#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1gee s TYR 2 N 0.00 3.42 0.53 1.12 1.51 -1.26 -4.96 117.35 117.71 1gee s TYR 2 Ca 0.00 -1.85 0.21 0.00 -1.01 0.00 0.00 57.07 54.42 1gee s TYR 2 Cb 0.00 -3.50 1.36 0.00 -0.11 0.00 0.00 41.96 39.71 1gee s TYR 2 CO 0.00 -0.99 2.07 0.87 -1.11 0.00 0.00 175.55 176.39 1gee h LYS 3 N 8.46 0.00 0.00 -0.62 1.57 -2.00 -1.73 116.57 122.25 1gee h LYS 3 Ca -0.21 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.57 1gee h LYS 3 Cb 1.07 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.38 1gee h LYS 3 CO 0.86 0.00 0.00 -0.40 -0.57 0.00 0.00 179.45 179.34 1gee n ASP 4 N -4.42 0.60 0.11 0.86 5.75 -1.26 -2.59 116.55 115.59 1gee n ASP 4 Ca 0.04 0.63 0.13 0.00 -0.01 0.00 0.00 54.79 55.57 1gee n ASP 4 Cb 0.37 -0.76 0.34 0.00 -1.03 0.00 0.00 41.12 40.04 1gee n ASP 4 CO 0.00 0.00 0.00 -0.07 -0.11 0.00 0.00 177.20 177.02 1gee h LEU 5 N 0.00 0.00 -9.54 -2.12 3.38 -1.58 -3.44 115.31 102.01 1gee h LEU 5 Ca 0.00 -0.04 -0.52 0.00 0.09 0.00 0.00 57.88 57.41 1gee h LEU 5 Cb 0.41 0.00 0.04 0.00 0.09 0.00 0.00 40.66 41.21 1gee h LEU 5 CO 0.00 0.02 1.09 -0.70 0.09 0.00 0.00 178.44 178.94 1gee s GLU 6 N -3.13 4.13 0.00 1.13 2.12 -1.07 -1.64 118.70 120.25 1gee s GLU 6 Ca 0.09 2.60 0.00 0.00 0.36 0.00 0.00 54.97 58.02 1gee s GLU 6 Cb 0.12 -3.49 0.00 0.00 0.26 0.00 0.00 34.13 31.02 1gee s GLU 6 CO 0.63 -0.83 0.00 0.41 -0.54 0.00 0.00 175.26 174.93 1gee n GLY 7 N 4.18 1.82 3.78 -1.50 0.00 -0.58 -4.94 105.19 107.95 1gee n GLY 7 Ca 0.17 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.83 1gee n GLY 7 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1gee s LYS 8 N -0.24 4.14 -0.29 1.61 -0.14 -0.65 -4.69 119.74 119.49 1gee s LYS 8 Ca 0.00 1.56 -0.11 0.00 -1.36 0.00 0.00 55.97 56.06 1gee s LYS 8 Cb 0.00 -2.56 -0.05 0.00 -1.68 0.00 0.00 37.83 33.54 1gee s LYS 8 CO 0.00 -0.17 0.19 0.08 -0.76 0.00 0.00 175.35 174.69 1gee s VAL 9 N -1.62 5.30 -0.13 3.17 1.01 -1.26 -0.10 120.40 126.77 1gee s VAL 9 Ca 0.58 0.13 0.01 0.00 0.00 0.00 0.00 61.98 62.70 1gee s VAL 9 Cb -0.23 -3.55 -0.00 0.00 0.00 0.00 0.00 36.38 32.60 1gee s VAL 9 CO 0.29 0.22 -0.17 -0.69 0.00 0.00 0.00 175.10 174.75 1gee s VAL 10 N 1.76 2.55 -0.14 2.92 1.01 0.57 -1.24 120.40 127.83 1gee s VAL 10 Ca 0.07 -0.82 -0.03 0.00 0.00 0.00 0.00 61.98 61.20 1gee s VAL 10 Cb -0.16 -2.05 -0.03 0.00 0.00 0.00 0.00 36.38 34.14 1gee s VAL 10 CO 0.11 0.53 -0.05 -0.69 0.00 0.00 0.00 175.10 175.00 1gee s VAL 11 N 0.60 3.81 -0.12 2.92 1.01 -0.23 -0.55 120.40 127.83 1gee s VAL 11 Ca -0.10 -0.40 -0.01 0.00 0.00 0.00 0.00 61.98 61.48 1gee s VAL 11 Cb -0.16 -2.64 0.03 0.00 0.00 0.00 0.00 36.38 33.60 1gee s VAL 11 CO 0.03 0.52 -0.05 -0.63 0.00 0.00 0.00 175.10 174.96 1gee s ILE 12 N 0.14 0.92 0.47 2.22 1.01 -0.96 -0.48 121.20 124.51 1gee s ILE 12 Ca -0.02 -0.30 -0.20 0.00 0.00 0.00 0.00 60.65 60.13 1gee s ILE 12 Cb -0.14 -1.01 -0.09 0.00 0.01 0.00 0.00 42.46 41.23 1gee s ILE 12 CO 0.03 0.28 0.99 0.42 0.00 0.00 0.00 174.94 176.66 1gee s THR 13 N 1.74 4.20 -1.41 2.92 -4.23 -0.68 -3.32 115.64 114.87 1gee s THR 13 Ca 0.04 1.29 -0.05 0.00 -1.18 0.00 0.00 61.69 61.79 1gee s THR 13 Cb -0.13 -3.56 0.03 0.00 1.34 0.00 0.00 72.50 70.18 1gee s THR 13 CO -0.08 -0.37 0.75 0.61 -0.54 0.00 0.00 174.62 174.99 1gee n GLY 14 N -0.70 -0.35 1.59 3.99 0.00 -1.24 -3.20 105.19 105.28 1gee n GLY 14 Ca 0.08 0.15 0.06 0.00 0.00 0.00 0.00 46.02 46.31 1gee n GLY 14 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1gee n SER 15 N -2.96 5.06 -0.00 1.61 3.41 -0.94 -4.28 113.62 115.52 1gee n SER 15 Ca -0.18 -3.00 0.12 0.00 -0.26 0.00 0.00 58.87 55.55 1gee n SER 15 Cb 0.63 -0.65 0.32 0.00 -0.26 0.00 0.00 64.21 64.25 1gee n SER 15 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 1gee n SER 16 N 0.18 0.41 -3.78 4.04 3.41 -1.22 -3.10 113.62 113.54 1gee n SER 16 Ca 0.27 -0.11 -0.12 0.00 -0.26 0.00 0.00 58.87 58.65 1gee n SER 16 Cb 1.13 0.11 -0.06 0.00 -0.26 0.00 0.00 64.21 65.12 1gee n SER 16 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 175.04 175.30 1gee s THR 17 N -3.00 0.00 0.00 6.66 -4.23 -1.26 -4.52 115.64 109.29 1gee s THR 17 Ca 0.12 -1.63 0.00 0.00 -1.18 0.00 0.00 61.69 59.00 1gee s THR 17 Cb 0.18 -2.43 0.00 0.00 1.34 0.00 0.00 72.50 71.59 1gee s THR 17 CO 0.67 0.00 0.00 0.61 -0.54 0.00 0.00 174.62 175.36 1gee n GLY 18 N -0.42 2.36 0.36 3.99 0.00 -1.26 -1.73 105.19 108.49 1gee n GLY 18 Ca 0.00 -0.10 -0.01 0.00 0.00 0.00 0.00 46.02 45.92 1gee n GLY 18 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1gee h LEU 19 N 0.00 0.99 -0.71 0.99 3.38 -1.93 -1.74 115.31 116.29 1gee h LEU 19 Ca 0.00 -0.03 -0.02 0.00 0.09 0.00 0.00 57.88 57.92 1gee h LEU 19 Cb 0.00 -0.25 -0.03 0.00 0.09 0.00 0.00 40.66 40.47 1gee h LEU 19 CO 0.00 0.72 0.36 1.23 0.09 0.00 0.00 178.44 180.84 1gee h GLY 20 N 1.17 1.08 0.91 0.83 0.00 -1.69 -0.28 103.07 105.08 1gee h GLY 20 Ca 0.32 -0.51 -0.02 0.00 0.00 0.00 0.00 47.33 47.11 1gee h GLY 20 CO -0.07 0.49 0.10 1.70 0.00 0.00 0.00 176.54 178.75 1gee h LYS 21 N 0.98 0.48 -0.76 4.80 3.64 -0.86 -0.85 116.57 124.00 1gee h LYS 21 Ca 0.25 -0.10 -0.02 0.00 -1.27 0.00 0.00 60.65 59.50 1gee h LYS 21 Cb 0.08 -0.07 -0.04 0.00 -0.41 0.00 0.00 32.23 31.79 1gee h LYS 21 CO -0.04 0.53 0.38 0.77 -2.27 0.00 0.00 179.45 178.82 1gee h SER 22 N 0.34 0.97 -0.30 4.20 0.02 -1.02 -1.42 113.55 116.34 1gee h SER 22 Ca 0.10 -0.10 -0.14 0.00 -0.84 0.00 0.00 61.79 60.81 1gee h SER 22 Cb 0.25 -0.25 -0.01 0.00 0.14 0.00 0.00 62.40 62.53 1gee h SER 22 CO -0.00 0.81 -0.31 0.24 -1.14 0.00 0.00 176.83 176.43 1gee h MET 23 N 1.07 0.82 -0.51 3.45 2.86 -0.85 -1.22 114.93 120.55 1gee h MET 23 Ca 0.26 -0.38 0.00 0.00 -2.06 0.00 0.00 59.70 57.52 1gee h MET 23 Cb 0.09 -0.01 -0.02 0.00 0.06 0.00 0.00 31.60 31.71 1gee h MET 23 CO -0.04 1.01 0.32 0.00 1.06 0.00 0.00 176.91 179.27 1gee h ALA 24 N 0.96 0.65 -0.45 6.32 0.00 -0.55 -0.37 119.26 125.81 1gee h ALA 24 Ca 0.08 -0.05 -0.07 0.00 0.00 0.00 0.00 54.91 54.87 1gee h ALA 24 Cb 0.85 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 18.42 1gee h ALA 24 CO 0.07 0.11 0.01 0.82 0.00 0.00 0.00 179.25 180.27 1gee h ILE 25 N 0.69 1.26 -0.36 0.00 2.04 -1.15 -1.89 117.51 118.10 1gee h ILE 25 Ca 0.18 -1.02 -0.01 0.00 1.00 0.00 0.00 64.86 65.02 1gee h ILE 25 Cb -0.05 1.03 -0.02 0.00 -0.74 0.00 0.00 36.82 37.04 1gee h ILE 25 CO -0.04 0.35 0.19 -0.09 0.00 0.00 0.00 178.15 178.57 1gee h ARG 26 N 0.64 0.50 -0.17 2.37 9.65 -0.90 -1.29 114.38 125.18 1gee h ARG 26 Ca 0.13 -0.06 -0.06 0.00 -1.10 0.00 0.00 59.98 58.89 1gee h ARG 26 Cb 0.48 -0.10 -0.01 0.00 -1.39 0.00 0.00 29.97 28.95 1gee h ARG 26 CO 0.02 0.42 -0.15 0.74 2.80 0.00 0.00 179.97 183.80 1gee h PHE 27 N 0.45 0.30 -0.51 2.20 -1.00 -1.00 -1.73 116.94 115.63 1gee h PHE 27 Ca 0.12 -0.04 -0.09 0.00 2.81 0.00 0.00 57.97 60.78 1gee h PHE 27 Cb 0.07 -0.08 -0.02 0.00 3.61 0.00 0.00 35.95 39.53 1gee h PHE 27 CO -0.03 0.43 -0.04 0.00 -1.61 0.00 0.00 178.31 177.06 1gee h ALA 28 N 1.59 0.96 0.00 2.45 0.00 -0.88 -1.10 119.26 122.27 1gee h ALA 28 Ca 0.05 -0.30 -0.04 0.00 0.00 0.00 0.00 54.91 54.62 1gee h ALA 28 Cb 0.43 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 18.01 1gee h ALA 28 CO 0.03 0.62 -0.18 1.15 0.00 0.00 0.00 179.25 180.87 1gee h THR 29 N 0.82 0.64 -0.17 0.00 2.02 -0.41 -0.22 112.91 115.60 1gee h THR 29 Ca 0.15 -0.79 0.00 0.00 0.77 0.00 0.00 66.41 66.54 1gee h THR 29 Cb 0.55 1.50 0.00 0.00 -1.74 0.00 0.00 68.15 68.46 1gee h THR 29 CO 0.03 0.18 0.00 -0.62 0.37 0.00 0.00 175.52 175.48 1gee n GLU 30 N -3.62 1.54 -1.78 6.66 -0.58 -0.71 -4.77 120.64 117.38 1gee n GLU 30 Ca -0.01 -0.82 -0.11 0.00 -0.42 0.00 0.00 57.16 55.80 1gee n GLU 30 Cb 0.31 -1.30 -0.02 0.00 -0.57 0.00 0.00 31.44 29.86 1gee n GLU 30 CO 0.00 0.00 0.00 1.63 -0.48 0.00 0.00 177.13 178.28 1gee n LYS 31 N 0.09 -0.82 -2.91 3.49 5.02 -0.09 -3.42 118.16 119.52 1gee n LYS 31 Ca 0.13 0.70 -0.28 0.00 -2.02 0.00 0.00 58.31 56.83 1gee n LYS 31 Cb 0.23 -4.73 -0.02 0.00 -0.02 0.00 0.00 35.03 30.49 1gee n LYS 31 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1gee s ALA 32 N -2.48 3.46 -0.17 7.82 0.00 -0.50 -1.53 121.76 128.37 1gee s ALA 32 Ca 0.00 -0.48 -0.18 0.00 0.00 0.00 0.00 51.96 51.30 1gee s ALA 32 Cb 0.00 -2.51 -0.04 0.00 0.00 0.00 0.00 23.12 20.57 1gee s ALA 32 CO 0.00 -0.11 0.47 0.15 0.00 0.00 0.00 175.76 176.26 1gee s LYS 33 N -4.23 4.25 -0.05 0.00 1.02 0.86 -4.38 119.74 117.21 1gee s LYS 33 Ca 0.47 0.37 0.03 0.00 0.02 0.00 0.00 55.97 56.85 1gee s LYS 33 Cb -0.10 -3.50 -0.03 0.00 -0.52 0.00 0.00 37.83 33.68 1gee s LYS 33 CO 0.37 0.01 -0.12 0.08 -0.92 0.00 0.00 175.35 174.78 1gee s VAL 34 N 1.12 3.27 -0.32 3.17 1.01 -0.88 -0.32 120.40 127.45 1gee s VAL 34 Ca 0.23 -0.68 -0.03 0.00 0.00 0.00 0.00 61.98 61.50 1gee s VAL 34 Cb -0.15 -2.31 0.05 0.00 0.00 0.00 0.00 36.38 33.97 1gee s VAL 34 CO 0.09 0.57 0.05 -0.69 0.00 0.00 0.00 175.10 175.13 1gee s VAL 35 N -0.78 3.26 0.31 2.92 1.01 0.28 -1.99 120.40 125.41 1gee s VAL 35 Ca 0.12 -1.39 -0.13 0.00 0.00 0.00 0.00 61.98 60.59 1gee s VAL 35 Cb -0.11 -2.91 -0.08 0.00 0.00 0.00 0.00 36.38 33.29 1gee s VAL 35 CO 0.01 -0.20 0.69 -0.69 0.00 0.00 0.00 175.10 174.92 1gee s VAL 36 N 1.28 4.77 -0.04 2.92 1.01 0.52 -2.28 120.40 128.58 1gee s VAL 36 Ca -0.03 0.75 0.03 0.00 0.00 0.00 0.00 61.98 62.73 1gee s VAL 36 Cb -0.20 -3.64 0.01 0.00 0.00 0.00 0.00 36.38 32.55 1gee s VAL 36 CO -0.00 -0.22 -0.12 0.21 0.00 0.00 0.00 175.10 174.97 1gee s ASN 37 N -2.48 1.59 0.09 3.32 3.84 -1.21 -0.59 114.94 119.51 1gee s ASN 37 Ca 0.52 -0.26 0.07 0.00 0.21 0.00 0.00 52.86 53.40 1gee s ASN 37 Cb -0.10 -0.54 -0.03 0.00 -0.55 0.00 0.00 41.25 40.02 1gee s ASN 37 CO 0.21 0.07 -0.17 -0.72 -2.79 0.00 0.00 177.10 173.70 1gee s TYR 38 N 0.33 1.49 -0.12 0.43 -0.85 -1.08 -2.22 117.35 115.33 1gee s TYR 38 Ca -0.07 -0.45 -0.24 0.00 -0.52 0.00 0.00 57.07 55.79 1gee s TYR 38 Cb -0.12 -0.82 -0.21 0.00 0.38 0.00 0.00 41.96 41.19 1gee s TYR 38 CO 0.02 0.13 0.70 -0.09 -1.52 0.00 0.00 175.55 174.79 1gee h ARG 39 N 4.14 -0.01 0.00 -3.49 2.43 -1.89 -0.80 114.38 114.75 1gee h ARG 39 Ca -0.43 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 58.74 1gee h ARG 39 Cb 1.19 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.74 1gee h ARG 39 CO 0.41 0.76 0.00 -1.13 -1.51 0.00 0.00 179.97 178.50 1gee n SER 40 N -4.67 0.00 -4.75 -3.80 3.41 -1.26 -4.19 113.62 98.36 1gee n SER 40 Ca -0.08 0.00 -0.27 0.00 -0.26 0.00 0.00 58.87 58.25 1gee n SER 40 Cb 0.38 0.00 0.10 0.00 -0.26 0.00 0.00 64.21 64.43 1gee n SER 40 CO 0.00 0.00 0.00 -0.75 -0.16 0.00 0.00 175.04 174.13 1gee s LYS 41 N -0.13 1.79 0.00 4.33 2.47 -1.26 -5.00 119.74 121.93 1gee s LYS 41 Ca 0.00 -0.22 0.02 0.00 -1.56 0.00 0.00 55.97 54.21 1gee s LYS 41 Cb 0.00 -2.04 0.05 0.00 -1.46 0.00 0.00 37.83 34.37 1gee s LYS 41 CO 0.00 -1.60 0.98 -0.85 0.16 0.00 0.00 175.35 174.05 1gee n GLU 42 N -3.21 2.54 -0.14 4.03 0.28 -1.26 -4.73 120.64 118.15 1gee n GLU 42 Ca 0.10 -1.47 -0.09 0.00 -0.16 0.00 0.00 57.16 55.54 1gee n GLU 42 Cb 0.60 -1.04 -0.00 0.00 1.43 0.00 0.00 31.44 32.43 1gee n GLU 42 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 177.13 176.53 1gee h ASP 43 N 0.33 0.53 0.14 -1.84 3.45 -1.99 0.61 116.42 117.65 1gee h ASP 43 Ca 0.00 -0.12 -0.05 0.00 0.43 0.00 0.00 57.03 57.29 1gee h ASP 43 Cb 0.48 -0.14 -0.01 0.00 -0.56 0.00 0.00 39.33 39.11 1gee h ASP 43 CO 0.00 0.51 -0.20 -0.33 -1.57 0.00 0.00 179.24 177.65 1gee h GLU 44 N 0.53 0.12 -0.13 3.56 5.08 -1.88 -2.15 114.58 119.70 1gee h GLU 44 Ca 0.14 -0.03 -0.17 0.00 -1.00 0.00 0.00 59.36 58.30 1gee h GLU 44 Cb 0.11 -0.02 -0.00 0.00 0.50 0.00 0.00 28.75 29.34 1gee h GLU 44 CO -0.02 0.32 -0.65 0.00 -1.00 0.00 0.00 179.01 177.67 1gee h ALA 45 N 1.69 0.64 -0.18 3.43 0.00 -1.61 -3.12 119.26 120.11 1gee h ALA 45 Ca 0.02 -0.56 -0.05 0.00 0.00 0.00 0.00 54.91 54.32 1gee h ALA 45 Cb 0.42 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.13 1gee h ALA 45 CO 0.03 0.72 -0.10 -0.91 0.00 0.00 0.00 179.25 178.99 1gee h ASN 46 N 0.35 0.27 0.12 0.00 2.35 -0.23 -0.14 115.58 118.29 1gee h ASN 46 Ca -0.01 -0.05 -0.01 0.00 -0.55 0.00 0.00 56.30 55.68 1gee h ASN 46 Cb 1.20 -0.07 0.00 0.00 0.05 0.00 0.00 38.32 39.50 1gee h ASN 46 CO 0.12 0.40 -0.06 -1.28 -1.65 0.00 0.00 177.43 174.96 1gee h SER 47 N 0.27 -0.13 -0.72 5.81 0.87 -1.45 0.42 113.55 118.61 1gee h SER 47 Ca 0.06 -0.08 -0.01 0.00 -1.23 0.00 0.00 61.79 60.52 1gee h SER 47 Cb 0.35 0.03 -0.03 0.00 -0.44 0.00 0.00 62.40 62.31 1gee h SER 47 CO 0.02 -0.00 0.41 0.58 -0.53 0.00 0.00 176.83 177.31 1gee h VAL 48 N -0.26 1.22 -0.81 2.23 2.07 -1.46 -0.56 116.25 118.68 1gee h VAL 48 Ca -0.02 -0.52 0.01 0.00 0.82 0.00 0.00 66.70 66.99 1gee h VAL 48 Cb 0.21 0.25 -0.04 0.00 -1.52 0.00 0.00 31.29 30.18 1gee h VAL 48 CO 0.03 0.23 0.53 -0.07 0.02 0.00 0.00 177.57 178.31 1gee h LEU 49 N 0.99 0.94 -0.58 2.57 3.38 -0.74 0.19 115.31 122.05 1gee h LEU 49 Ca 0.26 -0.03 -0.15 0.00 0.09 0.00 0.00 57.88 58.04 1gee h LEU 49 Cb 0.01 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 40.52 1gee h LEU 49 CO -0.04 0.68 -0.56 -0.33 0.09 0.00 0.00 178.44 178.28 1gee h GLU 50 N 1.10 0.45 -0.44 1.13 4.39 -0.21 -1.47 114.58 119.52 1gee h GLU 50 Ca 0.30 -0.29 -0.09 0.00 0.34 0.00 0.00 59.36 59.62 1gee h GLU 50 Cb -0.12 0.03 -0.02 0.00 -0.10 0.00 0.00 28.75 28.55 1gee h GLU 50 CO -0.06 0.89 -0.10 0.93 -1.16 0.00 0.00 179.01 179.51 1gee h GLU 51 N 0.35 0.79 -0.42 2.33 4.39 -0.36 -0.96 114.58 120.70 1gee h GLU 51 Ca 0.00 -0.26 -0.15 0.00 0.34 0.00 0.00 59.36 59.30 1gee h GLU 51 Cb 1.08 -0.07 -0.01 0.00 -0.10 0.00 0.00 28.75 29.65 1gee h GLU 51 CO 0.10 0.86 -0.31 0.82 -1.16 0.00 0.00 179.01 179.32 1gee h ILE 52 N 0.72 1.27 -0.36 3.13 2.04 -0.78 -2.72 117.51 120.81 1gee h ILE 52 Ca 0.12 -1.48 -0.07 0.00 1.00 0.00 0.00 64.86 64.43 1gee h ILE 52 Cb 0.58 1.28 -0.02 0.00 -0.74 0.00 0.00 36.82 37.92 1gee h ILE 52 CO 0.04 0.50 -0.08 0.11 0.00 0.00 0.00 178.15 178.72 1gee h LYS 53 N 0.79 0.61 -0.53 2.37 1.57 -1.06 0.63 116.57 120.95 1gee h LYS 53 Ca 0.08 -0.17 0.09 0.00 -1.87 0.00 0.00 60.65 58.78 1gee h LYS 53 Cb 0.90 -0.07 -0.03 0.00 0.08 0.00 0.00 32.23 33.11 1gee h LYS 53 CO 0.08 0.69 0.36 -0.22 -0.57 0.00 0.00 179.45 179.79 1gee h LYS 54 N 0.56 0.32 -0.68 3.15 3.64 -0.86 0.46 116.57 123.16 1gee h LYS 54 Ca 0.11 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.47 1gee h LYS 54 Cb 0.48 -0.07 0.00 0.00 -0.41 0.00 0.00 32.23 32.23 1gee h LYS 54 CO 0.03 0.21 0.00 1.33 -2.27 0.00 0.00 179.45 178.74 1gee n VAL 55 N -4.46 1.12 -1.37 2.00 0.24 -0.92 -4.93 118.33 110.01 1gee n VAL 55 Ca 0.08 -0.97 -0.05 0.00 -2.04 0.00 0.00 64.34 61.36 1gee n VAL 55 Cb 0.36 0.37 -0.02 0.00 -1.47 0.00 0.00 33.84 33.09 1gee n VAL 55 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1gee n GLY 56 N 1.48 0.65 3.94 7.63 0.00 0.15 -4.86 105.19 114.19 1gee n GLY 56 Ca 0.23 -0.78 -0.24 0.00 0.00 0.00 0.00 46.02 45.23 1gee n GLY 56 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1gee s GLY 57 N -2.90 1.72 -0.11 -0.02 0.00 0.17 -4.99 107.32 101.18 1gee s GLY 57 Ca 0.00 -1.04 0.03 0.00 0.00 0.00 0.00 44.72 43.71 1gee s GLY 57 CO 0.00 -0.70 -0.21 1.85 0.00 0.00 0.00 173.10 174.04 1gee s GLU 58 N -5.01 3.14 0.20 2.90 2.12 -1.26 -4.39 118.70 116.39 1gee s GLU 58 Ca 0.58 -0.82 -0.22 0.00 0.36 0.00 0.00 54.97 54.86 1gee s GLU 58 Cb -0.11 -2.40 0.05 0.00 0.26 0.00 0.00 34.13 31.94 1gee s GLU 58 CO 0.42 0.18 0.64 0.00 -0.54 0.00 0.00 175.26 175.96 1gee s ALA 59 N 0.37 -1.48 0.08 6.30 0.00 -1.26 -2.06 121.76 123.71 1gee s ALA 59 Ca -0.16 0.24 0.01 0.00 0.00 0.00 0.00 51.96 52.05 1gee s ALA 59 Cb -0.17 0.88 -0.04 0.00 0.00 0.00 0.00 23.12 23.78 1gee s ALA 59 CO 0.07 -0.86 -0.06 0.96 0.00 0.00 0.00 175.76 175.88 1gee s ILE 60 N -3.80 0.53 -0.09 0.00 -4.36 -0.84 -5.00 121.20 107.63 1gee s ILE 60 Ca 0.04 -1.74 0.03 0.00 -0.26 0.00 0.00 60.65 58.71 1gee s ILE 60 Cb -0.03 -1.43 -0.01 0.00 1.25 0.00 0.00 42.46 42.23 1gee s ILE 60 CO -0.07 -0.82 -0.17 0.00 0.24 0.00 0.00 174.94 174.12 1gee s ALA 61 N -3.30 2.48 -0.08 2.27 0.00 -1.26 -0.36 121.76 121.52 1gee s ALA 61 Ca 0.06 -0.95 0.02 0.00 0.00 0.00 0.00 51.96 51.10 1gee s ALA 61 Cb 0.03 -0.99 0.01 0.00 0.00 0.00 0.00 23.12 22.17 1gee s ALA 61 CO -0.05 0.36 -0.14 0.08 0.00 0.00 0.00 175.76 176.01 1gee s VAL 62 N -0.01 1.30 0.31 0.00 1.01 0.25 -4.95 120.40 118.30 1gee s VAL 62 Ca -0.05 -0.57 -0.28 0.00 0.00 0.00 0.00 61.98 61.08 1gee s VAL 62 Cb -0.14 -1.18 -0.09 0.00 0.00 0.00 0.00 36.38 34.96 1gee s VAL 62 CO 0.04 0.39 1.11 -0.75 0.00 0.00 0.00 175.10 175.89 1gee s LYS 63 N 0.67 4.49 0.00 2.72 2.20 -1.26 -2.64 119.74 125.93 1gee s LYS 63 Ca -0.14 1.78 0.00 0.00 -0.36 0.00 0.00 55.97 57.25 1gee s LYS 63 Cb -0.16 -3.03 0.00 0.00 -1.51 0.00 0.00 37.83 33.13 1gee s LYS 63 CO 0.04 0.09 0.00 0.41 -0.36 0.00 0.00 175.35 175.53 1gee n GLY 64 N 0.98 1.00 3.58 5.54 0.00 -0.31 -4.88 105.19 111.11 1gee n GLY 64 Ca 0.00 0.32 -0.39 0.00 0.00 0.00 0.00 46.02 45.96 1gee n GLY 64 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1gee s ASP 65 N 0.00 6.06 0.00 1.61 -1.08 -1.26 -4.23 116.67 117.77 1gee s ASP 65 Ca 0.00 -0.08 0.10 0.00 -0.52 0.00 0.00 52.55 52.05 1gee s ASP 65 Cb 0.00 -2.14 0.52 0.00 -1.46 0.00 0.00 42.92 39.84 1gee s ASP 65 CO 0.00 -0.11 1.20 1.33 0.52 0.00 0.00 175.17 178.10 1gee n VAL 66 N 5.08 0.69 1.19 1.11 0.24 -1.26 -1.32 118.33 124.06 1gee n VAL 66 Ca -0.13 0.17 0.12 0.00 -2.04 0.00 0.00 64.34 62.47 1gee n VAL 66 Cb 0.51 -1.01 0.26 0.00 -1.47 0.00 0.00 33.84 32.14 1gee n VAL 66 CO 0.00 0.00 0.00 0.35 -2.14 0.00 0.00 176.83 175.04 1gee n THR 67 N -1.26 0.00 -3.72 3.34 -2.24 -1.26 -4.26 114.28 104.88 1gee n THR 67 Ca 0.05 -0.24 -0.38 0.00 -2.27 0.00 0.00 64.05 61.21 1gee n THR 67 Cb 0.08 0.81 -0.12 0.00 -2.10 0.00 0.00 70.33 69.00 1gee n THR 67 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 1gee s VAL 68 N -2.33 3.99 0.19 2.28 1.01 -0.44 -5.01 120.40 120.10 1gee s VAL 68 Ca 0.26 -0.96 -0.16 0.00 0.00 0.00 0.00 61.98 61.11 1gee s VAL 68 Cb 0.19 -3.20 0.18 0.00 0.00 0.00 0.00 36.38 33.55 1gee s VAL 68 CO 0.47 -0.13 1.63 -0.08 0.00 0.00 0.00 175.10 176.99 1gee h GLU 69 N 8.27 -0.05 0.00 2.72 4.81 -1.85 -0.48 114.58 127.99 1gee h GLU 69 Ca -0.26 0.00 -0.01 0.00 -0.13 0.00 0.00 59.36 58.96 1gee h GLU 69 Cb 1.10 0.01 -0.00 0.00 0.63 0.00 0.00 28.75 30.49 1gee h GLU 69 CO 0.62 -0.03 -0.07 0.66 -0.73 0.00 0.00 179.01 179.45 1gee h SER 70 N -0.05 0.00 -0.28 1.04 4.64 -1.95 -1.38 113.55 115.57 1gee h SER 70 Ca 0.26 0.00 -0.18 0.00 -0.47 0.00 0.00 61.79 61.39 1gee h SER 70 Cb 0.45 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.54 1gee h SER 70 CO -0.59 0.07 -0.54 0.44 -0.87 0.00 0.00 176.83 175.34 1gee h ASP 71 N 0.00 0.97 -0.32 4.97 5.19 -1.37 -1.15 116.42 124.70 1gee h ASP 71 Ca -0.00 -0.51 -0.12 0.00 -0.62 0.00 0.00 57.03 55.78 1gee h ASP 71 Cb 0.14 -0.28 -0.01 0.00 0.18 0.00 0.00 39.33 39.36 1gee h ASP 71 CO 0.01 1.31 -0.27 0.58 -3.12 0.00 0.00 179.24 177.76 1gee h VAL 72 N 0.67 1.29 -0.62 -1.35 2.07 -0.92 -0.58 116.25 116.81 1gee h VAL 72 Ca 0.02 -1.42 -0.00 0.00 0.82 0.00 0.00 66.70 66.11 1gee h VAL 72 Cb 1.14 1.49 -0.03 0.00 -1.52 0.00 0.00 31.29 32.37 1gee h VAL 72 CO 0.12 0.46 0.38 0.40 0.02 0.00 0.00 177.57 178.95 1gee h ILE 73 N 0.51 1.18 -0.33 4.57 2.04 -1.26 -2.48 117.51 121.74 1gee h ILE 73 Ca 0.06 -0.38 -0.09 0.00 1.00 0.00 0.00 64.86 65.45 1gee h ILE 73 Cb 0.83 0.31 -0.02 0.00 -0.74 0.00 0.00 36.82 37.21 1gee h ILE 73 CO 0.07 0.18 -0.15 -1.13 0.00 0.00 0.00 178.15 177.12 1gee h ASN 74 N 0.84 0.58 -0.39 1.72 -0.73 -1.05 -1.87 115.58 114.68 1gee h ASN 74 Ca 0.22 -0.17 0.00 0.00 1.87 0.00 0.00 56.30 58.22 1gee h ASN 74 Cb -0.04 -0.16 -0.02 0.00 0.27 0.00 0.00 38.32 38.38 1gee h ASN 74 CO -0.04 0.75 0.25 0.25 -0.37 0.00 0.00 177.43 178.27 1gee h LEU 75 N 0.54 0.46 -0.35 0.34 5.85 -0.68 0.14 115.31 121.62 1gee h LEU 75 Ca 0.09 -0.04 -0.08 0.00 0.84 0.00 0.00 57.88 58.70 1gee h LEU 75 Cb 0.57 -0.12 -0.01 0.00 0.37 0.00 0.00 40.66 41.47 1gee h LEU 75 CO 0.04 0.36 -0.09 0.58 -0.34 0.00 0.00 178.44 178.99 1gee h VAL 76 N 0.52 1.28 -0.24 1.05 2.07 -1.30 -2.90 116.25 116.72 1gee h VAL 76 Ca 0.14 -1.15 -0.05 0.00 0.82 0.00 0.00 66.70 66.46 1gee h VAL 76 Cb -0.02 1.31 -0.01 0.00 -1.52 0.00 0.00 31.29 31.04 1gee h VAL 76 CO -0.03 0.38 -0.07 1.56 0.02 0.00 0.00 177.57 179.43 1gee h GLN 77 N 0.46 0.38 -0.50 1.57 1.08 -1.10 -2.50 115.11 114.51 1gee h GLN 77 Ca 0.09 -0.09 -0.07 0.00 -1.45 0.00 0.00 58.65 57.13 1gee h GLN 77 Cb 0.59 -0.05 -0.02 0.00 -0.05 0.00 0.00 27.48 27.95 1gee h GLN 77 CO 0.03 0.47 0.03 0.77 -0.95 0.00 0.00 178.83 179.18 1gee h SER 78 N 0.37 0.77 -0.35 1.46 0.02 -0.56 -0.24 113.55 115.02 1gee h SER 78 Ca 0.08 -0.18 -0.04 0.00 -0.84 0.00 0.00 61.79 60.81 1gee h SER 78 Cb 0.36 -0.20 -0.01 0.00 0.14 0.00 0.00 62.40 62.68 1gee h SER 78 CO 0.02 0.82 0.07 0.00 -1.14 0.00 0.00 176.83 176.60 1gee h ALA 79 N 1.27 0.46 -0.63 3.77 0.00 -1.26 -0.97 119.26 121.90 1gee h ALA 79 Ca 0.15 -0.19 -0.07 0.00 0.00 0.00 0.00 54.91 54.80 1gee h ALA 79 Cb 0.42 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 18.05 1gee h ALA 79 CO 0.01 0.14 0.11 0.82 0.00 0.00 0.00 179.25 180.34 1gee h ILE 80 N 0.41 1.26 -0.45 0.00 2.04 -1.23 0.41 117.51 119.94 1gee h ILE 80 Ca 0.11 -0.99 -0.14 0.00 1.00 0.00 0.00 64.86 64.84 1gee h ILE 80 Cb 0.32 0.69 -0.01 0.00 -0.74 0.00 0.00 36.82 37.08 1gee h ILE 80 CO 0.00 0.37 -0.25 0.50 0.00 0.00 0.00 178.15 178.77 1gee h LYS 81 N 0.95 0.96 0.02 2.37 3.64 -0.91 0.41 116.57 124.00 1gee h LYS 81 Ca 0.19 -0.42 -0.04 0.00 -1.27 0.00 0.00 60.65 59.11 1gee h LYS 81 Cb 0.41 -0.02 0.00 0.00 -0.41 0.00 0.00 32.23 32.21 1gee h LYS 81 CO 0.01 1.09 -0.18 1.49 -2.27 0.00 0.00 179.45 179.59 1gee h GLU 82 N 0.82 0.09 -0.02 1.90 4.57 -1.08 -3.38 114.58 117.48 1gee h GLU 82 Ca 0.10 -0.12 0.00 0.00 -1.18 0.00 0.00 59.36 58.16 1gee h GLU 82 Cb 0.82 0.04 0.00 0.00 -0.16 0.00 0.00 28.75 29.45 1gee h GLU 82 CO 0.07 0.96 -0.18 1.19 -1.18 0.00 0.00 179.01 179.88 1gee n PHE 83 N -4.54 0.00 -0.10 0.92 0.99 0.12 -5.00 117.46 109.86 1gee n PHE 83 Ca -0.10 0.00 0.00 0.00 -0.00 0.00 0.00 57.45 57.35 1gee n PHE 83 Cb 0.51 0.00 0.00 0.00 -1.00 0.00 0.00 39.48 38.99 1gee n PHE 83 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 1gee n GLY 84 N 1.08 2.23 3.85 1.37 0.00 0.15 -4.96 105.19 108.90 1gee n GLY 84 Ca 0.08 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 46.06 1gee n GLY 84 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1gee s LYS 85 N -0.20 1.43 -0.02 1.61 -2.85 -1.24 -4.92 119.74 113.55 1gee s LYS 85 Ca 0.00 -0.90 -0.00 0.00 -1.00 0.00 0.00 55.97 54.06 1gee s LYS 85 Cb 0.00 0.41 0.03 0.00 -2.06 0.00 0.00 37.83 36.21 1gee s LYS 85 CO 0.00 -0.67 0.04 -1.17 0.10 0.00 0.00 175.35 173.65 1gee s LEU 86 N -3.28 1.17 -0.01 2.77 2.96 -1.26 -4.13 118.68 116.90 1gee s LEU 86 Ca 0.19 0.07 0.00 0.00 -0.22 0.00 0.00 54.13 54.17 1gee s LEU 86 Cb -0.03 -0.01 -0.01 0.00 0.50 0.00 0.00 46.19 46.65 1gee s LEU 86 CO 0.06 -0.11 -0.00 0.47 -1.32 0.00 0.00 176.35 175.44 1gee n ASP 87 N 4.02 4.15 -3.91 3.68 9.92 -0.38 -4.91 116.55 129.13 1gee n ASP 87 Ca -0.25 -0.00 -0.21 0.00 -0.53 0.00 0.00 54.79 53.79 1gee n ASP 87 Cb 0.52 0.11 -0.16 0.00 -0.64 0.00 0.00 41.12 40.94 1gee n ASP 87 CO 0.00 0.00 0.00 -0.69 0.13 0.00 0.00 177.20 176.64 1gee s VAL 88 N -2.02 0.65 -0.17 2.53 1.01 -0.56 -1.84 120.40 120.01 1gee s VAL 88 Ca -0.01 -0.17 -0.01 0.00 0.00 0.00 0.00 61.98 61.79 1gee s VAL 88 Cb 0.00 -0.67 -0.00 0.00 0.00 0.00 0.00 36.38 35.71 1gee s VAL 88 CO 0.02 0.26 -0.13 -0.32 0.00 0.00 0.00 175.10 174.93 1gee s MET 89 N 0.99 3.26 -0.23 2.72 1.75 -0.63 -1.07 119.30 126.10 1gee s MET 89 Ca -0.10 -0.72 0.02 0.00 -1.25 0.00 0.00 55.69 53.65 1gee s MET 89 Cb -0.14 -2.71 0.05 0.00 2.84 0.00 0.00 34.83 34.86 1gee s MET 89 CO -0.00 -0.02 -0.13 0.42 -0.65 0.00 0.00 175.02 174.64 1gee s ILE 90 N 0.93 2.03 -0.56 10.11 1.01 0.37 -0.54 121.20 134.55 1gee s ILE 90 Ca -0.03 -1.34 -0.20 0.00 0.00 0.00 0.00 60.65 59.08 1gee s ILE 90 Cb -0.15 -2.06 0.07 0.00 0.01 0.00 0.00 42.46 40.33 1gee s ILE 90 CO -0.01 0.15 0.75 0.20 0.00 0.00 0.00 174.94 176.02 1gee s ASN 91 N 1.21 6.23 -0.01 3.58 0.01 -0.57 -1.68 114.94 123.71 1gee s ASN 91 Ca -0.04 -0.95 0.02 0.00 -0.71 0.00 0.00 52.86 51.18 1gee s ASN 91 Cb -0.18 -2.34 -0.03 0.00 0.41 0.00 0.00 41.25 39.12 1gee s ASN 91 CO -0.08 -1.08 0.04 -3.20 -1.51 0.00 0.00 177.10 171.27 1gee n ASN 92 N 6.66 4.50 -4.69 -1.22 2.85 -1.25 -1.00 115.26 121.11 1gee n ASN 92 Ca -0.05 0.00 -0.41 0.00 -0.11 0.00 0.00 54.58 54.00 1gee n ASN 92 Cb 0.45 1.02 0.01 0.00 1.24 0.00 0.00 39.78 42.50 1gee n ASN 92 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 1gee n ALA 93 N -1.64 1.13 -3.63 5.20 0.00 -1.19 -4.90 120.51 115.48 1gee n ALA 93 Ca -0.01 0.27 -0.02 0.00 0.00 0.00 0.00 53.44 53.68 1gee n ALA 93 Cb 0.13 -2.24 -0.01 0.00 0.00 0.00 0.00 19.45 17.33 1gee n ALA 93 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 1gee s GLY 94 N -0.54 -0.35 0.15 0.00 0.00 -1.26 -4.61 107.32 100.70 1gee s GLY 94 Ca 0.61 0.84 -0.13 0.00 0.00 0.00 0.00 44.72 46.04 1gee s GLY 94 CO 0.58 0.22 0.36 0.48 0.00 0.00 0.00 173.10 174.75 1gee s LEU 95 N -2.71 0.66 0.01 0.66 2.34 -1.26 -5.03 118.68 113.35 1gee s LEU 95 Ca 0.11 -0.59 -0.26 0.00 0.06 0.00 0.00 54.13 53.45 1gee s LEU 95 Cb 0.01 1.58 0.06 0.00 -0.56 0.00 0.00 46.19 47.29 1gee s LEU 95 CO -0.03 -0.90 0.60 -1.83 -1.06 0.00 0.00 176.35 173.13 1gee s GLU 96 N -3.88 1.07 -0.27 1.48 -1.05 -1.26 -4.91 118.70 109.88 1gee s GLU 96 Ca 0.09 -0.03 -0.23 0.00 -0.15 0.00 0.00 54.97 54.66 1gee s GLU 96 Cb 0.02 0.50 0.07 0.00 -0.44 0.00 0.00 34.13 34.28 1gee s GLU 96 CO -0.05 -0.37 0.70 0.54 0.95 0.00 0.00 175.26 177.03 1gee s ASN 97 N -1.68 -0.78 0.01 0.83 4.22 -1.26 -5.16 114.94 111.12 1gee s ASN 97 Ca -0.07 1.44 -0.28 0.00 -2.14 0.00 0.00 52.86 51.81 1gee s ASN 97 Cb -0.01 1.44 -0.04 0.00 1.28 0.00 0.00 41.25 43.92 1gee s ASN 97 CO 0.03 -0.25 0.87 -2.16 -2.04 0.00 0.00 177.10 173.55 1gee s PRO 98 N 0.61 4.54 -0.23 3.55 0.04 -1.26 -4.73 135.00 137.51 1gee s PRO 98 Ca -0.02 1.24 -0.16 0.00 0.04 0.00 0.00 61.00 62.10 1gee s PRO 98 Cb -0.05 -3.43 0.07 0.00 0.04 0.00 0.00 34.50 31.13 1gee s PRO 98 CO -0.03 0.08 0.59 0.08 0.04 0.00 0.00 177.00 177.76 1gee s VAL 99 N 0.59 -0.01 0.25 -0.36 1.01 -0.01 -5.04 120.40 116.85 1gee s VAL 99 Ca 0.45 0.02 -0.31 0.00 0.00 0.00 0.00 61.98 62.15 1gee s VAL 99 Cb -0.21 -0.84 -0.13 0.00 0.00 0.00 0.00 36.38 35.20 1gee s VAL 99 CO 0.25 0.01 1.46 -1.20 0.00 0.00 0.00 175.10 175.62 1gee n SER 100 N 3.79 3.06 -0.25 3.32 7.64 -1.26 -4.23 113.62 125.69 1gee n SER 100 Ca -0.19 1.14 0.04 0.00 1.01 0.00 0.00 58.87 60.87 1gee n SER 100 Cb 0.57 -1.47 0.17 0.00 -1.01 0.00 0.00 64.21 62.46 1gee n SER 100 CO 0.00 0.00 0.00 0.28 -3.01 0.00 0.00 175.04 172.31 1gee h SER 101 N 4.38 0.31 0.43 6.43 0.02 -1.97 -0.34 113.55 122.81 1gee h SER 101 Ca -0.46 0.09 0.00 0.00 -0.84 0.00 0.00 61.79 60.59 1gee h SER 101 Cb 1.26 0.06 0.00 0.00 0.14 0.00 0.00 62.40 63.86 1gee h SER 101 CO 0.77 0.14 0.00 0.00 -1.14 0.00 0.00 176.83 176.60 1gee n HIS 102 N -4.97 0.00 0.34 3.45 1.44 -1.26 -2.44 115.22 111.78 1gee n HIS 102 Ca 0.13 0.00 0.04 0.00 -2.01 0.00 0.00 57.72 55.88 1gee n HIS 102 Cb 0.37 -0.34 0.04 0.00 0.12 0.00 0.00 29.99 30.17 1gee n HIS 102 CO 0.00 0.00 0.00 0.39 -2.81 0.00 0.00 176.34 173.92 1gee n GLU 103 N -1.34 0.26 -2.37 -1.40 1.02 -0.22 -5.01 120.64 111.56 1gee n GLU 103 Ca 0.08 -1.03 -0.42 0.00 -0.02 0.00 0.00 57.16 55.77 1gee n GLU 103 Cb 0.17 -1.16 -0.03 0.00 -0.02 0.00 0.00 31.44 30.40 1gee n GLU 103 CO 0.00 0.00 0.00 1.41 1.18 0.00 0.00 177.13 179.72 1gee s MET 104 N -0.71 4.38 0.61 3.49 1.75 -0.70 -4.90 119.30 123.21 1gee s MET 104 Ca 0.10 1.81 -0.14 0.00 -1.25 0.00 0.00 55.69 56.21 1gee s MET 104 Cb 0.07 -3.42 -0.03 0.00 2.84 0.00 0.00 34.83 34.28 1gee s MET 104 CO 0.11 -0.37 1.04 -1.54 -0.65 0.00 0.00 175.02 173.61 1gee s SER 105 N 1.30 5.87 0.37 1.11 1.04 -1.26 -4.93 113.70 117.20 1gee s SER 105 Ca 0.59 1.68 0.07 0.00 0.48 0.00 0.00 55.95 58.78 1gee s SER 105 Cb -0.29 -2.51 0.73 0.00 0.10 0.00 0.00 66.02 64.04 1gee s SER 105 CO 0.27 -1.11 1.92 0.25 0.98 0.00 0.00 173.24 175.55 1gee h LEU 106 N 0.16 0.36 -0.28 2.42 6.46 -1.99 -2.08 115.31 120.36 1gee h LEU 106 Ca -0.46 -0.06 0.00 0.00 -0.12 0.00 0.00 57.88 57.24 1gee h LEU 106 Cb 1.21 -0.10 -0.01 0.00 -0.73 0.00 0.00 40.66 41.03 1gee h LEU 106 CO 0.58 0.45 0.18 -1.28 -0.62 0.00 0.00 178.44 177.75 1gee h SER 107 N 0.38 0.32 -0.47 1.25 0.87 -1.99 0.61 113.55 114.52 1gee h SER 107 Ca 0.08 -0.02 -0.09 0.00 -1.23 0.00 0.00 61.79 60.53 1gee h SER 107 Cb 0.29 -0.08 -0.02 0.00 -0.44 0.00 0.00 62.40 62.16 1gee h SER 107 CO 0.01 0.25 -0.05 0.44 -0.53 0.00 0.00 176.83 176.95 1gee h ASP 108 N 0.36 0.86 -0.02 6.23 3.45 -1.85 -1.78 116.42 123.68 1gee h ASP 108 Ca 0.10 -0.33 0.01 0.00 0.43 0.00 0.00 57.03 57.23 1gee h ASP 108 Cb -0.02 -0.23 -0.01 0.00 -0.56 0.00 0.00 39.33 38.51 1gee h ASP 108 CO -0.02 0.99 -0.03 -0.25 -1.57 0.00 0.00 179.24 178.37 1gee h TRP 109 N 0.72 -0.07 -0.77 4.55 2.91 -1.17 -2.81 115.95 119.31 1gee h TRP 109 Ca 0.13 0.00 -0.03 0.00 1.13 0.00 0.00 58.89 60.12 1gee h TRP 109 Cb 0.58 0.03 -0.04 0.00 -0.51 0.00 0.00 29.16 29.23 1gee h TRP 109 CO 0.04 -0.04 0.35 -0.91 -1.03 0.00 0.00 178.44 176.85 1gee h ASN 110 N -0.04 1.02 -0.51 2.65 2.35 -0.79 -1.68 115.58 118.58 1gee h ASN 110 Ca 0.02 -0.13 0.04 0.00 -0.55 0.00 0.00 56.30 55.68 1gee h ASN 110 Cb 0.07 -0.26 -0.04 0.00 0.05 0.00 0.00 38.32 38.13 1gee h ASN 110 CO -0.04 0.88 0.26 0.50 -1.65 0.00 0.00 177.43 177.38 1gee h LYS 111 N 1.11 0.49 -0.18 0.81 3.64 -1.15 0.33 116.57 121.62 1gee h LYS 111 Ca 0.26 -0.03 -0.12 0.00 -1.27 0.00 0.00 60.65 59.49 1gee h LYS 111 Cb 0.15 -0.11 0.00 0.00 -0.41 0.00 0.00 32.23 31.86 1gee h LYS 111 CO -0.03 0.32 -0.38 0.28 -2.27 0.00 0.00 179.45 177.38 1gee h VAL 112 N 0.50 1.34 -0.23 2.00 2.07 -1.30 -2.15 116.25 118.48 1gee h VAL 112 Ca 0.22 -1.62 -0.01 0.00 0.82 0.00 0.00 66.70 66.11 1gee h VAL 112 Cb 0.13 1.93 -0.01 0.00 -1.52 0.00 0.00 31.29 31.81 1gee h VAL 112 CO -0.15 0.50 0.10 0.40 0.02 0.00 0.00 177.57 178.43 1gee h ILE 113 N 0.22 1.16 -0.62 4.57 1.08 -1.10 0.34 117.51 123.17 1gee h ILE 113 Ca 0.00 -0.47 0.04 0.00 -0.39 0.00 0.00 64.86 64.05 1gee h ILE 113 Cb 0.98 1.03 -0.05 0.00 -3.07 0.00 0.00 36.82 35.72 1gee h ILE 113 CO 0.08 0.16 0.36 0.44 -0.69 0.00 0.00 178.15 178.50 1gee h ASP 114 N 0.23 0.56 0.04 1.72 3.45 -0.37 -0.84 116.42 121.20 1gee h ASP 114 Ca 0.08 0.02 -0.00 0.00 0.43 0.00 0.00 57.03 57.55 1gee h ASP 114 Cb 0.15 -0.10 0.00 0.00 -0.56 0.00 0.00 39.33 38.82 1gee h ASP 114 CO -0.01 0.38 -0.02 0.74 -1.57 0.00 0.00 179.24 178.76 1gee h THR 115 N 0.69 1.21 -0.21 0.35 2.02 -1.29 -0.18 112.91 115.50 1gee h THR 115 Ca 0.26 -1.71 -0.19 0.00 0.77 0.00 0.00 66.41 65.54 1gee h THR 115 Cb 0.09 2.20 0.00 0.00 -1.74 0.00 0.00 68.15 68.71 1gee h THR 115 CO -0.14 0.38 -0.63 0.78 0.37 0.00 0.00 175.52 176.28 1gee h ASN 116 N -0.92 0.83 0.00 4.18 4.21 -0.98 -3.22 115.58 119.68 1gee h ASN 116 Ca -0.01 -0.48 -0.04 0.00 1.21 0.00 0.00 56.30 56.99 1gee h ASN 116 Cb 0.66 -0.24 -0.01 0.00 -1.12 0.00 0.00 38.32 37.61 1gee h ASN 116 CO 0.01 1.25 -0.98 -0.11 -1.29 0.00 0.00 177.43 176.31 1gee n LEU 117 N -3.96 1.80 -0.14 1.61 7.94 -0.40 -4.18 117.00 119.68 1gee n LEU 117 Ca -0.05 0.30 -0.01 0.00 -1.11 0.00 0.00 56.01 55.14 1gee n LEU 117 Cb 0.66 -0.68 0.23 0.00 0.53 0.00 0.00 43.42 44.16 1gee n LEU 117 CO 0.50 -0.27 1.07 0.74 -1.11 0.00 0.00 177.39 178.32 1gee h THR 118 N -0.85 1.21 -0.85 1.96 2.02 -1.36 -0.75 112.91 114.28 1gee h THR 118 Ca -0.06 -0.63 -0.03 0.00 0.77 0.00 0.00 66.41 66.47 1gee h THR 118 Cb 0.91 0.50 -0.04 0.00 -1.74 0.00 0.00 68.15 67.78 1gee h THR 118 CO -0.03 0.25 0.43 1.23 0.37 0.00 0.00 175.52 177.77 1gee h GLY 119 N 0.95 1.30 1.68 2.16 0.00 -1.02 -0.52 103.07 107.62 1gee h GLY 119 Ca 0.20 -0.63 -0.13 0.00 0.00 0.00 0.00 47.33 46.77 1gee h GLY 119 CO -0.02 0.60 -0.49 0.00 0.00 0.00 0.00 176.54 176.62 1gee h ALA 120 N 1.26 0.92 -0.24 3.60 0.00 -1.53 -2.04 119.26 121.22 1gee h ALA 120 Ca 0.30 -0.47 -0.02 0.00 0.00 0.00 0.00 54.91 54.71 1gee h ALA 120 Cb 0.09 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 1gee h ALA 120 CO -0.04 0.66 0.06 0.35 0.00 0.00 0.00 179.25 180.28 1gee h PHE 121 N 0.27 0.40 -0.46 0.00 3.57 -0.50 -0.45 116.94 119.77 1gee h PHE 121 Ca 0.01 -0.05 0.01 0.00 3.53 0.00 0.00 57.97 61.47 1gee h PHE 121 Cb 0.97 -0.11 -0.02 0.00 2.79 0.00 0.00 35.95 39.57 1gee h PHE 121 CO 0.02 0.47 0.30 -0.07 -2.23 0.00 0.00 178.31 176.81 1gee h LEU 122 N 0.22 0.53 -0.53 0.59 3.38 -0.98 0.27 115.31 118.78 1gee h LEU 122 Ca 0.08 -0.01 -0.03 0.00 0.09 0.00 0.00 57.88 58.00 1gee h LEU 122 Cb 0.26 -0.13 -0.02 0.00 0.09 0.00 0.00 40.66 40.86 1gee h LEU 122 CO -0.00 0.38 0.22 1.23 0.09 0.00 0.00 178.44 180.36 1gee h GLY 123 N 0.62 0.85 0.96 0.83 0.00 -1.28 -1.41 103.07 103.64 1gee h GLY 123 Ca 0.17 -0.46 -0.04 0.00 0.00 0.00 0.00 47.33 47.00 1gee h GLY 123 CO -0.04 0.44 0.11 1.76 0.00 0.00 0.00 176.54 178.81 1gee h SER 124 N 0.72 0.70 -0.04 0.19 0.02 -0.71 -2.20 113.55 112.22 1gee h SER 124 Ca 0.18 -0.23 0.00 0.00 -0.84 0.00 0.00 61.79 60.90 1gee h SER 124 Cb 0.19 -0.18 -0.00 0.00 0.14 0.00 0.00 62.40 62.54 1gee h SER 124 CO -0.02 0.75 0.01 -0.09 -1.14 0.00 0.00 176.83 176.34 1gee h ARG 125 N 0.61 0.03 -0.63 3.45 2.43 -0.25 -0.79 114.38 119.24 1gee h ARG 125 Ca 0.14 -0.00 -0.07 0.00 -0.81 0.00 0.00 59.98 59.24 1gee h ARG 125 Cb 0.32 -0.01 -0.03 0.00 -0.42 0.00 0.00 29.97 29.84 1gee h ARG 125 CO 0.00 0.02 0.12 0.93 -1.51 0.00 0.00 179.97 179.53 1gee h GLU 126 N 0.03 1.02 -0.13 0.20 4.39 -1.23 0.61 114.58 119.47 1gee h GLU 126 Ca 0.02 -0.25 -0.03 0.00 0.34 0.00 0.00 59.36 59.44 1gee h GLU 126 Cb 0.01 -0.13 -0.00 0.00 -0.10 0.00 0.00 28.75 28.52 1gee h GLU 126 CO -0.02 0.93 -0.02 0.00 -1.16 0.00 0.00 179.01 178.73 1gee h ALA 127 N 1.16 0.18 -0.51 3.43 0.00 -1.25 -2.60 119.26 119.67 1gee h ALA 127 Ca 0.20 -0.22 -0.08 0.00 0.00 0.00 0.00 54.91 54.81 1gee h ALA 127 Cb 0.39 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.11 1gee h ALA 127 CO 0.01 -0.09 0.01 0.82 0.00 0.00 0.00 179.25 180.00 1gee h ILE 128 N -0.05 1.25 -0.65 0.00 2.04 -1.03 -0.62 117.51 118.45 1gee h ILE 128 Ca 0.03 -1.02 0.03 0.00 1.00 0.00 0.00 64.86 64.91 1gee h ILE 128 Cb 0.43 0.84 -0.04 0.00 -0.74 0.00 0.00 36.82 37.32 1gee h ILE 128 CO 0.01 0.36 0.39 0.50 0.00 0.00 0.00 178.15 179.42 1gee h LYS 129 N 0.79 0.74 -0.23 2.37 3.64 -0.83 0.80 116.57 123.84 1gee h LYS 129 Ca 0.15 -0.04 -0.02 0.00 -1.27 0.00 0.00 60.65 59.47 1gee h LYS 129 Cb 0.46 -0.17 -0.01 0.00 -0.41 0.00 0.00 32.23 32.10 1gee h LYS 129 CO 0.02 0.49 0.05 -0.92 -2.27 0.00 0.00 179.45 176.82 1gee h TYR 130 N 0.76 0.39 -0.54 1.91 3.20 -1.05 -1.87 116.97 119.78 1gee h TYR 130 Ca 0.27 -0.05 0.04 0.00 3.14 0.00 0.00 58.73 62.13 1gee h TYR 130 Cb 0.05 -0.11 -0.04 0.00 1.54 0.00 0.00 36.73 38.17 1gee h TYR 130 CO -0.06 0.47 0.30 0.74 -1.64 0.00 0.00 178.16 177.97 1gee h PHE 131 N 0.19 0.55 -0.30 -3.82 0.05 -0.53 -2.08 116.94 111.00 1gee h PHE 131 Ca 0.07 0.02 -0.06 0.00 3.82 0.00 0.00 57.97 61.82 1gee h PHE 131 Cb 0.28 -0.17 -0.01 0.00 2.00 0.00 0.00 35.95 38.05 1gee h PHE 131 CO 0.01 0.29 -0.04 0.28 -0.18 0.00 0.00 178.31 178.67 1gee h VAL 132 N 0.58 1.27 0.00 -0.55 2.07 -0.79 0.15 116.25 118.98 1gee h VAL 132 Ca 0.23 -1.04 0.00 0.00 0.82 0.00 0.00 66.70 66.71 1gee h VAL 132 Cb 0.09 1.34 0.00 0.00 -1.52 0.00 0.00 31.29 31.21 1gee h VAL 132 CO -0.13 0.33 0.00 -0.33 0.02 0.00 0.00 177.57 177.46 1gee h GLU 133 N 0.34 0.00 -0.05 1.57 5.08 -1.18 -3.11 114.58 117.23 1gee h GLU 133 Ca 0.08 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.44 1gee h GLU 133 Cb 0.51 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.76 1gee h GLU 133 CO 0.02 0.00 0.00 0.09 -1.00 0.00 0.00 179.01 178.12 1gee n ASN 134 N -2.67 2.26 -3.97 1.42 3.02 -0.80 -5.00 115.26 109.53 1gee n ASN 134 Ca 0.01 -2.33 -0.30 0.00 -0.03 0.00 0.00 54.58 51.94 1gee n ASN 134 Cb 0.27 -0.16 0.01 0.00 -0.61 0.00 0.00 39.78 39.29 1gee n ASN 134 CO 0.00 0.00 0.00 0.47 -2.62 0.00 0.00 177.26 175.11 1gee n ASP 135 N -0.64 -3.56 -4.71 6.41 10.43 -0.45 -4.96 116.55 119.07 1gee n ASP 135 Ca 0.06 -0.86 -0.35 0.00 2.57 0.00 0.00 54.79 56.21 1gee n ASP 135 Cb 0.40 -3.54 -0.09 0.00 1.84 0.00 0.00 41.12 39.73 1gee n ASP 135 CO 0.00 0.00 0.00 -0.63 -1.07 0.00 0.00 177.20 175.50 1gee s ILE 136 N -3.41 5.06 -1.33 0.53 1.01 -0.09 -5.00 121.20 117.98 1gee s ILE 136 Ca 0.54 0.06 -0.08 0.00 0.00 0.00 0.00 60.65 61.17 1gee s ILE 136 Cb -0.28 -3.27 0.13 0.00 0.01 0.00 0.00 42.46 39.05 1gee s ILE 136 CO 0.86 0.49 2.14 0.29 0.00 0.00 0.00 174.94 178.72 1gee n LYS 137 N 3.14 3.90 -1.45 2.79 5.02 -1.26 -4.63 118.16 125.67 1gee n LYS 137 Ca -0.17 -3.36 -0.21 0.00 -2.02 0.00 0.00 58.31 52.55 1gee n LYS 137 Cb 0.53 -2.84 0.14 0.00 -0.02 0.00 0.00 35.03 32.84 1gee n LYS 137 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1gee n GLY 138 N 2.57 -1.15 3.00 0.72 0.00 -1.26 -4.82 105.19 104.25 1gee n GLY 138 Ca 0.50 -1.74 -0.09 0.00 0.00 0.00 0.00 46.02 44.69 1gee n GLY 138 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 1gee s THR 139 N -2.99 0.11 -0.08 2.61 -1.32 -0.76 -2.68 115.64 110.52 1gee s THR 139 Ca 0.54 -0.88 0.04 0.00 -1.21 0.00 0.00 61.69 60.17 1gee s THR 139 Cb -0.02 -0.29 0.00 0.00 -1.51 0.00 0.00 72.50 70.69 1gee s THR 139 CO 0.37 -0.48 -0.20 -0.69 -2.21 0.00 0.00 174.62 171.41 1gee s VAL 140 N -1.45 1.74 -0.15 5.08 1.01 -0.22 -1.60 120.40 124.81 1gee s VAL 140 Ca -0.16 -0.84 0.02 0.00 0.00 0.00 0.00 61.98 61.00 1gee s VAL 140 Cb -0.10 -1.52 0.02 0.00 0.00 0.00 0.00 36.38 34.78 1gee s VAL 140 CO -0.01 0.49 -0.20 -0.63 0.00 0.00 0.00 175.10 174.76 1gee s ILE 141 N 0.37 1.95 -0.15 2.22 1.01 0.30 -1.70 121.20 125.20 1gee s ILE 141 Ca -0.15 -0.90 -0.05 0.00 0.00 0.00 0.00 60.65 59.55 1gee s ILE 141 Cb -0.17 -1.75 -0.03 0.00 0.01 0.00 0.00 42.46 40.52 1gee s ILE 141 CO 0.07 0.53 -0.00 0.20 0.00 0.00 0.00 174.94 175.73 1gee s ASN 142 N 1.07 5.10 -0.48 3.58 0.01 -0.01 -1.52 114.94 122.68 1gee s ASN 142 Ca -0.01 -0.03 -0.26 0.00 -0.71 0.00 0.00 52.86 51.84 1gee s ASN 142 Cb -0.14 -1.80 0.03 0.00 0.41 0.00 0.00 41.25 39.75 1gee s ASN 142 CO -0.07 0.20 0.99 -0.32 -1.51 0.00 0.00 177.10 176.39 1gee s MET 143 N 0.21 3.55 0.00 -0.60 1.75 -0.17 -1.93 119.30 122.11 1gee s MET 143 Ca -0.00 0.20 0.00 0.00 -1.25 0.00 0.00 55.69 54.64 1gee s MET 143 Cb -0.13 -3.94 0.00 0.00 2.84 0.00 0.00 34.83 33.59 1gee s MET 143 CO 0.02 -1.32 0.00 0.45 -0.65 0.00 0.00 175.02 173.52 1gee n SER 144 N 7.44 0.00 -3.60 1.11 2.88 0.52 -4.89 113.62 117.09 1gee n SER 144 Ca 0.07 0.00 -0.04 0.00 -1.33 0.00 0.00 58.87 57.57 1gee n SER 144 Cb 0.49 0.00 -0.02 0.00 -0.75 0.00 0.00 64.21 63.93 1gee n SER 144 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 1gee s SER 145 N -0.75 -0.20 0.61 -3.46 0.15 -1.25 -4.40 113.70 104.40 1gee s SER 145 Ca 0.00 -0.09 0.41 0.00 0.70 0.00 0.00 55.95 56.97 1gee s SER 145 Cb 0.00 0.27 2.13 0.00 -1.71 0.00 0.00 66.02 66.71 1gee s SER 145 CO 0.00 -0.47 2.24 -0.37 1.20 0.00 0.00 173.24 175.84 1gee h VAL 146 N 2.00 0.00 0.00 4.45 -1.51 -1.59 -2.12 116.25 117.48 1gee h VAL 146 Ca -0.19 -0.10 0.00 0.00 -1.23 0.00 0.00 66.70 65.18 1gee h VAL 146 Cb 1.21 1.05 0.00 0.00 -2.13 0.00 0.00 31.29 31.41 1gee h VAL 146 CO 0.27 0.00 0.00 1.41 -1.23 0.00 0.00 177.57 178.02 1gee n HIS 147 N -3.00 0.00 1.15 5.19 8.25 -1.26 -0.40 115.22 125.14 1gee n HIS 147 Ca -0.02 0.00 0.13 0.00 -0.26 0.00 0.00 57.72 57.56 1gee n HIS 147 Cb 0.11 -0.04 0.32 0.00 1.12 0.00 0.00 29.99 31.50 1gee n HIS 147 CO 0.00 0.00 0.00 -0.85 0.64 0.00 0.00 176.34 176.13 1gee n GLU 148 N -0.28 0.53 0.00 -0.41 0.28 -0.80 -4.34 120.64 115.62 1gee n GLU 148 Ca 0.00 -0.31 0.00 0.00 -0.16 0.00 0.00 57.16 56.69 1gee n GLU 148 Cb 0.09 -1.49 0.00 0.00 1.43 0.00 0.00 31.44 31.47 1gee n GLU 148 CO 0.00 0.00 0.00 1.17 -0.16 0.00 0.00 177.13 178.14 1gee n LYS 149 N -0.96 0.00 -3.10 3.44 4.81 -0.57 -4.55 118.16 117.22 1gee n LYS 149 Ca 0.10 0.00 -0.40 0.00 -0.87 0.00 0.00 58.31 57.13 1gee n LYS 149 Cb 0.34 -0.70 -0.06 0.00 0.02 0.00 0.00 35.03 34.64 1gee n LYS 149 CO 0.00 0.00 0.00 0.42 1.17 0.00 0.00 177.40 178.99 1gee s ILE 150 N -1.79 4.99 0.87 3.15 1.01 0.46 -5.05 121.20 124.84 1gee s ILE 150 Ca 0.00 1.16 -0.12 0.00 0.00 0.00 0.00 60.65 61.69 1gee s ILE 150 Cb 0.00 -3.94 0.11 0.00 0.01 0.00 0.00 42.46 38.63 1gee s ILE 150 CO 0.00 0.05 1.11 -2.65 0.00 0.00 0.00 174.94 173.45 1gee n PRO 151 N 5.52 -0.14 -3.36 2.79 -0.02 -1.26 -4.30 135.00 134.22 1gee n PRO 151 Ca -0.01 0.03 -0.24 0.00 -2.02 0.00 0.00 63.50 61.27 1gee n PRO 151 Cb 0.49 -2.36 -0.09 0.00 -0.02 0.00 0.00 33.50 31.52 1gee n PRO 151 CO 0.00 0.00 0.00 -0.46 1.98 0.00 0.00 175.50 177.02 1gee s TRP 152 N -2.37 0.47 0.35 6.00 -0.00 -1.26 -5.02 118.94 117.10 1gee s TRP 152 Ca 0.69 -1.64 -0.27 0.00 -0.00 0.00 0.00 56.10 54.88 1gee s TRP 152 Cb -0.26 -0.71 -0.12 0.00 -0.00 0.00 0.00 33.47 32.37 1gee s TRP 152 CO 0.55 -0.89 1.12 -2.30 -0.00 0.00 0.00 176.95 175.43 1gee n PRO 153 N 3.55 1.65 0.00 5.86 -0.02 -1.26 -0.62 135.00 144.16 1gee n PRO 153 Ca 0.19 0.58 0.00 0.00 -2.02 0.00 0.00 63.50 62.25 1gee n PRO 153 Cb 0.44 -2.09 0.00 0.00 -0.02 0.00 0.00 33.50 31.84 1gee n PRO 153 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 1gee n LEU 154 N 0.84 0.00 -2.58 2.45 4.32 -1.26 -4.81 117.00 115.96 1gee n LEU 154 Ca 0.08 0.00 -0.12 0.00 -0.02 0.00 0.00 56.01 55.94 1gee n LEU 154 Cb 0.35 0.00 0.03 0.00 -1.62 0.00 0.00 43.42 42.18 1gee n LEU 154 CO 0.60 0.00 0.02 0.49 -1.22 0.00 0.00 177.39 177.28 1gee n PHE 155 N -2.00 1.88 0.08 -1.77 3.01 0.21 -0.83 117.46 118.03 1gee n PHE 155 Ca 0.00 -2.60 0.04 0.00 1.01 0.00 0.00 57.45 55.90 1gee n PHE 155 Cb 0.00 -0.27 0.45 0.00 -0.01 0.00 0.00 39.48 39.64 1gee n PHE 155 CO 0.00 0.00 0.00 -0.24 1.01 0.00 0.00 176.76 177.53 1gee h VAL 156 N 3.50 1.11 -0.44 -4.37 3.04 -1.85 -0.67 116.25 116.57 1gee h VAL 156 Ca 0.04 -0.33 -0.14 0.00 -1.01 0.00 0.00 66.70 65.25 1gee h VAL 156 Cb 1.20 0.79 -0.01 0.00 -2.01 0.00 0.00 31.29 31.26 1gee h VAL 156 CO 0.52 0.13 -0.29 1.12 -1.01 0.00 0.00 177.57 178.04 1gee h HIS 157 N 0.37 1.13 -0.15 3.17 2.07 -1.91 -1.08 115.15 118.75 1gee h HIS 157 Ca 0.10 -0.30 -0.02 0.00 -2.85 0.00 0.00 60.37 57.29 1gee h HIS 157 Cb 0.08 -0.25 -0.01 0.00 2.57 0.00 0.00 27.41 29.80 1gee h HIS 157 CO 0.00 1.13 -0.00 -0.92 -3.07 0.00 0.00 177.93 175.07 1gee h TYR 158 N 0.81 0.29 -0.55 6.12 3.20 -1.72 -0.56 116.97 124.57 1gee h TYR 158 Ca 0.09 -0.05 0.01 0.00 3.14 0.00 0.00 58.73 61.92 1gee h TYR 158 Cb 0.87 -0.08 -0.03 0.00 1.54 0.00 0.00 36.73 39.04 1gee h TYR 158 CO 0.06 0.49 0.36 0.00 -1.64 0.00 0.00 178.16 177.43 1gee h ALA 159 N 0.76 0.70 -0.70 1.82 0.00 -1.13 -1.47 119.26 119.24 1gee h ALA 159 Ca 0.04 -0.04 -0.04 0.00 0.00 0.00 0.00 54.91 54.87 1gee h ALA 159 Cb 0.38 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 17.92 1gee h ALA 159 CO 0.01 0.13 0.27 0.00 0.00 0.00 0.00 179.25 179.65 1gee h ALA 160 N 1.21 1.15 -0.43 0.00 0.00 -1.10 0.20 119.26 120.29 1gee h ALA 160 Ca 0.20 -0.19 -0.08 0.00 0.00 0.00 0.00 54.91 54.85 1gee h ALA 160 Cb -0.08 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 17.42 1gee h ALA 160 CO -0.05 0.61 -0.07 0.66 0.00 0.00 0.00 179.25 180.40 1gee h SER 161 N 1.02 0.72 0.71 0.00 4.64 -0.42 -0.62 113.55 119.59 1gee h SER 161 Ca 0.23 -0.19 -0.26 0.00 -0.47 0.00 0.00 61.79 61.10 1gee h SER 161 Cb 0.22 -0.19 -0.01 0.00 -0.31 0.00 0.00 62.40 62.11 1gee h SER 161 CO -0.02 0.83 -1.21 0.11 -0.87 0.00 0.00 176.83 175.67 1gee h LYS 162 N 0.68 0.20 -0.54 4.77 1.79 -1.01 -1.28 116.57 121.18 1gee h LYS 162 Ca 0.12 -0.34 -0.06 0.00 -2.18 0.00 0.00 60.65 58.19 1gee h LYS 162 Cb 0.52 0.13 -0.02 0.00 -1.58 0.00 0.00 32.23 31.27 1gee h LYS 162 CO 0.03 1.15 0.07 0.78 -1.08 0.00 0.00 179.45 180.40 1gee h GLY 163 N 1.98 0.92 1.23 3.86 0.00 -0.83 -0.78 103.07 109.45 1gee h GLY 163 Ca -0.11 -0.58 -0.13 0.00 0.00 0.00 0.00 47.33 46.50 1gee h GLY 163 CO 0.18 0.54 -0.26 -1.33 0.00 0.00 0.00 176.54 175.67 1gee h GLY 164 N 0.99 0.95 1.30 4.60 0.00 -1.07 -2.88 103.07 106.96 1gee h GLY 164 Ca 0.17 -0.86 -0.01 0.00 0.00 0.00 0.00 47.33 46.63 1gee h GLY 164 CO 0.01 0.78 0.35 1.98 0.00 0.00 0.00 176.54 179.66 1gee h MET 165 N 0.75 0.91 0.16 4.80 -1.53 -0.54 -0.74 114.93 118.74 1gee h MET 165 Ca 0.09 -0.10 -0.00 0.00 -3.44 0.00 0.00 59.70 56.25 1gee h MET 165 Cb 0.81 -0.18 -0.01 0.00 -0.55 0.00 0.00 31.60 31.68 1gee h MET 165 CO 0.07 0.68 -0.12 -0.22 0.14 0.00 0.00 176.91 177.46 1gee h LYS 166 N 0.92 -0.27 0.00 0.39 3.64 -0.95 0.42 116.57 120.72 1gee h LYS 166 Ca 0.23 0.02 -0.08 0.00 -1.27 0.00 0.00 60.65 59.55 1gee h LYS 166 Cb 0.04 0.06 -0.01 0.00 -0.41 0.00 0.00 32.23 31.91 1gee h LYS 166 CO -0.04 -0.18 -0.39 -0.07 -2.27 0.00 0.00 179.45 176.51 1gee h LEU 167 N -0.28 0.00 -0.07 5.20 -0.00 -1.39 -1.05 115.31 117.73 1gee h LEU 167 Ca -0.01 0.00 -0.01 0.00 -0.00 0.00 0.00 57.88 57.86 1gee h LEU 167 Cb 0.25 0.00 -0.00 0.00 -0.00 0.00 0.00 40.66 40.90 1gee h LEU 167 CO -0.00 0.39 -0.01 -0.03 -0.00 0.00 0.00 178.44 178.79 1gee h MET 168 N 0.00 0.12 -0.30 1.13 4.05 -0.80 -1.24 114.93 117.90 1gee h MET 168 Ca -0.00 -0.04 0.00 0.00 -0.28 0.00 0.00 59.70 59.38 1gee h MET 168 Cb 0.70 -0.01 -0.01 0.00 -0.80 0.00 0.00 31.60 31.48 1gee h MET 168 CO 0.05 0.42 0.19 1.15 0.23 0.00 0.00 176.91 178.95 1gee h THR 169 N -0.18 1.09 -0.37 -0.77 2.02 -0.68 -0.45 112.91 113.56 1gee h THR 169 Ca 0.02 -0.18 -0.06 0.00 0.77 0.00 0.00 66.41 66.96 1gee h THR 169 Cb 0.37 0.67 -0.02 0.00 -1.74 0.00 0.00 68.15 67.43 1gee h THR 169 CO 0.00 0.08 -0.01 -0.33 0.37 0.00 0.00 175.52 175.64 1gee h GLU 170 N 0.39 0.59 -0.14 6.66 5.08 -1.19 0.52 114.58 126.50 1gee h GLU 170 Ca 0.11 -0.14 -0.04 0.00 -1.00 0.00 0.00 59.36 58.29 1gee h GLU 170 Cb -0.03 -0.08 -0.00 0.00 0.50 0.00 0.00 28.75 29.14 1gee h GLU 170 CO -0.02 0.62 -0.08 1.15 -1.00 0.00 0.00 179.01 179.68 1gee h THR 171 N 0.56 1.32 -0.63 1.13 2.02 -0.87 -1.81 112.91 114.63 1gee h THR 171 Ca 0.12 -1.14 -0.05 0.00 0.77 0.00 0.00 66.41 66.11 1gee h THR 171 Cb 0.37 1.77 -0.03 0.00 -1.74 0.00 0.00 68.15 68.52 1gee h THR 171 CO 0.01 0.33 0.19 -0.07 0.37 0.00 0.00 175.52 176.35 1gee h LEU 172 N -0.04 0.89 -0.60 2.58 3.38 -0.87 0.20 115.31 120.84 1gee h LEU 172 Ca 0.03 -0.15 -0.02 0.00 0.09 0.00 0.00 57.88 57.83 1gee h LEU 172 Cb 0.56 -0.23 -0.03 0.00 0.09 0.00 0.00 40.66 41.05 1gee h LEU 172 CO 0.02 0.84 0.30 0.00 0.09 0.00 0.00 178.44 179.69 1gee h ALA 173 N 1.28 0.78 -0.22 1.53 0.00 -0.81 -1.31 119.26 120.52 1gee h ALA 173 Ca 0.20 -0.13 -0.09 0.00 0.00 0.00 0.00 54.91 54.90 1gee h ALA 173 Cb 0.27 -0.24 -0.00 0.00 0.00 0.00 0.00 17.79 17.82 1gee h ALA 173 CO -0.01 0.33 -0.21 1.25 0.00 0.00 0.00 179.25 180.62 1gee h LEU 174 N 0.83 0.56 -1.11 0.00 5.85 -0.96 -1.80 115.31 118.67 1gee h LEU 174 Ca 0.21 -0.47 -0.02 0.00 0.84 0.00 0.00 57.88 58.43 1gee h LEU 174 Cb 0.10 -0.16 -0.03 0.00 0.37 0.00 0.00 40.66 40.95 1gee h LEU 174 CO -0.03 0.92 0.32 -0.08 -0.34 0.00 0.00 178.44 179.23 1gee h GLU 175 N 0.21 0.94 -0.32 1.25 4.81 -0.81 -3.20 114.58 117.46 1gee h GLU 175 Ca 0.03 -0.12 0.00 0.00 -0.13 0.00 0.00 59.36 59.14 1gee h GLU 175 Cb 0.76 -0.18 0.00 0.00 0.63 0.00 0.00 28.75 29.96 1gee h GLU 175 CO 0.05 0.73 0.00 0.66 -0.73 0.00 0.00 179.01 179.72 1gee n TYR 176 N -4.34 0.42 -0.35 0.92 4.02 -0.51 -4.60 117.16 112.72 1gee n TYR 176 Ca 0.06 -0.43 0.02 0.00 -0.01 0.00 0.00 57.90 57.54 1gee n TYR 176 Cb 0.13 -0.02 0.17 0.00 -0.02 0.00 0.00 39.34 39.60 1gee n TYR 176 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 1gee h ALA 177 N 2.18 1.39 0.00 -0.72 0.00 -1.32 -1.62 119.26 119.18 1gee h ALA 177 Ca 0.00 -0.04 -0.00 0.00 0.00 0.00 0.00 54.91 54.87 1gee h ALA 177 Cb 0.71 -0.33 -0.00 0.00 0.00 0.00 0.00 17.79 18.17 1gee h ALA 177 CO 0.00 0.49 -0.00 -1.35 0.00 0.00 0.00 179.25 178.39 1gee h PRO 178 N 1.20 0.00 -0.33 0.00 0.11 -1.81 -0.84 132.00 130.32 1gee h PRO 178 Ca 0.40 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.51 1gee h PRO 178 Cb 0.07 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.18 1gee h PRO 178 CO -0.14 0.00 0.00 1.63 -0.21 0.00 0.00 178.00 179.28 1gee n LYS 179 N -3.29 2.26 -1.01 1.05 5.02 -0.62 -4.94 118.16 116.62 1gee n LYS 179 Ca -0.03 -1.90 -0.00 0.00 -2.02 0.00 0.00 58.31 54.36 1gee n LYS 179 Cb 0.08 -1.47 -0.00 0.00 -0.02 0.00 0.00 35.03 33.61 1gee n LYS 179 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1gee n GLY 180 N 1.38 0.47 3.60 0.72 0.00 -0.32 -4.63 105.19 106.41 1gee n GLY 180 Ca 0.18 -0.35 -0.41 0.00 0.00 0.00 0.00 46.02 45.45 1gee n GLY 180 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1gee s ILE 181 N -1.98 5.03 -0.06 -0.61 1.01 -1.13 -4.46 121.20 119.00 1gee s ILE 181 Ca 0.00 0.71 -0.12 0.00 0.00 0.00 0.00 60.65 61.24 1gee s ILE 181 Cb 0.00 -3.90 -0.05 0.00 0.01 0.00 0.00 42.46 38.52 1gee s ILE 181 CO 0.00 -0.05 0.31 -0.13 0.00 0.00 0.00 174.94 175.07 1gee s ARG 182 N 2.40 3.82 -0.09 2.79 0.52 -1.09 -4.13 118.95 123.16 1gee s ARG 182 Ca 0.21 0.20 -0.01 0.00 -0.52 0.00 0.00 55.73 55.61 1gee s ARG 182 Cb -0.15 -3.24 0.03 0.00 0.52 0.00 0.00 34.95 32.10 1gee s ARG 182 CO 0.11 0.65 -0.03 0.08 0.02 0.00 0.00 175.30 176.13 1gee s VAL 183 N -0.84 0.66 0.08 3.52 1.01 -1.26 -1.05 120.40 122.52 1gee s VAL 183 Ca 0.20 -0.06 0.01 0.00 0.00 0.00 0.00 61.98 62.13 1gee s VAL 183 Cb -0.15 -0.75 -0.04 0.00 0.00 0.00 0.00 36.38 35.44 1gee s VAL 183 CO 0.09 0.31 -0.06 0.20 0.00 0.00 0.00 175.10 175.64 1gee s ASN 184 N 1.83 0.96 0.08 3.32 0.01 -0.69 -0.25 114.94 120.21 1gee s ASN 184 Ca 0.05 -0.94 0.06 0.00 -0.71 0.00 0.00 52.86 51.31 1gee s ASN 184 Cb -0.12 0.11 -0.04 0.00 0.41 0.00 0.00 41.25 41.61 1gee s ASN 184 CO -0.06 -0.46 -0.07 0.20 -1.51 0.00 0.00 177.10 175.20 1gee s ASN 185 N -2.82 4.62 -0.09 -1.22 -0.87 0.12 -0.83 114.94 113.85 1gee s ASN 185 Ca 0.08 -0.28 0.02 0.00 -1.57 0.00 0.00 52.86 51.11 1gee s ASN 185 Cb 0.04 -0.99 -0.01 0.00 -0.02 0.00 0.00 41.25 40.27 1gee s ASN 185 CO -0.05 0.20 -0.17 -0.63 -2.57 0.00 0.00 177.10 173.88 1gee s ILE 186 N -1.20 2.75 -0.60 0.60 1.01 -0.81 -1.03 121.20 121.92 1gee s ILE 186 Ca 0.22 -0.79 0.02 0.00 0.00 0.00 0.00 60.65 60.10 1gee s ILE 186 Cb -0.11 -2.10 0.15 0.00 0.01 0.00 0.00 42.46 40.41 1gee s ILE 186 CO 0.14 0.55 0.38 -0.83 0.00 0.00 0.00 174.94 175.18 1gee s GLY 187 N -0.00 2.59 0.52 6.18 0.00 -0.11 -0.35 107.32 116.15 1gee s GLY 187 Ca -0.05 -3.42 -0.19 0.00 0.00 0.00 0.00 44.72 41.06 1gee s GLY 187 CO 0.04 1.06 1.07 -4.14 0.00 0.00 0.00 173.10 171.13 1gee s PRO 188 N -0.52 3.59 0.00 2.90 0.02 -1.26 -1.72 135.00 138.00 1gee s PRO 188 Ca 0.19 1.43 0.00 0.00 0.02 0.00 0.00 61.00 62.64 1gee s PRO 188 Cb -0.20 -2.06 0.00 0.00 0.02 0.00 0.00 34.50 32.27 1gee s PRO 188 CO -0.04 -0.62 0.00 0.41 -0.33 0.00 0.00 177.00 176.41 1gee n GLY 189 N -0.18 1.14 3.63 0.52 0.00 -0.72 -2.02 105.19 107.56 1gee n GLY 189 Ca 0.10 -0.89 -0.42 0.00 0.00 0.00 0.00 46.02 44.81 1gee n GLY 189 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1gee s ALA 190 N -3.38 3.58 0.05 4.61 0.00 -1.26 -4.88 121.76 120.48 1gee s ALA 190 Ca 0.00 -0.22 0.09 0.00 0.00 0.00 0.00 51.96 51.83 1gee s ALA 190 Cb 0.00 -3.36 -0.03 0.00 0.00 0.00 0.00 23.12 19.73 1gee s ALA 190 CO 0.00 -1.12 -0.25 0.42 0.00 0.00 0.00 175.76 174.81 1gee s ILE 191 N 3.01 2.06 -0.96 0.00 -1.09 -1.26 -1.92 121.20 121.05 1gee s ILE 191 Ca 0.36 -1.39 -0.24 0.00 -2.23 0.00 0.00 60.65 57.15 1gee s ILE 191 Cb -0.14 -1.77 -0.00 0.00 -1.58 0.00 0.00 42.46 38.96 1gee s ILE 191 CO 0.10 0.31 1.71 0.21 -1.23 0.00 0.00 174.94 176.05 1gee s ASN 192 N -1.29 5.79 0.31 3.58 2.47 0.42 -4.78 114.94 121.43 1gee s ASN 192 Ca 0.11 -1.04 0.03 0.00 0.42 0.00 0.00 52.86 52.38 1gee s ASN 192 Cb -0.10 -2.56 -0.05 0.00 -1.45 0.00 0.00 41.25 37.09 1gee s ASN 192 CO 0.02 -2.16 0.11 0.42 -3.72 0.00 0.00 177.10 171.78 1gee s THR 193 N 7.65 0.64 0.57 -5.21 -4.23 -1.26 -4.42 115.64 109.38 1gee s THR 193 Ca 0.59 -2.00 0.25 0.00 -1.18 0.00 0.00 61.69 59.35 1gee s THR 193 Cb -0.04 -2.60 0.33 0.00 1.34 0.00 0.00 72.50 71.54 1gee s THR 193 CO -0.05 0.00 2.19 1.55 -0.54 0.00 0.00 174.62 177.77 1gee h PRO 194 N 2.19 0.00 0.00 3.99 0.13 -1.97 -1.11 132.00 135.23 1gee h PRO 194 Ca -0.37 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.76 1gee h PRO 194 Cb 1.25 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.38 1gee h PRO 194 CO 0.60 0.00 0.00 1.51 -0.23 0.00 0.00 178.00 179.88 1gee n ILE 195 N -4.08 1.01 -0.47 -3.56 0.13 -1.26 -2.54 119.36 108.58 1gee n ILE 195 Ca -0.02 0.25 0.00 0.00 -1.10 0.00 0.00 62.75 61.88 1gee n ILE 195 Cb 0.14 -1.04 0.00 0.00 -0.84 0.00 0.00 39.64 37.90 1gee n ILE 195 CO 0.00 0.00 0.00 0.59 2.80 0.00 0.00 176.55 179.94 1gee n ASN 196 N -1.43 0.83 -0.05 9.51 3.02 -0.46 -4.87 115.26 121.80 1gee n ASN 196 Ca 0.04 -1.30 -0.08 0.00 -0.03 0.00 0.00 54.58 53.21 1gee n ASN 196 Cb 0.13 0.00 -0.02 0.00 -0.61 0.00 0.00 39.78 39.28 1gee n ASN 196 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1gee h ALA 197 N 0.00 0.11 -0.43 5.41 0.00 -1.16 0.76 119.26 123.95 1gee h ALA 197 Ca 0.00 0.09 -0.05 0.00 0.00 0.00 0.00 54.91 54.95 1gee h ALA 197 Cb 0.53 0.23 -0.02 0.00 0.00 0.00 0.00 17.79 18.53 1gee h ALA 197 CO 0.00 -0.50 0.06 1.05 0.00 0.00 0.00 179.25 179.86 1gee h GLU 198 N -0.05 0.71 -0.41 0.00 9.09 -1.89 -0.86 114.58 121.16 1gee h GLU 198 Ca 0.12 -0.20 -0.01 0.00 0.05 0.00 0.00 59.36 59.32 1gee h GLU 198 Cb 0.23 -0.08 -0.02 0.00 -1.65 0.00 0.00 28.75 27.23 1gee h GLU 198 CO -0.27 0.75 0.22 -0.22 0.05 0.00 0.00 179.01 179.55 1gee h LYS 199 N 0.57 0.58 0.00 1.06 3.64 -1.84 -2.28 116.57 118.30 1gee h LYS 199 Ca 0.13 -0.07 0.00 0.00 -1.27 0.00 0.00 60.65 59.44 1gee h LYS 199 Cb 0.39 -0.11 0.00 0.00 -0.41 0.00 0.00 32.23 32.10 1gee h LYS 199 CO 0.01 0.47 0.00 1.19 -2.27 0.00 0.00 179.45 178.85 1gee n PHE 200 N -4.72 0.00 -0.03 1.91 0.99 0.24 -3.24 117.46 112.60 1gee n PHE 200 Ca 0.00 0.00 -0.17 0.00 -0.00 0.00 0.00 57.45 57.29 1gee n PHE 200 Cb 0.08 -0.38 -0.07 0.00 -1.00 0.00 0.00 39.48 38.11 1gee n PHE 200 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.76 176.76 1gee h ALA 201 N 3.16 0.28 -2.27 4.37 0.00 -0.54 -3.43 119.26 120.83 1gee h ALA 201 Ca 0.00 -0.55 -0.55 0.00 0.00 0.00 0.00 54.91 53.80 1gee h ALA 201 Cb 0.35 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.10 1gee h ALA 201 CO 0.00 0.57 0.90 0.34 0.00 0.00 0.00 179.25 181.05 1gee s ASP 202 N -6.93 6.86 0.45 0.00 2.15 -1.20 -4.91 116.67 113.09 1gee s ASP 202 Ca -0.11 1.97 0.15 0.00 0.43 0.00 0.00 52.55 54.98 1gee s ASP 202 Cb 0.08 -2.55 1.06 0.00 -0.30 0.00 0.00 42.92 41.21 1gee s ASP 202 CO 0.87 -0.76 1.99 1.55 -0.17 0.00 0.00 175.17 178.66 1gee h PRO 203 N 8.28 0.35 -0.07 4.34 0.13 -1.88 -0.27 132.00 142.88 1gee h PRO 203 Ca -0.34 -0.02 -0.17 0.00 -0.87 0.00 0.00 66.00 64.59 1gee h PRO 203 Cb 1.15 -0.08 0.01 0.00 0.13 0.00 0.00 31.00 32.21 1gee h PRO 203 CO 0.93 0.23 -0.64 1.49 -0.23 0.00 0.00 178.00 179.79 1gee h GLU 204 N 0.36 0.55 -0.46 0.86 4.81 -1.93 -2.50 114.58 116.27 1gee h GLU 204 Ca 0.26 -0.50 -0.12 0.00 -0.13 0.00 0.00 59.36 58.86 1gee h GLU 204 Cb 0.53 0.12 -0.01 0.00 0.63 0.00 0.00 28.75 30.02 1gee h GLU 204 CO -0.06 1.13 -0.17 1.96 -0.73 0.00 0.00 179.01 181.13 1gee h GLN 205 N 0.15 0.93 -0.23 1.92 4.20 -1.69 -1.84 115.11 118.55 1gee h GLN 205 Ca -0.06 -0.39 -0.01 0.00 0.06 0.00 0.00 58.65 58.26 1gee h GLN 205 Cb 1.30 -0.04 -0.01 0.00 0.30 0.00 0.00 27.48 29.03 1gee h GLN 205 CO 0.13 1.04 0.12 -0.09 -0.67 0.00 0.00 178.83 179.36 1gee h ARG 206 N 0.77 0.32 -0.19 1.46 2.43 -1.12 -1.29 114.38 116.75 1gee h ARG 206 Ca 0.11 -0.04 -0.04 0.00 -0.81 0.00 0.00 59.98 59.20 1gee h ARG 206 Cb 0.74 -0.06 -0.01 0.00 -0.42 0.00 0.00 29.97 30.22 1gee h ARG 206 CO 0.06 0.30 -0.06 0.00 -1.51 0.00 0.00 179.97 178.76 1gee h ALA 207 N 1.00 1.54 -0.32 2.80 0.00 -1.41 -1.05 119.26 121.83 1gee h ALA 207 Ca 0.08 -0.17 -0.05 0.00 0.00 0.00 0.00 54.91 54.77 1gee h ALA 207 Cb 0.08 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.76 1gee h ALA 207 CO -0.01 0.33 0.02 0.22 0.00 0.00 0.00 179.25 179.80 1gee h ASP 208 N 0.28 0.53 -0.35 0.00 3.58 -0.73 -2.18 116.42 117.55 1gee h ASP 208 Ca 0.06 -0.29 -0.07 0.00 0.42 0.00 0.00 57.03 57.15 1gee h ASP 208 Cb 0.29 -0.14 -0.01 0.00 1.72 0.00 0.00 39.33 41.19 1gee h ASP 208 CO 0.01 0.69 -0.07 0.58 -2.88 0.00 0.00 179.24 177.58 1gee h VAL 209 N 0.35 1.27 -0.03 2.25 2.07 -0.87 -2.82 116.25 118.48 1gee h VAL 209 Ca 0.09 -1.12 0.01 0.00 0.82 0.00 0.00 66.70 66.50 1gee h VAL 209 Cb 0.41 1.28 -0.00 0.00 -1.52 0.00 0.00 31.29 31.46 1gee h VAL 209 CO 0.01 0.37 0.03 -0.33 0.02 0.00 0.00 177.57 177.67 1gee h GLU 210 N 0.46 0.00 0.00 1.57 5.08 -1.13 0.05 114.58 120.62 1gee h GLU 210 Ca 0.09 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.45 1gee h GLU 210 Cb 0.57 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.82 1gee h GLU 210 CO 0.03 0.00 0.00 -1.13 -1.00 0.00 0.00 179.01 176.91 1gee n SER 211 N -4.28 0.57 -1.03 1.42 3.41 -0.83 -2.14 113.62 110.74 1gee n SER 211 Ca -0.02 0.62 0.12 0.00 -0.26 0.00 0.00 58.87 59.33 1gee n SER 211 Cb 0.12 -0.75 0.20 0.00 -0.26 0.00 0.00 64.21 63.53 1gee n SER 211 CO 0.00 0.00 0.00 0.23 -0.16 0.00 0.00 175.04 175.11 1gee n MET 212 N -2.10 2.37 -3.90 4.33 2.81 0.00 -4.80 117.12 115.82 1gee n MET 212 Ca 0.03 -2.04 -0.35 0.00 -1.81 0.00 0.00 57.70 53.53 1gee n MET 212 Cb 0.26 -1.49 -0.14 0.00 -0.71 0.00 0.00 33.22 31.14 1gee n MET 212 CO 0.00 0.00 0.00 0.42 1.51 0.00 0.00 175.97 177.90 1gee s ILE 213 N -1.70 2.95 0.28 2.02 1.01 -0.91 -4.56 121.20 120.28 1gee s ILE 213 Ca 0.35 -1.55 0.01 0.00 0.00 0.00 0.00 60.65 59.46 1gee s ILE 213 Cb 0.21 -2.77 0.27 0.00 0.01 0.00 0.00 42.46 40.18 1gee s ILE 213 CO 0.31 -0.21 1.72 -0.65 0.00 0.00 0.00 174.94 176.10 1gee h PRO 214 N 7.97 0.44 0.00 2.79 0.11 -1.80 0.25 132.00 141.77 1gee h PRO 214 Ca -0.19 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.89 1gee h PRO 214 Cb 1.06 -0.10 0.00 0.00 0.11 0.00 0.00 31.00 32.07 1gee h PRO 214 CO 0.55 0.29 0.00 -1.33 -0.21 0.00 0.00 178.00 177.30 1gee n MET 215 N -5.00 0.06 -0.91 1.05 2.81 -0.50 -4.89 117.12 109.73 1gee n MET 215 Ca 0.19 0.35 0.00 0.00 -1.81 0.00 0.00 57.70 56.44 1gee n MET 215 Cb 0.56 -1.63 0.00 0.00 -0.71 0.00 0.00 33.22 31.44 1gee n MET 215 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1gee n GLY 216 N -0.26 0.77 3.05 3.03 0.00 0.89 -5.04 105.19 107.64 1gee n GLY 216 Ca 0.02 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.95 1gee n GLY 216 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1gee s TYR 217 N -2.99 0.17 0.02 1.61 -0.85 -1.26 -4.95 117.35 109.10 1gee s TYR 217 Ca 0.00 -0.38 -0.30 0.00 -0.52 0.00 0.00 57.07 55.87 1gee s TYR 217 Cb 0.00 -0.13 -0.04 0.00 0.38 0.00 0.00 41.96 42.17 1gee s TYR 217 CO 0.00 -0.25 1.00 0.42 -1.52 0.00 0.00 175.55 175.19 1gee s ILE 218 N -1.60 4.73 0.78 -3.49 1.01 -1.26 -4.95 121.20 116.42 1gee s ILE 218 Ca -0.14 2.01 -0.10 0.00 0.00 0.00 0.00 60.65 62.41 1gee s ILE 218 Cb -0.08 -4.29 0.06 0.00 0.01 0.00 0.00 42.46 38.17 1gee s ILE 218 CO -0.00 0.18 1.09 -0.83 0.00 0.00 0.00 174.94 175.38 1gee s GLY 219 N 0.84 1.68 0.10 6.18 0.00 -0.81 -4.77 107.32 110.55 1gee s GLY 219 Ca 0.52 0.28 0.02 0.00 0.00 0.00 0.00 44.72 45.54 1gee s GLY 219 CO 0.28 0.63 0.19 -0.54 0.00 0.00 0.00 173.10 173.67 1gee s GLU 220 N -4.89 3.24 0.41 2.90 0.41 -1.26 -0.44 118.70 119.07 1gee s GLU 220 Ca 0.61 -0.60 0.15 0.00 -0.41 0.00 0.00 54.97 54.73 1gee s GLU 220 Cb -0.17 -2.90 1.03 0.00 -1.78 0.00 0.00 34.13 30.31 1gee s GLU 220 CO 0.56 0.56 1.88 -1.35 -0.49 0.00 0.00 175.26 176.42 1gee h PRO 221 N 2.78 0.44 0.00 0.39 0.11 -1.95 -0.92 132.00 132.85 1gee h PRO 221 Ca -0.47 -0.03 -0.02 0.00 0.11 0.00 0.00 66.00 65.59 1gee h PRO 221 Cb 1.18 -0.10 -0.00 0.00 0.11 0.00 0.00 31.00 32.18 1gee h PRO 221 CO 0.70 0.29 -0.11 0.93 -0.21 0.00 0.00 178.00 179.60 1gee h GLU 222 N 0.46 0.00 0.00 1.05 3.07 -1.95 -1.03 114.58 116.18 1gee h GLU 222 Ca 0.43 0.00 -0.03 0.00 -0.50 0.00 0.00 59.36 59.25 1gee h GLU 222 Cb 0.98 0.00 -0.00 0.00 -0.84 0.00 0.00 28.75 28.88 1gee h GLU 222 CO -0.16 0.11 -0.16 0.93 -1.40 0.00 0.00 179.01 178.33 1gee h GLU 223 N 0.00 0.00 0.10 2.33 5.08 -1.57 -1.53 114.58 119.00 1gee h GLU 223 Ca -0.00 0.00 -0.34 0.00 -1.00 0.00 0.00 59.36 58.02 1gee h GLU 223 Cb 0.21 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.43 1gee h GLU 223 CO 0.01 0.16 -1.86 0.82 -1.00 0.00 0.00 179.01 177.15 1gee h ILE 224 N 0.00 0.76 -0.13 3.13 1.08 -1.32 -3.32 117.51 117.70 1gee h ILE 224 Ca -0.00 -2.49 -0.03 0.00 -0.39 0.00 0.00 64.86 61.95 1gee h ILE 224 Cb 0.66 2.53 -0.01 0.00 -3.07 0.00 0.00 36.82 36.94 1gee h ILE 224 CO 0.02 0.79 -0.04 0.00 -0.69 0.00 0.00 178.15 178.23 1gee h ALA 225 N 0.36 1.70 -0.67 1.87 0.00 -1.04 -1.49 119.26 119.98 1gee h ALA 225 Ca -0.36 -0.11 -0.04 0.00 0.00 0.00 0.00 54.91 54.39 1gee h ALA 225 Cb 2.03 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 19.72 1gee h ALA 225 CO 0.10 0.23 0.25 0.00 0.00 0.00 0.00 179.25 179.82 1gee h ALA 226 N 1.78 1.17 -0.29 0.00 0.00 -1.39 -1.63 119.26 118.90 1gee h ALA 226 Ca 0.04 -0.19 -0.07 0.00 0.00 0.00 0.00 54.91 54.70 1gee h ALA 226 Cb 0.19 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.71 1gee h ALA 226 CO 0.01 0.59 -0.10 0.28 0.00 0.00 0.00 179.25 180.03 1gee h VAL 227 N 0.98 1.29 -0.80 0.00 2.07 -1.39 -2.59 116.25 115.81 1gee h VAL 227 Ca 0.22 -1.17 -0.01 0.00 0.82 0.00 0.00 66.70 66.57 1gee h VAL 227 Cb 0.22 1.44 -0.04 0.00 -1.52 0.00 0.00 31.29 31.39 1gee h VAL 227 CO -0.02 0.37 0.47 0.00 0.02 0.00 0.00 177.57 178.42 1gee h ALA 228 N 0.77 1.02 -0.53 1.67 0.00 -1.16 -1.18 119.26 119.84 1gee h ALA 228 Ca 0.07 -0.10 -0.04 0.00 0.00 0.00 0.00 54.91 54.84 1gee h ALA 228 Cb 0.60 -0.32 -0.02 0.00 0.00 0.00 0.00 17.79 18.05 1gee h ALA 228 CO 0.04 0.50 0.18 0.00 0.00 0.00 0.00 179.25 179.96 1gee h ALA 229 N 1.25 0.69 -0.20 0.00 0.00 -1.26 -1.92 119.26 117.82 1gee h ALA 229 Ca 0.29 -0.18 -0.03 0.00 0.00 0.00 0.00 54.91 54.98 1gee h ALA 229 Cb -0.02 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.55 1gee h ALA 229 CO -0.05 0.34 0.02 2.35 0.00 0.00 0.00 179.25 181.91 1gee h TRP 230 N 0.73 0.37 -0.06 0.00 7.01 -1.18 -2.51 115.95 120.32 1gee h TRP 230 Ca 0.17 -0.06 -0.01 0.00 2.11 0.00 0.00 58.89 61.10 1gee h TRP 230 Cb 0.26 -0.10 -0.00 0.00 -2.10 0.00 0.00 29.16 27.22 1gee h TRP 230 CO 0.01 0.51 -0.02 -0.07 -2.79 0.00 0.00 178.44 176.08 1gee h LEU 231 N 0.13 0.07 -0.24 0.65 3.38 -1.13 -1.89 115.31 116.28 1gee h LEU 231 Ca 0.06 -0.01 -0.08 0.00 0.09 0.00 0.00 57.88 57.94 1gee h LEU 231 Cb 0.35 -0.02 -0.01 0.00 0.09 0.00 0.00 40.66 41.07 1gee h LEU 231 CO 0.01 0.11 -0.40 0.00 0.09 0.00 0.00 178.44 178.25 1gee h ALA 232 N 1.90 0.78 -2.45 1.53 0.00 -1.19 -3.45 119.26 116.39 1gee h ALA 232 Ca 0.02 -0.36 -0.48 0.00 0.00 0.00 0.00 54.91 54.08 1gee h ALA 232 Cb 0.10 -0.06 0.10 0.00 0.00 0.00 0.00 17.79 17.93 1gee h ALA 232 CO 0.00 0.50 0.36 -1.54 0.00 0.00 0.00 179.25 178.57 1gee s SER 233 N -6.39 4.61 0.00 0.00 1.04 -0.71 -4.94 113.70 107.31 1gee s SER 233 Ca 0.04 1.19 0.20 0.00 0.48 0.00 0.00 55.95 57.85 1gee s SER 233 Cb 0.08 -1.90 0.99 0.00 0.10 0.00 0.00 66.02 65.29 1gee s SER 233 CO 0.72 -1.88 1.62 -1.54 0.98 0.00 0.00 173.24 173.14 1gee n SER 234 N -3.36 0.00 0.19 7.02 3.41 -1.26 -2.38 113.62 117.24 1gee n SER 234 Ca 0.07 0.04 0.03 0.00 -0.26 0.00 0.00 58.87 58.75 1gee n SER 234 Cb 0.57 -0.30 0.39 0.00 -0.26 0.00 0.00 64.21 64.61 1gee n SER 234 CO 0.00 0.00 0.00 -0.33 -0.16 0.00 0.00 175.04 174.55 1gee h GLU 235 N 0.00 0.01 -1.01 4.33 4.39 -1.92 -2.20 114.58 118.18 1gee h GLU 235 Ca 0.00 -0.00 -0.56 0.00 0.34 0.00 0.00 59.36 59.13 1gee h GLU 235 Cb 0.20 -0.00 -0.29 0.00 -0.10 0.00 0.00 28.75 28.56 1gee h GLU 235 CO 0.00 0.33 0.72 0.00 -1.16 0.00 0.00 179.01 178.90 1gee n ALA 236 N -2.48 5.80 0.02 3.43 0.00 -1.00 -4.71 120.51 121.57 1gee n ALA 236 Ca -0.02 -3.02 0.17 0.00 0.00 0.00 0.00 53.44 50.58 1gee n ALA 236 Cb 0.37 -1.56 0.65 0.00 0.00 0.00 0.00 19.45 18.91 1gee n ALA 236 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1gee h SER 237 N 1.35 0.06 -0.55 0.00 4.64 -1.55 -2.04 113.55 115.46 1gee h SER 237 Ca 0.61 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.93 1gee h SER 237 Cb 2.05 -0.01 0.00 0.00 -0.31 0.00 0.00 62.40 64.13 1gee h SER 237 CO 1.25 0.03 0.00 0.00 -0.87 0.00 0.00 176.83 177.25 1gee n TYR 238 N -4.42 1.29 -3.77 4.77 9.36 -1.26 -4.91 117.16 118.22 1gee n TYR 238 Ca 0.08 -0.64 -0.37 0.00 3.32 0.00 0.00 57.90 60.29 1gee n TYR 238 Cb 0.50 -0.24 -0.13 0.00 -0.63 0.00 0.00 39.34 38.85 1gee n TYR 238 CO 0.00 0.00 0.00 0.08 0.22 0.00 0.00 176.86 177.16 1gee s VAL 239 N -1.91 4.07 -0.06 2.97 1.01 -0.77 -5.08 120.40 120.63 1gee s VAL 239 Ca 0.46 -0.43 -0.18 0.00 0.00 0.00 0.00 61.98 61.84 1gee s VAL 239 Cb 0.31 -2.98 0.04 0.00 0.00 0.00 0.00 36.38 33.74 1gee s VAL 239 CO 0.21 0.24 0.40 0.28 0.00 0.00 0.00 175.10 176.23 1gee s THR 240 N 1.55 0.03 0.00 3.92 -1.32 -1.26 -4.79 115.64 113.78 1gee s THR 240 Ca 0.05 -0.27 0.00 0.00 -1.21 0.00 0.00 61.69 60.26 1gee s THR 240 Cb -0.16 -0.68 0.00 0.00 -1.51 0.00 0.00 72.50 70.15 1gee s THR 240 CO 0.02 -0.15 0.00 0.61 -2.21 0.00 0.00 174.62 172.89 1gee n GLY 241 N 1.61 0.45 4.00 6.08 0.00 0.66 -4.97 105.19 113.01 1gee n GLY 241 Ca -0.19 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.64 1gee n GLY 241 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1gee s ILE 242 N -1.94 2.85 -0.18 -0.61 -4.36 -1.26 -4.65 121.20 111.04 1gee s ILE 242 Ca 0.00 -0.87 0.01 0.00 -0.26 0.00 0.00 60.65 59.53 1gee s ILE 242 Cb 0.00 -2.97 0.03 0.00 1.25 0.00 0.00 42.46 40.77 1gee s ILE 242 CO 0.00 0.00 -0.14 -0.89 0.24 0.00 0.00 174.94 174.15 1gee s THR 243 N -2.52 1.78 -0.47 8.37 2.01 -1.26 -0.70 115.64 122.85 1gee s THR 243 Ca 0.56 -0.94 -0.17 0.00 0.31 0.00 0.00 61.69 61.45 1gee s THR 243 Cb -0.10 -1.73 0.06 0.00 0.01 0.00 0.00 72.50 70.73 1gee s THR 243 CO 0.35 0.33 0.47 -0.22 -0.69 0.00 0.00 174.62 174.86 1gee s LEU 244 N 1.37 5.26 0.03 4.42 0.20 -0.19 -4.89 118.68 124.88 1gee s LEU 244 Ca 0.01 -1.06 -0.29 0.00 0.69 0.00 0.00 54.13 53.48 1gee s LEU 244 Cb -0.15 -2.30 -0.04 0.00 -0.43 0.00 0.00 46.19 43.27 1gee s LEU 244 CO -0.10 -0.70 0.95 -0.36 -0.29 0.00 0.00 176.35 175.85 1gee s PHE 245 N 2.04 3.71 -0.49 5.38 0.40 -1.26 -0.93 117.98 126.82 1gee s PHE 245 Ca 0.09 1.70 0.03 0.00 -0.60 0.00 0.00 56.93 58.15 1gee s PHE 245 Cb -0.21 -3.07 0.15 0.00 0.51 0.00 0.00 43.02 40.40 1gee s PHE 245 CO 0.10 0.07 0.31 0.00 0.70 0.00 0.00 175.22 176.40 1gee s ALA 246 N 0.64 2.46 -0.01 5.36 0.00 -0.70 -4.92 121.76 124.60 1gee s ALA 246 Ca 0.49 -2.88 0.01 0.00 0.00 0.00 0.00 51.96 49.59 1gee s ALA 246 Cb -0.22 -1.92 0.02 0.00 0.00 0.00 0.00 23.12 21.00 1gee s ALA 246 CO 0.28 -2.05 0.77 -0.40 0.00 0.00 0.00 175.76 174.35 1gee n ASP 247 N 3.09 0.29 -0.79 0.00 3.85 -1.26 -1.76 116.55 119.97 1gee n ASP 247 Ca 0.14 -1.58 -0.10 0.00 -0.71 0.00 0.00 54.79 52.54 1gee n ASP 247 Cb 0.36 -0.10 -0.04 0.00 -1.35 0.00 0.00 41.12 39.99 1gee n ASP 247 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 1gee n GLY 248 N -0.12 1.03 0.03 6.12 0.00 -1.26 -2.42 105.19 108.56 1gee n GLY 248 Ca 0.01 -0.07 0.00 0.00 0.00 0.00 0.00 46.02 45.96 1gee n GLY 248 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1gee n GLY 249 N -0.14 0.92 0.33 -0.02 0.00 -1.26 -1.41 105.19 103.60 1gee n GLY 249 Ca -0.10 0.00 0.06 0.00 0.00 0.00 0.00 46.02 45.98 1gee n GLY 249 CO 0.00 0.00 0.00 1.98 0.00 0.00 0.00 173.32 175.30 1gee h MET 250 N 4.11 0.77 0.00 1.61 -1.53 -1.72 -1.04 114.93 117.13 1gee h MET 250 Ca 0.00 -0.05 0.00 0.00 -3.44 0.00 0.00 59.70 56.21 1gee h MET 250 Cb 0.00 -0.17 0.00 0.00 -0.55 0.00 0.00 31.60 30.88 1gee h MET 250 CO 0.00 0.51 0.00 0.25 0.14 0.00 0.00 176.91 177.81 1gee n THR 251 N -4.75 0.15 1.36 -0.77 -2.24 -1.26 -3.19 114.28 103.59 1gee n THR 251 Ca 0.17 0.04 0.08 0.00 -2.27 0.00 0.00 64.05 62.07 1gee n THR 251 Cb 0.37 -0.72 0.31 0.00 -2.10 0.00 0.00 70.33 68.20 1gee n THR 251 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 1gee n LEU 252 N -1.11 1.23 -2.22 3.22 4.77 -0.39 -4.96 117.00 117.55 1gee n LEU 252 Ca 0.13 -0.56 -0.02 0.00 -0.03 0.00 0.00 56.01 55.53 1gee n LEU 252 Cb 0.10 -0.11 0.00 0.00 -2.33 0.00 0.00 43.42 41.09 1gee n LEU 252 CO 0.13 0.28 0.08 -1.22 -1.33 0.00 0.00 177.39 175.33 1gee n TYR 253 N 0.08 -1.65 0.06 -1.77 4.02 -1.19 -4.90 117.16 111.81 1gee n TYR 253 Ca 0.13 0.65 0.20 0.00 -0.01 0.00 0.00 57.90 58.87 1gee n TYR 253 Cb 0.24 -2.80 0.73 0.00 -0.02 0.00 0.00 39.34 37.49 1gee n TYR 253 CO 0.00 0.00 0.00 -1.00 -1.01 0.00 0.00 176.86 174.85 1gee h PRO 254 N 0.70 0.00 0.00 -0.72 0.13 -1.83 -2.08 132.00 128.20 1gee h PRO 254 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.13 1gee h PRO 254 Cb 0.70 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.83 1gee h PRO 254 CO 0.12 0.00 0.00 -1.13 -0.23 0.00 0.00 178.00 176.76 1gee n SER 255 N -4.08 0.60 -1.16 1.44 3.41 -1.26 -2.88 113.62 109.69 1gee n SER 255 Ca 0.08 0.65 0.07 0.00 -0.26 0.00 0.00 58.87 59.41 1gee n SER 255 Cb 0.56 -0.77 0.25 0.00 -0.26 0.00 0.00 64.21 63.99 1gee n SER 255 CO 0.00 0.00 0.00 0.49 -0.16 0.00 0.00 175.04 175.37 1gee n PHE 256 N -2.16 0.98 -1.78 7.33 3.01 -0.78 -4.74 117.46 119.32 1gee n PHE 256 Ca 0.02 -0.41 -0.34 0.00 1.01 0.00 0.00 57.45 57.73 1gee n PHE 256 Cb 0.23 -0.14 0.05 0.00 -0.01 0.00 0.00 39.48 39.61 1gee n PHE 256 CO 0.00 0.00 0.00 -0.65 1.01 0.00 0.00 176.76 177.12 1gee s GLN 257 N -1.63 2.75 -1.17 -1.08 -0.21 -1.14 -3.27 119.66 113.92 1gee s GLN 257 Ca 0.37 1.53 0.00 0.00 0.02 0.00 0.00 55.36 57.28 1gee s GLN 257 Cb 0.22 -1.93 0.00 0.00 1.00 0.00 0.00 33.01 32.30 1gee s GLN 257 CO 0.20 -1.31 0.00 0.00 -2.12 0.00 0.00 175.29 172.05 1gee n ALA 258 N -2.26 -0.29 -2.29 6.09 0.00 -1.26 -3.21 120.51 117.29 1gee n ALA 258 Ca 0.11 0.14 -0.19 0.00 0.00 0.00 0.00 53.44 53.51 1gee n ALA 258 Cb 0.51 -1.47 -0.01 0.00 0.00 0.00 0.00 19.45 18.48 1gee n ALA 258 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1gee n GLY 259 N -1.21 -0.23 3.69 0.00 0.00 -1.20 -4.99 105.19 101.25 1gee n GLY 259 Ca -0.14 -0.09 -0.30 0.00 0.00 0.00 0.00 46.02 45.50 1gee n GLY 259 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1gee s ARG 260 N -4.84 0.94 0.00 1.61 0.52 -1.20 -5.14 118.95 110.85 1gee s ARG 260 Ca 0.00 0.83 0.00 0.00 -0.52 0.00 0.00 55.73 56.04 1gee s ARG 260 Cb 0.00 -1.77 0.00 0.00 0.52 0.00 0.00 34.95 33.70 1gee s ARG 260 CO 0.00 -2.46 0.00 0.41 0.02 0.00 0.00 175.30 173.27