#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2zm3 s PHE 981 N 0.00 3.62 0.24 7.33 5.36 -1.26 -4.86 117.98 128.41 2zm3 s PHE 981 Ca 0.00 1.25 -0.05 0.00 -0.96 0.00 0.00 56.93 57.17 2zm3 s PHE 981 Cb 0.00 -2.75 0.02 0.00 -0.34 0.00 0.00 43.02 39.95 2zm3 s PHE 981 CO 0.00 0.17 0.40 -1.13 -1.46 0.00 0.00 175.22 173.21 2zm3 n SER 982 N 3.42 -1.16 -0.02 6.13 3.41 -1.26 -5.04 113.62 119.11 2zm3 n SER 982 Ca -0.03 -2.10 0.16 0.00 -0.26 0.00 0.00 58.87 56.64 2zm3 n SER 982 Cb 0.51 2.01 0.61 0.00 -0.26 0.00 0.00 64.21 67.09 2zm3 n SER 982 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2zm3 h ALA 983 N 1.91 2.28 0.00 7.33 0.00 -1.96 -0.87 119.26 127.95 2zm3 h ALA 983 Ca -0.19 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.70 2zm3 h ALA 983 Cb 0.77 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.55 2zm3 h ALA 983 CO 0.25 -0.42 -0.01 0.00 0.00 0.00 0.00 179.25 179.07 2zm3 h ALA 984 N 1.74 1.01 0.00 0.00 0.00 -1.93 -1.59 119.26 118.49 2zm3 h ALA 984 Ca 0.25 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.15 2zm3 h ALA 984 Cb 0.78 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.57 2zm3 h ALA 984 CO -0.04 0.01 0.00 -0.44 0.00 0.00 0.00 179.25 178.79 2zm3 h ASP 985 N 0.00 0.00 0.00 0.00 3.32 -1.42 -3.37 116.42 114.95 2zm3 h ASP 985 Ca -0.00 0.00 -0.11 0.00 0.02 0.00 0.00 57.03 56.94 2zm3 h ASP 985 Cb 0.40 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 39.94 2zm3 h ASP 985 CO 0.00 0.00 -1.41 0.52 -1.72 0.00 0.00 179.24 176.63 2zm3 n VAL 986 N -2.77 0.41 1.20 -1.35 0.31 -0.70 -4.77 118.33 110.66 2zm3 n VAL 986 Ca 0.03 -0.16 0.13 0.00 -0.01 0.00 0.00 64.34 64.33 2zm3 n VAL 986 Cb 0.41 -0.79 0.36 0.00 -0.91 0.00 0.00 33.84 32.90 2zm3 n VAL 986 CO 0.00 0.00 0.00 -1.22 -1.32 0.00 0.00 176.83 174.29 2zm3 n TYR 987 N -2.74 0.00 -4.64 3.52 4.01 -0.68 -4.79 117.16 111.84 2zm3 n TYR 987 Ca -0.13 0.00 -0.25 0.00 -0.16 0.00 0.00 57.90 57.36 2zm3 n TYR 987 Cb 0.63 -0.15 -0.16 0.00 -0.31 0.00 0.00 39.34 39.35 2zm3 n TYR 987 CO 0.00 0.00 0.00 0.14 -0.46 0.00 0.00 176.86 176.54 2zm3 s VAL 988 N -2.59 1.20 0.43 -0.72 -7.23 -1.26 -4.81 120.40 105.42 2zm3 s VAL 988 Ca 0.22 -0.53 -0.26 0.00 -1.81 0.00 0.00 61.98 59.60 2zm3 s VAL 988 Cb 0.19 -1.08 -0.09 0.00 0.56 0.00 0.00 36.38 35.95 2zm3 s VAL 988 CO 0.55 0.37 1.44 -2.65 -0.31 0.00 0.00 175.10 174.50 2zm3 n PRO 989 N 3.71 2.34 0.00 4.82 -0.02 -1.26 -4.88 135.00 139.71 2zm3 n PRO 989 Ca -0.22 0.83 0.07 0.00 -2.02 0.00 0.00 63.50 62.16 2zm3 n PRO 989 Cb 0.52 -2.63 0.31 0.00 -0.02 0.00 0.00 33.50 31.68 2zm3 n PRO 989 CO 0.00 0.00 0.00 -0.25 1.98 0.00 0.00 175.50 177.23 2zm3 n ASP 990 N 0.01 0.00 -0.65 2.55 9.92 -1.26 -2.09 116.55 125.03 2zm3 n ASP 990 Ca 0.04 0.46 0.12 0.00 -0.53 0.00 0.00 54.79 54.89 2zm3 n ASP 990 Cb 0.41 -0.48 0.37 0.00 -0.64 0.00 0.00 41.12 40.78 2zm3 n ASP 990 CO 0.00 0.00 0.00 -0.62 0.13 0.00 0.00 177.20 176.71 2zm3 n GLU 991 N -1.48 1.88 0.00 -1.24 1.02 -1.26 -2.82 120.64 116.74 2zm3 n GLU 991 Ca 0.04 -1.30 0.10 0.00 -0.02 0.00 0.00 57.16 55.98 2zm3 n GLU 991 Cb 0.16 -1.45 -0.06 0.00 -0.02 0.00 0.00 31.44 30.07 2zm3 n GLU 991 CO 0.00 0.00 0.00 0.91 1.18 0.00 0.00 177.13 179.22 2zm3 n TRP 992 N 0.55 0.00 -1.84 -0.32 7.02 -0.89 -5.01 117.44 116.96 2zm3 n TRP 992 Ca 0.17 0.00 -0.39 0.00 -1.02 0.00 0.00 57.50 56.26 2zm3 n TRP 992 Cb 0.41 -0.03 0.02 0.00 -2.42 0.00 0.00 31.31 29.29 2zm3 n TRP 992 CO 0.00 0.00 0.00 -2.00 -2.02 0.00 0.00 177.69 173.67 2zm3 s GLU 993 N -2.97 3.56 -0.01 -0.99 2.56 -1.13 -1.59 118.70 118.13 2zm3 s GLU 993 Ca 0.09 2.32 0.02 0.00 0.00 0.00 0.00 54.97 57.39 2zm3 s GLU 993 Cb 0.16 -2.54 -0.00 0.00 2.00 0.00 0.00 34.13 33.75 2zm3 s GLU 993 CO 0.83 -0.88 -0.05 0.54 -0.56 0.00 0.00 175.26 175.13 2zm3 s VAL 994 N -1.25 0.45 0.32 3.70 0.11 0.11 -4.77 120.40 119.07 2zm3 s VAL 994 Ca 0.64 -0.22 -0.29 0.00 -2.93 0.00 0.00 61.98 59.18 2zm3 s VAL 994 Cb -0.42 -0.40 -0.11 0.00 -1.53 0.00 0.00 36.38 33.93 2zm3 s VAL 994 CO 0.52 0.14 1.49 0.00 -3.33 0.00 0.00 175.10 173.92 2zm3 s ALA 995 N 0.02 3.63 0.45 1.54 0.00 -1.26 -4.26 121.76 121.87 2zm3 s ALA 995 Ca 0.00 1.49 0.12 0.00 0.00 0.00 0.00 51.96 53.56 2zm3 s ALA 995 Cb -0.04 -3.60 1.02 0.00 0.00 0.00 0.00 23.12 20.51 2zm3 s ALA 995 CO -0.00 -0.92 2.06 -0.09 0.00 0.00 0.00 175.76 176.81 2zm3 h ARG 996 N 4.04 0.35 0.00 0.00 2.43 -1.95 -1.09 114.38 118.17 2zm3 h ARG 996 Ca -0.48 -0.02 0.00 0.00 -0.81 0.00 0.00 59.98 58.66 2zm3 h ARG 996 Cb 1.23 -0.08 0.00 0.00 -0.42 0.00 0.00 29.97 30.70 2zm3 h ARG 996 CO 0.72 0.23 0.00 0.39 -1.51 0.00 0.00 179.97 179.80 2zm3 n GLU 997 N -4.48 0.96 -0.18 0.20 1.02 -1.26 -1.89 120.64 115.00 2zm3 n GLU 997 Ca 0.03 0.00 0.11 0.00 -0.02 0.00 0.00 57.16 57.28 2zm3 n GLU 997 Cb 0.16 -1.48 0.27 0.00 -0.02 0.00 0.00 31.44 30.37 2zm3 n GLU 997 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 2zm3 n LYS 998 N -0.98 2.22 -4.73 3.49 5.02 -0.41 -4.89 118.16 117.87 2zm3 n LYS 998 Ca 0.22 -1.86 -0.29 0.00 -2.02 0.00 0.00 58.31 54.36 2zm3 n LYS 998 Cb 0.10 -1.46 -0.17 0.00 -0.02 0.00 0.00 35.03 33.49 2zm3 n LYS 998 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 2zm3 s ILE 999 N -1.52 1.61 -0.06 -0.18 -1.09 -0.79 -1.34 121.20 117.83 2zm3 s ILE 999 Ca 0.36 -0.74 0.03 0.00 -2.23 0.00 0.00 60.65 58.08 2zm3 s ILE 999 Cb 0.20 -1.44 0.01 0.00 -1.58 0.00 0.00 42.46 39.65 2zm3 s ILE 999 CO 0.28 0.46 -0.14 0.28 -1.23 0.00 0.00 174.94 174.59 2zm3 s THR 1000N 0.69 1.27 -0.05 2.92 -1.32 -0.96 -5.01 115.64 113.18 2zm3 s THR 1000Ca -0.12 -0.59 -0.04 0.00 -1.21 0.00 0.00 61.69 59.73 2zm3 s THR 1000Cb -0.16 -1.13 -0.04 0.00 -1.51 0.00 0.00 72.50 69.66 2zm3 s THR 1000CO 0.03 0.38 0.14 -0.04 -2.21 0.00 0.00 174.62 172.92 2zm3 s MET 1001N 0.40 3.35 0.00 7.08 -1.94 -1.26 -1.79 119.30 125.15 2zm3 s MET 1001Ca -0.11 -0.28 0.00 0.00 -1.71 0.00 0.00 55.69 53.59 2zm3 s MET 1001Cb -0.14 -3.07 0.00 0.00 2.01 0.00 0.00 34.83 33.62 2zm3 s MET 1001CO 0.03 0.71 0.00 0.45 -0.01 0.00 0.00 175.02 176.20 2zm3 n SER 1002N 1.42 3.83 -3.60 3.03 2.88 0.11 -4.98 113.62 116.31 2zm3 n SER 1002Ca -0.15 0.00 -0.03 0.00 -1.33 0.00 0.00 58.87 57.36 2zm3 n SER 1002Cb 0.53 0.07 -0.02 0.00 -0.75 0.00 0.00 64.21 64.05 2zm3 n SER 1002CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2zm3 s ARG 1003N -1.92 0.41 0.20 -1.46 1.70 -1.24 -4.98 118.95 111.65 2zm3 s ARG 1003Ca 0.00 -0.18 -0.30 0.00 -0.47 0.00 0.00 55.73 54.78 2zm3 s ARG 1003Cb 0.00 0.17 -0.08 0.00 -0.57 0.00 0.00 34.95 34.47 2zm3 s ARG 1003CO 0.00 -0.18 1.07 -1.21 -1.08 0.00 0.00 175.30 173.90 2zm3 s GLU 1004N -2.52 4.64 -0.16 3.89 2.02 -1.26 -0.91 118.70 124.40 2zm3 s GLU 1004Ca 0.10 1.68 0.11 0.00 0.02 0.00 0.00 54.97 56.89 2zm3 s GLU 1004Cb 0.01 -3.27 -0.18 0.00 0.10 0.00 0.00 34.13 30.79 2zm3 s GLU 1004CO -0.04 0.16 0.01 1.28 0.02 0.00 0.00 175.26 176.69 2zm3 n LEU 1005N 2.10 0.53 0.00 1.80 4.77 0.76 -4.83 117.00 122.14 2zm3 n LEU 1005Ca 0.01 -0.02 0.00 0.00 -0.03 0.00 0.00 56.01 55.98 2zm3 n LEU 1005Cb 0.46 0.19 0.00 0.00 -2.33 0.00 0.00 43.42 41.74 2zm3 n LEU 1005CO 0.53 0.46 0.00 0.61 -1.33 0.00 0.00 177.39 177.66 2zm3 n GLY 1006N 2.15 2.52 3.69 -0.72 0.00 -1.15 -5.00 105.19 106.67 2zm3 n GLY 1006Ca -0.27 -1.09 -0.42 0.00 0.00 0.00 0.00 46.02 44.23 2zm3 n GLY 1006CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2zm3 s GLN 1007N -2.03 4.40 0.44 1.61 2.00 -1.26 0.18 119.66 124.99 2zm3 s GLN 1007Ca 0.00 1.46 0.01 0.00 -2.00 0.00 0.00 55.36 54.83 2zm3 s GLN 1007Cb 0.00 -3.55 0.08 0.00 0.80 0.00 0.00 33.01 30.34 2zm3 s GLN 1007CO 0.00 -0.36 0.60 0.41 -0.50 0.00 0.00 175.29 175.44 2zm3 n GLY 1008N 3.17 0.97 0.00 2.59 0.00 0.78 -4.88 105.19 107.82 2zm3 n GLY 1008Ca 0.09 -2.04 0.13 0.00 0.00 0.00 0.00 46.02 44.20 2zm3 n GLY 1008CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2zm3 n SER 1009N -2.86 0.00 0.00 1.61 3.41 -1.26 -3.68 113.62 110.84 2zm3 n SER 1009Ca 0.10 0.23 0.00 0.00 -0.26 0.00 0.00 58.87 58.94 2zm3 n SER 1009Cb 0.37 -0.40 0.00 0.00 -0.26 0.00 0.00 64.21 63.92 2zm3 n SER 1009CO 0.00 0.00 0.00 0.49 -0.16 0.00 0.00 175.04 175.37 2zm3 n PHE 1010N -1.40 0.00 -1.74 7.33 3.01 -1.26 -5.13 117.46 118.26 2zm3 n PHE 1010Ca 0.09 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.55 2zm3 n PHE 1010Cb 0.27 0.00 0.00 0.00 -0.01 0.00 0.00 39.48 39.74 2zm3 n PHE 1010CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 2zm3 n GLY 1011N 0.82 -1.53 3.77 1.37 0.00 -1.24 -4.74 105.19 103.63 2zm3 n GLY 1011Ca 0.00 -1.04 -0.38 0.00 0.00 0.00 0.00 46.02 44.60 2zm3 n GLY 1011CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 2zm3 s MET 1012N -1.36 4.00 -0.08 1.61 -2.45 -1.26 -0.15 119.30 119.61 2zm3 s MET 1012Ca 0.00 1.85 -0.02 0.00 -1.25 0.00 0.00 55.69 56.26 2zm3 s MET 1012Cb 0.00 -2.64 -0.03 0.00 1.25 0.00 0.00 34.83 33.41 2zm3 s MET 1012CO 0.00 -0.37 0.03 0.08 1.05 0.00 0.00 175.02 175.82 2zm3 s VAL 1013N -1.43 4.54 0.28 10.11 1.01 0.13 -3.07 120.40 131.97 2zm3 s VAL 1013Ca 0.58 -0.21 0.08 0.00 0.00 0.00 0.00 61.98 62.43 2zm3 s VAL 1013Cb -0.31 -2.94 -0.06 0.00 0.00 0.00 0.00 36.38 33.07 2zm3 s VAL 1013CO 0.38 0.57 -0.09 -0.31 0.00 0.00 0.00 175.10 175.66 2zm3 s TYR 1014N -0.95 2.03 0.12 5.22 2.02 0.60 -0.17 117.35 126.22 2zm3 s TYR 1014Ca 0.15 -0.61 -0.03 0.00 -0.37 0.00 0.00 57.07 56.21 2zm3 s TYR 1014Cb -0.11 -1.11 -0.05 0.00 -0.40 0.00 0.00 41.96 40.29 2zm3 s TYR 1014CO 0.04 0.39 0.31 -2.00 -1.57 0.00 0.00 175.55 172.72 2zm3 s GLU 1015N -3.68 3.54 0.34 -0.62 2.12 -0.09 0.28 118.70 120.60 2zm3 s GLU 1015Ca 0.29 -0.24 -0.17 0.00 0.36 0.00 0.00 54.97 55.21 2zm3 s GLU 1015Cb 0.02 -2.92 0.06 0.00 0.26 0.00 0.00 34.13 31.55 2zm3 s GLU 1015CO 0.12 0.52 0.84 0.20 -0.54 0.00 0.00 175.26 176.40 2zm3 s GLY 1016N -2.52 0.30 -0.07 -1.50 0.00 -0.12 -0.72 107.32 102.70 2zm3 s GLY 1016Ca 0.39 -0.65 0.05 0.00 0.00 0.00 0.00 44.72 44.50 2zm3 s GLY 1016CO 0.26 0.24 -0.22 0.14 0.00 0.00 0.00 173.10 173.53 2zm3 s VAL 1017N -2.32 1.86 -0.22 1.40 1.01 -0.74 -0.20 120.40 121.19 2zm3 s VAL 1017Ca 0.17 -0.93 -0.04 0.00 0.00 0.00 0.00 61.98 61.18 2zm3 s VAL 1017Cb -0.05 -1.60 -0.00 0.00 0.00 0.00 0.00 36.38 34.73 2zm3 s VAL 1017CO 0.10 0.52 -0.05 0.00 0.00 0.00 0.00 175.10 175.67 2zm3 s ALA 1018N 0.14 2.79 -0.68 5.51 0.00 0.29 -2.27 121.76 127.54 2zm3 s ALA 1018Ca -0.10 -1.20 -0.22 0.00 0.00 0.00 0.00 51.96 50.43 2zm3 s ALA 1018Cb -0.15 -1.69 0.08 0.00 0.00 0.00 0.00 23.12 21.35 2zm3 s ALA 1018CO 0.05 -0.47 0.96 0.15 0.00 0.00 0.00 175.76 176.45 2zm3 s LYS 1019N 1.46 3.15 0.00 0.00 1.02 -0.45 -1.24 119.74 123.68 2zm3 s LYS 1019Ca 0.05 -0.96 0.00 0.00 0.02 0.00 0.00 55.97 55.08 2zm3 s LYS 1019Cb -0.14 -4.30 0.00 0.00 -0.52 0.00 0.00 37.83 32.86 2zm3 s LYS 1019CO -0.04 -1.80 0.00 0.41 -0.92 0.00 0.00 175.35 173.01 2zm3 n GLY 1020N 5.35 0.62 0.00 -3.33 0.00 -0.48 -4.84 105.19 102.50 2zm3 n GLY 1020Ca -0.02 -0.53 0.00 0.00 0.00 0.00 0.00 46.02 45.47 2zm3 n GLY 1020CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 2zm3 n VAL 1021N -0.59 0.00 -4.20 1.61 0.24 -1.26 -5.05 118.33 109.08 2zm3 n VAL 1021Ca 0.00 -0.01 -0.28 0.00 -2.04 0.00 0.00 64.34 62.01 2zm3 n VAL 1021Cb 0.24 0.35 -0.08 0.00 -1.47 0.00 0.00 33.84 32.88 2zm3 n VAL 1021CO 0.00 0.00 0.00 -0.69 -2.14 0.00 0.00 176.83 174.00 2zm3 s VAL 1022N -0.11 3.72 -0.10 3.34 1.01 -1.26 -5.00 120.40 121.99 2zm3 s VAL 1022Ca 0.00 -1.34 -0.29 0.00 0.00 0.00 0.00 61.98 60.35 2zm3 s VAL 1022Cb 0.00 -2.84 -0.05 0.00 0.00 0.00 0.00 36.38 33.50 2zm3 s VAL 1022CO 0.00 -0.05 1.65 -0.54 0.00 0.00 0.00 175.10 176.17 2zm3 s LYS 1023N -2.75 4.06 0.00 2.72 1.02 -1.26 -2.75 119.74 120.78 2zm3 s LYS 1023Ca 0.26 2.05 0.00 0.00 0.02 0.00 0.00 55.97 58.30 2zm3 s LYS 1023Cb -0.10 -4.00 0.00 0.00 -0.52 0.00 0.00 37.83 33.21 2zm3 s LYS 1023CO 0.18 -0.99 0.00 -0.25 -0.92 0.00 0.00 175.35 173.37 2zm3 n ASP 1024N 7.58 0.00 -4.51 2.83 8.00 -1.26 -4.98 116.55 124.20 2zm3 n ASP 1024Ca 0.18 0.00 -0.36 0.00 0.71 0.00 0.00 54.79 55.32 2zm3 n ASP 1024Cb 0.43 -0.66 -0.12 0.00 -0.02 0.00 0.00 41.12 40.76 2zm3 n ASP 1024CO 0.00 0.00 0.00 -1.61 -0.39 0.00 0.00 177.20 175.20 2zm3 s GLU 1025N -0.26 3.78 0.18 -1.24 2.02 -1.11 -4.99 118.70 117.08 2zm3 s GLU 1025Ca 0.00 -0.42 -0.12 0.00 0.02 0.00 0.00 54.97 54.45 2zm3 s GLU 1025Cb 0.00 -3.35 0.09 0.00 0.10 0.00 0.00 34.13 30.97 2zm3 s GLU 1025CO 0.00 -0.08 1.78 -1.35 0.02 0.00 0.00 175.26 175.63 2zm3 h PRO 1026N 7.88 0.88 -4.67 0.39 0.11 -1.94 -3.39 132.00 131.26 2zm3 h PRO 1026Ca -0.37 -0.12 -0.27 0.00 0.11 0.00 0.00 66.00 65.35 2zm3 h PRO 1026Cb 1.18 -0.16 -0.19 0.00 0.11 0.00 0.00 31.00 31.93 2zm3 h PRO 1026CO 0.60 0.69 -0.73 -1.21 -0.21 0.00 0.00 178.00 177.14 2zm3 s GLU 1027N -5.76 0.65 -0.02 1.05 2.02 -1.26 -1.39 118.70 113.98 2zm3 s GLU 1027Ca -0.13 -0.94 -0.01 0.00 0.02 0.00 0.00 54.97 53.91 2zm3 s GLU 1027Cb 0.13 -0.33 0.02 0.00 0.10 0.00 0.00 34.13 34.06 2zm3 s GLU 1027CO 0.78 0.04 0.05 0.99 0.02 0.00 0.00 175.26 177.14 2zm3 s THR 1028N -2.01 -0.04 0.20 3.63 2.01 -0.38 -4.95 115.64 114.12 2zm3 s THR 1028Ca -0.03 0.14 -0.30 0.00 0.31 0.00 0.00 61.69 61.81 2zm3 s THR 1028Cb -0.06 -0.09 -0.09 0.00 0.01 0.00 0.00 72.50 72.28 2zm3 s THR 1028CO -0.01 0.06 1.24 -0.13 -0.69 0.00 0.00 174.62 175.09 2zm3 s ARG 1029N 0.72 4.46 0.16 4.92 0.52 -1.26 -0.55 118.95 127.92 2zm3 s ARG 1029Ca -0.06 1.95 -0.00 0.00 -0.52 0.00 0.00 55.73 57.10 2zm3 s ARG 1029Cb -0.08 -3.21 -0.04 0.00 0.52 0.00 0.00 34.95 32.13 2zm3 s ARG 1029CO -0.02 -0.13 0.06 0.14 0.02 0.00 0.00 175.30 175.36 2zm3 s VAL 1030N -0.13 0.24 -0.13 3.52 -7.23 0.72 -3.92 120.40 113.46 2zm3 s VAL 1030Ca 0.53 -1.95 -0.05 0.00 -1.81 0.00 0.00 61.98 58.71 2zm3 s VAL 1030Cb -0.34 -2.17 -0.04 0.00 0.56 0.00 0.00 36.38 34.39 2zm3 s VAL 1030CO 0.38 -0.36 0.04 0.00 -0.31 0.00 0.00 175.10 174.85 2zm3 s ALA 1031N -3.96 3.38 -0.23 1.32 0.00 -0.51 -0.95 121.76 120.82 2zm3 s ALA 1031Ca 0.27 -0.76 -0.02 0.00 0.00 0.00 0.00 51.96 51.45 2zm3 s ALA 1031Cb 0.07 -1.72 0.01 0.00 0.00 0.00 0.00 23.12 21.48 2zm3 s ALA 1031CO 0.05 0.40 -0.07 0.42 0.00 0.00 0.00 175.76 176.55 2zm3 s ILE 1032N -0.30 2.98 -0.12 0.00 -1.09 0.14 0.01 121.20 122.83 2zm3 s ILE 1032Ca 0.08 -0.77 -0.09 0.00 -2.23 0.00 0.00 60.65 57.64 2zm3 s ILE 1032Cb -0.12 -2.41 -0.04 0.00 -1.58 0.00 0.00 42.46 38.31 2zm3 s ILE 1032CO 0.02 0.35 0.19 -0.54 -1.23 0.00 0.00 174.94 173.72 2zm3 s LYS 1033N 1.39 3.69 0.13 2.79 1.02 -0.47 -0.29 119.74 128.00 2zm3 s LYS 1033Ca 0.04 -0.06 0.11 0.00 0.02 0.00 0.00 55.97 56.08 2zm3 s LYS 1033Cb -0.15 -3.25 -0.04 0.00 -0.52 0.00 0.00 37.83 33.87 2zm3 s LYS 1033CO -0.05 0.65 -0.26 0.95 -0.92 0.00 0.00 175.35 175.71 2zm3 s THR 1034N -0.69 2.20 -0.09 2.17 -4.23 -1.17 -1.40 115.64 112.42 2zm3 s THR 1034Ca 0.15 -1.74 -0.01 0.00 -1.18 0.00 0.00 61.69 58.91 2zm3 s THR 1034Cb -0.13 -1.95 0.03 0.00 1.34 0.00 0.00 72.50 71.79 2zm3 s THR 1034CO 0.04 0.07 -0.02 -0.69 -0.54 0.00 0.00 174.62 173.48 2zm3 s VAL 1035N -1.09 0.58 0.75 2.29 1.01 -0.78 -3.80 120.40 119.35 2zm3 s VAL 1035Ca 0.13 -0.06 -0.11 0.00 0.00 0.00 0.00 61.98 61.95 2zm3 s VAL 1035Cb -0.10 -0.73 0.04 0.00 0.00 0.00 0.00 36.38 35.59 2zm3 s VAL 1035CO 0.06 0.25 1.08 0.20 0.00 0.00 0.00 175.10 176.70 2zm3 s ASN 1036N 1.88 4.76 0.39 3.32 0.01 -1.26 -2.10 114.94 121.95 2zm3 s ASN 1036Ca 0.04 1.78 0.12 0.00 -0.71 0.00 0.00 52.86 54.10 2zm3 s ASN 1036Cb -0.13 -2.52 0.93 0.00 0.41 0.00 0.00 41.25 39.94 2zm3 s ASN 1036CO -0.06 -1.86 1.91 -0.08 -1.51 0.00 0.00 177.10 175.49 2zm3 h GLU 1037N -0.95 0.54 -2.02 -0.60 4.81 -1.96 -2.48 114.58 111.92 2zm3 h GLU 1037Ca -0.44 -0.03 -0.51 0.00 -0.13 0.00 0.00 59.36 58.25 2zm3 h GLU 1037Cb 1.23 -0.12 -0.18 0.00 0.63 0.00 0.00 28.75 30.31 2zm3 h GLU 1037CO 0.53 0.36 0.47 0.00 -0.73 0.00 0.00 179.01 179.64 2zm3 n ALA 1038N -2.48 6.47 -2.51 2.92 0.00 -1.26 -4.85 120.51 118.80 2zm3 n ALA 1038Ca 0.15 -3.10 -0.24 0.00 0.00 0.00 0.00 53.44 50.24 2zm3 n ALA 1038Cb 0.46 -2.17 -0.15 0.00 0.00 0.00 0.00 19.45 17.59 2zm3 n ALA 1038CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2zm3 s ALA 1039N -1.73 1.41 0.55 0.00 0.00 -0.94 -5.12 121.76 115.93 2zm3 s ALA 1039Ca 0.59 -0.75 -0.21 0.00 0.00 0.00 0.00 51.96 51.59 2zm3 s ALA 1039Cb 0.38 -0.35 -0.06 0.00 0.00 0.00 0.00 23.12 23.09 2zm3 s ALA 1039CO -0.22 0.34 1.06 -1.13 0.00 0.00 0.00 175.76 175.80 2zm3 n SER 1040N 2.57 1.29 -0.06 0.00 3.41 -1.26 -4.79 113.62 114.78 2zm3 n SER 1040Ca -0.15 0.90 0.08 0.00 -0.26 0.00 0.00 58.87 59.44 2zm3 n SER 1040Cb 0.54 -1.42 0.46 0.00 -0.26 0.00 0.00 64.21 63.53 2zm3 n SER 1040CO 0.00 0.00 0.00 -0.03 -0.16 0.00 0.00 175.04 174.85 2zm3 h MET 1041N 0.94 0.48 -0.25 4.33 4.05 -1.99 -2.02 114.93 120.48 2zm3 h MET 1041Ca -0.48 -0.03 0.00 0.00 -0.28 0.00 0.00 59.70 58.91 2zm3 h MET 1041Cb 1.34 -0.11 -0.01 0.00 -0.80 0.00 0.00 31.60 32.02 2zm3 h MET 1041CO 0.54 0.32 0.16 -0.09 0.23 0.00 0.00 176.91 178.06 2zm3 h ARG 1042N 0.50 0.33 -0.06 0.39 9.65 -2.00 -0.45 114.38 122.74 2zm3 h ARG 1042Ca 0.23 -0.02 -0.16 0.00 -1.10 0.00 0.00 59.98 58.93 2zm3 h ARG 1042Cb 0.29 -0.07 -0.01 0.00 -1.39 0.00 0.00 29.97 28.78 2zm3 h ARG 1042CO -0.06 0.24 -0.66 0.93 2.80 0.00 0.00 179.97 183.22 2zm3 h GLU 1043N 0.33 0.25 -0.55 0.20 4.39 -1.80 -1.99 114.58 115.41 2zm3 h GLU 1043Ca 0.09 -0.19 -0.08 0.00 0.34 0.00 0.00 59.36 59.52 2zm3 h GLU 1043Cb -0.01 0.03 -0.02 0.00 -0.10 0.00 0.00 28.75 28.65 2zm3 h GLU 1043CO -0.02 0.82 0.02 -0.09 -1.16 0.00 0.00 179.01 178.59 2zm3 h ARG 1044N 0.18 0.96 -0.72 2.33 2.43 -1.19 0.24 114.38 118.61 2zm3 h ARG 1044Ca -0.01 -0.29 -0.01 0.00 -0.81 0.00 0.00 59.98 58.85 2zm3 h ARG 1044Cb 1.19 -0.09 -0.03 0.00 -0.42 0.00 0.00 29.97 30.61 2zm3 h ARG 1044CO 0.10 0.95 0.42 0.82 -1.51 0.00 0.00 179.97 180.75 2zm3 h ILE 1045N 0.84 1.21 -0.47 1.20 2.04 -0.97 -0.48 117.51 120.88 2zm3 h ILE 1045Ca 0.16 -0.51 -0.04 0.00 1.00 0.00 0.00 64.86 65.47 2zm3 h ILE 1045Cb 0.50 0.24 -0.02 0.00 -0.74 0.00 0.00 36.82 36.80 2zm3 h ILE 1045CO 0.02 0.23 0.15 -0.08 0.00 0.00 0.00 178.15 178.48 2zm3 h GLU 1046N 0.99 0.73 -0.30 2.37 4.57 -1.02 -0.02 114.58 121.91 2zm3 h GLU 1046Ca 0.26 -0.15 0.06 0.00 -1.18 0.00 0.00 59.36 58.35 2zm3 h GLU 1046Cb 0.00 -0.11 -0.06 0.00 -0.16 0.00 0.00 28.75 28.43 2zm3 h GLU 1046CO -0.04 0.69 -0.09 0.35 -1.18 0.00 0.00 179.01 178.74 2zm3 h PHE 1047N 0.63 -0.19 -0.50 0.92 3.57 -0.21 -1.32 116.94 119.84 2zm3 h PHE 1047Ca 0.15 0.03 -0.09 0.00 3.53 0.00 0.00 57.97 61.59 2zm3 h PHE 1047Cb 0.26 0.13 -0.02 0.00 2.79 0.00 0.00 35.95 39.11 2zm3 h PHE 1047CO 0.01 -0.15 -0.05 -0.07 -2.23 0.00 0.00 178.31 175.83 2zm3 h LEU 1048N -0.02 0.90 -0.89 0.59 4.07 -0.83 -2.60 115.31 116.53 2zm3 h LEU 1048Ca 0.15 -0.33 -0.02 0.00 0.08 0.00 0.00 57.88 57.75 2zm3 h LEU 1048Cb 0.24 -0.24 -0.04 0.00 1.08 0.00 0.00 40.66 41.70 2zm3 h LEU 1048CO -0.32 1.02 0.45 0.78 -1.08 0.00 0.00 178.44 179.29 2zm3 h ASN 1049N 0.77 1.12 0.17 -0.43 2.35 -0.83 -1.50 115.58 117.24 2zm3 h ASN 1049Ca 0.13 -0.12 -0.05 0.00 -0.55 0.00 0.00 56.30 55.71 2zm3 h ASN 1049Cb 0.58 -0.29 -0.01 0.00 0.05 0.00 0.00 38.32 38.66 2zm3 h ASN 1049CO 0.03 0.92 -0.22 -0.08 -1.65 0.00 0.00 177.43 176.44 2zm3 h GLU 1050N 1.24 0.09 -0.17 0.81 4.81 -1.09 -2.09 114.58 118.18 2zm3 h GLU 1050Ca 0.31 -0.02 -0.21 0.00 -0.13 0.00 0.00 59.36 59.31 2zm3 h GLU 1050Cb 0.07 -0.01 0.00 0.00 0.63 0.00 0.00 28.75 29.45 2zm3 h GLU 1050CO -0.04 0.31 -0.71 0.00 -0.73 0.00 0.00 179.01 177.83 2zm3 h ALA 1051N 1.70 0.42 -0.95 2.92 0.00 -1.04 -3.13 119.26 119.19 2zm3 h ALA 1051Ca 0.01 -0.58 0.03 0.00 0.00 0.00 0.00 54.91 54.38 2zm3 h ALA 1051Cb 0.44 -0.04 -0.05 0.00 0.00 0.00 0.00 17.79 18.13 2zm3 h ALA 1051CO 0.03 0.70 0.62 0.77 0.00 0.00 0.00 179.25 181.37 2zm3 h SER 1052N 0.51 1.04 -0.21 0.00 0.02 -0.61 -0.94 113.55 113.35 2zm3 h SER 1052Ca -0.03 -0.01 -0.02 0.00 -0.84 0.00 0.00 61.79 60.89 2zm3 h SER 1052Cb 1.32 -0.24 -0.01 0.00 0.14 0.00 0.00 62.40 63.62 2zm3 h SER 1052CO 0.14 0.71 0.07 0.58 -1.14 0.00 0.00 176.83 177.19 2zm3 h VAL 1053N 1.20 1.19 0.00 2.27 2.07 -1.48 -3.01 116.25 118.49 2zm3 h VAL 1053Ca 0.37 -0.60 -0.06 0.00 0.82 0.00 0.00 66.70 67.23 2zm3 h VAL 1053Cb -0.01 1.19 -0.01 0.00 -1.52 0.00 0.00 31.29 30.94 2zm3 h VAL 1053CO -0.11 0.19 -0.30 0.24 0.02 0.00 0.00 177.57 177.62 2zm3 h MET 1054N 0.17 0.00 -0.89 1.57 2.86 -1.41 -3.08 114.93 114.15 2zm3 h MET 1054Ca 0.07 0.00 0.19 0.00 -2.06 0.00 0.00 59.70 57.90 2zm3 h MET 1054Cb 0.24 0.00 -0.17 0.00 0.06 0.00 0.00 31.60 31.73 2zm3 h MET 1054CO -0.00 0.30 -0.17 1.63 1.06 0.00 0.00 176.91 179.72 2zm3 n LYS 1055N -4.14 -0.08 -0.03 1.72 5.02 -0.39 -1.51 118.16 118.74 2zm3 n LYS 1055Ca -0.02 1.38 -0.08 0.00 -2.02 0.00 0.00 58.31 57.57 2zm3 n LYS 1055Cb 0.35 -2.09 0.09 0.00 -0.02 0.00 0.00 35.03 33.35 2zm3 n LYS 1055CO 0.00 0.00 0.00 0.93 -0.52 0.00 0.00 177.40 177.81 2zm3 h GLU 1056N 0.00 0.65 -6.15 1.97 4.39 -1.69 -3.43 114.58 110.32 2zm3 h GLU 1056Ca 0.45 -0.32 -0.56 0.00 0.34 0.00 0.00 59.36 59.27 2zm3 h GLU 1056Cb 0.75 -0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 29.38 2zm3 h GLU 1056CO -0.91 0.92 1.34 -0.06 -1.16 0.00 0.00 179.01 179.14 2zm3 s PHE 1057N -4.32 1.65 -0.57 4.33 0.08 -0.57 -4.92 117.98 113.66 2zm3 s PHE 1057Ca -0.08 0.70 0.04 0.00 0.12 0.00 0.00 56.93 57.70 2zm3 s PHE 1057Cb 0.12 -4.06 0.15 0.00 -0.57 0.00 0.00 43.02 38.66 2zm3 s PHE 1057CO 0.83 -2.99 0.35 1.21 -0.10 0.00 0.00 175.22 174.52 2zm3 s ASN 1058N 7.05 4.18 0.02 1.36 3.84 -1.26 -4.73 114.94 125.40 2zm3 s ASN 1058Ca 0.82 -3.26 0.02 0.00 0.21 0.00 0.00 52.86 50.64 2zm3 s ASN 1058Cb -0.22 -1.44 -0.02 0.00 -0.55 0.00 0.00 41.25 39.02 2zm3 s ASN 1058CO 0.32 -0.18 -0.06 0.00 -2.79 0.00 0.00 177.10 174.38 2zm3 h HIS 1060N 5.16 0.00 -0.32 0.00 2.76 -1.95 -2.00 115.15 118.80 2zm3 h HIS 1060Ca -0.32 0.00 -0.03 0.00 -2.20 0.00 0.00 60.37 57.82 2zm3 h HIS 1060Cb 1.20 0.00 -0.02 0.00 1.55 0.00 0.00 27.41 30.14 2zm3 h HIS 1060CO 0.54 0.00 0.01 0.72 -1.30 0.00 0.00 177.93 177.90 2zm3 n HIS 1061N -2.84 1.12 -4.55 5.26 8.25 -1.26 -4.87 115.22 116.32 2zm3 n HIS 1061Ca -0.01 -0.95 -0.27 0.00 -0.26 0.00 0.00 57.72 56.23 2zm3 n HIS 1061Cb 0.17 -0.37 -0.17 0.00 1.12 0.00 0.00 29.99 30.74 2zm3 n HIS 1061CO 0.00 0.00 0.00 0.08 0.64 0.00 0.00 176.34 177.06 2zm3 s VAL 1062N -2.88 1.37 0.08 1.59 1.01 -0.75 -0.87 120.40 119.94 2zm3 s VAL 1062Ca 0.44 -0.59 -0.32 0.00 0.00 0.00 0.00 61.98 61.52 2zm3 s VAL 1062Cb 0.36 -1.25 -0.11 0.00 0.00 0.00 0.00 36.38 35.38 2zm3 s VAL 1062CO 0.09 0.41 1.84 0.52 0.00 0.00 0.00 175.10 177.96 2zm3 n VAL 1063N 4.03 0.43 -2.99 2.92 0.31 -0.58 -4.56 118.33 117.89 2zm3 n VAL 1063Ca -0.20 -0.08 -0.39 0.00 -0.01 0.00 0.00 64.34 63.66 2zm3 n VAL 1063Cb 0.51 -2.05 -0.06 0.00 -0.91 0.00 0.00 33.84 31.34 2zm3 n VAL 1063CO 0.00 0.00 0.00 -0.60 -1.32 0.00 0.00 176.83 174.91 2zm3 s ARG 1064N 3.05 4.56 -0.13 5.55 3.52 -1.26 -4.89 118.95 129.36 2zm3 s ARG 1064Ca 0.85 1.15 -0.21 0.00 -0.13 0.00 0.00 55.73 57.38 2zm3 s ARG 1064Cb -0.53 -3.26 -0.03 0.00 -1.56 0.00 0.00 34.95 29.56 2zm3 s ARG 1064CO 0.41 0.57 0.64 -1.17 -0.81 0.00 0.00 175.30 174.93 2zm3 s LEU 1065N -1.14 4.24 -0.01 -0.88 0.20 -1.26 -0.94 118.68 118.89 2zm3 s LEU 1065Ca 0.36 0.98 0.18 0.00 0.69 0.00 0.00 54.13 56.34 2zm3 s LEU 1065Cb -0.23 -2.94 -0.23 0.00 -0.43 0.00 0.00 46.19 42.35 2zm3 s LEU 1065CO 0.26 -0.16 0.63 0.18 -0.29 0.00 0.00 176.35 176.97 2zm3 n LEU 1066N 4.28 0.52 0.00 -0.68 4.77 0.11 -4.94 117.00 121.06 2zm3 n LEU 1066Ca -0.02 -0.30 0.00 0.00 -0.03 0.00 0.00 56.01 55.65 2zm3 n LEU 1066Cb 0.51 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.60 2zm3 n LEU 1066CO 0.45 0.13 0.00 0.61 -1.33 0.00 0.00 177.39 177.25 2zm3 n GLY 1067N 1.43 -1.88 3.02 -0.72 0.00 -1.19 -4.97 105.19 100.88 2zm3 n GLY 1067Ca 0.01 -1.50 -0.18 0.00 0.00 0.00 0.00 46.02 44.35 2zm3 n GLY 1067CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2zm3 s VAL 1068N -1.73 0.67 -0.62 1.61 1.01 -0.62 -0.92 120.40 119.79 2zm3 s VAL 1068Ca 0.00 -0.46 -0.11 0.00 0.00 0.00 0.00 61.98 61.41 2zm3 s VAL 1068Cb 0.00 -0.58 0.16 0.00 0.00 0.00 0.00 36.38 35.96 2zm3 s VAL 1068CO 0.00 0.12 0.52 -0.69 0.00 0.00 0.00 175.10 175.06 2zm3 s VAL 1069N -0.34 4.72 -0.14 2.92 1.01 0.12 0.06 120.40 128.76 2zm3 s VAL 1069Ca 0.02 -2.18 0.18 0.00 0.00 0.00 0.00 61.98 60.00 2zm3 s VAL 1069Cb -0.04 -4.02 -0.25 0.00 0.00 0.00 0.00 36.38 32.07 2zm3 s VAL 1069CO -0.00 -0.89 0.30 -1.54 0.00 0.00 0.00 175.10 172.97 2zm3 n SER 1070N 4.40 0.20 -3.69 3.32 3.41 -1.26 -2.11 113.62 117.89 2zm3 n SER 1070Ca 0.01 0.09 -0.41 0.00 -0.26 0.00 0.00 58.87 58.30 2zm3 n SER 1070Cb 0.42 0.96 -0.00 0.00 -0.26 0.00 0.00 64.21 65.33 2zm3 n SER 1070CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2zm3 n GLN 1071N -2.71 3.78 0.00 4.33 1.13 -1.26 -4.65 117.38 117.99 2zm3 n GLN 1071Ca -0.23 -3.26 0.00 0.00 -1.94 0.00 0.00 57.00 51.57 2zm3 n GLN 1071Cb 1.00 -2.89 0.00 0.00 0.11 0.00 0.00 30.24 28.46 2zm3 n GLN 1071CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 2zm3 n GLY 1072N 2.77 -0.67 3.64 1.08 0.00 -1.26 -4.91 105.19 105.84 2zm3 n GLY 1072Ca 0.51 -0.47 -0.04 0.00 0.00 0.00 0.00 46.02 46.01 2zm3 n GLY 1072CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2zm3 s GLN 1073N -1.02 0.51 0.54 1.61 2.00 -1.26 -4.59 119.66 117.43 2zm3 s GLN 1073Ca 0.00 0.86 -0.16 0.00 -2.00 0.00 0.00 55.36 54.05 2zm3 s GLN 1073Cb 0.00 0.11 -0.07 0.00 0.80 0.00 0.00 33.01 33.85 2zm3 s GLN 1073CO 0.00 -0.10 1.00 -1.25 -0.50 0.00 0.00 175.29 174.44 2zm3 s PRO 1074N 1.38 3.80 0.27 1.67 0.04 -1.26 -5.00 135.00 135.89 2zm3 s PRO 1074Ca -0.09 1.00 -0.30 0.00 0.04 0.00 0.00 61.00 61.66 2zm3 s PRO 1074Cb -0.04 -2.11 -0.10 0.00 0.04 0.00 0.00 34.50 32.29 2zm3 s PRO 1074CO -0.16 -0.40 1.41 0.99 0.04 0.00 0.00 177.00 178.88 2zm3 s THR 1075N -2.61 2.68 -0.04 1.26 2.01 -0.89 -4.85 115.64 113.21 2zm3 s THR 1075Ca 0.60 0.59 0.06 0.00 0.31 0.00 0.00 61.69 63.26 2zm3 s THR 1075Cb -0.11 -3.38 -0.01 0.00 0.01 0.00 0.00 72.50 69.00 2zm3 s THR 1075CO 0.33 0.11 -0.24 -0.76 -0.69 0.00 0.00 174.62 173.37 2zm3 s LEU 1076N -0.71 2.04 -0.21 4.42 1.43 -0.90 -1.87 118.68 122.88 2zm3 s LEU 1076Ca 0.57 -0.46 -0.03 0.00 -1.03 0.00 0.00 54.13 53.18 2zm3 s LEU 1076Cb -0.41 -1.27 -0.01 0.00 0.03 0.00 0.00 46.19 44.54 2zm3 s LEU 1076CO 0.46 0.26 -0.07 -0.69 0.23 0.00 0.00 176.35 176.53 2zm3 s VAL 1077N -0.32 3.17 -0.32 -1.59 1.01 -0.49 -0.70 120.40 121.16 2zm3 s VAL 1077Ca 0.02 -0.57 -0.18 0.00 0.00 0.00 0.00 61.98 61.25 2zm3 s VAL 1077Cb -0.11 -2.42 -0.01 0.00 0.00 0.00 0.00 36.38 33.83 2zm3 s VAL 1077CO 0.01 0.45 0.53 -0.63 0.00 0.00 0.00 175.10 175.46 2zm3 s ILE 1078N 1.33 5.02 0.35 2.22 1.09 -0.10 -1.37 121.20 129.73 2zm3 s ILE 1078Ca 0.04 0.53 0.08 0.00 -1.10 0.00 0.00 60.65 60.20 2zm3 s ILE 1078Cb -0.14 -3.94 -0.03 0.00 -1.06 0.00 0.00 42.46 37.29 2zm3 s ILE 1078CO -0.04 -0.14 0.28 -0.04 -0.10 0.00 0.00 174.94 174.90 2zm3 s MET 1079N 2.41 2.63 0.29 2.79 -1.94 0.10 0.05 119.30 125.63 2zm3 s MET 1079Ca 0.20 -1.39 -0.29 0.00 -1.71 0.00 0.00 55.69 52.50 2zm3 s MET 1079Cb -0.15 -2.40 -0.10 0.00 2.01 0.00 0.00 34.83 34.18 2zm3 s MET 1079CO 0.12 0.05 1.40 -2.00 -0.01 0.00 0.00 175.02 174.58 2zm3 s GLU 1080N -3.99 4.28 -0.10 2.03 2.12 -0.11 -1.42 118.70 121.51 2zm3 s GLU 1080Ca 0.42 2.30 -0.25 0.00 0.36 0.00 0.00 54.97 57.80 2zm3 s GLU 1080Cb -0.05 -3.08 -0.03 0.00 0.26 0.00 0.00 34.13 31.24 2zm3 s GLU 1080CO 0.26 -0.35 0.78 -1.17 -0.54 0.00 0.00 175.26 174.25 2zm3 s LEU 1081N -1.11 4.27 -0.53 2.70 2.96 -1.25 -4.28 118.68 121.43 2zm3 s LEU 1081Ca 0.55 1.24 -0.02 0.00 -0.22 0.00 0.00 54.13 55.68 2zm3 s LEU 1081Cb -0.42 -3.20 0.14 0.00 0.50 0.00 0.00 46.19 43.21 2zm3 s LEU 1081CO 0.49 -0.24 0.33 -0.04 -1.32 0.00 0.00 176.35 175.57 2zm3 s MET 1082N 1.33 2.26 0.63 1.98 -1.94 -1.26 -4.83 119.30 117.46 2zm3 s MET 1082Ca 0.40 -2.31 0.36 0.00 -1.71 0.00 0.00 55.69 52.43 2zm3 s MET 1082Cb -0.18 -3.60 2.10 0.00 2.01 0.00 0.00 34.83 35.15 2zm3 s MET 1082CO 0.17 -1.12 2.31 1.79 -0.01 0.00 0.00 175.02 178.16 2zm3 h THR 1083N 5.69 0.29 -0.66 2.05 1.35 -1.84 -1.57 112.91 118.22 2zm3 h THR 1083Ca -0.06 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.80 2zm3 h THR 1083Cb 0.97 1.00 0.00 0.00 -1.73 0.00 0.00 68.15 68.39 2zm3 h THR 1083CO 0.70 0.00 0.00 0.54 -0.25 0.00 0.00 175.52 176.51 2zm3 n ARG 1084N -3.51 2.62 0.00 4.72 1.74 -0.59 -4.97 116.66 116.67 2zm3 n ARG 1084Ca -0.03 -2.51 0.00 0.00 -0.77 0.00 0.00 57.85 54.54 2zm3 n ARG 1084Cb 0.08 -1.55 0.00 0.00 -1.02 0.00 0.00 32.46 29.97 2zm3 n ARG 1084CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2zm3 n GLY 1085N 1.61 -0.99 3.76 -0.13 0.00 -0.59 -4.63 105.19 104.22 2zm3 n GLY 1085Ca 0.23 -1.20 -0.39 0.00 0.00 0.00 0.00 46.02 44.65 2zm3 n GLY 1085CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 2zm3 s ASP 1086N -4.00 7.27 0.35 1.61 -4.77 -1.26 0.39 116.67 116.26 2zm3 s ASP 1086Ca 0.00 2.15 0.09 0.00 -3.30 0.00 0.00 52.55 51.49 2zm3 s ASP 1086Cb 0.00 -2.62 0.81 0.00 -1.09 0.00 0.00 42.92 40.02 2zm3 s ASP 1086CO 0.00 -0.13 1.86 0.25 0.70 0.00 0.00 175.17 177.85 2zm3 h LEU 1087N 3.65 0.67 0.69 2.11 5.85 -0.55 -2.34 115.31 125.39 2zm3 h LEU 1087Ca -0.47 0.04 -0.03 0.00 0.84 0.00 0.00 57.88 58.27 2zm3 h LEU 1087Cb 1.21 -0.09 0.00 0.00 0.37 0.00 0.00 40.66 42.15 2zm3 h LEU 1087CO 0.66 0.33 -0.37 0.50 -0.34 0.00 0.00 178.44 179.23 2zm3 h LYS 1088N 0.70 -0.94 0.00 1.25 3.64 -1.74 -0.30 116.57 119.19 2zm3 h LYS 1088Ca 0.46 0.06 0.00 0.00 -1.27 0.00 0.00 60.65 59.90 2zm3 h LYS 1088Cb 0.73 0.21 0.00 0.00 -0.41 0.00 0.00 32.23 32.76 2zm3 h LYS 1088CO -0.21 -0.63 0.00 0.66 -2.27 0.00 0.00 179.45 177.00 2zm3 h SER 1089N -0.98 0.00 -0.26 4.20 4.64 -1.86 -2.30 113.55 116.99 2zm3 h SER 1089Ca -0.09 0.00 -0.15 0.00 -0.47 0.00 0.00 61.79 61.08 2zm3 h SER 1089Cb 0.77 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.86 2zm3 h SER 1089CO 0.13 0.00 -0.41 0.22 -0.87 0.00 0.00 176.83 175.89 2zm3 h TYR 1090N 0.00 0.92 -0.69 4.77 3.20 -1.10 -2.31 116.97 121.75 2zm3 h TYR 1090Ca 0.00 -0.31 -0.06 0.00 3.14 0.00 0.00 58.73 61.50 2zm3 h TYR 1090Cb 0.56 -0.18 -0.03 0.00 1.54 0.00 0.00 36.73 38.62 2zm3 h TYR 1090CO 0.00 1.10 0.21 -0.07 -1.64 0.00 0.00 178.16 177.75 2zm3 h LEU 1091N 0.48 1.01 -0.97 2.82 3.38 -0.60 -2.69 115.31 118.74 2zm3 h LEU 1091Ca 0.02 -0.19 -0.09 0.00 0.09 0.00 0.00 57.88 57.72 2zm3 h LEU 1091Cb 1.01 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 41.48 2zm3 h LEU 1091CO 0.09 0.95 -0.18 0.03 0.09 0.00 0.00 178.44 179.43 2zm3 h ARG 1092N 1.03 0.54 0.00 1.13 3.08 -1.42 -2.14 114.38 116.60 2zm3 h ARG 1092Ca 0.22 -0.18 0.00 0.00 0.07 0.00 0.00 59.98 60.09 2zm3 h ARG 1092Cb 0.31 -0.05 0.00 0.00 0.08 0.00 0.00 29.97 30.31 2zm3 h ARG 1092CO -0.01 0.70 0.00 -1.13 -1.07 0.00 0.00 179.97 178.46 2zm3 n SER 1093N -4.16 0.51 0.00 7.04 3.41 -0.87 -1.73 113.62 117.82 2zm3 n SER 1093Ca 0.00 0.66 0.13 0.00 -0.26 0.00 0.00 58.87 59.41 2zm3 n SER 1093Cb 0.37 -0.76 0.41 0.00 -0.26 0.00 0.00 64.21 63.96 2zm3 n SER 1093CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 2zm3 n LEU 1094N -2.11 0.30 -4.76 1.04 4.77 -0.80 -4.89 117.00 110.55 2zm3 n LEU 1094Ca 0.01 0.22 -0.40 0.00 -0.03 0.00 0.00 56.01 55.81 2zm3 n LEU 1094Cb 0.15 -0.35 -0.04 0.00 -2.33 0.00 0.00 43.42 40.84 2zm3 n LEU 1094CO 0.15 0.07 0.82 -0.13 -1.33 0.00 0.00 177.39 176.97 2zm3 s ARG 1095N -3.00 4.56 0.00 3.23 0.52 -0.71 -3.75 118.95 119.80 2zm3 s ARG 1095Ca 0.12 1.87 0.00 0.00 -0.52 0.00 0.00 55.73 57.20 2zm3 s ARG 1095Cb 0.18 -3.13 0.00 0.00 0.52 0.00 0.00 34.95 32.52 2zm3 s ARG 1095CO 0.63 0.12 0.39 -0.35 0.02 0.00 0.00 175.30 176.10 2zm3 n PRO 1096N 1.05 0.39 -2.09 3.54 -0.04 -1.26 -5.08 135.00 131.51 2zm3 n PRO 1096Ca -0.01 0.00 -0.27 0.00 -0.04 0.00 0.00 63.50 63.19 2zm3 n PRO 1096Cb 0.44 -1.00 0.02 0.00 -0.04 0.00 0.00 33.50 32.92 2zm3 n PRO 1096CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 2zm3 n GLU 1097N -0.50 3.44 -0.60 0.54 4.71 -1.26 -5.26 120.64 121.72 2zm3 n GLU 1097Ca 0.00 -4.16 0.00 0.00 -0.01 0.00 0.00 57.16 52.99 2zm3 n GLU 1097Cb 0.00 -2.27 0.00 0.00 -1.01 0.00 0.00 31.44 28.16 2zm3 n GLU 1097CO 0.00 0.00 0.00 -1.71 0.09 0.00 0.00 177.13 175.51 2zm3 n ASN 1101N -0.65 -1.06 0.15 1.62 2.85 -1.26 -5.07 115.26 111.83 2zm3 n ASN 1101Ca 0.45 0.00 0.07 0.00 -0.11 0.00 0.00 54.58 54.99 2zm3 n ASN 1101Cb 0.82 -0.53 0.38 0.00 1.24 0.00 0.00 39.78 41.69 2zm3 n ASN 1101CO 0.00 0.00 0.00 -2.65 -2.11 0.00 0.00 177.26 172.50 2zm3 n PRO 1102N 1.17 0.09 -0.11 1.20 -0.02 -1.26 -0.76 135.00 135.32 2zm3 n PRO 1102Ca 0.00 0.57 0.10 0.00 -2.02 0.00 0.00 63.50 62.14 2zm3 n PRO 1102Cb 0.00 -2.02 0.14 0.00 -0.02 0.00 0.00 33.50 31.60 2zm3 n PRO 1102CO 0.00 0.00 0.00 1.55 1.98 0.00 0.00 175.50 179.03 2zm3 n VAL 1103N -2.04 0.35 -4.05 -1.45 3.14 -1.26 -4.87 118.33 108.15 2zm3 n VAL 1103Ca -0.01 -0.68 -0.32 0.00 -2.96 0.00 0.00 64.34 60.37 2zm3 n VAL 1103Cb 0.24 1.08 -0.15 0.00 -1.06 0.00 0.00 33.84 33.95 2zm3 n VAL 1103CO 0.00 0.00 0.00 -0.76 -6.46 0.00 0.00 176.83 169.61 2zm3 s LEU 1104N -1.39 3.50 0.04 6.55 1.43 0.06 -5.10 118.68 123.77 2zm3 s LEU 1104Ca 0.29 -1.37 0.02 0.00 -1.03 0.00 0.00 54.13 52.03 2zm3 s LEU 1104Cb 0.18 -1.57 -0.02 0.00 0.03 0.00 0.00 46.19 44.80 2zm3 s LEU 1104CO 0.25 -0.20 -0.07 0.00 0.23 0.00 0.00 176.35 176.57 2zm3 s ALA 1105N 1.13 0.48 0.31 4.21 0.00 -1.26 -4.84 121.76 121.79 2zm3 s ALA 1105Ca -0.08 -0.73 -0.27 0.00 0.00 0.00 0.00 51.96 50.88 2zm3 s ALA 1105Cb -0.20 0.07 -0.14 0.00 0.00 0.00 0.00 23.12 22.85 2zm3 s ALA 1105CO -0.04 -0.05 0.86 -2.30 0.00 0.00 0.00 175.76 174.22 2zm3 n PRO 1106N 1.47 1.03 -2.60 0.00 -0.02 -1.25 -4.88 135.00 128.76 2zm3 n PRO 1106Ca -0.23 0.36 -0.37 0.00 -2.02 0.00 0.00 63.50 61.25 2zm3 n PRO 1106Cb 0.55 -1.69 -0.05 0.00 -0.02 0.00 0.00 33.50 32.29 2zm3 n PRO 1106CO 0.00 0.00 0.00 -2.14 1.98 0.00 0.00 175.50 175.34 2zm3 s PRO 1107N -1.54 4.29 1.06 0.52 0.02 -1.26 -5.04 135.00 133.06 2zm3 s PRO 1107Ca 0.61 1.48 -0.15 0.00 0.02 0.00 0.00 61.00 62.95 2zm3 s PRO 1107Cb -0.70 -2.63 0.22 0.00 0.02 0.00 0.00 34.50 31.41 2zm3 s PRO 1107CO 0.59 -0.02 1.12 -1.54 -0.33 0.00 0.00 177.00 176.82 2zm3 s SER 1108N -1.55 2.12 0.37 2.53 1.04 -1.26 -4.81 113.70 112.14 2zm3 s SER 1108Ca 0.55 0.88 0.05 0.00 0.48 0.00 0.00 55.95 57.92 2zm3 s SER 1108Cb -0.21 -1.35 0.74 0.00 0.10 0.00 0.00 66.02 65.30 2zm3 s SER 1108CO 0.27 -3.41 1.99 0.25 0.98 0.00 0.00 173.24 173.32 2zm3 h LEU 1109N -2.09 0.64 -0.43 2.42 5.85 -1.99 -1.74 115.31 117.98 2zm3 h LEU 1109Ca -0.50 -0.01 -0.08 0.00 0.84 0.00 0.00 57.88 58.13 2zm3 h LEU 1109Cb 1.31 -0.15 -0.01 0.00 0.37 0.00 0.00 40.66 42.18 2zm3 h LEU 1109CO 0.49 0.44 -0.05 -1.28 -0.34 0.00 0.00 178.44 177.70 2zm3 h SER 1110N 0.74 0.79 -0.65 1.25 0.87 -1.96 -1.18 113.55 113.41 2zm3 h SER 1110Ca 0.26 -0.33 -0.08 0.00 -1.23 0.00 0.00 61.79 60.41 2zm3 h SER 1110Cb 0.12 -0.21 -0.03 0.00 -0.44 0.00 0.00 62.40 61.84 2zm3 h SER 1110CO -0.08 0.94 0.11 0.11 -0.53 0.00 0.00 176.83 177.38 2zm3 h LYS 1111N 0.63 1.09 -0.44 2.24 1.79 -1.82 -2.24 116.57 117.81 2zm3 h LYS 1111Ca 0.12 -0.28 -0.08 0.00 -2.18 0.00 0.00 60.65 58.23 2zm3 h LYS 1111Cb 0.56 -0.13 -0.02 0.00 -1.58 0.00 0.00 32.23 31.06 2zm3 h LYS 1111CO 0.03 0.99 -0.04 0.52 -1.08 0.00 0.00 179.45 179.87 2zm3 h MET 1112N 1.02 0.74 -0.66 3.15 2.86 -1.11 -1.37 114.93 119.57 2zm3 h MET 1112Ca 0.20 -0.21 -0.08 0.00 -2.06 0.00 0.00 59.70 57.55 2zm3 h MET 1112Cb 0.43 -0.08 -0.03 0.00 0.06 0.00 0.00 31.60 31.98 2zm3 h MET 1112CO 0.01 0.78 0.11 0.82 1.06 0.00 0.00 176.91 179.70 2zm3 h ILE 1113N 0.69 1.26 0.04 -1.22 1.08 -1.01 -1.38 117.51 116.98 2zm3 h ILE 1113Ca 0.13 -1.03 -0.00 0.00 -0.39 0.00 0.00 64.86 63.57 2zm3 h ILE 1113Cb 0.48 0.65 0.00 0.00 -3.07 0.00 0.00 36.82 34.88 2zm3 h ILE 1113CO 0.02 0.38 -0.02 -0.61 -0.69 0.00 0.00 178.15 177.24 2zm3 h GLN 1114N 1.01 -0.05 -0.93 2.37 5.75 -0.94 0.21 115.11 122.54 2zm3 h GLN 1114Ca 0.20 0.00 0.11 0.00 -0.15 0.00 0.00 58.65 58.81 2zm3 h GLN 1114Cb 0.43 0.01 -0.08 0.00 1.07 0.00 0.00 27.48 28.92 2zm3 h GLN 1114CO 0.01 0.02 0.56 0.52 -2.65 0.00 0.00 178.83 177.30 2zm3 h MET 1115N -0.11 0.89 -0.10 1.69 2.86 -1.19 -1.25 114.93 117.72 2zm3 h MET 1115Ca -0.01 -0.05 -0.01 0.00 -2.06 0.00 0.00 59.70 57.57 2zm3 h MET 1115Cb 0.10 -0.20 -0.00 0.00 0.06 0.00 0.00 31.60 31.55 2zm3 h MET 1115CO 0.01 0.59 0.01 0.00 1.06 0.00 0.00 176.91 178.58 2zm3 h ALA 1116N 1.50 0.13 -0.70 6.32 0.00 -0.64 -1.29 119.26 124.58 2zm3 h ALA 1116Ca 0.45 -0.16 -0.06 0.00 0.00 0.00 0.00 54.91 55.14 2zm3 h ALA 1116Cb 0.42 -0.04 -0.03 0.00 0.00 0.00 0.00 17.79 18.15 2zm3 h ALA 1116CO -0.25 -0.20 0.21 0.78 0.00 0.00 0.00 179.25 179.78 2zm3 h GLY 1117N -0.09 1.17 0.94 0.00 0.00 -0.79 0.08 103.07 104.38 2zm3 h GLY 1117Ca 0.03 -0.70 -0.04 0.00 0.00 0.00 0.00 47.33 46.63 2zm3 h GLY 1117CO 0.00 0.65 0.12 0.83 0.00 0.00 0.00 176.54 178.14 2zm3 h GLU 1118N 1.03 0.64 -0.53 4.80 5.08 -1.17 0.35 114.58 124.78 2zm3 h GLU 1118Ca 0.22 -0.14 -0.06 0.00 -1.00 0.00 0.00 59.36 58.38 2zm3 h GLU 1118Cb 0.31 -0.09 -0.02 0.00 0.50 0.00 0.00 28.75 29.45 2zm3 h GLU 1118CO -0.01 0.65 0.10 0.82 -1.00 0.00 0.00 179.01 179.57 2zm3 h ILE 1119N 0.52 1.25 -0.32 3.13 2.04 -1.14 -2.58 117.51 120.41 2zm3 h ILE 1119Ca 0.13 -0.93 -0.10 0.00 1.00 0.00 0.00 64.86 64.95 2zm3 h ILE 1119Cb 0.28 0.83 -0.01 0.00 -0.74 0.00 0.00 36.82 37.17 2zm3 h ILE 1119CO -0.00 0.34 -0.23 0.00 0.00 0.00 0.00 178.15 178.25 2zm3 h ALA 1120N 0.99 1.01 0.50 1.87 0.00 -0.68 -2.28 119.26 120.66 2zm3 h ALA 1120Ca 0.16 -0.35 -0.02 0.00 0.00 0.00 0.00 54.91 54.70 2zm3 h ALA 1120Cb 0.39 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.05 2zm3 h ALA 1120CO 0.01 0.59 -0.25 0.22 0.00 0.00 0.00 179.25 179.82 2zm3 h ASP 1121N 0.54 -0.59 -0.67 0.00 3.58 -0.17 0.24 116.42 119.35 2zm3 h ASP 1121Ca 0.08 0.02 0.12 0.00 0.42 0.00 0.00 57.03 57.67 2zm3 h ASP 1121Cb 0.69 0.16 -0.04 0.00 1.72 0.00 0.00 39.33 41.85 2zm3 h ASP 1121CO 0.05 -0.41 0.45 1.23 -2.88 0.00 0.00 179.24 177.68 2zm3 h GLY 1122N -0.68 0.62 1.20 -0.78 0.00 -1.38 0.56 103.07 102.61 2zm3 h GLY 1122Ca -0.07 -0.17 -0.27 0.00 0.00 0.00 0.00 47.33 46.83 2zm3 h GLY 1122CO 0.10 0.08 -1.04 -0.33 0.00 0.00 0.00 176.54 175.35 2zm3 h MET 1123N 0.40 0.70 -0.68 4.80 2.86 -1.04 -2.27 114.93 119.71 2zm3 h MET 1123Ca 0.32 -0.76 0.10 0.00 -2.06 0.00 0.00 59.70 57.30 2zm3 h MET 1123Cb 0.69 0.22 -0.07 0.00 0.06 0.00 0.00 31.60 32.50 2zm3 h MET 1123CO -0.09 1.33 0.30 0.00 1.06 0.00 0.00 176.91 179.50 2zm3 h ALA 1124N 0.39 0.92 -0.16 6.32 0.00 0.44 -0.94 119.26 126.23 2zm3 h ALA 1124Ca -0.13 0.07 0.02 0.00 0.00 0.00 0.00 54.91 54.87 2zm3 h ALA 1124Cb 1.70 0.01 -0.02 0.00 0.00 0.00 0.00 17.79 19.48 2zm3 h ALA 1124CO 0.20 -0.12 0.04 -0.92 0.00 0.00 0.00 179.25 178.45 2zm3 h TYR 1125N 0.51 0.08 0.36 0.00 3.20 -0.82 -0.92 116.97 119.38 2zm3 h TYR 1125Ca 0.34 0.01 -0.01 0.00 3.14 0.00 0.00 58.73 62.21 2zm3 h TYR 1125Cb 0.41 -0.01 -0.01 0.00 1.54 0.00 0.00 36.73 38.66 2zm3 h TYR 1125CO -0.14 0.04 -0.24 -0.07 -1.64 0.00 0.00 178.16 176.11 2zm3 h LEU 1126N 0.12 -0.60 -1.94 2.82 3.38 -0.94 -2.19 115.31 115.96 2zm3 h LEU 1126Ca 0.07 0.04 0.04 0.00 0.09 0.00 0.00 57.88 58.12 2zm3 h LEU 1126Cb 0.05 0.19 -0.01 0.00 0.09 0.00 0.00 40.66 40.97 2zm3 h LEU 1126CO -0.08 -0.37 0.14 0.78 0.09 0.00 0.00 178.44 179.00 2zm3 h ASN 1127N -0.58 0.07 0.44 -0.43 -0.26 -1.08 -0.71 115.58 113.03 2zm3 h ASN 1127Ca -0.03 -0.00 -0.15 0.00 -0.56 0.00 0.00 56.30 55.56 2zm3 h ASN 1127Cb 0.49 -0.02 -0.01 0.00 -1.06 0.00 0.00 38.32 37.72 2zm3 h ASN 1127CO 0.02 0.05 -0.63 0.00 -1.06 0.00 0.00 177.43 175.81 2zm3 h ALA 1128N 1.89 0.85 -0.29 -0.83 0.00 -0.82 -1.91 119.26 118.16 2zm3 h ALA 1128Ca 0.09 -0.56 0.00 0.00 0.00 0.00 0.00 54.91 54.44 2zm3 h ALA 1128Cb 0.26 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.97 2zm3 h ALA 1128CO -0.01 0.75 0.00 0.09 0.00 0.00 0.00 179.25 180.09 2zm3 n ASN 1129N -3.84 3.22 -3.42 0.00 3.02 -0.38 -4.91 115.26 108.95 2zm3 n ASN 1129Ca -0.02 -2.42 -0.17 0.00 -0.03 0.00 0.00 54.58 51.94 2zm3 n ASN 1129Cb 0.63 -0.56 0.09 0.00 -0.61 0.00 0.00 39.78 39.33 2zm3 n ASN 1129CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 2zm3 n LYS 1130N 0.33 -6.48 -4.63 3.52 4.76 -0.72 -4.92 118.16 110.03 2zm3 n LYS 1130Ca 0.14 0.85 -0.25 0.00 -2.87 0.00 0.00 58.31 56.18 2zm3 n LYS 1130Cb 0.68 -5.86 -0.14 0.00 -1.84 0.00 0.00 35.03 27.87 2zm3 n LYS 1130CO 0.00 0.00 0.00 -0.06 -1.37 0.00 0.00 177.40 175.97 2zm3 s PHE 1131N -3.36 1.74 -0.14 2.13 0.08 -0.55 -1.17 117.98 116.72 2zm3 s PHE 1131Ca 0.01 -0.37 -0.03 0.00 0.12 0.00 0.00 56.93 56.67 2zm3 s PHE 1131Cb -0.00 -1.04 -0.03 0.00 -0.57 0.00 0.00 43.02 41.38 2zm3 s PHE 1131CO 0.73 0.08 -0.04 0.08 -0.10 0.00 0.00 175.22 175.97 2zm3 s VAL 1132N -0.79 3.92 -0.06 -0.44 1.01 -0.69 -3.43 120.40 119.92 2zm3 s VAL 1132Ca 0.07 -0.36 -0.26 0.00 0.00 0.00 0.00 61.98 61.42 2zm3 s VAL 1132Cb -0.09 -2.69 -0.22 0.00 0.00 0.00 0.00 36.38 33.39 2zm3 s VAL 1132CO 0.02 0.52 1.10 -0.74 0.00 0.00 0.00 175.10 176.00 2zm3 h HIS 1133N 6.32 -0.02 0.00 5.22 2.76 -1.89 -1.82 115.15 125.72 2zm3 h HIS 1133Ca -0.36 -0.00 0.00 0.00 -2.20 0.00 0.00 60.37 57.81 2zm3 h HIS 1133Cb 1.19 0.00 0.00 0.00 1.55 0.00 0.00 27.41 30.15 2zm3 h HIS 1133CO 0.55 0.61 0.00 0.54 -1.30 0.00 0.00 177.93 178.32 2zm3 n ARG 1134N -4.79 0.00 -2.16 5.26 1.74 -1.26 -3.24 116.66 112.20 2zm3 n ARG 1134Ca -0.09 0.00 -0.01 0.00 -0.77 0.00 0.00 57.85 56.99 2zm3 n ARG 1134Cb 0.31 -2.23 0.04 0.00 -1.02 0.00 0.00 32.46 29.57 2zm3 n ARG 1134CO 0.00 0.00 0.00 -3.47 -1.52 0.00 0.00 177.63 172.64 2zm3 n ASP 1135N 0.00 0.34 -4.69 0.55 2.03 -1.26 -4.99 116.55 108.53 2zm3 n ASP 1135Ca 0.00 -2.06 -0.42 0.00 0.52 0.00 0.00 54.79 52.83 2zm3 n ASP 1135Cb 0.00 -0.05 -0.03 0.00 -0.72 0.00 0.00 41.12 40.32 2zm3 n ASP 1135CO 0.00 0.00 0.00 -0.22 -1.92 0.00 0.00 177.20 175.06 2zm3 s LEU 1136N -2.29 4.33 -0.02 -2.67 2.96 -1.26 -4.80 118.68 114.93 2zm3 s LEU 1136Ca 0.21 2.18 -0.29 0.00 -0.22 0.00 0.00 54.13 56.01 2zm3 s LEU 1136Cb 0.32 -3.56 0.11 0.00 0.50 0.00 0.00 46.19 43.55 2zm3 s LEU 1136CO -0.09 -0.73 0.92 0.00 -1.32 0.00 0.00 176.35 175.13 2zm3 s ALA 1137N 2.29 -1.84 0.33 5.97 0.00 -1.26 -4.76 121.76 122.49 2zm3 s ALA 1137Ca 0.65 1.06 0.03 0.00 0.00 0.00 0.00 51.96 53.70 2zm3 s ALA 1137Cb -0.33 0.37 0.62 0.00 0.00 0.00 0.00 23.12 23.78 2zm3 s ALA 1137CO 0.28 -0.68 1.95 0.00 0.00 0.00 0.00 175.76 177.31 2zm3 h ALA 1138N 2.00 1.58 0.00 0.00 0.00 -1.93 -0.20 119.26 120.72 2zm3 h ALA 1138Ca -0.21 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.67 2zm3 h ALA 1138Cb 1.23 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 18.78 2zm3 h ALA 1138CO 0.30 0.32 0.00 0.07 0.00 0.00 0.00 179.25 179.94 2zm3 h ARG 1139N 0.90 0.00 -0.49 0.00 0.11 -1.92 -1.88 114.38 111.10 2zm3 h ARG 1139Ca 0.32 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.40 2zm3 h ARG 1139Cb 0.13 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.21 2zm3 h ARG 1139CO -0.10 0.00 0.00 0.09 0.10 0.00 0.00 179.97 180.06 2zm3 n ASN 1140N -2.67 3.42 -4.71 0.08 3.02 -0.10 -4.74 115.26 109.57 2zm3 n ASN 1140Ca -0.00 -1.96 -0.23 0.00 -0.03 0.00 0.00 54.58 52.36 2zm3 n ASN 1140Cb 0.18 -0.32 -0.06 0.00 -0.61 0.00 0.00 39.78 38.97 2zm3 n ASN 1140CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2zm3 s MET 1142N -3.60 0.93 -0.16 0.00 -1.94 -0.14 -0.39 119.30 114.01 2zm3 s MET 1142Ca 0.31 -1.14 -0.03 0.00 -1.71 0.00 0.00 55.69 53.13 2zm3 s MET 1142Cb -0.07 -0.82 -0.02 0.00 2.01 0.00 0.00 34.83 35.93 2zm3 s MET 1142CO 0.21 0.16 -0.06 0.08 -0.01 0.00 0.00 175.02 175.40 2zm3 s VAL 1143N -1.93 3.58 0.83 -6.03 1.01 0.16 -1.57 120.40 116.46 2zm3 s VAL 1143Ca 0.05 -0.46 -0.11 0.00 0.00 0.00 0.00 61.98 61.46 2zm3 s VAL 1143Cb -0.06 -2.56 0.13 0.00 0.00 0.00 0.00 36.38 33.88 2zm3 s VAL 1143CO 0.02 0.49 1.17 0.00 0.00 0.00 0.00 175.10 176.78 2zm3 s ALA 1144N 0.54 2.74 0.29 5.51 0.00 0.26 -1.54 121.76 129.56 2zm3 s ALA 1144Ca -0.05 -1.06 -0.01 0.00 0.00 0.00 0.00 51.96 50.84 2zm3 s ALA 1144Cb -0.15 -2.69 0.45 0.00 0.00 0.00 0.00 23.12 20.73 2zm3 s ALA 1144CO 0.03 -1.85 1.92 1.49 0.00 0.00 0.00 175.76 177.35 2zm3 h GLU 1145N -1.11 1.09 -0.59 0.00 4.57 -1.88 -0.79 114.58 115.87 2zm3 h GLU 1145Ca -0.44 -0.07 0.00 0.00 -1.18 0.00 0.00 59.36 57.68 2zm3 h GLU 1145Cb 1.28 -0.25 0.00 0.00 -0.16 0.00 0.00 28.75 29.63 2zm3 h GLU 1145CO 0.51 0.72 0.00 -0.40 -1.18 0.00 0.00 179.01 178.66 2zm3 n ASP 1146N -4.46 2.80 0.00 1.04 5.68 -1.26 -4.89 116.55 115.46 2zm3 n ASP 1146Ca 0.13 -2.25 0.00 0.00 -0.50 0.00 0.00 54.79 52.17 2zm3 n ASP 1146Cb 0.13 -0.43 0.00 0.00 -1.14 0.00 0.00 41.12 39.67 2zm3 n ASP 1146CO 0.00 0.00 0.00 0.49 -1.33 0.00 0.00 177.20 176.36 2zm3 n PHE 1147N 0.48 0.00 -1.89 2.11 3.72 -0.30 -5.01 117.46 116.56 2zm3 n PHE 1147Ca 0.14 0.00 -0.42 0.00 -0.05 0.00 0.00 57.45 57.12 2zm3 n PHE 1147Cb 0.54 -0.05 -0.02 0.00 -0.94 0.00 0.00 39.48 39.01 2zm3 n PHE 1147CO 0.00 0.00 0.00 0.99 -0.05 0.00 0.00 176.76 177.70 2zm3 s THR 1148N -3.16 2.40 -0.13 4.37 2.01 -1.26 -4.65 115.64 115.22 2zm3 s THR 1148Ca 0.00 0.32 -0.07 0.00 0.31 0.00 0.00 61.69 62.25 2zm3 s THR 1148Cb 0.00 -3.20 -0.04 0.00 0.01 0.00 0.00 72.50 69.27 2zm3 s THR 1148CO 0.00 0.04 0.14 -0.69 -0.69 0.00 0.00 174.62 173.42 2zm3 s VAL 1149N 0.30 5.50 0.04 3.82 1.01 -1.26 -0.57 120.40 129.23 2zm3 s VAL 1149Ca 0.64 0.21 0.01 0.00 0.00 0.00 0.00 61.98 62.84 2zm3 s VAL 1149Cb -0.45 -3.41 -0.02 0.00 0.00 0.00 0.00 36.38 32.50 2zm3 s VAL 1149CO 0.42 0.60 -0.05 -0.54 0.00 0.00 0.00 175.10 175.53 2zm3 s LYS 1150N -0.89 0.47 0.02 2.72 1.02 -0.61 -4.48 119.74 117.99 2zm3 s LYS 1150Ca 0.14 -0.77 -0.30 0.00 0.02 0.00 0.00 55.97 55.06 2zm3 s LYS 1150Cb -0.12 -0.08 -0.06 0.00 -0.52 0.00 0.00 37.83 37.05 2zm3 s LYS 1150CO 0.03 -0.01 1.38 0.42 -0.92 0.00 0.00 175.35 176.26 2zm3 s ILE 1151N -1.76 3.67 0.00 2.17 -1.09 -0.05 -0.96 121.20 123.18 2zm3 s ILE 1151Ca -0.10 1.10 0.00 0.00 -2.23 0.00 0.00 60.65 59.43 2zm3 s ILE 1151Cb -0.08 -3.71 0.00 0.00 -1.58 0.00 0.00 42.46 37.10 2zm3 s ILE 1151CO -0.01 0.02 0.49 0.61 -1.23 0.00 0.00 174.94 174.81 2zm3 n GLY 1152N 3.58 -0.16 2.93 6.18 0.00 -0.09 -1.53 105.19 116.09 2zm3 n GLY 1152Ca 0.12 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 46.01 2zm3 n GLY 1152CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2zm3 s ASP 1153N -0.20 -0.12 -0.07 1.61 2.15 -1.12 -4.94 116.67 113.99 2zm3 s ASP 1153Ca 0.00 0.32 0.10 0.00 0.43 0.00 0.00 52.55 53.39 2zm3 s ASP 1153Cb 0.00 0.20 0.15 0.00 -0.30 0.00 0.00 42.92 42.97 2zm3 s ASP 1153CO 0.00 -0.15 1.06 0.49 -0.17 0.00 0.00 175.17 176.40 2zm3 n PHE 1154N 4.21 0.00 0.19 -5.34 3.01 -1.26 -4.83 117.46 113.45 2zm3 n PHE 1154Ca -0.26 -0.52 0.18 0.00 1.01 0.00 0.00 57.45 57.85 2zm3 n PHE 1154Cb 0.52 -0.10 0.82 0.00 -0.01 0.00 0.00 39.48 40.71 2zm3 n PHE 1154CO 0.00 0.00 0.00 0.78 1.01 0.00 0.00 176.76 178.55 2zm3 h GLY 1155N 0.00 0.00 -1.21 1.37 0.00 -1.94 -2.53 103.07 98.76 2zm3 h GLY 1155Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 2zm3 h GLY 1155CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 176.54 177.57 2zm3 n MET 1156N -3.71 1.79 -2.08 4.80 2.81 -1.26 -5.02 117.12 114.45 2zm3 n MET 1156Ca 0.02 -1.68 -0.39 0.00 -1.81 0.00 0.00 57.70 53.85 2zm3 n MET 1156Cb 0.38 -1.27 -0.00 0.00 -0.71 0.00 0.00 33.22 31.62 2zm3 n MET 1156CO 0.00 0.00 0.00 0.95 1.51 0.00 0.00 175.97 178.43 2zm3 s THR 1157N -1.02 2.70 0.05 2.03 -4.23 -0.95 -4.64 115.64 109.58 2zm3 s THR 1157Ca 0.20 0.58 0.06 0.00 -1.18 0.00 0.00 61.69 61.36 2zm3 s THR 1157Cb 0.12 -3.33 -0.03 0.00 1.34 0.00 0.00 72.50 70.61 2zm3 s THR 1157CO 0.17 0.05 -0.17 -0.13 -0.54 0.00 0.00 174.62 174.00 2zm3 s ARG 1158N -2.42 1.10 -0.18 3.99 1.81 -0.68 -4.99 118.95 117.58 2zm3 s ARG 1158Ca 0.60 -0.89 -0.26 0.00 -1.72 0.00 0.00 55.73 53.46 2zm3 s ARG 1158Cb -0.36 -1.18 -0.01 0.00 -0.45 0.00 0.00 34.95 32.95 2zm3 s ARG 1158CO 0.45 0.29 0.87 0.34 -0.68 0.00 0.00 175.30 176.57 2zm3 s ASP 1159N -1.31 6.98 -0.20 0.23 -1.08 -1.26 -1.71 116.67 118.32 2zm3 s ASP 1159Ca 0.04 1.21 0.01 0.00 -0.52 0.00 0.00 52.55 53.29 2zm3 s ASP 1159Cb -0.09 -2.47 0.03 0.00 -1.46 0.00 0.00 42.92 38.93 2zm3 s ASP 1159CO 0.02 -0.45 -0.16 0.27 0.52 0.00 0.00 175.17 175.36 2zm3 s ILE 1160N 2.35 2.20 0.00 4.11 -4.36 -0.31 -4.98 121.20 120.21 2zm3 s ILE 1160Ca 0.39 -1.07 0.00 0.00 -0.26 0.00 0.00 60.65 59.71 2zm3 s ILE 1160Cb -0.16 -2.02 0.00 0.00 1.25 0.00 0.00 42.46 41.53 2zm3 s ILE 1160CO 0.11 0.39 0.00 1.21 0.24 0.00 0.00 174.94 176.90 2zm3 n GLU 1162N 4.59 0.00 -0.05 0.37 2.13 -1.26 -0.82 120.64 125.60 2zm3 n GLU 1162Ca -0.19 0.00 -0.06 0.00 0.66 0.00 0.00 57.16 57.57 2zm3 n GLU 1162Cb 0.48 -0.15 -0.04 0.00 0.27 0.00 0.00 31.44 32.00 2zm3 n GLU 1162CO 0.00 0.00 0.00 2.41 -0.41 0.00 0.00 177.13 179.13 2zm3 n THR 1163N 0.00 0.53 -1.09 6.31 -1.04 -1.26 -5.33 114.28 112.40 2zm3 n THR 1163Ca 0.00 -0.22 -0.03 0.00 -2.04 0.00 0.00 64.05 61.76 2zm3 n THR 1163Cb 0.00 -0.83 -0.01 0.00 -1.82 0.00 0.00 70.33 67.67 2zm3 n THR 1163CO 0.00 0.00 0.00 0.47 -0.64 0.00 0.00 175.07 174.90 2zm3 n ASP 1164N -2.70 -3.69 -3.48 8.00 8.00 -0.00 -5.20 116.55 117.47 2zm3 n ASP 1164Ca -0.16 0.07 0.01 0.00 0.71 0.00 0.00 54.79 55.42 2zm3 n ASP 1164Cb 0.68 -1.45 -0.04 0.00 -0.02 0.00 0.00 41.12 40.29 2zm3 n ASP 1164CO 0.00 0.00 0.00 -0.60 -0.39 0.00 0.00 177.20 176.21 2zm3 s ARG 1167N -1.59 0.38 -0.07 -1.24 3.52 -1.26 -4.58 118.95 114.11 2zm3 s ARG 1167Ca 0.00 0.95 -0.30 0.00 -0.13 0.00 0.00 55.73 56.25 2zm3 s ARG 1167Cb 0.00 0.56 -0.04 0.00 -1.56 0.00 0.00 34.95 33.91 2zm3 s ARG 1167CO 0.00 -0.13 1.33 0.21 -0.81 0.00 0.00 175.30 175.90 2zm3 s LYS 1168N 2.56 4.28 -0.02 5.12 2.47 -0.15 -4.96 119.74 129.04 2zm3 s LYS 1168Ca -0.04 1.82 -0.10 0.00 -1.56 0.00 0.00 55.97 56.09 2zm3 s LYS 1168Cb -0.08 -3.67 -0.05 0.00 -1.46 0.00 0.00 37.83 32.57 2zm3 s LYS 1168CO -0.18 -0.61 0.58 0.78 0.16 0.00 0.00 175.35 176.09 2zm3 h GLY 1169N 8.91 -0.37 0.00 5.54 0.00 -1.96 -3.46 103.07 111.73 2zm3 h GLY 1169Ca -0.34 0.14 0.00 0.00 0.00 0.00 0.00 47.33 47.13 2zm3 h GLY 1169CO 0.92 -0.14 0.00 0.61 0.00 0.00 0.00 176.54 177.94 2zm3 n GLY 1170N 0.45 4.40 3.71 4.60 0.00 -1.26 -5.07 105.19 112.02 2zm3 n GLY 1170Ca -0.04 -1.45 -0.43 0.00 0.00 0.00 0.00 46.02 44.09 2zm3 n GLY 1170CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 2zm3 n LYS 1171N 0.00 2.71 -4.42 1.61 3.00 -1.26 -5.01 118.16 114.79 2zm3 n LYS 1171Ca 0.00 0.98 -0.26 0.00 -0.00 0.00 0.00 58.31 59.03 2zm3 n LYS 1171Cb 0.00 -2.83 -0.11 0.00 0.00 0.00 0.00 35.03 32.09 2zm3 n LYS 1171CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.40 177.60 2zm3 s GLY 1172N 1.58 1.77 0.00 3.14 0.00 -1.26 -5.06 107.32 107.49 2zm3 s GLY 1172Ca 0.77 -1.71 0.01 0.00 0.00 0.00 0.00 44.72 43.80 2zm3 s GLY 1172CO 0.34 -1.76 1.01 1.04 0.00 0.00 0.00 173.10 173.73 2zm3 n LEU 1173N -0.12 2.08 -4.77 0.66 4.77 -1.26 -5.02 117.00 113.34 2zm3 n LEU 1173Ca -0.09 -1.96 -0.41 0.00 -0.03 0.00 0.00 56.01 53.52 2zm3 n LEU 1173Cb 0.57 -0.03 -0.01 0.00 -2.33 0.00 0.00 43.42 41.62 2zm3 n LEU 1173CO 0.33 0.52 1.09 -0.76 -1.33 0.00 0.00 177.39 177.24 2zm3 s LEU 1174N -0.97 4.37 0.22 2.23 1.43 -1.26 -4.96 118.68 119.74 2zm3 s LEU 1174Ca 0.03 2.85 -0.30 0.00 -1.03 0.00 0.00 54.13 55.68 2zm3 s LEU 1174Cb 0.02 -3.65 -0.09 0.00 0.03 0.00 0.00 46.19 42.49 2zm3 s LEU 1174CO 0.02 -0.73 1.37 -2.16 0.23 0.00 0.00 176.35 175.08 2zm3 s PRO 1175N -1.52 4.34 0.36 1.29 0.04 -1.26 -4.94 135.00 133.31 2zm3 s PRO 1175Ca 0.54 2.16 0.04 0.00 0.04 0.00 0.00 61.00 63.78 2zm3 s PRO 1175Cb -0.43 -3.16 0.68 0.00 0.04 0.00 0.00 34.50 31.63 2zm3 s PRO 1175CO 0.54 -0.32 1.96 -0.39 0.04 0.00 0.00 177.00 178.83 2zm3 h VAL 1176N 3.65 1.16 0.00 -0.36 -1.51 -1.94 -2.99 116.25 114.27 2zm3 h VAL 1176Ca -0.45 -0.50 0.00 0.00 -1.23 0.00 0.00 66.70 64.52 2zm3 h VAL 1176Cb 1.22 0.65 0.00 0.00 -2.13 0.00 0.00 31.29 31.02 2zm3 h VAL 1176CO 0.77 0.19 0.00 0.54 -1.23 0.00 0.00 177.57 177.85 2zm3 n ARG 1177N -4.37 0.45 0.00 5.19 1.74 -1.26 -1.75 116.66 116.65 2zm3 n ARG 1177Ca 0.03 0.02 0.00 0.00 -0.77 0.00 0.00 57.85 57.13 2zm3 n ARG 1177Cb 0.14 -1.50 0.00 0.00 -1.02 0.00 0.00 32.46 30.08 2zm3 n ARG 1177CO 0.00 0.00 0.00 0.91 -1.52 0.00 0.00 177.63 177.02 2zm3 n TRP 1178N -1.04 0.00 -3.66 -1.55 8.01 -1.13 -4.93 117.44 113.14 2zm3 n TRP 1178Ca 0.11 -0.23 -0.36 0.00 -1.31 0.00 0.00 57.50 55.71 2zm3 n TRP 1178Cb 0.06 -0.02 -0.06 0.00 -2.01 0.00 0.00 31.31 29.28 2zm3 n TRP 1178CO 0.00 0.00 0.00 -1.64 -1.01 0.00 0.00 177.69 175.04 2zm3 s MET 1179N -0.46 3.70 0.77 -0.99 -1.94 -0.72 -4.35 119.30 115.31 2zm3 s MET 1179Ca 0.00 0.12 -0.12 0.00 -1.71 0.00 0.00 55.69 53.98 2zm3 s MET 1179Cb 0.00 -3.13 0.06 0.00 2.01 0.00 0.00 34.83 33.77 2zm3 s MET 1179CO 0.00 0.67 1.12 -1.54 -0.01 0.00 0.00 175.02 175.26 2zm3 s SER 1180N -1.39 4.29 0.24 3.03 1.04 -1.26 -4.83 113.70 114.81 2zm3 s SER 1180Ca 0.25 2.01 -0.05 0.00 0.48 0.00 0.00 55.95 58.64 2zm3 s SER 1180Cb -0.14 -2.55 0.37 0.00 0.10 0.00 0.00 66.02 63.80 2zm3 s SER 1180CO 0.13 -2.18 1.80 -0.65 0.98 0.00 0.00 173.24 173.32 2zm3 h PRO 1181N -0.89 0.71 -0.02 4.02 0.11 -1.93 -1.06 132.00 132.94 2zm3 h PRO 1181Ca -0.45 -0.04 -0.14 0.00 0.11 0.00 0.00 66.00 65.48 2zm3 h PRO 1181Cb 1.25 -0.16 -0.02 0.00 0.11 0.00 0.00 31.00 32.18 2zm3 h PRO 1181CO 0.50 0.47 -0.64 1.05 -0.21 0.00 0.00 178.00 179.17 2zm3 h GLU 1182N 0.74 0.08 -0.40 1.05 9.09 -1.91 -1.73 114.58 121.50 2zm3 h GLU 1182Ca 0.38 -0.06 -0.08 0.00 0.05 0.00 0.00 59.36 59.64 2zm3 h GLU 1182Cb 0.35 0.01 -0.01 0.00 -1.65 0.00 0.00 28.75 27.44 2zm3 h GLU 1182CO -0.25 0.69 -0.08 0.77 0.05 0.00 0.00 179.01 180.19 2zm3 h SER 1183N 0.06 0.76 -0.51 3.06 0.02 -1.52 -0.89 113.55 114.53 2zm3 h SER 1183Ca -0.01 -0.36 -0.03 0.00 -0.84 0.00 0.00 61.79 60.56 2zm3 h SER 1183Cb 1.13 -0.21 -0.03 0.00 0.14 0.00 0.00 62.40 63.44 2zm3 h SER 1183CO 0.09 0.94 0.22 -0.07 -1.14 0.00 0.00 176.83 176.87 2zm3 h LEU 1184N 0.57 0.72 0.10 5.07 3.38 -1.00 0.10 115.31 124.26 2zm3 h LEU 1184Ca 0.10 -0.09 -0.17 0.00 0.09 0.00 0.00 57.88 57.81 2zm3 h LEU 1184Cb 0.60 -0.19 0.01 0.00 0.09 0.00 0.00 40.66 41.17 2zm3 h LEU 1184CO 0.04 0.65 -0.82 0.50 0.09 0.00 0.00 178.44 178.90 2zm3 h LYS 1185N 0.79 0.20 0.00 1.13 3.64 -1.16 -3.41 116.57 117.76 2zm3 h LYS 1185Ca 0.19 -0.34 0.00 0.00 -1.27 0.00 0.00 60.65 59.22 2zm3 h LYS 1185Cb 0.16 0.13 0.00 0.00 -0.41 0.00 0.00 32.23 32.10 2zm3 h LYS 1185CO -0.02 1.16 0.00 -0.25 -2.27 0.00 0.00 179.45 178.08 2zm3 n ASP 1186N -4.20 0.71 -1.55 4.20 8.00 -0.35 -5.00 116.55 118.36 2zm3 n ASP 1186Ca -0.17 -1.07 -0.15 0.00 0.71 0.00 0.00 54.79 54.11 2zm3 n ASP 1186Cb 0.76 0.00 -0.02 0.00 -0.02 0.00 0.00 41.12 41.84 2zm3 n ASP 1186CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2zm3 n GLY 1187N -0.04 0.28 3.77 0.44 0.00 0.35 -4.68 105.19 105.32 2zm3 n GLY 1187Ca 0.00 -0.27 -0.39 0.00 0.00 0.00 0.00 46.02 45.36 2zm3 n GLY 1187CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2zm3 s VAL 1188N -2.70 4.85 -0.06 1.61 1.01 -1.24 -0.97 120.40 122.89 2zm3 s VAL 1188Ca 0.00 1.27 0.02 0.00 0.00 0.00 0.00 61.98 63.27 2zm3 s VAL 1188Cb 0.00 -3.94 0.01 0.00 0.00 0.00 0.00 36.38 32.46 2zm3 s VAL 1188CO 0.00 0.45 -0.12 -0.36 0.00 0.00 0.00 175.10 175.07 2zm3 s PHE 1189N -0.41 1.40 0.02 5.22 0.40 -1.26 -3.65 117.98 119.69 2zm3 s PHE 1189Ca 0.31 -0.51 0.00 0.00 -0.60 0.00 0.00 56.93 56.14 2zm3 s PHE 1189Cb -0.19 -1.03 -0.00 0.00 0.51 0.00 0.00 43.02 42.31 2zm3 s PHE 1189CO 0.18 -0.27 0.01 0.25 0.70 0.00 0.00 175.22 176.10 2zm3 n THR 1190N 3.82 0.00 0.19 0.64 -2.24 -1.26 -4.80 114.28 110.63 2zm3 n THR 1190Ca -0.23 -0.11 0.05 0.00 -2.27 0.00 0.00 64.05 61.49 2zm3 n THR 1190Cb 0.52 0.05 0.38 0.00 -2.10 0.00 0.00 70.33 69.18 2zm3 n THR 1190CO 0.00 0.00 0.00 0.71 -0.57 0.00 0.00 175.07 175.21 2zm3 h THR 1191N 1.05 1.03 -0.55 4.28 1.35 -1.93 -2.91 112.91 115.23 2zm3 h THR 1191Ca -0.01 -1.38 -0.06 0.00 -0.55 0.00 0.00 66.41 64.41 2zm3 h THR 1191Cb 0.05 1.79 -0.02 0.00 -1.73 0.00 0.00 68.15 68.25 2zm3 h THR 1191CO 0.02 0.36 0.10 1.88 -0.25 0.00 0.00 175.52 177.62 2zm3 h TYR 1192N 0.00 0.97 0.00 4.73 0.05 -1.93 -1.44 116.97 119.34 2zm3 h TYR 1192Ca -0.00 -0.13 -0.04 0.00 0.05 0.00 0.00 58.73 58.61 2zm3 h TYR 1192Cb 0.76 -0.27 -0.01 0.00 1.01 0.00 0.00 36.73 38.23 2zm3 h TYR 1192CO 0.00 0.85 -0.17 0.66 -1.05 0.00 0.00 178.16 178.45 2zm3 h SER 1193N 0.80 0.00 -0.33 3.88 4.64 -1.90 -0.69 113.55 119.96 2zm3 h SER 1193Ca 0.17 0.00 -0.14 0.00 -0.47 0.00 0.00 61.79 61.35 2zm3 h SER 1193Cb 0.40 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.48 2zm3 h SER 1193CO 0.01 0.17 -0.32 0.44 -0.87 0.00 0.00 176.83 176.26 2zm3 h ASP 1194N 0.00 0.90 -0.45 4.97 3.32 -1.27 -2.75 116.42 121.14 2zm3 h ASP 1194Ca -0.00 -0.38 -0.07 0.00 0.02 0.00 0.00 57.03 56.60 2zm3 h ASP 1194Cb 0.69 -0.25 -0.02 0.00 0.22 0.00 0.00 39.33 39.97 2zm3 h ASP 1194CO 0.02 1.14 0.05 0.58 -1.72 0.00 0.00 179.24 179.31 2zm3 h VAL 1195N 0.72 1.24 -0.31 -1.35 2.07 -0.18 -1.23 116.25 117.21 2zm3 h VAL 1195Ca 0.07 -0.95 0.05 0.00 0.82 0.00 0.00 66.70 66.69 2zm3 h VAL 1195Cb 0.88 0.79 -0.04 0.00 -1.52 0.00 0.00 31.29 31.40 2zm3 h VAL 1195CO 0.08 0.34 0.05 -0.25 0.02 0.00 0.00 177.57 177.81 2zm3 h TRP 1196N 0.79 0.08 -0.78 1.57 2.91 -1.07 -1.96 115.95 117.48 2zm3 h TRP 1196Ca 0.16 0.02 -0.04 0.00 1.13 0.00 0.00 58.89 60.16 2zm3 h TRP 1196Cb 0.40 0.01 -0.04 0.00 -0.51 0.00 0.00 29.16 29.03 2zm3 h TRP 1196CO 0.02 0.01 0.35 0.77 -1.03 0.00 0.00 178.44 178.56 2zm3 h SER 1197N 0.16 1.05 -0.84 2.65 0.02 -1.14 -1.86 113.55 113.58 2zm3 h SER 1197Ca 0.15 -0.15 0.12 0.00 -0.84 0.00 0.00 61.79 61.06 2zm3 h SER 1197Cb 0.17 -0.27 -0.08 0.00 0.14 0.00 0.00 62.40 62.36 2zm3 h SER 1197CO -0.20 0.91 0.47 0.15 -1.14 0.00 0.00 176.83 177.01 2zm3 h PHE 1198N 1.11 0.84 -0.95 3.45 3.57 -0.85 0.15 116.94 124.26 2zm3 h PHE 1198Ca 0.27 0.03 0.09 0.00 3.53 0.00 0.00 57.97 61.88 2zm3 h PHE 1198Cb 0.16 -0.25 -0.07 0.00 2.79 0.00 0.00 35.95 38.58 2zm3 h PHE 1198CO 0.01 0.29 0.59 0.78 -2.23 0.00 0.00 178.31 177.76 2zm3 h GLY 1199N 0.74 1.48 1.77 2.40 0.00 -0.58 -1.31 103.07 107.56 2zm3 h GLY 1199Ca 0.43 -0.42 -0.12 0.00 0.00 0.00 0.00 47.33 47.22 2zm3 h GLY 1199CO -0.29 0.24 -0.46 -2.08 0.00 0.00 0.00 176.54 173.95 2zm3 h VAL 1200N 1.02 1.33 0.00 4.60 2.07 -0.43 -2.48 116.25 122.36 2zm3 h VAL 1200Ca 0.44 -1.64 -0.10 0.00 0.82 0.00 0.00 66.70 66.22 2zm3 h VAL 1200Cb 0.30 1.76 -0.01 0.00 -1.52 0.00 0.00 31.29 31.81 2zm3 h VAL 1200CO -0.21 0.49 -0.46 -0.37 0.02 0.00 0.00 177.57 177.04 2zm3 h VAL 1201N 0.21 0.87 -0.51 2.57 -1.51 -0.43 -1.56 116.25 115.89 2zm3 h VAL 1201Ca 0.01 -1.99 -0.01 0.00 -1.23 0.00 0.00 66.70 63.49 2zm3 h VAL 1201Cb 0.89 2.26 -0.02 0.00 -2.13 0.00 0.00 31.29 32.29 2zm3 h VAL 1201CO 0.07 0.45 0.27 -0.07 -1.23 0.00 0.00 177.57 177.07 2zm3 h LEU 1202N 0.00 0.64 -0.70 4.19 3.38 -1.07 -0.68 115.31 121.06 2zm3 h LEU 1202Ca -0.00 -0.10 0.03 0.00 0.09 0.00 0.00 57.88 57.90 2zm3 h LEU 1202Cb 1.22 -0.16 -0.04 0.00 0.09 0.00 0.00 40.66 41.77 2zm3 h LEU 1202CO 0.06 0.55 0.44 -0.25 0.09 0.00 0.00 178.44 179.33 2zm3 h TRP 1203N 0.68 0.82 -0.91 1.13 7.01 -1.15 -1.16 115.95 122.37 2zm3 h TRP 1203Ca 0.18 0.02 -0.02 0.00 2.11 0.00 0.00 58.89 61.18 2zm3 h TRP 1203Cb 0.06 -0.27 -0.04 0.00 -2.10 0.00 0.00 29.16 26.80 2zm3 h TRP 1203CO -0.02 0.48 0.49 0.93 -2.79 0.00 0.00 178.44 177.53 2zm3 h GLU 1204N 0.86 1.26 -0.56 2.65 5.08 -0.88 -0.97 114.58 122.02 2zm3 h GLU 1204Ca 0.28 -0.15 -0.08 0.00 -1.00 0.00 0.00 59.36 58.41 2zm3 h GLU 1204Cb 0.01 -0.25 -0.02 0.00 0.50 0.00 0.00 28.75 28.99 2zm3 h GLU 1204CO -0.10 0.92 0.03 0.82 -1.00 0.00 0.00 179.01 179.68 2zm3 h ILE 1205N 1.27 1.25 0.00 3.13 2.04 -0.53 0.80 117.51 125.47 2zm3 h ILE 1205Ca 0.32 -1.05 0.00 0.00 1.00 0.00 0.00 64.86 65.13 2zm3 h ILE 1205Cb 0.03 0.79 0.00 0.00 -0.74 0.00 0.00 36.82 36.90 2zm3 h ILE 1205CO -0.05 0.38 0.00 0.00 0.00 0.00 0.00 178.15 178.48 2zm3 h ALA 1206N 1.15 1.00 -0.17 1.87 0.00 -0.69 -2.98 119.26 119.44 2zm3 h ALA 1206Ca 0.17 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.08 2zm3 h ALA 1206Cb 0.48 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.27 2zm3 h ALA 1206CO 0.02 0.00 0.00 0.25 0.00 0.00 0.00 179.25 179.52 2zm3 n THR 1207N -2.35 0.42 -4.00 0.00 -2.24 -0.42 -4.88 114.28 100.80 2zm3 n THR 1207Ca 0.04 -0.71 -0.29 0.00 -2.27 0.00 0.00 64.05 60.82 2zm3 n THR 1207Cb 0.35 0.94 -0.01 0.00 -2.10 0.00 0.00 70.33 69.51 2zm3 n THR 1207CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 2zm3 n LEU 1208N 0.66 -2.22 -2.46 3.22 4.77 -0.30 -3.59 117.00 117.09 2zm3 n LEU 1208Ca 0.09 -0.95 -0.09 0.00 -0.03 0.00 0.00 56.01 55.04 2zm3 n LEU 1208Cb 0.36 -2.29 0.04 0.00 -2.33 0.00 0.00 43.42 39.21 2zm3 n LEU 1208CO 0.08 0.40 0.03 0.00 -1.33 0.00 0.00 177.39 176.56 2zm3 n ALA 1209N -4.44 -1.51 -2.18 -1.18 0.00 0.26 -3.88 120.51 107.59 2zm3 n ALA 1209Ca -0.13 0.05 -0.27 0.00 0.00 0.00 0.00 53.44 53.09 2zm3 n ALA 1209Cb 0.60 -3.05 0.01 0.00 0.00 0.00 0.00 19.45 17.01 2zm3 n ALA 1209CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 2zm3 s GLU 1210N -4.00 3.35 -0.00 0.00 2.02 -1.24 -4.90 118.70 113.92 2zm3 s GLU 1210Ca 0.20 0.18 -0.30 0.00 0.02 0.00 0.00 54.97 55.06 2zm3 s GLU 1210Cb -0.03 -2.32 -0.05 0.00 0.10 0.00 0.00 34.13 31.83 2zm3 s GLU 1210CO 0.41 -0.39 1.37 -1.14 0.02 0.00 0.00 175.26 175.53 2zm3 s GLN 1211N -4.86 4.30 0.37 1.61 0.74 -1.26 -4.89 119.66 115.68 2zm3 s GLN 1211Ca 0.50 1.93 -0.28 0.00 0.05 0.00 0.00 55.36 57.56 2zm3 s GLN 1211Cb -0.10 -3.56 -0.11 0.00 1.10 0.00 0.00 33.01 30.34 2zm3 s GLN 1211CO 0.46 -0.55 1.44 -2.14 -0.55 0.00 0.00 175.29 173.94 2zm3 s PRO 1212N 2.31 4.12 -1.53 1.67 0.02 -1.26 -2.97 135.00 137.36 2zm3 s PRO 1212Ca 0.63 2.47 -0.00 0.00 0.02 0.00 0.00 61.00 64.11 2zm3 s PRO 1212Cb -0.31 -2.96 0.00 0.00 0.02 0.00 0.00 34.50 31.26 2zm3 s PRO 1212CO 0.26 -0.48 0.05 0.66 -0.33 0.00 0.00 177.00 177.16 2zm3 n TYR 1213N 0.46 -0.95 -1.60 6.54 4.01 -1.26 -4.95 117.16 119.42 2zm3 n TYR 1213Ca 0.01 0.05 -0.43 0.00 -0.16 0.00 0.00 57.90 57.37 2zm3 n TYR 1213Cb 0.40 -3.63 -0.00 0.00 -0.31 0.00 0.00 39.34 35.80 2zm3 n TYR 1213CO 0.00 0.00 0.00 0.94 -0.46 0.00 0.00 176.86 177.34 2zm3 n GLN 1214N -2.82 1.37 0.00 -0.72 7.27 -1.16 -1.55 117.38 119.77 2zm3 n GLN 1214Ca -0.20 0.49 0.00 0.00 0.07 0.00 0.00 57.00 57.35 2zm3 n GLN 1214Cb 0.66 -1.94 0.00 0.00 2.41 0.00 0.00 30.24 31.36 2zm3 n GLN 1214CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 2zm3 n GLY 1215N 1.20 3.25 3.66 1.69 0.00 -1.26 -5.05 105.19 108.68 2zm3 n GLY 1215Ca 0.09 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.80 2zm3 n GLY 1215CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2zm3 s LEU 1216N 0.00 3.39 0.67 0.99 1.43 -0.60 -5.13 118.68 119.43 2zm3 s LEU 1216Ca 0.00 -0.12 -0.09 0.00 -1.03 0.00 0.00 54.13 52.89 2zm3 s LEU 1216Cb 0.00 -2.02 0.02 0.00 0.03 0.00 0.00 46.19 44.21 2zm3 s LEU 1216CO 0.00 0.24 1.02 -0.94 0.23 0.00 0.00 176.35 176.90 2zm3 s SER 1217N -1.83 5.43 0.39 2.29 1.04 -1.26 -4.83 113.70 114.92 2zm3 s SER 1217Ca 0.21 0.93 0.14 0.00 0.48 0.00 0.00 55.95 57.71 2zm3 s SER 1217Cb -0.11 -1.78 0.99 0.00 0.10 0.00 0.00 66.02 65.22 2zm3 s SER 1217CO 0.13 -1.28 1.83 0.78 0.98 0.00 0.00 173.24 175.68 2zm3 h ASN 1218N -0.49 0.51 0.69 7.02 2.35 -1.99 0.12 115.58 123.78 2zm3 h ASN 1218Ca -0.45 0.06 -0.14 0.00 -0.55 0.00 0.00 56.30 55.21 2zm3 h ASN 1218Cb 1.26 -0.04 -0.02 0.00 0.05 0.00 0.00 38.32 39.57 2zm3 h ASN 1218CO 0.63 0.20 -0.69 -0.08 -1.65 0.00 0.00 177.43 175.84 2zm3 h GLU 1219N 0.51 0.00 0.00 0.81 4.81 -2.00 -2.65 114.58 116.05 2zm3 h GLU 1219Ca 0.50 0.00 -0.15 0.00 -0.13 0.00 0.00 59.36 59.58 2zm3 h GLU 1219Cb 1.11 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 30.47 2zm3 h GLU 1219CO -0.23 0.69 -0.75 1.96 -0.73 0.00 0.00 179.01 179.94 2zm3 h GLN 1220N 0.00 0.00 -0.59 1.92 4.20 -1.22 -3.12 115.11 116.31 2zm3 h GLN 1220Ca -0.01 0.00 -0.08 0.00 0.06 0.00 0.00 58.65 58.62 2zm3 h GLN 1220Cb 1.22 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 28.97 2zm3 h GLN 1220CO 0.09 0.72 0.05 0.28 -0.67 0.00 0.00 178.83 179.30 2zm3 h VAL 1221N 0.00 1.26 -0.40 -0.54 2.07 -0.93 -1.05 116.25 116.65 2zm3 h VAL 1221Ca -0.01 -1.07 0.03 0.00 0.82 0.00 0.00 66.70 66.47 2zm3 h VAL 1221Cb 1.57 0.80 -0.03 0.00 -1.52 0.00 0.00 31.29 32.10 2zm3 h VAL 1221CO 0.09 0.39 0.21 0.25 0.02 0.00 0.00 177.57 178.53 2zm3 h LEU 1222N 0.90 0.31 -0.17 2.57 5.85 -1.42 -0.41 115.31 122.94 2zm3 h LEU 1222Ca 0.17 0.02 -0.13 0.00 0.84 0.00 0.00 57.88 58.78 2zm3 h LEU 1222Cb 0.49 -0.04 0.00 0.00 0.37 0.00 0.00 40.66 41.48 2zm3 h LEU 1222CO 0.02 0.22 -0.39 0.03 -0.34 0.00 0.00 178.44 177.98 2zm3 h ARG 1223N 0.42 0.57 0.32 1.25 3.08 -1.51 -2.33 114.38 116.18 2zm3 h ARG 1223Ca 0.17 -0.38 -0.00 0.00 0.07 0.00 0.00 59.98 59.84 2zm3 h ARG 1223Cb 0.07 0.05 -0.02 0.00 0.08 0.00 0.00 29.97 30.15 2zm3 h ARG 1223CO -0.11 1.00 -0.29 0.35 -1.07 0.00 0.00 179.97 179.84 2zm3 h PHE 1224N 0.22 -0.79 0.00 3.04 3.57 -0.98 -2.40 116.94 119.61 2zm3 h PHE 1224Ca -0.00 0.00 -0.13 0.00 3.53 0.00 0.00 57.97 61.38 2zm3 h PHE 1224Cb 1.00 0.30 -0.02 0.00 2.79 0.00 0.00 35.95 40.02 2zm3 h PHE 1224CO 0.10 -0.43 -0.60 0.28 -2.23 0.00 0.00 178.31 175.43 2zm3 h VAL 1225N -0.64 1.40 0.00 1.41 2.07 -1.17 0.25 116.25 119.58 2zm3 h VAL 1225Ca -0.02 -2.08 -0.09 0.00 0.82 0.00 0.00 66.70 65.33 2zm3 h VAL 1225Cb 0.57 2.13 -0.01 0.00 -1.52 0.00 0.00 31.29 32.46 2zm3 h VAL 1225CO -0.04 0.59 -0.43 -0.03 0.02 0.00 0.00 177.57 177.68 2zm3 h MET 1226N 0.00 0.00 -0.69 1.57 4.05 -1.34 -3.07 114.93 115.45 2zm3 h MET 1226Ca -0.01 0.00 0.00 0.00 -0.28 0.00 0.00 59.70 59.41 2zm3 h MET 1226Cb 1.08 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 31.88 2zm3 h MET 1226CO 0.08 0.43 0.00 0.39 0.23 0.00 0.00 176.91 178.04 2zm3 n GLU 1227N -3.53 2.66 0.00 0.39 1.02 -0.91 -4.93 120.64 115.34 2zm3 n GLU 1227Ca -0.00 -2.57 0.00 0.00 -0.02 0.00 0.00 57.16 54.57 2zm3 n GLU 1227Cb 0.55 -1.56 0.00 0.00 -0.02 0.00 0.00 31.44 30.42 2zm3 n GLU 1227CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2zm3 n GLY 1228N 1.64 0.87 3.77 0.62 0.00 -1.14 -5.07 105.19 105.88 2zm3 n GLY 1228Ca 0.24 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.91 2zm3 n GLY 1228CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2zm3 s GLY 1229N -1.30 2.44 0.12 -0.02 0.00 0.06 -4.99 107.32 103.63 2zm3 s GLY 1229Ca 0.00 0.72 0.04 0.00 0.00 0.00 0.00 44.72 45.48 2zm3 s GLY 1229CO 0.00 1.08 -0.10 1.08 0.00 0.00 0.00 173.10 175.16 2zm3 s LEU 1230N -4.28 2.47 0.37 0.66 1.43 -1.26 -4.48 118.68 113.59 2zm3 s LEU 1230Ca 0.71 -0.91 -0.28 0.00 -1.03 0.00 0.00 54.13 52.62 2zm3 s LEU 1230Cb -0.23 -0.32 -0.10 0.00 0.03 0.00 0.00 46.19 45.57 2zm3 s LEU 1230CO 0.34 -0.30 1.35 -0.76 0.23 0.00 0.00 176.35 177.21 2zm3 s LEU 1231N -2.79 4.33 0.45 1.79 1.43 -1.26 -5.00 118.68 117.63 2zm3 s LEU 1231Ca 0.11 2.77 -0.22 0.00 -1.03 0.00 0.00 54.13 55.76 2zm3 s LEU 1231Cb -0.00 -3.73 -0.09 0.00 0.03 0.00 0.00 46.19 42.40 2zm3 s LEU 1231CO 0.00 -0.72 1.05 -1.81 0.23 0.00 0.00 176.35 175.10 2zm3 s ASP 1232N -0.48 6.51 0.03 2.29 1.01 -1.26 -4.97 116.67 119.80 2zm3 s ASP 1232Ca 0.52 2.00 -0.33 0.00 0.71 0.00 0.00 52.55 55.46 2zm3 s ASP 1232Cb -0.41 -2.57 -0.11 0.00 1.01 0.00 0.00 42.92 40.83 2zm3 s ASP 1232CO 0.54 -0.67 1.84 1.17 0.21 0.00 0.00 175.17 178.27 2zm3 n LYS 1233N -0.55 2.47 -1.69 8.23 4.81 -1.26 -4.93 118.16 125.24 2zm3 n LYS 1233Ca 0.07 0.90 -0.37 0.00 -0.87 0.00 0.00 58.31 58.04 2zm3 n LYS 1233Cb 0.51 -2.77 0.06 0.00 0.02 0.00 0.00 35.03 32.85 2zm3 n LYS 1233CO 0.00 0.00 0.00 -2.30 1.17 0.00 0.00 177.40 176.27 2zm3 n PRO 1234N 6.04 1.08 -1.81 1.64 -0.02 -1.26 -4.91 135.00 135.76 2zm3 n PRO 1234Ca 0.20 0.42 -0.42 0.00 -2.02 0.00 0.00 63.50 61.68 2zm3 n PRO 1234Cb 0.34 -2.40 -0.02 0.00 -0.02 0.00 0.00 33.50 31.40 2zm3 n PRO 1234CO 0.00 0.00 0.00 0.34 1.98 0.00 0.00 175.50 177.82 2zm3 s ASP 1235N -1.29 6.43 0.00 2.55 2.15 -1.26 -2.09 116.67 123.16 2zm3 s ASP 1235Ca 0.79 2.86 0.00 0.00 0.43 0.00 0.00 52.55 56.63 2zm3 s ASP 1235Cb -0.40 -2.62 0.00 0.00 -0.30 0.00 0.00 42.92 39.60 2zm3 s ASP 1235CO 0.43 -0.89 0.00 0.59 -0.17 0.00 0.00 175.17 175.14 2zm3 n ASN 1236N 2.78 -2.89 -4.72 -0.34 3.02 -1.26 -4.97 115.26 106.87 2zm3 n ASN 1236Ca 0.10 0.00 -0.42 0.00 -0.03 0.00 0.00 54.58 54.23 2zm3 n ASN 1236Cb 0.37 -1.53 -0.03 0.00 -0.61 0.00 0.00 39.78 37.98 2zm3 n ASN 1236CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2zm3 n PRO 1238N 3.63 1.59 -0.30 0.00 -0.02 -1.26 -4.84 135.00 133.80 2zm3 n PRO 1238Ca 0.10 0.57 0.11 0.00 -2.02 0.00 0.00 63.50 62.26 2zm3 n PRO 1238Cb 0.42 -2.22 0.34 0.00 -0.02 0.00 0.00 33.50 32.03 2zm3 n PRO 1238CO 0.00 0.00 0.00 -0.44 1.98 0.00 0.00 175.50 177.04 2zm3 h ASP 1239N 4.58 0.72 -0.49 2.55 3.32 -2.00 -1.75 116.42 123.37 2zm3 h ASP 1239Ca -0.45 0.05 -0.02 0.00 0.02 0.00 0.00 57.03 56.62 2zm3 h ASP 1239Cb 1.30 -0.10 -0.02 0.00 0.22 0.00 0.00 39.33 40.74 2zm3 h ASP 1239CO 0.79 0.36 0.23 -0.03 -1.72 0.00 0.00 179.24 178.86 2zm3 h MET 1240N 0.76 0.70 -0.62 3.56 4.05 -2.00 -2.08 114.93 119.30 2zm3 h MET 1240Ca 0.47 -0.11 -0.04 0.00 -0.28 0.00 0.00 59.70 59.74 2zm3 h MET 1240Cb 0.69 -0.12 -0.03 0.00 -0.80 0.00 0.00 31.60 31.34 2zm3 h MET 1240CO -0.23 0.60 0.23 -0.07 0.23 0.00 0.00 176.91 177.66 2zm3 h LEU 1241N 0.64 0.88 -0.61 3.39 3.38 -1.69 -2.41 115.31 118.89 2zm3 h LEU 1241Ca 0.17 -0.19 -0.11 0.00 0.09 0.00 0.00 57.88 57.84 2zm3 h LEU 1241Cb 0.13 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 40.64 2zm3 h LEU 1241CO -0.02 0.83 -0.11 0.15 0.09 0.00 0.00 178.44 179.39 2zm3 h PHE 1242N 0.88 1.10 -0.55 1.13 3.57 -1.35 -1.92 116.94 119.81 2zm3 h PHE 1242Ca 0.20 -0.22 0.01 0.00 3.53 0.00 0.00 57.97 61.49 2zm3 h PHE 1242Cb 0.24 -0.28 -0.03 0.00 2.79 0.00 0.00 35.95 38.68 2zm3 h PHE 1242CO 0.02 1.03 0.36 0.93 -2.23 0.00 0.00 178.31 178.41 2zm3 h GLU 1243N 0.88 0.72 -0.47 1.11 4.39 -1.19 -0.86 114.58 119.15 2zm3 h GLU 1243Ca 0.14 -0.04 -0.13 0.00 0.34 0.00 0.00 59.36 59.67 2zm3 h GLU 1243Cb 0.66 -0.16 -0.01 0.00 -0.10 0.00 0.00 28.75 29.14 2zm3 h GLU 1243CO 0.05 0.47 -0.20 1.25 -1.16 0.00 0.00 179.01 179.42 2zm3 h LEU 1244N 0.74 1.00 -0.74 1.33 5.85 -1.04 -2.53 115.31 119.92 2zm3 h LEU 1244Ca 0.20 -0.39 0.01 0.00 0.84 0.00 0.00 57.88 58.53 2zm3 h LEU 1244Cb -0.08 -0.27 -0.04 0.00 0.37 0.00 0.00 40.66 40.63 2zm3 h LEU 1244CO -0.04 1.17 0.49 0.24 -0.34 0.00 0.00 178.44 179.95 2zm3 h MET 1245N 0.82 0.97 -0.73 1.25 2.86 -0.59 -2.34 114.93 117.18 2zm3 h MET 1245Ca 0.11 -0.06 -0.00 0.00 -2.06 0.00 0.00 59.70 57.69 2zm3 h MET 1245Cb 0.78 -0.22 -0.04 0.00 0.06 0.00 0.00 31.60 32.18 2zm3 h MET 1245CO 0.06 0.65 0.44 0.00 1.06 0.00 0.00 176.91 179.12 2zm3 h ARG 1246N 1.00 0.98 -0.13 1.72 3.08 -0.92 -0.22 114.38 119.90 2zm3 h ARG 1246Ca 0.27 -0.08 -0.13 0.00 0.07 0.00 0.00 59.98 60.11 2zm3 h ARG 1246Cb -0.12 -0.21 -0.01 0.00 0.08 0.00 0.00 29.97 29.71 2zm3 h ARG 1246CO -0.06 0.68 -0.48 0.52 -1.07 0.00 0.00 179.97 179.56 2zm3 h MET 1247N 1.00 0.32 0.00 0.04 2.86 -1.16 -2.83 114.93 115.16 2zm3 h MET 1247Ca 0.26 -0.18 -0.08 0.00 -2.06 0.00 0.00 59.70 57.65 2zm3 h MET 1247Cb -0.05 0.01 -0.01 0.00 0.06 0.00 0.00 31.60 31.61 2zm3 h MET 1247CO -0.05 0.74 -0.37 0.00 1.06 0.00 0.00 176.91 178.28 2zm3 n TRP 1249N -3.48 2.42 -1.72 0.00 8.01 -0.18 -3.97 117.44 118.51 2zm3 n TRP 1249Ca 0.00 -1.38 -0.42 0.00 -1.31 0.00 0.00 57.50 54.39 2zm3 n TRP 1249Cb 0.52 -0.72 -0.00 0.00 -2.01 0.00 0.00 31.31 29.10 2zm3 n TRP 1249CO 0.00 0.00 0.00 1.04 -1.01 0.00 0.00 177.69 177.72 2zm3 n GLN 1250N -0.49 2.28 -0.11 -0.99 1.13 -1.19 -4.91 117.38 113.09 2zm3 n GLN 1250Ca 0.44 0.80 -0.11 0.00 -1.94 0.00 0.00 57.00 56.18 2zm3 n GLN 1250Cb 1.41 -2.43 -0.03 0.00 0.11 0.00 0.00 30.24 29.29 2zm3 n GLN 1250CO 0.00 0.00 0.00 -0.92 -1.44 0.00 0.00 177.06 174.70 2zm3 h TYR 1251N 2.63 0.72 -3.59 1.08 3.20 -1.93 -3.39 116.97 115.69 2zm3 h TYR 1251Ca -0.48 -0.16 -0.56 0.00 3.14 0.00 0.00 58.73 60.67 2zm3 h TYR 1251Cb 1.27 -0.17 -0.08 0.00 1.54 0.00 0.00 36.73 39.29 2zm3 h TYR 1251CO 0.51 0.82 0.89 1.21 -1.64 0.00 0.00 178.16 179.95 2zm3 s ASN 1252N -6.26 6.57 0.48 -2.11 3.84 -1.26 -4.88 114.94 111.32 2zm3 s ASN 1252Ca -0.13 0.33 0.28 0.00 0.21 0.00 0.00 52.86 53.55 2zm3 s ASN 1252Cb 0.09 -2.54 1.35 0.00 -0.55 0.00 0.00 41.25 39.60 2zm3 s ASN 1252CO 0.79 -1.28 1.81 -0.65 -2.79 0.00 0.00 177.10 174.98 2zm3 h PRO 1253N 9.29 0.16 0.00 0.43 0.11 -1.98 0.23 132.00 140.24 2zm3 h PRO 1253Ca -0.24 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.86 2zm3 h PRO 1253Cb 1.06 -0.04 0.00 0.00 0.11 0.00 0.00 31.00 32.13 2zm3 h PRO 1253CO 1.13 0.11 0.00 1.63 -0.21 0.00 0.00 178.00 180.66 2zm3 n LYS 1254N -4.38 0.15 -0.04 1.05 5.02 -1.26 -2.50 118.16 116.20 2zm3 n LYS 1254Ca 0.24 0.29 0.12 0.00 -2.02 0.00 0.00 58.31 56.95 2zm3 n LYS 1254Cb 1.04 -1.74 0.39 0.00 -0.02 0.00 0.00 35.03 34.69 2zm3 n LYS 1254CO 0.00 0.00 0.00 -1.33 -0.52 0.00 0.00 177.40 175.55 2zm3 n MET 1255N -2.01 1.87 -2.17 1.97 2.81 0.80 -4.91 117.12 115.47 2zm3 n MET 1255Ca 0.04 -1.28 -0.31 0.00 -1.81 0.00 0.00 57.70 54.34 2zm3 n MET 1255Cb 0.28 -1.45 -0.00 0.00 -0.71 0.00 0.00 33.22 31.33 2zm3 n MET 1255CO 0.00 0.00 0.00 1.03 1.51 0.00 0.00 175.97 178.51 2zm3 s ARG 1256N -1.89 3.68 0.62 0.03 0.52 -1.04 -4.90 118.95 115.98 2zm3 s ARG 1256Ca 0.35 0.70 -0.13 0.00 -0.52 0.00 0.00 55.73 56.13 2zm3 s ARG 1256Cb 0.20 -2.16 -0.03 0.00 0.52 0.00 0.00 34.95 33.48 2zm3 s ARG 1256CO 0.31 -0.41 1.04 -2.14 0.02 0.00 0.00 175.30 174.11 2zm3 s PRO 1257N -4.77 3.37 0.63 3.54 0.02 -1.26 -5.07 135.00 131.46 2zm3 s PRO 1257Ca 0.55 0.94 -0.07 0.00 0.02 0.00 0.00 61.00 62.43 2zm3 s PRO 1257Cb -0.11 -2.05 0.02 0.00 0.02 0.00 0.00 34.50 32.38 2zm3 s PRO 1257CO 0.46 -0.75 0.95 -1.54 -0.33 0.00 0.00 177.00 175.79 2zm3 s SER 1258N -3.60 5.46 0.38 2.53 1.04 -1.26 -4.91 113.70 113.34 2zm3 s SER 1258Ca 0.58 0.77 0.09 0.00 0.48 0.00 0.00 55.95 57.87 2zm3 s SER 1258Cb -0.13 -1.68 0.77 0.00 0.10 0.00 0.00 66.02 65.09 2zm3 s SER 1258CO 0.47 -1.19 1.92 -0.26 0.98 0.00 0.00 173.24 175.17 2zm3 h PHE 1259N -0.33 0.30 -0.73 5.02 0.04 -1.94 -1.53 116.94 117.77 2zm3 h PHE 1259Ca -0.45 -0.03 -0.03 0.00 2.80 0.00 0.00 57.97 60.26 2zm3 h PHE 1259Cb 1.26 -0.09 -0.03 0.00 2.20 0.00 0.00 35.95 39.29 2zm3 h PHE 1259CO 0.46 0.38 0.36 -0.07 -0.60 0.00 0.00 178.31 178.84 2zm3 h LEU 1260N 0.28 0.95 -0.75 1.54 3.38 -1.93 -0.77 115.31 118.01 2zm3 h LEU 1260Ca 0.06 -0.13 -0.11 0.00 0.09 0.00 0.00 57.88 57.79 2zm3 h LEU 1260Cb 0.34 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 40.83 2zm3 h LEU 1260CO 0.02 0.81 -0.18 -0.33 0.09 0.00 0.00 178.44 178.85 2zm3 h GLU 1261N 1.02 0.77 0.12 1.13 5.08 -1.79 -1.62 114.58 119.29 2zm3 h GLU 1261Ca 0.25 -0.29 -0.01 0.00 -1.00 0.00 0.00 59.36 58.32 2zm3 h GLU 1261Cb 0.11 -0.05 0.00 0.00 0.50 0.00 0.00 28.75 29.31 2zm3 h GLU 1261CO -0.03 0.89 -0.06 0.82 -1.00 0.00 0.00 179.01 179.63 2zm3 h ILE 1262N 0.68 0.97 -0.80 3.13 2.04 -0.91 -2.22 117.51 120.39 2zm3 h ILE 1262Ca 0.10 -0.34 0.03 0.00 1.00 0.00 0.00 64.86 65.66 2zm3 h ILE 1262Cb 0.67 1.19 -0.05 0.00 -0.74 0.00 0.00 36.82 37.89 2zm3 h ILE 1262CO 0.05 0.08 0.51 0.40 0.00 0.00 0.00 178.15 179.19 2zm3 h ILE 1263N -0.32 1.12 -0.58 -0.67 2.04 -1.14 -2.38 117.51 115.58 2zm3 h ILE 1263Ca -0.02 -0.34 0.04 0.00 1.00 0.00 0.00 64.86 65.54 2zm3 h ILE 1263Cb 0.26 0.04 -0.03 0.00 -0.74 0.00 0.00 36.82 36.34 2zm3 h ILE 1263CO 0.03 0.18 0.38 -1.28 0.00 0.00 0.00 178.15 177.46 2zm3 h SER 1264N 1.00 0.56 1.27 1.72 0.87 -1.12 -0.10 113.55 117.75 2zm3 h SER 1264Ca 0.32 -0.01 0.00 0.00 -1.23 0.00 0.00 61.79 60.88 2zm3 h SER 1264Cb 0.02 -0.13 0.00 0.00 -0.44 0.00 0.00 62.40 61.85 2zm3 h SER 1264CO -0.12 0.39 0.00 -1.54 -0.53 0.00 0.00 176.83 175.03 2zm3 n SER 1265N -4.47 0.79 -0.05 6.23 3.41 -0.85 -3.58 113.62 115.10 2zm3 n SER 1265Ca 0.07 0.60 0.02 0.00 -0.26 0.00 0.00 58.87 59.30 2zm3 n SER 1265Cb 0.16 -0.81 0.02 0.00 -0.26 0.00 0.00 64.21 63.32 2zm3 n SER 1265CO 0.00 0.00 0.00 2.30 -0.16 0.00 0.00 175.04 177.18 2zm3 n ILE 1266N -2.28 0.79 -0.03 -1.33 -5.35 -0.75 -4.85 119.36 105.56 2zm3 n ILE 1266Ca 0.05 -0.85 -0.01 0.00 -0.27 0.00 0.00 62.75 61.67 2zm3 n ILE 1266Cb 0.38 0.52 0.27 0.00 -1.74 0.00 0.00 39.64 39.07 2zm3 n ILE 1266CO 0.00 0.00 0.00 0.07 -1.76 0.00 0.00 176.55 174.86 2zm3 h LYS 1267N 0.00 0.59 0.00 6.28 2.10 -1.10 -1.55 116.57 122.89 2zm3 h LYS 1267Ca 0.00 -0.13 0.00 0.00 -2.00 0.00 0.00 60.65 58.52 2zm3 h LYS 1267Cb 0.78 -0.09 0.00 0.00 -0.90 0.00 0.00 32.23 32.03 2zm3 h LYS 1267CO 0.00 0.60 0.00 0.39 -2.00 0.00 0.00 179.45 178.44 2zm3 n GLU 1268N -4.28 0.28 0.00 0.07 -0.58 -1.26 -2.25 120.64 112.62 2zm3 n GLU 1268Ca 0.02 0.07 0.09 0.00 -0.42 0.00 0.00 57.16 56.92 2zm3 n GLU 1268Cb 0.24 -1.50 -0.01 0.00 -0.57 0.00 0.00 31.44 29.61 2zm3 n GLU 1268CO 0.00 0.00 0.00 0.39 -0.48 0.00 0.00 177.13 177.04 2zm3 n GLU 1269N -1.32 1.51 -2.32 3.49 1.02 -0.60 -4.95 120.64 117.47 2zm3 n GLU 1269Ca 0.10 -0.85 -0.34 0.00 -0.02 0.00 0.00 57.16 56.05 2zm3 n GLU 1269Cb 0.20 -1.35 -0.01 0.00 -0.02 0.00 0.00 31.44 30.26 2zm3 n GLU 1269CO 0.00 0.00 0.00 -1.64 1.18 0.00 0.00 177.13 176.67 2zm3 s MET 1270N -2.12 3.54 0.59 3.49 -1.94 -0.95 -4.80 119.30 117.10 2zm3 s MET 1270Ca 0.15 1.37 -0.16 0.00 -1.71 0.00 0.00 55.69 55.34 2zm3 s MET 1270Cb 0.15 -2.05 -0.04 0.00 2.01 0.00 0.00 34.83 34.89 2zm3 s MET 1270CO 0.47 -0.65 1.06 -1.21 -0.01 0.00 0.00 175.02 174.68 2zm3 s GLU 1271N -3.50 3.35 0.29 2.03 2.02 -1.26 -4.93 118.70 116.70 2zm3 s GLU 1271Ca 0.67 1.22 0.02 0.00 0.02 0.00 0.00 54.97 56.91 2zm3 s GLU 1271Cb -0.18 -2.04 0.74 0.00 0.10 0.00 0.00 34.13 32.75 2zm3 s GLU 1271CO 0.27 -0.79 1.62 -1.35 0.02 0.00 0.00 175.26 175.03 2zm3 h PRO 1272N 0.52 0.12 0.00 0.39 0.11 -1.97 -1.74 132.00 129.44 2zm3 h PRO 1272Ca -0.47 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.63 2zm3 h PRO 1272Cb 1.22 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 32.30 2zm3 h PRO 1272CO 0.58 0.08 0.00 0.41 -0.21 0.00 0.00 178.00 178.86 2zm3 n GLY 1273N -1.41 -0.59 0.34 -0.55 0.00 -1.26 -3.17 105.19 98.55 2zm3 n GLY 1273Ca 0.22 -0.02 -0.05 0.00 0.00 0.00 0.00 46.02 46.18 2zm3 n GLY 1273CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 2zm3 h PHE 1274N 0.00 1.13 0.00 1.61 3.57 -1.68 -2.88 116.94 118.69 2zm3 h PHE 1274Ca 0.00 -0.08 -0.04 0.00 3.53 0.00 0.00 57.97 61.38 2zm3 h PHE 1274Cb 0.07 -0.34 -0.01 0.00 2.79 0.00 0.00 35.95 38.46 2zm3 h PHE 1274CO 0.00 0.85 -0.21 -0.09 -2.23 0.00 0.00 178.31 176.63 2zm3 h ARG 1275N 1.09 0.00 -0.00 1.11 2.43 -1.80 -0.99 114.38 116.21 2zm3 h ARG 1275Ca 0.25 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.42 2zm3 h ARG 1275Cb 0.20 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.75 2zm3 h ARG 1275CO -0.02 0.21 -0.45 -0.85 -1.51 0.00 0.00 179.97 177.35 2zm3 n GLU 1276N -3.81 0.12 0.00 0.20 0.28 -1.09 -4.49 120.64 111.85 2zm3 n GLU 1276Ca -0.02 -0.07 0.00 0.00 -0.16 0.00 0.00 57.16 56.91 2zm3 n GLU 1276Cb 0.31 -1.50 0.00 0.00 1.43 0.00 0.00 31.44 31.68 2zm3 n GLU 1276CO 0.00 0.00 0.00 1.33 -0.16 0.00 0.00 177.13 178.30 2zm3 n VAL 1277N -1.38 0.00 -1.73 3.84 0.24 -1.02 -5.09 118.33 113.19 2zm3 n VAL 1277Ca 0.07 -0.06 -0.30 0.00 -2.04 0.00 0.00 64.34 62.00 2zm3 n VAL 1277Cb 0.34 0.46 0.05 0.00 -1.47 0.00 0.00 33.84 33.21 2zm3 n VAL 1277CO 0.00 0.00 0.00 -0.94 -2.14 0.00 0.00 176.83 173.75 2zm3 s SER 1278N -1.20 5.40 0.21 -1.34 1.04 -0.41 -4.18 113.70 113.22 2zm3 s SER 1278Ca 0.00 1.36 -0.01 0.00 0.48 0.00 0.00 55.95 57.79 2zm3 s SER 1278Cb 0.00 -2.23 0.16 0.00 0.10 0.00 0.00 66.02 64.05 2zm3 s SER 1278CO 0.00 -1.40 1.52 0.15 0.98 0.00 0.00 173.24 174.50 2zm3 h PHE 1279N -0.69 0.56 -0.58 5.02 3.57 -1.89 -3.31 116.94 119.62 2zm3 h PHE 1279Ca -0.45 -0.20 0.12 0.00 3.53 0.00 0.00 57.97 60.96 2zm3 h PHE 1279Cb 1.23 -0.10 -0.09 0.00 2.79 0.00 0.00 35.95 39.77 2zm3 h PHE 1279CO 0.56 0.91 0.02 -0.92 -2.23 0.00 0.00 178.31 176.65 2zm3 h TYR 1280N 0.34 0.00 -0.91 0.41 5.03 -1.93 -1.30 116.97 118.62 2zm3 h TYR 1280Ca 0.00 0.04 -0.41 0.00 2.58 0.00 0.00 58.73 60.94 2zm3 h TYR 1280Cb 1.10 0.09 -0.25 0.00 1.55 0.00 0.00 36.73 39.22 2zm3 h TYR 1280CO 0.04 -0.13 0.52 0.66 -1.32 0.00 0.00 178.16 177.93 2zm3 n TYR 1281N -5.24 2.87 -3.56 -3.82 4.02 -1.25 -4.81 117.16 105.38 2zm3 n TYR 1281Ca 0.08 -1.62 -0.20 0.00 -0.01 0.00 0.00 57.90 56.15 2zm3 n TYR 1281Cb 0.32 -0.86 -0.01 0.00 -0.02 0.00 0.00 39.34 38.78 2zm3 n TYR 1281CO 0.00 0.00 0.00 -1.54 -1.01 0.00 0.00 176.86 174.31 2zm3 s SER 1282N -1.19 6.07 0.35 7.72 1.04 -0.49 -4.96 113.70 122.24 2zm3 s SER 1282Ca 0.56 -0.04 0.09 0.00 0.48 0.00 0.00 55.95 57.04 2zm3 s SER 1282Cb 0.47 -1.47 0.67 0.00 0.10 0.00 0.00 66.02 65.78 2zm3 s SER 1282CO 0.12 -0.35 1.83 -0.33 0.98 0.00 0.00 173.24 175.49 2zm3 h GLU 1283N 0.92 0.20 -0.88 4.02 4.39 -1.93 -2.44 114.58 118.85 2zm3 h GLU 1283Ca -0.48 -0.07 0.16 0.00 0.34 0.00 0.00 59.36 59.32 2zm3 h GLU 1283Cb 1.25 -0.02 -0.10 0.00 -0.10 0.00 0.00 28.75 29.78 2zm3 h GLU 1283CO 0.56 0.45 0.47 0.93 -1.16 0.00 0.00 179.01 180.26 2zm3 h GLU 1284N 0.18 0.61 0.00 2.33 5.08 -1.95 -3.54 114.58 117.30 2zm3 h GLU 1284Ca 0.03 -0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.35 2zm3 h GLU 1284Cb 0.56 -0.14 0.00 0.00 0.50 0.00 0.00 28.75 29.67 2zm3 h GLU 1284CO 0.04 0.41 0.00 -1.71 -1.00 0.00 0.00 179.01 176.75