#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2pva s SER 3 N 0.00 0.15 0.02 6.43 1.04 0.45 0.43 113.70 122.22 2pva s SER 3 Ca 0.00 -0.57 -0.28 0.00 0.48 0.00 0.00 55.95 55.59 2pva s SER 3 Cb 0.00 0.27 0.09 0.00 0.10 0.00 0.00 66.02 66.49 2pva s SER 3 CO 0.00 -0.60 0.78 -1.48 0.98 0.00 0.00 173.24 172.93 2pva s LEU 4 N -2.41 -0.47 0.22 2.42 2.34 -0.42 -2.43 118.68 117.93 2pva s LEU 4 Ca -0.01 0.17 0.11 0.00 0.06 0.00 0.00 54.13 54.46 2pva s LEU 4 Cb 0.02 2.26 -0.05 0.00 -0.56 0.00 0.00 46.19 47.86 2pva s LEU 4 CO -0.07 -0.69 -0.22 -0.94 -1.06 0.00 0.00 176.35 173.37 2pva s SER 5 N -2.17 3.42 -0.02 1.48 1.04 -0.91 0.17 113.70 116.71 2pva s SER 5 Ca 0.00 -0.91 -0.11 0.00 0.48 0.00 0.00 55.95 55.41 2pva s SER 5 Cb -0.01 -0.26 0.01 0.00 0.10 0.00 0.00 66.02 65.87 2pva s SER 5 CO -0.06 0.09 0.23 -0.63 0.98 0.00 0.00 173.24 173.85 2pva s ILE 6 N -1.94 0.06 -0.12 -1.02 1.01 -0.13 -4.93 121.20 114.13 2pva s ILE 6 Ca 0.23 -0.50 -0.05 0.00 0.00 0.00 0.00 60.65 60.33 2pva s ILE 6 Cb -0.07 -0.51 -0.04 0.00 0.01 0.00 0.00 42.46 41.86 2pva s ILE 6 CO 0.11 -0.28 0.05 -0.13 0.00 0.00 0.00 174.94 174.69 2pva s ARG 7 N -1.17 3.36 0.70 2.79 1.81 -1.26 -0.74 118.95 124.44 2pva s ARG 7 Ca -0.12 -0.33 0.03 0.00 -1.72 0.00 0.00 55.73 53.59 2pva s ARG 7 Cb -0.06 -3.00 0.13 0.00 -0.45 0.00 0.00 34.95 31.57 2pva s ARG 7 CO 0.03 0.61 0.96 0.95 -0.68 0.00 0.00 175.30 177.16 2pva s THR 8 N -0.58 2.05 0.17 0.02 -4.23 0.46 -4.54 115.64 108.99 2pva s THR 8 Ca 0.11 -0.73 0.09 0.00 -1.18 0.00 0.00 61.69 59.98 2pva s THR 8 Cb -0.12 -2.32 -0.12 0.00 1.34 0.00 0.00 72.50 71.28 2pva s THR 8 CO 0.02 0.00 1.43 0.74 -0.54 0.00 0.00 174.62 176.27 2pva h THR 9 N -0.38 1.56 0.00 3.99 2.02 -0.84 -2.96 112.91 116.31 2pva h THR 9 Ca -0.33 -2.82 0.00 0.00 0.77 0.00 0.00 66.41 64.04 2pva h THR 9 Cb 1.27 2.53 0.00 0.00 -1.74 0.00 0.00 68.15 70.21 2pva h THR 9 CO 0.38 0.80 0.01 0.47 0.37 0.00 0.00 175.52 177.55 2pva n ASP 10 N -3.53 0.00 -0.40 4.18 9.92 -1.15 -4.83 116.55 120.74 2pva n ASP 10 Ca -0.00 0.42 -0.04 0.00 -0.53 0.00 0.00 54.79 54.64 2pva n ASP 10 Cb 0.79 -0.42 -0.01 0.00 -0.64 0.00 0.00 41.12 40.84 2pva n ASP 10 CO 0.00 0.00 0.00 0.47 0.13 0.00 0.00 177.20 177.80 2pva n ASP 11 N -1.42 -2.53 -4.90 -2.24 9.92 -1.12 -5.03 116.55 109.23 2pva n ASP 11 Ca 0.00 0.04 -0.31 0.00 -0.53 0.00 0.00 54.79 53.98 2pva n ASP 11 Cb 0.01 -1.34 -0.04 0.00 -0.64 0.00 0.00 41.12 39.11 2pva n ASP 11 CO 0.00 0.00 0.00 -0.54 0.13 0.00 0.00 177.20 176.79 2pva s LYS 12 N -3.48 3.38 -0.22 -1.24 1.02 -1.26 -4.85 119.74 113.09 2pva s LYS 12 Ca 0.00 -0.45 -0.07 0.00 0.02 0.00 0.00 55.97 55.47 2pva s LYS 12 Cb 0.00 -3.01 -0.03 0.00 -0.52 0.00 0.00 37.83 34.26 2pva s LYS 12 CO 0.00 0.62 0.05 -1.12 -0.92 0.00 0.00 175.35 173.98 2pva s SER 13 N -2.40 5.21 0.16 2.83 0.01 -1.26 -0.40 113.70 117.84 2pva s SER 13 Ca 0.33 -0.12 0.10 0.00 1.31 0.00 0.00 55.95 57.57 2pva s SER 13 Cb -0.13 -1.91 -0.04 0.00 0.21 0.00 0.00 66.02 64.15 2pva s SER 13 CO 0.26 0.05 -0.23 -0.76 0.41 0.00 0.00 173.24 172.97 2pva s LEU 14 N 1.08 2.39 -0.01 2.44 1.02 0.08 -1.22 118.68 124.46 2pva s LEU 14 Ca 0.04 -0.81 0.00 0.00 0.02 0.00 0.00 54.13 53.38 2pva s LEU 14 Cb -0.14 -1.06 0.00 0.00 0.02 0.00 0.00 46.19 45.01 2pva s LEU 14 CO 0.03 0.09 -0.01 0.12 0.02 0.00 0.00 176.35 176.60 2pva s PHE 15 N -1.54 0.11 0.04 0.29 5.36 -0.71 -0.96 117.98 120.58 2pva s PHE 15 Ca 0.16 -0.00 -0.03 0.00 -0.96 0.00 0.00 56.93 56.09 2pva s PHE 15 Cb -0.08 -0.11 -0.02 0.00 -0.34 0.00 0.00 43.02 42.46 2pva s PHE 15 CO 0.07 -0.02 0.04 0.00 -1.46 0.00 0.00 175.22 173.86 2pva s ALA 16 N 0.18 0.14 0.02 11.12 0.00 0.13 -1.05 121.76 132.29 2pva s ALA 16 Ca -0.01 -0.78 -0.21 0.00 0.00 0.00 0.00 51.96 50.95 2pva s ALA 16 Cb -0.03 0.26 0.04 0.00 0.00 0.00 0.00 23.12 23.40 2pva s ALA 16 CO -0.01 -0.33 0.47 -0.98 0.00 0.00 0.00 175.76 174.92 2pva s ARG 17 N -2.98 0.93 0.06 0.00 1.04 -0.59 -1.29 118.95 116.12 2pva s ARG 17 Ca -0.02 -0.18 0.02 0.00 -1.04 0.00 0.00 55.73 54.51 2pva s ARG 17 Cb 0.01 0.42 -0.04 0.00 -2.04 0.00 0.00 34.95 33.30 2pva s ARG 17 CO -0.06 -0.31 0.11 0.95 -0.04 0.00 0.00 175.30 175.95 2pva s THR 18 N -1.99 4.76 -0.35 4.99 -4.23 0.17 -1.30 115.64 117.70 2pva s THR 18 Ca -0.08 -0.61 -0.04 0.00 -1.18 0.00 0.00 61.69 59.78 2pva s THR 18 Cb -0.02 -3.28 0.07 0.00 1.34 0.00 0.00 72.50 70.61 2pva s THR 18 CO 0.01 0.17 0.10 -0.32 -0.54 0.00 0.00 174.62 174.05 2pva s MET 19 N -2.29 2.35 -0.22 3.99 1.75 -0.49 -3.20 119.30 121.19 2pva s MET 19 Ca 0.29 -1.43 -0.08 0.00 -1.25 0.00 0.00 55.69 53.23 2pva s MET 19 Cb -0.12 -3.40 -0.04 0.00 2.84 0.00 0.00 34.83 34.11 2pva s MET 19 CO 0.22 -0.79 0.08 -0.51 -0.65 0.00 0.00 175.02 173.36 2pva s ASP 20 N 1.51 5.45 0.33 1.11 1.01 -1.26 -0.85 116.67 123.97 2pva s ASP 20 Ca 0.00 -0.05 -0.15 0.00 0.71 0.00 0.00 52.55 53.06 2pva s ASP 20 Cb -0.21 -1.96 0.03 0.00 1.01 0.00 0.00 42.92 41.79 2pva s ASP 20 CO -0.01 0.06 0.68 0.12 0.21 0.00 0.00 175.17 176.24 2pva s PHE 21 N 1.03 0.17 -0.67 4.23 5.36 -0.37 -4.91 117.98 122.82 2pva s PHE 21 Ca 0.04 -0.68 0.22 0.00 -0.96 0.00 0.00 56.93 55.55 2pva s PHE 21 Cb -0.14 0.59 -0.19 0.00 -0.34 0.00 0.00 43.02 42.94 2pva s PHE 21 CO 0.03 -1.32 0.83 0.25 -1.46 0.00 0.00 175.22 173.54 2pva n THR 22 N -0.49 0.03 -4.07 0.12 -2.24 -1.26 -1.70 114.28 104.67 2pva n THR 22 Ca -0.05 -0.18 -0.07 0.00 -2.27 0.00 0.00 64.05 61.48 2pva n THR 22 Cb 0.60 0.57 -0.10 0.00 -2.10 0.00 0.00 70.33 69.30 2pva n THR 22 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2pva s MET 23 N -3.17 0.57 -0.52 -0.78 0.23 -1.26 -4.67 119.30 109.69 2pva s MET 23 Ca 0.03 -1.12 -0.09 0.00 -1.03 0.00 0.00 55.69 53.47 2pva s MET 23 Cb 0.15 0.20 0.13 0.00 -1.53 0.00 0.00 34.83 33.78 2pva s MET 23 CO 0.86 -0.10 0.40 -1.21 -2.03 0.00 0.00 175.02 172.94 2pva s GLU 24 N -3.55 2.61 0.88 3.16 2.02 -1.26 -5.09 118.70 117.48 2pva s GLU 24 Ca 0.04 -1.90 -0.10 0.00 0.02 0.00 0.00 54.97 53.02 2pva s GLU 24 Cb 0.05 -3.98 0.12 0.00 0.10 0.00 0.00 34.13 30.43 2pva s GLU 24 CO -0.09 -1.21 1.12 -1.25 0.02 0.00 0.00 175.26 173.85 2pva s PRO 25 N 1.13 1.33 -0.02 0.39 0.04 -1.26 -4.89 135.00 131.73 2pva s PRO 25 Ca 0.08 1.37 -0.30 0.00 0.04 0.00 0.00 61.00 62.18 2pva s PRO 25 Cb -0.24 -1.78 -0.07 0.00 0.04 0.00 0.00 34.50 32.45 2pva s PRO 25 CO -0.01 -2.35 1.83 0.34 0.04 0.00 0.00 177.00 176.84 2pva s ASP 26 N -2.93 6.51 0.04 6.66 2.15 -1.26 -4.94 116.67 122.91 2pva s ASP 26 Ca 0.65 2.42 0.03 0.00 0.43 0.00 0.00 52.55 56.08 2pva s ASP 26 Cb -0.21 -2.53 -0.02 0.00 -0.30 0.00 0.00 42.92 39.86 2pva s ASP 26 CO 0.58 -1.03 -0.10 -0.44 -0.17 0.00 0.00 175.17 174.01 2pva s SER 27 N 4.06 1.11 0.21 -0.34 0.01 -1.26 -4.61 113.70 112.88 2pva s SER 27 Ca 0.82 -0.51 -0.16 0.00 1.31 0.00 0.00 55.95 57.40 2pva s SER 27 Cb -0.38 -0.01 0.02 0.00 0.21 0.00 0.00 66.02 65.86 2pva s SER 27 CO 0.36 -0.12 0.51 -1.59 0.41 0.00 0.00 173.24 172.80 2pva s LYS 28 N -1.43 1.42 -0.03 12.44 0.00 -0.31 -4.56 119.74 127.27 2pva s LYS 28 Ca -0.06 -0.96 -0.26 0.00 0.00 0.00 0.00 55.97 54.69 2pva s LYS 28 Cb -0.09 0.51 -0.04 0.00 0.00 0.00 0.00 37.83 38.21 2pva s LYS 28 CO 0.01 -0.60 0.80 0.14 0.00 0.00 0.00 175.35 175.70 2pva s VAL 29 N -3.91 4.95 -0.08 1.79 -7.23 -0.53 -1.62 120.40 113.77 2pva s VAL 29 Ca 0.12 1.66 0.05 0.00 -1.81 0.00 0.00 61.98 62.00 2pva s VAL 29 Cb -0.01 -4.14 -0.01 0.00 0.56 0.00 0.00 36.38 32.79 2pva s VAL 29 CO 0.00 0.24 -0.24 -0.63 -0.31 0.00 0.00 175.10 174.16 2pva s ILE 30 N 0.76 2.15 -0.24 -0.62 1.01 -0.29 -0.64 121.20 123.33 2pva s ILE 30 Ca 0.42 -1.01 -0.09 0.00 0.00 0.00 0.00 60.65 59.97 2pva s ILE 30 Cb -0.19 -1.80 -0.04 0.00 0.01 0.00 0.00 42.46 40.43 2pva s ILE 30 CO 0.22 0.56 0.11 -0.63 0.00 0.00 0.00 174.94 175.20 2pva s ILE 31 N 0.09 4.83 -0.21 2.92 1.01 0.61 -2.56 121.20 127.90 2pva s ILE 31 Ca -0.11 -0.00 -0.06 0.00 0.00 0.00 0.00 60.65 60.48 2pva s ILE 31 Cb -0.16 -3.25 -0.03 0.00 0.01 0.00 0.00 42.46 39.04 2pva s ILE 31 CO 0.06 0.35 0.02 0.68 0.00 0.00 0.00 174.94 176.05 2pva s VAL 32 N 1.26 4.13 0.79 2.92 -7.23 0.39 -2.30 120.40 120.35 2pva s VAL 32 Ca 0.06 -0.25 -0.11 0.00 -1.81 0.00 0.00 61.98 59.86 2pva s VAL 32 Cb -0.14 -2.88 0.07 0.00 0.56 0.00 0.00 36.38 33.99 2pva s VAL 32 CO 0.05 0.42 1.15 -2.16 -0.31 0.00 0.00 175.10 174.25 2pva s PRO 33 N 1.01 2.07 0.81 4.82 0.04 -1.26 -1.66 135.00 140.83 2pva s PRO 33 Ca 0.02 0.11 -0.14 0.00 0.04 0.00 0.00 61.00 61.03 2pva s PRO 33 Cb -0.14 -1.98 0.06 0.00 0.04 0.00 0.00 34.50 32.47 2pva s PRO 33 CO 0.02 -1.51 1.01 0.54 0.04 0.00 0.00 177.00 177.11 2pva n ARG 34 N -3.25 0.16 -4.27 4.56 1.74 0.17 -3.54 116.66 112.23 2pva n ARG 34 Ca 0.08 0.12 -0.36 0.00 -0.77 0.00 0.00 57.85 56.92 2pva n ARG 34 Cb 0.61 -2.28 -0.04 0.00 -1.02 0.00 0.00 32.46 29.72 2pva n ARG 34 CO 0.00 0.00 0.00 0.09 -1.52 0.00 0.00 177.63 176.20 2pva n ASN 35 N -2.57 -2.26 -0.00 0.55 3.02 0.56 -4.85 115.26 109.70 2pva n ASN 35 Ca 0.12 -1.08 -0.17 0.00 -0.03 0.00 0.00 54.58 53.42 2pva n ASN 35 Cb 0.51 -2.45 -0.14 0.00 -0.61 0.00 0.00 39.78 37.09 2pva n ASN 35 CO 0.00 0.00 0.00 0.22 -2.62 0.00 0.00 177.26 174.86 2pva h TYR 36 N -1.43 0.31 -0.27 3.10 5.03 -1.78 -3.46 116.97 118.47 2pva h TYR 36 Ca -0.60 -0.23 0.00 0.00 2.58 0.00 0.00 58.73 60.48 2pva h TYR 36 Cb 1.39 -0.01 0.00 0.00 1.55 0.00 0.00 36.73 39.65 2pva h TYR 36 CO 0.62 1.48 0.00 0.41 -1.32 0.00 0.00 178.16 179.36 2pva n GLY 37 N 1.82 -0.12 3.16 1.82 0.00 -1.25 -4.98 105.19 105.64 2pva n GLY 37 Ca -0.26 -1.09 -0.28 0.00 0.00 0.00 0.00 46.02 44.39 2pva n GLY 37 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2pva s ILE 38 N -0.03 1.62 0.93 -0.61 -1.09 -0.05 -4.86 121.20 117.12 2pva s ILE 38 Ca 0.00 -0.81 -0.13 0.00 -2.23 0.00 0.00 60.65 57.49 2pva s ILE 38 Cb 0.00 -1.40 0.15 0.00 -1.58 0.00 0.00 42.46 39.63 2pva s ILE 38 CO 0.00 0.46 1.14 -0.13 -1.23 0.00 0.00 174.94 175.18 2pva s ARG 39 N 0.14 0.97 -0.17 2.79 1.81 -1.26 -0.36 118.95 122.87 2pva s ARG 39 Ca -0.08 0.28 -0.12 0.00 -1.72 0.00 0.00 55.73 54.08 2pva s ARG 39 Cb -0.14 -1.82 -0.07 0.00 -0.45 0.00 0.00 34.95 32.47 2pva s ARG 39 CO 0.04 -2.31 -0.28 1.28 -0.68 0.00 0.00 175.30 173.35 2pva n LEU 40 N -3.84 1.63 -4.51 2.53 4.77 -1.21 -4.86 117.00 111.50 2pva n LEU 40 Ca 0.07 0.27 -0.32 0.00 -0.03 0.00 0.00 56.01 56.00 2pva n LEU 40 Cb 0.59 -0.64 -0.12 0.00 -2.33 0.00 0.00 43.42 40.92 2pva n LEU 40 CO 0.57 0.06 -0.44 -0.76 -1.33 0.00 0.00 177.39 175.49 2pva s LEU 41 N -7.42 2.86 0.38 2.23 1.43 -1.26 -0.83 118.68 116.07 2pva s LEU 41 Ca -0.27 -0.24 0.16 0.00 -1.03 0.00 0.00 54.13 52.76 2pva s LEU 41 Cb 0.08 -1.64 0.76 0.00 0.03 0.00 0.00 46.19 45.42 2pva s LEU 41 CO 0.36 0.30 1.80 -0.08 0.23 0.00 0.00 176.35 178.96 2pva h GLU 42 N 4.84 0.00 0.00 1.70 4.57 -1.93 -3.23 114.58 120.53 2pva h GLU 42 Ca -0.48 0.00 -0.06 0.00 -1.18 0.00 0.00 59.36 57.65 2pva h GLU 42 Cb 1.16 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 29.74 2pva h GLU 42 CO 0.51 0.37 -1.03 0.87 -1.18 0.00 0.00 179.01 178.55 2pva h LYS 43 N 0.00 0.00 -6.00 1.92 1.57 -1.95 -3.47 116.57 108.64 2pva h LYS 43 Ca -0.00 0.00 -0.64 0.00 -1.87 0.00 0.00 60.65 58.14 2pva h LYS 43 Cb 0.75 0.00 -0.07 0.00 0.08 0.00 0.00 32.23 32.99 2pva h LYS 43 CO 0.05 0.11 -0.55 -2.00 -0.57 0.00 0.00 179.45 176.49 2pva s GLU 44 N -3.20 3.18 -0.49 3.15 2.12 -1.22 -5.05 118.70 117.19 2pva s GLU 44 Ca -0.00 -0.51 0.03 0.00 0.36 0.00 0.00 54.97 54.85 2pva s GLU 44 Cb 0.09 -2.91 0.55 0.00 0.26 0.00 0.00 34.13 32.12 2pva s GLU 44 CO 0.79 0.62 1.83 -1.71 -0.54 0.00 0.00 175.26 176.24 2pva n ASN 45 N 0.68 4.95 -4.67 -1.70 2.85 -1.26 -4.50 115.26 111.61 2pva n ASN 45 Ca -0.09 -3.71 -0.41 0.00 -0.11 0.00 0.00 54.58 50.26 2pva n ASN 45 Cb 0.52 -0.82 -0.05 0.00 1.24 0.00 0.00 39.78 40.68 2pva n ASN 45 CO 0.00 0.00 0.00 -0.69 -2.11 0.00 0.00 177.26 174.46 2pva s VAL 46 N -3.91 4.93 0.07 3.44 1.01 -1.26 -5.04 120.40 119.63 2pva s VAL 46 Ca 0.57 1.51 0.05 0.00 0.00 0.00 0.00 61.98 64.11 2pva s VAL 46 Cb 0.47 -4.08 -0.04 0.00 0.00 0.00 0.00 36.38 32.73 2pva s VAL 46 CO 0.04 0.06 -0.05 0.68 0.00 0.00 0.00 175.10 175.84 2pva s VAL 47 N 1.98 3.73 -0.14 2.92 -7.23 -1.26 -3.34 120.40 117.06 2pva s VAL 47 Ca 0.36 -1.00 -0.02 0.00 -1.81 0.00 0.00 61.98 59.51 2pva s VAL 47 Cb -0.16 -2.73 -0.02 0.00 0.56 0.00 0.00 36.38 34.03 2pva s VAL 47 CO 0.12 0.20 -0.09 -0.63 -0.31 0.00 0.00 175.10 174.40 2pva s ILE 48 N -1.19 3.46 0.00 -0.62 -1.09 0.52 -4.86 121.20 117.41 2pva s ILE 48 Ca 0.22 -0.52 -0.30 0.00 -2.23 0.00 0.00 60.65 57.82 2pva s ILE 48 Cb -0.11 -2.48 -0.05 0.00 -1.58 0.00 0.00 42.46 38.23 2pva s ILE 48 CO 0.14 0.51 1.32 0.20 -1.23 0.00 0.00 174.94 175.88 2pva s ASN 49 N 0.32 6.93 -0.17 3.58 -0.87 -1.26 -0.87 114.94 122.60 2pva s ASN 49 Ca -0.07 2.04 -0.22 0.00 -1.57 0.00 0.00 52.86 53.03 2pva s ASN 49 Cb -0.15 -2.56 -0.02 0.00 -0.02 0.00 0.00 41.25 38.49 2pva s ASN 49 CO 0.04 -0.65 0.68 0.54 -2.57 0.00 0.00 177.10 175.14 2pva s ASN 50 N 1.61 6.78 0.22 -1.22 4.22 -1.26 -4.93 114.94 120.35 2pva s ASN 50 Ca 0.61 0.95 -0.05 0.00 -2.14 0.00 0.00 52.86 52.23 2pva s ASN 50 Cb -0.30 -2.38 0.19 0.00 1.28 0.00 0.00 41.25 40.05 2pva s ASN 50 CO 0.26 -0.27 1.66 0.28 -2.04 0.00 0.00 177.10 176.98 2pva h SER 51 N 7.34 0.84 -2.77 3.54 0.02 -1.43 0.16 113.55 121.25 2pva h SER 51 Ca -0.32 -0.27 -0.59 0.00 -0.84 0.00 0.00 61.79 59.77 2pva h SER 51 Cb 1.15 -0.23 -0.09 0.00 0.14 0.00 0.00 62.40 63.37 2pva h SER 51 CO 0.79 0.98 -0.62 -0.31 -1.14 0.00 0.00 176.83 176.52 2pva s TYR 52 N -4.77 2.95 0.20 3.45 2.02 0.00 -4.62 117.35 116.58 2pva s TYR 52 Ca -0.10 -0.10 -0.09 0.00 -0.37 0.00 0.00 57.07 56.42 2pva s TYR 52 Cb 0.13 -1.42 -0.07 0.00 -0.40 0.00 0.00 41.96 40.21 2pva s TYR 52 CO 0.84 0.52 0.50 0.00 -1.57 0.00 0.00 175.55 175.84 2pva s ALA 53 N -1.77 3.63 -0.04 3.71 0.00 -1.26 -4.46 121.76 121.56 2pva s ALA 53 Ca 0.29 -0.34 -0.27 0.00 0.00 0.00 0.00 51.96 51.64 2pva s ALA 53 Cb -0.09 -2.35 0.06 0.00 0.00 0.00 0.00 23.12 20.73 2pva s ALA 53 CO 0.20 0.55 0.59 -0.59 0.00 0.00 0.00 175.76 176.52 2pva s PHE 54 N -1.75 -0.55 0.27 0.00 -0.12 -0.66 -0.91 117.98 114.26 2pva s PHE 54 Ca 0.45 0.93 0.10 0.00 -0.05 0.00 0.00 56.93 58.36 2pva s PHE 54 Cb -0.12 0.33 -0.04 0.00 -0.63 0.00 0.00 43.02 42.56 2pva s PHE 54 CO 0.22 -0.55 -0.01 0.08 -0.05 0.00 0.00 175.22 174.90 2pva s VAL 55 N -1.20 3.40 0.00 -2.49 1.01 -0.37 -0.46 120.40 120.29 2pva s VAL 55 Ca -0.11 -1.94 0.00 0.00 0.00 0.00 0.00 61.98 59.93 2pva s VAL 55 Cb -0.01 -2.82 0.00 0.00 0.00 0.00 0.00 36.38 33.55 2pva s VAL 55 CO 0.08 -0.38 0.00 0.61 0.00 0.00 0.00 175.10 175.42 2pva n GLY 56 N -0.88 0.12 3.79 4.51 0.00 -1.06 -0.86 105.19 110.80 2pva n GLY 56 Ca -0.06 -1.13 -0.39 0.00 0.00 0.00 0.00 46.02 44.44 2pva n GLY 56 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 2pva s MET 57 N -2.00 4.47 0.00 1.61 -2.45 -1.05 -1.13 119.30 118.75 2pva s MET 57 Ca 0.00 1.07 0.00 0.00 -1.25 0.00 0.00 55.69 55.51 2pva s MET 57 Cb 0.00 -3.16 0.00 0.00 1.25 0.00 0.00 34.83 32.92 2pva s MET 57 CO 0.00 0.53 0.00 0.41 1.05 0.00 0.00 175.02 177.01 2pva n GLY 58 N 1.37 1.17 3.03 2.11 0.00 -0.64 -0.12 105.19 112.11 2pva n GLY 58 Ca -0.05 -0.63 -0.10 0.00 0.00 0.00 0.00 46.02 45.24 2pva n GLY 58 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2pva s SER 59 N 1.94 0.16 0.00 1.61 0.15 -0.01 -1.16 113.70 116.40 2pva s SER 59 Ca 0.00 -0.39 0.07 0.00 0.70 0.00 0.00 55.95 56.33 2pva s SER 59 Cb 0.00 0.14 0.18 0.00 -1.71 0.00 0.00 66.02 64.63 2pva s SER 59 CO 0.00 -0.33 1.13 0.35 1.20 0.00 0.00 173.24 175.59 2pva n THR 60 N 1.53 0.93 -0.04 6.45 -2.24 -1.26 -0.86 114.28 118.79 2pva n THR 60 Ca -0.23 -0.97 -0.00 0.00 -2.27 0.00 0.00 64.05 60.58 2pva n THR 60 Cb 0.55 0.55 0.28 0.00 -2.10 0.00 0.00 70.33 69.61 2pva n THR 60 CO 0.00 0.00 0.00 0.44 -0.57 0.00 0.00 175.07 174.94 2pva h ASP 61 N 1.27 0.58 -3.62 3.42 3.45 -1.90 -3.44 116.42 116.18 2pva h ASP 61 Ca 0.00 -0.09 -0.00 0.00 0.43 0.00 0.00 57.03 57.37 2pva h ASP 61 Cb 0.62 -0.15 0.00 0.00 -0.56 0.00 0.00 39.33 39.24 2pva h ASP 61 CO 0.00 0.59 0.00 2.30 -1.57 0.00 0.00 179.24 180.56 2pva n ILE 62 N -4.31 0.00 0.00 0.35 -5.35 -1.26 -5.04 119.36 103.76 2pva n ILE 62 Ca 0.03 -0.00 0.00 0.00 -0.27 0.00 0.00 62.75 62.50 2pva n ILE 62 Cb 0.21 -1.19 0.00 0.00 -1.74 0.00 0.00 39.64 36.92 2pva n ILE 62 CO 0.00 0.00 0.00 0.41 -1.76 0.00 0.00 176.55 175.20 2pva n THR 63 N -1.19 0.00 -1.73 7.28 -1.04 -1.26 -4.69 114.28 111.64 2pva n THR 63 Ca 0.00 1.32 -0.31 0.00 -2.04 0.00 0.00 64.05 63.02 2pva n THR 63 Cb 0.00 -2.31 0.03 0.00 -1.82 0.00 0.00 70.33 66.23 2pva n THR 63 CO 0.00 0.00 0.00 -0.44 -0.64 0.00 0.00 175.07 173.99 2pva s SER 64 N -2.00 5.72 0.22 8.00 0.01 -1.26 -5.00 113.70 119.38 2pva s SER 64 Ca 0.00 1.47 -0.30 0.00 1.31 0.00 0.00 55.95 58.43 2pva s SER 64 Cb 0.00 -2.41 -0.09 0.00 0.21 0.00 0.00 66.02 63.73 2pva s SER 64 CO 0.00 -1.21 1.36 -2.84 0.41 0.00 0.00 173.24 170.96 2pva s PRO 65 N -5.14 4.34 -0.21 12.44 0.02 -1.26 -4.86 135.00 140.33 2pva s PRO 65 Ca 0.57 2.14 -0.08 0.00 0.02 0.00 0.00 61.00 63.65 2pva s PRO 65 Cb -0.12 -3.16 -0.04 0.00 0.02 0.00 0.00 34.50 31.19 2pva s PRO 65 CO 0.54 -0.32 0.08 0.14 -0.33 0.00 0.00 177.00 177.12 2pva s VAL 66 N 0.08 4.77 -0.15 3.83 -7.23 -0.04 -4.88 120.40 116.79 2pva s VAL 66 Ca 0.58 -0.03 -0.05 0.00 -1.81 0.00 0.00 61.98 60.66 2pva s VAL 66 Cb -0.38 -3.18 -0.04 0.00 0.56 0.00 0.00 36.38 33.34 2pva s VAL 66 CO 0.40 0.41 0.03 -0.76 -0.31 0.00 0.00 175.10 174.87 2pva s LEU 67 N 0.79 3.65 0.05 1.32 1.02 -1.26 -0.82 118.68 123.42 2pva s LEU 67 Ca 0.04 0.06 -0.00 0.00 0.02 0.00 0.00 54.13 54.26 2pva s LEU 67 Cb -0.13 -1.89 -0.26 0.00 0.02 0.00 0.00 46.19 43.93 2pva s LEU 67 CO 0.02 0.23 1.02 1.88 0.02 0.00 0.00 176.35 179.52 2pva h TYR 68 N 6.25 0.33 -3.09 0.29 0.05 -0.90 -3.41 116.97 116.48 2pva h TYR 68 Ca -0.40 -0.24 0.04 0.00 0.05 0.00 0.00 58.73 58.18 2pva h TYR 68 Cb 1.18 -0.01 -0.07 0.00 1.01 0.00 0.00 36.73 38.84 2pva h TYR 68 CO 0.58 1.24 0.18 0.16 -1.05 0.00 0.00 178.16 179.26 2pva s ASP 69 N -6.90 -0.28 0.00 3.88 1.47 -1.21 -1.72 116.67 111.91 2pva s ASP 69 Ca -0.05 -0.57 0.00 0.00 1.18 0.00 0.00 52.55 53.11 2pva s ASP 69 Cb 0.08 0.69 0.00 0.00 -0.34 0.00 0.00 42.92 43.35 2pva s ASP 69 CO 0.85 -1.26 0.00 0.61 0.68 0.00 0.00 175.17 176.05 2pva n GLY 70 N -0.43 -2.11 3.10 2.12 0.00 -0.84 -2.52 105.19 104.50 2pva n GLY 70 Ca -0.06 -1.20 -0.21 0.00 0.00 0.00 0.00 46.02 44.56 2pva n GLY 70 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2pva s VAL 71 N -2.26 1.01 0.52 1.61 1.01 -0.04 -1.56 120.40 120.68 2pva s VAL 71 Ca 0.00 -0.67 0.09 0.00 0.00 0.00 0.00 61.98 61.40 2pva s VAL 71 Cb 0.00 -0.87 0.05 0.00 0.00 0.00 0.00 36.38 35.56 2pva s VAL 71 CO 0.00 0.19 0.65 0.54 0.00 0.00 0.00 175.10 176.49 2pva s ASN 72 N -0.54 5.19 0.17 3.32 2.20 -0.64 -1.24 114.94 123.41 2pva s ASN 72 Ca 0.04 -0.77 0.19 0.00 -0.94 0.00 0.00 52.86 51.37 2pva s ASN 72 Cb -0.06 -0.02 0.83 0.00 -2.00 0.00 0.00 41.25 40.01 2pva s ASN 72 CO 0.00 -1.10 1.58 -1.84 -2.94 0.00 0.00 177.10 172.80 2pva n GLU 73 N -2.03 0.12 -0.34 3.55 0.28 -0.09 -2.39 120.64 119.74 2pva n GLU 73 Ca 0.11 0.41 0.12 0.00 -0.16 0.00 0.00 57.16 57.63 2pva n GLU 73 Cb 0.61 -1.75 0.31 0.00 1.43 0.00 0.00 31.44 32.04 2pva n GLU 73 CO 0.00 0.00 0.00 1.63 -0.16 0.00 0.00 177.13 178.60 2pva n LYS 74 N -1.97 2.70 -0.57 3.44 4.76 -1.26 -4.96 118.16 120.29 2pva n LYS 74 Ca 0.02 -2.60 0.00 0.00 -2.87 0.00 0.00 58.31 52.86 2pva n LYS 74 Cb 0.17 -1.56 0.00 0.00 -1.84 0.00 0.00 35.03 31.80 2pva n LYS 74 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2pva n GLY 75 N 1.61 0.91 3.73 0.72 0.00 -1.01 -4.67 105.19 106.49 2pva n GLY 75 Ca 0.24 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.84 2pva n GLY 75 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2pva s LEU 76 N 0.00 4.42 0.14 0.99 0.20 -1.26 -3.07 118.68 120.09 2pva s LEU 76 Ca 0.00 2.33 0.07 0.00 0.69 0.00 0.00 54.13 57.22 2pva s LEU 76 Cb 0.00 -3.61 -0.04 0.00 -0.43 0.00 0.00 46.19 42.12 2pva s LEU 76 CO 0.00 -0.49 -0.17 -0.04 -0.29 0.00 0.00 176.35 175.36 2pva s MET 77 N -0.02 1.13 0.03 1.98 -1.94 0.28 -1.62 119.30 119.14 2pva s MET 77 Ca 0.56 -1.29 -0.29 0.00 -1.71 0.00 0.00 55.69 52.96 2pva s MET 77 Cb -0.35 -1.14 0.10 0.00 2.01 0.00 0.00 34.83 35.45 2pva s MET 77 CO 0.37 0.23 1.13 0.20 -0.01 0.00 0.00 175.02 176.94 2pva s GLY 78 N -2.46 -0.34 0.00 -0.03 0.00 -0.60 -1.50 107.32 102.40 2pva s GLY 78 Ca 0.11 0.62 -0.23 0.00 0.00 0.00 0.00 44.72 45.22 2pva s GLY 78 CO 0.05 0.14 0.51 0.00 0.00 0.00 0.00 173.10 173.80 2pva s ALA 79 N -2.78 -1.31 -0.24 3.20 0.00 -0.00 -1.99 121.76 118.63 2pva s ALA 79 Ca 0.12 0.73 -0.08 0.00 0.00 0.00 0.00 51.96 52.74 2pva s ALA 79 Cb 0.02 0.20 -0.03 0.00 0.00 0.00 0.00 23.12 23.30 2pva s ALA 79 CO -0.02 -0.41 0.09 0.00 0.00 0.00 0.00 175.76 175.42 2pva s MET 80 N -1.82 3.76 0.18 0.00 0.23 -0.70 -1.29 119.30 119.65 2pva s MET 80 Ca -0.09 -0.43 0.10 0.00 -1.03 0.00 0.00 55.69 54.24 2pva s MET 80 Cb -0.01 -3.35 -0.04 0.00 -1.53 0.00 0.00 34.83 29.89 2pva s MET 80 CO 0.03 -0.10 -0.22 -0.51 -2.03 0.00 0.00 175.02 172.19 2pva s LEU 81 N 1.40 2.43 0.28 0.18 1.02 0.14 -4.92 118.68 119.20 2pva s LEU 81 Ca 0.06 -0.86 -0.30 0.00 0.02 0.00 0.00 54.13 53.05 2pva s LEU 81 Cb -0.15 -1.04 -0.12 0.00 0.02 0.00 0.00 46.19 44.90 2pva s LEU 81 CO 0.04 0.07 1.54 0.00 0.02 0.00 0.00 176.35 178.02 2pva n TYR 82 N 0.32 2.67 -3.01 0.29 9.36 -1.26 0.82 117.16 126.34 2pva n TYR 82 Ca -0.13 0.31 -0.16 0.00 3.32 0.00 0.00 57.90 61.24 2pva n TYR 82 Cb 0.56 -2.56 -0.01 0.00 -0.63 0.00 0.00 39.34 36.70 2pva n TYR 82 CO 0.00 0.00 0.00 0.98 0.22 0.00 0.00 176.86 178.06 2pva n TYR 83 N 2.00 0.74 -1.66 2.98 9.36 -0.58 -4.15 117.16 125.85 2pva n TYR 83 Ca 0.09 -3.52 -0.45 0.00 3.32 0.00 0.00 57.90 57.34 2pva n TYR 83 Cb 0.35 -0.40 -0.03 0.00 -0.63 0.00 0.00 39.34 38.63 2pva n TYR 83 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 2pva n ALA 84 N 0.14 0.79 -0.94 2.98 0.00 -1.26 -1.75 120.51 120.47 2pva n ALA 84 Ca 0.21 0.42 0.00 0.00 0.00 0.00 0.00 53.44 54.07 2pva n ALA 84 Cb 0.69 -2.23 0.00 0.00 0.00 0.00 0.00 19.45 17.91 2pva n ALA 84 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 2pva n THR 85 N 1.71 0.00 0.00 0.00 -2.24 -1.26 -4.71 114.28 107.78 2pva n THR 85 Ca 0.12 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.90 2pva n THR 85 Cb 0.31 -0.53 0.00 0.00 -2.10 0.00 0.00 70.33 68.00 2pva n THR 85 CO 0.00 0.00 0.00 0.49 -0.57 0.00 0.00 175.07 174.99 2pva n PHE 86 N -2.32 0.00 -1.71 4.78 3.01 -0.80 -5.02 117.46 115.40 2pva n PHE 86 Ca 0.00 0.00 -0.42 0.00 1.01 0.00 0.00 57.45 58.04 2pva n PHE 86 Cb 0.24 0.00 -0.03 0.00 -0.01 0.00 0.00 39.48 39.68 2pva n PHE 86 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 2pva s ALA 87 N -1.81 3.67 -0.12 4.37 0.00 -0.72 -4.17 121.76 122.98 2pva s ALA 87 Ca 0.00 1.37 0.01 0.00 0.00 0.00 0.00 51.96 53.34 2pva s ALA 87 Cb 0.00 -3.80 0.02 0.00 0.00 0.00 0.00 23.12 19.33 2pva s ALA 87 CO 0.00 -1.40 -0.15 0.95 0.00 0.00 0.00 175.76 175.16 2pva s THR 88 N 3.62 1.53 0.38 0.00 -4.23 0.12 -4.89 115.64 112.16 2pva s THR 88 Ca 0.84 -0.64 0.08 0.00 -1.18 0.00 0.00 61.69 60.79 2pva s THR 88 Cb -0.44 -1.41 -0.03 0.00 1.34 0.00 0.00 72.50 71.96 2pva s THR 88 CO 0.39 0.45 0.31 -0.31 -0.54 0.00 0.00 174.62 174.92 2pva s TYR 89 N 1.16 2.79 0.25 3.99 2.02 -1.26 -4.55 117.35 121.75 2pva s TYR 89 Ca -0.03 -0.40 0.06 0.00 -0.37 0.00 0.00 57.07 56.33 2pva s TYR 89 Cb -0.14 -1.96 -0.03 0.00 -0.40 0.00 0.00 41.96 39.43 2pva s TYR 89 CO -0.05 0.06 0.26 0.00 -1.57 0.00 0.00 175.55 174.25 2pva s ALA 90 N -2.40 3.72 -0.12 3.71 0.00 -0.96 -4.76 121.76 120.96 2pva s ALA 90 Ca 0.44 -1.35 -0.12 0.00 0.00 0.00 0.00 51.96 50.93 2pva s ALA 90 Cb -0.04 -1.47 -0.26 0.00 0.00 0.00 0.00 23.12 21.35 2pva s ALA 90 CO 0.27 0.24 0.44 -0.44 0.00 0.00 0.00 175.76 176.27 2pva h ASP 91 N 1.36 0.37 -4.36 0.00 3.32 -1.95 0.28 116.42 115.43 2pva h ASP 91 Ca -0.50 -0.86 -0.63 0.00 0.02 0.00 0.00 57.03 55.06 2pva h ASP 91 Cb 1.24 -0.12 -0.27 0.00 0.22 0.00 0.00 39.33 40.39 2pva h ASP 91 CO 0.61 1.73 -0.86 -1.61 -1.72 0.00 0.00 179.24 177.38 2pva s GLU 92 N -2.51 1.67 0.30 3.56 0.41 -1.26 -4.77 118.70 116.11 2pva s GLU 92 Ca -0.22 -0.94 -0.30 0.00 -0.41 0.00 0.00 54.97 53.10 2pva s GLU 92 Cb 0.06 -1.74 -0.12 0.00 -1.78 0.00 0.00 34.13 30.55 2pva s GLU 92 CO 0.75 0.46 1.51 -0.35 -0.49 0.00 0.00 175.26 177.14 2pva n PRO 93 N 2.07 2.51 -1.88 0.39 -0.04 -1.26 -4.95 135.00 131.84 2pva n PRO 93 Ca -0.16 0.89 -0.37 0.00 -0.04 0.00 0.00 63.50 63.82 2pva n PRO 93 Cb 0.52 -2.62 0.05 0.00 -0.04 0.00 0.00 33.50 31.41 2pva n PRO 93 CO 0.00 0.00 0.00 0.21 -0.04 0.00 0.00 175.50 175.67 2pva s LYS 94 N -0.92 2.82 0.20 0.54 2.20 -1.26 -4.89 119.74 118.43 2pva s LYS 94 Ca 0.62 1.97 -0.31 0.00 -0.36 0.00 0.00 55.97 57.89 2pva s LYS 94 Cb -0.53 -1.93 -0.09 0.00 -1.51 0.00 0.00 37.83 33.77 2pva s LYS 94 CO 0.53 -1.36 1.44 -1.59 -0.36 0.00 0.00 175.35 174.01 2pva s LYS 95 N -3.30 4.28 0.00 4.03 0.00 -1.26 -2.98 119.74 120.52 2pva s LYS 95 Ca 0.79 2.23 0.00 0.00 0.00 0.00 0.00 55.97 58.99 2pva s LYS 95 Cb -0.34 -3.16 0.00 0.00 0.00 0.00 0.00 37.83 34.33 2pva s LYS 95 CO 0.37 -0.44 0.00 0.41 0.00 0.00 0.00 175.35 175.69 2pva n GLY 96 N 2.84 0.88 3.17 0.59 0.00 -1.26 -5.07 105.19 106.34 2pva n GLY 96 Ca 0.09 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 46.01 2pva n GLY 96 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2pva s THR 97 N -2.04 0.44 0.12 2.61 -4.23 -1.16 -4.88 115.64 106.49 2pva s THR 97 Ca 0.00 -1.91 0.05 0.00 -1.18 0.00 0.00 61.69 58.64 2pva s THR 97 Cb 0.00 -1.86 -0.04 0.00 1.34 0.00 0.00 72.50 71.94 2pva s THR 97 CO 0.00 -0.69 0.06 -0.89 -0.54 0.00 0.00 174.62 172.56 2pva s THR 98 N -3.81 4.26 0.26 3.99 2.01 -0.34 -4.73 115.64 117.28 2pva s THR 98 Ca 0.17 -1.00 -0.29 0.00 0.31 0.00 0.00 61.69 60.88 2pva s THR 98 Cb 0.07 -3.09 -0.09 0.00 0.01 0.00 0.00 72.50 69.40 2pva s THR 98 CO -0.02 0.04 0.95 -0.83 -0.69 0.00 0.00 174.62 174.07 2pva s GLY 99 N -2.61 3.07 -0.02 4.40 0.00 -1.26 -0.91 107.32 110.00 2pva s GLY 99 Ca 0.28 0.63 -0.00 0.00 0.00 0.00 0.00 44.72 45.63 2pva s GLY 99 CO 0.21 1.18 0.03 -1.50 0.00 0.00 0.00 173.10 173.02 2pva s ILE 100 N -1.24 -0.03 0.12 0.90 2.07 -0.62 -4.43 121.20 117.98 2pva s ILE 100 Ca 0.43 0.10 -0.30 0.00 -1.41 0.00 0.00 60.65 59.46 2pva s ILE 100 Cb -0.25 -0.06 -0.07 0.00 0.13 0.00 0.00 42.46 42.20 2pva s ILE 100 CO 0.32 0.04 1.24 0.21 -1.91 0.00 0.00 174.94 174.84 2pva s ASN 101 N 0.49 7.02 0.57 4.50 3.84 -0.01 -2.07 114.94 129.28 2pva s ASN 101 Ca -0.04 2.18 0.31 0.00 0.21 0.00 0.00 52.86 55.52 2pva s ASN 101 Cb -0.06 -2.59 1.42 0.00 -0.55 0.00 0.00 41.25 39.47 2pva s ASN 101 CO -0.02 -0.48 1.78 -0.65 -2.79 0.00 0.00 177.10 174.95 2pva h PRO 102 N 6.15 0.00 -0.00 0.43 0.11 -1.87 0.15 132.00 136.97 2pva h PRO 102 Ca -0.43 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.68 2pva h PRO 102 Cb 1.21 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.32 2pva h PRO 102 CO 0.80 0.00 -0.16 1.55 -0.21 0.00 0.00 178.00 179.97 2pva n VAL 103 N -3.82 0.00 0.48 3.15 3.14 -1.26 -3.51 118.33 116.50 2pva n VAL 103 Ca 0.16 -0.07 0.08 0.00 -2.96 0.00 0.00 64.34 61.55 2pva n VAL 103 Cb 0.98 0.04 0.10 0.00 -1.06 0.00 0.00 33.84 33.90 2pva n VAL 103 CO 0.00 0.00 0.00 -1.22 -6.46 0.00 0.00 176.83 169.15 2pva n TYR 104 N -0.91 0.13 -0.24 1.45 4.01 0.53 -4.53 117.16 117.60 2pva n TYR 104 Ca 0.13 -0.10 -0.03 0.00 -0.16 0.00 0.00 57.90 57.74 2pva n TYR 104 Cb 0.30 -0.00 0.16 0.00 -0.31 0.00 0.00 39.34 39.48 2pva n TYR 104 CO 0.00 0.00 0.00 0.28 -0.46 0.00 0.00 176.86 176.68 2pva h VAL 105 N 3.06 1.23 0.17 -0.72 2.07 -1.61 -0.85 116.25 119.60 2pva h VAL 105 Ca 0.00 -0.65 -0.01 0.00 0.82 0.00 0.00 66.70 66.87 2pva h VAL 105 Cb 0.69 0.27 0.00 0.00 -1.52 0.00 0.00 31.29 30.74 2pva h VAL 105 CO 0.00 0.28 -0.08 0.40 0.02 0.00 0.00 177.57 178.18 2pva h ILE 106 N 1.05 0.96 -0.38 4.57 1.08 -1.83 -2.17 117.51 120.78 2pva h ILE 106 Ca 0.26 -0.78 0.08 0.00 -0.39 0.00 0.00 64.86 64.03 2pva h ILE 106 Cb 0.10 1.41 -0.07 0.00 -3.07 0.00 0.00 36.82 35.19 2pva h ILE 106 CO -0.03 0.17 -0.07 0.28 -0.69 0.00 0.00 178.15 177.81 2pva h SER 107 N -0.62 -0.30 -0.49 1.72 0.02 -1.79 -0.53 113.55 111.58 2pva h SER 107 Ca -0.02 0.11 -0.03 0.00 -0.84 0.00 0.00 61.79 61.01 2pva h SER 107 Cb 0.46 0.21 -0.03 0.00 0.14 0.00 0.00 62.40 63.19 2pva h SER 107 CO 0.04 -0.10 0.21 1.56 -1.14 0.00 0.00 176.83 177.39 2pva h GLN 108 N 0.03 0.77 0.01 3.45 1.08 -1.11 -2.10 115.11 117.23 2pva h GLN 108 Ca 0.19 -0.11 -0.06 0.00 -1.45 0.00 0.00 58.65 57.21 2pva h GLN 108 Cb 0.28 -0.14 0.01 0.00 -0.05 0.00 0.00 27.48 27.58 2pva h GLN 108 CO -0.37 0.63 -0.24 0.28 -0.95 0.00 0.00 178.83 178.18 2pva h VAL 109 N 0.76 1.57 -0.79 -0.54 2.07 -0.56 -3.01 116.25 115.76 2pva h VAL 109 Ca 0.18 -2.01 0.05 0.00 0.82 0.00 0.00 66.70 65.74 2pva h VAL 109 Cb 0.16 2.86 -0.05 0.00 -1.52 0.00 0.00 31.29 32.74 2pva h VAL 109 CO -0.02 0.55 0.52 -0.07 0.02 0.00 0.00 177.57 178.57 2pva h LEU 110 N -0.56 0.79 -0.83 2.57 4.07 -1.19 -0.06 115.31 120.10 2pva h LEU 110 Ca -0.03 -0.00 -0.02 0.00 0.08 0.00 0.00 57.88 57.90 2pva h LEU 110 Cb 1.02 -0.17 -0.00 0.00 1.08 0.00 0.00 40.66 42.59 2pva h LEU 110 CO 0.05 0.53 -0.11 1.23 -1.08 0.00 0.00 178.44 179.05 2pva h GLY 111 N 0.91 0.00 0.00 0.83 0.00 -1.40 -3.38 103.07 100.03 2pva h GLY 111 Ca 0.33 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.66 2pva h GLY 111 CO -0.10 0.00 0.00 0.70 0.00 0.00 0.00 176.54 177.14 2pva n ASN 112 N -3.19 0.69 -4.26 0.19 4.13 -0.90 -0.82 115.26 111.10 2pva n ASN 112 Ca 0.01 -1.27 -0.19 0.00 1.68 0.00 0.00 54.58 54.82 2pva n ASN 112 Cb 0.44 0.00 -0.11 0.00 -1.54 0.00 0.00 39.78 38.57 2pva n ASN 112 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 2pva n VAL 114 N 0.45 0.18 -4.10 0.00 0.31 -1.26 -4.78 118.33 109.14 2pva n VAL 114 Ca -0.15 -0.05 -0.25 0.00 -0.01 0.00 0.00 64.34 63.88 2pva n VAL 114 Cb 0.57 -1.23 -0.05 0.00 -0.91 0.00 0.00 33.84 32.21 2pva n VAL 114 CO 0.00 0.00 0.00 -0.89 -1.32 0.00 0.00 176.83 174.62 2pva s THR 115 N -2.06 4.46 0.35 2.52 2.01 -1.26 -4.14 115.64 117.52 2pva s THR 115 Ca -0.04 -1.18 0.07 0.00 0.31 0.00 0.00 61.69 60.85 2pva s THR 115 Cb 0.02 -3.31 0.13 0.00 0.01 0.00 0.00 72.50 69.35 2pva s THR 115 CO 0.06 -0.18 1.86 -0.37 -0.69 0.00 0.00 174.62 175.30 2pva h VAL 116 N 1.90 1.21 -0.07 3.82 -1.51 -1.95 -0.91 116.25 118.74 2pva h VAL 116 Ca -0.48 -0.93 -0.08 0.00 -1.23 0.00 0.00 66.70 63.98 2pva h VAL 116 Cb 1.21 1.24 -0.01 0.00 -2.13 0.00 0.00 31.29 31.60 2pva h VAL 116 CO 0.62 0.29 -0.33 0.44 -1.23 0.00 0.00 177.57 177.37 2pva h ASP 117 N 0.29 0.13 -0.33 4.19 3.32 -1.99 -2.69 116.42 119.35 2pva h ASP 117 Ca 0.06 -0.04 -0.03 0.00 0.02 0.00 0.00 57.03 57.03 2pva h ASP 117 Cb 0.45 -0.03 -0.01 0.00 0.22 0.00 0.00 39.33 39.95 2pva h ASP 117 CO 0.03 0.45 0.07 0.44 -1.72 0.00 0.00 179.24 178.51 2pva h ASP 118 N 0.11 0.51 -0.34 6.45 3.32 -1.58 -2.39 116.42 122.51 2pva h ASP 118 Ca 0.01 -0.24 0.07 0.00 0.02 0.00 0.00 57.03 56.89 2pva h ASP 118 Cb 0.64 -0.13 -0.06 0.00 0.22 0.00 0.00 39.33 39.99 2pva h ASP 118 CO 0.05 0.62 -0.09 0.58 -1.72 0.00 0.00 179.24 178.68 2pva h VAL 119 N 0.38 0.65 -0.42 -1.35 2.07 -1.12 0.11 116.25 116.58 2pva h VAL 119 Ca 0.10 0.00 0.06 0.00 0.82 0.00 0.00 66.70 67.68 2pva h VAL 119 Cb 0.32 0.65 -0.05 0.00 -1.52 0.00 0.00 31.29 30.69 2pva h VAL 119 CO 0.00 0.00 0.12 0.40 0.02 0.00 0.00 177.57 178.11 2pva h ILE 120 N -0.01 0.83 0.14 4.57 2.04 -1.35 -1.43 117.51 122.31 2pva h ILE 120 Ca 0.16 -0.09 -0.01 0.00 1.00 0.00 0.00 64.86 65.93 2pva h ILE 120 Cb 0.25 0.54 0.00 0.00 -0.74 0.00 0.00 36.82 36.88 2pva h ILE 120 CO -0.35 0.05 -0.07 -0.33 0.00 0.00 0.00 178.15 177.45 2pva h GLU 121 N 0.26 -0.18 -0.11 2.37 5.08 -0.77 -2.87 114.58 118.36 2pva h GLU 121 Ca 0.20 0.01 0.02 0.00 -1.00 0.00 0.00 59.36 58.59 2pva h GLU 121 Cb 0.21 0.04 -0.04 0.00 0.50 0.00 0.00 28.75 29.47 2pva h GLU 121 CO -0.23 -0.05 -0.28 0.87 -1.00 0.00 0.00 179.01 178.32 2pva h LYS 122 N -0.27 -0.26 -0.17 2.33 1.79 -0.35 -2.08 116.57 117.56 2pva h LYS 122 Ca -0.02 0.02 0.05 0.00 -2.18 0.00 0.00 60.65 58.52 2pva h LYS 122 Cb 0.22 0.06 -0.01 0.00 -1.58 0.00 0.00 32.23 30.92 2pva h LYS 122 CO 0.03 -0.18 0.53 -0.07 -1.08 0.00 0.00 179.45 178.68 2pva h LEU 123 N -0.27 0.00 -0.16 2.94 -0.00 -1.30 -1.81 115.31 114.71 2pva h LEU 123 Ca 0.02 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 57.90 2pva h LEU 123 Cb 0.34 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 41.00 2pva h LEU 123 CO -0.25 0.00 0.00 0.41 -0.00 0.00 0.00 178.44 178.60 2pva n THR 124 N -3.04 0.65 -0.09 0.22 -1.04 -0.78 -2.87 114.28 107.32 2pva n THR 124 Ca 0.02 0.11 0.03 0.00 -2.04 0.00 0.00 64.05 62.17 2pva n THR 124 Cb 0.61 -0.85 0.09 0.00 -1.82 0.00 0.00 70.33 68.36 2pva n THR 124 CO 0.00 0.00 0.00 -1.54 -0.64 0.00 0.00 175.07 172.89 2pva n SER 125 N -1.77 2.51 -4.60 8.00 3.41 -0.68 -4.95 113.62 115.54 2pva n SER 125 Ca 0.04 -1.98 -0.24 0.00 -0.26 0.00 0.00 58.87 56.43 2pva n SER 125 Cb 0.26 -0.13 -0.08 0.00 -0.26 0.00 0.00 64.21 64.00 2pva n SER 125 CO 0.00 0.00 0.00 -0.31 -0.16 0.00 0.00 175.04 174.57 2pva s TYR 126 N -0.99 2.55 -0.19 7.33 2.02 -1.14 -1.20 117.35 125.74 2pva s TYR 126 Ca 0.13 -0.30 -0.03 0.00 -0.37 0.00 0.00 57.07 56.50 2pva s TYR 126 Cb 0.07 -1.21 0.06 0.00 -0.40 0.00 0.00 41.96 40.47 2pva s TYR 126 CO 0.09 0.61 0.03 0.99 -1.57 0.00 0.00 175.55 175.70 2pva s THR 127 N -2.42 0.57 0.29 -0.71 2.01 -0.09 -4.78 115.64 110.51 2pva s THR 127 Ca 0.32 -0.55 -0.29 0.00 0.31 0.00 0.00 61.69 61.48 2pva s THR 127 Cb -0.04 -1.04 -0.10 0.00 0.01 0.00 0.00 72.50 71.32 2pva s THR 127 CO 0.18 -0.17 1.40 -0.76 -0.69 0.00 0.00 174.62 174.59 2pva s LEU 128 N 1.84 4.39 0.30 4.42 1.02 -1.26 -1.58 118.68 127.80 2pva s LEU 128 Ca -0.01 2.73 0.10 0.00 0.02 0.00 0.00 54.13 56.97 2pva s LEU 128 Cb -0.17 -3.64 -0.06 0.00 0.02 0.00 0.00 46.19 42.35 2pva s LEU 128 CO -0.08 -0.67 -0.14 -0.76 0.02 0.00 0.00 176.35 174.73 2pva s LEU 129 N -1.08 2.63 -0.33 1.79 1.43 -0.88 -2.26 118.68 119.98 2pva s LEU 129 Ca 0.55 -1.11 -0.05 0.00 -1.03 0.00 0.00 54.13 52.48 2pva s LEU 129 Cb -0.42 -0.96 -0.11 0.00 0.03 0.00 0.00 46.19 44.73 2pva s LEU 129 CO 0.49 -0.12 3.20 -3.20 0.23 0.00 0.00 176.35 176.95 2pva n ASN 130 N -0.66 6.05 -4.75 2.29 4.05 0.97 -4.35 115.26 118.86 2pva n ASN 130 Ca -0.05 -2.80 -0.37 0.00 0.45 0.00 0.00 54.58 51.81 2pva n ASN 130 Cb 0.62 -1.35 -0.07 0.00 1.23 0.00 0.00 39.78 40.21 2pva n ASN 130 CO 0.00 0.00 0.00 -0.70 -3.05 0.00 0.00 177.26 173.51 2pva s GLU 131 N -0.12 4.18 0.63 1.20 2.12 -1.26 -4.86 118.70 120.60 2pva s GLU 131 Ca 0.63 0.15 -0.10 0.00 0.36 0.00 0.00 54.97 56.01 2pva s GLU 131 Cb 0.33 -3.39 0.15 0.00 0.26 0.00 0.00 34.13 31.48 2pva s GLU 131 CO -0.10 0.31 0.86 0.00 -0.54 0.00 0.00 175.26 175.80 2pva n ALA 132 N 3.29 -0.96 -2.92 6.30 0.00 -1.26 -4.19 120.51 120.77 2pva n ALA 132 Ca -0.12 -1.14 -0.11 0.00 0.00 0.00 0.00 53.44 52.07 2pva n ALA 132 Cb 0.52 -0.05 -0.08 0.00 0.00 0.00 0.00 19.45 19.85 2pva n ALA 132 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 2pva s ASN 133 N -4.16 -0.05 0.39 0.00 2.20 -1.26 -4.84 114.94 107.23 2pva s ASN 133 Ca 0.49 -0.29 0.18 0.00 -0.94 0.00 0.00 52.86 52.30 2pva s ASN 133 Cb -0.01 0.33 0.80 0.00 -2.00 0.00 0.00 41.25 40.36 2pva s ASN 133 CO 0.34 -0.60 1.81 0.40 -2.94 0.00 0.00 177.10 176.12 2pva h ILE 134 N 3.29 1.00 0.00 0.54 5.03 -1.94 0.21 117.51 125.64 2pva h ILE 134 Ca -0.32 -1.33 -0.15 0.00 -0.12 0.00 0.00 64.86 62.95 2pva h ILE 134 Cb 1.20 1.77 -0.02 0.00 -3.03 0.00 0.00 36.82 36.74 2pva h ILE 134 CO 0.47 0.34 -0.69 0.16 -0.68 0.00 0.00 178.15 177.75 2pva h ILE 135 N 0.00 1.46 0.00 -0.67 3.07 -1.96 -3.36 117.51 116.05 2pva h ILE 135 Ca -0.00 -2.41 -0.13 0.00 1.55 0.00 0.00 64.86 63.87 2pva h ILE 135 Cb 0.74 2.31 -0.02 0.00 -0.27 0.00 0.00 36.82 39.58 2pva h ILE 135 CO 0.05 0.68 -1.50 0.18 -1.05 0.00 0.00 178.15 176.51 2pva n LEU 136 N -3.65 0.00 0.00 0.16 4.77 -1.15 -5.02 117.00 112.11 2pva n LEU 136 Ca -0.01 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.97 2pva n LEU 136 Cb 0.69 0.17 0.00 0.00 -2.33 0.00 0.00 43.42 41.96 2pva n LEU 136 CO 0.43 0.17 0.00 0.61 -1.33 0.00 0.00 177.39 177.27 2pva n GLY 137 N 2.53 1.63 3.41 -0.72 0.00 0.72 -5.00 105.19 107.75 2pva n GLY 137 Ca -0.12 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.81 2pva n GLY 137 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 2pva s PHE 138 N -2.36 0.03 -0.18 1.61 -0.71 -1.25 -4.66 117.98 110.45 2pva s PHE 138 Ca 0.00 -0.37 -0.29 0.00 -1.04 0.00 0.00 56.93 55.22 2pva s PHE 138 Cb 0.00 0.21 -0.01 0.00 -1.21 0.00 0.00 43.02 42.01 2pva s PHE 138 CO 0.00 -0.80 1.27 0.00 -1.34 0.00 0.00 175.22 174.35 2pva s ALA 139 N -3.88 3.62 0.38 1.99 0.00 -1.26 -4.19 121.76 118.43 2pva s ALA 139 Ca 0.10 0.41 -0.25 0.00 0.00 0.00 0.00 51.96 52.21 2pva s ALA 139 Cb 0.01 -3.64 -0.09 0.00 0.00 0.00 0.00 23.12 19.40 2pva s ALA 139 CO -0.04 -1.25 1.14 -1.25 0.00 0.00 0.00 175.76 174.35 2pva s PRO 140 N 3.59 4.15 -0.01 0.00 0.04 -1.26 -4.97 135.00 136.54 2pva s PRO 140 Ca 0.55 1.77 -0.30 0.00 0.04 0.00 0.00 61.00 63.05 2pva s PRO 140 Cb -0.21 -2.71 -0.06 0.00 0.04 0.00 0.00 34.50 31.56 2pva s PRO 140 CO 0.16 -0.22 1.48 -1.25 0.04 0.00 0.00 177.00 177.21 2pva s PRO 141 N -2.24 4.25 0.05 0.56 0.04 -1.26 -4.99 135.00 131.41 2pva s PRO 141 Ca 0.56 2.05 -0.03 0.00 0.04 0.00 0.00 61.00 63.62 2pva s PRO 141 Cb -0.29 -3.65 -0.03 0.00 0.04 0.00 0.00 34.50 30.57 2pva s PRO 141 CO 0.37 -0.66 0.03 -0.51 0.04 0.00 0.00 177.00 176.27 2pva s LEU 142 N 2.76 2.15 0.05 -3.56 1.43 -1.26 -1.53 118.68 118.73 2pva s LEU 142 Ca 0.67 -0.76 0.00 0.00 -1.03 0.00 0.00 54.13 53.01 2pva s LEU 142 Cb -0.33 0.38 -0.03 0.00 0.03 0.00 0.00 46.19 46.24 2pva s LEU 142 CO 0.27 -0.54 -0.04 -1.38 0.23 0.00 0.00 176.35 174.89 2pva s HIS 143 N -3.17 0.53 0.08 0.29 -3.43 0.24 -4.45 115.29 105.38 2pva s HIS 143 Ca -0.00 -0.85 0.06 0.00 -0.80 0.00 0.00 55.06 53.47 2pva s HIS 143 Cb 0.02 -0.36 -0.03 0.00 -1.43 0.00 0.00 32.58 30.78 2pva s HIS 143 CO -0.07 -0.26 -0.17 0.71 -2.00 0.00 0.00 174.74 172.95 2pva s TYR 144 N -2.98 1.42 -0.01 0.38 2.02 -0.27 0.26 117.35 118.17 2pva s TYR 144 Ca 0.00 -0.44 0.02 0.00 -0.37 0.00 0.00 57.07 56.28 2pva s TYR 144 Cb 0.01 -0.79 -0.00 0.00 -0.40 0.00 0.00 41.96 40.77 2pva s TYR 144 CO -0.06 0.11 -0.07 -0.08 -1.57 0.00 0.00 175.55 173.88 2pva s THR 145 N -1.21 0.55 0.01 -0.71 -1.32 -0.41 -0.07 115.64 112.48 2pva s THR 145 Ca 0.01 -0.29 0.02 0.00 -1.21 0.00 0.00 61.69 60.22 2pva s THR 145 Cb -0.10 -0.47 -0.01 0.00 -1.51 0.00 0.00 72.50 70.41 2pva s THR 145 CO 0.03 0.16 -0.06 -0.36 -2.21 0.00 0.00 174.62 172.17 2pva s PHE 146 N -0.13 0.56 -0.06 9.09 0.08 -1.02 -0.82 117.98 125.67 2pva s PHE 146 Ca 0.02 -0.25 0.01 0.00 0.12 0.00 0.00 56.93 56.84 2pva s PHE 146 Cb -0.03 -0.35 0.02 0.00 -0.57 0.00 0.00 43.02 42.09 2pva s PHE 146 CO -0.00 -0.04 -0.08 0.99 -0.10 0.00 0.00 175.22 175.99 2pva s THR 147 N -0.60 0.86 0.64 0.64 2.01 -0.56 -0.92 115.64 117.72 2pva s THR 147 Ca -0.02 -0.30 0.03 0.00 0.31 0.00 0.00 61.69 61.70 2pva s THR 147 Cb -0.05 -0.83 0.12 0.00 0.01 0.00 0.00 72.50 71.75 2pva s THR 147 CO 0.00 0.30 0.89 -0.90 -0.69 0.00 0.00 174.62 174.22 2pva n ASP 148 N 4.05 1.53 -0.00 3.53 5.68 -1.07 -0.56 116.55 129.70 2pva n ASP 148 Ca -0.22 -2.21 0.10 0.00 -0.50 0.00 0.00 54.79 51.96 2pva n ASP 148 Cb 0.51 -0.54 0.52 0.00 -1.14 0.00 0.00 41.12 40.47 2pva n ASP 148 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 2pva h ALA 149 N -0.35 1.97 0.00 2.12 0.00 -1.81 -1.60 119.26 119.60 2pva h ALA 149 Ca -0.29 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.60 2pva h ALA 149 Cb 1.17 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.88 2pva h ALA 149 CO 0.35 -0.06 0.00 0.66 0.00 0.00 0.00 179.25 180.20 2pva h SER 150 N 0.35 0.00 0.00 0.00 4.64 -1.94 -3.40 113.55 113.20 2pva h SER 150 Ca 0.20 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.52 2pva h SER 150 Cb 0.34 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.43 2pva h SER 150 CO -0.05 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 176.52 2pva n GLY 151 N -0.05 0.81 3.71 -0.77 0.00 -0.60 -5.05 105.19 103.25 2pva n GLY 151 Ca 0.01 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.61 2pva n GLY 151 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2pva s GLU 152 N -0.86 4.50 0.03 1.61 2.12 -1.26 -4.84 118.70 119.99 2pva s GLU 152 Ca 0.00 1.61 0.03 0.00 0.36 0.00 0.00 54.97 56.96 2pva s GLU 152 Cb 0.00 -3.40 -0.04 0.00 0.26 0.00 0.00 34.13 30.96 2pva s GLU 152 CO 0.00 -0.15 -0.00 -1.12 -0.54 0.00 0.00 175.26 173.45 2pva s SER 153 N 0.99 5.05 0.08 -1.70 0.01 -1.26 -2.58 113.70 114.30 2pva s SER 153 Ca 0.55 -0.07 0.03 0.00 1.31 0.00 0.00 55.95 57.77 2pva s SER 153 Cb -0.26 -1.27 -0.03 0.00 0.21 0.00 0.00 66.02 64.67 2pva s SER 153 CO 0.29 0.25 -0.09 0.27 0.41 0.00 0.00 173.24 174.37 2pva s ILE 154 N -1.15 0.79 -0.07 1.44 -4.36 -0.09 -2.46 121.20 115.29 2pva s ILE 154 Ca 0.21 -1.53 0.04 0.00 -0.26 0.00 0.00 60.65 59.12 2pva s ILE 154 Cb -0.12 -1.20 0.00 0.00 1.25 0.00 0.00 42.46 42.39 2pva s ILE 154 CO 0.13 -0.56 -0.20 -0.69 0.24 0.00 0.00 174.94 173.86 2pva s VAL 155 N -2.33 1.73 -0.17 8.37 1.01 -0.36 -2.44 120.40 126.21 2pva s VAL 155 Ca 0.02 -0.85 -0.00 0.00 0.00 0.00 0.00 61.98 61.15 2pva s VAL 155 Cb -0.04 -1.50 0.00 0.00 0.00 0.00 0.00 36.38 34.85 2pva s VAL 155 CO -0.01 0.49 -0.15 -0.63 0.00 0.00 0.00 175.10 174.80 2pva s ILE 156 N 0.25 2.62 -0.12 2.22 -1.09 0.90 -0.30 121.20 125.69 2pva s ILE 156 Ca -0.12 -0.77 -0.02 0.00 -2.23 0.00 0.00 60.65 57.51 2pva s ILE 156 Cb -0.15 -2.12 0.04 0.00 -1.58 0.00 0.00 42.46 38.65 2pva s ILE 156 CO 0.05 0.51 0.00 -1.61 -1.23 0.00 0.00 174.94 172.66 2pva s GLU 157 N 1.01 0.77 -1.09 2.79 2.02 0.12 -1.12 118.70 123.20 2pva s GLU 157 Ca -0.02 -0.13 -0.21 0.00 0.02 0.00 0.00 54.97 54.63 2pva s GLU 157 Cb -0.15 -1.45 0.07 0.00 0.10 0.00 0.00 34.13 32.70 2pva s GLU 157 CO -0.03 -0.41 1.49 -1.25 0.02 0.00 0.00 175.26 175.08 2pva s PRO 158 N 1.89 3.71 0.46 0.39 0.04 -1.26 0.79 135.00 141.01 2pva s PRO 158 Ca 0.03 -1.47 -0.01 0.00 0.04 0.00 0.00 61.00 59.59 2pva s PRO 158 Cb -0.14 -5.35 -0.01 0.00 0.04 0.00 0.00 34.50 29.04 2pva s PRO 158 CO -0.07 -2.16 0.69 -0.51 0.04 0.00 0.00 177.00 175.00 2pva s ASP 159 N 4.57 5.89 0.26 6.66 1.01 -0.64 -0.70 116.67 133.72 2pva s ASP 159 Ca 0.47 0.40 -0.01 0.00 0.71 0.00 0.00 52.55 54.11 2pva s ASP 159 Cb 0.00 -1.66 0.56 0.00 1.01 0.00 0.00 42.92 42.83 2pva s ASP 159 CO -0.05 -0.69 1.70 0.50 0.21 0.00 0.00 175.17 176.85 2pva h LYS 160 N 0.36 0.37 0.00 8.23 3.64 -1.87 0.86 116.57 128.16 2pva h LYS 160 Ca -0.46 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 58.89 2pva h LYS 160 Cb 1.25 -0.08 0.00 0.00 -0.41 0.00 0.00 32.23 32.98 2pva h LYS 160 CO 0.58 0.24 0.00 0.25 -2.27 0.00 0.00 179.45 178.26 2pva n THR 161 N -5.06 0.00 0.00 1.00 -2.24 -1.26 -5.01 114.28 101.71 2pva n THR 161 Ca 0.17 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.95 2pva n THR 161 Cb 0.52 -0.53 0.00 0.00 -2.10 0.00 0.00 70.33 68.22 2pva n THR 161 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2pva n GLY 162 N 0.73 1.33 3.68 3.38 0.00 0.29 -5.03 105.19 109.57 2pva n GLY 162 Ca 0.20 -2.10 -0.42 0.00 0.00 0.00 0.00 46.02 43.69 2pva n GLY 162 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2pva s ILE 163 N -1.19 4.04 -0.20 -0.61 -1.09 -1.26 -1.62 121.20 119.26 2pva s ILE 163 Ca 0.00 1.35 -0.07 0.00 -2.23 0.00 0.00 60.65 59.70 2pva s ILE 163 Cb 0.00 -3.87 -0.04 0.00 -1.58 0.00 0.00 42.46 36.98 2pva s ILE 163 CO 0.00 -0.05 0.06 -0.89 -1.23 0.00 0.00 174.94 172.83 2pva s THR 164 N 2.84 4.61 -0.13 2.92 2.01 0.24 -4.93 115.64 123.21 2pva s THR 164 Ca 0.59 -0.09 -0.02 0.00 0.31 0.00 0.00 61.69 62.49 2pva s THR 164 Cb -0.26 -3.10 -0.03 0.00 0.01 0.00 0.00 72.50 69.12 2pva s THR 164 CO 0.22 0.42 -0.06 -0.63 -0.69 0.00 0.00 174.62 173.87 2pva s ILE 165 N 0.80 3.68 -0.17 1.82 1.09 -1.26 0.10 121.20 127.26 2pva s ILE 165 Ca 0.03 -0.45 -0.00 0.00 -1.10 0.00 0.00 60.65 59.14 2pva s ILE 165 Cb -0.14 -2.58 0.00 0.00 -1.06 0.00 0.00 42.46 38.69 2pva s ILE 165 CO 0.02 0.52 -0.14 -1.00 -0.10 0.00 0.00 174.94 174.24 2pva s HIS 166 N 0.10 2.81 0.02 3.97 3.76 0.59 -4.97 115.29 121.57 2pva s HIS 166 Ca -0.02 -1.13 -0.05 0.00 -0.15 0.00 0.00 55.06 53.71 2pva s HIS 166 Cb -0.14 -1.93 -0.05 0.00 1.11 0.00 0.00 32.58 31.58 2pva s HIS 166 CO 0.03 -0.54 0.26 1.03 -0.85 0.00 0.00 174.74 174.67 2pva s ARG 167 N 1.00 3.55 -1.42 1.40 0.52 -1.26 -1.22 118.95 121.51 2pva s ARG 167 Ca -0.02 -0.14 -0.06 0.00 -0.52 0.00 0.00 55.73 54.99 2pva s ARG 167 Cb -0.15 -3.06 0.04 0.00 0.52 0.00 0.00 34.95 32.30 2pva s ARG 167 CO -0.03 0.63 0.77 1.63 0.02 0.00 0.00 175.30 178.32 2pva n LYS 168 N 0.93 -4.87 -1.16 3.54 5.02 -1.03 -4.98 118.16 115.61 2pva n LYS 168 Ca -0.10 0.57 -0.30 0.00 -2.02 0.00 0.00 58.31 56.46 2pva n LYS 168 Cb 0.53 -5.20 0.24 0.00 -0.02 0.00 0.00 35.03 30.57 2pva n LYS 168 CO 0.00 0.00 0.00 0.95 -0.52 0.00 0.00 177.40 177.83 2pva s THR 169 N -3.56 1.62 -2.00 -0.18 -4.23 -1.14 -4.92 115.64 101.23 2pva s THR 169 Ca 0.27 0.00 0.28 0.00 -1.18 0.00 0.00 61.69 61.06 2pva s THR 169 Cb -0.14 -2.54 0.79 0.00 1.34 0.00 0.00 72.50 71.96 2pva s THR 169 CO 0.83 0.00 2.05 2.30 -0.54 0.00 0.00 174.62 179.26 2pva n ILE 170 N -4.69 0.00 -2.81 2.99 -5.35 -1.26 -4.67 119.36 103.57 2pva n ILE 170 Ca 0.14 0.00 -0.08 0.00 -0.27 0.00 0.00 62.75 62.54 2pva n ILE 170 Cb 0.60 -0.48 0.03 0.00 -1.74 0.00 0.00 39.64 38.04 2pva n ILE 170 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2pva n GLY 171 N 0.87 0.39 2.94 3.28 0.00 -1.26 -4.90 105.19 106.50 2pva n GLY 171 Ca 0.21 -0.34 -0.12 0.00 0.00 0.00 0.00 46.02 45.77 2pva n GLY 171 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2pva s VAL 172 N -3.11 -0.01 -0.27 1.61 1.01 -1.26 -2.14 120.40 116.22 2pva s VAL 172 Ca 0.17 0.02 -0.23 0.00 0.00 0.00 0.00 61.98 61.94 2pva s VAL 172 Cb -0.07 -0.13 0.08 0.00 0.00 0.00 0.00 36.38 36.26 2pva s VAL 172 CO 0.25 0.01 0.76 -0.32 0.00 0.00 0.00 175.10 175.80 2pva s MET 173 N 0.17 0.76 0.00 2.72 1.75 -1.02 -5.01 119.30 118.67 2pva s MET 173 Ca -0.01 1.00 0.00 0.00 -1.25 0.00 0.00 55.69 55.43 2pva s MET 173 Cb -0.02 0.32 0.00 0.00 2.84 0.00 0.00 34.83 37.97 2pva s MET 173 CO -0.00 -0.11 0.00 0.25 -0.65 0.00 0.00 175.02 174.51 2pva n THR 174 N 3.04 0.00 -1.77 10.11 -2.24 -1.26 -0.42 114.28 121.74 2pva n THR 174 Ca -0.15 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.63 2pva n THR 174 Cb 0.56 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.79 2pva n THR 174 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 2pva n ASN 175 N 0.00 0.12 -4.72 3.42 4.13 -1.26 -4.79 115.26 112.17 2pva n ASN 175 Ca 0.00 0.00 -0.32 0.00 1.68 0.00 0.00 54.58 55.94 2pva n ASN 175 Cb 0.00 0.00 0.12 0.00 -1.54 0.00 0.00 39.78 38.36 2pva n ASN 175 CO 0.00 0.00 0.00 -0.44 0.28 0.00 0.00 177.26 177.10 2pva s SER 176 N 0.37 3.84 0.00 6.41 0.01 -1.26 -4.70 113.70 118.36 2pva s SER 176 Ca 0.00 2.10 0.00 0.00 1.31 0.00 0.00 55.95 59.36 2pva s SER 176 Cb 0.00 -2.56 0.00 0.00 0.21 0.00 0.00 66.02 63.67 2pva s SER 176 CO 0.00 -2.49 0.00 -0.81 0.41 0.00 0.00 173.24 170.35 2pva n PRO 177 N -3.55 1.79 -1.49 12.44 -0.04 -1.26 -4.40 135.00 138.49 2pva n PRO 177 Ca 0.11 0.00 -0.32 0.00 -0.04 0.00 0.00 63.50 63.25 2pva n PRO 177 Cb 0.52 0.00 0.07 0.00 -0.04 0.00 0.00 33.50 34.05 2pva n PRO 177 CO 0.00 0.00 0.00 0.20 -0.04 0.00 0.00 175.50 175.66 2pva s GLY 178 N -0.56 1.89 0.16 0.55 0.00 -1.26 -4.86 107.32 103.24 2pva s GLY 178 Ca 0.00 0.39 -0.17 0.00 0.00 0.00 0.00 44.72 44.95 2pva s GLY 178 CO 0.00 0.74 1.70 -1.82 0.00 0.00 0.00 173.10 173.72 2pva h TYR 179 N -0.60 -0.05 -0.71 1.90 3.20 -2.00 -1.42 116.97 117.29 2pva h TYR 179 Ca -0.45 0.03 0.13 0.00 3.14 0.00 0.00 58.73 61.58 2pva h TYR 179 Cb 1.24 0.08 -0.05 0.00 1.54 0.00 0.00 36.73 39.54 2pva h TYR 179 CO 0.56 -0.09 0.48 0.93 -1.64 0.00 0.00 178.16 178.40 2pva h GLU 180 N 0.08 0.39 -0.17 1.82 5.08 -1.99 -1.35 114.58 118.45 2pva h GLU 180 Ca 0.18 -0.02 -0.01 0.00 -1.00 0.00 0.00 59.36 58.51 2pva h GLU 180 Cb 0.26 -0.09 -0.01 0.00 0.50 0.00 0.00 28.75 29.41 2pva h GLU 180 CO -0.32 0.26 0.07 2.35 -1.00 0.00 0.00 179.01 180.37 2pva h TRP 181 N 0.41 0.25 -0.32 4.33 7.01 -1.62 -2.71 115.95 123.31 2pva h TRP 181 Ca 0.34 -0.02 0.00 0.00 2.11 0.00 0.00 58.89 61.32 2pva h TRP 181 Cb 0.77 -0.08 -0.02 0.00 -2.10 0.00 0.00 29.16 27.74 2pva h TRP 181 CO -0.00 0.32 0.20 0.45 -2.79 0.00 0.00 178.44 176.61 2pva h HIS 182 N 0.12 0.41 -0.97 2.65 3.86 -1.37 -0.09 115.15 119.76 2pva h HIS 182 Ca 0.06 0.00 0.06 0.00 -1.16 0.00 0.00 60.37 59.33 2pva h HIS 182 Cb 0.17 -0.14 -0.06 0.00 1.06 0.00 0.00 27.41 28.44 2pva h HIS 182 CO -0.01 0.28 0.62 0.37 0.86 0.00 0.00 177.93 180.05 2pva h GLN 183 N 0.42 1.11 -0.03 2.45 4.15 -1.28 -1.30 115.11 120.61 2pva h GLN 183 Ca 0.11 -0.07 -0.19 0.00 0.77 0.00 0.00 58.65 59.27 2pva h GLN 183 Cb -0.02 -0.25 -0.01 0.00 0.21 0.00 0.00 27.48 27.42 2pva h GLN 183 CO -0.02 0.73 -0.81 1.15 -1.93 0.00 0.00 178.83 177.95 2pva h THR 184 N 1.14 1.42 0.00 2.39 2.02 -1.33 -3.05 112.91 115.49 2pva h THR 184 Ca 0.41 -2.34 -0.01 0.00 0.77 0.00 0.00 66.41 65.25 2pva h THR 184 Cb 0.14 2.28 -0.00 0.00 -1.74 0.00 0.00 68.15 68.83 2pva h THR 184 CO -0.17 0.69 -0.03 -1.13 0.37 0.00 0.00 175.52 175.25 2pva h ASN 185 N 0.21 0.00 -0.92 4.18 -0.00 0.08 -2.14 115.58 116.99 2pva h ASN 185 Ca -0.04 0.00 0.05 0.00 -0.00 0.00 0.00 56.30 56.30 2pva h ASN 185 Cb 1.41 0.00 -0.06 0.00 -0.00 0.00 0.00 38.32 39.67 2pva h ASN 185 CO 0.13 0.03 0.59 -0.07 -0.00 0.00 0.00 177.43 178.12 2pva h LEU 186 N 0.00 0.96 -2.11 0.34 3.38 -1.22 -2.71 115.31 113.95 2pva h LEU 186 Ca -0.00 0.00 0.05 0.00 0.09 0.00 0.00 57.88 58.02 2pva h LEU 186 Cb 0.09 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 40.63 2pva h LEU 186 CO 0.00 0.64 0.13 0.03 0.09 0.00 0.00 178.44 179.33 2pva h ARG 187 N 1.11 0.00 0.00 1.13 3.08 -1.54 -1.85 114.38 116.31 2pva h ARG 187 Ca 0.38 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.43 2pva h ARG 187 Cb 0.08 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.13 2pva h ARG 187 CO -0.14 0.00 0.00 0.00 -1.07 0.00 0.00 179.97 178.76 2pva h ALA 188 N 1.89 1.00 -0.00 0.04 0.00 -1.64 -3.33 119.26 117.23 2pva h ALA 188 Ca 0.07 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.98 2pva h ALA 188 Cb 0.33 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.12 2pva h ALA 188 CO -0.00 0.00 0.00 0.66 0.00 0.00 0.00 179.25 179.91 2pva n TYR 189 N -2.48 0.01 0.15 0.00 4.01 -0.70 -4.81 117.16 113.34 2pva n TYR 189 Ca 0.03 -0.89 0.19 0.00 -0.16 0.00 0.00 57.90 57.08 2pva n TYR 189 Cb 0.34 -0.13 0.76 0.00 -0.31 0.00 0.00 39.34 40.00 2pva n TYR 189 CO 0.00 0.00 0.00 0.97 -0.46 0.00 0.00 176.86 177.37 2pva h ILE 190 N 0.02 0.29 -0.05 -0.72 2.10 -1.66 -0.81 117.51 116.68 2pva h ILE 190 Ca 0.00 0.00 0.00 0.00 1.08 0.00 0.00 64.86 65.94 2pva h ILE 190 Cb 0.89 0.65 0.00 0.00 -1.09 0.00 0.00 36.82 37.27 2pva h ILE 190 CO 0.00 0.00 0.00 0.61 -1.08 0.00 0.00 178.15 177.68 2pva n GLY 191 N -1.43 -0.18 3.56 8.18 0.00 -1.26 -4.69 105.19 109.38 2pva n GLY 191 Ca 0.05 -0.37 -0.43 0.00 0.00 0.00 0.00 46.02 45.27 2pva n GLY 191 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2pva s VAL 192 N -1.95 4.19 0.22 1.61 1.01 -0.31 -4.76 120.40 120.41 2pva s VAL 192 Ca 0.38 0.75 0.01 0.00 0.00 0.00 0.00 61.98 63.12 2pva s VAL 192 Cb 0.20 -4.63 -0.05 0.00 0.00 0.00 0.00 36.38 31.90 2pva s VAL 192 CO 0.32 -1.19 0.08 0.42 0.00 0.00 0.00 175.10 174.73 2pva s THR 193 N 4.50 0.46 0.05 3.92 -4.23 -0.91 -4.97 115.64 114.45 2pva s THR 193 Ca 0.39 -1.99 0.22 0.00 -1.18 0.00 0.00 61.69 59.13 2pva s THR 193 Cb -0.09 -2.48 0.20 0.00 1.34 0.00 0.00 72.50 71.47 2pva s THR 193 CO 0.25 -0.12 1.74 -0.65 -0.54 0.00 0.00 174.62 175.29 2pva h PRO 194 N 2.51 0.00 -6.95 3.99 0.11 -1.94 -3.18 132.00 126.54 2pva h PRO 194 Ca -0.37 0.00 -0.46 0.00 0.11 0.00 0.00 66.00 65.28 2pva h PRO 194 Cb 1.24 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.33 2pva h PRO 194 CO 0.60 0.28 0.31 -0.80 -0.21 0.00 0.00 178.00 178.17 2pva s ASN 195 N -6.26 7.05 0.50 -2.05 0.02 -1.26 -4.69 114.94 108.26 2pva s ASN 195 Ca 0.01 1.68 -0.18 0.00 -1.02 0.00 0.00 52.86 53.35 2pva s ASN 195 Cb 0.09 -2.53 -0.08 0.00 0.02 0.00 0.00 41.25 38.76 2pva s ASN 195 CO 0.66 -0.23 1.00 -2.16 0.02 0.00 0.00 177.10 176.39 2pva s PRO 196 N -2.75 3.89 0.55 -0.60 0.05 -1.26 -3.19 135.00 131.69 2pva s PRO 196 Ca 0.57 1.10 -0.18 0.00 0.05 0.00 0.00 61.00 62.53 2pva s PRO 196 Cb -0.12 -2.12 -0.06 0.00 0.05 0.00 0.00 34.50 32.25 2pva s PRO 196 CO 0.17 -0.33 1.06 -1.25 0.05 0.00 0.00 177.00 176.71 2pva s PRO 197 N -3.74 3.49 0.41 0.56 0.04 -1.26 -4.89 135.00 129.62 2pva s PRO 197 Ca 0.62 1.35 -0.26 0.00 0.04 0.00 0.00 61.00 62.74 2pva s PRO 197 Cb -0.12 -2.05 -0.09 0.00 0.04 0.00 0.00 34.50 32.29 2pva s PRO 197 CO 0.26 -0.69 1.30 -0.65 0.04 0.00 0.00 177.00 177.26 2pva s GLN 198 N -3.61 3.93 0.72 4.56 -0.21 -1.26 -4.94 119.66 118.86 2pva s GLN 198 Ca 0.67 2.14 -0.15 0.00 0.02 0.00 0.00 55.36 58.04 2pva s GLN 198 Cb -0.18 -2.73 0.04 0.00 1.00 0.00 0.00 33.01 31.14 2pva s GLN 198 CO 0.29 -0.52 1.20 -0.51 -2.12 0.00 0.00 175.29 173.63 2pva s ASP 199 N -0.77 4.28 0.19 5.90 1.01 -1.26 -5.02 116.67 121.00 2pva s ASP 199 Ca 0.58 2.32 0.03 0.00 0.71 0.00 0.00 52.55 56.18 2pva s ASP 199 Cb -0.38 -2.58 -0.05 0.00 1.01 0.00 0.00 42.92 40.92 2pva s ASP 199 CO 0.48 -2.21 -0.00 0.27 0.21 0.00 0.00 175.17 173.92 2pva s ILE 200 N -2.03 0.82 -0.04 0.77 -4.36 -0.71 -4.97 121.20 110.69 2pva s ILE 200 Ca 0.73 -2.00 0.02 0.00 -0.26 0.00 0.00 60.65 59.14 2pva s ILE 200 Cb -0.28 -2.20 -0.03 0.00 1.25 0.00 0.00 42.46 41.20 2pva s ILE 200 CO 0.45 -0.42 -0.07 -0.04 0.24 0.00 0.00 174.94 175.10 2pva s MET 201 N -3.89 2.67 -0.54 0.37 -1.94 -1.26 0.19 119.30 114.89 2pva s MET 201 Ca 0.26 -0.61 0.04 0.00 -1.71 0.00 0.00 55.69 53.66 2pva s MET 201 Cb 0.06 -2.55 0.14 0.00 2.01 0.00 0.00 34.83 34.48 2pva s MET 201 CO 0.06 0.64 0.30 -1.64 -0.01 0.00 0.00 175.02 174.37 2pva s MET 202 N -1.04 1.98 6.44 2.03 -1.94 -0.69 -4.96 119.30 121.13 2pva s MET 202 Ca 0.14 -2.68 0.00 0.00 -1.71 0.00 0.00 55.69 51.44 2pva s MET 202 Cb -0.11 -3.22 0.00 0.00 2.01 0.00 0.00 34.83 33.51 2pva s MET 202 CO 0.04 -1.15 0.00 0.41 -0.01 0.00 0.00 175.02 174.31 2pva n GLY 203 N 2.96 1.86 0.04 -0.03 0.00 -1.26 -1.89 105.19 106.86 2pva n GLY 203 Ca 0.08 -0.13 0.11 0.00 0.00 0.00 0.00 46.02 46.08 2pva n GLY 203 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2pva n ASP 204 N 10.22 0.54 -4.75 1.61 8.00 -1.26 -4.93 116.55 125.98 2pva n ASP 204 Ca 0.00 -0.13 -0.40 0.00 0.71 0.00 0.00 54.79 54.97 2pva n ASP 204 Cb 0.00 1.01 -0.05 0.00 -0.02 0.00 0.00 41.12 42.07 2pva n ASP 204 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 2pva s LEU 205 N -4.22 4.55 -0.37 0.64 1.43 -0.79 -5.02 118.68 114.90 2pva s LEU 205 Ca 0.01 2.14 -0.14 0.00 -1.03 0.00 0.00 54.13 55.11 2pva s LEU 205 Cb 0.14 -3.62 -0.00 0.00 0.03 0.00 0.00 46.19 42.74 2pva s LEU 205 CO 0.83 -0.11 0.28 -0.62 0.23 0.00 0.00 176.35 176.95 2pva s ASP 206 N -0.66 6.09 -0.21 2.29 -1.08 -1.26 -1.70 116.67 120.14 2pva s ASP 206 Ca 0.45 -0.56 -0.08 0.00 -0.52 0.00 0.00 52.55 51.84 2pva s ASP 206 Cb -0.30 -2.15 -0.04 0.00 -1.46 0.00 0.00 42.92 38.97 2pva s ASP 206 CO 0.37 -0.32 0.08 -0.76 0.52 0.00 0.00 175.17 175.05 2pva s LEU 207 N 1.75 3.76 0.02 -1.34 1.02 0.49 -4.98 118.68 119.40 2pva s LEU 207 Ca 0.06 0.01 -0.09 0.00 0.02 0.00 0.00 54.13 54.13 2pva s LEU 207 Cb -0.18 -1.97 0.00 0.00 0.02 0.00 0.00 46.19 44.06 2pva s LEU 207 CO 0.11 0.11 0.18 0.28 0.02 0.00 0.00 176.35 177.04 2pva s THR 208 N 0.79 0.10 0.78 5.49 -1.32 -1.26 -1.73 115.64 118.48 2pva s THR 208 Ca 0.04 -0.79 -0.14 0.00 -1.21 0.00 0.00 61.69 59.60 2pva s THR 208 Cb -0.13 -0.71 0.07 0.00 -1.51 0.00 0.00 72.50 70.21 2pva s THR 208 CO 0.02 -0.43 1.20 -2.84 -2.21 0.00 0.00 174.62 170.36 2pva s PRO 209 N -2.01 1.82 0.18 7.08 0.02 -1.26 -4.93 135.00 135.89 2pva s PRO 209 Ca -0.09 1.75 -0.06 0.00 0.02 0.00 0.00 61.00 62.62 2pva s PRO 209 Cb -0.04 -1.80 0.09 0.00 0.02 0.00 0.00 34.50 32.78 2pva s PRO 209 CO -0.01 -2.08 1.53 0.74 -0.33 0.00 0.00 177.00 176.85 2pva h PHE 210 N -0.70 0.87 0.00 6.54 0.04 -2.04 -3.48 116.94 118.16 2pva h PHE 210 Ca -0.47 -0.26 0.00 0.00 2.80 0.00 0.00 57.97 60.04 2pva h PHE 210 Cb 1.29 -0.18 0.00 0.00 2.20 0.00 0.00 35.95 39.26 2pva h PHE 210 CO 0.47 1.02 0.00 0.41 -0.60 0.00 0.00 178.31 179.61 2pva n GLY 211 N 0.09 2.63 3.63 -1.45 0.00 -1.26 -5.17 105.19 103.66 2pva n GLY 211 Ca -0.02 0.14 -0.26 0.00 0.00 0.00 0.00 46.02 45.88 2pva n GLY 211 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2pva s GLN 212 N 3.39 2.02 0.00 1.61 -1.52 -1.26 -4.82 119.66 119.07 2pva s GLN 212 Ca 0.00 -1.94 0.00 0.00 -1.95 0.00 0.00 55.36 51.47 2pva s GLN 212 Cb 0.00 -1.79 0.00 0.00 -0.22 0.00 0.00 33.01 31.00 2pva s GLN 212 CO 0.00 0.01 0.00 0.41 -0.25 0.00 0.00 175.29 175.46 2pva n GLY 213 N -0.99 0.59 0.20 3.09 0.00 -1.26 -4.97 105.19 101.85 2pva n GLY 213 Ca -0.04 -0.77 0.08 0.00 0.00 0.00 0.00 46.02 45.29 2pva n GLY 213 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2pva h ALA 214 N 0.00 0.96 0.00 4.61 0.00 -1.87 -3.11 119.26 119.85 2pva h ALA 214 Ca 0.00 -0.27 0.00 0.00 0.00 0.00 0.00 54.91 54.64 2pva h ALA 214 Cb 0.08 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 17.83 2pva h ALA 214 CO 0.00 0.36 0.00 0.41 0.00 0.00 0.00 179.25 180.02 2pva n GLY 215 N 0.35 -1.09 0.41 0.00 0.00 -1.19 -1.79 105.19 101.89 2pva n GLY 215 Ca 0.00 0.11 0.13 0.00 0.00 0.00 0.00 46.02 46.27 2pva n GLY 215 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2pva n GLY 216 N -0.49 -0.11 3.59 -0.02 0.00 -1.17 -2.15 105.19 104.82 2pva n GLY 216 Ca 0.01 -0.39 -0.53 0.00 0.00 0.00 0.00 46.02 45.11 2pva n GLY 216 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 2pva n LEU 217 N 0.01 1.51 0.00 0.99 7.94 -0.74 -2.16 117.00 124.55 2pva n LEU 217 Ca 0.19 1.12 0.00 0.00 -1.11 0.00 0.00 56.01 56.21 2pva n LEU 217 Cb 0.31 -1.16 0.00 0.00 0.53 0.00 0.00 43.42 43.09 2pva n LEU 217 CO 0.16 -1.11 0.00 0.61 -1.11 0.00 0.00 177.39 175.94 2pva n GLY 218 N 2.49 0.79 3.74 -3.96 0.00 -1.26 -4.76 105.19 102.23 2pva n GLY 218 Ca 0.19 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.86 2pva n GLY 218 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2pva s LEU 219 N 0.00 4.18 0.52 0.99 1.98 -0.92 -5.05 118.68 120.39 2pva s LEU 219 Ca 0.00 0.24 -0.19 0.00 -2.89 0.00 0.00 54.13 51.30 2pva s LEU 219 Cb 0.00 -2.07 -0.07 0.00 0.66 0.00 0.00 46.19 44.71 2pva s LEU 219 CO 0.00 0.21 1.04 -2.16 -1.89 0.00 0.00 176.35 173.55 2pva s PRO 220 N 0.17 3.67 0.00 0.98 0.04 -1.26 -5.01 135.00 133.59 2pva s PRO 220 Ca 0.08 1.27 0.03 0.00 0.04 0.00 0.00 61.00 62.43 2pva s PRO 220 Cb -0.11 -2.08 0.03 0.00 0.04 0.00 0.00 34.50 32.38 2pva s PRO 220 CO -0.01 -0.53 0.67 0.41 0.04 0.00 0.00 177.00 177.58 2pva n GLY 221 N -0.59 -0.59 3.86 0.56 0.00 -1.26 -4.88 105.19 102.29 2pva n GLY 221 Ca 0.09 -0.09 -0.29 0.00 0.00 0.00 0.00 46.02 45.72 2pva n GLY 221 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 2pva s ASP 222 N -0.36 3.45 -0.27 1.61 1.47 -1.26 -4.99 116.67 116.31 2pva s ASP 222 Ca 0.04 0.62 0.12 0.00 1.18 0.00 0.00 52.55 54.51 2pva s ASP 222 Cb 0.03 -0.94 0.62 0.00 -0.34 0.00 0.00 42.92 42.29 2pva s ASP 222 CO 0.04 -2.56 1.61 0.49 0.68 0.00 0.00 175.17 175.43 2pva n PHE 223 N -3.71 1.66 -1.24 2.11 3.72 -1.26 -4.50 117.46 114.24 2pva n PHE 223 Ca 0.11 -1.20 -0.32 0.00 -0.05 0.00 0.00 57.45 55.99 2pva n PHE 223 Cb 0.60 -0.53 0.10 0.00 -0.94 0.00 0.00 39.48 38.71 2pva n PHE 223 CO 0.00 0.00 0.00 0.95 -0.05 0.00 0.00 176.76 177.66 2pva s THR 224 N -3.01 2.90 0.27 4.37 -4.23 -1.26 -4.79 115.64 109.89 2pva s THR 224 Ca 0.49 0.33 -0.01 0.00 -1.18 0.00 0.00 61.69 61.32 2pva s THR 224 Cb 0.40 -2.72 0.25 0.00 1.34 0.00 0.00 72.50 71.77 2pva s THR 224 CO 0.09 -0.34 1.80 -0.65 -0.54 0.00 0.00 174.62 174.97 2pva h PRO 225 N -1.00 0.78 -0.14 3.99 0.11 -1.94 -0.75 132.00 133.05 2pva h PRO 225 Ca -0.44 -0.05 -0.20 0.00 0.11 0.00 0.00 66.00 65.42 2pva h PRO 225 Cb 1.25 -0.18 0.00 0.00 0.11 0.00 0.00 31.00 32.19 2pva h PRO 225 CO 0.49 0.52 -0.71 0.66 -0.21 0.00 0.00 178.00 178.75 2pva h SER 226 N 0.80 0.73 0.14 -2.05 4.64 -1.91 -2.41 113.55 113.49 2pva h SER 226 Ca 0.46 -0.46 -0.20 0.00 -0.47 0.00 0.00 61.79 61.13 2pva h SER 226 Cb 0.54 -0.21 0.00 0.00 -0.31 0.00 0.00 62.40 62.41 2pva h SER 226 CO -0.30 1.22 -0.75 0.00 -0.87 0.00 0.00 176.83 176.13 2pva h ALA 227 N 0.77 0.50 -0.71 5.18 0.00 -1.73 -2.84 119.26 120.42 2pva h ALA 227 Ca -0.03 -0.61 -0.02 0.00 0.00 0.00 0.00 54.91 54.25 2pva h ALA 227 Cb 1.30 -0.04 -0.03 0.00 0.00 0.00 0.00 17.79 19.02 2pva h ALA 227 CO 0.14 0.74 0.35 0.00 0.00 0.00 0.00 179.25 180.47 2pva h ARG 228 N 0.36 1.02 -0.74 0.00 3.08 -1.15 -2.01 114.38 114.93 2pva h ARG 228 Ca -0.04 -0.15 0.02 0.00 0.07 0.00 0.00 59.98 59.88 2pva h ARG 228 Cb 1.35 -0.18 -0.04 0.00 0.08 0.00 0.00 29.97 31.17 2pva h ARG 228 CO 0.14 0.80 0.48 0.35 -1.07 0.00 0.00 179.97 180.66 2pva h PHE 229 N 0.99 0.90 -0.00 3.04 3.04 -1.41 -1.06 116.94 122.43 2pva h PHE 229 Ca 0.24 0.02 -0.00 0.00 3.98 0.00 0.00 57.97 62.22 2pva h PHE 229 Cb 0.11 -0.30 -0.00 0.00 2.56 0.00 0.00 35.95 38.32 2pva h PHE 229 CO 0.01 0.55 0.00 -0.07 -2.02 0.00 0.00 178.31 176.77 2pva h LEU 230 N 0.96 0.00 0.19 0.59 3.38 -1.16 0.84 115.31 120.11 2pva h LEU 230 Ca 0.28 -0.28 -0.00 0.00 0.09 0.00 0.00 57.88 57.97 2pva h LEU 230 Cb -0.06 -0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.68 2pva h LEU 230 CO -0.08 0.28 -0.15 0.03 0.09 0.00 0.00 178.44 178.61 2pva h ARG 231 N -0.27 -0.34 -0.81 1.13 3.08 -1.25 0.10 114.38 116.03 2pva h ARG 231 Ca 0.00 0.02 0.01 0.00 0.07 0.00 0.00 59.98 60.09 2pva h ARG 231 Cb 0.28 0.08 -0.04 0.00 0.08 0.00 0.00 29.97 30.36 2pva h ARG 231 CO 0.00 -0.22 0.53 0.28 -1.07 0.00 0.00 179.97 179.49 2pva h VAL 232 N -0.35 1.19 -0.46 2.04 2.07 -1.17 0.34 116.25 119.91 2pva h VAL 232 Ca -0.01 -0.37 -0.10 0.00 0.82 0.00 0.00 66.70 67.04 2pva h VAL 232 Cb 0.31 0.02 -0.01 0.00 -1.52 0.00 0.00 31.29 30.09 2pva h VAL 232 CO -0.01 0.20 -0.11 0.00 0.02 0.00 0.00 177.57 177.66 2pva h ALA 233 N 1.30 0.64 0.14 1.67 0.00 -0.55 -1.52 119.26 120.94 2pva h ALA 233 Ca 0.30 -0.34 -0.29 0.00 0.00 0.00 0.00 54.91 54.59 2pva h ALA 233 Cb -0.10 -0.16 0.02 0.00 0.00 0.00 0.00 17.79 17.54 2pva h ALA 233 CO -0.07 0.54 -1.25 1.88 0.00 0.00 0.00 179.25 180.34 2pva h TYR 234 N 0.74 0.71 0.00 0.00 0.05 -0.57 -2.82 116.97 115.07 2pva h TYR 234 Ca 0.12 -0.48 -0.10 0.00 0.05 0.00 0.00 58.73 58.31 2pva h TYR 234 Cb 0.66 -0.04 -0.01 0.00 1.01 0.00 0.00 36.73 38.35 2pva h TYR 234 CO 0.05 1.36 -0.48 -1.49 -1.05 0.00 0.00 178.16 176.54 2pva h TRP 235 N 0.15 0.00 -0.55 4.88 -0.00 -0.37 -2.69 115.95 117.37 2pva h TRP 235 Ca -0.16 0.00 -0.10 0.00 -0.00 0.00 0.00 58.89 58.63 2pva h TRP 235 Cb 1.95 0.00 -0.02 0.00 -0.00 0.00 0.00 29.16 31.09 2pva h TRP 235 CO 0.09 0.48 -0.04 -0.22 -0.00 0.00 0.00 178.44 178.75 2pva h LYS 236 N 0.00 1.00 -0.18 0.49 3.64 -1.31 -1.22 116.57 118.98 2pva h LYS 236 Ca -0.00 -0.34 -0.12 0.00 -1.27 0.00 0.00 60.65 58.92 2pva h LYS 236 Cb 1.09 -0.08 -0.01 0.00 -0.41 0.00 0.00 32.23 32.82 2pva h LYS 236 CO 0.06 1.01 -0.38 -0.22 -2.27 0.00 0.00 179.45 177.65 2pva h LYS 237 N 0.88 0.41 0.00 1.90 3.64 -1.22 -3.34 116.57 118.84 2pva h LYS 237 Ca 0.15 -0.19 0.00 0.00 -1.27 0.00 0.00 60.65 59.34 2pva h LYS 237 Cb 0.59 -0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.40 2pva h LYS 237 CO 0.04 0.73 -1.79 0.66 -2.27 0.00 0.00 179.45 176.82 2pva n TYR 238 N -4.04 0.00 -1.89 1.91 4.01 -1.07 -4.95 117.16 111.13 2pva n TYR 238 Ca -0.01 0.00 -0.39 0.00 -0.16 0.00 0.00 57.90 57.33 2pva n TYR 238 Cb 0.48 -0.40 0.01 0.00 -0.31 0.00 0.00 39.34 39.13 2pva n TYR 238 CO 0.00 0.00 0.00 0.99 -0.46 0.00 0.00 176.86 177.39 2pva s THR 239 N -3.39 2.28 0.57 -0.72 2.01 -0.47 -4.93 115.64 110.99 2pva s THR 239 Ca -0.05 0.24 -0.20 0.00 0.31 0.00 0.00 61.69 62.00 2pva s THR 239 Cb 0.14 -3.14 -0.05 0.00 0.01 0.00 0.00 72.50 69.46 2pva s THR 239 CO 0.89 0.03 1.03 -0.62 -0.69 0.00 0.00 174.62 175.26 2pva n GLU 240 N -0.25 1.06 -1.82 4.92 1.02 -1.26 -4.92 120.64 119.39 2pva n GLU 240 Ca 0.06 0.40 -0.42 0.00 -0.02 0.00 0.00 57.16 57.19 2pva n GLU 240 Cb 0.43 -2.22 -0.02 0.00 -0.02 0.00 0.00 31.44 29.62 2pva n GLU 240 CO 0.00 0.00 0.00 0.15 1.18 0.00 0.00 177.13 178.46 2pva s LYS 241 N -2.70 4.15 0.07 3.49 3.01 -1.26 -4.97 119.74 121.53 2pva s LYS 241 Ca 0.74 2.53 -0.30 0.00 -1.01 0.00 0.00 55.97 57.92 2pva s LYS 241 Cb -0.43 -3.05 -0.06 0.00 -1.01 0.00 0.00 37.83 33.29 2pva s LYS 241 CO 0.48 -0.61 1.14 0.00 0.51 0.00 0.00 175.35 176.87 2pva s ALA 242 N 0.15 3.34 0.04 5.17 0.00 -1.26 -4.94 121.76 124.26 2pva s ALA 242 Ca 0.64 0.78 -0.08 0.00 0.00 0.00 0.00 51.96 53.31 2pva s ALA 242 Cb -0.47 -3.41 -0.31 0.00 0.00 0.00 0.00 23.12 18.94 2pva s ALA 242 CO 0.45 -0.35 1.01 0.87 0.00 0.00 0.00 175.76 177.74 2pva h LYS 243 N 6.44 0.35 0.00 0.00 6.56 -1.93 0.13 116.57 128.12 2pva h LYS 243 Ca -0.42 -0.60 -0.26 0.00 -1.06 0.00 0.00 60.65 58.30 2pva h LYS 243 Cb 1.21 0.22 -0.07 0.00 -0.57 0.00 0.00 32.23 33.03 2pva h LYS 243 CO 0.78 1.27 -0.21 0.27 -2.06 0.00 0.00 179.45 179.50 2pva n ASN 244 N -3.57 -0.71 -0.28 0.86 0.23 -1.26 -2.92 115.26 107.61 2pva n ASN 244 Ca -0.14 -2.41 -0.01 0.00 -0.53 0.00 0.00 54.58 51.49 2pva n ASN 244 Cb 1.06 1.46 0.18 0.00 -2.08 0.00 0.00 39.78 40.39 2pva n ASN 244 CO 0.00 0.00 0.00 -0.08 -0.93 0.00 0.00 177.26 176.25 2pva h GLU 245 N 0.00 1.12 -0.41 -3.83 4.81 -1.98 -0.17 114.58 114.12 2pva h GLU 245 Ca -0.17 -0.09 -0.13 0.00 -0.13 0.00 0.00 59.36 58.84 2pva h GLU 245 Cb 0.83 -0.24 -0.01 0.00 0.63 0.00 0.00 28.75 29.95 2pva h GLU 245 CO 0.25 0.77 -0.25 1.15 -0.73 0.00 0.00 179.01 180.19 2pva h THR 246 N 1.15 1.27 -0.40 0.32 2.02 -1.99 -0.78 112.91 114.49 2pva h THR 246 Ca 0.30 -1.39 -0.06 0.00 0.77 0.00 0.00 66.41 66.03 2pva h THR 246 Cb -0.08 1.22 -0.01 0.00 -1.74 0.00 0.00 68.15 67.54 2pva h THR 246 CO -0.06 0.47 0.00 -0.33 0.37 0.00 0.00 175.52 175.97 2pva h GLU 247 N 0.73 0.70 -0.38 6.66 5.08 -1.90 -1.58 114.58 123.89 2pva h GLU 247 Ca 0.09 -0.22 0.08 0.00 -1.00 0.00 0.00 59.36 58.31 2pva h GLU 247 Cb 0.79 -0.06 -0.08 0.00 0.50 0.00 0.00 28.75 29.89 2pva h GLU 247 CO 0.07 0.79 -0.18 0.78 -1.00 0.00 0.00 179.01 179.46 2pva h GLY 248 N 0.53 0.10 0.93 -3.84 0.00 -0.54 0.79 103.07 101.04 2pva h GLY 248 Ca 0.11 0.23 -0.02 0.00 0.00 0.00 0.00 47.33 47.66 2pva h GLY 248 CO 0.02 -0.19 0.14 -2.08 0.00 0.00 0.00 176.54 174.43 2pva h VAL 249 N -0.11 1.19 -0.73 4.60 2.07 -1.01 -0.57 116.25 121.69 2pva h VAL 249 Ca 0.19 -0.58 -0.02 0.00 0.82 0.00 0.00 66.70 67.11 2pva h VAL 249 Cb 0.40 0.92 -0.03 0.00 -1.52 0.00 0.00 31.29 31.06 2pva h VAL 249 CO -0.45 0.21 0.39 0.74 0.02 0.00 0.00 177.57 178.48 2pva h THR 250 N 0.42 1.22 -0.61 2.57 2.02 -0.32 -2.24 112.91 115.97 2pva h THR 250 Ca 0.12 -0.56 -0.09 0.00 0.77 0.00 0.00 66.41 66.64 2pva h THR 250 Cb 0.19 0.27 -0.02 0.00 -1.74 0.00 0.00 68.15 66.85 2pva h THR 250 CO -0.01 0.25 0.01 0.78 0.37 0.00 0.00 175.52 176.92 2pva h ASN 251 N 1.00 1.03 -0.70 4.18 -0.26 0.81 -2.63 115.58 119.01 2pva h ASN 251 Ca 0.26 -0.29 -0.07 0.00 -0.56 0.00 0.00 56.30 55.63 2pva h ASN 251 Cb 0.04 -0.28 -0.03 0.00 -1.06 0.00 0.00 38.32 37.00 2pva h ASN 251 CO -0.04 1.08 0.15 -0.07 -1.06 0.00 0.00 177.43 177.49 2pva h LEU 252 N 0.97 1.09 -0.43 1.61 4.07 -0.89 -2.37 115.31 119.36 2pva h LEU 252 Ca 0.17 -0.24 0.00 0.00 0.08 0.00 0.00 57.88 57.89 2pva h LEU 252 Cb 0.54 -0.29 0.00 0.00 1.08 0.00 0.00 40.66 42.00 2pva h LEU 252 CO 0.03 1.05 0.00 -0.26 -1.08 0.00 0.00 178.44 178.18 2pva h PHE 253 N 1.08 0.00 0.09 1.13 -1.00 -1.38 -2.23 116.94 114.63 2pva h PHE 253 Ca 0.22 0.00 -0.18 0.00 2.81 0.00 0.00 57.97 60.82 2pva h PHE 253 Cb 0.40 0.00 0.02 0.00 3.61 0.00 0.00 35.95 39.98 2pva h PHE 253 CO 0.03 0.00 -0.75 0.45 -1.61 0.00 0.00 178.31 176.43 2pva h HIS 254 N 0.00 0.57 -0.52 -0.55 3.86 -1.21 -2.64 115.15 114.66 2pva h HIS 254 Ca 0.00 -0.38 -0.00 0.00 -1.16 0.00 0.00 60.37 58.82 2pva h HIS 254 Cb 0.80 -0.04 -0.03 0.00 1.06 0.00 0.00 27.41 29.20 2pva h HIS 254 CO 0.00 1.26 0.31 0.82 0.86 0.00 0.00 177.93 181.18 2pva h ILE 255 N -0.27 1.16 0.00 2.45 2.04 -1.37 -1.93 117.51 119.59 2pva h ILE 255 Ca -0.12 -0.38 0.00 0.00 1.00 0.00 0.00 64.86 65.35 2pva h ILE 255 Cb 1.54 0.47 0.00 0.00 -0.74 0.00 0.00 36.82 38.09 2pva h ILE 255 CO 0.14 0.17 0.00 0.18 0.00 0.00 0.00 178.15 178.64 2pva n LEU 256 N -4.66 0.00 0.23 1.44 4.77 -0.85 -2.28 117.00 115.65 2pva n LEU 256 Ca 0.03 0.40 0.11 0.00 -0.03 0.00 0.00 56.01 56.51 2pva n LEU 256 Cb 0.06 -0.40 0.47 0.00 -2.33 0.00 0.00 43.42 41.23 2pva n LEU 256 CO 0.36 -0.10 0.82 0.77 -1.33 0.00 0.00 177.39 177.90 2pva h SER 257 N 0.00 0.00 0.80 -1.43 4.64 -0.95 -2.67 113.55 113.94 2pva h SER 257 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2pva h SER 257 Cb 0.30 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.39 2pva h SER 257 CO 0.00 0.20 0.00 -1.54 -0.87 0.00 0.00 176.83 174.62 2pva n SER 258 N -3.36 0.00 -0.43 4.97 3.41 -0.97 -2.98 113.62 114.25 2pva n SER 258 Ca 0.00 0.49 0.07 0.00 -0.26 0.00 0.00 58.87 59.17 2pva n SER 258 Cb 0.42 -0.49 0.13 0.00 -0.26 0.00 0.00 64.21 64.00 2pva n SER 258 CO 0.00 0.00 0.00 1.33 -0.16 0.00 0.00 175.04 176.21 2pva n VAL 259 N -1.49 1.52 -3.44 -3.33 0.24 -1.06 -5.03 118.33 105.73 2pva n VAL 259 Ca 0.06 -2.10 -0.38 0.00 -2.04 0.00 0.00 64.34 59.87 2pva n VAL 259 Cb 0.27 -0.01 -0.09 0.00 -1.47 0.00 0.00 33.84 32.55 2pva n VAL 259 CO 0.00 0.00 0.00 0.21 -2.14 0.00 0.00 176.83 174.90 2pva s ASN 260 N -2.62 6.27 -0.40 -1.34 3.84 -1.03 -4.93 114.94 114.73 2pva s ASN 260 Ca 0.29 0.31 -0.14 0.00 0.21 0.00 0.00 52.86 53.53 2pva s ASN 260 Cb 0.28 -2.19 0.02 0.00 -0.55 0.00 0.00 41.25 38.80 2pva s ASN 260 CO -0.02 -0.10 0.28 -0.63 -2.79 0.00 0.00 177.10 173.83 2pva s ILE 261 N 1.67 5.15 0.78 -5.21 1.01 -1.26 -4.99 121.20 118.35 2pva s ILE 261 Ca 0.14 -0.65 -0.13 0.00 0.00 0.00 0.00 60.65 60.01 2pva s ILE 261 Cb -0.15 -3.85 0.07 0.00 0.01 0.00 0.00 42.46 38.54 2pva s ILE 261 CO 0.09 -0.27 1.18 -2.84 0.00 0.00 0.00 174.94 173.10 2pva s PRO 262 N 1.66 1.87 0.18 2.79 0.02 -1.26 -2.60 135.00 137.67 2pva s PRO 262 Ca 0.05 1.66 -0.30 0.00 0.02 0.00 0.00 61.00 62.42 2pva s PRO 262 Cb -0.19 -1.81 -0.08 0.00 0.02 0.00 0.00 34.50 32.44 2pva s PRO 262 CO 0.09 -2.02 1.09 0.15 -0.33 0.00 0.00 177.00 175.98 2pva s LYS 263 N -4.18 4.61 0.00 5.54 1.02 -1.26 -3.58 119.74 121.89 2pva s LYS 263 Ca 0.71 1.70 0.00 0.00 0.02 0.00 0.00 55.97 58.40 2pva s LYS 263 Cb -0.26 -3.28 0.00 0.00 -0.52 0.00 0.00 37.83 33.77 2pva s LYS 263 CO 0.49 0.11 0.00 0.41 -0.92 0.00 0.00 175.35 175.44 2pva n GLY 264 N 1.98 3.00 0.15 -3.33 0.00 -1.26 -4.91 105.19 100.81 2pva n GLY 264 Ca 0.02 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.17 2pva n GLY 264 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 173.32 172.93 2pva h VAL 265 N 0.00 0.00 -3.21 1.61 -1.51 -1.89 -3.41 116.25 107.84 2pva h VAL 265 Ca 0.00 -0.43 -0.56 0.00 -1.23 0.00 0.00 66.70 64.48 2pva h VAL 265 Cb 0.00 1.32 -0.36 0.00 -2.13 0.00 0.00 31.29 30.12 2pva h VAL 265 CO 0.00 0.00 -0.82 -0.69 -1.23 0.00 0.00 177.57 174.83 2pva s VAL 266 N -3.29 1.28 0.13 7.19 1.01 -1.26 -5.09 120.40 120.38 2pva s VAL 266 Ca 0.06 -0.48 0.08 0.00 0.00 0.00 0.00 61.98 61.65 2pva s VAL 266 Cb 0.10 -1.23 -0.04 0.00 0.00 0.00 0.00 36.38 35.21 2pva s VAL 266 CO 0.51 0.41 -0.14 -0.76 0.00 0.00 0.00 175.10 175.12 2pva s LEU 267 N 1.38 2.86 0.89 3.92 1.43 -1.26 -1.93 118.68 125.97 2pva s LEU 267 Ca 0.00 -0.53 -0.11 0.00 -1.03 0.00 0.00 54.13 52.47 2pva s LEU 267 Cb -0.13 -1.64 0.18 0.00 0.03 0.00 0.00 46.19 44.62 2pva s LEU 267 CO -0.06 0.16 1.22 0.42 0.23 0.00 0.00 176.35 178.32 2pva s THR 268 N -1.32 2.03 -1.01 5.49 -4.23 -0.23 -4.92 115.64 111.45 2pva s THR 268 Ca 0.21 -0.19 0.25 0.00 -1.18 0.00 0.00 61.69 60.78 2pva s THR 268 Cb -0.10 -2.85 0.21 0.00 1.34 0.00 0.00 72.50 71.11 2pva s THR 268 CO 0.12 0.00 1.80 -0.46 -0.54 0.00 0.00 174.62 175.54 2pva n ASN 269 N -3.48 0.00 -0.66 3.99 2.04 -1.26 -2.46 115.26 113.43 2pva n ASN 269 Ca 0.15 0.48 0.06 0.00 -0.44 0.00 0.00 54.58 54.84 2pva n ASN 269 Cb 0.60 -0.49 0.19 0.00 -2.53 0.00 0.00 39.78 37.54 2pva n ASN 269 CO 0.00 0.00 0.00 -0.62 -0.44 0.00 0.00 177.26 176.20 2pva n GLU 270 N -1.49 1.83 -0.94 -3.83 4.71 -1.26 -4.92 120.64 114.74 2pva n GLU 270 Ca 0.06 -1.28 0.00 0.00 -0.01 0.00 0.00 57.16 55.93 2pva n GLU 270 Cb 0.29 -1.30 0.00 0.00 -1.01 0.00 0.00 31.44 29.42 2pva n GLU 270 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 2pva n GLY 271 N 1.09 0.69 3.78 0.62 0.00 -1.03 -5.03 105.19 105.30 2pva n GLY 271 Ca 0.13 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.76 2pva n GLY 271 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2pva s LYS 272 N -0.06 4.61 0.11 1.61 -0.14 -1.26 -4.75 119.74 119.85 2pva s LYS 272 Ca 0.00 1.23 -0.30 0.00 -1.36 0.00 0.00 55.97 55.54 2pva s LYS 272 Cb 0.00 -3.14 -0.06 0.00 -1.68 0.00 0.00 37.83 32.95 2pva s LYS 272 CO 0.00 0.49 1.16 0.99 -0.76 0.00 0.00 175.35 177.22 2pva s THR 273 N -1.28 3.98 -0.28 2.17 2.01 -1.26 -1.07 115.64 119.91 2pva s THR 273 Ca 0.40 1.53 -0.06 0.00 0.31 0.00 0.00 61.69 63.87 2pva s THR 273 Cb -0.22 -3.98 0.01 0.00 0.01 0.00 0.00 72.50 68.32 2pva s THR 273 CO 0.27 0.18 0.05 -0.62 -0.69 0.00 0.00 174.62 173.81 2pva s ASP 274 N 0.60 4.97 0.25 3.53 2.15 -0.81 -4.03 116.67 123.32 2pva s ASP 274 Ca 0.55 -0.68 -0.01 0.00 0.43 0.00 0.00 52.55 52.84 2pva s ASP 274 Cb -0.29 -1.85 -0.03 0.00 -0.30 0.00 0.00 42.92 40.45 2pva s ASP 274 CO 0.32 -0.16 0.24 -0.72 -0.17 0.00 0.00 175.17 174.68 2pva s TYR 275 N 1.48 1.19 -0.72 -5.34 1.13 -0.69 -4.43 117.35 109.97 2pva s TYR 275 Ca 0.03 -1.35 -0.23 0.00 -1.41 0.00 0.00 57.07 54.11 2pva s TYR 275 Cb -0.17 -0.45 0.07 0.00 -1.10 0.00 0.00 41.96 40.31 2pva s TYR 275 CO 0.01 -0.79 1.04 0.99 -2.51 0.00 0.00 175.55 174.29 2pva s THR 276 N -3.86 4.28 0.03 -3.49 2.01 -1.07 -1.24 115.64 112.31 2pva s THR 276 Ca 0.36 -0.43 -0.25 0.00 0.31 0.00 0.00 61.69 61.68 2pva s THR 276 Cb 0.04 -4.74 -0.17 0.00 0.01 0.00 0.00 72.50 67.64 2pva s THR 276 CO 0.16 -1.53 1.46 0.40 -0.69 0.00 0.00 174.62 174.42 2pva h ILE 277 N 6.00 0.99 -3.21 1.82 2.04 -1.33 -3.37 117.51 120.44 2pva h ILE 277 Ca -0.21 -0.50 -0.08 0.00 1.00 0.00 0.00 64.86 65.07 2pva h ILE 277 Cb 1.06 1.30 -0.16 0.00 -0.74 0.00 0.00 36.82 38.28 2pva h ILE 277 CO 1.20 0.12 -0.17 -0.72 0.00 0.00 0.00 178.15 178.58 2pva s TYR 278 N -5.21 -0.18 -0.10 1.37 -0.85 -1.24 -0.66 117.35 110.49 2pva s TYR 278 Ca -0.15 0.05 0.03 0.00 -0.52 0.00 0.00 57.07 56.48 2pva s TYR 278 Cb 0.03 0.16 0.01 0.00 0.38 0.00 0.00 41.96 42.55 2pva s TYR 278 CO 0.63 -0.56 -0.18 0.99 -1.52 0.00 0.00 175.55 174.92 2pva s THR 279 N -2.73 1.62 0.18 -3.49 2.01 -0.77 -1.40 115.64 111.06 2pva s THR 279 Ca -0.04 -0.74 0.09 0.00 0.31 0.00 0.00 61.69 61.31 2pva s THR 279 Cb -0.00 -1.45 -0.04 0.00 0.01 0.00 0.00 72.50 71.02 2pva s THR 279 CO -0.04 0.46 -0.17 -0.94 -0.69 0.00 0.00 174.62 173.24 2pva s SER 280 N 0.72 2.72 0.03 3.53 1.04 -0.42 -1.16 113.70 120.17 2pva s SER 280 Ca -0.12 -0.91 -0.05 0.00 0.48 0.00 0.00 55.95 55.35 2pva s SER 280 Cb -0.16 -0.16 -0.01 0.00 0.10 0.00 0.00 66.02 65.79 2pva s SER 280 CO 0.02 -0.06 0.09 0.00 0.98 0.00 0.00 173.24 174.27 2pva s ALA 281 N -2.29 -0.06 0.01 5.32 0.00 0.66 -1.54 121.76 123.86 2pva s ALA 281 Ca 0.18 -0.54 -0.11 0.00 0.00 0.00 0.00 51.96 51.49 2pva s ALA 281 Cb -0.05 0.24 0.01 0.00 0.00 0.00 0.00 23.12 23.32 2pva s ALA 281 CO 0.07 -0.30 0.22 -1.64 0.00 0.00 0.00 175.76 174.11 2pva s MET 282 N -2.50 0.61 -0.08 0.00 -1.94 -0.21 -0.22 119.30 114.96 2pva s MET 282 Ca -0.06 -0.39 0.01 0.00 -1.71 0.00 0.00 55.69 53.54 2pva s MET 282 Cb -0.02 0.26 0.02 0.00 2.01 0.00 0.00 34.83 37.10 2pva s MET 282 CO -0.04 -0.17 -0.09 0.00 -0.01 0.00 0.00 175.02 174.71 2pva h ALA 284 N 7.46 0.93 0.03 0.00 0.00 -1.41 -0.99 119.26 125.28 2pva h ALA 284 Ca -0.31 -0.38 -0.17 0.00 0.00 0.00 0.00 54.91 54.04 2pva h ALA 284 Cb 1.16 -0.13 0.02 0.00 0.00 0.00 0.00 17.79 18.84 2pva h ALA 284 CO 0.45 0.61 -0.69 1.96 0.00 0.00 0.00 179.25 181.58 2pva h GLN 285 N 0.54 0.41 0.00 0.00 7.50 -1.88 -3.35 115.11 118.33 2pva h GLN 285 Ca 0.07 -0.49 -0.19 0.00 0.50 0.00 0.00 58.65 58.54 2pva h GLN 285 Cb 0.77 0.15 -0.03 0.00 0.05 0.00 0.00 27.48 28.41 2pva h GLN 285 CO 0.06 1.15 -1.30 0.66 -1.50 0.00 0.00 178.83 177.91 2pva h SER 286 N -0.12 0.00 -2.67 1.46 4.64 -1.95 -3.48 113.55 111.43 2pva h SER 286 Ca -0.10 0.00 -0.28 0.00 -0.47 0.00 0.00 61.79 60.94 2pva h SER 286 Cb 1.42 0.00 0.02 0.00 -0.31 0.00 0.00 62.40 63.53 2pva h SER 286 CO 0.13 0.70 -0.40 0.29 -0.87 0.00 0.00 176.83 176.69 2pva n LYS 287 N -3.02 -2.33 -3.07 4.77 4.76 -0.38 -4.77 118.16 114.13 2pva n LYS 287 Ca -0.09 0.66 -0.35 0.00 -2.87 0.00 0.00 58.31 55.67 2pva n LYS 287 Cb 0.88 -4.95 -0.06 0.00 -1.84 0.00 0.00 35.03 29.06 2pva n LYS 287 CO 0.00 0.00 0.00 -0.80 -1.37 0.00 0.00 177.40 175.23 2pva s ASN 288 N -2.59 7.01 -0.15 4.39 0.01 -1.25 -2.33 114.94 120.03 2pva s ASN 288 Ca 0.11 1.43 0.01 0.00 -0.71 0.00 0.00 52.86 53.71 2pva s ASN 288 Cb -0.05 -2.43 0.01 0.00 0.41 0.00 0.00 41.25 39.19 2pva s ASN 288 CO 0.14 -0.05 -0.19 -0.47 -1.51 0.00 0.00 177.10 175.02 2pva s TYR 289 N -1.66 2.73 0.15 2.20 5.04 0.11 -2.47 117.35 123.45 2pva s TYR 289 Ca 0.47 -1.29 0.11 0.00 -2.44 0.00 0.00 57.07 53.92 2pva s TYR 289 Cb -0.15 -1.86 -0.04 0.00 0.35 0.00 0.00 41.96 40.26 2pva s TYR 289 CO 0.20 -0.60 -0.25 0.71 -1.34 0.00 0.00 175.55 174.27 2pva s TYR 290 N 0.91 2.24 0.02 4.97 1.51 0.69 -0.50 117.35 127.20 2pva s TYR 290 Ca -0.04 -0.38 -0.26 0.00 -1.01 0.00 0.00 57.07 55.38 2pva s TYR 290 Cb -0.15 -1.18 0.06 0.00 -0.11 0.00 0.00 41.96 40.58 2pva s TYR 290 CO -0.03 0.37 0.60 -0.59 -1.11 0.00 0.00 175.55 174.79 2pva s PHE 291 N -1.27 -0.55 0.27 2.71 -0.71 -0.57 -0.25 117.98 117.63 2pva s PHE 291 Ca 0.15 0.73 0.04 0.00 -1.04 0.00 0.00 56.93 56.81 2pva s PHE 291 Cb -0.09 0.41 -0.06 0.00 -1.21 0.00 0.00 43.02 42.07 2pva s PHE 291 CO 0.07 -0.66 0.02 -1.59 -1.34 0.00 0.00 175.22 171.72 2pva s LYS 292 N -2.09 1.48 0.27 1.99 -2.85 -0.31 -1.10 119.74 117.12 2pva s LYS 292 Ca -0.07 -1.78 0.05 0.00 -1.00 0.00 0.00 55.97 53.17 2pva s LYS 292 Cb -0.01 -0.74 -0.06 0.00 -2.06 0.00 0.00 37.83 34.97 2pva s LYS 292 CO 0.02 -0.13 -0.02 -0.51 0.10 0.00 0.00 175.35 174.81 2pva s LEU 293 N -3.38 2.33 0.15 2.77 1.02 -0.21 -1.85 118.68 119.51 2pva s LEU 293 Ca 0.32 -1.23 -0.21 0.00 0.02 0.00 0.00 54.13 53.04 2pva s LEU 293 Cb 0.07 -0.46 0.04 0.00 0.02 0.00 0.00 46.19 45.86 2pva s LEU 293 CO 0.12 -0.44 1.65 0.22 0.02 0.00 0.00 176.35 177.91 2pva h TYR 294 N 2.33 -0.46 -0.06 0.29 3.20 -1.05 -2.13 116.97 119.09 2pva h TYR 294 Ca -0.39 0.03 0.00 0.00 3.14 0.00 0.00 58.73 61.51 2pva h TYR 294 Cb 1.23 0.24 0.00 0.00 1.54 0.00 0.00 36.73 39.74 2pva h TYR 294 CO 0.63 -0.25 0.00 -0.25 -1.64 0.00 0.00 178.16 176.64 2pva n ASP 295 N -5.34 1.33 -3.59 -2.11 8.00 -1.26 -4.73 116.55 108.85 2pva n ASP 295 Ca -0.00 -1.52 -0.25 0.00 0.71 0.00 0.00 54.79 53.73 2pva n ASP 295 Cb 0.25 -0.04 -0.16 0.00 -0.02 0.00 0.00 41.12 41.16 2pva n ASP 295 CO 0.00 0.00 0.00 0.21 -0.39 0.00 0.00 177.20 177.02 2pva s ASN 296 N -1.83 2.36 0.40 -2.24 2.47 -0.80 -2.44 114.94 112.86 2pva s ASN 296 Ca 0.36 -0.65 0.27 0.00 0.42 0.00 0.00 52.86 53.27 2pva s ASN 296 Cb 0.19 -0.17 0.92 0.00 -1.45 0.00 0.00 41.25 40.73 2pva s ASN 296 CO 0.31 -0.36 1.79 -1.28 -3.72 0.00 0.00 177.10 173.84 2pva h SER 297 N 8.40 0.00 -3.66 -4.21 0.87 -1.85 -0.53 113.55 112.58 2pva h SER 297 Ca -0.16 0.00 -0.51 0.00 -1.23 0.00 0.00 61.79 59.90 2pva h SER 297 Cb 1.13 0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 63.08 2pva h SER 297 CO 0.31 0.00 0.40 -0.60 -0.53 0.00 0.00 176.83 176.41 2pva s ARG 298 N -3.37 4.72 -0.00 2.24 3.52 -1.26 -4.92 118.95 119.88 2pva s ARG 298 Ca 0.05 1.58 -0.28 0.00 -0.13 0.00 0.00 55.73 56.94 2pva s ARG 298 Cb 0.09 -3.29 -0.03 0.00 -1.56 0.00 0.00 34.95 30.15 2pva s ARG 298 CO 0.55 0.29 0.91 0.42 -0.81 0.00 0.00 175.30 176.66 2pva s ILE 299 N -0.63 4.87 -0.02 4.11 1.01 -1.26 -4.56 121.20 124.72 2pva s ILE 299 Ca 0.45 1.91 0.01 0.00 0.00 0.00 0.00 60.65 63.02 2pva s ILE 299 Cb -0.27 -4.25 -0.03 0.00 0.01 0.00 0.00 42.46 37.92 2pva s ILE 299 CO 0.33 0.20 -0.02 -0.44 0.00 0.00 0.00 174.94 175.01 2pva s SER 300 N 0.84 5.00 0.07 3.58 0.01 -0.26 -4.93 113.70 118.02 2pva s SER 300 Ca 0.48 -0.01 0.07 0.00 1.31 0.00 0.00 55.95 57.80 2pva s SER 300 Cb -0.20 -1.30 -0.03 0.00 0.21 0.00 0.00 66.02 64.70 2pva s SER 300 CO 0.26 0.31 -0.18 0.00 0.41 0.00 0.00 173.24 174.04 2pva s ALA 301 N -1.00 1.52 -0.03 1.44 0.00 -1.26 -1.51 121.76 120.92 2pva s ALA 301 Ca 0.17 -1.07 0.03 0.00 0.00 0.00 0.00 51.96 51.09 2pva s ALA 301 Cb -0.11 -0.22 0.00 0.00 0.00 0.00 0.00 23.12 22.80 2pva s ALA 301 CO 0.07 0.29 -0.10 0.08 0.00 0.00 0.00 175.76 176.10 2pva s VAL 302 N -1.06 0.89 -0.23 0.00 1.01 0.35 -4.96 120.40 116.40 2pva s VAL 302 Ca 0.04 -0.41 -0.06 0.00 0.00 0.00 0.00 61.98 61.54 2pva s VAL 302 Cb -0.09 -0.80 -0.02 0.00 0.00 0.00 0.00 36.38 35.47 2pva s VAL 302 CO 0.03 0.28 0.02 -0.55 0.00 0.00 0.00 175.10 174.88 2pva s SER 303 N 0.23 4.84 0.17 3.32 0.15 -1.26 0.09 113.70 121.24 2pva s SER 303 Ca -0.04 -0.25 -0.12 0.00 0.70 0.00 0.00 55.95 56.24 2pva s SER 303 Cb -0.10 -1.85 0.08 0.00 -1.71 0.00 0.00 66.02 62.44 2pva s SER 303 CO 0.01 -0.01 1.73 0.25 1.20 0.00 0.00 173.24 176.42 2pva h LEU 304 N 8.02 0.83 -0.13 3.45 5.85 -1.76 -3.14 115.31 128.43 2pva h LEU 304 Ca -0.39 -0.17 0.00 0.00 0.84 0.00 0.00 57.88 58.17 2pva h LEU 304 Cb 1.17 -0.22 0.00 0.00 0.37 0.00 0.00 40.66 41.99 2pva h LEU 304 CO 0.59 0.77 0.00 0.23 -0.34 0.00 0.00 178.44 179.70 2pva n MET 305 N -4.46 1.08 -0.21 1.25 2.81 -1.26 -3.11 117.12 113.22 2pva n MET 305 Ca 0.04 -0.13 0.09 0.00 -1.81 0.00 0.00 57.70 55.89 2pva n MET 305 Cb 0.16 -1.33 0.25 0.00 -0.71 0.00 0.00 33.22 31.59 2pva n MET 305 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 2pva n ALA 306 N -0.68 2.44 -2.62 3.04 0.00 -1.19 -4.94 120.51 116.56 2pva n ALA 306 Ca 0.15 -0.82 -0.28 0.00 0.00 0.00 0.00 53.44 52.50 2pva n ALA 306 Cb 0.10 -0.97 -0.11 0.00 0.00 0.00 0.00 19.45 18.47 2pva n ALA 306 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 2pva s GLU 307 N -1.44 1.96 -0.50 0.00 0.41 -1.18 -5.07 118.70 112.87 2pva s GLU 307 Ca 0.34 -2.11 -0.26 0.00 -0.41 0.00 0.00 54.97 52.52 2pva s GLU 307 Cb 0.18 -1.63 0.03 0.00 -1.78 0.00 0.00 34.13 30.93 2pva s GLU 307 CO 0.24 -0.05 1.01 1.21 -0.49 0.00 0.00 175.26 177.17 2pva s ASN 308 N -3.71 6.47 0.00 -0.19 3.04 -1.26 -4.84 114.94 114.45 2pva s ASN 308 Ca 0.35 0.06 0.23 0.00 0.04 0.00 0.00 52.86 53.54 2pva s ASN 308 Cb 0.10 -2.48 1.24 0.00 -1.54 0.00 0.00 41.25 38.57 2pva s ASN 308 CO 0.18 -1.19 1.76 0.18 -3.04 0.00 0.00 177.10 174.99 2pva n LEU 309 N 7.55 0.00 -0.68 3.21 4.32 -1.26 -1.25 117.00 128.89 2pva n LEU 309 Ca 0.06 0.19 0.09 0.00 -0.02 0.00 0.00 56.01 56.34 2pva n LEU 309 Cb 0.48 -0.19 0.06 0.00 -1.62 0.00 0.00 43.42 42.16 2pva n LEU 309 CO 0.66 -0.05 0.49 0.59 -1.22 0.00 0.00 177.39 177.86 2pva n ASN 310 N -1.19 2.39 -4.33 -1.43 5.03 -1.26 -0.66 115.26 113.82 2pva n ASN 310 Ca 0.13 -1.70 -0.37 0.00 0.87 0.00 0.00 54.58 53.52 2pva n ASN 310 Cb 0.15 0.12 0.05 0.00 -1.02 0.00 0.00 39.78 39.07 2pva n ASN 310 CO 0.00 0.00 0.00 -0.24 -1.83 0.00 0.00 177.26 175.19 2pva n SER 311 N 0.79 -2.70 0.02 6.41 2.88 -0.38 -4.90 113.62 115.74 2pva n SER 311 Ca 0.10 0.55 0.11 0.00 -1.33 0.00 0.00 58.87 58.31 2pva n SER 311 Cb 0.46 -1.03 -0.01 0.00 -0.75 0.00 0.00 64.21 62.87 2pva n SER 311 CO 0.00 0.00 0.00 1.67 -1.23 0.00 0.00 175.04 175.48 2pva n GLN 312 N 0.49 0.27 -4.38 -1.46 7.27 -1.26 -4.71 117.38 113.59 2pva n GLN 312 Ca 0.08 -0.02 -0.28 0.00 0.07 0.00 0.00 57.00 56.84 2pva n GLN 312 Cb 0.50 -1.57 -0.13 0.00 2.41 0.00 0.00 30.24 31.45 2pva n GLN 312 CO 0.00 0.00 0.00 -0.51 0.07 0.00 0.00 177.06 176.62 2pva s ASP 313 N -3.81 3.25 0.44 1.69 1.01 -1.26 -5.02 116.67 112.96 2pva s ASP 313 Ca 0.03 -0.76 -0.25 0.00 0.71 0.00 0.00 52.55 52.29 2pva s ASP 313 Cb 0.15 -0.22 -0.09 0.00 1.01 0.00 0.00 42.92 43.77 2pva s ASP 313 CO 0.82 0.16 1.26 0.18 0.21 0.00 0.00 175.17 177.79 2pva n LEU 314 N 0.84 4.12 -4.30 1.23 4.32 -1.26 -4.78 117.00 117.17 2pva n LEU 314 Ca -0.17 1.08 -0.34 0.00 -0.02 0.00 0.00 56.01 56.56 2pva n LEU 314 Cb 0.53 -1.50 -0.14 0.00 -1.62 0.00 0.00 43.42 40.69 2pva n LEU 314 CO 0.24 -0.72 -0.43 -0.63 -1.22 0.00 0.00 177.39 174.62 2pva s ILE 315 N -1.23 3.03 0.07 -0.08 1.01 -0.97 -4.98 121.20 118.04 2pva s ILE 315 Ca 0.63 -0.63 0.06 0.00 0.00 0.00 0.00 60.65 60.71 2pva s ILE 315 Cb -0.49 -2.33 -0.03 0.00 0.01 0.00 0.00 42.46 39.62 2pva s ILE 315 CO 0.57 0.48 -0.16 0.42 0.00 0.00 0.00 174.94 176.25 2pva s THR 316 N 1.05 1.25 -0.05 2.92 -4.23 -1.26 -0.28 115.64 115.04 2pva s THR 316 Ca -0.00 -1.26 0.04 0.00 -1.18 0.00 0.00 61.69 59.28 2pva s THR 316 Cb -0.15 -1.16 0.00 0.00 1.34 0.00 0.00 72.50 72.53 2pva s THR 316 CO -0.02 -0.11 -0.16 -0.36 -0.54 0.00 0.00 174.62 173.43 2pva s PHE 317 N -1.12 1.71 0.24 3.99 0.40 0.19 -4.99 117.98 118.41 2pva s PHE 317 Ca 0.01 -0.55 -0.08 0.00 -0.60 0.00 0.00 56.93 55.71 2pva s PHE 317 Cb -0.09 -1.17 -0.07 0.00 0.51 0.00 0.00 43.02 42.20 2pva s PHE 317 CO 0.02 -0.21 0.55 -1.21 0.70 0.00 0.00 175.22 175.06 2pva s GLU 318 N 0.22 3.75 0.16 0.44 0.41 -1.26 -1.45 118.70 120.96 2pva s GLU 318 Ca -0.08 0.19 -0.31 0.00 -0.41 0.00 0.00 54.97 54.36 2pva s GLU 318 Cb -0.13 -2.65 -0.09 0.00 -1.78 0.00 0.00 34.13 29.48 2pva s GLU 318 CO 0.03 0.29 1.42 -1.58 -0.49 0.00 0.00 175.26 174.93 2pva s TRP 319 N -1.89 3.18 -0.68 1.61 0.52 -1.26 -4.95 118.94 115.48 2pva s TRP 319 Ca 0.46 0.94 -0.17 0.00 0.02 0.00 0.00 56.10 57.35 2pva s TRP 319 Cb -0.11 -3.73 0.14 0.00 -1.15 0.00 0.00 33.47 28.61 2pva s TRP 319 CO 0.24 -2.53 0.74 0.34 0.02 0.00 0.00 176.95 175.75 2pva s ASP 320 N 0.89 6.36 -1.23 2.95 2.15 -1.26 -4.93 116.67 121.60 2pva s ASP 320 Ca 0.64 -1.83 -0.04 0.00 0.43 0.00 0.00 52.55 51.74 2pva s ASP 320 Cb -0.39 -2.28 0.18 0.00 -0.30 0.00 0.00 42.92 40.14 2pva s ASP 320 CO 0.33 -0.96 2.21 -2.11 -0.17 0.00 0.00 175.17 174.47 2pva n ARG 321 N 5.69 4.86 -4.38 4.34 1.85 -1.26 -4.79 116.66 122.98 2pva n ARG 321 Ca -0.01 -3.84 -0.20 0.00 -1.00 0.00 0.00 57.85 52.79 2pva n ARG 321 Cb 0.44 -2.58 -0.15 0.00 -1.05 0.00 0.00 32.46 29.11 2pva n ARG 321 CO 0.00 0.00 0.00 0.21 -0.01 0.00 0.00 177.63 177.83 2pva s LYS 322 N -2.14 0.95 -0.12 2.89 2.20 -1.26 -4.89 119.74 117.38 2pva s LYS 322 Ca 0.49 -0.29 -0.29 0.00 -0.36 0.00 0.00 55.97 55.52 2pva s LYS 322 Cb 0.19 -0.89 -0.06 0.00 -1.51 0.00 0.00 37.83 35.55 2pva s LYS 322 CO -0.10 0.10 2.02 -1.14 -0.36 0.00 0.00 175.35 175.87 2pva s GLN 323 N 0.23 3.63 -1.26 4.03 2.00 -1.02 -4.57 119.66 122.70 2pva s GLN 323 Ca -0.04 2.19 -0.17 0.00 -2.00 0.00 0.00 55.36 55.35 2pva s GLN 323 Cb -0.09 -4.24 0.11 0.00 0.80 0.00 0.00 33.01 29.59 2pva s GLN 323 CO 0.00 -1.53 1.62 0.34 -0.50 0.00 0.00 175.29 175.22 2pva s ASP 324 N 6.14 6.91 -0.06 6.67 -1.08 -1.26 -4.98 116.67 129.01 2pva s ASP 324 Ca 0.91 -2.62 -0.25 0.00 -0.52 0.00 0.00 52.55 50.07 2pva s ASP 324 Cb -0.35 -2.51 -0.03 0.00 -1.46 0.00 0.00 42.92 38.56 2pva s ASP 324 CO 0.37 -1.03 0.76 -0.63 0.52 0.00 0.00 175.17 175.16 2pva s ILE 325 N 3.30 5.00 -0.78 4.11 1.01 -1.26 -4.83 121.20 127.74 2pva s ILE 325 Ca 0.50 1.57 -0.25 0.00 0.00 0.00 0.00 60.65 62.47 2pva s ILE 325 Cb 0.01 -4.10 0.05 0.00 0.01 0.00 0.00 42.46 38.43 2pva s ILE 325 CO 0.05 0.22 1.24 -0.75 0.00 0.00 0.00 174.94 175.69 2pva s LYS 326 N 0.95 3.26 0.13 2.79 2.20 -1.26 -4.99 119.74 122.81 2pva s LYS 326 Ca 0.40 -0.59 -0.31 0.00 -0.36 0.00 0.00 55.97 55.11 2pva s LYS 326 Cb -0.18 -4.43 -0.10 0.00 -1.51 0.00 0.00 37.83 31.62 2pva s LYS 326 CO 0.19 -2.07 1.64 -0.65 -0.36 0.00 0.00 175.35 174.10 2pva s GLN 327 N 5.12 4.19 -0.01 4.03 -0.21 -1.26 -4.88 119.66 126.64 2pva s GLN 327 Ca 0.34 2.39 0.18 0.00 0.02 0.00 0.00 55.36 58.29 2pva s GLN 327 Cb -0.08 -3.35 -0.23 0.00 1.00 0.00 0.00 33.01 30.35 2pva s GLN 327 CO 0.09 -0.69 0.58 1.28 -2.12 0.00 0.00 175.29 174.43 2pva n LEU 328 N 4.72 0.44 -2.62 2.90 4.77 -1.26 -4.62 117.00 121.33 2pva n LEU 328 Ca 0.15 -0.27 -0.01 0.00 -0.03 0.00 0.00 56.01 55.85 2pva n LEU 328 Cb 0.39 0.00 0.07 0.00 -2.33 0.00 0.00 43.42 41.55 2pva n LEU 328 CO 0.62 0.11 0.26 -0.46 -1.33 0.00 0.00 177.39 176.59 2pva n ASN 329 N -1.74 0.26 -3.60 -1.43 6.94 -1.26 -4.99 115.26 109.44 2pva n ASN 329 Ca 0.00 -2.09 -0.26 0.00 -0.02 0.00 0.00 54.58 52.21 2pva n ASN 329 Cb 0.36 0.01 0.05 0.00 -2.36 0.00 0.00 39.78 37.84 2pva n ASN 329 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 2pva n GLN 330 N -0.88 -2.20 -1.24 -3.83 6.02 -1.26 -4.93 117.38 109.06 2pva n GLN 330 Ca -0.04 0.58 -0.30 0.00 -0.01 0.00 0.00 57.00 57.22 2pva n GLN 330 Cb 0.85 -4.71 0.22 0.00 1.02 0.00 0.00 30.24 27.62 2pva n GLN 330 CO 0.00 0.00 0.00 0.14 -1.01 0.00 0.00 177.06 176.19 2pva s VAL 331 N -3.51 1.70 -2.06 5.09 -7.23 -1.26 -5.16 120.40 107.97 2pva s VAL 331 Ca 0.37 0.00 0.16 0.00 -1.81 0.00 0.00 61.98 60.70 2pva s VAL 331 Cb -0.11 -2.58 0.13 0.00 0.56 0.00 0.00 36.38 34.38 2pva s VAL 331 CO 0.83 0.00 1.02 0.59 -0.31 0.00 0.00 175.10 177.23