0.00 2.99 -0.08 2.61 1.11 -1.26 -4.64 116.67 117.40 2h96 s ASP 103 Ca 0.00 -0.56 0.01 0.00 0.18 0.00 0.00 52.55 52.18 2h96 s ASP 103 Cb 0.00 -1.38 0.02 0.00 1.07 0.00 0.00 42.92 42.63 2h96 s ASP 103 CO 0.00 0.10 -0.11 -0.69 1.18 0.00 0.00 175.17 175.65 2h96 s VAL 104 N 0.68 1.08 -0.17 -1.27 1.01 -1.26 -4.50 120.40 115.97 2h96 s VAL 104 Ca -0.11 -0.41 -0.03 0.00 0.00 0.00 0.00 61.98 61.43 2h96 s VAL 104 Cb -0.16 -1.03 -0.02 0.00 0.00 0.00 0.00 36.38 35.17 2h96 s VAL 104 CO 0.02 0.35 -0.05 -0.31 0.00 0.00 0.00 175.10 175.11 2h96 s TYR 105 N 0.97 2.98 -0.09 5.22 1.51 -0.56 -1.42 117.35 125.96 2h96 s TYR 105 Ca -0.09 -0.50 -0.01 0.00 -1.01 0.00 0.00 57.07 55.46 2h96 s TYR 105 Cb -0.15 -1.99 -0.03 0.00 -0.11 0.00 0.00 41.96 39.68 2h96 s TYR 105 CO 0.00 -0.20 -0.04 0.42 -1.11 0.00 0.00 175.55 174.62 2h96 s ILE 106 N 0.68 3.93 -0.06 2.71 1.01 0.38 -0.75 121.20 129.10 2h96 s ILE 106 Ca -0.03 -0.38 0.05 0.00 0.00 0.00 0.00 60.65 60.29 2h96 s ILE 106 Cb -0.15 -2.65 -0.01 0.00 0.01 0.00 0.00 42.46 39.66 2h96 s ILE 106 CO 0.02 0.58 -0.22 -0.69 0.00 0.00 0.00 174.94 174.63 2h96 s VAL 107 N -0.56 2.32 0.08 2.92 1.01 0.24 -0.55 120.40 125.87 2h96 s VAL 107 Ca 0.09 -0.97 -0.14 0.00 0.00 0.00 0.00 61.98 60.95 2h96 s VAL 107 Cb -0.12 -1.87 0.02 0.00 0.00 0.00 0.00 36.38 34.42 2h96 s VAL 107 CO 0.02 0.57 0.34 -0.04 0.00 0.00 0.00 175.10 175.98 2h96 s MET 108 N -0.20 0.93 0.82 2.72 -1.94 -0.50 -0.18 119.30 120.96 2h96 s MET 108 Ca -0.02 -0.65 -0.15 0.00 -1.71 0.00 0.00 55.69 53.16 2h96 s MET 108 Cb -0.13 0.40 -0.04 0.00 2.01 0.00 0.00 34.83 37.08 2h96 s MET 108 CO 0.03 -0.33 0.27 -0.85 -0.01 0.00 0.00 175.02 174.13 2h96 n GLU 109 N 0.13 0.05 -4.12 2.03 0.28 -0.97 -1.27 120.64 116.77 2h96 n GLU 109 Ca -0.17 0.05 -0.21 0.00 -0.16 0.00 0.00 57.16 56.67 2h96 n GLU 109 Cb 0.62 -1.68 -0.17 0.00 1.43 0.00 0.00 31.44 31.64 2h96 n GLU 109 CO 0.00 0.00 0.00 -0.48 -0.16 0.00 0.00 177.13 176.49 2h96 s LEU 110 N 0.90 1.24 0.00 -1.84 0.05 -1.26 -4.51 118.68 113.26 2h96 s LEU 110 Ca 0.59 -0.14 0.00 0.00 0.05 0.00 0.00 54.13 54.62 2h96 s LEU 110 Cb -0.29 -0.50 0.00 0.00 -2.05 0.00 0.00 46.19 43.35 2h96 s LEU 110 CO 0.65 -0.07 0.00 0.23 -0.55 0.00 0.00 176.35 176.61 2h96 n MET 111 N 4.24 1.15 -0.05 1.48 2.81 -1.26 -4.94 117.12 120.55 2h96 n MET 111 Ca -0.21 0.00 -0.14 0.00 -1.81 0.00 0.00 57.70 55.53 2h96 n MET 111 Cb 0.51 0.00 -0.14 0.00 -0.71 0.00 0.00 33.22 32.88 2h96 n MET 111 CO 0.00 0.00 0.00 -0.25 1.51 0.00 0.00 175.97 177.23 2h96 n ASP 112 N -0.13 1.27 -0.78 7.83 8.00 -0.08 -4.95 116.55 127.70 2h96 n ASP 112 Ca 0.00 0.18 0.00 0.00 0.71 0.00 0.00 54.79 55.68 2h96 n ASP 112 Cb 0.00 -0.16 0.00 0.00 -0.02 0.00 0.00 41.12 40.94 2h96 n ASP 112 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2h96 n ALA 113 N -2.84 0.00 -2.86 2.24 0.00 0.48 -4.99 120.51 112.54 2h96 n ALA 113 Ca -0.29 0.00 -0.25 0.00 0.00 0.00 0.00 53.44 52.90 2h96 n ALA 113 Cb 1.06 0.00 -0.04 0.00 0.00 0.00 0.00 19.45 20.47 2h96 n ALA 113 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.50 178.71 2h96 s ASN 114 N -0.39 5.79 0.40 0.00 3.04 -1.26 -2.11 114.94 120.41 2h96 s ASN 114 Ca 0.00 -0.06 0.28 0.00 0.04 0.00 0.00 52.86 53.12 2h96 s ASN 114 Cb 0.00 -1.59 1.32 0.00 -1.54 0.00 0.00 41.25 39.45 2h96 s ASN 114 CO 0.00 0.03 1.86 0.25 -3.04 0.00 0.00 177.10 176.20 2h96 h LEU 115 N 2.03 0.00 -1.53 3.21 6.46 -1.26 0.23 115.31 124.45 2h96 h LEU 115 Ca -0.48 0.00 -0.04 0.00 -0.12 0.00 0.00 57.88 57.24 2h96 h LEU 115 Cb 1.21 0.00 -0.01 0.00 -0.73 0.00 0.00 40.66 41.13 2h96 h LEU 115 CO 0.64 0.00 -0.18 0.00 -0.62 0.00 0.00 178.44 178.27 2h96 h GLN 117 N 0.00 0.50 -0.00 0.00 5.75 -0.93 -3.18 115.11 117.25 2h96 h GLN 117 Ca -0.00 -0.42 -0.00 0.00 -0.15 0.00 0.00 58.65 58.07 2h96 h GLN 117 Cb 0.54 0.09 0.00 0.00 1.07 0.00 0.00 27.48 29.18 2h96 h GLN 117 CO 0.02 1.06 -0.01 0.28 -2.65 0.00 0.00 178.83 177.53 2h96 h VAL 118 N 0.33 1.59 0.00 2.39 2.07 -1.23 -3.16 116.25 118.24 2h96 h VAL 118 Ca -0.04 -1.76 0.00 0.00 0.82 0.00 0.00 66.70 65.71 2h96 h VAL 118 Cb 1.37 2.79 0.00 0.00 -1.52 0.00 0.00 31.29 33.93 2h96 h VAL 118 CO 0.14 0.46 0.20 -0.38 0.02 0.00 0.00 177.57 178.01 2h96 n ILE 119 N -4.72 0.94 -0.58 4.57 5.41 0.64 0.46 119.36 126.08 2h96 n ILE 119 Ca -0.09 0.44 0.08 0.00 1.00 0.00 0.00 62.75 64.17 2h96 n ILE 119 Cb 0.37 -1.44 0.24 0.00 -0.71 0.00 0.00 39.64 38.11 2h96 n ILE 119 CO 0.00 0.00 0.00 1.67 0.00 0.00 0.00 176.55 178.22 2h96 n GLN 120 N -1.21 3.12 -4.00 0.38 -0.06 -1.19 -4.69 117.38 109.74 2h96 n GLN 120 Ca 0.00 -2.55 -0.09 0.00 -2.00 0.00 0.00 57.00 52.36 2h96 n GLN 120 Cb 0.20 -1.64 -0.11 0.00 -4.06 0.00 0.00 30.24 24.64 2h96 n GLN 120 CO 0.00 0.00 0.00 0.00 -0.20 0.00 0.00 177.06 176.86 2h96 s MET 121 N -1.87 0.39 -0.22 3.69 0.23 0.17 -5.10 119.30 116.59 2h96 s MET 121 Ca 0.37 -0.74 -0.20 0.00 -1.03 0.00 0.00 55.69 54.10 2h96 s MET 121 Cb 0.25 0.14 -0.03 0.00 -1.53 0.00 0.00 34.83 33.66 2h96 s MET 121 CO 0.15 -0.07 0.58 -1.21 -2.03 0.00 0.00 175.02 172.45 2h96 s GLU 122 N -2.01 4.16 0.00 3.16 2.02 -1.26 -4.97 118.70 119.80 2h96 s GLU 122 Ca -0.11 0.50 0.00 0.00 0.02 0.00 0.00 54.97 55.39 2h96 s GLU 122 Cb -0.06 -3.60 0.00 0.00 0.10 0.00 0.00 34.13 30.57 2h96 s GLU 122 CO -0.03 -0.28 0.00 1.28 0.02 0.00 0.00 175.26 176.25 2h96 n LEU 123 N 5.22 0.00 -4.12 1.80 4.77 -1.26 -5.14 117.00 118.27 2h96 n LEU 123 Ca -0.02 0.00 -0.11 0.00 -0.03 0.00 0.00 56.01 55.85 2h96 n LEU 123 Cb 0.50 0.00 -0.10 0.00 -2.33 0.00 0.00 43.42 41.48 2h96 n LEU 123 CO 0.43 -0.37 -0.39 1.51 -1.33 0.00 0.00 177.39 177.24 2h96 s ASP 124 N -1.00 0.94 0.40 -1.43 -4.77 -1.26 -4.66 116.67 104.89 2h96 s ASP 124 Ca 0.00 -0.85 0.27 0.00 -3.30 0.00 0.00 52.55 48.67 2h96 s ASP 124 Cb 0.00 0.09 1.41 0.00 -1.09 0.00 0.00 42.92 43.33 2h96 s ASP 124 CO 0.00 -0.40 1.55 1.41 0.70 0.00 0.00 175.17 178.43 2h96 n HIS 125 N 0.49 0.89 0.43 2.11 8.25 -1.26 -0.29 115.22 125.84 2h96 n HIS 125 Ca -0.16 0.89 -0.18 0.00 -0.26 0.00 0.00 57.72 58.01 2h96 n HIS 125 Cb 0.59 -1.32 -0.09 0.00 1.12 0.00 0.00 29.99 30.29 2h96 n HIS 125 CO 0.00 0.00 0.00 0.93 0.64 0.00 0.00 176.34 177.91 2h96 h GLU 126 N 0.00 -1.11 0.94 -0.41 4.39 -1.96 -1.63 114.58 114.80 2h96 h GLU 126 Ca 0.85 0.08 -0.05 0.00 0.34 0.00 0.00 59.36 60.58 2h96 h GLU 126 Cb 2.55 0.25 0.01 0.00 -0.10 0.00 0.00 28.75 31.47 2h96 h GLU 126 CO -0.59 -0.74 -0.45 0.00 -1.16 0.00 0.00 179.01 176.07 2h96 h ARG 127 N -1.15 -1.21 -0.44 2.33 2.47 -1.05 -1.79 114.38 113.54 2h96 h ARG 127 Ca -0.11 0.08 0.09 0.00 -1.26 0.00 0.00 59.98 58.78 2h96 h ARG 127 Cb 0.91 0.28 -0.08 0.00 -1.65 0.00 0.00 29.97 29.43 2h96 h ARG 127 CO 0.14 -0.81 -0.03 1.98 0.56 0.00 0.00 179.97 181.81 2h96 h MET 128 N -1.32 0.07 -0.69 0.04 4.05 -1.20 0.35 114.93 116.22 2h96 h MET 128 Ca -0.13 -0.00 -0.06 0.00 -0.28 0.00 0.00 59.70 59.23 2h96 h MET 128 Cb 0.96 -0.02 -0.03 0.00 -0.80 0.00 0.00 31.60 31.72 2h96 h MET 128 CO 0.21 0.05 0.20 1.03 0.23 0.00 0.00 176.91 178.63 2h96 h SER 129 N 0.07 1.00 0.01 1.39 0.87 -1.35 -1.18 113.55 114.37 2h96 h SER 129 Ca 0.22 -0.19 -0.00 0.00 -1.23 0.00 0.00 61.79 60.59 2h96 h SER 129 Cb 0.32 -0.26 0.00 0.00 -0.44 0.00 0.00 62.40 62.02 2h96 h SER 129 CO -0.39 0.94 -0.00 0.22 -0.53 0.00 0.00 176.83 177.06 2h96 h TYR 130 N 1.03 -0.01 -0.67 2.24 3.20 -0.37 -1.31 116.97 121.08 2h96 h TYR 130 Ca 0.22 -0.00 0.13 0.00 3.14 0.00 0.00 58.73 62.22 2h96 h TYR 130 Cb 0.31 0.00 -0.09 0.00 1.54 0.00 0.00 36.73 38.49 2h96 h TYR 130 CO 0.02 0.38 0.20 -0.07 -1.64 0.00 0.00 178.16 177.05 2h96 h LEU 131 N -0.40 0.11 -0.82 2.82 3.38 -0.19 -0.20 115.31 120.02 2h96 h LEU 131 Ca -0.00 0.11 -0.05 0.00 0.09 0.00 0.00 57.88 58.03 2h96 h LEU 131 Cb 0.39 0.13 -0.03 0.00 0.09 0.00 0.00 40.66 41.24 2h96 h LEU 131 CO 0.00 0.05 0.28 -0.07 0.09 0.00 0.00 178.44 178.79 2h96 h LEU 132 N 0.33 1.07 0.02 1.67 4.07 -1.15 -1.56 115.31 119.77 2h96 h LEU 132 Ca 0.36 -0.18 0.02 0.00 0.08 0.00 0.00 57.88 58.16 2h96 h LEU 132 Cb 0.54 -0.28 -0.02 0.00 1.08 0.00 0.00 40.66 41.98 2h96 h LEU 132 CO -0.41 0.96 -0.13 0.22 -1.08 0.00 0.00 178.44 178.01 2h96 h TYR 133 N 1.12 -0.32 -0.17 1.13 3.20 0.12 0.37 116.97 122.41 2h96 h TYR 133 Ca 0.25 0.01 0.01 0.00 3.14 0.00 0.00 58.73 62.14 2h96 h TYR 133 Cb 0.25 0.14 -0.01 0.00 1.54 0.00 0.00 36.73 38.65 2h96 h TYR 133 CO 0.02 -0.19 0.08 1.96 -1.64 0.00 0.00 178.16 178.39 2h96 h GLN 134 N -0.23 0.18 -0.78 1.82 4.20 -0.99 0.63 115.11 119.94 2h96 h GLN 134 Ca 0.04 -0.01 0.06 0.00 0.06 0.00 0.00 58.65 58.80 2h96 h GLN 134 Cb 0.27 -0.04 -0.06 0.00 0.30 0.00 0.00 27.48 27.95 2h96 h GLN 134 CO -0.11 0.12 0.47 1.98 -0.67 0.00 0.00 178.83 180.62 2h96 h MET 135 N 0.18 0.84 -0.65 1.46 4.05 -0.96 -0.18 114.93 119.67 2h96 h MET 135 Ca 0.07 -0.05 -0.06 0.00 -0.28 0.00 0.00 59.70 59.37 2h96 h MET 135 Cb 0.01 -0.19 -0.03 0.00 -0.80 0.00 0.00 31.60 30.60 2h96 h MET 135 CO -0.05 0.56 0.15 -0.07 0.23 0.00 0.00 176.91 177.73 2h96 h LEU 136 N 0.87 0.97 -0.46 3.39 3.38 0.40 -2.65 115.31 121.21 2h96 h LEU 136 Ca 0.34 -0.20 -0.10 0.00 0.09 0.00 0.00 57.88 58.02 2h96 h LEU 136 Cb 0.17 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.65 2h96 h LEU 136 CO -0.17 0.94 -0.10 0.00 0.09 0.00 0.00 178.44 179.20 2h96 h GLY 138 N 0.71 0.99 0.73 0.00 0.00 -0.88 -2.14 103.07 102.47 2h96 h GLY 138 Ca 0.12 -0.22 -0.05 0.00 0.00 0.00 0.00 47.33 47.18 2h96 h GLY 138 CO 0.04 0.08 -0.10 -2.22 0.00 0.00 0.00 176.54 174.34 2h96 h ILE 139 N 0.60 1.34 -1.02 2.60 2.04 -1.34 -2.92 117.51 118.80 2h96 h ILE 139 Ca 0.32 -1.22 0.25 0.00 1.00 0.00 0.00 64.86 65.22 2h96 h ILE 139 Cb 0.30 1.85 -0.12 0.00 -0.74 0.00 0.00 36.82 38.11 2h96 h ILE 139 CO -0.24 0.35 0.62 0.50 0.00 0.00 0.00 178.15 179.39 2h96 h LYS 140 N -0.06 0.51 0.33 2.37 1.63 -1.07 0.42 116.57 120.70 2h96 h LYS 140 Ca 0.03 -0.03 -0.01 0.00 -0.85 0.00 0.00 60.65 59.78 2h96 h LYS 140 Cb 0.61 -0.11 -0.00 0.00 -0.60 0.00 0.00 32.23 32.12 2h96 h LYS 140 CO 0.03 0.34 -0.18 1.25 -3.45 0.00 0.00 179.45 177.43 2h96 h HIS 141 N 0.52 -0.47 -0.21 1.91 2.76 -1.20 0.62 115.15 119.08 2h96 h HIS 141 Ca 0.63 -0.01 0.01 0.00 -2.20 0.00 0.00 60.37 58.80 2h96 h HIS 141 Cb 1.32 0.16 -0.01 0.00 1.55 0.00 0.00 27.41 30.43 2h96 h HIS 141 CO -0.01 -0.28 0.13 -0.07 -1.30 0.00 0.00 177.93 176.40 2h96 h LEU 142 N -0.47 0.21 -1.33 0.26 4.07 -0.46 -2.70 115.31 114.88 2h96 h LEU 142 Ca -0.04 0.00 0.02 0.00 0.08 0.00 0.00 57.88 57.95 2h96 h LEU 142 Cb 0.38 -0.04 -0.04 0.00 1.08 0.00 0.00 40.66 42.04 2h96 h LEU 142 CO 0.05 0.15 0.47 0.45 -1.08 0.00 0.00 178.44 178.49 2h96 h HIS 143 N 0.26 0.85 0.00 1.13 3.86 -0.16 -1.13 115.15 119.97 2h96 h HIS 143 Ca 0.08 0.02 0.00 0.00 -1.16 0.00 0.00 60.37 59.31 2h96 h HIS 143 Cb -0.01 -0.29 0.00 0.00 1.06 0.00 0.00 27.41 28.17 2h96 h HIS 143 CO -0.08 0.51 0.14 0.66 0.86 0.00 0.00 177.93 180.03 2h96 h SER 144 N 0.90 0.00 -0.28 2.45 4.64 -0.53 0.29 113.55 121.02 2h96 h SER 144 Ca 0.28 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.60 2h96 h SER 144 Cb -0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 2h96 h SER 144 CO -0.07 0.00 0.00 0.00 -0.87 0.00 0.00 176.83 175.89 2h96 n ALA 145 N -1.82 2.80 -1.26 5.18 0.00 -0.50 -4.82 120.51 120.09 2h96 n ALA 145 Ca -0.02 -2.02 -0.09 0.00 0.00 0.00 0.00 53.44 51.31 2h96 n ALA 145 Cb 0.19 -0.64 -0.04 0.00 0.00 0.00 0.00 19.45 18.95 2h96 n ALA 145 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2h96 n GLY 146 N -0.26 1.01 3.80 0.00 0.00 0.10 -4.98 105.19 104.86 2h96 n GLY 146 Ca 0.19 -0.33 -0.37 0.00 0.00 0.00 0.00 46.02 45.51 2h96 n GLY 146 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2h96 s ILE 147 N -2.16 5.22 0.03 -0.61 1.01 -0.77 -4.21 121.20 119.71 2h96 s ILE 147 Ca 0.00 0.64 0.06 0.00 0.00 0.00 0.00 60.65 61.35 2h96 s ILE 147 Cb 0.00 -3.64 -0.03 0.00 0.01 0.00 0.00 42.46 38.80 2h96 s ILE 147 CO 0.00 0.50 -0.14 -0.63 0.00 0.00 0.00 174.94 174.67 2h96 s ILE 148 N -0.38 3.11 -0.07 2.92 1.01 0.38 -3.28 121.20 124.89 2h96 s ILE 148 Ca 0.20 -1.07 -0.13 0.00 0.00 0.00 0.00 60.65 59.66 2h96 s ILE 148 Cb -0.14 -2.34 -0.29 0.00 0.01 0.00 0.00 42.46 39.69 2h96 s ILE 148 CO 0.08 0.33 0.62 -0.74 0.00 0.00 0.00 174.94 175.24 2h96 h HIS 149 N 4.45 0.62 0.00 3.97 -0.00 -1.91 -1.57 115.15 120.71 2h96 h HIS 149 Ca -0.48 -0.45 0.00 0.00 -0.00 0.00 0.00 60.37 59.44 2h96 h HIS 149 Cb 1.16 -0.02 0.00 0.00 -0.00 0.00 0.00 27.41 28.54 2h96 h HIS 149 CO 0.55 1.64 0.00 0.54 -0.00 0.00 0.00 177.93 180.66 2h96 n ARG 150 N -3.71 -0.66 -2.70 5.26 1.74 -1.26 -3.72 116.66 111.61 2h96 n ARG 150 Ca -0.25 0.17 -0.05 0.00 -0.77 0.00 0.00 57.85 56.94 2h96 n ARG 150 Cb 1.01 -4.23 0.10 0.00 -1.02 0.00 0.00 32.46 28.32 2h96 n ARG 150 CO 0.00 0.00 0.00 -3.47 -1.52 0.00 0.00 177.63 172.64 2h96 n ASP 151 N -0.33 -0.96 -4.72 0.55 2.03 -1.26 -4.73 116.55 107.12 2h96 n ASP 151 Ca 0.00 -2.38 -0.42 0.00 0.52 0.00 0.00 54.79 52.51 2h96 n ASP 151 Cb 0.17 0.55 -0.04 0.00 -0.72 0.00 0.00 41.12 41.08 2h96 n ASP 151 CO 0.00 0.00 0.00 -0.76 -1.92 0.00 0.00 177.20 174.52 2h96 s LEU 152 N -3.53 4.43 0.20 -2.67 1.43 -1.26 -4.83 118.68 112.46 2h96 s LEU 152 Ca 0.19 1.87 -0.22 0.00 -1.03 0.00 0.00 54.13 54.94 2h96 s LEU 152 Cb 0.42 -3.58 0.07 0.00 0.03 0.00 0.00 46.19 43.12 2h96 s LEU 152 CO -0.08 -0.24 0.99 -1.59 0.23 0.00 0.00 176.35 175.66 2h96 s LYS 153 N 0.42 1.40 0.14 1.70 -2.85 -1.26 -4.84 119.74 114.45 2h96 s LYS 153 Ca 0.51 -0.87 -0.18 0.00 -1.00 0.00 0.00 55.97 54.43 2h96 s LYS 153 Cb -0.25 0.41 -0.03 0.00 -2.06 0.00 0.00 37.83 35.90 2h96 s LYS 153 CO 0.30 -0.65 1.78 -1.35 0.10 0.00 0.00 175.35 175.53 2h96 h PRO 154 N 2.00 0.41 -0.58 1.78 0.11 -1.94 -2.42 132.00 131.36 2h96 h PRO 154 Ca -0.27 -0.03 0.17 0.00 0.11 0.00 0.00 66.00 65.97 2h96 h PRO 154 Cb 1.23 -0.09 -0.02 0.00 0.11 0.00 0.00 31.00 32.22 2h96 h PRO 154 CO 0.34 0.29 0.58 0.77 -0.21 0.00 0.00 178.00 179.77 2h96 h SER 155 N 0.41 0.00 -0.66 -2.05 0.02 -1.96 -0.23 113.55 109.07 2h96 h SER 155 Ca 0.11 0.00 -0.32 0.00 -0.84 0.00 0.00 61.79 60.74 2h96 h SER 155 Cb -0.02 0.00 -0.19 0.00 0.14 0.00 0.00 62.40 62.33 2h96 h SER 155 CO -0.02 0.00 0.27 0.59 -1.14 0.00 0.00 176.83 176.53 2h96 n ASN 156 N -3.73 3.30 -3.71 3.07 3.02 -0.92 -4.91 115.26 111.39 2h96 n ASN 156 Ca 0.11 -3.62 -0.16 0.00 -0.03 0.00 0.00 54.58 50.88 2h96 n ASN 156 Cb 0.80 -0.73 -0.16 0.00 -0.61 0.00 0.00 39.78 39.08 2h96 n ASN 156 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 2h96 s ILE 157 N -3.23 -0.13 0.02 2.41 1.01 -0.10 -1.54 121.20 119.64 2h96 s ILE 157 Ca 0.51 0.30 0.07 0.00 0.00 0.00 0.00 60.65 61.53 2h96 s ILE 157 Cb 0.44 -0.21 -0.03 0.00 0.01 0.00 0.00 42.46 42.67 2h96 s ILE 157 CO 0.06 0.12 -0.20 0.68 0.00 0.00 0.00 174.94 175.60 2h96 s VAL 158 N 1.73 2.58 0.25 2.92 -7.23 -0.93 -1.24 120.40 118.49 2h96 s VAL 158 Ca -0.02 -1.14 0.11 0.00 -1.81 0.00 0.00 61.98 59.12 2h96 s VAL 158 Cb -0.12 -2.03 -0.05 0.00 0.56 0.00 0.00 36.38 34.74 2h96 s VAL 158 CO -0.05 0.42 -0.21 0.68 -0.31 0.00 0.00 175.10 175.64 2h96 s VAL 159 N -0.82 2.38 0.15 1.32 -7.23 -0.90 -0.88 120.40 114.42 2h96 s VAL 159 Ca 0.13 -2.26 0.07 0.00 -1.81 0.00 0.00 61.98 58.10 2h96 s VAL 159 Cb -0.10 -2.22 -0.04 0.00 0.56 0.00 0.00 36.38 34.58 2h96 s VAL 159 CO 0.03 -0.32 -0.14 -0.75 -0.31 0.00 0.00 175.10 173.60 2h96 s LYS 160 N -3.23 1.14 0.62 4.82 2.20 -0.85 -0.39 119.74 124.05 2h96 s LYS 160 Ca 0.26 -1.37 0.25 0.00 -0.36 0.00 0.00 55.97 54.76 2h96 s LYS 160 Cb -0.06 -0.99 1.23 0.00 -1.51 0.00 0.00 37.83 36.50 2h96 s LYS 160 CO 0.13 0.18 1.67 1.03 -0.36 0.00 0.00 175.35 178.00 2h96 h SER 161 N 3.18 0.00 -0.25 1.43 0.87 -1.96 -0.23 113.55 116.59 2h96 h SER 161 Ca -0.39 0.00 -0.03 0.00 -1.23 0.00 0.00 61.79 60.13 2h96 h SER 161 Cb 1.20 0.00 -0.02 0.00 -0.44 0.00 0.00 62.40 63.14 2h96 h SER 161 CO 0.55 0.00 0.04 -0.90 -0.53 0.00 0.00 176.83 175.99 2h96 n ASP 162 N -3.26 2.90 -3.63 6.23 5.68 -1.26 -4.90 116.55 118.31 2h96 n ASP 162 Ca 0.08 -2.40 -0.21 0.00 -0.50 0.00 0.00 54.79 51.76 2h96 n ASP 162 Cb 0.81 -0.58 0.04 0.00 -1.14 0.00 0.00 41.12 40.25 2h96 n ASP 162 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 2h96 s THR 164 N -3.60 1.04 0.16 0.00 -4.23 -1.24 -4.85 115.64 102.92 2h96 s THR 164 Ca 0.06 -1.23 0.07 0.00 -1.18 0.00 0.00 61.69 59.41 2h96 s THR 164 Cb -0.02 -1.00 -0.04 0.00 1.34 0.00 0.00 72.50 72.78 2h96 s THR 164 CO 0.80 -0.21 -0.15 -1.48 -0.54 0.00 0.00 174.62 173.04 2h96 s LEU 165 N -1.63 2.48 -0.05 4.79 2.34 -1.26 -2.00 118.68 123.35 2h96 s LEU 165 Ca -0.03 -0.92 -0.03 0.00 0.06 0.00 0.00 54.13 53.22 2h96 s LEU 165 Cb -0.10 -0.64 0.02 0.00 -0.56 0.00 0.00 46.19 44.91 2h96 s LEU 165 CO 0.02 -0.14 0.11 -0.54 -1.06 0.00 0.00 176.35 174.73 2h96 s LYS 166 N -3.15 0.08 0.94 1.48 1.02 -0.06 -4.60 119.74 115.46 2h96 s LYS 166 Ca 0.16 0.24 -0.11 0.00 0.02 0.00 0.00 55.97 56.28 2h96 s LYS 166 Cb -0.03 -0.09 0.16 0.00 -0.52 0.00 0.00 37.83 37.35 2h96 s LYS 166 CO 0.05 -0.10 1.12 0.42 -0.92 0.00 0.00 175.35 175.92 2h96 s ILE 167 N 0.66 2.22 0.22 2.17 -1.09 -0.67 -2.18 121.20 122.53 2h96 s ILE 167 Ca -0.05 0.07 -0.03 0.00 -2.23 0.00 0.00 60.65 58.42 2h96 s ILE 167 Cb -0.07 -2.17 -0.03 0.00 -1.58 0.00 0.00 42.46 38.61 2h96 s ILE 167 CO -0.03 -0.09 0.20 -0.22 -1.23 0.00 0.00 174.94 173.57 2h96 s LEU 168 N -6.62 1.04 0.22 2.97 0.20 -0.59 -2.21 118.68 113.70 2h96 s LEU 168 Ca 0.66 -1.33 0.00 0.00 0.69 0.00 0.00 54.13 54.15 2h96 s LEU 168 Cb -0.22 0.63 0.00 0.00 -0.43 0.00 0.00 46.19 46.17 2h96 s LEU 168 CO 0.59 -0.91 0.00 -0.67 -0.29 0.00 0.00 176.35 175.07 2h96 n ASP 169 N -0.37 -3.55 0.00 3.68 -0.08 -1.26 -4.94 116.55 110.04 2h96 n ASP 169 Ca 0.02 0.54 0.00 0.00 -1.51 0.00 0.00 54.79 53.83 2h96 n ASP 169 Cb 0.65 -2.97 0.00 0.00 2.34 0.00 0.00 41.12 41.14 2h96 n ASP 169 CO 0.00 0.00 0.00 0.49 0.12 0.00 0.00 177.20 177.81 2h96 n PHE 170 N -1.05 0.00 0.00 -0.67 3.72 -1.26 -4.83 117.46 113.37 2h96 n PHE 170 Ca 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.40 2h96 n PHE 170 Cb 0.01 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 38.56 2h96 n PHE 170 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2h96 n GLY 171 N 0.00 -0.33 0.00 1.37 0.00 -1.26 0.11 105.19 105.07 2h96 n GLY 171 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 2h96 n GLY 171 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 2h96 n LEU 172 N -1.32 0.74 -4.72 0.99 7.94 -1.26 -4.65 117.00 114.72 2h96 n LEU 172 Ca 0.00 -0.74 -0.41 0.00 -1.11 0.00 0.00 56.01 53.75 2h96 n LEU 172 Cb 0.09 0.00 -0.04 0.00 0.53 0.00 0.00 43.42 44.00 2h96 n LEU 172 CO 0.00 0.18 0.75 0.00 -1.11 0.00 0.00 177.39 177.22 2h96 s ALA 173 N -0.14 3.29 0.32 1.96 0.00 0.30 -4.68 121.76 122.81 2h96 s ALA 173 Ca 0.00 0.69 -0.19 0.00 0.00 0.00 0.00 51.96 52.46 2h96 s ALA 173 Cb 0.00 -3.35 0.04 0.00 0.00 0.00 0.00 23.12 19.81 2h96 s ALA 173 CO 0.00 -0.21 0.76 -0.98 0.00 0.00 0.00 175.76 175.33 2h96 s ARG 174 N 0.34 1.96 0.53 0.00 1.70 -0.59 -4.84 118.95 118.04 2h96 s ARG 174 Ca 0.51 -1.17 0.03 0.00 -0.47 0.00 0.00 55.73 54.63 2h96 s ARG 174 Cb -0.26 0.61 0.01 0.00 -0.57 0.00 0.00 34.95 34.74 2h96 s ARG 174 CO 0.31 -0.91 0.16 -0.08 -1.08 0.00 0.00 175.30 173.70 2h96 s THR 175 N -3.22 1.30 0.00 4.99 -1.32 -1.26 -0.47 115.64 115.67 2h96 s THR 175 Ca 0.13 -1.80 0.00 0.00 -1.21 0.00 0.00 61.69 58.81 2h96 s THR 175 Cb -0.05 -2.10 0.00 0.00 -1.51 0.00 0.00 72.50 68.84 2h96 s THR 175 CO 0.09 0.00 0.00 0.00 -2.21 0.00 0.00 174.62 172.50 2h96 n ALA 176 N -1.48 0.00 0.00 11.08 0.00 -1.26 -4.74 120.51 124.11 2h96 n ALA 176 Ca -0.13 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.31 2h96 n ALA 176 Cb 0.66 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.11 2h96 n ALA 176 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2h96 n GLY 177 N 0.00 0.00 0.00 0.00 0.00 -1.26 -4.86 105.19 99.07 2h96 n GLY 177 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 2h96 n GLY 177 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2h96 n THR 178 N 0.00 0.00 -0.50 2.61 -2.24 -1.26 -4.00 114.28 108.89 2h96 n THR 178 Ca 0.00 1.30 -0.23 0.00 -2.27 0.00 0.00 64.05 62.85 2h96 n THR 178 Cb 0.00 -1.89 0.18 0.00 -2.10 0.00 0.00 70.33 66.52 2h96 n THR 178 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 2h96 n SER 179 N -2.03 -3.07 -0.70 3.42 3.41 -1.26 -4.75 113.62 108.64 2h96 n SER 179 Ca 0.00 -0.42 0.06 0.00 -0.26 0.00 0.00 58.87 58.25 2h96 n SER 179 Cb 0.00 -0.85 0.17 0.00 -0.26 0.00 0.00 64.21 63.27 2h96 n SER 179 CO 0.00 0.00 0.00 2.22 -0.16 0.00 0.00 175.04 177.10 2h96 n PHE 180 N -4.68 0.56 -1.27 7.33 -1.74 -1.26 -3.59 117.46 112.81 2h96 n PHE 180 Ca 0.06 -0.56 0.00 0.00 -0.56 0.00 0.00 57.45 56.39 2h96 n PHE 180 Cb 0.45 -0.08 0.00 0.00 1.52 0.00 0.00 39.48 41.37 2h96 n PHE 180 CO 0.00 0.00 0.00 -0.12 -0.56 0.00 0.00 176.76 176.08 2h96 n MET 181 N 0.37 0.00 0.27 3.97 0.00 -1.26 -3.98 117.12 116.48 2h96 n MET 181 Ca 0.13 0.42 0.17 0.00 -0.00 0.00 0.00 57.70 58.43 2h96 n MET 181 Cb 0.51 -0.85 0.69 0.00 0.00 0.00 0.00 33.22 33.58 2h96 n MET 181 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 2h96 h MET 182 N 0.00 0.00 -2.13 2.12 -0.00 -2.01 -3.19 114.93 109.72 2h96 h MET 182 Ca 0.00 0.00 -0.55 0.00 -0.00 0.00 0.00 59.70 59.15 2h96 h MET 182 Cb 0.00 0.00 -0.41 0.00 -0.00 0.00 0.00 31.60 31.19 2h96 h MET 182 CO 0.00 0.00 -0.89 -1.91 -0.00 0.00 0.00 176.91 174.11 2h96 n GLU 183 N -3.02 1.94 0.22 -0.10 0.00 -1.26 -4.84 120.64 113.58 2h96 n GLU 183 Ca 0.01 -4.07 0.11 0.00 0.00 0.00 0.00 57.16 53.21 2h96 n GLU 183 Cb 0.29 -1.89 0.23 0.00 0.00 0.00 0.00 31.44 30.07 2h96 n GLU 183 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.13 176.13 2h96 h PRO 184 N 3.41 0.00 0.00 5.31 0.13 -1.87 -3.13 132.00 135.85 2h96 h PRO 184 Ca 0.12 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.25 2h96 h PRO 184 Cb 0.75 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.88 2h96 h PRO 184 CO 0.66 0.07 0.14 0.93 -0.23 0.00 0.00 178.00 179.57 2h96 h GLU 185 N 0.00 0.00 -0.07 0.86 3.07 -1.89 -2.95 114.58 113.60 2h96 h GLU 185 Ca -0.00 0.00 -0.24 0.00 -0.50 0.00 0.00 59.36 58.62 2h96 h GLU 185 Cb 0.97 0.00 0.02 0.00 -0.84 0.00 0.00 28.75 28.90 2h96 h GLU 185 CO 0.01 0.00 -0.88 -0.24 -1.40 0.00 0.00 179.01 176.50 2h96 h VAL 186 N 0.00 1.29 -4.20 3.13 3.04 -1.97 -3.46 116.25 114.09 2h96 h VAL 186 Ca 0.00 -2.10 -0.51 0.00 -1.01 0.00 0.00 66.70 63.08 2h96 h VAL 186 Cb 0.29 2.23 0.11 0.00 -2.01 0.00 0.00 31.29 31.91 2h96 h VAL 186 CO 0.00 0.65 0.38 0.54 -1.01 0.00 0.00 177.57 178.13 2h96 s VAL 187 N -3.50 3.06 -0.63 1.51 0.11 -1.12 -4.90 120.40 114.93 2h96 s VAL 187 Ca -0.10 0.50 -0.27 0.00 -2.93 0.00 0.00 61.98 59.17 2h96 s VAL 187 Cb 0.07 -3.02 0.01 0.00 -1.53 0.00 0.00 36.38 31.91 2h96 s VAL 187 CO 0.90 -0.30 1.51 -0.89 -3.33 0.00 0.00 175.10 173.00 2h96 s THR 188 N -2.27 3.63 0.00 5.04 2.01 -1.26 -4.91 115.64 117.87 2h96 s THR 188 Ca 0.68 0.44 0.00 0.00 0.31 0.00 0.00 61.69 63.12 2h96 s THR 188 Cb -0.22 -4.43 0.00 0.00 0.01 0.00 0.00 72.50 67.86 2h96 s THR 188 CO 0.42 -1.30 0.00 -1.14 -0.69 0.00 0.00 174.62 171.91 2h96 n ARG 189 N 9.05 0.00 0.01 4.92 0.63 -1.26 -0.47 116.66 129.54 2h96 n ARG 189 Ca 0.12 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 57.05 2h96 n ARG 189 Cb 0.50 0.00 0.02 0.00 0.45 0.00 0.00 32.46 33.43 2h96 n ARG 189 CO 0.00 0.00 0.00 0.66 -2.51 0.00 0.00 177.63 175.78 2h96 n TYR 190 N -1.37 0.03 -0.16 -0.14 4.01 -1.26 -0.95 117.16 117.31 2h96 n TYR 190 Ca 0.00 0.01 0.00 0.00 -0.16 0.00 0.00 57.90 57.75 2h96 n TYR 190 Cb 0.00 -0.36 0.00 0.00 -0.31 0.00 0.00 39.34 38.67 2h96 n TYR 190 CO 0.00 0.00 0.00 0.66 -0.46 0.00 0.00 176.86 177.06 2h96 n TYR 191 N -1.38 0.00 -1.73 -0.72 4.02 0.38 -4.50 117.16 113.23 2h96 n TYR 191 Ca -0.00 -0.00 -0.42 0.00 -0.01 0.00 0.00 57.90 57.46 2h96 n TYR 191 Cb 0.17 -0.00 -0.01 0.00 -0.02 0.00 0.00 39.34 39.48 2h96 n TYR 191 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 176.86 176.39 2h96 n ARG 192 N -0.00 2.46 -3.31 -0.72 1.74 -0.13 -4.34 116.66 112.36 2h96 n ARG 192 Ca 0.00 0.87 -0.35 0.00 -0.77 0.00 0.00 57.85 57.60 2h96 n ARG 192 Cb 0.04 -2.57 -0.06 0.00 -1.02 0.00 0.00 32.46 28.85 2h96 n ARG 192 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2h96 s ALA 193 N -0.62 3.54 0.30 7.54 0.00 -1.26 -4.87 121.76 126.40 2h96 s ALA 193 Ca 0.59 -0.07 0.06 0.00 0.00 0.00 0.00 51.96 52.54 2h96 s ALA 193 Cb -0.53 -2.58 0.83 0.00 0.00 0.00 0.00 23.12 20.84 2h96 s ALA 193 CO 0.57 0.43 1.43 -2.30 0.00 0.00 0.00 175.76 175.89 2h96 n PRO 194 N 0.77 -0.07 0.29 0.00 -0.02 -1.26 0.13 135.00 134.84 2h96 n PRO 194 Ca -0.05 1.34 0.17 0.00 -2.02 0.00 0.00 63.50 62.94 2h96 n PRO 194 Cb 0.52 -2.19 0.89 0.00 -0.02 0.00 0.00 33.50 32.70 2h96 n PRO 194 CO 0.00 0.00 0.00 1.05 1.98 0.00 0.00 175.50 178.53 2h96 h GLU 195 N 0.00 0.00 0.00 -0.52 9.09 -1.93 -1.13 114.58 120.09 2h96 h GLU 195 Ca 0.61 0.00 -0.02 0.00 0.05 0.00 0.00 59.36 60.00 2h96 h GLU 195 Cb 1.38 0.00 -0.00 0.00 -1.65 0.00 0.00 28.75 28.47 2h96 h GLU 195 CO -0.82 0.05 -0.19 0.28 0.05 0.00 0.00 179.01 178.39 2h96 h VAL 196 N 0.00 0.57 -0.61 -1.06 2.07 0.67 0.79 116.25 118.67 2h96 h VAL 196 Ca -0.00 -1.47 0.13 0.00 0.82 0.00 0.00 66.70 66.18 2h96 h VAL 196 Cb 0.22 1.11 -0.11 0.00 -1.52 0.00 0.00 31.29 30.99 2h96 h VAL 196 CO 0.01 0.19 -0.09 0.40 0.02 0.00 0.00 177.57 178.09 2h96 h ILE 197 N -1.00 0.42 -0.65 4.57 2.04 -1.14 -1.69 117.51 120.06 2h96 h ILE 197 Ca -0.03 -0.01 -0.41 0.00 1.00 0.00 0.00 64.86 65.40 2h96 h ILE 197 Cb 0.46 0.38 -0.19 0.00 -0.74 0.00 0.00 36.82 36.73 2h96 h ILE 197 CO -0.02 0.01 0.53 0.18 0.00 0.00 0.00 178.15 178.85 2h96 n LEU 198 N -5.37 6.50 -1.81 1.44 4.77 -0.45 -4.96 117.00 117.11 2h96 n LEU 198 Ca 0.08 -3.43 -0.02 0.00 -0.03 0.00 0.00 56.01 52.62 2h96 n LEU 198 Cb 0.34 -0.95 0.00 0.00 -2.33 0.00 0.00 43.42 40.48 2h96 n LEU 198 CO 0.07 1.19 -0.23 0.61 -1.33 0.00 0.00 177.39 177.70 2h96 n GLY 199 N -0.20 0.01 0.00 -0.72 0.00 -0.64 -4.74 105.19 98.89 2h96 n GLY 199 Ca 0.40 0.05 0.00 0.00 0.00 0.00 0.00 46.02 46.47 2h96 n GLY 199 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 2h96 n MET 200 N 0.79 3.47 -0.40 1.61 2.81 0.27 -4.61 117.12 121.06 2h96 n MET 200 Ca -0.00 0.00 0.00 0.00 -1.81 0.00 0.00 57.70 55.89 2h96 n MET 200 Cb 0.24 -0.47 0.00 0.00 -0.71 0.00 0.00 33.22 32.28 2h96 n MET 200 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2h96 n GLY 201 N 0.58 -1.33 3.76 3.03 0.00 -1.24 -4.89 105.19 105.11 2h96 n GLY 201 Ca 0.00 -0.88 -0.23 0.00 0.00 0.00 0.00 46.02 44.91 2h96 n GLY 201 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 2h96 s TYR 202 N 0.00 2.98 0.00 1.61 -0.85 -1.26 -4.98 117.35 114.85 2h96 s TYR 202 Ca 0.00 -0.14 0.00 0.00 -0.52 0.00 0.00 57.07 56.41 2h96 s TYR 202 Cb 0.00 -1.35 0.00 0.00 0.38 0.00 0.00 41.96 40.99 2h96 s TYR 202 CO 0.00 0.55 0.00 1.63 -1.52 0.00 0.00 175.55 176.21 2h96 n LYS 203 N -0.95 2.53 0.01 -3.49 5.02 -1.26 -4.48 118.16 115.54 2h96 n LYS 203 Ca -0.08 0.00 -0.15 0.00 -2.02 0.00 0.00 58.31 56.06 2h96 n LYS 203 Cb 0.58 0.00 -0.04 0.00 -0.02 0.00 0.00 35.03 35.55 2h96 n LYS 203 CO 0.00 0.00 0.00 0.93 -0.52 0.00 0.00 177.40 177.81 2h96 h GLU 204 N 0.00 0.66 0.00 1.97 4.39 -1.96 -3.16 114.58 116.47 2h96 h GLU 204 Ca 0.00 -0.55 0.00 0.00 0.34 0.00 0.00 59.36 59.15 2h96 h GLU 204 Cb 0.00 0.12 0.00 0.00 -0.10 0.00 0.00 28.75 28.77 2h96 h GLU 204 CO 0.00 1.17 0.00 0.27 -1.16 0.00 0.00 179.01 179.29 2h96 n ASN 205 N -3.89 0.00 0.09 1.42 6.94 -1.26 -2.26 115.26 116.29 2h96 n ASN 205 Ca -0.07 0.02 0.09 0.00 -0.02 0.00 0.00 54.58 54.61 2h96 n ASN 205 Cb 0.75 -0.03 0.41 0.00 -2.36 0.00 0.00 39.78 38.55 2h96 n ASN 205 CO 0.00 0.00 0.00 0.55 -1.03 0.00 0.00 177.26 176.78 2h96 n VAL 206 N -1.03 1.02 0.07 3.53 3.14 -1.20 -2.16 118.33 121.71 2h96 n VAL 206 Ca 0.00 0.34 -0.20 0.00 -2.96 0.00 0.00 64.34 61.53 2h96 n VAL 206 Cb 0.00 -1.24 -0.15 0.00 -1.06 0.00 0.00 33.84 31.39 2h96 n VAL 206 CO 0.00 0.00 0.00 0.44 -6.46 0.00 0.00 176.83 170.81 2h96 h ASP 207 N 0.00 0.50 0.00 6.55 3.32 -1.74 -3.30 116.42 121.75 2h96 h ASP 207 Ca 0.00 -0.71 0.00 0.00 0.02 0.00 0.00 57.03 56.34 2h96 h ASP 207 Cb 0.24 -0.16 0.00 0.00 0.22 0.00 0.00 39.33 39.63 2h96 h ASP 207 CO 0.00 1.59 0.03 -0.07 -1.72 0.00 0.00 179.24 179.07 2h96 h LEU 208 N 0.09 0.00 0.26 1.55 -0.00 -1.67 -0.48 115.31 115.06 2h96 h LEU 208 Ca -0.29 0.00 -0.01 0.00 -0.00 0.00 0.00 57.88 57.58 2h96 h LEU 208 Cb 2.06 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 42.72 2h96 h LEU 208 CO 0.17 0.00 -0.13 -0.25 -0.00 0.00 0.00 178.44 178.24 2h96 h TRP 209 N 0.00 -0.33 -0.95 1.13 2.91 -1.65 -1.76 115.95 115.31 2h96 h TRP 209 Ca 0.00 -0.01 0.18 0.00 1.13 0.00 0.00 58.89 60.19 2h96 h TRP 209 Cb 0.06 0.11 -0.08 0.00 -0.51 0.00 0.00 29.16 28.73 2h96 h TRP 209 CO 0.00 0.01 0.60 0.77 -1.03 0.00 0.00 178.44 178.80 2h96 h SER 210 N -0.95 0.64 -0.53 2.65 0.02 -1.31 0.37 113.55 114.44 2h96 h SER 210 Ca -0.04 0.06 -0.02 0.00 -0.84 0.00 0.00 61.79 60.96 2h96 h SER 210 Cb 0.48 -0.06 -0.03 0.00 0.14 0.00 0.00 62.40 62.94 2h96 h SER 210 CO 0.06 0.27 0.27 0.58 -1.14 0.00 0.00 176.83 176.87 2h96 h VAL 211 N 0.65 1.18 -0.05 2.27 2.07 -1.07 -0.47 116.25 120.84 2h96 h VAL 211 Ca 0.51 -0.51 -0.04 0.00 0.82 0.00 0.00 66.70 67.48 2h96 h VAL 211 Cb 0.93 0.47 0.00 0.00 -1.52 0.00 0.00 31.29 31.17 2h96 h VAL 211 CO -0.27 0.21 -0.15 1.23 0.02 0.00 0.00 177.57 178.62 2h96 h GLY 212 N 0.88 0.20 0.55 2.17 0.00 0.57 -1.55 103.07 105.88 2h96 h GLY 212 Ca 0.20 -0.26 0.21 0.00 0.00 0.00 0.00 47.33 47.47 2h96 h GLY 212 CO -0.03 0.23 0.52 0.00 0.00 0.00 0.00 176.54 177.27 2h96 h ILE 214 N 0.03 1.16 -0.13 0.00 2.04 -0.98 -2.78 117.51 116.85 2h96 h ILE 214 Ca 0.35 -1.99 0.04 0.00 1.00 0.00 0.00 64.86 64.26 2h96 h ILE 214 Cb 1.35 2.31 -0.01 0.00 -0.74 0.00 0.00 36.82 39.74 2h96 h ILE 214 CO -0.02 0.39 0.11 -0.03 0.00 0.00 0.00 178.15 178.61 2h96 h MET 215 N -1.00 0.00 -0.01 2.37 4.05 -0.91 0.43 114.93 119.86 2h96 h MET 215 Ca -0.08 0.00 -0.18 0.00 -0.28 0.00 0.00 59.70 59.16 2h96 h MET 215 Cb 0.87 0.00 -0.01 0.00 -0.80 0.00 0.00 31.60 31.65 2h96 h MET 215 CO -0.05 0.00 -0.80 0.78 0.23 0.00 0.00 176.91 177.08 2h96 h GLY 216 N 0.00 0.20 1.83 1.39 0.00 -0.83 -3.07 103.07 102.58 2h96 h GLY 216 Ca 0.06 -0.32 -0.13 0.00 0.00 0.00 0.00 47.33 46.95 2h96 h GLY 216 CO -0.00 0.28 -0.53 -2.09 0.00 0.00 0.00 176.54 174.20 2h96 h GLU 217 N 0.11 0.19 0.00 4.80 4.81 0.07 -0.61 114.58 123.94 2h96 h GLU 217 Ca -0.03 -0.11 0.00 0.00 -0.13 0.00 0.00 59.36 59.09 2h96 h GLU 217 Cb 1.39 0.01 0.00 0.00 0.63 0.00 0.00 28.75 30.78 2h96 h GLU 217 CO 0.12 0.67 0.00 0.52 -0.73 0.00 0.00 179.01 179.59 2h96 h MET 218 N 0.14 0.00 0.00 1.92 2.86 -1.01 0.30 114.93 119.15 2h96 h MET 218 Ca 0.00 0.00 -0.25 0.00 -2.06 0.00 0.00 59.70 57.39 2h96 h MET 218 Cb 0.99 0.00 -0.04 0.00 0.06 0.00 0.00 31.60 32.61 2h96 h MET 218 CO 0.08 0.00 -1.58 0.28 1.06 0.00 0.00 176.91 176.75 2h96 n VAL 219 N -3.06 1.51 -0.17 -2.22 0.31 -1.14 -4.49 118.33 109.06 2h96 n VAL 219 Ca 0.02 -0.10 -0.11 0.00 -0.01 0.00 0.00 64.34 64.14 2h96 n VAL 219 Cb 0.39 -2.08 0.00 0.00 -0.91 0.00 0.00 33.84 31.25 2h96 n VAL 219 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2h96 n HIS 221 N -4.18 0.00 -4.01 0.00 -0.00 0.11 -5.02 115.22 102.12 2h96 n HIS 221 Ca 0.01 0.00 -0.08 0.00 -0.00 0.00 0.00 57.72 57.65 2h96 n HIS 221 Cb 0.41 -0.01 -0.09 0.00 -0.00 0.00 0.00 29.99 30.29 2h96 n HIS 221 CO 0.00 0.00 0.00 0.15 -0.00 0.00 0.00 176.34 176.49 2h96 s LYS 222 N -0.21 0.63 0.20 -0.41 1.02 -1.25 -4.98 119.74 114.74 2h96 s LYS 222 Ca 0.00 -1.05 -0.33 0.00 0.02 0.00 0.00 55.97 54.61 2h96 s LYS 222 Cb 0.00 0.23 -0.13 0.00 -0.52 0.00 0.00 37.83 37.41 2h96 s LYS 222 CO 0.00 -0.14 1.65 -0.89 -0.92 0.00 0.00 175.35 175.05 2h96 n ILE 223 N 0.29 0.08 0.46 2.17 5.41 -1.26 -4.48 119.36 122.04 2h96 n ILE 223 Ca -0.16 -0.02 -0.19 0.00 1.00 0.00 0.00 62.75 63.38 2h96 n ILE 223 Cb 0.60 -1.80 -0.09 0.00 -0.71 0.00 0.00 39.64 37.64 2h96 n ILE 223 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 176.55 176.80 2h96 h LEU 224 N 6.27 -1.11 -7.58 1.39 5.85 -1.89 -3.38 115.31 114.86 2h96 h LEU 224 Ca -0.44 0.05 -0.68 0.00 0.84 0.00 0.00 57.88 57.65 2h96 h LEU 224 Cb 1.22 0.30 -0.37 0.00 0.37 0.00 0.00 40.66 42.18 2h96 h LEU 224 CO 0.92 -0.75 -0.51 -0.36 -0.34 0.00 0.00 178.44 177.41 2h96 s PHE 225 N -5.74 3.42 0.00 1.25 0.08 -1.26 -5.06 117.98 110.67 2h96 s PHE 225 Ca -0.18 -2.81 0.00 0.00 0.12 0.00 0.00 56.93 54.06 2h96 s PHE 225 Cb 0.02 -3.08 0.00 0.00 -0.57 0.00 0.00 43.02 39.39 2h96 s PHE 225 CO 0.55 -0.85 0.00 -2.30 -0.10 0.00 0.00 175.22 172.52 2h96 n PRO 226 N 3.68 2.99 0.00 0.24 -0.02 -1.26 -4.62 135.00 136.00 2h96 n PRO 226 Ca 0.05 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.53 2h96 n PRO 226 Cb 0.37 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 33.85 2h96 n PRO 226 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2h96 n GLY 227 N 0.00 2.55 0.00 -1.23 0.00 -1.26 -4.68 105.19 100.57 2h96 n GLY 227 Ca 0.00 -0.22 0.08 0.00 0.00 0.00 0.00 46.02 45.88 2h96 n GLY 227 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2h96 n ARG 228 N 0.00 0.01 -3.72 1.61 1.74 -1.26 -4.79 116.66 110.26 2h96 n ARG 228 Ca 0.00 0.21 -0.04 0.00 -0.77 0.00 0.00 57.85 57.25 2h96 n ARG 228 Cb 0.00 -1.50 -0.01 0.00 -1.02 0.00 0.00 32.46 29.93 2h96 n ARG 228 CO 0.00 0.00 0.00 0.16 -1.52 0.00 0.00 177.63 176.27 2h96 s ASP 229 N -2.97 -0.21 0.33 0.55 1.47 -1.26 -4.98 116.67 109.60 2h96 s ASP 229 Ca 0.08 -0.35 0.12 0.00 1.18 0.00 0.00 52.55 53.59 2h96 s ASP 229 Cb 0.11 0.48 0.99 0.00 -0.34 0.00 0.00 42.92 44.17 2h96 s ASP 229 CO 0.30 -0.88 1.70 0.22 0.68 0.00 0.00 175.17 177.18 2h96 h TYR 230 N 2.00 0.96 0.01 2.11 3.20 -2.00 -0.96 116.97 122.29 2h96 h TYR 230 Ca -0.24 0.04 -0.27 0.00 3.14 0.00 0.00 58.73 61.40 2h96 h TYR 230 Cb 1.23 -0.27 -0.04 0.00 1.54 0.00 0.00 36.73 39.20 2h96 h TYR 230 CO 0.37 -0.05 -1.44 0.82 -1.64 0.00 0.00 178.16 176.21 2h96 h ILE 231 N 0.45 1.18 0.00 1.81 2.04 -1.98 -3.31 117.51 117.71 2h96 h ILE 231 Ca 0.69 -2.96 -0.04 0.00 1.00 0.00 0.00 64.86 63.55 2h96 h ILE 231 Cb 1.46 2.61 -0.01 0.00 -0.74 0.00 0.00 36.82 40.14 2h96 h ILE 231 CO -0.53 0.70 -0.18 -0.78 0.00 0.00 0.00 178.15 177.36 2h96 h ASP 232 N 0.01 0.00 -0.27 1.72 3.58 -1.59 -2.93 116.42 116.95 2h96 h ASP 232 Ca -0.19 0.00 0.04 0.00 0.42 0.00 0.00 57.03 57.31 2h96 h ASP 232 Cb 1.93 0.00 -0.07 0.00 1.72 0.00 0.00 39.33 42.90 2h96 h ASP 232 CO 0.11 0.18 -0.52 -0.61 -2.88 0.00 0.00 179.24 175.52 2h96 h GLN 233 N 0.00 -0.46 -0.66 0.28 5.75 -1.43 -1.42 115.11 117.17 2h96 h GLN 233 Ca -0.00 0.03 0.13 0.00 -0.15 0.00 0.00 58.65 58.66 2h96 h GLN 233 Cb 0.50 0.10 -0.13 0.00 1.07 0.00 0.00 27.48 29.03 2h96 h GLN 233 CO 0.02 -0.30 -0.20 2.35 -2.65 0.00 0.00 178.83 178.05 2h96 h TRP 234 N -0.47 -0.46 -0.15 3.99 2.91 -1.72 0.16 115.95 120.21 2h96 h TRP 234 Ca 0.07 0.06 0.04 0.00 1.13 0.00 0.00 58.89 60.19 2h96 h TRP 234 Cb 0.64 0.30 -0.01 0.00 -0.51 0.00 0.00 29.16 29.58 2h96 h TRP 234 CO -0.63 -0.31 0.12 -0.91 -1.03 0.00 0.00 178.44 175.69 2h96 h ASN 235 N -0.03 0.00 0.61 2.65 -0.26 -1.39 -0.15 115.58 117.01 2h96 h ASN 235 Ca 0.31 0.00 -0.22 0.00 -0.56 0.00 0.00 56.30 55.83 2h96 h ASN 235 Cb 0.51 0.00 -0.01 0.00 -1.06 0.00 0.00 38.32 37.76 2h96 h ASN 235 CO -0.69 0.00 -0.99 0.11 -1.06 0.00 0.00 177.43 174.80 2h96 h LYS 236 N 0.00 0.22 0.37 0.81 1.79 -0.08 -2.32 116.57 117.37 2h96 h LYS 236 Ca 0.07 -0.28 -0.02 0.00 -2.18 0.00 0.00 60.65 58.24 2h96 h LYS 236 Cb 0.32 0.09 0.00 0.00 -1.58 0.00 0.00 32.23 31.06 2h96 h LYS 236 CO -0.00 1.04 -0.18 0.28 -1.08 0.00 0.00 179.45 179.51 2h96 h VAL 237 N 0.10 0.60 -0.79 0.50 2.07 -0.45 -3.07 116.25 115.21 2h96 h VAL 237 Ca -0.07 -0.47 -0.03 0.00 0.82 0.00 0.00 66.70 66.96 2h96 h VAL 237 Cb 1.65 0.82 -0.04 0.00 -1.52 0.00 0.00 31.29 32.21 2h96 h VAL 237 CO 0.15 0.08 0.39 0.16 0.02 0.00 0.00 177.57 178.38 2h96 h ILE 238 N -0.78 1.25 -0.28 4.57 3.07 -1.43 -0.80 117.51 123.11 2h96 h ILE 238 Ca -0.05 -0.68 0.08 0.00 1.55 0.00 0.00 64.86 65.76 2h96 h ILE 238 Cb 0.52 0.24 -0.01 0.00 -0.27 0.00 0.00 36.82 37.30 2h96 h ILE 238 CO 0.08 0.29 0.22 -0.08 -1.05 0.00 0.00 178.15 177.62 2h96 h GLU 239 N 1.12 0.00 0.00 0.16 4.81 -1.46 1.75 114.58 120.96 2h96 h GLU 239 Ca 0.27 0.00 -0.03 0.00 -0.13 0.00 0.00 59.36 59.47 2h96 h GLU 239 Cb 0.10 0.00 -0.00 0.00 0.63 0.00 0.00 28.75 29.48 2h96 h GLU 239 CO -0.04 0.00 -0.34 1.96 -0.73 0.00 0.00 179.01 179.87 2h96 h GLN 240 N 0.00 0.00 -0.01 1.92 1.08 -1.25 -3.40 115.11 113.45 2h96 h GLN 240 Ca 0.13 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.33 2h96 h GLN 240 Cb 0.58 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.01 2h96 h GLN 240 CO -0.00 0.26 -0.20 1.28 -0.95 0.00 0.00 178.83 179.21 2h96 n LEU 241 N -4.66 1.65 0.00 1.46 4.77 -0.38 -0.94 117.00 118.90 2h96 n LEU 241 Ca -0.08 -0.54 0.00 0.00 -0.03 0.00 0.00 56.01 55.36 2h96 n LEU 241 Cb 0.24 -0.05 0.00 0.00 -2.33 0.00 0.00 43.42 41.29 2h96 n LEU 241 CO 0.11 0.29 0.00 0.61 -1.33 0.00 0.00 177.39 177.07 2h96 n GLY 242 N 1.32 -2.63 3.66 -0.72 0.00 0.60 -4.58 105.19 102.82 2h96 n GLY 242 Ca 0.14 -1.38 -0.44 0.00 0.00 0.00 0.00 46.02 44.34 2h96 n GLY 242 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 2h96 n THR 243 N -1.68 1.58 -1.18 2.61 -1.04 0.18 -4.67 114.28 110.08 2h96 n THR 243 Ca 0.00 -0.40 -0.30 0.00 -2.04 0.00 0.00 64.05 61.31 2h96 n THR 243 Cb 0.00 -1.36 0.13 0.00 -1.82 0.00 0.00 70.33 67.28 2h96 n THR 243 CO 0.00 0.00 0.00 -2.16 -0.64 0.00 0.00 175.07 172.27 2h96 s PRO 244 N -1.23 1.54 0.81 -2.82 0.04 -1.26 -4.95 135.00 127.13 2h96 s PRO 244 Ca 0.61 0.98 -0.12 0.00 0.04 0.00 0.00 61.00 62.52 2h96 s PRO 244 Cb -0.64 -1.83 0.08 0.00 0.04 0.00 0.00 34.50 32.15 2h96 s PRO 244 CO 0.57 -2.09 1.18 0.00 0.04 0.00 0.00 177.00 176.69 2h96 h PRO 246 N -1.05 0.00 -0.12 0.00 0.11 -1.99 -2.41 132.00 126.53 2h96 h PRO 246 Ca -0.46 0.00 0.04 0.00 0.11 0.00 0.00 66.00 65.69 2h96 h PRO 246 Cb 1.33 0.00 -0.04 0.00 0.11 0.00 0.00 31.00 32.40 2h96 h PRO 246 CO 0.66 0.08 -0.10 1.49 -0.21 0.00 0.00 178.00 179.92 2h96 h GLU 247 N 0.00 -0.11 0.86 1.05 4.81 -2.00 -2.32 114.58 116.87 2h96 h GLU 247 Ca -0.00 0.01 -0.04 0.00 -0.13 0.00 0.00 59.36 59.20 2h96 h GLU 247 Cb 0.15 0.03 0.00 0.00 0.63 0.00 0.00 28.75 29.56 2h96 h GLU 247 CO 0.01 -0.07 -0.47 0.35 -0.73 0.00 0.00 179.01 178.10 2h96 h PHE 248 N -0.12 -1.24 -0.99 0.92 3.57 -1.81 -3.02 116.94 114.26 2h96 h PHE 248 Ca 0.08 -0.02 0.33 0.00 3.53 0.00 0.00 57.97 61.89 2h96 h PHE 248 Cb 0.23 0.43 -0.18 0.00 2.79 0.00 0.00 35.95 39.22 2h96 h PHE 248 CO -0.22 -0.73 0.22 0.52 -2.23 0.00 0.00 178.31 175.87 2h96 h MET 249 N -1.23 0.01 0.00 1.11 2.86 -1.39 0.70 114.93 116.99 2h96 h MET 249 Ca -0.12 -0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.52 2h96 h MET 249 Cb 0.96 -0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.62 2h96 h MET 249 CO 0.16 0.01 0.04 1.17 1.06 0.00 0.00 176.91 179.34 2h96 n LYS 250 N -5.40 0.00 -0.00 1.72 3.00 -0.88 -1.53 118.16 115.07 2h96 n LYS 250 Ca 0.29 0.34 0.10 0.00 -0.00 0.00 0.00 58.31 59.04 2h96 n LYS 250 Cb 0.95 -1.54 -0.11 0.00 0.00 0.00 0.00 35.03 34.34 2h96 n LYS 250 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.40 179.03 2h96 n LYS 251 N -1.33 0.14 -2.68 1.64 5.02 0.24 -4.99 118.16 116.21 2h96 n LYS 251 Ca 0.00 -0.04 -0.34 0.00 -2.02 0.00 0.00 58.31 55.91 2h96 n LYS 251 Cb 0.04 -1.51 -0.05 0.00 -0.02 0.00 0.00 35.03 33.49 2h96 n LYS 251 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 2h96 s LEU 252 N -3.34 3.91 0.87 -0.35 1.43 -0.58 -5.01 118.68 115.61 2h96 s LEU 252 Ca 0.05 1.82 -0.14 0.00 -1.03 0.00 0.00 54.13 54.82 2h96 s LEU 252 Cb 0.16 -4.53 0.01 0.00 0.03 0.00 0.00 46.19 41.86 2h96 s LEU 252 CO 0.87 -0.55 0.45 0.00 0.23 0.00 0.00 176.35 177.34 2h96 n GLN 253 N -0.75 -0.06 -0.30 1.70 6.02 -1.26 -4.47 117.38 118.26 2h96 n GLN 253 Ca 0.08 0.03 0.03 0.00 -0.01 0.00 0.00 57.00 57.13 2h96 n GLN 253 Cb 0.53 -1.85 0.17 0.00 1.02 0.00 0.00 30.24 30.11 2h96 n GLN 253 CO 0.00 0.00 0.00 -1.35 -1.01 0.00 0.00 177.06 174.70 2h96 h PRO 254 N -1.12 0.80 -0.13 -1.09 0.11 -1.98 0.02 132.00 128.61 2h96 h PRO 254 Ca -0.44 -0.05 -0.01 0.00 0.11 0.00 0.00 66.00 65.61 2h96 h PRO 254 Cb 1.31 -0.18 -0.01 0.00 0.11 0.00 0.00 31.00 32.23 2h96 h PRO 254 CO 0.37 0.53 0.06 1.15 -0.21 0.00 0.00 178.00 179.90 2h96 h THR 255 N 0.82 1.14 -0.18 -1.15 2.02 -2.02 -3.05 112.91 110.50 2h96 h THR 255 Ca 0.40 -0.41 -0.06 0.00 0.77 0.00 0.00 66.41 67.11 2h96 h THR 255 Cb 0.36 1.17 -0.00 0.00 -1.74 0.00 0.00 68.15 67.93 2h96 h THR 255 CO -0.24 0.13 -0.12 0.58 0.37 0.00 0.00 175.52 176.24 2h96 h VAL 256 N 0.07 1.32 -0.77 3.16 2.07 -1.80 -3.26 116.25 117.04 2h96 h VAL 256 Ca 0.04 -1.22 0.18 0.00 0.82 0.00 0.00 66.70 66.52 2h96 h VAL 256 Cb 0.15 1.74 -0.13 0.00 -1.52 0.00 0.00 31.29 31.54 2h96 h VAL 256 CO -0.00 0.36 0.10 -0.09 0.02 0.00 0.00 177.57 177.96 2h96 h ARG 257 N 0.06 0.17 0.29 1.57 2.43 -1.03 0.43 114.38 118.29 2h96 h ARG 257 Ca 0.04 -0.01 -0.01 0.00 -0.81 0.00 0.00 59.98 59.18 2h96 h ARG 257 Cb 0.62 -0.04 0.00 0.00 -0.42 0.00 0.00 29.97 30.14 2h96 h ARG 257 CO 0.03 0.11 -0.15 1.15 -1.51 0.00 0.00 179.97 179.60 2h96 h THR 258 N 0.17 0.70 -0.01 0.20 2.02 -1.58 -1.18 112.91 113.23 2h96 h THR 258 Ca 0.44 0.00 -0.00 0.00 0.77 0.00 0.00 66.41 67.61 2h96 h THR 258 Cb 0.78 0.70 -0.00 0.00 -1.74 0.00 0.00 68.15 67.89 2h96 h THR 258 CO -0.61 0.00 0.01 0.22 0.37 0.00 0.00 175.52 175.51 2h96 h TYR 259 N -0.40 0.02 -0.44 3.16 3.20 -1.47 -1.89 116.97 119.15 2h96 h TYR 259 Ca -0.04 -0.00 0.13 0.00 3.14 0.00 0.00 58.73 61.96 2h96 h TYR 259 Cb 0.32 -0.01 -0.02 0.00 1.54 0.00 0.00 36.73 38.56 2h96 h TYR 259 CO -0.07 0.07 0.42 0.28 -1.64 0.00 0.00 178.16 177.22 2h96 h VAL 260 N -0.04 0.46 0.00 1.81 2.07 -0.79 0.77 116.25 120.53 2h96 h VAL 260 Ca 0.01 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.53 2h96 h VAL 260 Cb 0.06 0.68 0.00 0.00 -1.52 0.00 0.00 31.29 30.51 2h96 h VAL 260 CO -0.00 0.00 -0.80 -0.33 0.02 0.00 0.00 177.57 176.46 2h96 h GLU 261 N 0.00 0.00 -0.69 1.57 5.08 -0.47 -3.32 114.58 116.75 2h96 h GLU 261 Ca 0.21 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.57 2h96 h GLU 261 Cb 1.04 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.29 2h96 h GLU 261 CO -0.00 0.00 0.00 0.09 -1.00 0.00 0.00 179.01 178.10 2h96 n ASN 262 N -2.40 3.50 -4.95 1.42 3.02 0.26 -4.90 115.26 111.21 2h96 n ASN 262 Ca 0.02 -2.44 -0.23 0.00 -0.03 0.00 0.00 54.58 51.90 2h96 n ASN 262 Cb 0.49 -0.55 0.02 0.00 -0.61 0.00 0.00 39.78 39.13 2h96 n ASN 262 CO 0.00 0.00 0.00 -0.13 -2.62 0.00 0.00 177.26 174.51 2h96 s ARG 263 N -1.91 2.93 0.61 3.52 1.81 -1.21 -5.04 118.95 119.66 2h96 s ARG 263 Ca 0.31 -0.51 -0.16 0.00 -1.72 0.00 0.00 55.73 53.65 2h96 s ARG 263 Cb 0.23 -2.51 -0.02 0.00 -0.45 0.00 0.00 34.95 32.19 2h96 s ARG 263 CO 0.11 -0.41 1.10 -2.14 -0.68 0.00 0.00 175.30 173.28 2h96 s PRO 264 N -4.64 3.06 -0.14 3.54 0.02 -1.26 -4.98 135.00 130.60 2h96 s PRO 264 Ca 0.51 1.41 -0.19 0.00 0.02 0.00 0.00 61.00 62.75 2h96 s PRO 264 Cb -0.10 -1.98 -0.04 0.00 0.02 0.00 0.00 34.50 32.40 2h96 s PRO 264 CO 0.39 -1.05 0.52 0.15 -0.33 0.00 0.00 177.00 176.68 2h96 s LYS 265 N -3.87 4.31 -0.04 5.54 -0.14 -1.26 -4.94 119.74 119.34 2h96 s LYS 265 Ca 0.68 0.51 0.06 0.00 -1.36 0.00 0.00 55.97 55.85 2h96 s LYS 265 Cb -0.20 -3.48 -0.02 0.00 -1.68 0.00 0.00 37.83 32.45 2h96 s LYS 265 CO 0.36 0.05 -0.22 0.71 -0.76 0.00 0.00 175.35 175.49 2h96 s TYR 266 N 0.96 2.48 -0.27 3.18 2.02 -1.26 -4.96 117.35 119.49 2h96 s TYR 266 Ca 0.27 -0.43 0.21 0.00 -0.37 0.00 0.00 57.07 56.75 2h96 s TYR 266 Cb -0.16 -1.57 0.09 0.00 -0.40 0.00 0.00 41.96 39.92 2h96 s TYR 266 CO 0.11 -0.02 1.22 0.00 -1.57 0.00 0.00 175.55 175.30 2h96 h ALA 267 N 5.62 0.69 0.00 3.71 0.00 -1.91 0.52 119.26 127.88 2h96 h ALA 267 Ca -0.41 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.32 2h96 h ALA 267 Cb 1.14 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.97 2h96 h ALA 267 CO 0.48 0.21 0.00 0.41 0.00 0.00 0.00 179.25 180.35 2h96 n GLY 268 N 1.19 -2.00 3.29 0.00 0.00 -1.26 -4.03 105.19 102.38 2h96 n GLY 268 Ca -0.00 -1.56 -0.17 0.00 0.00 0.00 0.00 46.02 44.29 2h96 n GLY 268 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2h96 s TYR 269 N 0.00 1.49 0.56 1.61 1.51 -0.11 -4.86 117.35 117.55 2h96 s TYR 269 Ca 0.00 -0.62 -0.19 0.00 -1.01 0.00 0.00 57.07 55.24 2h96 s TYR 269 Cb 0.00 -0.73 -0.05 0.00 -0.11 0.00 0.00 41.96 41.07 2h96 s TYR 269 CO 0.00 0.21 1.16 -1.54 -1.11 0.00 0.00 175.55 174.27 2h96 s SER 270 N -3.03 5.51 0.54 2.29 1.04 -1.26 -4.74 113.70 114.06 2h96 s SER 270 Ca 0.17 2.24 0.36 0.00 0.48 0.00 0.00 55.95 59.20 2h96 s SER 270 Cb -0.01 -2.59 1.75 0.00 0.10 0.00 0.00 66.02 65.27 2h96 s SER 270 CO 0.04 -1.36 2.08 -0.26 0.98 0.00 0.00 173.24 174.72 2h96 h PHE 271 N 1.05 0.00 0.00 5.02 -1.00 -1.96 0.37 116.94 120.41 2h96 h PHE 271 Ca -0.50 0.00 -0.11 0.00 2.81 0.00 0.00 57.97 60.17 2h96 h PHE 271 Cb 1.27 0.00 -0.02 0.00 3.61 0.00 0.00 35.95 40.82 2h96 h PHE 271 CO 0.50 0.00 -0.54 0.93 -1.61 0.00 0.00 178.31 177.59 2h96 h GLU 272 N 0.00 0.00 0.03 1.51 4.39 -1.91 0.56 114.58 119.16 2h96 h GLU 272 Ca 0.00 0.00 -0.12 0.00 0.34 0.00 0.00 59.36 59.58 2h96 h GLU 272 Cb 0.23 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 28.87 2h96 h GLU 272 CO 0.00 0.54 -0.64 0.87 -1.16 0.00 0.00 179.01 178.62 2h96 h LYS 273 N 0.00 0.06 -0.96 2.33 1.57 -0.83 -2.58 116.57 116.15 2h96 h LYS 273 Ca -0.01 -0.10 0.07 0.00 -1.87 0.00 0.00 60.65 58.74 2h96 h LYS 273 Cb 1.15 0.04 -0.07 0.00 0.08 0.00 0.00 32.23 33.43 2h96 h LYS 273 CO 0.07 1.05 0.61 -0.07 -0.57 0.00 0.00 179.45 180.54 2h96 h LEU 274 N -0.86 0.98 -6.90 2.94 3.38 -0.50 -3.31 115.31 111.04 2h96 h LEU 274 Ca -0.16 0.01 -0.61 0.00 0.09 0.00 0.00 57.88 57.21 2h96 h LEU 274 Cb 1.25 -0.19 -0.41 0.00 0.09 0.00 0.00 40.66 41.40 2h96 h LEU 274 CO -0.05 0.62 -0.71 -0.36 0.09 0.00 0.00 178.44 178.03 2h96 s PHE 275 N -6.05 2.61 0.83 1.13 0.08 0.18 -5.05 117.98 111.72 2h96 s PHE 275 Ca -0.12 -2.90 -0.11 0.00 0.12 0.00 0.00 56.93 53.92 2h96 s PHE 275 Cb 0.20 -2.10 0.09 0.00 -0.57 0.00 0.00 43.02 40.64 2h96 s PHE 275 CO 0.81 -0.67 1.12 -1.25 -0.10 0.00 0.00 175.22 175.12 2h96 s PRO 276 N -0.66 1.76 0.12 0.24 0.04 -0.97 -4.47 135.00 131.05 2h96 s PRO 276 Ca 0.25 1.34 -0.31 0.00 0.04 0.00 0.00 61.00 62.33 2h96 s PRO 276 Cb -0.07 -1.83 -0.11 0.00 0.04 0.00 0.00 34.50 32.53 2h96 s PRO 276 CO -0.13 -2.05 1.51 -0.44 0.04 0.00 0.00 177.00 175.93 2h96 h ASP 277 N -1.39 -1.68 -0.76 6.66 3.32 -1.95 -2.78 116.42 117.83 2h96 h ASP 277 Ca -0.43 0.21 0.22 0.00 0.02 0.00 0.00 57.03 57.05 2h96 h ASP 277 Cb 1.25 0.68 -0.03 0.00 0.22 0.00 0.00 39.33 41.44 2h96 h ASP 277 CO 0.47 -0.41 0.95 0.52 -1.72 0.00 0.00 179.24 179.06 2h96 n VAL 278 N -5.19 0.00 0.03 -1.35 0.31 -1.26 0.10 118.33 110.97 2h96 n VAL 278 Ca -0.04 0.97 -0.08 0.00 -0.01 0.00 0.00 64.34 65.19 2h96 n VAL 278 Cb 0.33 -1.76 -0.13 0.00 -0.91 0.00 0.00 33.84 31.38 2h96 n VAL 278 CO 0.00 0.00 0.00 -0.07 -1.32 0.00 0.00 176.83 175.44 2h96 h LEU 279 N 0.00 0.00-10.26 7.52 3.38 -1.84 -3.46 115.31 110.66 2h96 h LEU 279 Ca 0.36 0.00 -0.50 0.00 0.09 0.00 0.00 57.88 57.83 2h96 h LEU 279 Cb 2.26 0.00 0.08 0.00 0.09 0.00 0.00 40.66 43.08 2h96 h LEU 279 CO -0.00 0.99 0.37 -0.36 0.09 0.00 0.00 178.44 179.53 2h96 s PHE 280 N -2.67 3.06 1.17 1.13 0.08 0.28 -4.86 117.98 116.18 2h96 s PHE 280 Ca -0.01 1.47 -0.18 0.00 0.12 0.00 0.00 56.93 58.33 2h96 s PHE 280 Cb 0.09 -2.94 0.21 0.00 -0.57 0.00 0.00 43.02 39.81 2h96 s PHE 280 CO 0.82 -1.13 0.40 -2.30 -0.10 0.00 0.00 175.22 172.91 2h96 n PRO 281 N -2.49 -2.58 -2.31 0.24 -0.02 -1.26 -4.83 135.00 121.75 2h96 n PRO 281 Ca 0.08 -0.75 -0.43 0.00 -2.02 0.00 0.00 63.50 60.39 2h96 n PRO 281 Cb 0.53 -1.75 -0.02 0.00 -0.02 0.00 0.00 33.50 32.24 2h96 n PRO 281 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2h96 s ALA 282 N -2.19 3.48 0.34 3.55 0.00 -1.26 -4.82 121.76 120.85 2h96 s ALA 282 Ca 0.55 0.40 -0.29 0.00 0.00 0.00 0.00 51.96 52.62 2h96 s ALA 282 Cb -0.12 -3.73 -0.11 0.00 0.00 0.00 0.00 23.12 19.16 2h96 s ALA 282 CO 0.55 -1.56 1.43 -0.51 0.00 0.00 0.00 175.76 175.68 2h96 s ASP 283 N 2.88 6.52 0.00 0.00 1.01 -1.26 -4.81 116.67 121.01 2h96 s ASP 283 Ca 0.61 2.88 0.00 0.00 0.71 0.00 0.00 52.55 56.75 2h96 s ASP 283 Cb -0.22 -2.65 0.00 0.00 1.01 0.00 0.00 42.92 41.06 2h96 s ASP 283 CO 0.22 -0.75 0.00 -1.54 0.21 0.00 0.00 175.17 173.31 2h96 n SER 284 N 0.95 0.00 0.00 0.27 3.41 -1.26 -4.99 113.62 112.00 2h96 n SER 284 Ca 0.02 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.63 2h96 n SER 284 Cb 0.40 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.35 2h96 n SER 284 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 2h96 n GLU 285 N 0.00 0.00 -2.92 4.33 -0.58 -1.26 -5.09 120.64 115.12 2h96 n GLU 285 Ca 0.00 0.00 -0.40 0.00 -0.42 0.00 0.00 57.16 56.34 2h96 n GLU 285 Cb 0.00 -0.05 -0.05 0.00 -0.57 0.00 0.00 31.44 30.77 2h96 n GLU 285 CO 0.00 0.00 0.00 -1.58 -0.48 0.00 0.00 177.13 175.07 2h96 s HIS 286 N 0.00 3.86 0.01 -0.32 2.46 -1.26 -5.02 115.29 115.02 2h96 s HIS 286 Ca 0.00 1.65 -0.26 0.00 0.47 0.00 0.00 55.06 56.92 2h96 s HIS 286 Cb 0.00 -2.85 -0.16 0.00 -0.13 0.00 0.00 32.58 29.44 2h96 s HIS 286 CO 0.00 0.40 1.23 -0.91 -2.47 0.00 0.00 174.74 172.99 2h96 h ASN 287 N 4.86 -0.49 -0.51 9.88 2.35 -2.00 -3.34 115.58 126.32 2h96 h ASN 287 Ca -0.45 -0.10 0.10 0.00 -0.55 0.00 0.00 56.30 55.30 2h96 h ASN 287 Cb 1.21 0.13 -0.09 0.00 0.05 0.00 0.00 38.32 39.61 2h96 h ASN 287 CO 0.68 -0.14 -0.04 0.11 -1.65 0.00 0.00 177.43 176.40 2h96 h LYS 288 N -0.88 0.07 -2.89 0.81 1.79 -1.96 -3.17 116.57 110.35 2h96 h LYS 288 Ca -0.06 -0.00 -0.79 0.00 -2.18 0.00 0.00 60.65 57.62 2h96 h LYS 288 Cb 0.56 -0.02 -0.22 0.00 -1.58 0.00 0.00 32.23 30.97 2h96 h LYS 288 CO 0.10 0.05 1.39 1.28 -1.08 0.00 0.00 179.45 181.19 2h96 n LEU 289 N -5.28 6.92 -4.42 2.94 4.32 -1.25 -4.08 117.00 116.15 2h96 n LEU 289 Ca 0.06 -5.06 -0.23 0.00 -0.02 0.00 0.00 56.01 50.75 2h96 n LEU 289 Cb 0.28 -1.32 -0.11 0.00 -1.62 0.00 0.00 43.42 40.66 2h96 n LEU 289 CO 0.13 1.74 -0.49 -0.75 -1.22 0.00 0.00 177.39 176.81 2h96 s LYS 290 N -2.07 1.53 0.39 3.23 2.20 -1.20 -4.47 119.74 119.36 2h96 s LYS 290 Ca 0.38 -1.63 0.08 0.00 -0.36 0.00 0.00 55.97 54.44 2h96 s LYS 290 Cb 0.11 -1.62 0.84 0.00 -1.51 0.00 0.00 37.83 35.65 2h96 s LYS 290 CO 0.01 0.31 1.99 0.00 -0.36 0.00 0.00 175.35 177.30 2h96 h ALA 291 N 2.67 1.78 -0.44 3.13 0.00 -1.92 -1.32 119.26 123.15 2h96 h ALA 291 Ca -0.41 -0.02 0.06 0.00 0.00 0.00 0.00 54.91 54.53 2h96 h ALA 291 Cb 1.23 -0.16 -0.05 0.00 0.00 0.00 0.00 17.79 18.81 2h96 h ALA 291 CO 0.56 0.13 0.14 0.77 0.00 0.00 0.00 179.25 180.85 2h96 h SER 292 N 0.62 0.12 0.00 0.00 0.02 -1.95 0.25 113.55 112.62 2h96 h SER 292 Ca 0.26 0.06 -0.00 0.00 -0.84 0.00 0.00 61.79 61.27 2h96 h SER 292 Cb 0.24 0.05 0.00 0.00 0.14 0.00 0.00 62.40 62.83 2h96 h SER 292 CO -0.08 0.10 -0.00 1.56 -1.14 0.00 0.00 176.83 177.27 2h96 h GLN 293 N 0.30 -0.00 -0.64 3.45 1.08 -1.59 0.72 115.11 118.43 2h96 h GLN 293 Ca 0.21 0.00 0.05 0.00 -1.45 0.00 0.00 58.65 57.47 2h96 h GLN 293 Cb 0.22 0.00 -0.05 0.00 -0.05 0.00 0.00 27.48 27.60 2h96 h GLN 293 CO -0.23 0.43 0.35 0.00 -0.95 0.00 0.00 178.83 178.43 2h96 h ALA 294 N 0.55 0.84 -0.50 3.87 0.00 -1.15 0.15 119.26 123.03 2h96 h ALA 294 Ca -0.00 0.02 -0.03 0.00 0.00 0.00 0.00 54.91 54.90 2h96 h ALA 294 Cb 0.44 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.09 2h96 h ALA 294 CO 0.00 0.03 0.20 -0.09 0.00 0.00 0.00 179.25 179.39 2h96 h ARG 295 N 0.65 0.74 -0.38 0.00 2.43 -0.46 -1.98 114.38 115.39 2h96 h ARG 295 Ca 0.28 -0.13 0.03 0.00 -0.81 0.00 0.00 59.98 59.35 2h96 h ARG 295 Cb 0.17 -0.12 -0.03 0.00 -0.42 0.00 0.00 29.97 29.57 2h96 h ARG 295 CO -0.17 0.66 0.19 0.22 -1.51 0.00 0.00 179.97 179.35 2h96 h ASP 296 N 0.66 0.28 -0.80 -3.80 3.58 0.54 -0.99 116.42 115.90 2h96 h ASP 296 Ca 0.17 0.02 0.03 0.00 0.42 0.00 0.00 57.03 57.66 2h96 h ASP 296 Cb 0.19 -0.04 -0.05 0.00 1.72 0.00 0.00 39.33 41.16 2h96 h ASP 296 CO -0.01 0.21 0.51 0.25 -2.88 0.00 0.00 179.24 177.31 2h96 h LEU 297 N 0.39 0.85 0.11 2.28 5.85 -0.60 -2.76 115.31 121.43 2h96 h LEU 297 Ca 0.16 -0.00 0.02 0.00 0.84 0.00 0.00 57.88 58.89 2h96 h LEU 297 Cb 0.06 -0.19 -0.04 0.00 0.37 0.00 0.00 40.66 40.87 2h96 h LEU 297 CO -0.11 0.58 -0.28 -0.07 -0.34 0.00 0.00 178.44 178.23 2h96 h LEU 298 N 1.00 -0.80 -0.46 2.25 3.38 -0.54 -1.44 115.31 118.70 2h96 h LEU 298 Ca 0.32 0.09 0.00 0.00 0.09 0.00 0.00 57.88 58.38 2h96 h LEU 298 Cb 0.01 0.30 0.00 0.00 0.09 0.00 0.00 40.66 41.06 2h96 h LEU 298 CO -0.11 -0.37 0.02 -1.54 0.09 0.00 0.00 178.44 176.53 2h96 n SER 299 N -5.39 0.18 -0.28 -0.43 3.41 -0.46 -0.81 113.62 109.83 2h96 n SER 299 Ca -0.06 0.57 0.10 0.00 -0.26 0.00 0.00 58.87 59.21 2h96 n SER 299 Cb 0.30 -0.59 -0.05 0.00 -0.26 0.00 0.00 64.21 63.62 2h96 n SER 299 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 2h96 n LYS 300 N -1.73 1.03 -0.11 4.33 5.02 -0.57 -4.42 118.16 121.71 2h96 n LYS 300 Ca -0.00 -0.58 -0.19 0.00 -2.02 0.00 0.00 58.31 55.52 2h96 n LYS 300 Cb 0.03 -1.42 -0.09 0.00 -0.02 0.00 0.00 35.03 33.53 2h96 n LYS 300 CO 0.00 0.00 0.00 -1.33 -0.52 0.00 0.00 177.40 175.55 2h96 n MET 301 N -0.60 0.49 -1.65 1.97 2.81 0.01 -1.36 117.12 118.79 2h96 n MET 301 Ca 0.07 0.16 -0.42 0.00 -1.81 0.00 0.00 57.70 55.69 2h96 n MET 301 Cb 0.38 -1.35 -0.01 0.00 -0.71 0.00 0.00 33.22 31.53 2h96 n MET 301 CO 0.00 0.00 0.00 1.28 1.51 0.00 0.00 175.97 178.76 2h96 n LEU 302 N -3.51 6.42 -3.85 4.03 4.77 -0.16 -4.41 117.00 120.28 2h96 n LEU 302 Ca -0.40 -3.94 -0.22 0.00 -0.03 0.00 0.00 56.01 51.42 2h96 n LEU 302 Cb 0.85 -1.58 -0.17 0.00 -2.33 0.00 0.00 43.42 40.20 2h96 n LEU 302 CO 0.12 0.87 -0.40 -0.69 -1.33 0.00 0.00 177.39 175.96 2h96 s VAL 303 N 3.50 0.52 0.08 4.08 1.01 -1.26 -4.87 120.40 123.47 2h96 s VAL 303 Ca 0.49 -0.05 -0.29 0.00 0.00 0.00 0.00 61.98 62.13 2h96 s VAL 303 Cb 0.14 -0.59 -0.15 0.00 0.00 0.00 0.00 36.38 35.77 2h96 s VAL 303 CO -0.06 0.25 1.65 0.40 0.00 0.00 0.00 175.10 177.35 2h96 h ILE 304 N 6.21 0.50 -2.31 2.22 2.04 -1.98 -3.40 117.51 120.80 2h96 h ILE 304 Ca -0.30 0.00 -0.53 0.00 1.00 0.00 0.00 64.86 65.02 2h96 h ILE 304 Cb 1.14 0.50 -0.03 0.00 -0.74 0.00 0.00 36.82 37.69 2h96 h ILE 304 CO 0.39 0.00 1.33 -0.62 0.00 0.00 0.00 178.15 179.24 2h96 s ASP 305 N -4.67 5.53 0.26 1.72 -1.08 -1.26 -4.73 116.67 112.44 2h96 s ASP 305 Ca -0.16 0.81 -0.02 0.00 -0.52 0.00 0.00 52.55 52.66 2h96 s ASP 305 Cb 0.05 -2.53 0.51 0.00 -1.46 0.00 0.00 42.92 39.50 2h96 s ASP 305 CO 0.64 -2.08 1.75 0.00 0.52 0.00 0.00 175.17 175.99 2h96 h ALA 306 N 14.16 1.22 0.00 3.66 0.00 -1.94 0.13 119.26 136.49 2h96 h ALA 306 Ca -0.29 0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.71 2h96 h ALA 306 Cb 1.17 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.98 2h96 h ALA 306 CO 1.13 -0.13 0.00 -1.13 0.00 0.00 0.00 179.25 179.12 2h96 n SER 307 N -4.91 0.00 0.00 0.00 3.41 -1.26 -0.47 113.62 110.39 2h96 n SER 307 Ca 0.16 -0.09 0.00 0.00 -0.26 0.00 0.00 58.87 58.69 2h96 n SER 307 Cb 0.43 -0.03 0.00 0.00 -0.26 0.00 0.00 64.21 64.35 2h96 n SER 307 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 2h96 n LYS 308 N -1.03 -0.54 -3.24 4.33 4.76 0.39 -5.04 118.16 117.79 2h96 n LYS 308 Ca 0.03 -0.29 -0.39 0.00 -2.87 0.00 0.00 58.31 54.80 2h96 n LYS 308 Cb 0.02 -0.79 -0.06 0.00 -1.84 0.00 0.00 35.03 32.36 2h96 n LYS 308 CO 0.00 0.00 0.00 0.50 -1.37 0.00 0.00 177.40 176.53 2h96 s ARG 309 N -0.01 4.26 0.96 1.97 3.52 0.38 -5.02 118.95 125.03 2h96 s ARG 309 Ca 0.00 0.73 -0.17 0.00 -0.13 0.00 0.00 55.73 56.16 2h96 s ARG 309 Cb 0.00 -3.30 0.03 0.00 -1.56 0.00 0.00 34.95 30.12 2h96 s ARG 309 CO 0.00 0.49 -0.31 1.51 -0.81 0.00 0.00 175.30 176.18 2h96 n ILE 310 N 2.30 0.00 -4.33 4.11 3.06 -0.46 -4.98 119.36 119.06 2h96 n ILE 310 Ca -0.08 -0.09 -0.17 0.00 -2.50 0.00 0.00 62.75 59.90 2h96 n ILE 310 Cb 0.51 -0.32 -0.10 0.00 0.54 0.00 0.00 39.64 40.26 2h96 n ILE 310 CO 0.00 0.00 0.00 -0.94 -2.50 0.00 0.00 176.55 173.11 2h96 s SER 311 N -1.54 1.28 0.17 9.51 1.04 -1.26 -4.85 113.70 118.05 2h96 s SER 311 Ca 0.36 -1.39 -0.13 0.00 0.48 0.00 0.00 55.95 55.28 2h96 s SER 311 Cb -0.02 0.15 0.08 0.00 0.10 0.00 0.00 66.02 66.33 2h96 s SER 311 CO 0.46 -0.73 1.78 0.58 0.98 0.00 0.00 173.24 176.31 2h96 h VAL 312 N 2.36 1.20 -0.93 5.02 2.07 -1.96 -1.54 116.25 122.46 2h96 h VAL 312 Ca -0.38 -0.52 0.18 0.00 0.82 0.00 0.00 66.70 66.80 2h96 h VAL 312 Cb 1.25 0.47 -0.17 0.00 -1.52 0.00 0.00 31.29 31.31 2h96 h VAL 312 CO 0.61 0.22 -0.24 0.47 0.02 0.00 0.00 177.57 178.65 2h96 n ASP 313 N -4.57 -0.35 0.07 0.57 8.00 -1.26 -0.24 116.55 118.77 2h96 n ASP 313 Ca 0.04 1.60 -0.05 0.00 0.71 0.00 0.00 54.79 57.08 2h96 n ASP 313 Cb 0.10 -0.48 -0.09 0.00 -0.02 0.00 0.00 41.12 40.63 2h96 n ASP 313 CO 0.00 0.00 0.00 -0.33 -0.39 0.00 0.00 177.20 176.48 2h96 h GLU 314 N 0.00 0.00 -0.22 -1.24 5.08 -1.90 -3.01 114.58 113.30 2h96 h GLU 314 Ca 0.44 0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.78 2h96 h GLU 314 Cb 0.67 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.91 2h96 h GLU 314 CO -0.95 0.84 0.06 0.00 -1.00 0.00 0.00 179.01 177.95 2h96 h ALA 315 N 1.11 0.29 0.00 3.43 0.00 0.42 0.10 119.26 124.61 2h96 h ALA 315 Ca -0.04 -0.15 -0.02 0.00 0.00 0.00 0.00 54.91 54.70 2h96 h ALA 315 Cb 1.71 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 19.42 2h96 h ALA 315 CO 0.11 -0.07 -0.07 -0.07 0.00 0.00 0.00 179.25 179.15 2h96 h LEU 316 N 0.17 0.00 -0.38 0.00 3.38 -1.08 -1.99 115.31 115.41 2h96 h LEU 316 Ca 0.07 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.04 2h96 h LEU 316 Cb 0.27 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.02 2h96 h LEU 316 CO 0.00 0.07 -0.54 0.00 0.09 0.00 0.00 178.44 178.07 2h96 n GLN 317 N -3.53 0.53 -2.29 1.13 1.13 -0.76 -3.80 117.38 109.79 2h96 n GLN 317 Ca -0.02 -0.38 -0.40 0.00 -1.94 0.00 0.00 57.00 54.25 2h96 n GLN 317 Cb 0.20 -1.49 -0.03 0.00 0.11 0.00 0.00 30.24 29.03 2h96 n GLN 317 CO 0.00 0.00 0.00 -1.58 -1.44 0.00 0.00 177.06 174.04 2h96 s HIS 318 N -2.73 3.30 0.66 1.08 2.46 0.29 -4.70 115.29 115.65 2h96 s HIS 318 Ca 0.16 1.56 0.11 0.00 0.47 0.00 0.00 55.06 57.35 2h96 s HIS 318 Cb 0.18 -3.48 0.54 0.00 -0.13 0.00 0.00 32.58 29.69 2h96 s HIS 318 CO 0.66 -1.22 1.29 -1.35 -2.47 0.00 0.00 174.74 171.65 2h96 h PRO 319 N 3.55 0.00 0.02 2.88 0.11 -1.90 0.70 132.00 137.36 2h96 h PRO 319 Ca -0.48 0.00 -0.35 0.00 0.11 0.00 0.00 66.00 65.28 2h96 h PRO 319 Cb 1.22 0.00 -0.05 0.00 0.11 0.00 0.00 31.00 32.28 2h96 h PRO 319 CO 0.66 0.00 -2.13 0.98 -0.21 0.00 0.00 178.00 177.30 2h96 n TYR 320 N -2.70 0.53 -0.04 0.65 9.36 -1.26 -4.42 117.16 119.28 2h96 n TYR 320 Ca 0.02 0.16 0.04 0.00 3.32 0.00 0.00 57.90 61.43 2h96 n TYR 320 Cb 0.87 -1.09 -0.16 0.00 -0.63 0.00 0.00 39.34 38.34 2h96 n TYR 320 CO 0.00 0.00 0.00 -0.89 0.22 0.00 0.00 176.86 176.19 2h96 n ILE 321 N -3.07 0.46 0.30 2.97 2.08 -0.52 -4.51 119.36 117.07 2h96 n ILE 321 Ca -0.31 -0.60 0.19 0.00 0.56 0.00 0.00 62.75 62.59 2h96 n ILE 321 Cb 1.07 -0.15 0.89 0.00 -0.75 0.00 0.00 39.64 40.70 2h96 n ILE 321 CO 0.00 0.00 0.00 -1.13 0.56 0.00 0.00 176.55 175.98 2h96 h ASN 322 N 0.00 0.00 -0.25 4.38 -0.73 0.26 -3.31 115.58 115.93 2h96 h ASN 322 Ca -0.18 0.00 -0.29 0.00 1.87 0.00 0.00 56.30 57.70 2h96 h ASN 322 Cb 1.39 0.00 -0.09 0.00 0.27 0.00 0.00 38.32 39.89 2h96 h ASN 322 CO 0.01 0.00 -0.00 1.33 -0.37 0.00 0.00 177.43 178.40 2h96 n VAL 323 N -2.92 3.16 -0.77 2.57 0.24 -1.26 -1.46 118.33 117.88 2h96 n VAL 323 Ca -0.01 -1.91 0.00 0.00 -2.04 0.00 0.00 64.34 60.38 2h96 n VAL 323 Cb 0.17 -1.94 0.00 0.00 -1.47 0.00 0.00 33.84 30.60 2h96 n VAL 323 CO 0.00 0.00 0.00 0.79 -2.14 0.00 0.00 176.83 175.48 2h96 n TRP 324 N 2.17 0.00 -1.51 6.34 7.02 -1.25 -5.08 117.44 125.14 2h96 n TRP 324 Ca 0.46 0.00 -0.53 0.00 -1.02 0.00 0.00 57.50 56.41 2h96 n TRP 324 Cb 0.80 0.00 -0.06 0.00 -2.42 0.00 0.00 31.31 29.63 2h96 n TRP 324 CO 0.00 0.00 0.00 0.98 -2.02 0.00 0.00 177.69 176.65 2h96 n TYR 325 N 0.00 0.69 -3.35 -5.99 9.36 -0.54 -4.97 117.16 112.36 2h96 n TYR 325 Ca 0.00 0.89 -0.09 0.00 3.32 0.00 0.00 57.90 62.02 2h96 n TYR 325 Cb 0.00 -2.14 -0.08 0.00 -0.63 0.00 0.00 39.34 36.49 2h96 n TYR 325 CO 0.00 0.00 0.00 0.34 0.22 0.00 0.00 176.86 177.42 2h96 s ASP 326 N -0.14 0.28 0.21 2.98 -1.08 -1.26 -5.05 116.67 112.59 2h96 s ASP 326 Ca 0.80 0.18 0.02 0.00 -0.52 0.00 0.00 52.55 53.03 2h96 s ASP 326 Cb -1.06 1.10 0.52 0.00 -1.46 0.00 0.00 42.92 42.03 2h96 s ASP 326 CO 0.54 -0.30 1.03 -2.65 0.52 0.00 0.00 175.17 174.31 2h96 n PRO 327 N 5.36 -0.05 0.00 4.34 -0.02 -1.26 -0.51 135.00 142.86 2h96 n PRO 327 Ca -0.03 0.98 0.00 0.00 -2.02 0.00 0.00 63.50 62.43 2h96 n PRO 327 Cb 0.50 -1.57 0.00 0.00 -0.02 0.00 0.00 33.50 32.41 2h96 n PRO 327 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 2h96 n SER 328 N -4.85 0.00 -0.16 2.55 3.41 -1.26 0.28 113.62 113.59 2h96 n SER 328 Ca 0.16 0.92 -0.02 0.00 -0.26 0.00 0.00 58.87 59.67 2h96 n SER 328 Cb 0.52 -0.42 0.07 0.00 -0.26 0.00 0.00 64.21 64.12 2h96 n SER 328 CO 0.00 0.00 0.00 -0.33 -0.16 0.00 0.00 175.04 174.55 2h96 h GLU 329 N 0.00 0.17 0.74 4.33 5.08 -1.75 0.21 114.58 123.37 2h96 h GLU 329 Ca 0.00 -0.01 -0.04 0.00 -1.00 0.00 0.00 59.36 58.31 2h96 h GLU 329 Cb 0.00 -0.04 0.01 0.00 0.50 0.00 0.00 28.75 29.22 2h96 h GLU 329 CO 0.00 0.11 -0.36 0.00 -1.00 0.00 0.00 179.01 177.77 2h96 h ALA 330 N 1.43 -1.26 -1.36 3.43 0.00 -0.80 -3.34 119.26 117.36 2h96 h ALA 330 Ca 0.26 -0.22 -0.67 0.00 0.00 0.00 0.00 54.91 54.28 2h96 h ALA 330 Cb 0.38 0.38 -0.35 0.00 0.00 0.00 0.00 17.79 18.20 2h96 h ALA 330 CO -0.38 -1.19 0.09 -0.85 0.00 0.00 0.00 179.25 176.92 2h96 n GLU 331 N -4.68 3.28 0.00 0.00 0.28 0.14 -4.78 120.64 114.89 2h96 n GLU 331 Ca -0.12 -4.16 0.00 0.00 -0.16 0.00 0.00 57.16 52.72 2h96 n GLU 331 Cb 0.39 -2.27 0.00 0.00 1.43 0.00 0.00 31.44 30.99 2h96 n GLU 331 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 2h96 n ALA 332 N -0.46 0.00 -2.69 -1.84 0.00 0.74 -4.82 120.51 111.44 2h96 n ALA 332 Ca 0.45 0.00 -0.40 0.00 0.00 0.00 0.00 53.44 53.48 2h96 n ALA 332 Cb 0.45 0.00 -0.05 0.00 0.00 0.00 0.00 19.45 19.85 2h96 n ALA 332 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 2h96 s PRO 333 N -1.87 4.36 0.13 0.00 0.04 -1.26 -4.99 135.00 131.41 2h96 s PRO 333 Ca 0.00 0.89 -0.32 0.00 0.04 0.00 0.00 61.00 61.61 2h96 s PRO 333 Cb 0.00 -3.51 -0.12 0.00 0.04 0.00 0.00 34.50 30.91 2h96 s PRO 333 CO 0.00 -0.11 1.75 -0.35 0.04 0.00 0.00 177.00 178.32 2h96 n PRO 334 N 4.45 2.54 -0.41 0.56 -0.04 -1.26 -4.94 135.00 135.91 2h96 n PRO 334 Ca 0.01 0.92 -0.29 0.00 -0.04 0.00 0.00 63.50 64.10 2h96 n PRO 334 Cb 0.50 -2.77 0.28 0.00 -0.04 0.00 0.00 33.50 31.47 2h96 n PRO 334 CO 0.00 0.00 0.00 -1.25 -0.04 0.00 0.00 175.50 174.21 2h96 s PRO 335 N 2.04 -1.92 -0.24 0.54 0.04 -1.26 -4.99 135.00 129.22 2h96 s PRO 335 Ca 0.81 0.59 -0.03 0.00 0.04 0.00 0.00 61.00 62.40 2h96 s PRO 335 Cb -0.57 -1.46 0.11 0.00 0.04 0.00 0.00 34.50 32.62 2h96 s PRO 335 CO 0.38 -4.32 0.23 0.15 0.04 0.00 0.00 177.00 173.48 2h96 s LYS 336 N -4.63 0.23 0.51 4.56 1.02 -1.25 -4.81 119.74 115.38 2h96 s LYS 336 Ca 0.69 0.03 -0.18 0.00 0.02 0.00 0.00 55.97 56.53 2h96 s LYS 336 Cb -0.21 -1.05 -0.08 0.00 -0.52 0.00 0.00 37.83 35.97 2h96 s LYS 336 CO 0.63 -0.80 1.00 0.42 -0.92 0.00 0.00 175.35 175.68 2h96 s ILE 337 N 2.31 4.27 0.00 2.17 -1.09 -1.26 -4.94 121.20 122.66 2h96 s ILE 337 Ca 0.08 1.20 -0.01 0.00 -2.23 0.00 0.00 60.65 59.68 2h96 s ILE 337 Cb -0.15 -3.60 -0.01 0.00 -1.58 0.00 0.00 42.46 37.12 2h96 s ILE 337 CO -0.21 -0.52 1.02 -0.65 -1.23 0.00 0.00 174.94 173.36 2h96 h PRO 338 N 1.12 -0.04 0.00 2.79 0.11 -1.98 -3.47 132.00 130.53 2h96 h PRO 338 Ca -0.48 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.64 2h96 h PRO 338 Cb 1.19 0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.31 2h96 h PRO 338 CO 0.60 -0.03 0.00 -0.40 -0.21 0.00 0.00 178.00 177.96 2h96 n ASP 339 N -2.16 0.00 -0.03 -2.05 5.68 -1.26 -4.99 116.55 111.74 2h96 n ASP 339 Ca -0.01 0.00 -0.14 0.00 -0.50 0.00 0.00 54.79 54.14 2h96 n ASP 339 Cb 0.02 0.00 -0.09 0.00 -1.14 0.00 0.00 41.12 39.91 2h96 n ASP 339 CO 0.00 0.00 0.00 0.07 -1.33 0.00 0.00 177.20 175.94 2h96 h LYS 340 N 0.00 0.26 -6.81 0.11 2.10 -2.03 -3.42 116.57 106.78 2h96 h LYS 340 Ca 0.00 -0.20 -0.53 0.00 -2.00 0.00 0.00 60.65 57.93 2h96 h LYS 340 Cb 0.00 0.03 0.07 0.00 -0.90 0.00 0.00 32.23 31.44 2h96 h LYS 340 CO 0.00 0.82 0.79 -1.14 -2.00 0.00 0.00 179.45 177.92 2h96 s GLN 341 N -3.75 4.21 0.00 0.07 -0.44 -1.26 -4.90 119.66 113.59 2h96 s GLN 341 Ca -0.15 2.41 0.00 0.00 -2.50 0.00 0.00 55.36 55.13 2h96 s GLN 341 Cb 0.03 -3.06 0.00 0.00 -1.64 0.00 0.00 33.01 28.34 2h96 s GLN 341 CO 0.75 -0.47 0.00 1.28 0.50 0.00 0.00 175.29 177.35 2h96 n LEU 342 N 1.82 0.00 0.00 3.68 4.77 -1.26 -5.02 117.00 120.99 2h96 n LEU 342 Ca 0.05 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.03 2h96 n LEU 342 Cb 0.39 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.48 2h96 n LEU 342 CO 0.62 0.00 0.00 -0.90 -1.33 0.00 0.00 177.39 175.78 2h96 n ASP 343 N 0.00 0.00 0.05 -1.43 3.85 -1.26 -4.20 116.55 113.56 2h96 n ASP 343 Ca 0.00 0.00 0.00 0.00 -0.71 0.00 0.00 54.79 54.08 2h96 n ASP 343 Cb 0.00 0.00 0.00 0.00 -1.35 0.00 0.00 41.12 39.77 2h96 n ASP 343 CO 0.00 0.00 0.00 -1.84 -1.01 0.00 0.00 177.20 174.35 2h96 n GLU 344 N -0.09 0.00 0.00 0.11 0.28 -1.26 -5.03 120.64 114.65 2h96 n GLU 344 Ca 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 57.00 2h96 n GLU 344 Cb 0.00 -0.42 0.00 0.00 1.43 0.00 0.00 31.44 32.45 2h96 n GLU 344 CO 0.00 0.00 0.00 2.89 -0.16 0.00 0.00 177.13 179.86 2h96 n ARG 345 N -3.39 0.00 -4.43 3.44 1.85 -1.26 -4.90 116.66 107.97 2h96 n ARG 345 Ca 0.00 0.00 -0.32 0.00 -1.00 0.00 0.00 57.85 56.53 2h96 n ARG 345 Cb 0.00 0.00 -0.10 0.00 -1.05 0.00 0.00 32.46 31.31 2h96 n ARG 345 CO 0.00 0.00 0.00 -1.21 -0.01 0.00 0.00 177.63 176.41 2h96 s GLU 346 N 0.00 2.54 0.27 2.89 0.41 -1.26 -5.02 118.70 118.53 2h96 s GLU 346 Ca 0.00 -0.73 0.04 0.00 -0.41 0.00 0.00 54.97 53.87 2h96 s GLU 346 Cb 0.00 -2.50 -0.02 0.00 -1.78 0.00 0.00 34.13 29.83 2h96 s GLU 346 CO 0.00 0.60 0.15 0.72 -0.49 0.00 0.00 175.26 176.24 2h96 n HIS 347 N 1.49 -0.21 -2.06 1.61 8.25 -1.26 -5.10 115.22 117.93 2h96 n HIS 347 Ca -0.15 -1.95 -0.29 0.00 -0.26 0.00 0.00 57.72 55.07 2h96 n HIS 347 Cb 0.52 0.09 0.19 0.00 1.12 0.00 0.00 29.99 31.92 2h96 n HIS 347 CO 0.00 0.00 0.00 0.95 0.64 0.00 0.00 176.34 177.93 2h96 s THR 348 N -2.80 2.01 0.17 1.59 -4.23 -1.26 -4.82 115.64 106.28 2h96 s THR 348 Ca 0.21 -0.11 -0.06 0.00 -1.18 0.00 0.00 61.69 60.55 2h96 s THR 348 Cb 0.01 -2.89 -0.08 0.00 1.34 0.00 0.00 72.50 70.88 2h96 s THR 348 CO 0.15 0.00 1.46 0.16 -0.54 0.00 0.00 174.62 175.85 2h96 h ILE 349 N -1.53 1.31 0.07 2.99 3.07 -1.94 -2.07 117.51 119.40 2h96 h ILE 349 Ca -0.42 -1.83 -0.00 0.00 1.55 0.00 0.00 64.86 64.15 2h96 h ILE 349 Cb 1.23 1.79 0.00 0.00 -0.27 0.00 0.00 36.82 39.57 2h96 h ILE 349 CO 0.34 0.58 -0.03 -0.33 -1.05 0.00 0.00 178.15 177.65 2h96 h GLU 350 N 0.48 -0.09 -0.76 0.16 4.39 -1.96 -2.59 114.58 114.21 2h96 h GLU 350 Ca 0.00 0.01 0.17 0.00 0.34 0.00 0.00 59.36 59.88 2h96 h GLU 350 Cb 1.16 0.02 -0.12 0.00 -0.10 0.00 0.00 28.75 29.71 2h96 h GLU 350 CO 0.12 0.46 0.18 1.49 -1.16 0.00 0.00 179.01 180.10 2h96 h GLU 351 N -0.89 0.25 0.40 2.33 4.81 -1.93 0.40 114.58 119.95 2h96 h GLU 351 Ca -0.01 -0.02 -0.02 0.00 -0.13 0.00 0.00 59.36 59.19 2h96 h GLU 351 Cb 0.60 -0.06 0.00 0.00 0.63 0.00 0.00 28.75 29.93 2h96 h GLU 351 CO 0.02 0.17 -0.19 -1.49 -0.73 0.00 0.00 179.01 176.78 2h96 h TRP 352 N 0.26 -0.50 -1.19 0.92 -0.00 -1.46 -2.19 115.95 111.79 2h96 h TRP 352 Ca 0.44 -0.01 0.34 0.00 -0.00 0.00 0.00 58.89 59.65 2h96 h TRP 352 Cb 0.77 0.16 -0.07 0.00 -0.00 0.00 0.00 29.16 30.02 2h96 h TRP 352 CO -0.27 -0.25 0.82 -0.22 -0.00 0.00 0.00 178.44 178.52 2h96 h LYS 353 N -0.65 0.14 0.83 0.49 3.64 -0.45 -0.22 116.57 120.35 2h96 h LYS 353 Ca -0.05 -0.01 -0.04 0.00 -1.27 0.00 0.00 60.65 59.28 2h96 h LYS 353 Cb 0.48 -0.03 0.00 0.00 -0.41 0.00 0.00 32.23 32.27 2h96 h LYS 353 CO 0.09 0.09 -0.47 1.49 -2.27 0.00 0.00 179.45 178.38 2h96 h GLU 354 N 0.14 -1.17 -0.74 1.90 4.57 0.32 -2.55 114.58 117.06 2h96 h GLU 354 Ca 0.62 0.08 0.06 0.00 -1.18 0.00 0.00 59.36 58.93 2h96 h GLU 354 Cb 2.11 0.27 -0.04 0.00 -0.16 0.00 0.00 28.75 30.92 2h96 h GLU 354 CO -0.14 -0.78 0.48 -0.07 -1.18 0.00 0.00 179.01 177.32 2h96 h LEU 355 N -1.21 0.70 -0.07 1.64 4.07 -0.94 -2.47 115.31 117.04 2h96 h LEU 355 Ca -0.11 0.00 -0.00 0.00 0.08 0.00 0.00 57.88 57.85 2h96 h LEU 355 Cb 0.96 -0.15 -0.00 0.00 1.08 0.00 0.00 40.66 42.54 2h96 h LEU 355 CO 0.14 0.46 0.04 0.40 -1.08 0.00 0.00 178.44 178.40 2h96 h ILE 356 N 0.80 1.06 0.71 1.22 1.08 -1.32 -2.22 117.51 118.84 2h96 h ILE 356 Ca 0.31 -0.16 -0.03 0.00 -0.39 0.00 0.00 64.86 64.59 2h96 h ILE 356 Cb 0.21 1.04 0.00 0.00 -3.07 0.00 0.00 36.82 35.00 2h96 h ILE 356 CO -0.10 0.05 -0.37 0.22 -0.69 0.00 0.00 178.15 177.25 2h96 h TYR 357 N 0.05 -0.98 0.00 1.37 3.20 -1.08 1.18 116.97 120.70 2h96 h TYR 357 Ca 0.02 -0.02 0.00 0.00 3.14 0.00 0.00 58.73 61.88 2h96 h TYR 357 Cb 0.05 0.33 0.00 0.00 1.54 0.00 0.00 36.73 38.65 2h96 h TYR 357 CO -0.06 -0.59 0.00 1.63 -1.64 0.00 0.00 178.16 177.51 2h96 n LYS 358 N -4.79 0.00 -0.07 1.82 4.76 -0.96 -0.18 118.16 118.74 2h96 n LYS 358 Ca -0.12 0.00 -0.14 0.00 -2.87 0.00 0.00 58.31 55.18 2h96 n LYS 358 Cb 0.40 -1.38 -0.05 0.00 -1.84 0.00 0.00 35.03 32.16 2h96 n LYS 358 CO 0.00 0.00 0.00 -1.91 -1.37 0.00 0.00 177.40 174.12 2h96 n GLU 359 N -0.81 0.30 0.12 1.97 4.07 -0.39 -4.18 120.64 121.72 2h96 n GLU 359 Ca 0.00 0.13 0.17 0.00 -0.06 0.00 0.00 57.16 57.40 2h96 n GLU 359 Cb 0.00 -1.01 0.73 0.00 -0.06 0.00 0.00 31.44 31.10 2h96 n GLU 359 CO 0.00 0.00 0.00 0.28 -0.06 0.00 0.00 177.13 177.35 2h96 h VAL 360 N -0.52 0.66 0.00 6.31 2.07 0.40 -2.63 116.25 122.54 2h96 h VAL 360 Ca -0.31 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.21 2h96 h VAL 360 Cb 1.20 0.80 0.00 0.00 -1.52 0.00 0.00 31.29 31.78 2h96 h VAL 360 CO -0.19 0.00 0.00 0.23 0.02 0.00 0.00 177.57 177.63 2h96 n MET 361 N -4.16 0.00 0.00 1.57 2.81 0.74 -1.38 117.12 116.70 2h96 n MET 361 Ca 0.05 0.02 0.00 0.00 -1.81 0.00 0.00 57.70 55.96 2h96 n MET 361 Cb 0.43 -0.83 0.00 0.00 -0.71 0.00 0.00 33.22 32.12 2h96 n MET 361 CO 0.00 0.00 0.00 -0.40 1.51 0.00 0.00 175.97 177.08 2h96 n ASP 362 N -0.56 0.09 0.00 7.83 5.75 -1.21 0.14 116.55 128.59 2h96 n ASP 362 Ca 0.00 -0.22 0.00 0.00 -0.01 0.00 0.00 54.79 54.56 2h96 n ASP 362 Cb 0.00 -0.05 0.00 0.00 -1.03 0.00 0.00 41.12 40.04 2h96 n ASP 362 CO 0.00 0.00 0.00 0.18 -0.11 0.00 0.00 177.20 177.27 2h96 n LEU 363 N 0.30 0.31 -4.44 -2.12 7.99 -0.99 -5.06 117.00 112.99 2h96 n LEU 363 Ca 0.00 -0.46 -0.29 0.00 -0.01 0.00 0.00 56.01 55.25 2h96 n LEU 363 Cb 0.02 0.00 0.25 0.00 -0.11 0.00 0.00 43.42 43.59 2h96 n LEU 363 CO 0.00 0.08 0.38 -1.84 -1.51 0.00 0.00 177.39 174.50 2h96 n GLU 364 N -0.30 -2.46 0.00 3.23 0.00 0.37 -4.07 120.64 117.41 2h96 n GLU 364 Ca 0.00 -0.69 0.00 0.00 0.00 0.00 0.00 57.16 56.47 2h96 n GLU 364 Cb 0.05 -2.11 0.00 0.00 0.00 0.00 0.00 31.44 29.38 2h96 n GLU 364 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.13 177.85