#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2wcg s ARG 2 N 0.00 4.30 0.60 0.00 0.52 -1.22 -4.93 118.95 118.23 2wcg s ARG 2 Ca 0.00 0.69 -0.13 0.00 -0.52 0.00 0.00 55.73 55.77 2wcg s ARG 2 Cb 0.00 -3.35 -0.04 0.00 0.52 0.00 0.00 34.95 32.08 2wcg s ARG 2 CO 0.00 0.34 1.03 -1.25 0.02 0.00 0.00 175.30 175.44 2wcg s PRO 3 N -0.09 3.56 0.18 3.54 0.04 -1.26 -1.12 135.00 139.85 2wcg s PRO 3 Ca 0.30 0.87 -0.33 0.00 0.04 0.00 0.00 61.00 61.88 2wcg s PRO 3 Cb -0.18 -2.08 -0.15 0.00 0.04 0.00 0.00 34.50 32.14 2wcg s PRO 3 CO 0.16 -0.60 1.34 0.00 0.04 0.00 0.00 177.00 177.94 2wcg s ILE 5 N 0.15 4.86 0.33 0.00 -1.09 -1.26 -4.98 121.20 119.21 2wcg s ILE 5 Ca 0.74 -0.78 -0.26 0.00 -2.23 0.00 0.00 60.65 58.12 2wcg s ILE 5 Cb -0.77 -4.39 -0.10 0.00 -1.58 0.00 0.00 42.46 35.62 2wcg s ILE 5 CO 0.48 -0.96 0.98 -2.16 -1.23 0.00 0.00 174.94 172.05 2wcg s PRO 6 N 2.61 4.52 -0.07 2.79 0.04 -1.26 -0.16 135.00 143.48 2wcg s PRO 6 Ca 0.13 1.43 -0.03 0.00 0.04 0.00 0.00 61.00 62.56 2wcg s PRO 6 Cb -0.22 -2.82 0.04 0.00 0.04 0.00 0.00 34.50 31.53 2wcg s PRO 6 CO 0.09 0.20 0.16 0.21 0.04 0.00 0.00 177.00 177.69 2wcg s LYS 7 N -2.02 0.12 -0.03 4.56 2.20 0.10 -4.87 119.74 119.79 2wcg s LYS 7 Ca 0.51 0.36 -0.13 0.00 -0.36 0.00 0.00 55.97 56.35 2wcg s LYS 7 Cb -0.21 -0.13 -0.05 0.00 -1.51 0.00 0.00 37.83 35.92 2wcg s LYS 7 CO 0.27 -0.14 0.34 0.45 -0.36 0.00 0.00 175.35 175.91 2wcg s SER 8 N 1.00 6.70 -0.17 1.43 0.15 -1.26 -1.39 113.70 120.16 2wcg s SER 8 Ca -0.08 0.83 0.17 0.00 0.70 0.00 0.00 55.95 57.57 2wcg s SER 8 Cb -0.10 -2.21 0.44 0.00 -1.71 0.00 0.00 66.02 62.45 2wcg s SER 8 CO -0.05 0.34 1.32 0.49 1.20 0.00 0.00 173.24 176.54 2wcg n PHE 9 N 1.93 0.59 -0.52 3.44 3.01 -1.26 -4.97 117.46 119.67 2wcg n PHE 9 Ca -0.15 -0.99 0.00 0.00 1.01 0.00 0.00 57.45 57.32 2wcg n PHE 9 Cb 0.53 -0.27 0.00 0.00 -0.01 0.00 0.00 39.48 39.73 2wcg n PHE 9 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 2wcg n GLY 10 N -0.91 0.75 0.00 1.37 0.00 -1.26 -4.97 105.19 100.17 2wcg n GLY 10 Ca 0.20 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.22 2wcg n GLY 10 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 2wcg n TYR 11 N -2.35 -1.22 0.26 1.61 4.02 -1.26 -5.00 117.16 113.21 2wcg n TYR 11 Ca 0.00 0.00 0.15 0.00 -0.01 0.00 0.00 57.90 58.04 2wcg n TYR 11 Cb 0.00 0.00 0.53 0.00 -0.02 0.00 0.00 39.34 39.85 2wcg n TYR 11 CO 0.00 0.00 0.00 0.66 -1.01 0.00 0.00 176.86 176.51 2wcg h SER 12 N 0.00 0.00 -1.55 7.72 4.64 -1.90 -3.46 113.55 119.01 2wcg h SER 12 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2wcg h SER 12 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 2wcg h SER 12 CO 0.00 0.03 0.00 -0.24 -0.87 0.00 0.00 176.83 175.75 2wcg n SER 13 N -3.12 0.00 -4.75 4.97 2.88 -0.30 -4.83 113.62 108.48 2wcg n SER 13 Ca 0.01 -0.85 -0.23 0.00 -1.33 0.00 0.00 58.87 56.48 2wcg n SER 13 Cb 0.38 0.00 -0.06 0.00 -0.75 0.00 0.00 64.21 63.78 2wcg n SER 13 CO 0.00 0.00 0.00 0.68 -1.23 0.00 0.00 175.04 174.49 2wcg s VAL 14 N -2.06 4.04 0.31 2.46 -7.23 -1.25 -4.57 120.40 112.10 2wcg s VAL 14 Ca 0.00 -1.58 0.05 0.00 -1.81 0.00 0.00 61.98 58.64 2wcg s VAL 14 Cb 0.00 -3.17 -0.02 0.00 0.56 0.00 0.00 36.38 33.75 2wcg s VAL 14 CO 0.00 -0.34 0.44 0.68 -0.31 0.00 0.00 175.10 175.57 2wcg s VAL 15 N -2.17 4.54 -0.24 1.32 -7.23 -0.48 -4.43 120.40 111.71 2wcg s VAL 15 Ca 0.32 -0.95 -0.09 0.00 -1.81 0.00 0.00 61.98 59.45 2wcg s VAL 15 Cb -0.07 -3.59 -0.04 0.00 0.56 0.00 0.00 36.38 33.23 2wcg s VAL 15 CO 0.23 -0.24 0.12 0.00 -0.31 0.00 0.00 175.10 174.89 2wcg s VAL 17 N 1.15 5.00 0.13 0.00 1.01 0.78 -1.28 120.40 127.19 2wcg s VAL 17 Ca 0.06 1.48 0.07 0.00 0.00 0.00 0.00 61.98 63.58 2wcg s VAL 17 Cb -0.14 -4.06 -0.04 0.00 0.00 0.00 0.00 36.38 32.14 2wcg s VAL 17 CO 0.05 0.18 -0.16 0.00 0.00 0.00 0.00 175.10 175.17 2wcg n ASN 19 N 0.54 0.00 0.21 0.00 0.23 0.38 -1.94 115.26 114.68 2wcg n ASN 19 Ca -0.15 -0.07 0.07 0.00 -0.53 0.00 0.00 54.58 53.89 2wcg n ASN 19 Cb 0.57 0.00 0.44 0.00 -2.08 0.00 0.00 39.78 38.70 2wcg n ASN 19 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 2wcg h ALA 20 N 1.79 1.12 -0.00 -2.53 0.00 -1.91 -3.20 119.26 114.53 2wcg h ALA 20 Ca 0.00 -0.28 0.00 0.00 0.00 0.00 0.00 54.91 54.63 2wcg h ALA 20 Cb 0.00 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 17.74 2wcg h ALA 20 CO 0.00 0.38 -0.20 0.25 0.00 0.00 0.00 179.25 179.68 2wcg n THR 21 N -3.63 0.00 -3.76 0.00 -2.24 -1.26 -4.24 114.28 99.16 2wcg n THR 21 Ca -0.01 -0.40 -0.15 0.00 -2.27 0.00 0.00 64.05 61.22 2wcg n THR 21 Cb 0.43 1.04 -0.16 0.00 -2.10 0.00 0.00 70.33 69.54 2wcg n THR 21 CO 0.00 0.00 0.00 -0.47 -0.57 0.00 0.00 175.07 174.03 2wcg s TYR 22 N -1.28 -0.01 -0.06 4.78 5.04 -1.21 -5.14 117.35 119.47 2wcg s TYR 22 Ca 0.04 0.22 -0.13 0.00 -2.44 0.00 0.00 57.07 54.76 2wcg s TYR 22 Cb 0.05 -0.23 0.03 0.00 0.35 0.00 0.00 41.96 42.16 2wcg s TYR 22 CO 0.20 -0.12 0.31 0.00 -1.34 0.00 0.00 175.55 174.60 2wcg s ASP 24 N -0.70 6.15 0.34 0.00 -4.77 -1.26 -4.76 116.67 111.66 2wcg s ASP 24 Ca -0.08 2.47 -0.06 0.00 -3.30 0.00 0.00 52.55 51.58 2wcg s ASP 24 Cb -0.04 -2.62 0.01 0.00 -1.09 0.00 0.00 42.92 39.18 2wcg s ASP 24 CO 0.03 -0.94 0.52 -0.94 0.70 0.00 0.00 175.17 174.53 2wcg s SER 25 N -1.10 0.66 0.29 2.11 1.04 -0.27 -4.92 113.70 111.51 2wcg s SER 25 Ca 0.62 -1.37 0.00 0.00 0.48 0.00 0.00 55.95 55.67 2wcg s SER 25 Cb -0.33 0.68 0.00 0.00 0.10 0.00 0.00 66.02 66.47 2wcg s SER 25 CO 0.41 -1.34 0.00 0.49 0.98 0.00 0.00 173.24 173.78 2wcg n PHE 26 N -0.54 -1.96 -4.53 5.02 3.01 -0.55 -3.40 117.46 114.51 2wcg n PHE 26 Ca -0.01 0.00 -0.26 0.00 1.01 0.00 0.00 57.45 58.20 2wcg n PHE 26 Cb 0.61 0.00 -0.08 0.00 -0.01 0.00 0.00 39.48 40.00 2wcg n PHE 26 CO 0.00 0.00 0.00 -1.25 1.01 0.00 0.00 176.76 176.52 2wcg s PRO 32 N -0.77 1.92 0.00 -1.08 0.04 -1.26 -2.63 135.00 131.22 2wcg s PRO 32 Ca 0.00 -2.17 0.00 0.00 0.04 0.00 0.00 61.00 58.87 2wcg s PRO 32 Cb 0.00 -0.70 0.00 0.00 0.04 0.00 0.00 34.50 33.84 2wcg s PRO 32 CO 0.00 -0.44 0.00 0.00 0.04 0.00 0.00 177.00 176.60 2wcg n ALA 33 N -0.91 0.00 -2.33 8.56 0.00 -1.26 -4.99 120.51 119.57 2wcg n ALA 33 Ca -0.07 0.00 -0.12 0.00 0.00 0.00 0.00 53.44 53.26 2wcg n ALA 33 Cb 0.65 0.00 -0.10 0.00 0.00 0.00 0.00 19.45 20.00 2wcg n ALA 33 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2wcg s LEU 34 N 0.00 2.45 -1.07 0.00 1.43 -1.26 -4.03 118.68 116.21 2wcg s LEU 34 Ca 0.00 -0.90 -0.22 0.00 -1.03 0.00 0.00 54.13 51.97 2wcg s LEU 34 Cb 0.00 -0.12 -0.00 0.00 0.03 0.00 0.00 46.19 46.10 2wcg s LEU 34 CO 0.00 -0.39 1.74 -0.83 0.23 0.00 0.00 176.35 177.10 2wcg s GLY 35 N -2.71 0.81 0.28 -3.19 0.00 -1.26 -5.05 107.32 96.19 2wcg s GLY 35 Ca 0.07 -2.14 0.10 0.00 0.00 0.00 0.00 44.72 42.75 2wcg s GLY 35 CO -0.03 3.09 -0.02 -0.51 0.00 0.00 0.00 173.10 175.63 2wcg s THR 36 N 7.45 3.27 0.20 0.90 -4.23 -1.26 -1.68 115.64 120.30 2wcg s THR 36 Ca 0.59 -1.96 0.08 0.00 -1.18 0.00 0.00 61.69 59.22 2wcg s THR 36 Cb -0.01 -2.79 -0.04 0.00 1.34 0.00 0.00 72.50 71.00 2wcg s THR 36 CO 0.00 -0.36 0.01 0.72 -0.54 0.00 0.00 174.62 174.46 2wcg s PHE 37 N -2.36 2.83 -0.03 3.99 -0.12 0.15 -4.64 117.98 117.78 2wcg s PHE 37 Ca 0.32 -0.16 -0.03 0.00 -0.05 0.00 0.00 56.93 57.02 2wcg s PHE 37 Cb -0.06 -1.33 -0.04 0.00 -0.63 0.00 0.00 43.02 40.96 2wcg s PHE 37 CO 0.19 0.54 0.12 -1.12 -0.05 0.00 0.00 175.22 174.91 2wcg s SER 38 N -3.19 6.02 -0.09 1.98 0.01 -0.18 -2.24 113.70 116.02 2wcg s SER 38 Ca 0.29 0.28 0.01 0.00 1.31 0.00 0.00 55.95 57.84 2wcg s SER 38 Cb -0.08 -1.83 0.02 0.00 0.21 0.00 0.00 66.02 64.33 2wcg s SER 38 CO 0.19 0.30 -0.11 -0.60 0.41 0.00 0.00 173.24 173.44 2wcg s ARG 39 N -1.61 1.70 -0.14 12.44 3.52 -0.07 -1.03 118.95 133.77 2wcg s ARG 39 Ca 0.22 -0.38 -0.05 0.00 -0.13 0.00 0.00 55.73 55.39 2wcg s ARG 39 Cb -0.12 -1.52 -0.04 0.00 -1.56 0.00 0.00 34.95 31.71 2wcg s ARG 39 CO 0.13 -0.08 0.04 0.71 -0.81 0.00 0.00 175.30 175.29 2wcg s TYR 40 N 1.05 3.25 -0.01 5.12 1.51 0.25 -0.72 117.35 127.79 2wcg s TYR 40 Ca -0.07 0.14 0.02 0.00 -1.01 0.00 0.00 57.07 56.15 2wcg s TYR 40 Cb -0.15 -1.95 -0.01 0.00 -0.11 0.00 0.00 41.96 39.75 2wcg s TYR 40 CO -0.01 0.32 -0.08 -2.00 -1.11 0.00 0.00 175.55 172.67 2wcg s GLU 41 N -0.24 0.65 -0.02 -0.62 2.12 -0.24 -1.24 118.70 119.11 2wcg s GLU 41 Ca 0.07 -0.28 0.03 0.00 0.36 0.00 0.00 54.97 55.15 2wcg s GLU 41 Cb -0.12 -0.63 0.00 0.00 0.26 0.00 0.00 34.13 33.64 2wcg s GLU 41 CO 0.02 0.16 -0.11 -1.12 -0.54 0.00 0.00 175.26 173.67 2wcg s SER 42 N -0.15 1.36 0.15 -1.70 0.01 -0.70 -0.70 113.70 111.97 2wcg s SER 42 Ca 0.03 -0.21 0.05 0.00 1.31 0.00 0.00 55.95 57.12 2wcg s SER 42 Cb -0.03 -0.33 -0.04 0.00 0.21 0.00 0.00 66.02 65.83 2wcg s SER 42 CO -0.00 0.09 -0.11 0.42 0.41 0.00 0.00 173.24 174.05 2wcg s THR 43 N 0.09 1.22 0.44 1.44 -4.23 -0.64 -1.53 115.64 112.43 2wcg s THR 43 Ca -0.02 -2.00 0.12 0.00 -1.18 0.00 0.00 61.69 58.60 2wcg s THR 43 Cb -0.08 -1.79 0.21 0.00 1.34 0.00 0.00 72.50 72.18 2wcg s THR 43 CO 0.01 -0.68 2.01 -0.09 -0.54 0.00 0.00 174.62 175.33 2wcg h ARG 44 N 2.90 0.18 0.00 3.99 2.43 -1.86 -2.05 114.38 119.97 2wcg h ARG 44 Ca -0.37 -0.03 0.00 0.00 -0.81 0.00 0.00 59.98 58.77 2wcg h ARG 44 Cb 1.19 -0.03 0.00 0.00 -0.42 0.00 0.00 29.97 30.71 2wcg h ARG 44 CO 0.61 0.24 0.00 -1.13 -1.51 0.00 0.00 179.97 178.18 2wcg n SER 45 N -4.38 0.35 0.00 -3.80 3.41 -1.26 -4.55 113.62 103.38 2wcg n SER 45 Ca -0.01 0.58 0.00 0.00 -0.26 0.00 0.00 58.87 59.18 2wcg n SER 45 Cb 0.18 -0.66 0.00 0.00 -0.26 0.00 0.00 64.21 63.48 2wcg n SER 45 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2wcg n GLY 46 N 0.12 0.27 3.75 5.00 0.00 -0.77 -4.99 105.19 108.57 2wcg n GLY 46 Ca 0.03 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.64 2wcg n GLY 46 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2wcg s ARG 47 N 0.00 4.45 -0.34 1.61 0.52 -1.24 -4.87 118.95 119.08 2wcg s ARG 47 Ca 0.00 2.00 0.02 0.00 -0.52 0.00 0.00 55.73 57.23 2wcg s ARG 47 Cb 0.00 -3.18 0.10 0.00 0.52 0.00 0.00 34.95 32.39 2wcg s ARG 47 CO 0.00 -0.13 0.08 1.03 0.02 0.00 0.00 175.30 176.30 2wcg s ARG 48 N -0.66 1.20 -1.49 3.54 1.81 -1.26 -1.62 118.95 120.48 2wcg s ARG 48 Ca 0.52 -1.60 -0.02 0.00 -1.72 0.00 0.00 55.73 52.92 2wcg s ARG 48 Cb -0.35 -2.73 0.02 0.00 -0.45 0.00 0.00 34.95 31.44 2wcg s ARG 48 CO 0.41 -0.97 0.05 -1.33 -0.68 0.00 0.00 175.30 172.79 2wcg n MET 49 N 4.43 -0.92 -2.34 3.54 2.81 -0.65 -4.90 117.12 119.09 2wcg n MET 49 Ca 0.02 0.09 -0.42 0.00 -1.81 0.00 0.00 57.70 55.58 2wcg n MET 49 Cb 0.42 -3.47 -0.03 0.00 -0.71 0.00 0.00 33.22 29.43 2wcg n MET 49 CO 0.00 0.00 0.00 -1.21 1.51 0.00 0.00 175.97 176.27 2wcg s GLU 50 N -7.10 4.40 -0.02 0.03 2.02 0.13 -4.61 118.70 113.55 2wcg s GLU 50 Ca 0.08 1.87 -0.22 0.00 0.02 0.00 0.00 54.97 56.72 2wcg s GLU 50 Cb -0.04 -3.31 -0.05 0.00 0.10 0.00 0.00 34.13 30.83 2wcg s GLU 50 CO 0.94 -0.30 0.63 -1.17 0.02 0.00 0.00 175.26 175.39 2wcg s LEU 51 N 0.96 4.38 0.29 1.80 2.96 -1.26 -1.07 118.68 126.74 2wcg s LEU 51 Ca 0.60 1.18 -0.04 0.00 -0.22 0.00 0.00 54.13 55.65 2wcg s LEU 51 Cb -0.32 -2.98 -0.01 0.00 0.50 0.00 0.00 46.19 43.38 2wcg s LEU 51 CO 0.30 0.03 0.39 -0.94 -1.32 0.00 0.00 176.35 174.81 2wcg s SER 52 N 0.13 0.56 0.05 3.68 1.04 0.10 -4.99 113.70 114.28 2wcg s SER 52 Ca 0.33 -1.35 -0.02 0.00 0.48 0.00 0.00 55.95 55.39 2wcg s SER 52 Cb -0.18 0.58 -0.03 0.00 0.10 0.00 0.00 66.02 66.48 2wcg s SER 52 CO 0.18 -1.14 0.01 -0.04 0.98 0.00 0.00 173.24 173.22 2wcg s MET 53 N -3.57 0.62 0.25 4.02 -1.94 -1.26 -0.89 119.30 116.53 2wcg s MET 53 Ca 0.31 -1.10 -0.14 0.00 -1.71 0.00 0.00 55.69 53.05 2wcg s MET 53 Cb 0.01 0.22 -0.00 0.00 2.01 0.00 0.00 34.83 37.07 2wcg s MET 53 CO 0.16 -0.13 0.51 0.20 -0.01 0.00 0.00 175.02 175.76 2wcg s GLY 54 N -2.75 0.45 0.08 -0.03 0.00 -0.95 -4.99 107.32 99.14 2wcg s GLY 54 Ca 0.04 -0.80 -0.19 0.00 0.00 0.00 0.00 44.72 43.77 2wcg s GLY 54 CO -0.09 -0.55 0.58 2.56 0.00 0.00 0.00 173.10 175.60 2wcg s PRO 55 N -4.00 4.20 -0.19 2.90 0.04 -1.26 -0.68 135.00 136.01 2wcg s PRO 55 Ca 0.21 0.74 -0.25 0.00 0.04 0.00 0.00 61.00 61.74 2wcg s PRO 55 Cb -0.01 -3.21 -0.01 0.00 0.04 0.00 0.00 34.50 31.30 2wcg s PRO 55 CO 0.09 0.62 0.81 0.42 0.04 0.00 0.00 177.00 178.97 2wcg s ILE 56 N -1.15 4.89 0.18 0.56 1.01 -0.68 -4.61 121.20 121.40 2wcg s ILE 56 Ca 0.30 1.56 -0.05 0.00 0.00 0.00 0.00 60.65 62.46 2wcg s ILE 56 Cb -0.19 -4.11 -0.06 0.00 0.01 0.00 0.00 42.46 38.11 2wcg s ILE 56 CO 0.19 0.01 0.43 -1.10 0.00 0.00 0.00 174.94 174.48 2wcg s GLN 57 N 2.28 3.65 0.12 2.79 -1.52 0.32 -4.82 119.66 122.47 2wcg s GLN 57 Ca 0.36 -0.03 -0.02 0.00 -1.95 0.00 0.00 55.36 53.73 2wcg s GLN 57 Cb -0.16 -2.78 -0.14 0.00 -0.22 0.00 0.00 33.01 29.71 2wcg s GLN 57 CO 0.11 0.40 1.27 0.00 -0.25 0.00 0.00 175.29 176.82 2wcg h ALA 58 N 2.56 0.31 -2.12 6.09 0.00 -1.88 0.40 119.26 124.63 2wcg h ALA 58 Ca -0.46 -0.79 -0.52 0.00 0.00 0.00 0.00 54.91 53.14 2wcg h ALA 58 Cb 1.17 -0.03 -0.14 0.00 0.00 0.00 0.00 17.79 18.79 2wcg h ALA 58 CO 0.71 0.92 -0.70 -0.80 0.00 0.00 0.00 179.25 179.37 2wcg s ASN 59 N -7.04 2.98 -0.12 0.00 -0.87 -1.26 -4.75 114.94 103.88 2wcg s ASN 59 Ca -0.04 -1.12 -0.10 0.00 -1.57 0.00 0.00 52.86 50.03 2wcg s ASN 59 Cb 0.09 -0.21 0.04 0.00 -0.02 0.00 0.00 41.25 41.15 2wcg s ASN 59 CO 0.86 -0.21 0.32 -2.28 -2.57 0.00 0.00 177.10 173.21 2wcg s HIS 60 N -2.86 -0.37 0.05 2.20 2.46 -1.26 -4.79 115.29 110.71 2wcg s HIS 60 Ca 0.28 0.89 0.02 0.00 0.47 0.00 0.00 55.06 56.72 2wcg s HIS 60 Cb 0.01 0.13 -0.03 0.00 -0.13 0.00 0.00 32.58 32.56 2wcg s HIS 60 CO 0.12 -0.19 -0.07 0.99 -2.47 0.00 0.00 174.74 173.12 2wcg s THR 61 N 0.40 0.51 0.00 0.89 2.01 -1.26 -5.12 115.64 113.07 2wcg s THR 61 Ca -0.02 -1.24 0.00 0.00 0.31 0.00 0.00 61.69 60.74 2wcg s THR 61 Cb -0.04 -0.79 0.00 0.00 0.01 0.00 0.00 72.50 71.68 2wcg s THR 61 CO -0.02 -0.50 0.00 0.61 -0.69 0.00 0.00 174.62 174.02 2wcg n GLY 62 N 1.17 2.19 0.30 4.40 0.00 -1.26 -4.91 105.19 107.07 2wcg n GLY 62 Ca -0.21 -1.91 0.07 0.00 0.00 0.00 0.00 46.02 43.98 2wcg n GLY 62 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2wcg n THR 63 N -1.80 1.69 -1.57 2.61 -2.24 -1.26 -5.05 114.28 106.66 2wcg n THR 63 Ca 0.00 -1.77 -0.29 0.00 -2.27 0.00 0.00 64.05 59.72 2wcg n THR 63 Cb 0.00 -0.00 0.17 0.00 -2.10 0.00 0.00 70.33 68.40 2wcg n THR 63 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 2wcg s GLY 64 N -2.05 1.64 0.14 3.38 0.00 -1.26 -4.95 107.32 104.22 2wcg s GLY 64 Ca 0.26 -0.85 -0.33 0.00 0.00 0.00 0.00 44.72 43.80 2wcg s GLY 64 CO 0.05 -0.15 1.65 -0.10 0.00 0.00 0.00 173.10 174.55 2wcg n LEU 65 N -3.98 3.34 -4.09 0.66 7.94 -1.26 -4.92 117.00 114.70 2wcg n LEU 65 Ca 0.11 1.06 -0.27 0.00 -1.11 0.00 0.00 56.01 55.80 2wcg n LEU 65 Cb 0.59 -1.45 -0.17 0.00 0.53 0.00 0.00 43.42 42.92 2wcg n LEU 65 CO 0.51 -0.16 -0.50 -0.22 -1.11 0.00 0.00 177.39 175.91 2wcg s LEU 66 N 1.37 1.80 -0.23 -1.96 2.96 -1.26 -1.69 118.68 119.67 2wcg s LEU 66 Ca 0.80 -0.39 -0.05 0.00 -0.22 0.00 0.00 54.13 54.27 2wcg s LEU 66 Cb -0.64 -1.02 -0.02 0.00 0.50 0.00 0.00 46.19 45.02 2wcg s LEU 66 CO 0.38 0.08 -0.01 -0.76 -1.32 0.00 0.00 176.35 174.72 2wcg s LEU 67 N 0.53 3.07 -0.26 -0.68 1.43 0.33 -0.99 118.68 122.11 2wcg s LEU 67 Ca -0.16 -0.33 -0.04 0.00 -1.03 0.00 0.00 54.13 52.57 2wcg s LEU 67 Cb -0.16 -1.80 0.01 0.00 0.03 0.00 0.00 46.19 44.27 2wcg s LEU 67 CO 0.05 -0.02 0.00 -0.89 0.23 0.00 0.00 176.35 175.73 2wcg s THR 68 N 1.48 3.47 0.37 5.49 2.01 0.43 -0.05 115.64 128.84 2wcg s THR 68 Ca 0.06 -0.71 -0.28 0.00 0.31 0.00 0.00 61.69 61.07 2wcg s THR 68 Cb -0.14 -2.71 -0.11 0.00 0.01 0.00 0.00 72.50 69.54 2wcg s THR 68 CO -0.01 0.23 1.41 0.18 -0.69 0.00 0.00 174.62 175.74 2wcg n LEU 69 N 4.79 4.33 -3.79 4.42 4.32 0.40 -1.95 117.00 129.51 2wcg n LEU 69 Ca -0.16 1.22 -0.28 0.00 -0.02 0.00 0.00 56.01 56.77 2wcg n LEU 69 Cb 0.49 -1.57 -0.11 0.00 -1.62 0.00 0.00 43.42 40.60 2wcg n LEU 69 CO 0.29 -0.10 -0.05 0.00 -1.22 0.00 0.00 177.39 176.31 2wcg n GLN 70 N 0.46 1.72 0.00 3.23 6.02 -0.22 -4.51 117.38 124.08 2wcg n GLN 70 Ca 0.03 -4.36 0.07 0.00 -0.01 0.00 0.00 57.00 52.73 2wcg n GLN 70 Cb 0.38 -2.21 0.37 0.00 1.02 0.00 0.00 30.24 29.80 2wcg n GLN 70 CO 0.00 0.00 0.00 -0.35 -1.01 0.00 0.00 177.06 175.70 2wcg n PRO 71 N 1.93 0.18 -0.00 -1.09 -0.04 -1.26 -1.72 135.00 132.99 2wcg n PRO 71 Ca 0.22 0.16 0.10 0.00 -0.04 0.00 0.00 63.50 63.94 2wcg n PRO 71 Cb 0.37 -1.50 -0.12 0.00 -0.04 0.00 0.00 33.50 32.21 2wcg n PRO 71 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 2wcg n GLU 72 N -1.32 0.14 -2.71 0.54 4.71 -1.26 -4.71 120.64 116.02 2wcg n GLU 72 Ca 0.06 -0.02 -0.43 0.00 -0.01 0.00 0.00 57.16 56.77 2wcg n GLU 72 Cb 0.13 -1.49 -0.03 0.00 -1.01 0.00 0.00 31.44 29.03 2wcg n GLU 72 CO 0.00 0.00 0.00 -0.65 0.09 0.00 0.00 177.13 176.57 2wcg s GLN 73 N -3.04 3.44 -0.13 3.49 -1.52 -0.70 -5.03 119.66 116.18 2wcg s GLN 73 Ca 0.06 0.03 -0.02 0.00 -1.95 0.00 0.00 55.36 53.48 2wcg s GLN 73 Cb 0.16 -4.02 -0.03 0.00 -0.22 0.00 0.00 33.01 28.90 2wcg s GLN 73 CO 0.87 -1.55 -0.05 0.15 -0.25 0.00 0.00 175.29 174.45 2wcg s LYS 74 N 4.41 3.36 0.00 2.91 -0.14 -1.26 -1.97 119.74 127.05 2wcg s LYS 74 Ca 0.37 -0.53 0.00 0.00 -1.36 0.00 0.00 55.97 54.46 2wcg s LYS 74 Cb -0.10 -2.80 0.00 0.00 -1.68 0.00 0.00 37.83 33.25 2wcg s LYS 74 CO 0.23 0.39 0.00 1.19 -0.76 0.00 0.00 175.35 176.40 2wcg n PHE 75 N 3.07 0.00 -2.17 3.18 3.01 0.87 -4.99 117.46 120.43 2wcg n PHE 75 Ca -0.18 0.00 -0.32 0.00 1.01 0.00 0.00 57.45 57.97 2wcg n PHE 75 Cb 0.53 0.00 -0.01 0.00 -0.01 0.00 0.00 39.48 39.98 2wcg n PHE 75 CO 0.00 0.00 0.00 1.14 1.01 0.00 0.00 176.76 178.91 2wcg s GLN 76 N 4.68 3.79 0.11 -1.08 0.00 -1.26 -4.62 119.66 121.28 2wcg s GLN 76 Ca 0.00 0.85 -0.13 0.00 -0.00 0.00 0.00 55.36 56.09 2wcg s GLN 76 Cb 0.00 -2.11 -0.06 0.00 0.00 0.00 0.00 33.01 30.83 2wcg s GLN 76 CO 0.00 -0.40 0.49 0.15 0.00 0.00 0.00 175.29 175.53 2wcg s LYS 77 N -4.57 3.90 -0.07 9.60 1.02 -1.26 -1.59 119.74 126.77 2wcg s LYS 77 Ca 0.57 0.38 -0.22 0.00 0.02 0.00 0.00 55.97 56.72 2wcg s LYS 77 Cb -0.10 -2.98 -0.04 0.00 -0.52 0.00 0.00 37.83 34.18 2wcg s LYS 77 CO 0.41 0.53 0.63 0.08 -0.92 0.00 0.00 175.35 176.08 2wcg s VAL 78 N -1.41 5.06 -0.13 3.17 1.01 0.46 -4.69 120.40 123.88 2wcg s VAL 78 Ca 0.35 1.29 -0.25 0.00 0.00 0.00 0.00 61.98 63.37 2wcg s VAL 78 Cb -0.15 -3.97 -0.22 0.00 0.00 0.00 0.00 36.38 32.04 2wcg s VAL 78 CO 0.18 0.29 0.68 0.50 0.00 0.00 0.00 175.10 176.76 2wcg h LYS 79 N 6.59 -0.00 0.00 2.72 1.63 -0.98 0.26 116.57 126.79 2wcg h LYS 79 Ca -0.42 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.38 2wcg h LYS 79 Cb 1.19 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 32.82 2wcg h LYS 79 CO 0.75 0.84 0.00 0.41 -3.45 0.00 0.00 179.45 178.00 2wcg n GLY 80 N 1.58 0.45 3.02 5.01 0.00 -1.15 -4.43 105.19 109.68 2wcg n GLY 80 Ca -0.09 -1.57 -0.11 0.00 0.00 0.00 0.00 46.02 44.26 2wcg n GLY 80 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2wcg s PHE 81 N -3.17 0.04 0.00 1.61 0.40 -1.26 -1.84 117.98 113.77 2wcg s PHE 81 Ca 0.00 -0.09 0.00 0.00 -0.60 0.00 0.00 56.93 56.24 2wcg s PHE 81 Cb 0.00 -0.05 0.00 0.00 0.51 0.00 0.00 43.02 43.48 2wcg s PHE 81 CO 0.00 -0.17 0.00 0.41 0.70 0.00 0.00 175.22 176.16 2wcg n GLY 82 N 2.08 1.08 3.74 4.36 0.00 -1.13 -1.29 105.19 114.02 2wcg n GLY 82 Ca -0.19 -0.22 -0.10 0.00 0.00 0.00 0.00 46.02 45.51 2wcg n GLY 82 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2wcg s GLY 83 N 0.00 0.64 -0.11 -0.02 0.00 -1.08 0.09 107.32 106.84 2wcg s GLY 83 Ca 0.00 -0.95 -0.02 0.00 0.00 0.00 0.00 44.72 43.76 2wcg s GLY 83 CO 0.00 -0.46 -0.03 0.00 0.00 0.00 0.00 173.10 172.60 2wcg s ALA 84 N -2.26 3.08 -1.15 3.20 0.00 -0.32 -1.07 121.76 123.24 2wcg s ALA 84 Ca 0.19 -0.83 -0.08 0.00 0.00 0.00 0.00 51.96 51.23 2wcg s ALA 84 Cb -0.04 -1.45 0.26 0.00 0.00 0.00 0.00 23.12 21.88 2wcg s ALA 84 CO 0.14 0.42 1.41 -0.12 0.00 0.00 0.00 175.76 177.61 2wcg n MET 85 N 2.78 3.85 -1.41 0.00 1.56 0.00 -1.61 117.12 122.30 2wcg n MET 85 Ca -0.18 -4.25 -0.29 0.00 -0.27 0.00 0.00 57.70 52.71 2wcg n MET 85 Cb 0.53 -2.67 0.15 0.00 2.15 0.00 0.00 33.22 33.38 2wcg n MET 85 CO 0.00 0.00 0.00 0.95 -0.73 0.00 0.00 175.97 176.19 2wcg s THR 86 N -1.09 1.99 0.23 1.12 -4.23 -1.26 -4.46 115.64 107.94 2wcg s THR 86 Ca 0.34 0.00 -0.07 0.00 -1.18 0.00 0.00 61.69 60.78 2wcg s THR 86 Cb -0.01 -2.66 0.19 0.00 1.34 0.00 0.00 72.50 71.36 2wcg s THR 86 CO 0.01 0.00 1.87 0.44 -0.54 0.00 0.00 174.62 176.40 2wcg h ASP 87 N -1.67 0.86 -0.45 3.99 3.32 -1.93 -1.31 116.42 119.23 2wcg h ASP 87 Ca -0.52 -0.00 -0.11 0.00 0.02 0.00 0.00 57.03 56.43 2wcg h ASP 87 Cb 1.33 -0.19 -0.02 0.00 0.22 0.00 0.00 39.33 40.68 2wcg h ASP 87 CO 0.60 0.58 -0.11 0.00 -1.72 0.00 0.00 179.24 178.59 2wcg h ALA 88 N 1.35 0.87 -0.01 3.45 0.00 -1.65 -0.15 119.26 123.13 2wcg h ALA 88 Ca 0.33 -0.34 -0.00 0.00 0.00 0.00 0.00 54.91 54.90 2wcg h ALA 88 Cb 0.04 -0.19 -0.00 0.00 0.00 0.00 0.00 17.79 17.64 2wcg h ALA 88 CO -0.12 0.64 0.00 0.00 0.00 0.00 0.00 179.25 179.77 2wcg h ALA 89 N 1.04 0.01 -0.63 0.00 0.00 -1.63 -1.30 119.26 116.75 2wcg h ALA 89 Ca 0.13 -0.07 0.06 0.00 0.00 0.00 0.00 54.91 55.03 2wcg h ALA 89 Cb 0.64 -0.00 -0.05 0.00 0.00 0.00 0.00 17.79 18.38 2wcg h ALA 89 CO 0.04 -0.42 0.34 0.00 0.00 0.00 0.00 179.25 179.21 2wcg h ALA 90 N 0.86 0.83 -0.48 0.00 0.00 -0.96 -1.09 119.26 118.43 2wcg h ALA 90 Ca 0.00 0.02 -0.09 0.00 0.00 0.00 0.00 54.91 54.84 2wcg h ALA 90 Cb 0.14 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 17.81 2wcg h ALA 90 CO -0.00 0.00 -0.06 -0.07 0.00 0.00 0.00 179.25 179.12 2wcg h LEU 91 N 0.63 0.82 -0.31 0.00 3.38 -0.95 -1.19 115.31 117.69 2wcg h LEU 91 Ca 0.28 -0.23 -0.03 0.00 0.09 0.00 0.00 57.88 57.99 2wcg h LEU 91 Cb 0.19 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 40.70 2wcg h LEU 91 CO -0.18 0.92 0.09 0.78 0.09 0.00 0.00 178.44 180.13 2wcg h ASN 92 N 0.76 0.46 -0.31 -0.43 2.35 -0.86 -2.78 115.58 114.77 2wcg h ASN 92 Ca 0.14 -0.22 -0.06 0.00 -0.55 0.00 0.00 56.30 55.60 2wcg h ASN 92 Cb 0.55 -0.12 -0.01 0.00 0.05 0.00 0.00 38.32 38.79 2wcg h ASN 92 CO 0.03 0.56 -0.05 0.40 -1.65 0.00 0.00 177.43 176.72 2wcg h ILE 93 N 0.34 1.27 0.00 2.81 2.04 -0.98 -2.46 117.51 120.53 2wcg h ILE 93 Ca 0.10 -1.06 0.00 0.00 1.00 0.00 0.00 64.86 64.90 2wcg h ILE 93 Cb 0.27 1.33 0.00 0.00 -0.74 0.00 0.00 36.82 37.68 2wcg h ILE 93 CO -0.00 0.34 0.00 0.18 0.00 0.00 0.00 178.15 178.67 2wcg n LEU 94 N -4.49 0.00 -0.08 1.44 4.77 -0.47 -2.02 117.00 116.15 2wcg n LEU 94 Ca -0.03 0.37 0.13 0.00 -0.03 0.00 0.00 56.01 56.46 2wcg n LEU 94 Cb 0.30 -0.37 0.44 0.00 -2.33 0.00 0.00 43.42 41.47 2wcg n LEU 94 CO 0.40 -0.21 0.70 0.00 -1.33 0.00 0.00 177.39 176.95 2wcg n ALA 95 N -1.37 3.02 -1.99 -1.18 0.00 -0.92 -4.85 120.51 113.22 2wcg n ALA 95 Ca 0.05 -0.29 -0.30 0.00 0.00 0.00 0.00 53.44 52.89 2wcg n ALA 95 Cb 0.12 -1.24 -0.01 0.00 0.00 0.00 0.00 19.45 18.32 2wcg n ALA 95 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2wcg s LEU 96 N -2.75 3.46 0.58 0.00 1.43 -0.86 -4.93 118.68 115.61 2wcg s LEU 96 Ca 0.19 1.31 -0.20 0.00 -1.03 0.00 0.00 54.13 54.40 2wcg s LEU 96 Cb 0.19 -4.30 -0.04 0.00 0.03 0.00 0.00 46.19 42.07 2wcg s LEU 96 CO 0.57 -0.70 1.28 -0.94 0.23 0.00 0.00 176.35 176.79 2wcg s SER 97 N -3.83 5.14 0.32 2.29 1.04 -1.26 -4.71 113.70 112.68 2wcg s SER 97 Ca 0.54 2.58 0.06 0.00 0.48 0.00 0.00 55.95 59.61 2wcg s SER 97 Cb -0.11 -2.62 0.75 0.00 0.10 0.00 0.00 66.02 64.14 2wcg s SER 97 CO 0.45 -1.64 1.80 -0.65 0.98 0.00 0.00 173.24 174.19 2wcg h PRO 98 N 1.10 0.75 -0.93 4.02 0.11 -1.95 0.45 132.00 135.55 2wcg h PRO 98 Ca -0.51 -0.05 0.01 0.00 0.11 0.00 0.00 66.00 65.56 2wcg h PRO 98 Cb 1.31 -0.17 -0.05 0.00 0.11 0.00 0.00 31.00 32.20 2wcg h PRO 98 CO 0.56 0.50 0.61 -1.35 -0.21 0.00 0.00 178.00 178.10 2wcg h PRO 99 N 0.77 1.24 -0.26 1.05 0.11 -1.91 -1.66 132.00 131.34 2wcg h PRO 99 Ca 0.54 -0.08 -0.14 0.00 0.11 0.00 0.00 66.00 66.43 2wcg h PRO 99 Cb 0.83 -0.27 -0.01 0.00 0.11 0.00 0.00 31.00 31.66 2wcg h PRO 99 CO -0.32 0.83 -0.40 0.00 -0.21 0.00 0.00 178.00 177.90 2wcg h ALA 100 N 1.33 0.80 -0.36 -0.75 0.00 -1.15 -2.32 119.26 116.82 2wcg h ALA 100 Ca 0.34 -0.44 0.07 0.00 0.00 0.00 0.00 54.91 54.87 2wcg h ALA 100 Cb -0.12 -0.11 -0.06 0.00 0.00 0.00 0.00 17.79 17.49 2wcg h ALA 100 CO -0.07 0.65 -0.04 1.96 0.00 0.00 0.00 179.25 181.75 2wcg h GLN 101 N 0.52 0.05 -0.72 0.00 4.20 -0.79 -0.85 115.11 117.52 2wcg h GLN 101 Ca 0.04 -0.00 -0.01 0.00 0.06 0.00 0.00 58.65 58.74 2wcg h GLN 101 Cb 0.92 -0.01 -0.03 0.00 0.30 0.00 0.00 27.48 28.66 2wcg h GLN 101 CO 0.08 0.03 0.41 -0.91 -0.67 0.00 0.00 178.83 177.77 2wcg h ASN 102 N 0.05 0.88 0.18 1.46 2.35 -1.16 -0.31 115.58 119.03 2wcg h ASN 102 Ca 0.17 -0.09 -0.06 0.00 -0.55 0.00 0.00 56.30 55.78 2wcg h ASN 102 Cb 0.25 -0.22 -0.01 0.00 0.05 0.00 0.00 38.32 38.39 2wcg h ASN 102 CO -0.33 0.71 -0.23 -0.07 -1.65 0.00 0.00 177.43 175.87 2wcg h LEU 103 N 0.98 0.08 -0.05 1.61 3.38 -1.13 0.97 115.31 121.17 2wcg h LEU 103 Ca 0.25 -0.02 -0.11 0.00 0.09 0.00 0.00 57.88 58.09 2wcg h LEU 103 Cb 0.01 -0.02 0.01 0.00 0.09 0.00 0.00 40.66 40.75 2wcg h LEU 103 CO -0.04 0.32 -0.41 0.25 0.09 0.00 0.00 178.44 178.65 2wcg h LEU 104 N 0.08 0.44 -0.53 1.67 6.46 -0.43 -1.52 115.31 121.48 2wcg h LEU 104 Ca 0.01 -0.70 -0.05 0.00 -0.12 0.00 0.00 57.88 57.03 2wcg h LEU 104 Cb 0.45 -0.13 -0.02 0.00 -0.73 0.00 0.00 40.66 40.23 2wcg h LEU 104 CO 0.03 1.07 0.14 -0.07 -0.62 0.00 0.00 178.44 178.99 2wcg h LEU 105 N -0.16 0.80 -1.01 2.25 3.38 -0.87 -2.53 115.31 117.16 2wcg h LEU 105 Ca -0.04 -0.23 0.08 0.00 0.09 0.00 0.00 57.88 57.79 2wcg h LEU 105 Cb 1.09 -0.21 -0.07 0.00 0.09 0.00 0.00 40.66 41.56 2wcg h LEU 105 CO 0.08 0.81 0.65 0.11 0.09 0.00 0.00 178.44 180.18 2wcg h LYS 106 N 0.74 1.09 -0.77 1.13 1.57 -0.82 0.81 116.57 120.32 2wcg h LYS 106 Ca 0.17 -0.07 0.12 0.00 -1.87 0.00 0.00 60.65 59.00 2wcg h LYS 106 Cb 0.32 -0.25 -0.08 0.00 0.08 0.00 0.00 32.23 32.30 2wcg h LYS 106 CO -0.00 0.72 0.38 0.77 -0.57 0.00 0.00 179.45 180.75 2wcg h SER 107 N 1.12 0.46 0.05 0.86 0.02 -0.83 -2.37 113.55 112.86 2wcg h SER 107 Ca 0.45 0.08 -0.09 0.00 -0.84 0.00 0.00 61.79 61.40 2wcg h SER 107 Cb 0.27 0.01 0.00 0.00 0.14 0.00 0.00 62.40 62.82 2wcg h SER 107 CO -0.20 0.23 -0.40 1.88 -1.14 0.00 0.00 176.83 177.19 2wcg h TYR 108 N 0.59 0.18 0.00 3.45 0.99 -1.37 0.81 116.97 121.63 2wcg h TYR 108 Ca 0.40 -0.13 -0.17 0.00 2.00 0.00 0.00 58.73 60.83 2wcg h TYR 108 Cb 0.51 -0.01 -0.03 0.00 1.00 0.00 0.00 36.73 38.20 2wcg h TYR 108 CO -0.11 1.16 -2.07 1.19 -0.00 0.00 0.00 178.16 178.32 2wcg n PHE 109 N -4.42 0.00 -2.37 4.88 3.01 0.24 -0.74 117.46 118.06 2wcg n PHE 109 Ca -0.14 0.00 -0.24 0.00 1.01 0.00 0.00 57.45 58.08 2wcg n PHE 109 Cb 0.62 -0.68 0.05 0.00 -0.01 0.00 0.00 39.48 39.46 2wcg n PHE 109 CO 0.00 0.00 0.00 -1.54 1.01 0.00 0.00 176.76 176.23 2wcg s SER 110 N -4.76 5.03 0.54 4.37 1.04 -0.90 -2.52 113.70 116.51 2wcg s SER 110 Ca -0.08 0.31 0.30 0.00 0.48 0.00 0.00 55.95 56.96 2wcg s SER 110 Cb 0.09 -1.07 1.56 0.00 0.10 0.00 0.00 66.02 66.70 2wcg s SER 110 CO 0.78 -1.40 2.09 1.05 0.98 0.00 0.00 173.24 176.74 2wcg h GLU 111 N -0.33 0.00 -0.00 4.02 9.09 -1.86 -0.93 114.58 124.57 2wcg h GLU 111 Ca -0.44 0.00 0.00 0.00 0.05 0.00 0.00 59.36 58.97 2wcg h GLU 111 Cb 1.31 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 28.41 2wcg h GLU 111 CO 0.58 0.09 -0.01 0.39 0.05 0.00 0.00 179.01 180.10 2wcg n GLU 112 N -3.49 0.04 0.00 1.06 4.71 -1.26 -4.83 120.64 116.87 2wcg n GLU 112 Ca -0.02 -0.00 0.00 0.00 -0.01 0.00 0.00 57.16 57.13 2wcg n GLU 112 Cb 0.23 -1.50 0.00 0.00 -1.01 0.00 0.00 31.44 29.16 2wcg n GLU 112 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 2wcg n GLY 113 N 1.48 4.19 1.39 0.62 0.00 -0.36 -1.49 105.19 111.02 2wcg n GLY 113 Ca 0.08 -1.67 0.11 0.00 0.00 0.00 0.00 46.02 44.54 2wcg n GLY 113 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 2wcg n ILE 114 N 0.00 1.24 -3.24 -0.61 -5.35 0.28 -4.88 119.36 106.80 2wcg n ILE 114 Ca 0.00 -1.06 -0.22 0.00 -0.27 0.00 0.00 62.75 61.20 2wcg n ILE 114 Cb 0.00 0.40 0.05 0.00 -1.74 0.00 0.00 39.64 38.35 2wcg n ILE 114 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2wcg n GLY 115 N 1.46 -0.50 3.58 3.28 0.00 -0.81 -2.51 105.19 109.69 2wcg n GLY 115 Ca 0.24 0.16 -0.43 0.00 0.00 0.00 0.00 46.02 45.99 2wcg n GLY 115 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 2wcg n TYR 116 N -4.69 1.08 -1.24 1.61 0.53 0.08 -4.76 117.16 109.78 2wcg n TYR 116 Ca -0.06 0.64 0.02 0.00 -1.02 0.00 0.00 57.90 57.49 2wcg n TYR 116 Cb 0.59 -2.22 0.03 0.00 -1.03 0.00 0.00 39.34 36.72 2wcg n TYR 116 CO 0.00 0.00 0.00 0.27 -1.02 0.00 0.00 176.86 176.11 2wcg n ASN 117 N 0.99 0.82 -3.98 7.72 6.94 -0.42 -4.76 115.26 122.58 2wcg n ASN 117 Ca 0.10 -1.99 -0.17 0.00 -0.02 0.00 0.00 54.58 52.49 2wcg n ASN 117 Cb 0.35 -0.17 -0.15 0.00 -2.36 0.00 0.00 39.78 37.45 2wcg n ASN 117 CO 0.00 0.00 0.00 -0.63 -1.03 0.00 0.00 177.26 175.60 2wcg s ILE 118 N -0.79 0.53 -0.07 1.53 1.01 -0.90 0.26 121.20 122.77 2wcg s ILE 118 Ca 0.07 -0.28 -0.01 0.00 0.00 0.00 0.00 60.65 60.43 2wcg s ILE 118 Cb 0.06 -0.46 0.03 0.00 0.01 0.00 0.00 42.46 42.10 2wcg s ILE 118 CO 0.01 0.16 -0.01 -0.63 0.00 0.00 0.00 174.94 174.47 2wcg s ILE 119 N -0.08 0.43 -0.08 2.92 1.01 -0.56 -2.62 121.20 122.22 2wcg s ILE 119 Ca 0.02 0.08 -0.15 0.00 0.00 0.00 0.00 60.65 60.59 2wcg s ILE 119 Cb -0.03 -0.57 -0.05 0.00 0.01 0.00 0.00 42.46 41.81 2wcg s ILE 119 CO -0.00 0.27 0.39 -0.60 0.00 0.00 0.00 174.94 175.00 2wcg s ARG 120 N 1.90 4.12 -0.17 2.79 3.52 -0.24 -1.60 118.95 129.26 2wcg s ARG 120 Ca 0.04 0.33 0.01 0.00 -0.13 0.00 0.00 55.73 55.98 2wcg s ARG 120 Cb -0.12 -3.34 0.03 0.00 -1.56 0.00 0.00 34.95 29.96 2wcg s ARG 120 CO -0.05 0.42 -0.14 0.08 -0.81 0.00 0.00 175.30 174.80 2wcg s VAL 121 N -0.18 1.71 0.36 7.11 1.01 0.12 -0.82 120.40 129.72 2wcg s VAL 121 Ca 0.22 -0.85 -0.27 0.00 0.00 0.00 0.00 61.98 61.08 2wcg s VAL 121 Cb -0.15 -1.66 -0.09 0.00 0.00 0.00 0.00 36.38 34.48 2wcg s VAL 121 CO 0.10 0.37 1.25 -2.84 0.00 0.00 0.00 175.10 173.97 2wcg s PRO 122 N 1.40 4.23 -0.67 2.72 0.02 -1.26 -1.95 135.00 139.49 2wcg s PRO 122 Ca 0.03 2.06 -0.23 0.00 0.02 0.00 0.00 61.00 62.88 2wcg s PRO 122 Cb -0.14 -2.92 0.07 0.00 0.02 0.00 0.00 34.50 31.52 2wcg s PRO 122 CO -0.10 -0.24 1.01 -1.64 -0.33 0.00 0.00 177.00 175.70 2wcg s MET 123 N -1.97 3.13 3.05 5.54 -1.94 0.30 -4.84 119.30 122.57 2wcg s MET 123 Ca 0.52 -0.78 0.00 0.00 -1.71 0.00 0.00 55.69 53.72 2wcg s MET 123 Cb -0.36 -4.24 0.00 0.00 2.01 0.00 0.00 34.83 32.24 2wcg s MET 123 CO 0.47 -1.86 0.00 0.00 -0.01 0.00 0.00 175.02 173.62 2wcg n ALA 124 N 7.89 0.00 -2.34 3.03 0.00 -1.26 -4.22 120.51 123.62 2wcg n ALA 124 Ca -0.02 0.00 -0.31 0.00 0.00 0.00 0.00 53.44 53.11 2wcg n ALA 124 Cb 0.46 0.00 -0.04 0.00 0.00 0.00 0.00 19.45 19.87 2wcg n ALA 124 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 2wcg s SER 125 N -4.00 6.57 0.00 0.00 1.04 -1.15 -4.94 113.70 111.22 2wcg s SER 125 Ca 0.00 0.98 0.00 0.00 0.48 0.00 0.00 55.95 57.41 2wcg s SER 125 Cb 0.00 -2.25 0.00 0.00 0.10 0.00 0.00 66.02 63.87 2wcg s SER 125 CO 0.00 -0.22 0.00 0.00 0.98 0.00 0.00 173.24 174.00 2wcg h ASP 127 N 0.00 0.00 -0.64 0.00 2.03 -1.97 -3.03 116.42 112.81 2wcg h ASP 127 Ca 0.00 0.00 -0.44 0.00 -0.73 0.00 0.00 57.03 55.86 2wcg h ASP 127 Cb 0.00 0.00 -0.12 0.00 -0.83 0.00 0.00 39.33 38.38 2wcg h ASP 127 CO 0.00 0.43 0.68 0.49 -1.03 0.00 0.00 179.24 179.81 2wcg n PHE 128 N -3.81 1.26 -4.21 4.15 3.01 -1.26 -2.17 117.46 114.43 2wcg n PHE 128 Ca -0.01 -2.00 -0.15 0.00 1.01 0.00 0.00 57.45 56.30 2wcg n PHE 128 Cb 0.49 -1.60 -0.11 0.00 -0.01 0.00 0.00 39.48 38.25 2wcg n PHE 128 CO 0.00 0.00 0.00 -1.12 1.01 0.00 0.00 176.76 176.65 2wcg s SER 129 N 1.05 1.66 0.03 4.37 0.01 -1.15 -1.79 113.70 117.88 2wcg s SER 129 Ca 0.62 -0.90 0.23 0.00 1.31 0.00 0.00 55.95 57.22 2wcg s SER 129 Cb 0.32 -0.01 0.12 0.00 0.21 0.00 0.00 66.02 66.66 2wcg s SER 129 CO -0.12 -0.28 1.11 2.30 0.41 0.00 0.00 173.24 176.66 2wcg n ILE 130 N 0.25 0.09 -4.11 1.44 -5.35 -1.26 -2.19 119.36 108.22 2wcg n ILE 130 Ca -0.14 -0.12 -0.08 0.00 -0.27 0.00 0.00 62.75 62.14 2wcg n ILE 130 Cb 0.59 0.38 -0.10 0.00 -1.74 0.00 0.00 39.64 38.77 2wcg n ILE 130 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 2wcg s ARG 131 N -3.10 0.68 0.01 6.28 1.70 -1.26 -4.81 118.95 118.45 2wcg s ARG 131 Ca 0.07 -1.27 -0.20 0.00 -0.47 0.00 0.00 55.73 53.86 2wcg s ARG 131 Cb 0.16 0.18 -0.06 0.00 -0.57 0.00 0.00 34.95 34.66 2wcg s ARG 131 CO 0.79 -0.13 0.58 0.95 -1.08 0.00 0.00 175.30 176.41 2wcg s THR 132 N -3.92 4.88 -0.12 4.99 -4.23 -1.26 -4.85 115.64 111.12 2wcg s THR 132 Ca 0.10 1.22 -0.30 0.00 -1.18 0.00 0.00 61.69 61.53 2wcg s THR 132 Cb 0.08 -3.91 0.11 0.00 1.34 0.00 0.00 72.50 70.12 2wcg s THR 132 CO -0.08 0.46 0.93 -0.72 -0.54 0.00 0.00 174.62 174.67 2wcg s TYR 133 N -0.44 -0.42 0.33 3.99 -0.85 -1.26 -5.07 117.35 113.63 2wcg s TYR 133 Ca 0.30 0.67 0.01 0.00 -0.52 0.00 0.00 57.07 57.53 2wcg s TYR 133 Cb -0.18 0.45 -0.00 0.00 0.38 0.00 0.00 41.96 42.61 2wcg s TYR 133 CO 0.17 -0.42 0.02 0.25 -1.52 0.00 0.00 175.55 174.06 2wcg n THR 134 N 0.64 0.00 0.88 -3.49 -2.24 -1.26 -2.92 114.28 105.90 2wcg n THR 134 Ca -0.12 -1.60 0.14 0.00 -2.27 0.00 0.00 64.05 60.20 2wcg n THR 134 Cb 0.58 0.37 0.54 0.00 -2.10 0.00 0.00 70.33 69.72 2wcg n THR 134 CO 0.00 0.00 0.00 -1.22 -0.57 0.00 0.00 175.07 173.28 2wcg n TYR 135 N -0.80 0.29 -3.14 4.78 0.53 -1.26 -4.39 117.16 113.17 2wcg n TYR 135 Ca -0.12 0.08 -0.22 0.00 -1.02 0.00 0.00 57.90 56.62 2wcg n TYR 135 Cb 0.43 -0.63 -0.05 0.00 -1.03 0.00 0.00 39.34 38.06 2wcg n TYR 135 CO 0.00 0.00 0.00 0.00 -1.02 0.00 0.00 176.86 175.84 2wcg n ALA 136 N -1.59 1.98 0.95 -0.72 0.00 -1.26 -0.68 120.51 119.18 2wcg n ALA 136 Ca 0.06 -3.18 0.13 0.00 0.00 0.00 0.00 53.44 50.46 2wcg n ALA 136 Cb 0.37 -0.87 0.46 0.00 0.00 0.00 0.00 19.45 19.40 2wcg n ALA 136 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 2wcg n ASP 137 N 1.37 0.26 -4.67 0.00 8.00 -1.26 -4.71 116.55 115.54 2wcg n ASP 137 Ca 0.20 0.25 -0.42 0.00 0.71 0.00 0.00 54.79 55.52 2wcg n ASP 137 Cb 0.55 -0.25 -0.03 0.00 -0.02 0.00 0.00 41.12 41.37 2wcg n ASP 137 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 2wcg s THR 138 N -3.02 3.46 0.28 -3.53 2.01 -1.26 -4.93 115.64 108.65 2wcg s THR 138 Ca 0.12 0.67 -0.30 0.00 0.31 0.00 0.00 61.69 62.50 2wcg s THR 138 Cb 0.18 -3.43 -0.10 0.00 0.01 0.00 0.00 72.50 69.15 2wcg s THR 138 CO 0.60 -0.04 1.41 -2.84 -0.69 0.00 0.00 174.62 173.06 2wcg s PRO 139 N 3.61 4.28 -1.57 4.92 0.02 -1.26 -3.07 135.00 141.92 2wcg s PRO 139 Ca 0.73 2.30 0.00 0.00 0.02 0.00 0.00 61.00 64.05 2wcg s PRO 139 Cb -0.35 -3.09 0.00 0.00 0.02 0.00 0.00 34.50 31.08 2wcg s PRO 139 CO 0.30 -0.37 0.00 -0.25 -0.33 0.00 0.00 177.00 176.35 2wcg n ASP 140 N 1.83 -4.84 -3.09 2.53 8.00 -1.26 -4.90 116.55 114.83 2wcg n ASP 140 Ca 0.05 0.27 -0.28 0.00 0.71 0.00 0.00 54.79 55.53 2wcg n ASP 140 Cb 0.41 -3.80 -0.04 0.00 -0.02 0.00 0.00 41.12 37.67 2wcg n ASP 140 CO 0.00 0.00 0.00 -0.67 -0.39 0.00 0.00 177.20 176.14 2wcg n ASP 141 N -0.68 6.59 0.23 -2.24 2.03 -1.17 -4.70 116.55 116.61 2wcg n ASP 141 Ca -0.17 -2.43 0.16 0.00 0.52 0.00 0.00 54.79 52.88 2wcg n ASP 141 Cb 0.55 -1.31 0.84 0.00 -0.72 0.00 0.00 41.12 40.49 2wcg n ASP 141 CO 0.00 0.00 0.00 -0.26 -1.92 0.00 0.00 177.20 175.02 2wcg h PHE 142 N 5.34 0.00 0.00 -0.67 -1.00 -1.91 0.38 116.94 119.08 2wcg h PHE 142 Ca 0.62 0.00 0.00 0.00 2.81 0.00 0.00 57.97 61.40 2wcg h PHE 142 Cb 0.36 0.00 0.00 0.00 3.61 0.00 0.00 35.95 39.92 2wcg h PHE 142 CO 1.88 0.00 0.00 1.96 -1.61 0.00 0.00 178.31 180.54 2wcg h GLN 143 N 0.00 0.00 -4.83 1.51 4.20 -2.01 -3.46 115.11 110.52 2wcg h GLN 143 Ca 0.06 0.00 -0.40 0.00 0.06 0.00 0.00 58.65 58.37 2wcg h GLN 143 Cb 0.32 0.00 0.03 0.00 0.30 0.00 0.00 27.48 28.12 2wcg h GLN 143 CO -0.00 0.00 -0.60 1.28 -0.67 0.00 0.00 178.83 178.84 2wcg n LEU 144 N -2.63 -2.41 0.11 1.46 4.77 0.13 -4.88 117.00 113.54 2wcg n LEU 144 Ca 0.02 -0.33 0.02 0.00 -0.03 0.00 0.00 56.01 55.69 2wcg n LEU 144 Cb 0.33 -2.75 0.37 0.00 -2.33 0.00 0.00 43.42 39.04 2wcg n LEU 144 CO 0.26 0.24 0.88 0.45 -1.33 0.00 0.00 177.39 177.89 2wcg h HIS 145 N -1.35 0.28 -0.74 -1.77 3.86 -1.91 -2.93 115.15 110.59 2wcg h HIS 145 Ca -0.51 -0.03 -0.21 0.00 -1.16 0.00 0.00 60.37 58.46 2wcg h HIS 145 Cb 1.35 -0.08 -0.13 0.00 1.06 0.00 0.00 27.41 29.61 2wcg h HIS 145 CO 0.57 0.40 0.26 0.09 0.86 0.00 0.00 177.93 180.11 2wcg n ASN 146 N -4.26 4.88 -4.71 2.45 4.13 -1.26 -4.96 115.26 111.52 2wcg n ASN 146 Ca -0.01 -3.22 -0.42 0.00 1.68 0.00 0.00 54.58 52.61 2wcg n ASN 146 Cb 0.28 -0.75 -0.03 0.00 -1.54 0.00 0.00 39.78 37.74 2wcg n ASN 146 CO 0.00 0.00 0.00 0.12 0.28 0.00 0.00 177.26 177.66 2wcg s PHE 147 N -3.00 3.12 -0.03 3.10 5.36 -1.11 -4.69 117.98 120.74 2wcg s PHE 147 Ca 0.55 0.88 -0.29 0.00 -0.96 0.00 0.00 56.93 57.12 2wcg s PHE 147 Cb 0.44 -3.70 0.08 0.00 -0.34 0.00 0.00 43.02 39.51 2wcg s PHE 147 CO 0.14 -2.50 0.74 -1.54 -1.46 0.00 0.00 175.22 170.60 2wcg s SER 148 N 1.33 -0.57 -0.07 6.13 1.04 0.14 -5.02 113.70 116.68 2wcg s SER 148 Ca 0.65 0.48 -0.30 0.00 0.48 0.00 0.00 55.95 57.27 2wcg s SER 148 Cb -0.36 0.50 -0.02 0.00 0.10 0.00 0.00 66.02 66.23 2wcg s SER 148 CO 0.30 -0.62 1.09 -0.76 0.98 0.00 0.00 173.24 174.22 2wcg s LEU 149 N -1.54 4.27 0.00 2.42 1.43 -1.26 -4.58 118.68 119.42 2wcg s LEU 149 Ca -0.06 1.66 -0.09 0.00 -1.03 0.00 0.00 54.13 54.61 2wcg s LEU 149 Cb -0.00 -3.56 0.13 0.00 0.03 0.00 0.00 46.19 42.78 2wcg s LEU 149 CO 0.03 -0.49 0.75 -0.81 0.23 0.00 0.00 176.35 176.06 2wcg n PRO 150 N 4.98 -0.69 0.22 1.29 -0.04 -1.26 -4.80 135.00 134.70 2wcg n PRO 150 Ca 0.09 -1.20 0.08 0.00 -0.04 0.00 0.00 63.50 62.43 2wcg n PRO 150 Cb 0.48 -0.76 0.53 0.00 -0.04 0.00 0.00 33.50 33.71 2wcg n PRO 150 CO 0.00 0.00 0.00 0.93 -0.04 0.00 0.00 175.50 176.39 2wcg h GLU 151 N 0.00 0.00 -1.00 0.54 5.08 -1.97 -1.49 114.58 115.74 2wcg h GLU 151 Ca -0.24 0.00 0.26 0.00 -1.00 0.00 0.00 59.36 58.38 2wcg h GLU 151 Cb 0.68 0.00 -0.13 0.00 0.50 0.00 0.00 28.75 29.80 2wcg h GLU 151 CO 0.18 0.23 0.58 0.93 -1.00 0.00 0.00 179.01 179.93 2wcg h GLU 152 N 0.00 0.51 0.00 2.33 3.07 -1.96 0.12 114.58 118.65 2wcg h GLU 152 Ca -0.00 -0.03 -0.15 0.00 -0.50 0.00 0.00 59.36 58.68 2wcg h GLU 152 Cb 0.50 -0.11 -0.02 0.00 -0.84 0.00 0.00 28.75 28.27 2wcg h GLU 152 CO 0.03 0.34 -0.83 -0.44 -1.40 0.00 0.00 179.01 176.71 2wcg h ASP 153 N 0.52 0.00 0.66 1.42 3.32 -1.67 -1.85 116.42 118.82 2wcg h ASP 153 Ca 0.66 -0.58 -0.17 0.00 0.02 0.00 0.00 57.03 56.96 2wcg h ASP 153 Cb 1.31 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 40.84 2wcg h ASP 153 CO -0.50 1.27 -0.78 0.71 -1.72 0.00 0.00 179.24 178.22 2wcg h THR 154 N -1.00 1.51 0.00 0.35 1.35 -1.07 -0.17 112.91 113.88 2wcg h THR 154 Ca -0.22 -2.54 -0.05 0.00 -0.55 0.00 0.00 66.41 63.06 2wcg h THR 154 Cb 1.12 2.38 -0.01 0.00 -1.73 0.00 0.00 68.15 69.91 2wcg h THR 154 CO -0.13 0.73 -1.85 0.29 -0.25 0.00 0.00 175.52 174.31 2wcg n LYS 155 N -3.67 0.66 0.00 4.72 5.02 0.39 -4.46 118.16 120.81 2wcg n LYS 155 Ca -0.02 -0.14 0.00 0.00 -2.02 0.00 0.00 58.31 56.14 2wcg n LYS 155 Cb 0.74 -1.41 0.00 0.00 -0.02 0.00 0.00 35.03 34.34 2wcg n LYS 155 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 2wcg n LEU 156 N -2.18 0.00 0.06 -0.35 4.77 -0.97 -4.71 117.00 113.62 2wcg n LEU 156 Ca -0.07 0.00 -0.13 0.00 -0.03 0.00 0.00 56.01 55.78 2wcg n LEU 156 Cb 0.54 -0.26 -0.08 0.00 -2.33 0.00 0.00 43.42 41.29 2wcg n LEU 156 CO 0.36 -0.45 0.71 0.11 -1.33 0.00 0.00 177.39 176.80 2wcg h LYS 157 N 0.00 -0.12 -0.22 3.23 1.57 -1.33 -3.03 116.57 116.67 2wcg h LYS 157 Ca 0.00 0.01 0.02 0.00 -1.87 0.00 0.00 60.65 58.81 2wcg h LYS 157 Cb 0.00 0.03 -0.02 0.00 0.08 0.00 0.00 32.23 32.32 2wcg h LYS 157 CO 0.00 0.13 0.09 0.82 -0.57 0.00 0.00 179.45 179.92 2wcg h ILE 158 N -0.37 0.97 -0.31 1.86 2.04 -1.27 0.40 117.51 120.82 2wcg h ILE 158 Ca -0.01 -0.07 -0.05 0.00 1.00 0.00 0.00 64.86 65.73 2wcg h ILE 158 Cb 0.31 0.75 -0.02 0.00 -0.74 0.00 0.00 36.82 37.12 2wcg h ILE 158 CO 0.02 0.04 -0.01 -0.65 0.00 0.00 0.00 178.15 177.55 2wcg h PRO 159 N 0.20 0.48 -0.24 2.37 0.11 -1.78 -0.63 132.00 132.52 2wcg h PRO 159 Ca 0.09 -0.10 -0.13 0.00 0.11 0.00 0.00 66.00 65.97 2wcg h PRO 159 Cb 0.05 -0.07 -0.00 0.00 0.11 0.00 0.00 31.00 31.08 2wcg h PRO 159 CO -0.08 0.52 -0.36 -0.07 -0.21 0.00 0.00 178.00 177.80 2wcg h LEU 160 N 0.47 0.73 -0.61 2.35 3.38 -1.35 -1.27 115.31 119.02 2wcg h LEU 160 Ca 0.10 -0.52 0.04 0.00 0.09 0.00 0.00 57.88 57.59 2wcg h LEU 160 Cb 0.32 -0.21 -0.05 0.00 0.09 0.00 0.00 40.66 40.81 2wcg h LEU 160 CO 0.01 1.10 0.35 0.40 0.09 0.00 0.00 178.44 180.39 2wcg h ILE 161 N 0.37 1.02 -0.34 1.22 2.04 -0.61 -0.30 117.51 120.92 2wcg h ILE 161 Ca 0.02 -0.23 0.07 0.00 1.00 0.00 0.00 64.86 65.72 2wcg h ILE 161 Cb 0.95 0.29 -0.07 0.00 -0.74 0.00 0.00 36.82 37.24 2wcg h ILE 161 CO 0.08 0.12 -0.13 0.45 0.00 0.00 0.00 178.15 178.68 2wcg h HIS 162 N 0.67 -0.30 -0.39 1.37 3.86 -0.98 -0.62 115.15 118.76 2wcg h HIS 162 Ca 0.26 0.03 0.01 0.00 -1.16 0.00 0.00 60.37 59.51 2wcg h HIS 162 Cb 0.10 0.18 -0.02 0.00 1.06 0.00 0.00 27.41 28.73 2wcg h HIS 162 CO -0.07 -0.20 0.25 0.00 0.86 0.00 0.00 177.93 178.78 2wcg h ARG 163 N -0.06 0.50 -0.80 2.45 -0.00 -0.94 -0.45 114.38 115.08 2wcg h ARG 163 Ca 0.17 -0.03 0.08 0.00 -0.50 0.00 0.00 59.98 59.70 2wcg h ARG 163 Cb 0.32 -0.11 -0.07 0.00 0.00 0.00 0.00 29.97 30.11 2wcg h ARG 163 CO -0.38 0.33 0.47 0.00 0.00 0.00 0.00 179.97 180.39 2wcg h ALA 164 N 1.15 1.12 -0.63 0.04 0.00 -0.82 -1.55 119.26 118.57 2wcg h ALA 164 Ca 0.15 0.02 -0.06 0.00 0.00 0.00 0.00 54.91 55.01 2wcg h ALA 164 Cb -0.05 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 17.55 2wcg h ALA 164 CO -0.04 0.14 0.14 -0.07 0.00 0.00 0.00 179.25 179.42 2wcg h LEU 165 N 0.82 0.95 -1.14 0.00 3.38 -0.42 -1.11 115.31 117.79 2wcg h LEU 165 Ca 0.37 -0.20 -0.05 0.00 0.09 0.00 0.00 57.88 58.09 2wcg h LEU 165 Cb 0.27 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 40.75 2wcg h LEU 165 CO -0.21 0.92 0.04 1.56 0.09 0.00 0.00 178.44 180.84 2wcg h GLN 166 N 0.95 0.63 0.00 1.13 4.20 -0.67 -2.69 115.11 118.67 2wcg h GLN 166 Ca 0.20 -0.14 0.00 0.00 0.06 0.00 0.00 58.65 58.77 2wcg h GLN 166 Cb 0.36 -0.09 0.00 0.00 0.30 0.00 0.00 27.48 28.05 2wcg h GLN 166 CO 0.00 0.63 -0.22 -0.07 -0.67 0.00 0.00 178.83 178.50 2wcg h LEU 167 N 0.61 0.00 -9.69 1.46 3.38 -1.02 -3.47 115.31 106.57 2wcg h LEU 167 Ca 0.13 -0.05 -0.52 0.00 0.09 0.00 0.00 57.88 57.53 2wcg h LEU 167 Cb 0.33 0.00 0.03 0.00 0.09 0.00 0.00 40.66 41.11 2wcg h LEU 167 CO 0.01 0.03 0.65 0.00 0.09 0.00 0.00 178.44 179.22 2wcg s ALA 168 N -3.15 3.53 0.07 1.53 0.00 -0.44 -4.07 121.76 119.21 2wcg s ALA 168 Ca 0.08 1.12 -0.29 0.00 0.00 0.00 0.00 51.96 52.87 2wcg s ALA 168 Cb 0.11 -3.48 -0.18 0.00 0.00 0.00 0.00 23.12 19.57 2wcg s ALA 168 CO 0.65 -0.54 1.61 0.37 0.00 0.00 0.00 175.76 177.85 2wcg h GLN 169 N 5.28 -0.57 -6.19 0.00 4.15 -1.81 -3.47 115.11 112.50 2wcg h GLN 169 Ca -0.45 0.04 -0.55 0.00 0.77 0.00 0.00 58.65 58.46 2wcg h GLN 169 Cb 1.21 0.13 -0.09 0.00 0.21 0.00 0.00 27.48 28.95 2wcg h GLN 169 CO 0.77 -0.36 -0.62 1.03 -1.93 0.00 0.00 178.83 177.71 2wcg s ARG 170 N -5.91 2.35 0.29 1.69 0.52 -1.26 -5.02 118.95 111.60 2wcg s ARG 170 Ca -0.16 -1.41 -0.30 0.00 -0.52 0.00 0.00 55.73 53.34 2wcg s ARG 170 Cb 0.04 -2.19 -0.11 0.00 0.52 0.00 0.00 34.95 33.21 2wcg s ARG 170 CO 0.62 0.34 1.61 -2.14 0.02 0.00 0.00 175.30 175.75 2wcg s PRO 171 N -3.71 4.12 -0.13 3.54 0.02 -1.26 -4.96 135.00 132.62 2wcg s PRO 171 Ca 0.32 2.59 -0.04 0.00 0.02 0.00 0.00 61.00 63.89 2wcg s PRO 171 Cb -0.06 -3.02 -0.03 0.00 0.02 0.00 0.00 34.50 31.40 2wcg s PRO 171 CO 0.21 -0.65 0.01 0.08 -0.33 0.00 0.00 177.00 176.31 2wcg s VAL 172 N 0.09 4.36 -0.18 3.83 1.01 -1.26 -4.82 120.40 123.43 2wcg s VAL 172 Ca 0.64 -0.21 -0.07 0.00 0.00 0.00 0.00 61.98 62.34 2wcg s VAL 172 Cb -0.48 -2.89 -0.04 0.00 0.00 0.00 0.00 36.38 32.97 2wcg s VAL 172 CO 0.47 0.53 0.06 -0.44 0.00 0.00 0.00 175.10 175.73 2wcg s SER 173 N -0.19 5.66 -0.04 3.32 0.01 0.14 -4.96 113.70 117.64 2wcg s SER 173 Ca 0.05 0.10 -0.07 0.00 1.31 0.00 0.00 55.95 57.35 2wcg s SER 173 Cb -0.12 -1.95 -0.04 0.00 0.21 0.00 0.00 66.02 64.11 2wcg s SER 173 CO 0.02 0.19 0.22 -0.76 0.41 0.00 0.00 173.24 173.32 2wcg s LEU 174 N 0.25 4.38 -0.07 2.44 1.43 -1.26 -1.50 118.68 124.36 2wcg s LEU 174 Ca 0.04 0.52 0.01 0.00 -1.03 0.00 0.00 54.13 53.67 2wcg s LEU 174 Cb -0.12 -2.46 0.02 0.00 0.03 0.00 0.00 46.19 43.66 2wcg s LEU 174 CO 0.00 0.31 -0.06 -0.22 0.23 0.00 0.00 176.35 176.61 2wcg s LEU 175 N -1.51 1.26 -0.01 1.79 2.96 -0.63 -0.62 118.68 121.92 2wcg s LEU 175 Ca 0.23 -0.20 0.00 0.00 -0.22 0.00 0.00 54.13 53.95 2wcg s LEU 175 Cb -0.13 -0.62 -0.04 0.00 0.50 0.00 0.00 46.19 45.91 2wcg s LEU 175 CO 0.12 -0.07 0.04 0.00 -1.32 0.00 0.00 176.35 175.12 2wcg s ALA 176 N 1.18 3.42 -0.06 5.97 0.00 -0.79 0.14 121.76 131.62 2wcg s ALA 176 Ca -0.06 -0.91 -0.05 0.00 0.00 0.00 0.00 51.96 50.94 2wcg s ALA 176 Cb -0.14 -1.46 0.02 0.00 0.00 0.00 0.00 23.12 21.54 2wcg s ALA 176 CO -0.02 0.66 0.17 -1.12 0.00 0.00 0.00 175.76 175.45 2wcg s SER 177 N -1.60 -0.17 0.17 0.00 0.01 -0.82 -1.51 113.70 109.77 2wcg s SER 177 Ca 0.21 0.34 -0.03 0.00 1.31 0.00 0.00 55.95 57.77 2wcg s SER 177 Cb -0.12 0.32 -0.05 0.00 0.21 0.00 0.00 66.02 66.38 2wcg s SER 177 CO 0.11 -0.08 0.39 -2.16 0.41 0.00 0.00 173.24 171.91 2wcg s PRO 178 N 0.32 3.58 -0.19 12.44 0.04 -1.26 -0.54 135.00 149.38 2wcg s PRO 178 Ca -0.02 -0.17 -0.15 0.00 0.04 0.00 0.00 61.00 60.70 2wcg s PRO 178 Cb -0.03 -2.84 -0.09 0.00 0.04 0.00 0.00 34.50 31.58 2wcg s PRO 178 CO -0.01 0.44 -0.16 0.91 0.04 0.00 0.00 177.00 178.21 2wcg n TRP 179 N -0.19 0.54 -4.28 0.56 5.03 -1.26 -0.81 117.44 117.03 2wcg n TRP 179 Ca -0.03 0.24 -0.18 0.00 3.03 0.00 0.00 57.50 60.55 2wcg n TRP 179 Cb 0.52 -0.83 -0.11 0.00 -1.03 0.00 0.00 31.31 29.86 2wcg n TRP 179 CO 0.00 0.00 0.00 -0.08 -0.03 0.00 0.00 177.69 177.58 2wcg s THR 180 N -2.49 1.49 0.72 -0.99 -1.32 -1.26 -3.16 115.64 108.63 2wcg s THR 180 Ca -0.27 -1.92 -0.09 0.00 -1.21 0.00 0.00 61.69 58.21 2wcg s THR 180 Cb 0.06 -1.75 0.05 0.00 -1.51 0.00 0.00 72.50 69.35 2wcg s THR 180 CO 0.42 -0.48 1.07 -0.94 -2.21 0.00 0.00 174.62 172.47 2wcg s SER 181 N -2.79 4.97 0.48 8.08 1.04 -1.26 -4.97 113.70 119.25 2wcg s SER 181 Ca 0.14 0.74 -0.21 0.00 0.48 0.00 0.00 55.95 57.11 2wcg s SER 181 Cb -0.03 -1.43 -0.11 0.00 0.10 0.00 0.00 66.02 64.55 2wcg s SER 181 CO 0.04 -1.56 0.55 -2.65 0.98 0.00 0.00 173.24 170.61 2wcg n PRO 182 N -3.02 0.60 0.24 4.02 -0.02 -1.26 -4.88 135.00 130.68 2wcg n PRO 182 Ca 0.07 0.22 0.13 0.00 -2.02 0.00 0.00 63.50 61.90 2wcg n PRO 182 Cb 0.59 -1.61 0.48 0.00 -0.02 0.00 0.00 33.50 32.94 2wcg n PRO 182 CO 0.00 0.00 0.00 1.79 1.98 0.00 0.00 175.50 179.27 2wcg h THR 183 N 0.62 0.25 0.00 3.45 1.35 -1.88 -2.53 112.91 114.17 2wcg h THR 183 Ca -0.43 -0.91 0.00 0.00 -0.55 0.00 0.00 66.41 64.52 2wcg h THR 183 Cb 1.40 1.74 0.00 0.00 -1.73 0.00 0.00 68.15 69.56 2wcg h THR 183 CO 0.50 0.11 0.00 -2.67 -0.25 0.00 0.00 175.52 173.21 2wcg n TRP 184 N -3.21 0.00 1.05 4.73 4.27 -1.26 -2.06 117.44 120.96 2wcg n TRP 184 Ca 0.01 0.00 0.11 0.00 -3.89 0.00 0.00 57.50 53.74 2wcg n TRP 184 Cb 0.41 -0.14 0.07 0.00 -1.36 0.00 0.00 31.31 30.30 2wcg n TRP 184 CO 0.00 0.00 0.00 1.28 -2.29 0.00 0.00 177.69 176.68 2wcg n LEU 185 N -1.14 1.92 -4.71 5.67 4.77 -0.95 -4.88 117.00 117.67 2wcg n LEU 185 Ca 0.15 -0.69 -0.34 0.00 -0.03 0.00 0.00 56.01 55.11 2wcg n LEU 185 Cb 0.14 -0.02 -0.09 0.00 -2.33 0.00 0.00 43.42 41.12 2wcg n LEU 185 CO 0.16 0.35 -0.29 -0.54 -1.33 0.00 0.00 177.39 175.74 2wcg s LYS 186 N -2.45 2.97 0.47 3.23 1.02 -0.87 -1.27 119.74 122.84 2wcg s LYS 186 Ca 0.20 -0.46 0.22 0.00 0.02 0.00 0.00 55.97 55.95 2wcg s LYS 186 Cb 0.18 -2.79 1.25 0.00 -0.52 0.00 0.00 37.83 35.95 2wcg s LYS 186 CO 0.54 0.68 1.91 1.79 -0.92 0.00 0.00 175.35 179.35 2wcg h THR 187 N 3.81 0.68 -0.04 2.17 1.35 -0.60 -2.14 112.91 118.13 2wcg h THR 187 Ca -0.50 -0.08 0.00 0.00 -0.55 0.00 0.00 66.41 65.28 2wcg h THR 187 Cb 1.19 0.44 0.00 0.00 -1.73 0.00 0.00 68.15 68.05 2wcg h THR 187 CO 0.57 0.04 0.00 -0.46 -0.25 0.00 0.00 175.52 175.42 2wcg n ASN 188 N -4.41 2.59 -2.18 5.36 6.94 -1.26 -4.99 115.26 117.31 2wcg n ASN 188 Ca 0.16 -1.79 -0.20 0.00 -0.02 0.00 0.00 54.58 52.74 2wcg n ASN 188 Cb 0.71 -0.01 -0.03 0.00 -2.36 0.00 0.00 39.78 38.09 2wcg n ASN 188 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 2wcg n GLY 189 N 1.05 0.16 3.12 4.83 0.00 -0.81 -4.97 105.19 108.58 2wcg n GLY 189 Ca 0.11 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 46.05 2wcg n GLY 189 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2wcg s ALA 190 N -2.90 0.46 0.06 4.61 0.00 -1.26 -4.88 121.76 117.85 2wcg s ALA 190 Ca 0.00 -1.17 0.16 0.00 0.00 0.00 0.00 51.96 50.95 2wcg s ALA 190 Cb 0.00 0.42 0.39 0.00 0.00 0.00 0.00 23.12 23.93 2wcg s ALA 190 CO 0.00 -0.42 1.59 -0.39 0.00 0.00 0.00 175.76 176.55 2wcg h VAL 191 N 3.03 0.97 -3.88 0.00 -1.51 -1.93 -3.46 116.25 109.47 2wcg h VAL 191 Ca -0.34 -1.94 0.00 0.00 -1.23 0.00 0.00 66.70 63.19 2wcg h VAL 191 Cb 1.16 2.18 0.00 0.00 -2.13 0.00 0.00 31.29 32.50 2wcg h VAL 191 CO 0.63 0.47 0.00 -0.46 -1.23 0.00 0.00 177.57 176.98 2wcg n ASN 192 N -3.42 1.92 0.00 4.19 6.94 -1.26 -2.02 115.26 121.60 2wcg n ASN 192 Ca 0.00 -0.88 0.00 0.00 -0.02 0.00 0.00 54.58 53.68 2wcg n ASN 192 Cb 0.63 0.00 0.00 0.00 -2.36 0.00 0.00 39.78 38.05 2wcg n ASN 192 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 2wcg n GLY 193 N 5.00 -1.31 3.69 4.83 0.00 0.15 -4.79 105.19 112.75 2wcg n GLY 193 Ca 0.00 -1.56 -0.42 0.00 0.00 0.00 0.00 46.02 44.04 2wcg n GLY 193 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2wcg s LYS 194 N -1.20 4.36 0.00 1.61 2.20 -1.22 -4.55 119.74 120.93 2wcg s LYS 194 Ca 0.00 1.61 0.00 0.00 -0.36 0.00 0.00 55.97 57.22 2wcg s LYS 194 Cb 0.00 -3.57 0.00 0.00 -1.51 0.00 0.00 37.83 32.75 2wcg s LYS 194 CO 0.00 -0.44 0.00 0.41 -0.36 0.00 0.00 175.35 174.96 2wcg n GLY 195 N 3.33 1.75 3.33 5.54 0.00 -0.63 -4.66 105.19 113.84 2wcg n GLY 195 Ca 0.11 -0.56 -0.20 0.00 0.00 0.00 0.00 46.02 45.36 2wcg n GLY 195 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2wcg s SER 196 N 0.00 1.77 0.35 1.61 1.04 -1.26 -0.92 113.70 116.29 2wcg s SER 196 Ca 0.00 -1.71 -0.28 0.00 0.48 0.00 0.00 55.95 54.44 2wcg s SER 196 Cb 0.00 0.53 -0.12 0.00 0.10 0.00 0.00 66.02 66.53 2wcg s SER 196 CO 0.00 -1.01 1.33 0.18 0.98 0.00 0.00 173.24 174.72 2wcg n LEU 197 N -0.65 3.81 -4.76 2.42 4.77 -1.26 0.09 117.00 121.42 2wcg n LEU 197 Ca 0.04 1.21 -0.33 0.00 -0.03 0.00 0.00 56.01 56.91 2wcg n LEU 197 Cb 0.63 -1.51 0.06 0.00 -2.33 0.00 0.00 43.42 40.27 2wcg n LEU 197 CO 0.33 -0.35 0.74 -0.54 -1.33 0.00 0.00 177.39 176.24 2wcg s LYS 198 N -1.93 2.59 3.25 3.23 1.02 -0.40 -4.62 119.74 122.88 2wcg s LYS 198 Ca 0.55 1.38 0.00 0.00 0.02 0.00 0.00 55.97 57.92 2wcg s LYS 198 Cb -0.55 -1.92 0.00 0.00 -0.52 0.00 0.00 37.83 34.84 2wcg s LYS 198 CO 0.63 -1.41 0.00 0.41 -0.92 0.00 0.00 175.35 174.06 2wcg n GLY 199 N -0.56 -0.12 3.10 -3.33 0.00 -1.26 -4.67 105.19 98.35 2wcg n GLY 199 Ca 0.10 -1.02 -0.10 0.00 0.00 0.00 0.00 46.02 45.00 2wcg n GLY 199 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 2wcg s GLN 200 N 0.00 0.64 0.55 1.61 -2.07 -1.26 -5.10 119.66 114.03 2wcg s GLN 200 Ca 0.00 -1.08 -0.20 0.00 -1.82 0.00 0.00 55.36 52.26 2wcg s GLN 200 Cb 0.00 -0.08 -0.07 0.00 -1.09 0.00 0.00 33.01 31.77 2wcg s GLN 200 CO 0.00 -0.03 0.84 -2.30 -1.32 0.00 0.00 175.29 172.48 2wcg n PRO 201 N 0.55 0.89 0.00 9.60 -0.02 -1.26 -1.98 135.00 142.77 2wcg n PRO 201 Ca -0.17 0.34 0.00 0.00 -2.02 0.00 0.00 63.50 61.65 2wcg n PRO 201 Cb 0.59 -2.00 0.00 0.00 -0.02 0.00 0.00 33.50 32.07 2wcg n PRO 201 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2wcg n GLY 202 N 1.41 2.11 2.11 -1.23 0.00 -1.26 -5.01 105.19 103.32 2wcg n GLY 202 Ca 0.12 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 46.03 2wcg n GLY 202 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2wcg n ASP 203 N 0.00 0.95 -0.15 1.61 5.68 -0.84 -4.83 116.55 118.97 2wcg n ASP 203 Ca 0.00 -1.73 -0.03 0.00 -0.50 0.00 0.00 54.79 52.53 2wcg n ASP 203 Cb 0.00 -0.29 0.18 0.00 -1.14 0.00 0.00 41.12 39.88 2wcg n ASP 203 CO 0.00 0.00 0.00 -0.29 -1.33 0.00 0.00 177.20 175.58 2wcg h ILE 204 N -0.20 1.23 -0.23 2.12 2.10 -1.96 0.21 117.51 120.78 2wcg h ILE 204 Ca -0.16 -0.78 -0.01 0.00 1.08 0.00 0.00 64.86 64.98 2wcg h ILE 204 Cb 0.67 0.59 -0.01 0.00 -1.09 0.00 0.00 36.82 36.98 2wcg h ILE 204 CO 0.20 0.30 0.10 1.88 -1.08 0.00 0.00 178.15 179.55 2wcg h TYR 205 N 0.85 0.34 -0.46 2.19 -1.99 -1.90 -1.14 116.97 114.86 2wcg h TYR 205 Ca 0.19 -0.02 -0.12 0.00 2.00 0.00 0.00 58.73 60.78 2wcg h TYR 205 Cb 0.26 -0.10 -0.01 0.00 2.00 0.00 0.00 36.73 38.87 2wcg h TYR 205 CO 0.02 0.36 -0.16 0.45 -0.00 0.00 0.00 178.16 178.82 2wcg h HIS 206 N 0.23 1.05 -0.12 4.88 3.86 -1.80 -1.21 115.15 122.04 2wcg h HIS 206 Ca 0.08 -0.24 0.01 0.00 -1.16 0.00 0.00 60.37 59.06 2wcg h HIS 206 Cb 0.15 -0.25 -0.01 0.00 1.06 0.00 0.00 27.41 28.36 2wcg h HIS 206 CO -0.02 1.03 0.04 0.37 0.86 0.00 0.00 177.93 180.22 2wcg h GLN 207 N 0.76 0.10 -0.57 2.45 4.15 -0.94 0.89 115.11 121.95 2wcg h GLN 207 Ca 0.11 -0.01 0.01 0.00 0.77 0.00 0.00 58.65 59.54 2wcg h GLN 207 Cb 0.72 -0.02 -0.03 0.00 0.21 0.00 0.00 27.48 28.36 2wcg h GLN 207 CO 0.06 0.07 0.37 1.15 -1.93 0.00 0.00 178.83 178.54 2wcg h THR 208 N 0.10 1.12 -0.52 2.39 2.02 -1.13 -1.39 112.91 115.51 2wcg h THR 208 Ca 0.05 -0.26 -0.03 0.00 0.77 0.00 0.00 66.41 66.94 2wcg h THR 208 Cb 0.02 0.31 -0.02 0.00 -1.74 0.00 0.00 68.15 66.72 2wcg h THR 208 CO -0.05 0.14 0.20 -0.25 0.37 0.00 0.00 175.52 175.92 2wcg h TRP 209 N 0.74 0.80 -0.84 3.16 -0.00 -0.86 -1.36 115.95 117.59 2wcg h TRP 209 Ca 0.22 -0.06 0.04 0.00 -0.00 0.00 0.00 58.89 59.08 2wcg h TRP 209 Cb -0.05 -0.24 -0.05 0.00 -0.00 0.00 0.00 29.16 28.81 2wcg h TRP 209 CO -0.04 0.67 0.53 0.00 -0.00 0.00 0.00 178.44 179.60 2wcg h ALA 210 N 1.05 1.13 -0.14 2.65 0.00 -0.67 -2.70 119.26 120.57 2wcg h ALA 210 Ca 0.17 -0.02 -0.04 0.00 0.00 0.00 0.00 54.91 55.02 2wcg h ALA 210 Cb 0.22 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.73 2wcg h ALA 210 CO -0.01 0.33 -0.09 0.00 0.00 0.00 0.00 179.25 179.48 2wcg h ARG 211 N 1.01 0.21 -0.90 0.00 3.08 -0.61 -2.28 114.38 114.90 2wcg h ARG 211 Ca 0.35 -0.04 0.03 0.00 0.07 0.00 0.00 59.98 60.39 2wcg h ARG 211 Cb 0.07 -0.03 -0.05 0.00 0.08 0.00 0.00 29.97 30.04 2wcg h ARG 211 CO -0.14 0.32 0.59 -0.92 -1.07 0.00 0.00 179.97 178.75 2wcg h TYR 212 N 0.21 1.08 -0.41 3.04 3.20 -0.93 -0.30 116.97 122.86 2wcg h TYR 212 Ca 0.05 0.03 -0.00 0.00 3.14 0.00 0.00 58.73 61.94 2wcg h TYR 212 Cb 0.30 -0.36 -0.02 0.00 1.54 0.00 0.00 36.73 38.19 2wcg h TYR 212 CO 0.00 0.63 0.24 0.74 -1.64 0.00 0.00 178.16 178.14 2wcg h PHE 213 N 1.12 0.54 -0.51 -3.82 -1.00 -1.38 -0.76 116.94 111.14 2wcg h PHE 213 Ca 0.35 -0.00 -0.03 0.00 2.81 0.00 0.00 57.97 61.10 2wcg h PHE 213 Cb 0.01 -0.18 -0.02 0.00 3.61 0.00 0.00 35.95 39.37 2wcg h PHE 213 CO -0.00 0.39 0.20 0.28 -1.61 0.00 0.00 178.31 177.56 2wcg h VAL 214 N 0.54 1.22 -0.87 -0.55 2.07 -1.36 -1.14 116.25 116.15 2wcg h VAL 214 Ca 0.15 -0.68 0.09 0.00 0.82 0.00 0.00 66.70 67.08 2wcg h VAL 214 Cb 0.01 0.71 -0.07 0.00 -1.52 0.00 0.00 31.29 30.42 2wcg h VAL 214 CO -0.03 0.26 0.52 0.11 0.02 0.00 0.00 177.57 178.45 2wcg h LYS 215 N 0.68 0.85 -0.07 1.57 1.79 -0.94 0.25 116.57 120.69 2wcg h LYS 215 Ca 0.17 -0.05 -0.01 0.00 -2.18 0.00 0.00 60.65 58.58 2wcg h LYS 215 Cb 0.21 -0.19 -0.00 0.00 -1.58 0.00 0.00 32.23 30.67 2wcg h LYS 215 CO -0.01 0.56 0.02 0.35 -1.08 0.00 0.00 179.45 179.28 2wcg h PHE 216 N 0.87 0.12 -0.83 -1.35 3.57 -0.83 -0.79 116.94 117.70 2wcg h PHE 216 Ca 0.41 -0.01 0.02 0.00 3.53 0.00 0.00 57.97 61.92 2wcg h PHE 216 Cb 0.35 -0.03 -0.05 0.00 2.79 0.00 0.00 35.95 39.01 2wcg h PHE 216 CO -0.04 0.31 0.54 -0.07 -2.23 0.00 0.00 178.31 176.82 2wcg h LEU 217 N -0.11 0.91 -0.42 0.59 3.38 -0.79 -2.07 115.31 116.82 2wcg h LEU 217 Ca 0.02 -0.01 -0.01 0.00 0.09 0.00 0.00 57.88 57.97 2wcg h LEU 217 Cb 0.25 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 40.77 2wcg h LEU 217 CO 0.00 0.64 0.22 0.44 0.09 0.00 0.00 178.44 179.84 2wcg h ASP 218 N 1.08 0.52 -0.42 -0.43 3.32 -0.34 0.37 116.42 120.51 2wcg h ASP 218 Ca 0.32 -0.10 -0.10 0.00 0.02 0.00 0.00 57.03 57.17 2wcg h ASP 218 Cb -0.05 -0.13 -0.02 0.00 0.22 0.00 0.00 39.33 39.35 2wcg h ASP 218 CO -0.09 0.47 -0.10 0.00 -1.72 0.00 0.00 179.24 177.79 2wcg h ALA 219 N 1.08 0.91 -0.15 3.45 0.00 -0.88 -1.88 119.26 121.77 2wcg h ALA 219 Ca 0.15 -0.33 -0.17 0.00 0.00 0.00 0.00 54.91 54.56 2wcg h ALA 219 Cb 0.07 -0.18 -0.00 0.00 0.00 0.00 0.00 17.79 17.67 2wcg h ALA 219 CO -0.02 0.63 -0.61 1.88 0.00 0.00 0.00 179.25 181.13 2wcg h TYR 220 N 0.79 0.68 -0.90 0.00 -1.99 -1.20 -3.03 116.97 111.32 2wcg h TYR 220 Ca 0.13 -0.26 -0.01 0.00 2.00 0.00 0.00 58.73 60.59 2wcg h TYR 220 Cb 0.62 -0.12 -0.04 0.00 2.00 0.00 0.00 36.73 39.18 2wcg h TYR 220 CO 0.04 1.01 0.51 0.00 -0.00 0.00 0.00 178.16 179.71 2wcg h ALA 221 N 0.93 1.15 0.00 3.88 0.00 -0.60 -0.48 119.26 124.14 2wcg h ALA 221 Ca -0.01 -0.12 -0.00 0.00 0.00 0.00 0.00 54.91 54.78 2wcg h ALA 221 Cb 1.17 -0.36 -0.00 0.00 0.00 0.00 0.00 17.79 18.60 2wcg h ALA 221 CO 0.11 0.63 -0.02 0.93 0.00 0.00 0.00 179.25 180.91 2wcg h GLU 222 N 1.25 0.00 -0.63 0.00 5.08 -1.31 0.18 114.58 119.14 2wcg h GLU 222 Ca 0.32 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.68 2wcg h GLU 222 Cb -0.01 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.24 2wcg h GLU 222 CO -0.05 0.02 0.00 0.72 -1.00 0.00 0.00 179.01 178.70 2wcg n HIS 223 N -3.41 1.78 -2.28 4.33 8.25 -0.34 -4.94 115.22 118.62 2wcg n HIS 223 Ca -0.02 -0.66 -0.12 0.00 -0.26 0.00 0.00 57.72 56.65 2wcg n HIS 223 Cb 0.12 -0.37 -0.00 0.00 1.12 0.00 0.00 29.99 30.86 2wcg n HIS 223 CO 0.00 0.00 0.00 1.63 0.64 0.00 0.00 176.34 178.61 2wcg n LYS 224 N 0.94 -1.17 -4.98 -0.41 4.76 0.64 -5.02 118.16 112.92 2wcg n LYS 224 Ca 0.27 0.60 -0.32 0.00 -2.87 0.00 0.00 58.31 55.98 2wcg n LYS 224 Cb 1.04 -4.78 -0.16 0.00 -1.84 0.00 0.00 35.03 29.29 2wcg n LYS 224 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 2wcg s LEU 225 N -3.62 2.39 0.16 -0.35 1.43 -0.35 -4.99 118.68 113.34 2wcg s LEU 225 Ca 0.02 -0.45 0.11 0.00 -1.03 0.00 0.00 54.13 52.78 2wcg s LEU 225 Cb -0.01 -1.51 -0.04 0.00 0.03 0.00 0.00 46.19 44.66 2wcg s LEU 225 CO 0.02 0.16 -0.25 0.00 0.23 0.00 0.00 176.35 176.51 2wcg s GLN 226 N 0.37 1.47 -0.14 1.70 -2.07 -1.26 -2.74 119.66 116.99 2wcg s GLN 226 Ca -0.15 -1.41 -0.08 0.00 -1.82 0.00 0.00 55.36 51.90 2wcg s GLN 226 Cb -0.17 -1.89 -0.04 0.00 -1.09 0.00 0.00 33.01 29.82 2wcg s GLN 226 CO 0.07 0.43 0.13 -0.06 -1.32 0.00 0.00 175.29 174.54 2wcg s PHE 227 N -1.32 3.53 0.05 9.60 0.40 -1.26 -4.51 117.98 124.47 2wcg s PHE 227 Ca 0.17 0.45 -0.16 0.00 -0.60 0.00 0.00 56.93 56.79 2wcg s PHE 227 Cb -0.09 -2.00 -0.22 0.00 0.51 0.00 0.00 43.02 41.22 2wcg s PHE 227 CO 0.08 0.60 1.17 2.35 0.70 0.00 0.00 175.22 180.12 2wcg h TRP 228 N 5.48 0.88 -3.56 0.36 7.01 -1.21 -3.43 115.95 121.48 2wcg h TRP 228 Ca -0.51 -0.46 -0.06 0.00 2.11 0.00 0.00 58.89 59.97 2wcg h TRP 228 Cb 1.21 -0.11 -0.12 0.00 -2.10 0.00 0.00 29.16 28.04 2wcg h TRP 228 CO 0.70 1.29 -0.16 0.00 -2.79 0.00 0.00 178.44 177.48 2wcg s ALA 229 N -3.34 -0.59 0.09 2.65 0.00 -1.00 -1.49 121.76 118.06 2wcg s ALA 229 Ca -0.11 -0.38 0.04 0.00 0.00 0.00 0.00 51.96 51.51 2wcg s ALA 229 Cb 0.06 0.73 -0.03 0.00 0.00 0.00 0.00 23.12 23.87 2wcg s ALA 229 CO 0.88 -0.65 -0.11 0.14 0.00 0.00 0.00 175.76 176.01 2wcg s VAL 230 N -3.87 0.98 0.15 0.00 -7.23 0.03 -1.89 120.40 108.57 2wcg s VAL 230 Ca 0.08 -1.52 0.03 0.00 -1.81 0.00 0.00 61.98 58.77 2wcg s VAL 230 Cb 0.02 -1.24 -0.04 0.00 0.56 0.00 0.00 36.38 35.69 2wcg s VAL 230 CO -0.07 -0.45 0.21 0.42 -0.31 0.00 0.00 175.10 174.90 2wcg s THR 231 N -2.04 4.95 -0.48 5.32 -4.23 -0.57 -0.75 115.64 117.84 2wcg s THR 231 Ca 0.03 -0.84 0.26 0.00 -1.18 0.00 0.00 61.69 59.95 2wcg s THR 231 Cb -0.05 -3.53 0.31 0.00 1.34 0.00 0.00 72.50 70.57 2wcg s THR 231 CO 0.01 -0.08 1.74 0.00 -0.54 0.00 0.00 174.62 175.75 2wcg h ALA 232 N 2.33 1.00 -1.01 3.99 0.00 -1.71 -3.42 119.26 120.44 2wcg h ALA 232 Ca -0.48 0.00 0.21 0.00 0.00 0.00 0.00 54.91 54.64 2wcg h ALA 232 Cb 1.19 0.00 -0.34 0.00 0.00 0.00 0.00 17.79 18.65 2wcg h ALA 232 CO 0.67 0.00 0.93 -2.00 0.00 0.00 0.00 179.25 178.85 2wcg s GLU 233 N -3.25 0.01 0.01 0.00 2.56 -1.26 -4.91 118.70 111.86 2wcg s GLU 233 Ca 0.07 0.01 -0.30 0.00 0.00 0.00 0.00 54.97 54.75 2wcg s GLU 233 Cb 0.09 0.01 -0.05 0.00 2.00 0.00 0.00 34.13 36.18 2wcg s GLU 233 CO 0.58 -0.00 1.23 1.21 -0.56 0.00 0.00 175.26 177.72 2wcg s ASN 234 N -0.03 7.03 -0.96 -1.70 2.47 0.01 -4.24 114.94 117.52 2wcg s ASN 234 Ca 0.08 1.96 -0.17 0.00 0.42 0.00 0.00 52.86 55.15 2wcg s ASN 234 Cb -0.05 -2.57 0.02 0.00 -1.45 0.00 0.00 41.25 37.21 2wcg s ASN 234 CO -0.16 -0.55 0.60 -0.62 -3.72 0.00 0.00 177.10 172.64 2wcg n GLU 235 N 4.60 -0.82 0.07 0.43 1.02 0.79 -4.78 120.64 121.95 2wcg n GLU 235 Ca 0.10 0.34 0.21 0.00 -0.02 0.00 0.00 57.16 57.79 2wcg n GLU 235 Cb 0.46 -2.13 0.74 0.00 -0.02 0.00 0.00 31.44 30.49 2wcg n GLU 235 CO 0.00 0.00 0.00 -1.00 1.18 0.00 0.00 177.13 177.31 2wcg h PRO 236 N -1.29 0.00 0.00 3.49 0.13 -1.75 -0.80 132.00 131.79 2wcg h PRO 236 Ca -0.64 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 64.49 2wcg h PRO 236 Cb 1.31 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.44 2wcg h PRO 236 CO 0.42 0.00 -0.02 0.66 -0.23 0.00 0.00 178.00 178.83 2wcg h SER 237 N 0.00 0.00 -0.81 1.44 4.64 -1.87 -1.78 113.55 115.18 2wcg h SER 237 Ca 0.21 0.00 0.02 0.00 -0.47 0.00 0.00 61.79 61.55 2wcg h SER 237 Cb 1.10 0.00 -0.05 0.00 -0.31 0.00 0.00 62.40 63.14 2wcg h SER 237 CO -0.00 0.02 0.52 0.00 -0.87 0.00 0.00 176.83 176.50 2wcg h ALA 238 N 1.98 1.04 0.00 5.18 0.00 -1.47 -0.82 119.26 125.17 2wcg h ALA 238 Ca -0.00 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.87 2wcg h ALA 238 Cb 0.77 -0.29 0.00 0.00 0.00 0.00 0.00 17.79 18.27 2wcg h ALA 238 CO 0.00 0.37 0.00 0.41 0.00 0.00 0.00 179.25 180.04 2wcg n GLY 239 N -1.32 -0.71 0.21 0.00 0.00 -1.22 -1.13 105.19 101.03 2wcg n GLY 239 Ca 0.09 -0.07 0.14 0.00 0.00 0.00 0.00 46.02 46.18 2wcg n GLY 239 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2wcg n LEU 240 N -1.24 0.76 -4.46 0.99 4.77 -0.31 -1.60 117.00 115.90 2wcg n LEU 240 Ca 0.07 -0.17 -0.36 0.00 -0.03 0.00 0.00 56.01 55.53 2wcg n LEU 240 Cb 0.10 -0.10 -0.12 0.00 -2.33 0.00 0.00 43.42 40.97 2wcg n LEU 240 CO 0.10 0.13 -0.30 -0.22 -1.33 0.00 0.00 177.39 175.78 2wcg s LEU 241 N -2.29 3.40 0.21 2.23 2.96 -0.28 -4.96 118.68 119.95 2wcg s LEU 241 Ca 0.33 -0.18 -0.31 0.00 -0.22 0.00 0.00 54.13 53.75 2wcg s LEU 241 Cb 0.20 -1.89 -0.11 0.00 0.50 0.00 0.00 46.19 44.90 2wcg s LEU 241 CO 0.43 0.02 1.60 -0.55 -1.32 0.00 0.00 176.35 176.54 2wcg s SER 242 N 1.26 6.49 0.00 3.68 0.15 -1.26 -1.77 113.70 122.25 2wcg s SER 242 Ca 0.04 2.77 0.00 0.00 0.70 0.00 0.00 55.95 59.46 2wcg s SER 242 Cb -0.15 -2.61 0.00 0.00 -1.71 0.00 0.00 66.02 61.56 2wcg s SER 242 CO 0.02 -0.87 0.00 0.61 1.20 0.00 0.00 173.24 174.20 2wcg n GLY 243 N 3.31 0.38 3.68 9.45 0.00 -1.26 -4.88 105.19 115.87 2wcg n GLY 243 Ca 0.12 0.00 -0.46 0.00 0.00 0.00 0.00 46.02 45.69 2wcg n GLY 243 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 2wcg n TYR 244 N -2.70 2.38 0.22 1.61 9.36 -0.73 -4.66 117.16 122.65 2wcg n TYR 244 Ca 0.00 0.12 0.12 0.00 3.32 0.00 0.00 57.90 61.46 2wcg n TYR 244 Cb 0.13 -2.61 0.17 0.00 -0.63 0.00 0.00 39.34 36.39 2wcg n TYR 244 CO 0.00 0.00 0.00 -1.00 0.22 0.00 0.00 176.86 176.08 2wcg h PRO 245 N 7.18 0.00 0.00 2.98 0.13 -1.92 0.42 132.00 140.79 2wcg h PRO 245 Ca -0.46 0.00 -0.15 0.00 -0.87 0.00 0.00 66.00 64.53 2wcg h PRO 245 Cb 1.25 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.35 2wcg h PRO 245 CO 0.92 0.00 -0.12 1.97 -0.23 0.00 0.00 178.00 180.54 2wcg n PHE 246 N -3.08 0.08 -1.63 1.56 1.16 -1.26 -4.83 117.46 109.47 2wcg n PHE 246 Ca 0.04 -0.66 -0.48 0.00 -1.87 0.00 0.00 57.45 54.48 2wcg n PHE 246 Cb 0.53 -0.02 -0.04 0.00 -1.61 0.00 0.00 39.48 38.34 2wcg n PHE 246 CO 0.00 0.00 0.00 1.04 -1.87 0.00 0.00 176.76 175.93 2wcg n GLN 247 N -0.25 1.60 -3.80 3.97 3.00 -1.26 -4.32 117.38 116.33 2wcg n GLN 247 Ca -0.02 0.58 -0.04 0.00 -0.01 0.00 0.00 57.00 57.50 2wcg n GLN 247 Cb 0.16 -2.21 -0.00 0.00 0.00 0.00 0.00 30.24 28.18 2wcg n GLN 247 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 2wcg s LEU 249 N -3.08 -1.13 0.11 0.00 2.96 -1.19 -4.42 118.68 111.93 2wcg s LEU 249 Ca 0.15 0.52 -0.27 0.00 -0.22 0.00 0.00 54.13 54.31 2wcg s LEU 249 Cb -0.02 1.88 -0.06 0.00 0.50 0.00 0.00 46.19 48.48 2wcg s LEU 249 CO 0.04 -0.21 0.85 -0.83 -1.32 0.00 0.00 176.35 174.89 2wcg s GLY 250 N 2.88 2.93 -0.04 7.98 0.00 -0.10 -4.50 107.32 116.48 2wcg s GLY 250 Ca 0.14 0.44 0.01 0.00 0.00 0.00 0.00 44.72 45.31 2wcg s GLY 250 CO -0.20 1.18 -0.02 -1.36 0.00 0.00 0.00 173.10 172.70 2wcg s PHE 251 N -0.39 0.51 0.94 1.90 0.40 -0.67 -4.54 117.98 116.12 2wcg s PHE 251 Ca 0.41 -0.09 -0.12 0.00 -0.60 0.00 0.00 56.93 56.53 2wcg s PHE 251 Cb -0.23 -0.52 0.15 0.00 0.51 0.00 0.00 43.02 42.94 2wcg s PHE 251 CO 0.27 -0.15 1.11 0.95 0.70 0.00 0.00 175.22 178.10 2wcg s THR 252 N 0.95 2.18 0.40 0.64 -4.23 -1.26 -4.32 115.64 110.00 2wcg s THR 252 Ca -0.11 0.06 0.08 0.00 -1.18 0.00 0.00 61.69 60.54 2wcg s THR 252 Cb -0.14 -2.68 0.23 0.00 1.34 0.00 0.00 72.50 71.25 2wcg s THR 252 CO -0.01 -0.08 2.01 1.55 -0.54 0.00 0.00 174.62 177.56 2wcg h PRO 253 N -1.63 0.44 -0.40 3.99 0.13 -1.99 -0.97 132.00 131.57 2wcg h PRO 253 Ca -0.52 -0.05 -0.11 0.00 -0.87 0.00 0.00 66.00 64.46 2wcg h PRO 253 Cb 1.32 -0.09 -0.01 0.00 0.13 0.00 0.00 31.00 32.35 2wcg h PRO 253 CO 0.59 0.36 -0.17 0.93 -0.23 0.00 0.00 178.00 179.48 2wcg h GLU 254 N 0.44 0.82 -0.19 0.86 3.07 -1.93 0.98 114.58 118.63 2wcg h GLU 254 Ca 0.11 -0.35 -0.02 0.00 -0.50 0.00 0.00 59.36 58.60 2wcg h GLU 254 Cb 0.08 -0.03 -0.01 0.00 -0.84 0.00 0.00 28.75 27.95 2wcg h GLU 254 CO -0.01 0.98 0.04 1.25 -1.40 0.00 0.00 179.01 179.86 2wcg h HIS 255 N 0.63 0.33 -0.43 4.33 2.76 -1.81 -0.67 115.15 120.29 2wcg h HIS 255 Ca 0.09 -0.04 0.01 0.00 -2.20 0.00 0.00 60.37 58.23 2wcg h HIS 255 Cb 0.72 -0.09 -0.03 0.00 1.55 0.00 0.00 27.41 29.56 2wcg h HIS 255 CO 0.06 0.45 0.27 0.37 -1.30 0.00 0.00 177.93 177.78 2wcg h GLN 256 N 0.12 0.52 -0.36 5.26 4.15 -1.09 -1.07 115.11 122.65 2wcg h GLN 256 Ca 0.06 -0.03 0.08 0.00 0.77 0.00 0.00 58.65 59.53 2wcg h GLN 256 Cb 0.30 -0.12 -0.08 0.00 0.21 0.00 0.00 27.48 27.78 2wcg h GLN 256 CO 0.00 0.35 -0.23 -0.09 -1.93 0.00 0.00 178.83 176.93 2wcg h ARG 257 N 0.54 -0.17 -0.10 1.69 2.43 -0.64 -0.65 114.38 117.49 2wcg h ARG 257 Ca 0.17 0.01 -0.11 0.00 -0.81 0.00 0.00 59.98 59.23 2wcg h ARG 257 Cb -0.02 0.04 -0.01 0.00 -0.42 0.00 0.00 29.97 29.56 2wcg h ARG 257 CO -0.06 -0.11 -0.45 -0.44 -1.51 0.00 0.00 179.97 177.39 2wcg h ASP 258 N -0.18 0.24 -0.21 -3.80 3.32 -0.96 -1.88 116.42 112.95 2wcg h ASP 258 Ca 0.18 -0.11 -0.09 0.00 0.02 0.00 0.00 57.03 57.03 2wcg h ASP 258 Cb 0.45 -0.07 -0.00 0.00 0.22 0.00 0.00 39.33 39.93 2wcg h ASP 258 CO -0.46 0.66 -0.21 0.15 -1.72 0.00 0.00 179.24 177.66 2wcg h PHE 259 N 0.19 0.62 -0.46 4.55 3.57 -1.06 -0.64 116.94 123.70 2wcg h PHE 259 Ca 0.01 -0.19 -0.01 0.00 3.53 0.00 0.00 57.97 61.31 2wcg h PHE 259 Cb 0.87 -0.13 -0.02 0.00 2.79 0.00 0.00 35.95 39.46 2wcg h PHE 259 CO 0.01 0.86 0.23 0.82 -2.23 0.00 0.00 178.31 178.01 2wcg h ILE 260 N 0.19 1.18 -0.31 1.41 2.04 -1.05 0.65 117.51 121.62 2wcg h ILE 260 Ca 0.03 -0.49 -0.06 0.00 1.00 0.00 0.00 64.86 65.34 2wcg h ILE 260 Cb 0.76 0.66 -0.01 0.00 -0.74 0.00 0.00 36.82 37.48 2wcg h ILE 260 CO 0.05 0.19 -0.05 0.00 0.00 0.00 0.00 178.15 178.35 2wcg h ALA 261 N 1.08 0.42 0.04 1.87 0.00 -1.27 0.17 119.26 121.57 2wcg h ALA 261 Ca 0.16 -0.27 -0.34 0.00 0.00 0.00 0.00 54.91 54.46 2wcg h ALA 261 Cb 0.10 -0.11 -0.05 0.00 0.00 0.00 0.00 17.79 17.73 2wcg h ALA 261 CO -0.02 0.22 -2.04 0.54 0.00 0.00 0.00 179.25 177.95 2wcg n ARG 262 N -4.50 0.69 0.03 0.00 1.74 -0.26 -4.60 116.66 109.76 2wcg n ARG 262 Ca -0.03 0.21 -0.00 0.00 -0.77 0.00 0.00 57.85 57.26 2wcg n ARG 262 Cb 0.30 -1.68 -0.00 0.00 -1.02 0.00 0.00 32.46 30.06 2wcg n ARG 262 CO 0.00 0.00 0.00 -0.25 -1.52 0.00 0.00 177.63 175.86 2wcg n ASP 263 N -3.17 0.80 -0.03 0.55 8.00 -0.57 -4.73 116.55 117.39 2wcg n ASP 263 Ca -0.29 0.10 -0.15 0.00 0.71 0.00 0.00 54.79 55.16 2wcg n ASP 263 Cb 1.06 -0.26 -0.08 0.00 -0.02 0.00 0.00 41.12 41.82 2wcg n ASP 263 CO 0.00 0.00 0.00 0.25 -0.39 0.00 0.00 177.20 177.06 2wcg h LEU 264 N -0.04 0.56 0.50 0.64 5.85 -0.99 -1.50 115.31 120.33 2wcg h LEU 264 Ca 0.00 -0.62 -0.02 0.00 0.84 0.00 0.00 57.88 58.07 2wcg h LEU 264 Cb 0.04 -0.16 0.00 0.00 0.37 0.00 0.00 40.66 40.91 2wcg h LEU 264 CO 0.00 1.09 -0.24 1.23 -0.34 0.00 0.00 178.44 180.18 2wcg h GLY 265 N 0.06 -0.70 1.06 3.75 0.00 -0.85 -2.20 103.07 104.19 2wcg h GLY 265 Ca -0.02 0.26 0.04 0.00 0.00 0.00 0.00 47.33 47.61 2wcg h GLY 265 CO 0.09 -0.25 0.52 -2.55 0.00 0.00 0.00 176.54 174.34 2wcg h PRO 266 N -0.68 0.90 -0.28 4.80 0.11 -1.73 -0.32 132.00 134.81 2wcg h PRO 266 Ca -0.07 -0.05 -0.10 0.00 0.11 0.00 0.00 66.00 65.89 2wcg h PRO 266 Cb 0.52 -0.20 -0.01 0.00 0.11 0.00 0.00 31.00 31.42 2wcg h PRO 266 CO 0.11 0.60 -0.22 1.15 -0.21 0.00 0.00 178.00 179.43 2wcg h THR 267 N 0.93 1.30 -0.32 -1.15 2.02 -1.22 -1.33 112.91 113.15 2wcg h THR 267 Ca 0.32 -1.36 -0.11 0.00 0.77 0.00 0.00 66.41 66.03 2wcg h THR 267 Cb 0.11 1.58 -0.01 0.00 -1.74 0.00 0.00 68.15 68.09 2wcg h THR 267 CO -0.10 0.43 -0.23 -0.07 0.37 0.00 0.00 175.52 175.92 2wcg h LEU 268 N 0.37 0.76 -1.72 2.58 3.38 -1.14 -3.09 115.31 116.44 2wcg h LEU 268 Ca 0.05 -0.44 -0.04 0.00 0.09 0.00 0.00 57.88 57.55 2wcg h LEU 268 Cb 0.77 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 41.30 2wcg h LEU 268 CO 0.06 1.04 -0.17 0.00 0.09 0.00 0.00 178.44 179.46 2wcg h ALA 269 N 0.75 1.57 -0.33 1.53 0.00 -0.99 -2.31 119.26 119.48 2wcg h ALA 269 Ca 0.06 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 54.82 2wcg h ALA 269 Cb 0.78 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.55 2wcg h ALA 269 CO 0.06 0.21 0.00 -1.71 0.00 0.00 0.00 179.25 177.81 2wcg n ASN 270 N -4.12 2.25 -4.77 0.00 5.15 -0.51 -4.69 115.26 108.57 2wcg n ASN 270 Ca -0.02 -2.12 -0.27 0.00 -0.60 0.00 0.00 54.58 51.57 2wcg n ASN 270 Cb 0.24 -0.33 -0.06 0.00 -0.53 0.00 0.00 39.78 39.10 2wcg n ASN 270 CO 0.00 0.00 0.00 -0.94 1.40 0.00 0.00 177.26 177.72 2wcg s SER 271 N -0.83 4.36 0.16 1.20 1.04 -0.88 -4.99 113.70 113.77 2wcg s SER 271 Ca 0.24 -1.28 0.17 0.00 0.48 0.00 0.00 55.95 55.57 2wcg s SER 271 Cb 0.14 -0.03 0.78 0.00 0.10 0.00 0.00 66.02 67.02 2wcg s SER 271 CO 0.14 -0.74 1.54 0.35 0.98 0.00 0.00 173.24 175.50 2wcg n THR 272 N -1.35 1.07 -1.01 2.02 -2.24 -1.26 -2.41 114.28 109.10 2wcg n THR 272 Ca -0.06 0.36 -0.01 0.00 -2.27 0.00 0.00 64.05 62.08 2wcg n THR 272 Cb 0.65 -1.26 0.34 0.00 -2.10 0.00 0.00 70.33 67.96 2wcg n THR 272 CO 0.00 0.00 0.00 1.41 -0.57 0.00 0.00 175.07 175.91 2wcg n HIS 273 N -1.93 2.23 0.33 4.78 8.25 -1.26 -4.64 115.22 122.97 2wcg n HIS 273 Ca 0.02 -1.03 0.21 0.00 -0.26 0.00 0.00 57.72 56.65 2wcg n HIS 273 Cb 0.15 -0.61 1.11 0.00 1.12 0.00 0.00 29.99 31.76 2wcg n HIS 273 CO 0.00 0.00 0.00 1.12 0.64 0.00 0.00 176.34 178.10 2wcg h HIS 274 N 3.07 0.00 0.00 4.41 -0.00 -1.41 -2.00 115.15 119.21 2wcg h HIS 274 Ca 0.16 0.00 0.00 0.00 -0.00 0.00 0.00 60.37 60.53 2wcg h HIS 274 Cb 2.16 0.00 0.00 0.00 -0.00 0.00 0.00 27.41 29.57 2wcg h HIS 274 CO 1.18 0.00 -0.17 0.09 -0.00 0.00 0.00 177.93 179.03 2wcg n ASN 275 N -3.00 0.37 -4.73 3.10 3.02 -1.26 -4.80 115.26 107.96 2wcg n ASN 275 Ca -0.03 0.33 -0.42 0.00 -0.03 0.00 0.00 54.58 54.43 2wcg n ASN 275 Cb 0.14 -0.35 -0.03 0.00 -0.61 0.00 0.00 39.78 38.94 2wcg n ASN 275 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 2wcg s VAL 276 N -3.04 2.04 0.39 2.41 1.01 -0.75 -4.99 120.40 117.46 2wcg s VAL 276 Ca 0.12 0.03 -0.23 0.00 0.00 0.00 0.00 61.98 61.90 2wcg s VAL 276 Cb 0.16 -3.02 -0.11 0.00 0.00 0.00 0.00 36.38 33.42 2wcg s VAL 276 CO 0.60 0.00 0.95 -0.13 0.00 0.00 0.00 175.10 176.52 2wcg s ARG 277 N 0.85 4.35 -0.21 2.72 1.81 -0.56 -4.89 118.95 123.02 2wcg s ARG 277 Ca 0.72 1.19 -0.06 0.00 -1.72 0.00 0.00 55.73 55.87 2wcg s ARG 277 Cb -0.49 -2.40 -0.02 0.00 -0.45 0.00 0.00 34.95 31.58 2wcg s ARG 277 CO 0.35 0.08 0.01 -1.17 -0.68 0.00 0.00 175.30 173.89 2wcg s LEU 278 N -2.78 3.30 -0.18 2.53 2.96 -1.26 -0.79 118.68 122.45 2wcg s LEU 278 Ca 0.58 -0.20 -0.08 0.00 -0.22 0.00 0.00 54.13 54.21 2wcg s LEU 278 Cb -0.12 -1.85 -0.04 0.00 0.50 0.00 0.00 46.19 44.67 2wcg s LEU 278 CO 0.17 0.04 0.09 -0.76 -1.32 0.00 0.00 176.35 174.58 2wcg s LEU 279 N 1.12 4.00 0.67 -0.68 1.43 0.07 -0.74 118.68 124.55 2wcg s LEU 279 Ca 0.03 0.16 -0.03 0.00 -1.03 0.00 0.00 54.13 53.27 2wcg s LEU 279 Cb -0.14 -2.02 0.08 0.00 0.03 0.00 0.00 46.19 44.14 2wcg s LEU 279 CO 0.02 0.19 0.95 0.00 0.23 0.00 0.00 176.35 177.74 2wcg s MET 280 N 0.26 2.03 0.45 1.70 0.23 0.05 -1.85 119.30 122.18 2wcg s MET 280 Ca 0.06 -0.74 0.00 0.00 -1.03 0.00 0.00 55.69 53.98 2wcg s MET 280 Cb -0.12 -2.31 0.00 0.00 -1.53 0.00 0.00 34.83 30.87 2wcg s MET 280 CO -0.01 -1.21 0.00 -0.11 -2.03 0.00 0.00 175.02 171.66 2wcg n LEU 281 N -2.75 0.00 -3.78 0.18 7.94 -1.26 -0.66 117.00 116.66 2wcg n LEU 281 Ca 0.11 0.00 -0.23 0.00 -1.11 0.00 0.00 56.01 54.77 2wcg n LEU 281 Cb 0.60 0.00 0.02 0.00 0.53 0.00 0.00 43.42 44.57 2wcg n LEU 281 CO 0.46 0.00 -0.07 -0.67 -1.11 0.00 0.00 177.39 176.00 2wcg n ASP 282 N 4.46 -1.55 -2.42 1.96 2.03 0.14 -4.32 116.55 116.85 2wcg n ASP 282 Ca 0.00 -0.85 -0.09 0.00 0.52 0.00 0.00 54.79 54.38 2wcg n ASP 282 Cb 0.00 -3.85 0.00 0.00 -0.72 0.00 0.00 41.12 36.56 2wcg n ASP 282 CO 0.00 0.00 0.00 -0.67 -1.92 0.00 0.00 177.20 174.61 2wcg n ASP 283 N -3.01 -1.47 -4.74 1.67 -0.08 -1.16 -0.15 116.55 107.61 2wcg n ASP 283 Ca -0.25 -2.30 -0.42 0.00 -1.51 0.00 0.00 54.79 50.31 2wcg n ASP 283 Cb 0.66 2.53 -0.01 0.00 2.34 0.00 0.00 41.12 46.64 2wcg n ASP 283 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 2wcg n GLN 284 N -0.42 2.56 0.19 -0.67 1.13 -1.26 -0.82 117.38 118.09 2wcg n GLN 284 Ca -0.04 0.91 0.14 0.00 -1.94 0.00 0.00 57.00 56.07 2wcg n GLN 284 Cb 0.45 -2.64 0.58 0.00 0.11 0.00 0.00 30.24 28.75 2wcg n GLN 284 CO 0.00 0.00 0.00 0.07 -1.44 0.00 0.00 177.06 175.69 2wcg h ARG 285 N 3.94 0.00 -0.10 -1.09 0.11 -1.91 -2.17 114.38 113.17 2wcg h ARG 285 Ca -0.48 0.00 0.03 0.00 0.10 0.00 0.00 59.98 59.63 2wcg h ARG 285 Cb 1.24 0.00 -0.00 0.00 1.11 0.00 0.00 29.97 32.32 2wcg h ARG 285 CO 0.73 0.00 0.28 1.37 0.10 0.00 0.00 179.97 182.45 2wcg h LEU 286 N 0.00 0.00 -0.18 0.08 8.10 -1.91 0.04 115.31 121.44 2wcg h LEU 286 Ca 0.00 0.00 0.00 0.00 0.11 0.00 0.00 57.88 57.99 2wcg h LEU 286 Cb 0.41 0.00 0.00 0.00 -0.44 0.00 0.00 40.66 40.63 2wcg h LEU 286 CO 0.00 0.00 0.00 0.18 -4.11 0.00 0.00 178.44 174.51 2wcg n LEU 287 N -3.20 0.30 -4.88 0.17 4.77 -0.81 -4.70 117.00 108.65 2wcg n LEU 287 Ca -0.00 0.55 -0.33 0.00 -0.03 0.00 0.00 56.01 56.20 2wcg n LEU 287 Cb 0.36 -0.49 -0.05 0.00 -2.33 0.00 0.00 43.42 40.91 2wcg n LEU 287 CO 0.19 -0.26 0.00 -0.76 -1.33 0.00 0.00 177.39 175.23 2wcg s LEU 288 N -3.62 4.33 0.00 2.23 1.43 -0.00 -1.16 118.68 121.89 2wcg s LEU 288 Ca 0.08 0.62 0.28 0.00 -1.03 0.00 0.00 54.13 54.09 2wcg s LEU 288 Cb 0.12 -2.97 1.07 0.00 0.03 0.00 0.00 46.19 44.44 2wcg s LEU 288 CO 0.41 0.16 1.76 -0.81 0.23 0.00 0.00 176.35 178.10 2wcg n PRO 289 N 0.70 1.50 -0.10 1.29 -0.04 -1.26 -4.50 135.00 132.59 2wcg n PRO 289 Ca -0.07 -0.83 -0.06 0.00 -0.04 0.00 0.00 63.50 62.50 2wcg n PRO 289 Cb 0.52 -1.48 0.01 0.00 -0.04 0.00 0.00 33.50 32.51 2wcg n PRO 289 CO 0.00 0.00 0.00 1.25 -0.04 0.00 0.00 175.50 176.71 2wcg h HIS 290 N 2.03 -0.41 -0.76 0.54 2.76 -1.85 -1.44 115.15 116.02 2wcg h HIS 290 Ca 0.00 0.04 -0.06 0.00 -2.20 0.00 0.00 60.37 58.15 2wcg h HIS 290 Cb 0.47 0.24 -0.03 0.00 1.55 0.00 0.00 27.41 29.63 2wcg h HIS 290 CO 0.00 -0.25 0.26 -1.49 -1.30 0.00 0.00 177.93 175.15 2wcg h TRP 291 N -0.10 1.19 -0.72 5.26 4.06 -1.50 -1.16 115.95 122.97 2wcg h TRP 291 Ca 0.18 -0.11 -0.01 0.00 2.06 0.00 0.00 58.89 61.01 2wcg h TRP 291 Cb 0.38 -0.35 -0.03 0.00 -1.00 0.00 0.00 29.16 28.16 2wcg h TRP 291 CO -0.40 0.93 0.41 0.00 -3.56 0.00 0.00 178.44 175.82 2wcg h ALA 292 N 1.15 0.93 -0.37 1.49 0.00 -1.62 -1.20 119.26 119.64 2wcg h ALA 292 Ca 0.25 -0.10 -0.03 0.00 0.00 0.00 0.00 54.91 55.02 2wcg h ALA 292 Cb 0.28 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 17.76 2wcg h ALA 292 CO -0.01 0.42 0.11 0.87 0.00 0.00 0.00 179.25 180.64 2wcg h LYS 293 N 0.99 0.58 -0.13 0.00 1.57 -0.94 0.31 116.57 118.96 2wcg h LYS 293 Ca 0.26 -0.13 -0.00 0.00 -1.87 0.00 0.00 60.65 58.91 2wcg h LYS 293 Cb 0.01 -0.08 -0.01 0.00 0.08 0.00 0.00 32.23 32.23 2wcg h LYS 293 CO -0.04 0.60 0.08 0.28 -0.57 0.00 0.00 179.45 179.79 2wcg h VAL 294 N 0.46 1.06 0.01 0.50 2.07 -1.13 -2.91 116.25 116.30 2wcg h VAL 294 Ca 0.12 -0.14 -0.09 0.00 0.82 0.00 0.00 66.70 67.41 2wcg h VAL 294 Cb 0.26 0.92 0.01 0.00 -1.52 0.00 0.00 31.29 30.96 2wcg h VAL 294 CO -0.00 0.05 -0.37 0.58 0.02 0.00 0.00 177.57 177.85 2wcg h VAL 295 N 0.14 1.53 0.00 2.57 2.07 -1.11 -3.37 116.25 118.08 2wcg h VAL 295 Ca 0.05 -2.05 0.00 0.00 0.82 0.00 0.00 66.70 65.51 2wcg h VAL 295 Cb 0.02 2.80 0.00 0.00 -1.52 0.00 0.00 31.29 32.59 2wcg h VAL 295 CO -0.01 0.57 -0.22 -0.07 0.02 0.00 0.00 177.57 177.86 2wcg h LEU 296 N -0.42 0.00 -0.03 2.57 3.38 -0.49 -2.99 115.31 117.33 2wcg h LEU 296 Ca -0.05 -0.06 0.00 0.00 0.09 0.00 0.00 57.88 57.86 2wcg h LEU 296 Cb 1.14 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.89 2wcg h LEU 296 CO 0.07 0.03 -0.09 0.35 0.09 0.00 0.00 178.44 178.90 2wcg n THR 297 N -2.34 0.00 -3.07 0.22 -2.24 -1.10 -4.58 114.28 101.18 2wcg n THR 297 Ca 0.04 -0.01 -0.42 0.00 -2.27 0.00 0.00 64.05 61.40 2wcg n THR 297 Cb 0.45 -0.34 -0.06 0.00 -2.10 0.00 0.00 70.33 68.28 2wcg n THR 297 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 2wcg s ASP 298 N -2.83 6.44 0.54 3.42 -1.08 -1.13 -4.94 116.67 117.07 2wcg s ASP 298 Ca 0.19 0.10 0.32 0.00 -0.52 0.00 0.00 52.55 52.63 2wcg s ASP 298 Cb 0.19 -2.35 1.39 0.00 -1.46 0.00 0.00 42.92 40.70 2wcg s ASP 298 CO 0.53 -0.68 2.00 1.55 0.52 0.00 0.00 175.17 179.09 2wcg h PRO 299 N 8.57 0.00 -0.59 4.34 0.13 -1.86 -0.41 132.00 142.18 2wcg h PRO 299 Ca -0.26 0.00 -0.10 0.00 -0.87 0.00 0.00 66.00 64.77 2wcg h PRO 299 Cb 1.10 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.21 2wcg h PRO 299 CO 0.87 0.07 -0.02 0.93 -0.23 0.00 0.00 178.00 179.61 2wcg h GLU 300 N 0.00 1.06 0.05 0.86 3.07 -1.94 -2.75 114.58 114.93 2wcg h GLU 300 Ca -0.00 -0.35 -0.00 0.00 -0.50 0.00 0.00 59.36 58.51 2wcg h GLU 300 Cb 0.49 -0.09 0.00 0.00 -0.84 0.00 0.00 28.75 28.31 2wcg h GLU 300 CO 0.01 1.05 -0.02 0.00 -1.40 0.00 0.00 179.01 178.64 2wcg h ALA 301 N 1.00 -0.06 -0.96 3.43 0.00 -1.66 -3.36 119.26 117.65 2wcg h ALA 301 Ca 0.17 -0.30 0.23 0.00 0.00 0.00 0.00 54.91 55.00 2wcg h ALA 301 Cb 0.58 0.02 -0.08 0.00 0.00 0.00 0.00 17.79 18.32 2wcg h ALA 301 CO 0.03 -0.20 0.63 0.00 0.00 0.00 0.00 179.25 179.71 2wcg h ALA 302 N 0.13 2.21 0.00 0.00 0.00 -1.19 -1.12 119.26 119.29 2wcg h ALA 302 Ca -0.01 0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.94 2wcg h ALA 302 Cb 0.62 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.40 2wcg h ALA 302 CO 0.01 -0.54 0.00 0.36 0.00 0.00 0.00 179.25 179.08 2wcg n LYS 303 N -4.55 0.13 0.00 0.00 2.85 -1.04 -2.48 118.16 113.08 2wcg n LYS 303 Ca 0.22 0.43 0.09 0.00 -1.05 0.00 0.00 58.31 58.00 2wcg n LYS 303 Cb 0.77 -1.79 -0.10 0.00 -0.65 0.00 0.00 35.03 33.26 2wcg n LYS 303 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 177.40 178.01 2wcg n TYR 304 N -2.04 0.00 -3.53 5.58 4.02 -0.43 -4.96 117.16 115.80 2wcg n TYR 304 Ca 0.02 0.00 -0.40 0.00 -0.01 0.00 0.00 57.90 57.50 2wcg n TYR 304 Cb 0.17 0.00 -0.11 0.00 -0.02 0.00 0.00 39.34 39.38 2wcg n TYR 304 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 176.86 175.93 2wcg s VAL 305 N -2.78 5.27 0.03 -0.72 1.01 -1.03 -4.31 120.40 117.85 2wcg s VAL 305 Ca 0.08 -0.24 0.01 0.00 0.00 0.00 0.00 61.98 61.84 2wcg s VAL 305 Cb 0.15 -3.71 -0.26 0.00 0.00 0.00 0.00 36.38 32.56 2wcg s VAL 305 CO 0.77 -0.02 0.93 -0.74 0.00 0.00 0.00 175.10 176.05 2wcg h HIS 306 N 8.49 0.29 -2.11 5.22 2.76 -1.26 -3.49 115.15 125.06 2wcg h HIS 306 Ca -0.31 -0.21 0.08 0.00 -2.20 0.00 0.00 60.37 57.72 2wcg h HIS 306 Cb 1.16 -0.01 -0.01 0.00 1.55 0.00 0.00 27.41 30.09 2wcg h HIS 306 CO 0.66 1.24 0.31 0.41 -1.30 0.00 0.00 177.93 179.25 2wcg n GLY 307 N 1.58 0.95 3.06 5.26 0.00 -1.16 -3.26 105.19 111.61 2wcg n GLY 307 Ca -0.13 -1.05 -0.30 0.00 0.00 0.00 0.00 46.02 44.55 2wcg n GLY 307 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2wcg s ILE 308 N -2.31 1.63 -0.04 -0.61 1.01 0.00 -0.77 121.20 120.11 2wcg s ILE 308 Ca 0.12 -0.69 -0.12 0.00 0.00 0.00 0.00 60.65 59.95 2wcg s ILE 308 Cb -0.02 -1.50 -0.05 0.00 0.01 0.00 0.00 42.46 40.91 2wcg s ILE 308 CO 0.03 0.47 0.32 0.00 0.00 0.00 0.00 174.94 175.76 2wcg s ALA 309 N 1.21 3.75 0.08 9.38 0.00 0.16 -0.93 121.76 135.41 2wcg s ALA 309 Ca -0.01 -0.36 0.05 0.00 0.00 0.00 0.00 51.96 51.65 2wcg s ALA 309 Cb -0.14 -2.26 -0.03 0.00 0.00 0.00 0.00 23.12 20.69 2wcg s ALA 309 CO -0.06 0.52 -0.15 0.14 0.00 0.00 0.00 175.76 176.21 2wcg s VAL 310 N -1.03 1.18 0.20 0.00 -7.23 0.30 -0.69 120.40 113.13 2wcg s VAL 310 Ca 0.21 -1.39 0.08 0.00 -1.81 0.00 0.00 61.98 59.07 2wcg s VAL 310 Cb -0.15 -1.18 -0.04 0.00 0.56 0.00 0.00 36.38 35.57 2wcg s VAL 310 CO 0.10 -0.25 0.01 -1.00 -0.31 0.00 0.00 175.10 173.66 2wcg s HIS 311 N -1.41 2.83 -2.47 2.82 3.76 0.00 -0.82 115.29 119.99 2wcg s HIS 311 Ca 0.00 -0.16 0.25 0.00 -0.15 0.00 0.00 55.06 55.01 2wcg s HIS 311 Cb -0.09 -1.34 0.41 0.00 1.11 0.00 0.00 32.58 32.67 2wcg s HIS 311 CO 0.02 0.54 1.37 -2.67 -0.85 0.00 0.00 174.74 173.15 2wcg n TRP 312 N -0.35 0.00 -0.04 1.40 4.27 -1.11 -3.56 117.44 118.05 2wcg n TRP 312 Ca -0.09 0.00 -0.03 0.00 -3.89 0.00 0.00 57.50 53.49 2wcg n TRP 312 Cb 0.56 -0.02 0.20 0.00 -1.36 0.00 0.00 31.31 30.69 2wcg n TRP 312 CO 0.00 0.00 0.00 1.88 -2.29 0.00 0.00 177.69 177.28 2wcg h TYR 313 N 3.12 0.68 -0.58 -2.67 -1.99 -1.95 -1.70 116.97 111.88 2wcg h TYR 313 Ca 0.00 -0.11 -0.30 0.00 2.00 0.00 0.00 58.73 60.32 2wcg h TYR 313 Cb 0.76 -0.18 -0.18 0.00 2.00 0.00 0.00 36.73 39.13 2wcg h TYR 313 CO 0.00 0.71 0.18 1.28 -0.00 0.00 0.00 178.16 180.33 2wcg n LEU 314 N -4.19 5.08 0.20 3.88 4.77 -1.26 -4.74 117.00 120.75 2wcg n LEU 314 Ca 0.01 -3.70 0.08 0.00 -0.03 0.00 0.00 56.01 52.38 2wcg n LEU 314 Cb 0.34 -0.71 0.61 0.00 -2.33 0.00 0.00 43.42 41.33 2wcg n LEU 314 CO 0.41 1.17 1.09 0.44 -1.33 0.00 0.00 177.39 179.18 2wcg h ASP 315 N 1.06 0.07 0.10 -1.43 3.32 -1.62 -2.10 116.42 115.83 2wcg h ASP 315 Ca 0.36 -0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.41 2wcg h ASP 315 Cb 2.09 -0.02 0.00 0.00 0.22 0.00 0.00 39.33 41.63 2wcg h ASP 315 CO 0.64 0.05 0.00 2.19 -1.72 0.00 0.00 179.24 180.40 2wcg h PHE 316 N 0.08 0.00 -0.01 4.55 -5.15 -1.85 0.18 116.94 114.75 2wcg h PHE 316 Ca 0.04 0.00 0.00 0.00 -0.20 0.00 0.00 57.97 57.81 2wcg h PHE 316 Cb 0.07 0.00 0.00 0.00 0.22 0.00 0.00 35.95 36.24 2wcg h PHE 316 CO -0.00 0.00 -0.50 1.28 -2.00 0.00 0.00 178.31 177.09 2wcg n LEU 317 N -2.86 1.28 -3.67 2.10 4.77 -0.79 -4.85 117.00 112.98 2wcg n LEU 317 Ca -0.02 -0.43 -0.30 0.00 -0.03 0.00 0.00 56.01 55.23 2wcg n LEU 317 Cb 0.08 -0.08 -0.14 0.00 -2.33 0.00 0.00 43.42 40.96 2wcg n LEU 317 CO 0.18 0.26 -0.29 0.00 -1.33 0.00 0.00 177.39 176.20 2wcg s ALA 318 N -2.66 1.66 0.22 -1.18 0.00 0.63 -4.94 121.76 115.49 2wcg s ALA 318 Ca 0.17 -2.09 -0.30 0.00 0.00 0.00 0.00 51.96 49.74 2wcg s ALA 318 Cb 0.18 -1.73 -0.10 0.00 0.00 0.00 0.00 23.12 21.47 2wcg s ALA 318 CO 0.63 -1.92 1.48 -1.25 0.00 0.00 0.00 175.76 174.70 2wcg s PRO 319 N 0.99 4.25 0.32 0.00 0.04 -1.26 -4.87 135.00 134.47 2wcg s PRO 319 Ca 0.15 2.32 0.00 0.00 0.04 0.00 0.00 61.00 63.51 2wcg s PRO 319 Cb -0.21 -3.12 0.54 0.00 0.04 0.00 0.00 34.50 31.75 2wcg s PRO 319 CO -0.10 -0.48 1.98 0.00 0.04 0.00 0.00 177.00 178.44 2wcg h ALA 320 N 5.57 1.46 -0.56 8.56 0.00 -1.98 -1.47 119.26 130.85 2wcg h ALA 320 Ca -0.45 -0.07 0.05 0.00 0.00 0.00 0.00 54.91 54.45 2wcg h ALA 320 Cb 1.21 -0.28 -0.05 0.00 0.00 0.00 0.00 17.79 18.67 2wcg h ALA 320 CO 0.82 0.48 0.29 -0.22 0.00 0.00 0.00 179.25 180.61 2wcg h LYS 321 N 0.94 0.53 0.00 0.00 3.64 -1.94 0.20 116.57 119.94 2wcg h LYS 321 Ca 0.25 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.60 2wcg h LYS 321 Cb -0.07 -0.12 0.00 0.00 -0.41 0.00 0.00 32.23 31.63 2wcg h LYS 321 CO -0.05 0.35 0.00 0.00 -2.27 0.00 0.00 179.45 177.48 2wcg h ALA 322 N 1.31 1.00 -1.03 5.00 0.00 -1.65 -1.97 119.26 121.93 2wcg h ALA 322 Ca 0.25 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.16 2wcg h ALA 322 Cb 0.16 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.95 2wcg h ALA 322 CO -0.17 0.00 0.00 0.25 0.00 0.00 0.00 179.25 179.33 2wcg n THR 323 N -2.99 0.00 0.10 0.00 -2.24 -1.13 -4.44 114.28 103.58 2wcg n THR 323 Ca 0.02 0.04 -0.13 0.00 -2.27 0.00 0.00 64.05 61.71 2wcg n THR 323 Cb 0.36 -0.90 -0.08 0.00 -2.10 0.00 0.00 70.33 67.62 2wcg n THR 323 CO 0.00 0.00 0.00 -0.07 -0.57 0.00 0.00 175.07 174.43 2wcg h LEU 324 N 0.00 -0.15 -0.45 3.22 3.38 -1.24 -1.62 115.31 118.46 2wcg h LEU 324 Ca 0.00 -0.05 0.03 0.00 0.09 0.00 0.00 57.88 57.94 2wcg h LEU 324 Cb 0.00 0.04 -0.03 0.00 0.09 0.00 0.00 40.66 40.75 2wcg h LEU 324 CO 0.00 -0.04 0.24 1.23 0.09 0.00 0.00 178.44 179.96 2wcg h GLY 325 N -0.24 0.62 1.81 0.83 0.00 -0.72 -1.70 103.07 103.67 2wcg h GLY 325 Ca -0.02 -0.18 -0.12 0.00 0.00 0.00 0.00 47.33 47.01 2wcg h GLY 325 CO 0.03 0.14 -0.50 -2.09 0.00 0.00 0.00 176.54 174.12 2wcg h GLU 326 N 0.49 0.21 -0.42 4.80 4.57 -1.37 -1.18 114.58 121.69 2wcg h GLU 326 Ca 0.19 -0.12 -0.14 0.00 -1.18 0.00 0.00 59.36 58.11 2wcg h GLU 326 Cb 0.06 0.01 -0.01 0.00 -0.16 0.00 0.00 28.75 28.64 2wcg h GLU 326 CO -0.11 0.66 -0.28 1.15 -1.18 0.00 0.00 179.01 179.26 2wcg h THR 327 N 0.17 1.27 -0.43 0.32 2.02 -1.14 -2.43 112.91 112.70 2wcg h THR 327 Ca 0.01 -1.44 -0.03 0.00 0.77 0.00 0.00 66.41 65.72 2wcg h THR 327 Cb 0.94 1.24 -0.02 0.00 -1.74 0.00 0.00 68.15 68.58 2wcg h THR 327 CO 0.08 0.48 0.16 -0.74 0.37 0.00 0.00 175.52 175.87 2wcg h HIS 328 N 0.76 0.66 -0.17 3.16 -0.00 -1.05 0.08 115.15 118.59 2wcg h HIS 328 Ca 0.09 -0.06 0.03 0.00 -0.00 0.00 0.00 60.37 60.43 2wcg h HIS 328 Cb 0.84 -0.20 -0.02 0.00 -0.00 0.00 0.00 27.41 28.03 2wcg h HIS 328 CO 0.05 0.59 0.01 -0.09 -0.00 0.00 0.00 177.93 178.48 2wcg h ARG 329 N 0.54 0.06 -0.02 5.26 2.43 -1.14 -1.12 114.38 120.40 2wcg h ARG 329 Ca 0.14 -0.00 -0.14 0.00 -0.81 0.00 0.00 59.98 59.17 2wcg h ARG 329 Cb 0.22 -0.01 -0.02 0.00 -0.42 0.00 0.00 29.97 29.74 2wcg h ARG 329 CO -0.01 0.04 -0.63 -0.07 -1.51 0.00 0.00 179.97 177.79 2wcg h LEU 330 N 0.06 0.08 -5.89 3.80 3.38 -1.39 -3.39 115.31 111.97 2wcg h LEU 330 Ca 0.08 -0.05 -0.50 0.00 0.09 0.00 0.00 57.88 57.50 2wcg h LEU 330 Cb 0.09 -0.02 -0.40 0.00 0.09 0.00 0.00 40.66 40.41 2wcg h LEU 330 CO -0.12 0.69 -1.10 0.49 0.09 0.00 0.00 178.44 178.48 2wcg n PHE 331 N -3.81 0.79 0.29 1.13 3.01 0.01 -4.96 117.46 113.92 2wcg n PHE 331 Ca -0.02 -3.84 0.16 0.00 1.01 0.00 0.00 57.45 54.77 2wcg n PHE 331 Cb 0.63 -0.43 0.93 0.00 -0.01 0.00 0.00 39.48 40.60 2wcg n PHE 331 CO 0.00 0.00 0.00 -1.00 1.01 0.00 0.00 176.76 176.77 2wcg h PRO 332 N 3.05 0.00 -0.31 -1.08 0.13 -1.40 -2.21 132.00 130.17 2wcg h PRO 332 Ca 0.10 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.23 2wcg h PRO 332 Cb 0.89 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.02 2wcg h PRO 332 CO 0.55 0.00 0.00 0.09 -0.23 0.00 0.00 178.00 178.41 2wcg n ASN 333 N -3.77 2.58 -4.26 1.44 3.02 -1.26 -4.76 115.26 108.24 2wcg n ASN 333 Ca -0.02 -1.88 -0.38 0.00 -0.03 0.00 0.00 54.58 52.27 2wcg n ASN 333 Cb 0.11 -0.20 -0.12 0.00 -0.61 0.00 0.00 39.78 38.96 2wcg n ASN 333 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 2wcg s THR 334 N -1.60 3.83 0.46 3.41 2.01 -0.83 -4.98 115.64 117.93 2wcg s THR 334 Ca 0.35 -1.24 -0.24 0.00 0.31 0.00 0.00 61.69 60.87 2wcg s THR 334 Cb 0.20 -3.23 -0.07 0.00 0.01 0.00 0.00 72.50 69.40 2wcg s THR 334 CO 0.28 -0.27 1.29 0.00 -0.69 0.00 0.00 174.62 175.22 2wcg s MET 335 N 1.39 3.68 -0.11 4.92 0.23 -1.20 -4.73 119.30 123.48 2wcg s MET 335 Ca -0.00 2.08 -0.12 0.00 -1.03 0.00 0.00 55.69 56.62 2wcg s MET 335 Cb -0.20 -2.52 -0.05 0.00 -1.53 0.00 0.00 34.83 30.53 2wcg s MET 335 CO 0.02 -0.71 0.28 -0.51 -2.03 0.00 0.00 175.02 172.08 2wcg s LEU 336 N -2.90 4.34 -0.02 0.18 1.43 -1.26 -0.82 118.68 119.63 2wcg s LEU 336 Ca 0.63 0.62 -0.00 0.00 -1.03 0.00 0.00 54.13 54.34 2wcg s LEU 336 Cb -0.36 -2.35 0.03 0.00 0.03 0.00 0.00 46.19 43.53 2wcg s LEU 336 CO 0.45 0.24 0.03 0.12 0.23 0.00 0.00 176.35 177.42 2wcg s PHE 337 N -0.31 0.02 -0.36 0.29 5.36 -0.10 -0.56 117.98 122.32 2wcg s PHE 337 Ca 0.18 0.13 -0.20 0.00 -0.96 0.00 0.00 56.93 56.08 2wcg s PHE 337 Cb -0.14 -0.22 0.00 0.00 -0.34 0.00 0.00 43.02 42.32 2wcg s PHE 337 CO 0.06 -0.09 0.64 0.00 -1.46 0.00 0.00 175.22 174.37 2wcg s ALA 338 N 1.03 3.45 -1.48 11.12 0.00 -0.50 -0.54 121.76 134.85 2wcg s ALA 338 Ca -0.09 -0.85 0.15 0.00 0.00 0.00 0.00 51.96 51.17 2wcg s ALA 338 Cb -0.12 -3.18 0.03 0.00 0.00 0.00 0.00 23.12 19.84 2wcg s ALA 338 CO -0.03 -1.35 0.84 -1.13 0.00 0.00 0.00 175.76 174.10 2wcg n SER 339 N 6.05 1.70 -3.60 0.00 3.41 -0.00 -0.90 113.62 120.28 2wcg n SER 339 Ca -0.01 -1.35 -0.03 0.00 -0.26 0.00 0.00 58.87 57.22 2wcg n SER 339 Cb 0.49 0.36 -0.06 0.00 -0.26 0.00 0.00 64.21 64.73 2wcg n SER 339 CO 0.00 0.00 0.00 -0.70 -0.16 0.00 0.00 175.04 174.18 2wcg s GLU 340 N -1.65 0.47 -0.03 4.33 2.12 -1.21 -4.69 118.70 118.05 2wcg s GLU 340 Ca 0.13 0.91 -0.12 0.00 0.36 0.00 0.00 54.97 56.25 2wcg s GLU 340 Cb 0.12 0.24 0.02 0.00 0.26 0.00 0.00 34.13 34.77 2wcg s GLU 340 CO 0.33 -0.11 0.27 0.00 -0.54 0.00 0.00 175.26 175.20 2wcg s ALA 341 N 1.78 -0.67 0.00 6.30 0.00 -1.18 -2.75 121.76 125.24 2wcg s ALA 341 Ca -0.08 0.30 -0.28 0.00 0.00 0.00 0.00 51.96 51.90 2wcg s ALA 341 Cb -0.05 -0.01 0.09 0.00 0.00 0.00 0.00 23.12 23.14 2wcg s ALA 341 CO -0.17 -0.23 0.75 0.00 0.00 0.00 0.00 175.76 176.11 2wcg s VAL 343 N -2.26 2.91 0.00 0.00 -7.23 -1.26 -4.53 120.40 108.02 2wcg s VAL 343 Ca -0.03 -1.05 0.00 0.00 -1.81 0.00 0.00 61.98 59.09 2wcg s VAL 343 Cb -0.01 -2.96 0.00 0.00 0.56 0.00 0.00 36.38 33.98 2wcg s VAL 343 CO -0.01 0.00 0.00 0.61 -0.31 0.00 0.00 175.10 175.39 2wcg n GLY 344 N -1.83 0.49 0.14 2.32 0.00 -1.26 -1.58 105.19 103.46 2wcg n GLY 344 Ca 0.08 0.00 -0.00 0.00 0.00 0.00 0.00 46.02 46.10 2wcg n GLY 344 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 2wcg h SER 345 N 0.00 0.00 -3.92 1.61 4.64 -1.82 -3.40 113.55 110.65 2wcg h SER 345 Ca 0.00 0.00 -0.53 0.00 -0.47 0.00 0.00 61.79 60.79 2wcg h SER 345 Cb 0.14 0.00 0.08 0.00 -0.31 0.00 0.00 62.40 62.30 2wcg h SER 345 CO 0.00 0.61 0.63 -0.54 -0.87 0.00 0.00 176.83 176.67 2wcg s LYS 346 N -3.39 4.11 0.53 4.77 -0.14 -1.26 -4.92 119.74 119.44 2wcg s LYS 346 Ca -0.00 2.20 0.23 0.00 -1.36 0.00 0.00 55.97 57.05 2wcg s LYS 346 Cb 0.11 -2.88 1.47 0.00 -1.68 0.00 0.00 37.83 34.85 2wcg s LYS 346 CO 0.75 -0.39 2.14 0.27 -0.76 0.00 0.00 175.35 177.36 2wcg h PHE 347 N 2.93 0.00 -0.00 3.18 -5.15 -2.00 -0.46 116.94 115.44 2wcg h PHE 347 Ca -0.49 0.00 0.00 0.00 -0.20 0.00 0.00 57.97 57.28 2wcg h PHE 347 Cb 1.24 0.00 0.00 0.00 0.22 0.00 0.00 35.95 37.41 2wcg h PHE 347 CO 0.54 0.06 -0.19 -2.67 -2.00 0.00 0.00 178.31 174.05 2wcg n TRP 348 N -4.04 0.00 -3.12 6.09 2.14 -1.26 -4.90 117.44 112.35 2wcg n TRP 348 Ca -0.03 0.00 -0.36 0.00 2.07 0.00 0.00 57.50 59.19 2wcg n TRP 348 Cb 0.15 -0.20 -0.06 0.00 -0.81 0.00 0.00 31.31 30.39 2wcg n TRP 348 CO 0.00 0.00 0.00 -1.21 2.07 0.00 0.00 177.69 178.55 2wcg s GLU 349 N -2.59 4.20 0.14 -2.67 2.02 -0.18 -5.04 118.70 114.58 2wcg s GLU 349 Ca 0.24 0.82 -0.31 0.00 0.02 0.00 0.00 54.97 55.74 2wcg s GLU 349 Cb 0.19 -2.82 -0.09 0.00 0.10 0.00 0.00 34.13 31.51 2wcg s GLU 349 CO 0.52 0.37 1.55 -1.14 0.02 0.00 0.00 175.26 176.57 2wcg s GLN 350 N -2.11 4.23 0.09 1.61 0.74 -1.26 -4.86 119.66 118.09 2wcg s GLN 350 Ca 0.44 2.31 -0.24 0.00 0.05 0.00 0.00 55.36 57.92 2wcg s GLN 350 Cb -0.16 -3.24 -0.15 0.00 1.10 0.00 0.00 33.01 30.57 2wcg s GLN 350 CO 0.20 -0.60 1.73 0.77 -0.55 0.00 0.00 175.29 176.85 2wcg h SER 351 N 7.03 -0.07 -3.13 6.67 0.02 -1.85 -3.42 113.55 118.81 2wcg h SER 351 Ca -0.42 0.00 -0.59 0.00 -0.84 0.00 0.00 61.79 59.94 2wcg h SER 351 Cb 1.20 0.02 -0.36 0.00 0.14 0.00 0.00 62.40 63.40 2wcg h SER 351 CO 0.91 -0.04 -0.83 -0.69 -1.14 0.00 0.00 176.83 175.04 2wcg s VAL 352 N -6.18 1.48 -0.57 2.27 1.01 -1.26 -1.69 120.40 115.45 2wcg s VAL 352 Ca -0.13 -0.58 0.02 0.00 0.00 0.00 0.00 61.98 61.29 2wcg s VAL 352 Cb 0.06 -1.40 0.14 0.00 0.00 0.00 0.00 36.38 35.18 2wcg s VAL 352 CO 0.66 0.44 0.34 -0.13 0.00 0.00 0.00 175.10 176.41 2wcg s ARG 353 N 1.51 2.22 -0.17 2.72 0.52 -1.26 -5.06 118.95 119.42 2wcg s ARG 353 Ca 0.05 -2.67 -0.33 0.00 -0.52 0.00 0.00 55.73 52.26 2wcg s ARG 353 Cb -0.13 -3.47 -0.10 0.00 0.52 0.00 0.00 34.95 31.78 2wcg s ARG 353 CO -0.10 -1.14 2.03 1.28 0.02 0.00 0.00 175.30 177.38 2wcg n LEU 354 N 3.11 3.14 0.00 2.53 4.77 -1.26 -1.75 117.00 127.54 2wcg n LEU 354 Ca 0.07 0.68 0.00 0.00 -0.03 0.00 0.00 56.01 56.73 2wcg n LEU 354 Cb 0.34 -1.39 0.00 0.00 -2.33 0.00 0.00 43.42 40.04 2wcg n LEU 354 CO 0.34 -0.33 0.00 0.61 -1.33 0.00 0.00 177.39 176.67 2wcg n GLY 355 N 5.19 0.83 3.61 -0.72 0.00 -1.26 -4.29 105.19 108.54 2wcg n GLY 355 Ca 0.28 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.87 2wcg n GLY 355 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2wcg s SER 356 N -2.22 5.85 0.17 1.61 0.15 -0.71 -1.15 113.70 117.41 2wcg s SER 356 Ca 0.00 1.55 -0.10 0.00 0.70 0.00 0.00 55.95 58.10 2wcg s SER 356 Cb 0.00 -2.52 0.05 0.00 -1.71 0.00 0.00 66.02 61.84 2wcg s SER 356 CO 0.00 -1.70 1.62 -0.25 1.20 0.00 0.00 173.24 174.11 2wcg h TRP 357 N 13.12 1.11 -0.39 3.44 2.91 -1.90 -3.11 115.95 131.12 2wcg h TRP 357 Ca -0.36 -0.20 0.06 0.00 1.13 0.00 0.00 58.89 59.52 2wcg h TRP 357 Cb 1.19 -0.29 -0.05 0.00 -0.51 0.00 0.00 29.16 29.50 2wcg h TRP 357 CO 0.95 0.99 0.08 0.22 -1.03 0.00 0.00 178.44 179.65 2wcg h ASP 358 N 0.90 0.01 -0.65 2.65 1.82 -1.98 -1.48 116.42 117.69 2wcg h ASP 358 Ca 0.16 0.06 0.00 0.00 -0.39 0.00 0.00 57.03 56.87 2wcg h ASP 358 Cb 0.56 0.09 -0.03 0.00 0.68 0.00 0.00 39.33 40.62 2wcg h ASP 358 CO 0.03 0.04 0.42 0.03 -1.61 0.00 0.00 179.24 178.16 2wcg h ARG 359 N 0.21 0.86 -0.06 0.28 3.08 -1.96 -1.48 114.38 115.31 2wcg h ARG 359 Ca 0.19 -0.06 0.02 0.00 0.07 0.00 0.00 59.98 60.20 2wcg h ARG 359 Cb 0.22 -0.19 -0.02 0.00 0.08 0.00 0.00 29.97 30.05 2wcg h ARG 359 CO -0.24 0.58 -0.08 0.78 -1.07 0.00 0.00 179.97 179.94 2wcg h GLY 360 N 0.89 -0.03 1.88 0.04 0.00 -1.29 -2.73 103.07 101.84 2wcg h GLY 360 Ca 0.24 0.09 -0.00 0.00 0.00 0.00 0.00 47.33 47.66 2wcg h GLY 360 CO -0.05 -0.09 0.07 -0.33 0.00 0.00 0.00 176.54 176.14 2wcg h MET 361 N -0.11 0.16 -0.41 4.80 2.86 -0.82 -1.63 114.93 119.78 2wcg h MET 361 Ca 0.05 -0.01 -0.00 0.00 -2.06 0.00 0.00 59.70 57.68 2wcg h MET 361 Cb 0.18 -0.04 -0.02 0.00 0.06 0.00 0.00 31.60 31.78 2wcg h MET 361 CO -0.12 0.12 0.24 1.96 1.06 0.00 0.00 176.91 180.16 2wcg h GLN 362 N 0.16 0.55 0.46 1.72 4.20 -0.99 0.37 115.11 121.58 2wcg h GLN 362 Ca 0.04 -0.05 -0.01 0.00 0.06 0.00 0.00 58.65 58.69 2wcg h GLN 362 Cb -0.00 -0.11 -0.01 0.00 0.30 0.00 0.00 27.48 27.65 2wcg h GLN 362 CO -0.01 0.42 -0.34 1.88 -0.67 0.00 0.00 178.83 180.11 2wcg h TYR 363 N 0.53 -0.90 -0.30 2.96 -1.99 -1.08 -1.79 116.97 114.41 2wcg h TYR 363 Ca 0.14 -0.00 -0.13 0.00 2.00 0.00 0.00 58.73 60.74 2wcg h TYR 363 Cb 0.01 0.33 -0.01 0.00 2.00 0.00 0.00 36.73 39.06 2wcg h TYR 363 CO -0.03 -0.50 -0.36 0.66 -0.00 0.00 0.00 178.16 177.93 2wcg h SER 364 N -0.78 0.71 -0.35 3.88 4.64 -1.39 0.37 113.55 120.63 2wcg h SER 364 Ca -0.05 -0.30 0.03 0.00 -0.47 0.00 0.00 61.79 61.01 2wcg h SER 364 Cb 0.66 -0.20 -0.03 0.00 -0.31 0.00 0.00 62.40 62.52 2wcg h SER 364 CO 0.01 1.00 0.15 -0.74 -0.87 0.00 0.00 176.83 176.38 2wcg h HIS 365 N 0.56 0.28 0.16 4.77 -0.00 -0.95 -0.47 115.15 119.49 2wcg h HIS 365 Ca 0.06 0.02 0.01 0.00 -0.00 0.00 0.00 60.37 60.45 2wcg h HIS 365 Cb 0.88 -0.07 -0.02 0.00 -0.00 0.00 0.00 27.41 28.19 2wcg h HIS 365 CO 0.04 0.14 -0.21 1.03 -0.00 0.00 0.00 177.93 178.93 2wcg h SER 366 N 0.32 -0.57 -0.28 3.26 0.87 -1.08 -1.73 113.55 114.35 2wcg h SER 366 Ca 0.15 0.06 0.05 0.00 -1.23 0.00 0.00 61.79 60.82 2wcg h SER 366 Cb 0.09 0.21 -0.05 0.00 -0.44 0.00 0.00 62.40 62.21 2wcg h SER 366 CO -0.13 -0.30 -0.02 0.40 -0.53 0.00 0.00 176.83 176.25 2wcg h ILE 367 N -0.42 0.77 -0.59 2.23 2.04 -0.79 -0.20 117.51 120.56 2wcg h ILE 367 Ca 0.01 -0.02 0.03 0.00 1.00 0.00 0.00 64.86 65.89 2wcg h ILE 367 Cb 0.41 0.72 -0.04 0.00 -0.74 0.00 0.00 36.82 37.17 2wcg h ILE 367 CO -0.08 0.01 0.35 0.40 0.00 0.00 0.00 178.15 178.83 2wcg h ILE 368 N 0.05 1.05 -0.44 -0.67 2.04 -1.09 -0.91 117.51 117.54 2wcg h ILE 368 Ca 0.13 -0.24 -0.03 0.00 1.00 0.00 0.00 64.86 65.73 2wcg h ILE 368 Cb 0.18 0.30 -0.02 0.00 -0.74 0.00 0.00 36.82 36.55 2wcg h ILE 368 CO -0.24 0.13 0.15 0.74 0.00 0.00 0.00 178.15 178.93 2wcg h THR 369 N 0.69 1.21 -0.17 -0.27 2.02 -0.98 -1.29 112.91 114.11 2wcg h THR 369 Ca 0.24 -0.68 0.04 0.00 0.77 0.00 0.00 66.41 66.78 2wcg h THR 369 Cb 0.04 0.84 -0.04 0.00 -1.74 0.00 0.00 68.15 67.25 2wcg h THR 369 CO -0.11 0.25 -0.06 0.78 0.37 0.00 0.00 175.52 176.74 2wcg h ASN 370 N 0.56 -0.22 -1.00 4.18 2.35 -0.90 -2.79 115.58 117.77 2wcg h ASN 370 Ca 0.14 0.06 0.11 0.00 -0.55 0.00 0.00 56.30 56.07 2wcg h ASN 370 Cb 0.23 0.13 -0.08 0.00 0.05 0.00 0.00 38.32 38.65 2wcg h ASN 370 CO -0.01 -0.09 0.63 -0.07 -1.65 0.00 0.00 177.43 176.25 2wcg h LEU 371 N -0.04 0.93 -1.04 1.61 3.38 -0.78 -1.77 115.31 117.60 2wcg h LEU 371 Ca 0.09 0.04 0.00 0.00 0.09 0.00 0.00 57.88 58.10 2wcg h LEU 371 Cb 0.17 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 40.77 2wcg h LEU 371 CO -0.20 0.51 0.00 -0.07 0.09 0.00 0.00 178.44 178.77 2wcg h LEU 372 N 1.01 0.00 -3.63 1.67 3.38 -1.06 -2.87 115.31 113.80 2wcg h LEU 372 Ca 0.48 0.00 -0.43 0.00 0.09 0.00 0.00 57.88 58.03 2wcg h LEU 372 Cb 0.45 0.00 -0.28 0.00 0.09 0.00 0.00 40.66 40.92 2wcg h LEU 372 CO -0.25 0.00 -0.22 -1.22 0.09 0.00 0.00 178.44 176.84 2wcg n TYR 373 N -2.84 2.17 -0.76 1.13 4.02 -0.82 -4.97 117.16 115.09 2wcg n TYR 373 Ca 0.02 -2.15 0.00 0.00 -0.01 0.00 0.00 57.90 55.76 2wcg n TYR 373 Cb 0.32 -0.61 0.00 0.00 -0.02 0.00 0.00 39.34 39.03 2wcg n TYR 373 CO 0.00 0.00 0.00 0.72 -1.01 0.00 0.00 176.86 176.57 2wcg n HIS 374 N -0.91 0.00 -2.64 -0.72 8.25 -1.08 -4.50 115.22 113.62 2wcg n HIS 374 Ca 0.43 0.00 -0.41 0.00 -0.26 0.00 0.00 57.72 57.48 2wcg n HIS 374 Cb 0.92 0.00 -0.04 0.00 1.12 0.00 0.00 29.99 31.99 2wcg n HIS 374 CO 0.00 0.00 0.00 0.08 0.64 0.00 0.00 176.34 177.06 2wcg s VAL 375 N -2.20 4.21 -1.00 1.59 1.01 -0.73 -4.46 120.40 118.82 2wcg s VAL 375 Ca 0.00 1.88 0.23 0.00 0.00 0.00 0.00 61.98 64.09 2wcg s VAL 375 Cb 0.00 -4.20 -0.09 0.00 0.00 0.00 0.00 36.38 32.10 2wcg s VAL 375 CO 0.00 0.31 1.21 1.33 0.00 0.00 0.00 175.10 177.95 2wcg n VAL 376 N 2.58 0.00 -3.66 2.92 0.24 0.27 -4.44 118.33 116.24 2wcg n VAL 376 Ca 0.02 -0.00 -0.06 0.00 -2.04 0.00 0.00 64.34 62.26 2wcg n VAL 376 Cb 0.48 0.54 -0.02 0.00 -1.47 0.00 0.00 33.84 33.37 2wcg n VAL 376 CO 0.00 0.00 0.00 -0.83 -2.14 0.00 0.00 176.83 173.86 2wcg s GLY 377 N -3.00 -0.32 -0.10 7.63 0.00 -1.26 -0.27 107.32 110.00 2wcg s GLY 377 Ca 0.10 0.34 -0.05 0.00 0.00 0.00 0.00 44.72 45.11 2wcg s GLY 377 CO 0.77 0.10 0.24 0.86 0.00 0.00 0.00 173.10 175.06 2wcg s TRP 378 N -3.40 -0.31 -0.14 1.90 -0.00 -0.77 -1.41 118.94 114.81 2wcg s TRP 378 Ca 0.09 0.76 0.02 0.00 -0.00 0.00 0.00 56.10 56.96 2wcg s TRP 378 Cb -0.02 0.04 0.02 0.00 -0.00 0.00 0.00 33.47 33.50 2wcg s TRP 378 CO -0.02 -0.23 -0.19 0.99 -0.00 0.00 0.00 176.95 177.51 2wcg s THR 379 N 1.25 1.85 0.97 5.86 2.01 -0.08 -2.83 115.64 124.66 2wcg s THR 379 Ca -0.09 -0.83 -0.12 0.00 0.31 0.00 0.00 61.69 60.95 2wcg s THR 379 Cb -0.10 -1.66 0.17 0.00 0.01 0.00 0.00 72.50 70.91 2wcg s THR 379 CO -0.08 0.51 1.09 -0.62 -0.69 0.00 0.00 174.62 174.82 2wcg s ASP 380 N 1.07 2.88 0.00 3.53 2.15 0.11 -3.11 116.67 123.30 2wcg s ASP 380 Ca -0.02 1.34 0.00 0.00 0.43 0.00 0.00 52.55 54.30 2wcg s ASP 380 Cb -0.14 -2.02 0.00 0.00 -0.30 0.00 0.00 42.92 40.46 2wcg s ASP 380 CO -0.06 -2.99 0.00 1.87 -0.17 0.00 0.00 175.17 173.82 2wcg n TRP 381 N -4.10 0.00 -1.62 -5.34 -0.00 -0.37 -3.02 117.44 102.99 2wcg n TRP 381 Ca 0.06 0.00 -0.60 0.00 -0.00 0.00 0.00 57.50 56.95 2wcg n TRP 381 Cb 0.56 0.00 -0.08 0.00 -0.00 0.00 0.00 31.31 31.79 2wcg n TRP 381 CO 0.00 0.00 0.00 0.09 -0.00 0.00 0.00 177.69 177.78 2wcg n ASN 382 N 0.00 0.90 -0.22 5.87 3.02 -1.26 -1.17 115.26 122.41 2wcg n ASN 382 Ca 0.00 1.15 0.06 0.00 -0.03 0.00 0.00 54.58 55.77 2wcg n ASN 382 Cb 0.00 -0.98 0.33 0.00 -0.61 0.00 0.00 39.78 38.52 2wcg n ASN 382 CO 0.00 0.00 0.00 -0.07 -2.62 0.00 0.00 177.26 174.57 2wcg h LEU 383 N 4.35 0.72 -7.37 3.41 3.38 -1.65 -3.41 115.31 114.74 2wcg h LEU 383 Ca -0.48 0.01 -0.10 0.00 0.09 0.00 0.00 57.88 57.40 2wcg h LEU 383 Cb 1.38 -0.15 -0.19 0.00 0.09 0.00 0.00 40.66 41.80 2wcg h LEU 383 CO 0.81 0.45 -0.14 0.00 0.09 0.00 0.00 178.44 179.66 2wcg s ALA 384 N -5.73 -1.06 0.18 1.53 0.00 -1.26 -3.93 121.76 111.51 2wcg s ALA 384 Ca -0.10 0.56 -0.02 0.00 0.00 0.00 0.00 51.96 52.40 2wcg s ALA 384 Cb 0.20 0.10 -0.04 0.00 0.00 0.00 0.00 23.12 23.38 2wcg s ALA 384 CO 0.78 -0.32 0.14 -0.51 0.00 0.00 0.00 175.76 175.85 2wcg s LEU 385 N -1.41 1.26 0.87 0.00 1.43 -0.89 -3.86 118.68 116.08 2wcg s LEU 385 Ca -0.12 -1.30 -0.13 0.00 -1.03 0.00 0.00 54.13 51.56 2wcg s LEU 385 Cb -0.03 0.47 0.14 0.00 0.03 0.00 0.00 46.19 46.80 2wcg s LEU 385 CO 0.05 -0.83 1.23 0.54 0.23 0.00 0.00 176.35 177.57 2wcg s ASN 386 N -3.12 3.82 0.28 2.29 2.20 -0.85 -0.47 114.94 119.09 2wcg s ASN 386 Ca 0.33 0.43 0.21 0.00 -0.94 0.00 0.00 52.86 52.90 2wcg s ASN 386 Cb 0.07 -0.70 1.05 0.00 -2.00 0.00 0.00 41.25 39.66 2wcg s ASN 386 CO 0.09 -2.30 1.65 -2.65 -2.94 0.00 0.00 177.10 170.95 2wcg n PRO 387 N -3.49 0.15 0.00 3.55 -0.02 -1.25 -0.66 135.00 133.28 2wcg n PRO 387 Ca 0.12 0.55 0.12 0.00 -2.02 0.00 0.00 63.50 62.27 2wcg n PRO 387 Cb 0.60 -1.90 0.22 0.00 -0.02 0.00 0.00 33.50 32.40 2wcg n PRO 387 CO 0.00 0.00 0.00 -1.91 1.98 0.00 0.00 175.50 175.57 2wcg n GLU 388 N -2.21 0.72 -0.66 -0.52 2.13 -1.26 -4.74 120.64 114.10 2wcg n GLU 388 Ca -0.00 -0.50 0.00 0.00 0.66 0.00 0.00 57.16 57.32 2wcg n GLU 388 Cb 0.11 -1.49 0.00 0.00 0.27 0.00 0.00 31.44 30.33 2wcg n GLU 388 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2wcg n GLY 389 N 1.40 0.65 0.00 8.31 0.00 0.16 -4.66 105.19 111.05 2wcg n GLY 389 Ca 0.10 -0.66 0.00 0.00 0.00 0.00 0.00 46.02 45.45 2wcg n GLY 389 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2wcg n GLY 390 N -2.48 6.61 3.73 -0.02 0.00 -1.26 -2.84 105.19 108.93 2wcg n GLY 390 Ca 0.00 -1.77 -0.30 0.00 0.00 0.00 0.00 46.02 43.95 2wcg n GLY 390 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2wcg s PRO 391 N 0.90 1.38 -0.30 1.61 0.04 -1.26 -2.01 135.00 135.37 2wcg s PRO 391 Ca 0.00 0.84 -0.15 0.00 0.04 0.00 0.00 61.00 61.73 2wcg s PRO 391 Cb 0.00 -1.82 0.16 0.00 0.04 0.00 0.00 34.50 32.88 2wcg s PRO 391 CO 0.00 -2.16 0.95 1.21 0.04 0.00 0.00 177.00 177.04 2wcg s ASN 392 N -3.44 -0.62 0.53 6.66 3.84 -1.26 -4.53 114.94 116.11 2wcg s ASN 392 Ca 0.63 0.87 0.31 0.00 0.21 0.00 0.00 52.86 54.88 2wcg s ASN 392 Cb -0.18 1.67 1.38 0.00 -0.55 0.00 0.00 41.25 43.57 2wcg s ASN 392 CO 0.57 -0.12 2.00 4.11 -2.79 0.00 0.00 177.10 180.87 2wcg h TRP 393 N 7.40 0.00 -0.48 0.43 5.08 -0.94 -0.52 115.95 126.93 2wcg h TRP 393 Ca -0.17 0.00 0.00 0.00 1.08 0.00 0.00 58.89 59.80 2wcg h TRP 393 Cb 1.12 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 27.28 2wcg h TRP 393 CO 0.19 0.09 0.00 1.33 -1.28 0.00 0.00 178.44 178.77 2wcg n VAL 394 N -3.31 1.18 -2.88 0.12 0.24 -1.26 -4.97 118.33 107.45 2wcg n VAL 394 Ca -0.01 -1.08 -0.19 0.00 -2.04 0.00 0.00 64.34 61.02 2wcg n VAL 394 Cb 0.30 0.41 0.03 0.00 -1.47 0.00 0.00 33.84 33.11 2wcg n VAL 394 CO 0.00 0.00 0.00 0.54 -2.14 0.00 0.00 176.83 175.23 2wcg n ARG 395 N 0.82 -4.08 -2.10 7.34 1.74 -0.20 -4.91 116.66 115.27 2wcg n ARG 395 Ca 0.17 0.80 -0.41 0.00 -0.77 0.00 0.00 57.85 57.65 2wcg n ARG 395 Cb 0.56 -5.42 -0.00 0.00 -1.02 0.00 0.00 32.46 26.59 2wcg n ARG 395 CO 0.00 0.00 0.00 -1.71 -1.52 0.00 0.00 177.63 174.40 2wcg n ASN 396 N -1.93 7.53 -4.76 0.55 4.05 -1.26 -4.99 115.26 114.44 2wcg n ASN 396 Ca -0.11 -3.17 -0.41 0.00 0.45 0.00 0.00 54.58 51.34 2wcg n ASN 396 Cb 0.61 -1.37 -0.03 0.00 1.23 0.00 0.00 39.78 40.23 2wcg n ASN 396 CO 0.00 0.00 0.00 -0.36 -3.05 0.00 0.00 177.26 173.85 2wcg s PHE 397 N -1.11 3.15 0.22 1.20 2.99 -1.26 -5.01 117.98 118.15 2wcg s PHE 397 Ca 0.51 1.42 0.04 0.00 0.00 0.00 0.00 56.93 58.90 2wcg s PHE 397 Cb 0.17 -3.62 -0.02 0.00 0.00 0.00 0.00 43.02 39.56 2wcg s PHE 397 CO -0.08 -1.70 0.15 1.33 -0.00 0.00 0.00 175.22 174.92 2wcg n VAL 398 N 1.12 0.00 -3.04 -0.44 0.24 -1.13 -4.65 118.33 110.43 2wcg n VAL 398 Ca 0.01 -1.48 -0.23 0.00 -2.04 0.00 0.00 64.34 60.60 2wcg n VAL 398 Cb 0.42 0.68 0.01 0.00 -1.47 0.00 0.00 33.84 33.48 2wcg n VAL 398 CO 0.00 0.00 0.00 -0.62 -2.14 0.00 0.00 176.83 174.07 2wcg s ASP 399 N -2.45 5.88 -0.04 -1.34 -1.08 -0.62 -4.19 116.67 112.81 2wcg s ASP 399 Ca 0.21 0.26 -0.13 0.00 -0.52 0.00 0.00 52.55 52.38 2wcg s ASP 399 Cb 0.01 -1.55 0.02 0.00 -1.46 0.00 0.00 42.92 39.95 2wcg s ASP 399 CO 0.15 -0.65 0.30 -0.55 0.52 0.00 0.00 175.17 174.93 2wcg s SER 400 N -4.20 -0.21 0.60 -0.34 0.15 -1.26 -4.56 113.70 103.87 2wcg s SER 400 Ca 0.47 0.23 0.40 0.00 0.70 0.00 0.00 55.95 57.75 2wcg s SER 400 Cb -0.10 0.41 2.11 0.00 -1.71 0.00 0.00 66.02 66.73 2wcg s SER 400 CO 0.37 -0.34 2.22 -0.65 1.20 0.00 0.00 173.24 176.05 2wcg h PRO 401 N 4.45 0.00 -4.30 5.44 0.11 -1.81 -3.40 132.00 132.50 2wcg h PRO 401 Ca -0.29 0.00 -0.49 0.00 0.11 0.00 0.00 66.00 65.33 2wcg h PRO 401 Cb 1.18 0.00 -0.35 0.00 0.11 0.00 0.00 31.00 31.94 2wcg h PRO 401 CO 0.37 0.00 -0.80 0.42 -0.21 0.00 0.00 178.00 177.78 2wcg s ILE 402 N -3.99 0.95 -0.17 4.15 1.01 -1.25 -0.94 121.20 120.96 2wcg s ILE 402 Ca -0.04 -0.32 -0.03 0.00 0.00 0.00 0.00 60.65 60.27 2wcg s ILE 402 Cb 0.12 -0.93 -0.02 0.00 0.01 0.00 0.00 42.46 41.64 2wcg s ILE 402 CO 0.40 0.33 -0.07 -0.63 0.00 0.00 0.00 174.94 174.97 2wcg s ILE 403 N 1.12 3.45 -0.17 2.92 -1.09 -0.44 -2.10 121.20 124.89 2wcg s ILE 403 Ca -0.07 -0.50 -0.11 0.00 -2.23 0.00 0.00 60.65 57.75 2wcg s ILE 403 Cb -0.14 -2.51 -0.05 0.00 -1.58 0.00 0.00 42.46 38.18 2wcg s ILE 403 CO -0.01 0.48 0.19 -0.69 -1.23 0.00 0.00 174.94 173.67 2wcg s VAL 404 N 0.74 5.38 -0.68 2.92 1.01 0.38 0.09 120.40 130.24 2wcg s VAL 404 Ca -0.03 0.32 -0.03 0.00 0.00 0.00 0.00 61.98 62.24 2wcg s VAL 404 Cb -0.15 -3.51 0.17 0.00 0.00 0.00 0.00 36.38 32.89 2wcg s VAL 404 CO 0.02 0.46 0.51 -0.62 0.00 0.00 0.00 175.10 175.47 2wcg s ASP 405 N 0.11 5.39 0.22 3.32 -1.08 0.24 -3.91 116.67 120.96 2wcg s ASP 405 Ca 0.12 -3.01 -0.07 0.00 -0.52 0.00 0.00 52.55 49.07 2wcg s ASP 405 Cb -0.12 -1.87 0.19 0.00 -1.46 0.00 0.00 42.92 39.65 2wcg s ASP 405 CO 0.01 -0.34 1.76 -0.29 0.52 0.00 0.00 175.17 176.83 2wcg h ILE 406 N 5.04 1.26 0.00 4.11 2.10 -1.92 -1.76 117.51 126.33 2wcg h ILE 406 Ca 0.02 -0.90 0.00 0.00 1.08 0.00 0.00 64.86 65.07 2wcg h ILE 406 Cb 0.93 0.47 0.00 0.00 -1.09 0.00 0.00 36.82 37.13 2wcg h ILE 406 CO 0.73 0.35 0.00 0.35 -1.08 0.00 0.00 178.15 178.50 2wcg n THR 407 N -4.25 1.20 0.20 2.19 -2.24 -1.26 -1.92 114.28 108.20 2wcg n THR 407 Ca 0.06 0.32 0.03 0.00 -2.27 0.00 0.00 64.05 62.19 2wcg n THR 407 Cb 0.23 -1.15 0.04 0.00 -2.10 0.00 0.00 70.33 67.35 2wcg n THR 407 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 2wcg n LYS 408 N -1.60 0.51 -4.11 -0.78 5.02 -0.71 -4.99 118.16 111.50 2wcg n LYS 408 Ca 0.02 -1.08 -0.31 0.00 -2.02 0.00 0.00 58.31 54.93 2wcg n LYS 408 Cb 0.13 -1.14 -0.03 0.00 -0.02 0.00 0.00 35.03 33.98 2wcg n LYS 408 CO 0.00 0.00 0.00 -3.47 -0.52 0.00 0.00 177.40 173.41 2wcg n ASP 409 N 0.33 -1.40 -4.25 4.39 2.03 -0.81 -4.97 116.55 111.87 2wcg n ASP 409 Ca 0.05 -1.04 -0.23 0.00 0.52 0.00 0.00 54.79 54.09 2wcg n ASP 409 Cb 0.20 -2.77 -0.13 0.00 -0.72 0.00 0.00 41.12 37.71 2wcg n ASP 409 CO 0.00 0.00 0.00 -0.89 -1.92 0.00 0.00 177.20 174.39 2wcg s THR 410 N -3.73 1.57 0.06 5.18 2.01 -1.06 -4.07 115.64 115.60 2wcg s THR 410 Ca 0.31 -1.44 0.03 0.00 0.31 0.00 0.00 61.69 60.90 2wcg s THR 410 Cb -0.17 -1.43 -0.03 0.00 0.01 0.00 0.00 72.50 70.88 2wcg s THR 410 CO 0.92 -0.06 -0.09 0.72 -0.69 0.00 0.00 174.62 175.42 2wcg s PHE 411 N -1.13 0.85 -0.14 4.92 -0.12 -0.82 0.79 117.98 122.32 2wcg s PHE 411 Ca 0.05 -0.59 0.00 0.00 -0.05 0.00 0.00 56.93 56.34 2wcg s PHE 411 Cb -0.10 -0.49 -0.01 0.00 -0.63 0.00 0.00 43.02 41.80 2wcg s PHE 411 CO 0.03 -0.06 -0.15 0.71 -0.05 0.00 0.00 175.22 175.70 2wcg s TYR 412 N -1.92 2.77 -0.33 3.49 1.51 0.11 -1.68 117.35 121.30 2wcg s TYR 412 Ca -0.03 -0.91 -0.18 0.00 -1.01 0.00 0.00 57.07 54.94 2wcg s TYR 412 Cb -0.06 -1.86 -0.01 0.00 -0.11 0.00 0.00 41.96 39.92 2wcg s TYR 412 CO -0.00 -0.38 0.53 0.15 -1.11 0.00 0.00 175.55 174.73 2wcg s LYS 413 N 0.62 3.71 0.66 -0.62 1.02 -0.40 -1.32 119.74 123.42 2wcg s LYS 413 Ca -0.08 -0.04 -0.06 0.00 0.02 0.00 0.00 55.97 55.80 2wcg s LYS 413 Cb -0.16 -3.78 0.04 0.00 -0.52 0.00 0.00 37.83 33.42 2wcg s LYS 413 CO 0.03 -0.60 0.98 -0.65 -0.92 0.00 0.00 175.35 174.18 2wcg s GLN 414 N 2.42 2.46 0.42 1.68 -0.21 -0.11 -1.93 119.66 124.39 2wcg s GLN 414 Ca 0.20 -0.16 0.15 0.00 0.02 0.00 0.00 55.36 55.57 2wcg s GLN 414 Cb -0.15 -2.20 1.03 0.00 1.00 0.00 0.00 33.01 32.68 2wcg s GLN 414 CO 0.13 -1.05 1.92 -1.35 -2.12 0.00 0.00 175.29 172.81 2wcg h PRO 415 N -0.45 0.43 -0.99 2.91 0.11 -1.80 -0.20 132.00 132.01 2wcg h PRO 415 Ca -0.45 -0.03 0.22 0.00 0.11 0.00 0.00 66.00 65.86 2wcg h PRO 415 Cb 1.29 -0.10 -0.10 0.00 0.11 0.00 0.00 31.00 32.21 2wcg h PRO 415 CO 0.60 0.29 0.62 0.52 -0.21 0.00 0.00 178.00 179.82 2wcg h MET 416 N 0.45 0.55 -0.34 1.05 2.86 -1.86 -1.07 114.93 116.57 2wcg h MET 416 Ca 0.38 -0.03 -0.01 0.00 -2.06 0.00 0.00 59.70 57.97 2wcg h MET 416 Cb 0.83 -0.12 -0.02 0.00 0.06 0.00 0.00 31.60 32.35 2wcg h MET 416 CO -0.13 0.36 0.16 0.35 1.06 0.00 0.00 176.91 178.72 2wcg h PHE 417 N 0.56 0.49 -0.10 -0.22 3.57 -1.23 -1.62 116.94 118.40 2wcg h PHE 417 Ca 0.56 -0.02 -0.21 0.00 3.53 0.00 0.00 57.97 61.83 2wcg h PHE 417 Cb 1.16 -0.15 0.00 0.00 2.79 0.00 0.00 35.95 39.75 2wcg h PHE 417 CO -0.00 0.43 -0.78 1.88 -2.23 0.00 0.00 178.31 177.61 2wcg h TYR 418 N 0.41 0.78 -0.42 0.41 -1.99 -1.42 -1.12 116.97 113.63 2wcg h TYR 418 Ca 0.12 -0.35 0.01 0.00 2.00 0.00 0.00 58.73 60.50 2wcg h TYR 418 Cb 0.12 -0.12 -0.02 0.00 2.00 0.00 0.00 36.73 38.71 2wcg h TYR 418 CO -0.02 1.15 0.27 0.45 -0.00 0.00 0.00 178.16 180.01 2wcg h HIS 419 N 0.38 0.51 -0.01 4.88 3.86 -1.12 -1.34 115.15 122.31 2wcg h HIS 419 Ca -0.05 0.01 0.03 0.00 -1.16 0.00 0.00 60.37 59.20 2wcg h HIS 419 Cb 1.38 -0.17 -0.04 0.00 1.06 0.00 0.00 27.41 29.65 2wcg h HIS 419 CO 0.06 0.31 -0.17 -0.07 0.86 0.00 0.00 177.93 178.92 2wcg h LEU 420 N 0.54 -0.51 -1.99 2.43 3.38 -1.28 -2.91 115.31 114.97 2wcg h LEU 420 Ca 0.16 0.08 0.16 0.00 0.09 0.00 0.00 57.88 58.36 2wcg h LEU 420 Cb -0.04 0.22 -0.02 0.00 0.09 0.00 0.00 40.66 40.91 2wcg h LEU 420 CO -0.05 -0.24 0.47 1.23 0.09 0.00 0.00 178.44 179.94 2wcg h GLY 421 N -0.28 0.00 2.00 0.83 0.00 -0.30 -0.53 103.07 104.80 2wcg h GLY 421 Ca 0.06 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.39 2wcg h GLY 421 CO -0.18 0.00 0.00 0.45 0.00 0.00 0.00 176.54 176.81 2wcg h HIS 422 N 0.00 0.00 0.00 5.60 3.86 -1.07 -2.27 115.15 121.27 2wcg h HIS 422 Ca 0.26 0.00 -0.26 0.00 -1.16 0.00 0.00 60.37 59.20 2wcg h HIS 422 Cb 1.19 0.00 -0.04 0.00 1.06 0.00 0.00 27.41 29.62 2wcg h HIS 422 CO 0.00 0.00 -1.84 1.19 0.86 0.00 0.00 177.93 178.14 2wcg n PHE 423 N -3.00 0.00 -0.34 2.45 3.01 -0.28 -4.53 117.46 114.77 2wcg n PHE 423 Ca -0.00 0.00 -0.01 0.00 1.01 0.00 0.00 57.45 58.45 2wcg n PHE 423 Cb 0.25 -0.75 0.15 0.00 -0.01 0.00 0.00 39.48 39.12 2wcg n PHE 423 CO 0.00 0.00 0.00 0.66 1.01 0.00 0.00 176.76 178.43 2wcg h SER 424 N -0.94 1.08 0.31 4.37 4.64 -1.41 -0.92 113.55 120.67 2wcg h SER 424 Ca -0.39 -0.02 -0.11 0.00 -0.47 0.00 0.00 61.79 60.79 2wcg h SER 424 Cb 1.32 -0.26 -0.01 0.00 -0.31 0.00 0.00 62.40 63.13 2wcg h SER 424 CO -0.24 0.77 -0.45 0.50 -0.87 0.00 0.00 176.83 176.54 2wcg h LYS 425 N 1.27 0.19 -0.08 4.77 3.64 -1.10 -3.32 116.57 121.93 2wcg h LYS 425 Ca 0.35 -0.09 0.00 0.00 -1.27 0.00 0.00 60.65 59.64 2wcg h LYS 425 Cb -0.12 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 31.71 2wcg h LYS 425 CO -0.08 0.61 0.00 1.19 -2.27 0.00 0.00 179.45 178.89 2wcg n PHE 426 N -3.99 0.10 -3.62 1.91 3.01 -0.92 -4.78 117.46 109.16 2wcg n PHE 426 Ca -0.02 -0.21 -0.28 0.00 1.01 0.00 0.00 57.45 57.95 2wcg n PHE 426 Cb 0.50 -0.02 -0.11 0.00 -0.01 0.00 0.00 39.48 39.85 2wcg n PHE 426 CO 0.00 0.00 0.00 0.42 1.01 0.00 0.00 176.76 178.19 2wcg s ILE 427 N -0.68 1.47 0.79 4.37 1.01 -0.39 -4.94 121.20 122.82 2wcg s ILE 427 Ca 0.08 -3.35 -0.11 0.00 0.00 0.00 0.00 60.65 57.27 2wcg s ILE 427 Cb 0.05 -1.99 0.06 0.00 0.01 0.00 0.00 42.46 40.60 2wcg s ILE 427 CO 0.07 -1.13 1.09 -2.16 0.00 0.00 0.00 174.94 172.81 2wcg s PRO 428 N -0.59 2.16 0.26 2.79 0.04 -1.26 -4.80 135.00 133.61 2wcg s PRO 428 Ca 0.29 0.78 -0.29 0.00 0.04 0.00 0.00 61.00 61.81 2wcg s PRO 428 Cb -0.01 -1.92 -0.14 0.00 0.04 0.00 0.00 34.50 32.48 2wcg s PRO 428 CO -0.18 -1.60 1.13 -1.91 0.04 0.00 0.00 177.00 174.48 2wcg n GLU 429 N -3.44 1.50 0.00 4.56 2.13 -1.26 -1.29 120.64 122.84 2wcg n GLU 429 Ca 0.07 0.53 0.00 0.00 0.66 0.00 0.00 57.16 58.42 2wcg n GLU 429 Cb 0.55 -1.99 0.00 0.00 0.27 0.00 0.00 31.44 30.27 2wcg n GLU 429 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2wcg n GLY 430 N 1.47 2.24 3.63 8.31 0.00 0.92 -4.85 105.19 116.90 2wcg n GLY 430 Ca 0.10 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.80 2wcg n GLY 430 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2wcg n SER 431 N 0.00 0.20 -3.86 1.61 7.64 -0.42 -4.49 113.62 114.30 2wcg n SER 431 Ca 0.00 0.48 -0.17 0.00 1.01 0.00 0.00 58.87 60.19 2wcg n SER 431 Cb 0.00 -1.44 -0.16 0.00 -1.01 0.00 0.00 64.21 61.60 2wcg n SER 431 CO 0.00 0.00 0.00 -1.58 -3.01 0.00 0.00 175.04 170.45 2wcg s GLN 432 N -4.20 0.40 0.30 1.43 0.74 0.42 -0.40 119.66 118.35 2wcg s GLN 432 Ca 0.68 -0.01 -0.27 0.00 0.05 0.00 0.00 55.36 55.80 2wcg s GLN 432 Cb -0.26 -0.50 -0.09 0.00 1.10 0.00 0.00 33.01 33.26 2wcg s GLN 432 CO 0.56 -0.07 0.99 0.50 -0.55 0.00 0.00 175.29 176.72 2wcg s ARG 433 N 0.70 4.61 0.31 1.67 3.52 -0.62 0.25 118.95 129.39 2wcg s ARG 433 Ca -0.07 1.49 0.04 0.00 -0.13 0.00 0.00 55.73 57.05 2wcg s ARG 433 Cb -0.11 -2.97 -0.06 0.00 -1.56 0.00 0.00 34.95 30.25 2wcg s ARG 433 CO -0.01 0.27 0.04 0.14 -0.81 0.00 0.00 175.30 174.94 2wcg s VAL 434 N -1.42 1.21 0.66 7.11 -7.23 -0.69 -0.09 120.40 119.95 2wcg s VAL 434 Ca 0.48 -2.02 -0.16 0.00 -1.81 0.00 0.00 61.98 58.48 2wcg s VAL 434 Cb -0.24 -2.72 0.00 0.00 0.56 0.00 0.00 36.38 33.99 2wcg s VAL 434 CO 0.30 -0.06 1.13 -0.83 -0.31 0.00 0.00 175.10 175.33 2wcg s GLY 435 N -3.46 2.26 -0.22 2.32 0.00 -0.83 -4.42 107.32 102.97 2wcg s GLY 435 Ca 0.35 0.66 -0.08 0.00 0.00 0.00 0.00 44.72 45.65 2wcg s GLY 435 CO 0.14 1.02 0.48 -2.27 0.00 0.00 0.00 173.10 172.48 2wcg s LEU 436 N -4.78 -0.68 0.10 0.66 2.96 -1.26 -1.05 118.68 114.63 2wcg s LEU 436 Ca 0.69 1.13 0.09 0.00 -0.22 0.00 0.00 54.13 55.83 2wcg s LEU 436 Cb -0.23 1.62 -0.04 0.00 0.50 0.00 0.00 46.19 48.04 2wcg s LEU 436 CO 0.40 -0.22 -0.23 0.68 -1.32 0.00 0.00 176.35 175.66 2wcg s VAL 437 N 2.42 1.92 0.01 1.68 -7.23 -0.82 -4.92 120.40 113.46 2wcg s VAL 437 Ca -0.04 -1.57 -0.01 0.00 -1.81 0.00 0.00 61.98 58.55 2wcg s VAL 437 Cb -0.11 -1.71 -0.04 0.00 0.56 0.00 0.00 36.38 35.08 2wcg s VAL 437 CO -0.15 0.05 0.15 0.00 -0.31 0.00 0.00 175.10 174.85 2wcg s ALA 438 N -1.06 3.84 -0.60 1.32 0.00 -1.26 -0.43 121.76 123.57 2wcg s ALA 438 Ca 0.09 -0.82 0.25 0.00 0.00 0.00 0.00 51.96 51.49 2wcg s ALA 438 Cb -0.10 -1.77 0.87 0.00 0.00 0.00 0.00 23.12 22.12 2wcg s ALA 438 CO 0.04 0.75 1.75 0.66 0.00 0.00 0.00 175.76 178.96 2wcg h SER 439 N 3.74 0.00 -4.88 0.00 4.64 -1.45 -3.47 113.55 112.14 2wcg h SER 439 Ca -0.48 0.00 0.08 0.00 -0.47 0.00 0.00 61.79 60.91 2wcg h SER 439 Cb 1.18 0.00 -0.12 0.00 -0.31 0.00 0.00 62.40 63.15 2wcg h SER 439 CO 0.68 0.00 0.38 0.00 -0.87 0.00 0.00 176.83 177.02 2wcg s GLN 440 N -3.20 1.09 0.46 4.77 -2.07 -1.26 -4.99 119.66 114.46 2wcg s GLN 440 Ca 0.08 -0.46 -0.25 0.00 -1.82 0.00 0.00 55.36 52.91 2wcg s GLN 440 Cb 0.11 0.47 -0.08 0.00 -1.09 0.00 0.00 33.01 32.41 2wcg s GLN 440 CO 0.53 -0.48 1.44 0.15 -1.32 0.00 0.00 175.29 175.61 2wcg s LYS 441 N -3.40 3.63 0.24 9.60 3.01 -1.26 -5.00 119.74 126.56 2wcg s LYS 441 Ca 0.05 2.45 -0.21 0.00 -1.01 0.00 0.00 55.97 57.25 2wcg s LYS 441 Cb -0.01 -2.63 0.03 0.00 -1.01 0.00 0.00 37.83 34.21 2wcg s LYS 441 CO -0.07 -0.87 0.67 0.54 0.51 0.00 0.00 175.35 176.12 2wcg s ASN 442 N -0.49 -0.32 -0.19 2.83 2.20 -1.26 -5.05 114.94 112.66 2wcg s ASN 442 Ca 0.62 -0.47 0.15 0.00 -0.94 0.00 0.00 52.86 52.22 2wcg s ASN 442 Cb -0.44 0.68 0.69 0.00 -2.00 0.00 0.00 41.25 40.18 2wcg s ASN 442 CO 0.57 -1.23 1.61 0.47 -2.94 0.00 0.00 177.10 175.57 2wcg n ASP 443 N -0.43 4.87 -4.88 3.54 8.00 -1.26 -4.98 116.55 121.41 2wcg n ASP 443 Ca -0.07 -2.85 -0.32 0.00 0.71 0.00 0.00 54.79 52.26 2wcg n ASP 443 Cb 0.61 -0.60 -0.05 0.00 -0.02 0.00 0.00 41.12 41.05 2wcg n ASP 443 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 2wcg s LEU 444 N -2.57 4.22 -0.17 0.64 1.43 -1.26 -2.48 118.68 118.48 2wcg s LEU 444 Ca 0.49 0.81 -0.07 0.00 -1.03 0.00 0.00 54.13 54.34 2wcg s LEU 444 Cb 0.37 -3.49 -0.04 0.00 0.03 0.00 0.00 46.19 43.06 2wcg s LEU 444 CO 0.15 -0.00 0.04 -1.81 0.23 0.00 0.00 176.35 174.96 2wcg s ASP 445 N -2.30 5.46 -0.01 2.29 1.01 0.09 -4.97 116.67 118.25 2wcg s ASP 445 Ca 0.44 0.04 -0.08 0.00 0.71 0.00 0.00 52.55 53.66 2wcg s ASP 445 Cb -0.12 -1.92 0.01 0.00 1.01 0.00 0.00 42.92 41.90 2wcg s ASP 445 CO 0.22 0.18 0.17 0.00 0.21 0.00 0.00 175.17 175.94 2wcg s ALA 446 N 0.33 -0.40 -0.02 5.23 0.00 -1.26 -0.38 121.76 125.27 2wcg s ALA 446 Ca 0.02 0.04 -0.04 0.00 0.00 0.00 0.00 51.96 51.98 2wcg s ALA 446 Cb -0.13 0.03 0.00 0.00 0.00 0.00 0.00 23.12 23.03 2wcg s ALA 446 CO 0.01 -0.19 0.08 0.54 0.00 0.00 0.00 175.76 176.20 2wcg s VAL 447 N -1.11 0.04 -0.05 0.00 0.11 -0.63 -4.99 120.40 113.78 2wcg s VAL 447 Ca -0.12 -0.31 0.05 0.00 -2.93 0.00 0.00 61.98 58.67 2wcg s VAL 447 Cb -0.06 -0.23 -0.02 0.00 -1.53 0.00 0.00 36.38 34.54 2wcg s VAL 447 CO 0.02 -0.17 -0.18 0.00 -3.33 0.00 0.00 175.10 171.43 2wcg s ALA 448 N -0.53 2.50 0.07 1.54 0.00 -1.26 -1.31 121.76 122.76 2wcg s ALA 448 Ca -0.06 -1.02 0.00 0.00 0.00 0.00 0.00 51.96 50.89 2wcg s ALA 448 Cb -0.04 -0.85 -0.04 0.00 0.00 0.00 0.00 23.12 22.19 2wcg s ALA 448 CO 0.00 0.53 -0.05 -0.51 0.00 0.00 0.00 175.76 175.73 2wcg s LEU 449 N -0.62 2.49 -0.18 0.00 1.02 0.09 -1.70 118.68 119.80 2wcg s LEU 449 Ca 0.09 -0.99 -0.05 0.00 0.02 0.00 0.00 54.13 53.20 2wcg s LEU 449 Cb -0.11 0.06 -0.03 0.00 0.02 0.00 0.00 46.19 46.13 2wcg s LEU 449 CO 0.00 -0.52 -0.01 -0.04 0.02 0.00 0.00 176.35 175.81 2wcg s MET 450 N -3.81 3.69 0.78 1.70 -1.94 0.14 -1.31 119.30 118.54 2wcg s MET 450 Ca 0.09 -0.50 -0.12 0.00 -1.71 0.00 0.00 55.69 53.45 2wcg s MET 450 Cb 0.06 -3.03 0.07 0.00 2.01 0.00 0.00 34.83 33.94 2wcg s MET 450 CO -0.07 0.14 1.13 -1.01 -0.01 0.00 0.00 175.02 175.20 2wcg s HIS 451 N 0.66 2.26 0.26 -0.03 3.76 -0.31 -0.44 115.29 121.46 2wcg s HIS 451 Ca -0.01 1.62 -0.01 0.00 -0.15 0.00 0.00 55.06 56.52 2wcg s HIS 451 Cb -0.14 -3.21 0.53 0.00 1.11 0.00 0.00 32.58 30.87 2wcg s HIS 451 CO 0.02 -2.16 1.78 -1.35 -0.85 0.00 0.00 174.74 172.18 2wcg h PRO 452 N -1.00 0.69 0.00 8.40 0.11 -1.89 0.49 132.00 138.80 2wcg h PRO 452 Ca -0.45 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.62 2wcg h PRO 452 Cb 1.25 -0.15 0.00 0.00 0.11 0.00 0.00 31.00 32.21 2wcg h PRO 452 CO 0.49 0.45 0.00 -0.40 -0.21 0.00 0.00 178.00 178.33 2wcg n ASP 453 N -4.81 0.00 0.00 -2.05 5.68 -1.26 -4.87 116.55 109.24 2wcg n ASP 453 Ca 0.17 -0.23 0.00 0.00 -0.50 0.00 0.00 54.79 54.23 2wcg n ASP 453 Cb 0.41 -0.07 0.00 0.00 -1.14 0.00 0.00 41.12 40.32 2wcg n ASP 453 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2wcg n GLY 454 N -0.32 1.15 3.80 6.12 0.00 0.16 -4.94 105.19 111.16 2wcg n GLY 454 Ca 0.08 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.80 2wcg n GLY 454 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2wcg s SER 455 N -3.08 4.53 0.04 1.61 1.04 -1.26 -4.47 113.70 112.11 2wcg s SER 455 Ca 0.00 1.33 -0.00 0.00 0.48 0.00 0.00 55.95 57.76 2wcg s SER 455 Cb 0.00 -2.07 -0.04 0.00 0.10 0.00 0.00 66.02 64.01 2wcg s SER 455 CO 0.00 -1.95 0.16 0.00 0.98 0.00 0.00 173.24 172.43 2wcg s ALA 456 N -3.15 3.86 -0.06 5.32 0.00 0.19 -1.16 121.76 126.76 2wcg s ALA 456 Ca 0.61 -0.86 0.00 0.00 0.00 0.00 0.00 51.96 51.71 2wcg s ALA 456 Cb -0.14 -1.74 0.02 0.00 0.00 0.00 0.00 23.12 21.26 2wcg s ALA 456 CO 0.54 0.78 -0.03 0.08 0.00 0.00 0.00 175.76 177.13 2wcg s VAL 457 N -1.40 0.54 -0.07 0.00 1.01 -0.43 -1.86 120.40 118.19 2wcg s VAL 457 Ca 0.30 -0.05 0.03 0.00 0.00 0.00 0.00 61.98 62.26 2wcg s VAL 457 Cb -0.13 -0.61 0.01 0.00 0.00 0.00 0.00 36.38 35.66 2wcg s VAL 457 CO 0.23 0.25 -0.14 -0.69 0.00 0.00 0.00 175.10 174.75 2wcg s VAL 458 N 1.38 1.28 -0.13 2.92 1.01 0.01 -0.73 120.40 126.13 2wcg s VAL 458 Ca -0.04 -0.57 -0.02 0.00 0.00 0.00 0.00 61.98 61.36 2wcg s VAL 458 Cb -0.13 -1.15 -0.02 0.00 0.00 0.00 0.00 36.38 35.07 2wcg s VAL 458 CO -0.03 0.39 -0.08 -0.69 0.00 0.00 0.00 175.10 174.69 2wcg s VAL 459 N 0.55 3.54 -0.15 2.92 1.01 -0.43 -0.60 120.40 127.25 2wcg s VAL 459 Ca -0.14 -0.49 -0.00 0.00 0.00 0.00 0.00 61.98 61.34 2wcg s VAL 459 Cb -0.16 -2.51 0.03 0.00 0.00 0.00 0.00 36.38 33.74 2wcg s VAL 459 CO 0.04 0.52 -0.09 -0.69 0.00 0.00 0.00 175.10 174.88 2wcg s VAL 460 N 0.17 1.30 -0.17 2.92 1.01 -0.26 -1.61 120.40 123.76 2wcg s VAL 460 Ca -0.04 -0.60 -0.05 0.00 0.00 0.00 0.00 61.98 61.29 2wcg s VAL 460 Cb -0.14 -1.34 -0.03 0.00 0.00 0.00 0.00 36.38 34.87 2wcg s VAL 460 CO 0.04 0.29 0.00 -0.22 0.00 0.00 0.00 175.10 175.21 2wcg s LEU 461 N 1.58 3.45 -0.38 3.92 2.96 0.49 -0.90 118.68 129.79 2wcg s LEU 461 Ca 0.03 -0.06 -0.16 0.00 -0.22 0.00 0.00 54.13 53.72 2wcg s LEU 461 Cb -0.14 -1.85 0.01 0.00 0.50 0.00 0.00 46.19 44.70 2wcg s LEU 461 CO -0.09 0.16 0.36 0.21 -1.32 0.00 0.00 176.35 175.68 2wcg s ASN 462 N 0.43 6.16 0.00 3.68 3.84 -0.31 -0.73 114.94 128.00 2wcg s ASN 462 Ca -0.01 -0.54 0.29 0.00 0.21 0.00 0.00 52.86 52.81 2wcg s ASN 462 Cb -0.14 -2.19 1.17 0.00 -0.55 0.00 0.00 41.25 39.55 2wcg s ASN 462 CO 0.02 -0.43 1.87 0.54 -2.79 0.00 0.00 177.10 176.31 2wcg n ARG 463 N 5.39 0.07 -3.78 0.43 1.74 -1.04 -2.39 116.66 117.08 2wcg n ARG 463 Ca -0.09 -0.01 -0.23 0.00 -0.77 0.00 0.00 57.85 56.75 2wcg n ARG 463 Cb 0.48 -1.50 -0.04 0.00 -1.02 0.00 0.00 32.46 30.38 2wcg n ARG 463 CO 0.00 0.00 0.00 -1.54 -1.52 0.00 0.00 177.63 174.57 2wcg s SER 464 N -2.94 4.80 0.00 0.55 1.04 -1.26 -4.83 113.70 111.07 2wcg s SER 464 Ca 0.16 -0.90 0.29 0.00 0.48 0.00 0.00 55.95 55.97 2wcg s SER 464 Cb 0.19 -0.44 1.27 0.00 0.10 0.00 0.00 66.02 67.14 2wcg s SER 464 CO 0.54 -0.66 1.91 -1.54 0.98 0.00 0.00 173.24 174.47 2wcg n SER 465 N -1.47 0.19 -4.80 7.02 3.41 -1.26 -1.02 113.62 115.68 2wcg n SER 465 Ca 0.02 -0.12 -0.38 0.00 -0.26 0.00 0.00 58.87 58.12 2wcg n SER 465 Cb 0.63 -0.23 -0.06 0.00 -0.26 0.00 0.00 64.21 64.29 2wcg n SER 465 CO 0.00 0.00 0.00 -0.54 -0.16 0.00 0.00 175.04 174.34 2wcg s LYS 466 N -2.69 4.06 0.17 4.33 3.01 -1.26 -4.21 119.74 123.16 2wcg s LYS 466 Ca 0.23 0.45 -0.31 0.00 -1.01 0.00 0.00 55.97 55.34 2wcg s LYS 466 Cb 0.20 -3.28 -0.09 0.00 -1.01 0.00 0.00 37.83 33.65 2wcg s LYS 466 CO 0.50 0.55 1.37 -0.51 0.51 0.00 0.00 175.35 177.78 2wcg s ASP 467 N -0.64 6.82 -0.31 2.83 1.01 -1.26 -3.51 116.67 121.60 2wcg s ASP 467 Ca 0.25 2.42 0.03 0.00 0.71 0.00 0.00 52.55 55.96 2wcg s ASP 467 Cb -0.17 -2.60 0.08 0.00 1.01 0.00 0.00 42.92 41.25 2wcg s ASP 467 CO 0.13 -0.62 -0.01 -0.69 0.21 0.00 0.00 175.17 174.20 2wcg s VAL 468 N 0.52 2.26 0.42 -1.27 1.01 -0.07 -4.91 120.40 118.36 2wcg s VAL 468 Ca 0.61 -2.07 -0.25 0.00 0.00 0.00 0.00 61.98 60.27 2wcg s VAL 468 Cb -0.38 -2.55 -0.08 0.00 0.00 0.00 0.00 36.38 33.37 2wcg s VAL 468 CO 0.36 -0.38 1.25 -2.16 0.00 0.00 0.00 175.10 174.16 2wcg s PRO 469 N 0.98 3.91 0.20 2.72 0.04 -1.26 -0.58 135.00 141.01 2wcg s PRO 469 Ca 0.03 2.02 -0.17 0.00 0.04 0.00 0.00 61.00 62.93 2wcg s PRO 469 Cb -0.19 -2.66 0.02 0.00 0.04 0.00 0.00 34.50 31.71 2wcg s PRO 469 CO -0.07 -0.50 0.51 -0.48 0.04 0.00 0.00 177.00 176.51 2wcg s LEU 470 N -2.59 0.15 -0.00 -3.56 2.34 -0.23 -4.30 118.68 110.49 2wcg s LEU 470 Ca 0.59 -0.56 0.06 0.00 0.06 0.00 0.00 54.13 54.28 2wcg s LEU 470 Cb -0.35 2.06 -0.02 0.00 -0.56 0.00 0.00 46.19 47.32 2wcg s LEU 470 CO 0.44 -1.06 -0.20 -0.89 -1.06 0.00 0.00 176.35 173.57 2wcg s THR 471 N -3.90 1.61 -0.18 5.48 2.01 -0.68 -0.50 115.64 119.48 2wcg s THR 471 Ca 0.11 -0.93 -0.04 0.00 0.31 0.00 0.00 61.69 61.15 2wcg s THR 471 Cb -0.01 -1.35 -0.02 0.00 0.01 0.00 0.00 72.50 71.13 2wcg s THR 471 CO -0.01 0.41 -0.04 -0.63 -0.69 0.00 0.00 174.62 173.66 2wcg s ILE 472 N -0.53 3.64 -0.22 1.82 1.01 -0.49 -0.51 121.20 125.91 2wcg s ILE 472 Ca 0.08 -0.43 -0.08 0.00 0.00 0.00 0.00 60.65 60.22 2wcg s ILE 472 Cb -0.08 -2.62 -0.04 0.00 0.01 0.00 0.00 42.46 39.73 2wcg s ILE 472 CO -0.00 0.46 0.09 -0.75 0.00 0.00 0.00 174.94 174.73 2wcg s LYS 473 N 0.85 3.87 -0.36 2.79 2.20 0.93 -1.33 119.74 128.69 2wcg s LYS 473 Ca -0.01 -0.38 -0.10 0.00 -0.36 0.00 0.00 55.97 55.12 2wcg s LYS 473 Cb -0.15 -3.33 0.03 0.00 -1.51 0.00 0.00 37.83 32.87 2wcg s LYS 473 CO 0.01 0.04 0.18 0.34 -0.36 0.00 0.00 175.35 175.57 2wcg s ASP 474 N 1.02 5.62 0.18 1.43 -1.08 -0.76 -0.45 116.67 122.63 2wcg s ASP 474 Ca 0.05 -0.97 -0.32 0.00 -0.52 0.00 0.00 52.55 50.78 2wcg s ASP 474 Cb -0.14 -1.99 -0.12 0.00 -1.46 0.00 0.00 42.92 39.21 2wcg s ASP 474 CO 0.03 -0.35 1.71 -2.65 0.52 0.00 0.00 175.17 174.43 2wcg n PRO 475 N 4.96 2.63 -1.01 4.34 -0.02 -1.26 -1.45 135.00 143.18 2wcg n PRO 475 Ca -0.12 0.95 -0.00 0.00 -2.02 0.00 0.00 63.50 62.31 2wcg n PRO 475 Cb 0.46 -2.79 -0.00 0.00 -0.02 0.00 0.00 33.50 31.15 2wcg n PRO 475 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2wcg n ALA 476 N 4.14 -0.00 -0.03 3.55 0.00 -1.26 -4.78 120.51 122.12 2wcg n ALA 476 Ca 0.17 0.01 -0.05 0.00 0.00 0.00 0.00 53.44 53.56 2wcg n ALA 476 Cb 0.34 -1.23 -0.03 0.00 0.00 0.00 0.00 19.45 18.53 2wcg n ALA 476 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 177.50 179.05 2wcg n VAL 477 N -2.19 0.35 -0.42 0.00 3.14 -0.63 -5.14 118.33 113.44 2wcg n VAL 477 Ca -0.00 -0.12 0.00 0.00 -2.96 0.00 0.00 64.34 61.26 2wcg n VAL 477 Cb 0.41 -1.03 0.00 0.00 -1.06 0.00 0.00 33.84 32.16 2wcg n VAL 477 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 2wcg n GLY 478 N 2.99 0.77 3.32 7.55 0.00 -0.53 -4.84 105.19 114.44 2wcg n GLY 478 Ca -0.12 -1.83 -0.31 0.00 0.00 0.00 0.00 46.02 43.77 2wcg n GLY 478 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2wcg s PHE 479 N -2.33 2.34 -0.26 1.61 0.40 0.14 -1.83 117.98 118.06 2wcg s PHE 479 Ca 0.00 -0.43 -0.04 0.00 -0.60 0.00 0.00 56.93 55.87 2wcg s PHE 479 Cb 0.00 -1.49 0.01 0.00 0.51 0.00 0.00 43.02 42.05 2wcg s PHE 479 CO 0.00 -0.02 -0.02 -0.51 0.70 0.00 0.00 175.22 175.37 2wcg s LEU 480 N -0.66 3.32 -0.16 -0.37 1.02 -0.44 -0.53 118.68 120.87 2wcg s LEU 480 Ca 0.10 -0.73 -0.15 0.00 0.02 0.00 0.00 54.13 53.37 2wcg s LEU 480 Cb -0.10 -1.74 -0.04 0.00 0.02 0.00 0.00 46.19 44.32 2wcg s LEU 480 CO -0.01 -0.13 0.34 -1.61 0.02 0.00 0.00 176.35 174.97 2wcg s GLU 481 N 1.40 4.26 0.36 1.70 0.41 -1.26 -1.40 118.70 124.17 2wcg s GLU 481 Ca 0.02 0.18 -0.06 0.00 -0.41 0.00 0.00 54.97 54.70 2wcg s GLU 481 Cb -0.16 -3.45 0.02 0.00 -1.78 0.00 0.00 34.13 28.76 2wcg s GLU 481 CO -0.02 0.18 0.57 -0.08 -0.49 0.00 0.00 175.26 175.42 2wcg s THR 482 N 0.63 0.00 -0.01 3.63 -1.32 0.34 -5.00 115.64 113.91 2wcg s THR 482 Ca 0.19 -1.42 0.02 0.00 -1.21 0.00 0.00 61.69 59.27 2wcg s THR 482 Cb -0.14 -2.71 -0.00 0.00 -1.51 0.00 0.00 72.50 68.14 2wcg s THR 482 CO 0.06 0.00 -0.08 -0.51 -2.21 0.00 0.00 174.62 171.88 2wcg s ILE 483 N -2.81 0.62 -0.47 5.08 -1.16 -1.26 -1.07 121.20 120.13 2wcg s ILE 483 Ca 0.26 -0.32 -0.10 0.00 -0.51 0.00 0.00 60.65 59.98 2wcg s ILE 483 Cb -0.02 -0.53 0.11 0.00 0.61 0.00 0.00 42.46 42.63 2wcg s ILE 483 CO 0.18 0.18 0.34 -0.55 -2.81 0.00 0.00 174.94 172.28 2wcg s SER 484 N -0.08 5.73 0.64 4.50 0.15 0.25 -4.94 113.70 119.95 2wcg s SER 484 Ca 0.02 -1.82 -0.18 0.00 0.70 0.00 0.00 55.95 54.66 2wcg s SER 484 Cb -0.04 -2.02 -0.01 0.00 -1.71 0.00 0.00 66.02 62.23 2wcg s SER 484 CO -0.00 -0.68 1.26 -2.84 1.20 0.00 0.00 173.24 172.19 2wcg s PRO 485 N 1.39 2.60 0.27 5.44 0.02 -1.26 -0.89 135.00 142.57 2wcg s PRO 485 Ca 0.05 1.98 -0.30 0.00 0.02 0.00 0.00 61.00 62.75 2wcg s PRO 485 Cb -0.26 -1.86 -0.14 0.00 0.02 0.00 0.00 34.50 32.26 2wcg s PRO 485 CO 0.00 -1.53 1.17 0.41 -0.33 0.00 0.00 177.00 176.72 2wcg n GLY 486 N 0.75 0.17 4.02 0.52 0.00 -1.23 -1.66 105.19 107.76 2wcg n GLY 486 Ca 0.15 0.40 0.00 0.00 0.00 0.00 0.00 46.02 46.57 2wcg n GLY 486 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 2wcg n TYR 487 N 0.84 0.00 -1.26 1.61 0.53 -0.19 -4.78 117.16 113.90 2wcg n TYR 487 Ca 0.10 0.00 -0.30 0.00 -1.02 0.00 0.00 57.90 56.68 2wcg n TYR 487 Cb 0.31 -0.36 0.13 0.00 -1.03 0.00 0.00 39.34 38.39 2wcg n TYR 487 CO 0.00 0.00 0.00 -1.54 -1.02 0.00 0.00 176.86 174.30 2wcg s SER 488 N -2.52 3.59 -0.05 7.72 1.04 -0.67 -4.62 113.70 118.19 2wcg s SER 488 Ca 0.00 1.44 0.02 0.00 0.48 0.00 0.00 55.95 57.89 2wcg s SER 488 Cb 0.00 -2.13 0.02 0.00 0.10 0.00 0.00 66.02 64.01 2wcg s SER 488 CO 0.00 -2.56 -0.09 -0.51 0.98 0.00 0.00 173.24 171.07 2wcg s ILE 489 N -2.97 0.86 0.02 -1.02 2.07 -0.58 -1.17 121.20 118.41 2wcg s ILE 489 Ca 0.63 -0.32 0.08 0.00 -1.41 0.00 0.00 60.65 59.63 2wcg s ILE 489 Cb -0.17 -0.82 -0.02 0.00 0.13 0.00 0.00 42.46 41.57 2wcg s ILE 489 CO 0.56 0.29 -0.25 -1.00 -1.91 0.00 0.00 174.94 172.64 2wcg s HIS 490 N 0.75 2.19 -0.09 3.50 3.76 -0.08 -1.72 115.29 123.60 2wcg s HIS 490 Ca -0.13 -0.41 0.04 0.00 -0.15 0.00 0.00 55.06 54.41 2wcg s HIS 490 Cb -0.15 -1.35 0.00 0.00 1.11 0.00 0.00 32.58 32.19 2wcg s HIS 490 CO 0.02 0.06 -0.22 0.99 -0.85 0.00 0.00 174.74 174.74 2wcg s THR 491 N -0.72 1.93 -0.10 1.30 2.01 -0.37 -1.10 115.64 118.59 2wcg s THR 491 Ca 0.10 -0.95 0.01 0.00 0.31 0.00 0.00 61.69 61.16 2wcg s THR 491 Cb -0.10 -1.67 -0.02 0.00 0.01 0.00 0.00 72.50 70.73 2wcg s THR 491 CO 0.01 0.53 -0.12 -0.31 -0.69 0.00 0.00 174.62 174.04 2wcg s TYR 492 N 0.31 2.80 -0.04 4.92 1.51 0.24 -0.59 117.35 126.50 2wcg s TYR 492 Ca -0.16 -0.43 0.03 0.00 -1.01 0.00 0.00 57.07 55.50 2wcg s TYR 492 Cb -0.17 -1.78 0.00 0.00 -0.11 0.00 0.00 41.96 39.90 2wcg s TYR 492 CO 0.07 -0.05 -0.12 -0.51 -1.11 0.00 0.00 175.55 173.83 2wcg s LEU 493 N -0.04 1.81 0.02 -1.29 1.43 -0.20 -0.81 118.68 119.60 2wcg s LEU 493 Ca -0.03 -0.26 -0.14 0.00 -1.03 0.00 0.00 54.13 52.68 2wcg s LEU 493 Cb -0.14 -0.74 0.02 0.00 0.03 0.00 0.00 46.19 45.36 2wcg s LEU 493 CO 0.04 0.09 0.30 -1.66 0.23 0.00 0.00 176.35 175.35 2wcg s TRP 494 N 0.21 -0.13 -0.15 0.29 -2.14 -0.78 -1.01 118.94 115.24 2wcg s TRP 494 Ca -0.05 0.08 -0.28 0.00 2.66 0.00 0.00 56.10 58.52 2wcg s TRP 494 Cb -0.11 0.09 -0.01 0.00 -3.10 0.00 0.00 33.47 30.34 2wcg s TRP 494 CO 0.01 -0.45 0.94 -1.01 -2.66 0.00 0.00 176.95 173.78 2wcg s HIS 495 N -2.02 3.46 -0.26 1.66 3.76 -1.26 -0.64 115.29 119.98 2wcg s HIS 495 Ca -0.09 1.44 -0.03 0.00 -0.15 0.00 0.00 55.06 56.24 2wcg s HIS 495 Cb -0.03 -3.13 -0.16 0.00 1.11 0.00 0.00 32.58 30.38 2wcg s HIS 495 CO -0.00 -0.26 -0.24 0.54 -0.85 0.00 0.00 174.74 173.93 2wcg n ARG 496 N 5.25 0.64 0.30 1.40 1.74 -1.26 -4.40 116.66 120.33 2wcg n ARG 496 Ca 0.07 0.19 0.20 0.00 -0.77 0.00 0.00 57.85 57.54 2wcg n ARG 496 Cb 0.48 -1.52 1.03 0.00 -1.02 0.00 0.00 32.46 31.43 2wcg n ARG 496 CO 0.00 0.00 0.00 -0.56 -1.52 0.00 0.00 177.63 175.55 2wcg h GLN 497 N -0.27 0.00 0.00 5.56 -0.00 -1.91 -3.49 115.11 115.00 2wcg h GLN 497 Ca -0.61 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.04 2wcg h GLN 497 Cb 1.83 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 29.31 2wcg h GLN 497 CO -0.17 0.00 0.00 1.28 -0.00 0.00 0.00 178.83 179.94