#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2i2d s LYS 2 N 0.00 4.31 0.10 0.03 1.02 -1.26 -2.53 119.74 121.41 2i2d s LYS 2 Ca 0.00 1.74 -0.17 0.00 0.02 0.00 0.00 55.97 57.56 2i2d s LYS 2 Cb 0.00 -2.83 0.04 0.00 -0.52 0.00 0.00 37.83 34.52 2i2d s LYS 2 CO 0.00 -0.07 0.42 1.52 -0.92 0.00 0.00 175.35 176.30 2i2d s TYR 3 N -1.39 -0.24 0.16 3.18 1.13 -0.88 -1.15 117.35 118.17 2i2d s TYR 3 Ca 0.52 0.02 -0.06 0.00 -1.41 0.00 0.00 57.07 56.14 2i2d s TYR 3 Cb -0.29 0.26 -0.02 0.00 -1.10 0.00 0.00 41.96 40.81 2i2d s TYR 3 CO 0.36 -0.67 0.21 0.00 -2.51 0.00 0.00 175.55 172.95 2i2d s MET 4 N -3.40 1.12 -0.05 -3.49 0.23 -0.75 -0.21 119.30 112.74 2i2d s MET 4 Ca 0.00 -1.31 0.00 0.00 -1.03 0.00 0.00 55.69 53.36 2i2d s MET 4 Cb 0.01 0.33 0.02 0.00 -1.53 0.00 0.00 34.83 33.66 2i2d s MET 4 CO -0.09 -0.38 -0.04 0.42 -2.03 0.00 0.00 175.02 172.90 2i2d s ILE 5 N -4.01 0.53 0.14 3.16 1.01 -1.26 -1.39 121.20 119.37 2i2d s ILE 5 Ca 0.22 -0.08 -0.02 0.00 0.00 0.00 0.00 60.65 60.77 2i2d s ILE 5 Cb 0.05 -0.58 -0.05 0.00 0.01 0.00 0.00 42.46 41.89 2i2d s ILE 5 CO 0.02 0.24 0.32 0.42 0.00 0.00 0.00 174.94 175.95 2i2d s THR 6 N 1.17 5.25 0.03 2.92 -4.23 0.05 -4.98 115.64 115.86 2i2d s THR 6 Ca -0.07 -0.26 0.05 0.00 -1.18 0.00 0.00 61.69 60.23 2i2d s THR 6 Cb -0.14 -3.67 -0.02 0.00 1.34 0.00 0.00 72.50 70.02 2i2d s THR 6 CO -0.01 -0.00 -0.14 -0.55 -0.54 0.00 0.00 174.62 173.37 2i2d s SER 7 N -2.72 1.67 0.25 3.99 0.15 -1.26 -1.44 113.70 114.34 2i2d s SER 7 Ca 0.38 -0.40 0.13 0.00 0.70 0.00 0.00 55.95 56.76 2i2d s SER 7 Cb -0.12 -0.13 0.70 0.00 -1.71 0.00 0.00 66.02 64.76 2i2d s SER 7 CO 0.27 0.07 1.32 1.17 1.20 0.00 0.00 173.24 177.27 2i2d n LYS 8 N 2.13 0.09 -1.00 5.44 4.81 0.08 -4.84 118.16 124.87 2i2d n LYS 8 Ca -0.17 0.55 0.00 0.00 -0.87 0.00 0.00 58.31 57.82 2i2d n LYS 8 Cb 0.55 -1.94 0.00 0.00 0.02 0.00 0.00 35.03 33.65 2i2d n LYS 8 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2i2d n GLY 9 N -1.31 0.49 3.97 3.14 0.00 -1.26 -5.03 105.19 105.20 2i2d n GLY 9 Ca -0.01 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.77 2i2d n GLY 9 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 2i2d s ASP 10 N -2.08 4.47 0.08 1.61 3.84 -1.26 -4.90 116.67 118.42 2i2d s ASP 10 Ca 0.00 -0.06 -0.31 0.00 -0.00 0.00 0.00 52.55 52.17 2i2d s ASP 10 Cb 0.00 -0.42 -0.17 0.00 -1.38 0.00 0.00 42.92 40.95 2i2d s ASP 10 CO 0.00 -1.78 1.63 1.05 -0.00 0.00 0.00 175.17 176.08 2i2d h GLU 11 N -0.56 -0.74 -0.79 2.11 4.11 -1.99 -1.48 114.58 115.25 2i2d h GLU 11 Ca -0.40 0.05 0.17 0.00 0.07 0.00 0.00 59.36 59.25 2i2d h GLU 11 Cb 1.28 0.17 -0.11 0.00 0.50 0.00 0.00 28.75 30.59 2i2d h GLU 11 CO 0.46 -0.49 0.28 1.57 0.07 0.00 0.00 179.01 180.90 2i2d h LYS 12 N -0.76 0.36 0.01 1.06 2.10 -1.99 -2.22 116.57 115.12 2i2d h LYS 12 Ca -0.06 -0.02 -0.21 0.00 -2.00 0.00 0.00 60.65 58.36 2i2d h LYS 12 Cb 0.62 -0.08 0.02 0.00 -0.90 0.00 0.00 32.23 31.88 2i2d h LYS 12 CO 0.07 0.24 -0.83 0.77 -2.00 0.00 0.00 179.45 177.70 2i2d h SER 13 N 0.37 0.71 -0.47 7.07 0.02 -1.90 -1.94 113.55 117.41 2i2d h SER 13 Ca 0.45 -0.76 -0.02 0.00 -0.84 0.00 0.00 61.79 60.62 2i2d h SER 13 Cb 0.77 -0.22 -0.02 0.00 0.14 0.00 0.00 62.40 63.07 2i2d h SER 13 CO -0.48 1.38 0.22 0.44 -1.14 0.00 0.00 176.83 177.25 2i2d h ASP 14 N 0.12 0.62 -0.51 3.07 5.19 -1.15 -0.89 116.42 122.87 2i2d h ASP 14 Ca -0.11 -0.14 -0.08 0.00 -0.62 0.00 0.00 57.03 56.08 2i2d h ASP 14 Cb 1.52 -0.16 -0.02 0.00 0.18 0.00 0.00 39.33 40.84 2i2d h ASP 14 CO 0.16 0.59 0.02 -0.07 -3.12 0.00 0.00 179.24 176.82 2i2d h LEU 15 N 0.62 0.91 -0.58 1.55 4.07 -1.45 -0.98 115.31 119.44 2i2d h LEU 15 Ca 0.16 -0.23 -0.12 0.00 0.08 0.00 0.00 57.88 57.77 2i2d h LEU 15 Cb 0.13 -0.24 -0.02 0.00 1.08 0.00 0.00 40.66 41.62 2i2d h LEU 15 CO -0.02 0.96 -0.15 0.25 -1.08 0.00 0.00 178.44 178.39 2i2d h LEU 16 N 0.87 0.98 -0.20 1.67 5.85 -1.16 -2.36 115.31 120.96 2i2d h LEU 16 Ca 0.16 -0.34 0.00 0.00 0.84 0.00 0.00 57.88 58.55 2i2d h LEU 16 Cb 0.49 -0.27 -0.01 0.00 0.37 0.00 0.00 40.66 41.24 2i2d h LEU 16 CO 0.02 1.12 0.13 -0.09 -0.34 0.00 0.00 178.44 179.28 2i2d h ARG 17 N 0.86 0.26 -0.79 1.25 2.43 -0.91 -2.27 114.38 115.21 2i2d h ARG 17 Ca 0.13 -0.02 -0.01 0.00 -0.81 0.00 0.00 59.98 59.27 2i2d h ARG 17 Cb 0.71 -0.06 -0.04 0.00 -0.42 0.00 0.00 29.97 30.17 2i2d h ARG 17 CO 0.05 0.18 0.46 -0.07 -1.51 0.00 0.00 179.97 179.08 2i2d h LEU 18 N 0.26 0.96 -0.83 3.80 3.38 -1.05 -1.50 115.31 120.33 2i2d h LEU 18 Ca 0.07 -0.06 -0.09 0.00 0.09 0.00 0.00 57.88 57.89 2i2d h LEU 18 Cb -0.02 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 40.47 2i2d h LEU 18 CO -0.02 0.75 -0.10 0.78 0.09 0.00 0.00 178.44 179.95 2i2d h ASN 19 N 1.09 0.76 -0.16 -0.43 2.35 -1.29 -0.97 115.58 116.92 2i2d h ASN 19 Ca 0.28 -0.22 -0.03 0.00 -0.55 0.00 0.00 56.30 55.78 2i2d h ASN 19 Cb -0.01 -0.20 -0.01 0.00 0.05 0.00 0.00 38.32 38.15 2i2d h ASN 19 CO -0.05 0.89 -0.03 0.24 -1.65 0.00 0.00 177.43 176.83 2i2d h MET 20 N 0.70 0.30 -0.36 0.81 2.86 -1.16 0.82 114.93 118.90 2i2d h MET 20 Ca 0.12 -0.11 0.07 0.00 -2.06 0.00 0.00 59.70 57.73 2i2d h MET 20 Cb 0.57 -0.02 -0.07 0.00 0.06 0.00 0.00 31.60 32.14 2i2d h MET 20 CO 0.04 0.56 -0.11 0.82 1.06 0.00 0.00 176.91 179.27 2i2d h ILE 21 N 0.01 0.59 -0.32 -1.22 2.04 -1.22 0.49 117.51 117.89 2i2d h ILE 21 Ca 0.04 0.00 0.02 0.00 1.00 0.00 0.00 64.86 65.92 2i2d h ILE 21 Cb 0.44 0.59 -0.02 0.00 -0.74 0.00 0.00 36.82 37.09 2i2d h ILE 21 CO 0.01 0.00 0.17 0.00 0.00 0.00 0.00 178.15 178.33 2i2d h ALA 22 N 1.31 0.39 -1.01 1.87 0.00 -1.12 -0.18 119.26 120.54 2i2d h ALA 22 Ca 0.18 0.00 0.07 0.00 0.00 0.00 0.00 54.91 55.16 2i2d h ALA 22 Cb 0.30 -0.07 -0.07 0.00 0.00 0.00 0.00 17.79 17.96 2i2d h ALA 22 CO -0.39 -0.20 0.65 0.78 0.00 0.00 0.00 179.25 180.09 2i2d h GLY 23 N 0.35 1.53 1.97 0.00 0.00 -0.23 -1.99 103.07 104.70 2i2d h GLY 23 Ca 0.13 -0.48 -0.07 0.00 0.00 0.00 0.00 47.33 46.92 2i2d h GLY 23 CO -0.08 0.34 -0.30 0.74 0.00 0.00 0.00 176.54 177.24 2i2d h PHE 24 N 1.18 0.04 -0.42 5.60 0.05 0.56 -2.73 116.94 121.22 2i2d h PHE 24 Ca 0.43 -0.01 0.12 0.00 3.82 0.00 0.00 57.97 62.34 2i2d h PHE 24 Cb 0.17 -0.01 -0.02 0.00 2.00 0.00 0.00 35.95 38.09 2i2d h PHE 24 CO -0.00 0.33 0.41 0.78 -0.18 0.00 0.00 178.31 179.65 2i2d h GLY 25 N 0.93 0.00 0.18 -1.45 0.00 -0.25 -1.30 103.07 101.18 2i2d h GLY 25 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 2i2d h GLY 25 CO 0.04 0.00 0.00 1.18 0.00 0.00 0.00 176.54 177.76 2i2d n GLU 26 N -3.86 1.24 -3.99 4.80 -0.58 -1.03 -4.81 120.64 112.41 2i2d n GLU 26 Ca 0.07 -0.36 -0.20 0.00 -0.42 0.00 0.00 57.16 56.26 2i2d n GLU 26 Cb 0.59 -1.35 -0.06 0.00 -0.57 0.00 0.00 31.44 30.05 2i2d n GLU 26 CO 0.00 0.00 0.00 0.66 -0.48 0.00 0.00 177.13 177.31 2i2d n TYR 27 N -0.45 -0.10 -3.51 -0.32 4.01 -0.49 -5.16 117.16 111.14 2i2d n TYR 27 Ca 0.16 -2.25 -0.21 0.00 -0.16 0.00 0.00 57.90 55.44 2i2d n TYR 27 Cb 0.16 0.06 -0.13 0.00 -0.31 0.00 0.00 39.34 39.12 2i2d n TYR 27 CO 0.00 0.00 0.00 -0.51 -0.46 0.00 0.00 176.86 175.89 2i2d s ASP 28 N -3.07 1.87 0.00 7.72 -0.00 -1.26 -4.81 116.67 117.12 2i2d s ASP 28 Ca 0.22 -0.51 0.00 0.00 -0.00 0.00 0.00 52.55 52.26 2i2d s ASP 28 Cb 0.01 0.20 0.00 0.00 -0.00 0.00 0.00 42.92 43.13 2i2d s ASP 28 CO 0.15 -0.35 0.00 0.23 -0.00 0.00 0.00 175.17 175.20 2i2d n MET 29 N 5.30 0.00 -4.96 8.23 0.00 -1.24 -3.79 117.12 120.67 2i2d n MET 29 Ca -0.05 0.07 -0.30 0.00 0.00 0.00 0.00 57.70 57.42 2i2d n MET 29 Cb 0.48 -0.22 -0.15 0.00 0.00 0.00 0.00 33.22 33.33 2i2d n MET 29 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 175.97 174.14 2i2d s GLU 30 N -1.96 1.93 0.00 0.03 -1.05 -1.05 -4.72 118.70 111.88 2i2d s GLU 30 Ca 0.00 -1.04 -0.30 0.00 -0.15 0.00 0.00 54.97 53.48 2i2d s GLU 30 Cb 0.00 -2.03 -0.05 0.00 -0.44 0.00 0.00 34.13 31.61 2i2d s GLU 30 CO 0.00 0.53 1.22 -0.47 0.95 0.00 0.00 175.26 177.49 2i2d s TYR 31 N -0.78 3.27 -0.25 4.83 6.14 -1.26 -2.07 117.35 127.22 2i2d s TYR 31 Ca 0.12 1.21 -0.03 0.00 0.64 0.00 0.00 57.07 59.00 2i2d s TYR 31 Cb -0.10 -3.45 0.14 0.00 0.42 0.00 0.00 41.96 38.97 2i2d s TYR 31 CO 0.02 -1.42 0.45 0.34 0.64 0.00 0.00 175.55 175.58 2i2d s ASP 32 N 1.33 -0.30 0.00 4.32 3.68 0.71 -4.87 116.67 121.55 2i2d s ASP 32 Ca 0.58 0.56 0.19 0.00 2.13 0.00 0.00 52.55 56.01 2i2d s ASP 32 Cb -0.28 1.47 0.54 0.00 -1.45 0.00 0.00 42.92 43.20 2i2d s ASP 32 CO 0.26 -0.28 1.44 -0.90 0.13 0.00 0.00 175.17 175.82 2i2d n ASP 33 N 5.39 2.53 -0.11 -0.34 5.68 -1.26 -3.02 116.55 125.42 2i2d n ASP 33 Ca -0.04 -1.90 -0.22 0.00 -0.50 0.00 0.00 54.79 52.13 2i2d n ASP 33 Cb 0.50 -0.23 -0.11 0.00 -1.14 0.00 0.00 41.12 40.14 2i2d n ASP 33 CO 0.00 0.00 0.00 0.52 -1.33 0.00 0.00 177.20 176.39 2i2d n VAL 34 N 0.88 1.53 -3.19 2.12 0.31 -1.26 -4.77 118.33 113.95 2i2d n VAL 34 Ca 0.17 -0.06 -0.24 0.00 -0.01 0.00 0.00 64.34 64.21 2i2d n VAL 34 Cb 0.44 -2.04 -0.06 0.00 -0.91 0.00 0.00 33.84 31.27 2i2d n VAL 34 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 2i2d n GLU 35 N -4.42 1.69 -1.94 5.55 4.71 -1.26 -5.12 120.64 119.85 2i2d n GLU 35 Ca -0.34 -3.92 -0.33 0.00 -0.01 0.00 0.00 57.16 52.56 2i2d n GLU 35 Cb 0.69 -1.78 0.03 0.00 -1.01 0.00 0.00 31.44 29.36 2i2d n GLU 35 CO 0.00 0.00 0.00 -1.25 0.09 0.00 0.00 177.13 175.97 2i2d s PRO 36 N -2.26 3.10 -0.03 3.49 0.04 -1.17 -4.83 135.00 133.35 2i2d s PRO 36 Ca 0.40 1.32 0.20 0.00 0.04 0.00 0.00 61.00 62.96 2i2d s PRO 36 Cb 0.24 -2.00 -0.31 0.00 0.04 0.00 0.00 34.50 32.47 2i2d s PRO 36 CO -0.09 -1.00 0.45 0.39 0.04 0.00 0.00 177.00 176.79 2i2d n GLU 37 N -2.12 0.60 -4.58 4.56 1.02 -0.30 -4.62 120.64 115.21 2i2d n GLU 37 Ca 0.10 -0.18 -0.27 0.00 -0.02 0.00 0.00 57.16 56.79 2i2d n GLU 37 Cb 0.52 -1.47 -0.17 0.00 -0.02 0.00 0.00 31.44 30.30 2i2d n GLU 37 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 2i2d s ILE 38 N -3.38 1.38 -0.21 -3.67 -1.09 -1.03 -0.62 121.20 112.59 2i2d s ILE 38 Ca -0.07 -0.60 0.01 0.00 -2.23 0.00 0.00 60.65 57.76 2i2d s ILE 38 Cb 0.13 -1.26 0.03 0.00 -1.58 0.00 0.00 42.46 39.78 2i2d s ILE 38 CO 0.83 0.41 -0.16 -0.69 -1.23 0.00 0.00 174.94 174.11 2i2d s VAL 39 N 0.81 2.21 -0.20 2.92 1.01 -0.87 -1.82 120.40 124.46 2i2d s VAL 39 Ca -0.11 -1.12 -0.07 0.00 0.00 0.00 0.00 61.98 60.68 2i2d s VAL 39 Cb -0.16 -2.05 -0.04 0.00 0.00 0.00 0.00 36.38 34.14 2i2d s VAL 39 CO 0.02 0.35 0.05 -0.63 0.00 0.00 0.00 175.10 174.89 2i2d s ILE 40 N 1.25 4.52 -0.19 2.22 1.01 -0.49 -1.04 121.20 128.49 2i2d s ILE 40 Ca 0.01 -0.12 -0.05 0.00 0.00 0.00 0.00 60.65 60.48 2i2d s ILE 40 Cb -0.15 -3.06 -0.03 0.00 0.01 0.00 0.00 42.46 39.23 2i2d s ILE 40 CO -0.10 0.42 0.01 -0.55 0.00 0.00 0.00 174.94 174.72 2i2d s SER 41 N 0.79 5.00 -0.19 3.58 0.15 0.53 -0.77 113.70 122.79 2i2d s SER 41 Ca 0.03 -0.13 -0.00 0.00 0.70 0.00 0.00 55.95 56.55 2i2d s SER 41 Cb -0.14 -1.85 0.01 0.00 -1.71 0.00 0.00 66.02 62.34 2i2d s SER 41 CO 0.02 0.10 -0.17 -0.63 1.20 0.00 0.00 173.24 173.76 2i2d s ILE 42 N 0.80 2.34 0.00 6.45 1.01 -0.52 0.52 121.20 131.80 2i2d s ILE 42 Ca 0.01 -0.85 0.00 0.00 0.00 0.00 0.00 60.65 59.81 2i2d s ILE 42 Cb -0.14 -2.00 0.00 0.00 0.01 0.00 0.00 42.46 40.33 2i2d s ILE 42 CO 0.02 0.51 0.00 0.61 0.00 0.00 0.00 174.94 176.09 2i2d n GLY 43 N 4.66 0.18 0.00 6.18 0.00 -0.40 -0.74 105.19 115.07 2i2d n GLY 43 Ca -0.20 -0.65 0.00 0.00 0.00 0.00 0.00 46.02 45.17 2i2d n GLY 43 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2i2d n GLY 44 N 0.00 5.07 0.19 -0.02 0.00 -1.26 -2.13 105.19 107.04 2i2d n GLY 44 Ca 0.00 -2.07 -0.07 0.00 0.00 0.00 0.00 46.02 43.88 2i2d n GLY 44 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 2i2d h ASP 45 N 0.00 0.42 -0.66 1.61 3.32 -1.98 -2.02 116.42 117.11 2i2d h ASP 45 Ca 0.00 -0.24 0.04 0.00 0.02 0.00 0.00 57.03 56.85 2i2d h ASP 45 Cb 0.00 -0.12 -0.05 0.00 0.22 0.00 0.00 39.33 39.38 2i2d h ASP 45 CO 0.00 0.91 0.40 1.23 -1.72 0.00 0.00 179.24 180.06 2i2d h GLY 46 N 1.28 0.96 1.00 2.75 0.00 -1.98 0.26 103.07 107.33 2i2d h GLY 46 Ca -0.00 -0.29 0.00 0.00 0.00 0.00 0.00 47.33 47.04 2i2d h GLY 46 CO 0.10 0.23 0.33 -0.84 0.00 0.00 0.00 176.54 176.35 2i2d h THR 47 N 0.76 1.14 -0.48 4.70 2.02 -1.90 -1.37 112.91 117.78 2i2d h THR 47 Ca 0.28 -0.29 -0.03 0.00 0.77 0.00 0.00 66.41 67.14 2i2d h THR 47 Cb 0.08 0.41 -0.02 0.00 -1.74 0.00 0.00 68.15 66.87 2i2d h THR 47 CO -0.13 0.14 0.19 0.15 0.37 0.00 0.00 175.52 176.24 2i2d h PHE 48 N 0.70 0.73 -0.73 3.16 3.57 -0.93 -1.64 116.94 121.80 2i2d h PHE 48 Ca 0.19 -0.06 0.06 0.00 3.53 0.00 0.00 57.97 61.69 2i2d h PHE 48 Cb -0.05 -0.22 -0.06 0.00 2.79 0.00 0.00 35.95 38.41 2i2d h PHE 48 CO -0.03 0.62 0.43 -0.07 -2.23 0.00 0.00 178.31 177.03 2i2d h LEU 49 N 0.63 0.66 -0.82 0.59 -0.00 -0.28 -0.91 115.31 115.18 2i2d h LEU 49 Ca 0.16 0.02 -0.02 0.00 -0.00 0.00 0.00 57.88 58.05 2i2d h LEU 49 Cb 0.20 -0.11 -0.04 0.00 -0.00 0.00 0.00 40.66 40.71 2i2d h LEU 49 CO -0.01 0.42 0.44 0.28 -0.00 0.00 0.00 178.44 179.57 2i2d h SER 50 N 0.79 1.03 -0.34 -0.43 0.02 -1.05 -1.67 113.55 111.90 2i2d h SER 50 Ca 0.32 -0.10 -0.01 0.00 -0.84 0.00 0.00 61.79 61.16 2i2d h SER 50 Cb 0.17 -0.26 -0.02 0.00 0.14 0.00 0.00 62.40 62.43 2i2d h SER 50 CO -0.17 0.84 0.17 0.00 -1.14 0.00 0.00 176.83 176.52 2i2d h ALA 51 N 1.23 0.44 -0.39 3.77 0.00 -0.81 0.33 119.26 123.84 2i2d h ALA 51 Ca 0.29 -0.09 0.05 0.00 0.00 0.00 0.00 54.91 55.16 2i2d h ALA 51 Cb 0.04 -0.14 -0.05 0.00 0.00 0.00 0.00 17.79 17.65 2i2d h ALA 51 CO -0.04 -0.01 0.11 0.35 0.00 0.00 0.00 179.25 179.66 2i2d h PHE 52 N 0.42 0.20 0.00 0.00 3.57 -0.99 -2.82 116.94 117.31 2i2d h PHE 52 Ca 0.12 0.02 -0.04 0.00 3.53 0.00 0.00 57.97 61.59 2i2d h PHE 52 Cb 0.10 -0.03 -0.01 0.00 2.79 0.00 0.00 35.95 38.80 2i2d h PHE 52 CO -0.02 0.06 -0.21 0.45 -2.23 0.00 0.00 178.31 176.36 2i2d h HIS 53 N 0.26 0.00 -0.61 0.41 3.86 -1.09 -2.37 115.15 115.60 2i2d h HIS 53 Ca 0.18 0.00 -0.03 0.00 -1.16 0.00 0.00 60.37 59.36 2i2d h HIS 53 Cb 0.19 0.00 -0.03 0.00 1.06 0.00 0.00 27.41 28.63 2i2d h HIS 53 CO -0.17 0.21 0.26 0.37 0.86 0.00 0.00 177.93 179.47 2i2d h GLN 54 N 0.00 0.90 -0.43 2.45 4.15 -0.71 -3.33 115.11 118.14 2i2d h GLN 54 Ca -0.00 -0.15 -0.28 0.00 0.77 0.00 0.00 58.65 58.99 2i2d h GLN 54 Cb 0.95 -0.15 -0.18 0.00 0.21 0.00 0.00 27.48 28.30 2i2d h GLN 54 CO 0.03 0.75 -0.29 0.66 -1.93 0.00 0.00 178.83 178.05 2i2d n TYR 55 N -4.47 1.45 0.26 3.99 4.01 -1.03 -4.74 117.16 116.64 2i2d n TYR 55 Ca 0.04 -1.87 0.16 0.00 -0.16 0.00 0.00 57.90 56.07 2i2d n TYR 55 Cb 0.15 -0.48 0.56 0.00 -0.31 0.00 0.00 39.34 39.27 2i2d n TYR 55 CO 0.00 0.00 0.00 1.05 -0.46 0.00 0.00 176.86 177.45 2i2d h GLU 56 N 1.39 0.00 0.00 -0.72 4.11 -1.56 -1.40 114.58 116.41 2i2d h GLU 56 Ca 0.24 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.67 2i2d h GLU 56 Cb 1.42 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.67 2i2d h GLU 56 CO 0.50 0.02 0.00 0.39 0.07 0.00 0.00 179.01 179.98 2i2d n GLU 57 N -3.11 0.05 -0.60 1.06 4.71 -1.26 -3.94 120.64 117.55 2i2d n GLU 57 Ca 0.01 0.11 0.06 0.00 -0.01 0.00 0.00 57.16 57.33 2i2d n GLU 57 Cb 0.36 -1.50 0.14 0.00 -1.01 0.00 0.00 31.44 29.43 2i2d n GLU 57 CO 0.00 0.00 0.00 0.54 0.09 0.00 0.00 177.13 177.76 2i2d n ARG 58 N -1.47 1.08 0.06 3.49 1.74 -0.53 -4.86 116.66 116.18 2i2d n ARG 58 Ca 0.06 -2.67 -0.01 0.00 -0.77 0.00 0.00 57.85 54.47 2i2d n ARG 58 Cb 0.25 -1.20 0.27 0.00 -1.02 0.00 0.00 32.46 30.76 2i2d n ARG 58 CO 0.00 0.00 0.00 -0.07 -1.52 0.00 0.00 177.63 176.04 2i2d h LEU 59 N 0.64 0.36 -1.34 0.55 3.38 -1.67 -1.91 115.31 115.31 2i2d h LEU 59 Ca -0.04 -0.11 -0.03 0.00 0.09 0.00 0.00 57.88 57.79 2i2d h LEU 59 Cb 1.19 -0.10 -0.00 0.00 0.09 0.00 0.00 40.66 41.84 2i2d h LEU 59 CO 0.02 0.59 -0.15 -0.78 0.09 0.00 0.00 178.44 178.21 2i2d h ASP 60 N 0.33 0.00 0.23 -0.43 3.58 -1.89 -3.19 116.42 115.04 2i2d h ASP 60 Ca 0.05 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.50 2i2d h ASP 60 Cb 0.58 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.63 2i2d h ASP 60 CO 0.04 0.15 -1.08 -0.62 -2.88 0.00 0.00 179.24 174.85 2i2d n GLU 61 N -3.34 0.19 -4.74 0.28 4.71 -0.76 -4.98 120.64 112.01 2i2d n GLU 61 Ca -0.00 -0.03 -0.33 0.00 -0.01 0.00 0.00 57.16 56.79 2i2d n GLU 61 Cb 0.37 -1.54 -0.12 0.00 -1.01 0.00 0.00 31.44 29.13 2i2d n GLU 61 CO 0.00 0.00 0.00 0.42 0.09 0.00 0.00 177.13 177.64 2i2d s ILE 62 N -3.14 3.39 -0.24 -3.67 1.01 -0.98 -4.54 121.20 113.03 2i2d s ILE 62 Ca 0.05 -0.59 -0.06 0.00 0.00 0.00 0.00 60.65 60.05 2i2d s ILE 62 Cb 0.15 -2.37 -0.02 0.00 0.01 0.00 0.00 42.46 40.23 2i2d s ILE 62 CO 0.83 0.58 0.02 0.00 0.00 0.00 0.00 174.94 176.38 2i2d s ALA 63 N -0.62 3.02 0.20 9.38 0.00 0.21 -4.29 121.76 129.67 2i2d s ALA 63 Ca 0.09 -1.14 -0.14 0.00 0.00 0.00 0.00 51.96 50.77 2i2d s ALA 63 Cb -0.11 -1.92 -0.08 0.00 0.00 0.00 0.00 23.12 21.01 2i2d s ALA 63 CO 0.01 -0.45 0.61 -0.06 0.00 0.00 0.00 175.76 175.87 2i2d s PHE 64 N 1.54 3.54 -0.00 0.00 0.08 -0.10 -2.06 117.98 120.99 2i2d s PHE 64 Ca 0.06 1.10 0.01 0.00 0.12 0.00 0.00 56.93 58.22 2i2d s PHE 64 Cb -0.15 -2.41 -0.00 0.00 -0.57 0.00 0.00 43.02 39.88 2i2d s PHE 64 CO 0.01 0.33 -0.04 0.42 -0.10 0.00 0.00 175.22 175.84 2i2d s ILE 65 N -1.63 0.30 -0.08 0.64 1.09 -0.20 -1.51 121.20 119.81 2i2d s ILE 65 Ca 0.43 -0.21 0.04 0.00 -1.10 0.00 0.00 60.65 59.81 2i2d s ILE 65 Cb -0.14 -0.26 -0.01 0.00 -1.06 0.00 0.00 42.46 40.99 2i2d s ILE 65 CO 0.20 0.05 -0.21 -0.83 -0.10 0.00 0.00 174.94 174.05 2i2d s GLY 66 N -0.17 1.39 -0.13 6.18 0.00 -1.24 -0.35 107.32 113.00 2i2d s GLY 66 Ca 0.01 -0.99 -0.02 0.00 0.00 0.00 0.00 44.72 43.71 2i2d s GLY 66 CO -0.00 -0.53 -0.06 -0.42 0.00 0.00 0.00 173.10 172.09 2i2d s ILE 67 N -0.08 3.70 -0.31 0.90 1.01 0.19 -2.43 121.20 124.18 2i2d s ILE 67 Ca -0.05 -0.44 -0.10 0.00 0.00 0.00 0.00 60.65 60.06 2i2d s ILE 67 Cb -0.14 -2.59 -0.02 0.00 0.01 0.00 0.00 42.46 39.72 2i2d s ILE 67 CO 0.04 0.52 0.17 -1.38 0.00 0.00 0.00 174.94 174.30 2i2d s HIS 68 N 0.11 3.19 -0.32 3.97 -3.43 -0.16 -1.28 115.29 117.37 2i2d s HIS 68 Ca -0.02 -0.35 0.14 0.00 -0.80 0.00 0.00 55.06 54.03 2i2d s HIS 68 Cb -0.14 -2.38 0.79 0.00 -1.43 0.00 0.00 32.58 29.42 2i2d s HIS 68 CO 0.03 -0.37 1.70 0.25 -2.00 0.00 0.00 174.74 174.35 2i2d n THR 69 N 5.02 2.62 0.00 -5.38 -2.24 -0.90 -4.13 114.28 109.27 2i2d n THR 69 Ca -0.14 -1.33 0.00 0.00 -2.27 0.00 0.00 64.05 60.31 2i2d n THR 69 Cb 0.50 -0.27 0.00 0.00 -2.10 0.00 0.00 70.33 68.46 2i2d n THR 69 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2i2d n GLY 73 N 0.63 2.77 0.09 3.38 0.00 -1.26 -5.02 105.19 105.77 2i2d n GLY 73 Ca 0.27 0.03 -0.04 0.00 0.00 0.00 0.00 46.02 46.27 2i2d n GLY 73 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 173.32 174.06 2i2d h PHE 74 N 0.00 0.00 0.00 1.61 -1.00 -1.98 -3.34 116.94 112.23 2i2d h PHE 74 Ca 0.00 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.78 2i2d h PHE 74 Cb 0.00 0.00 0.00 0.00 3.61 0.00 0.00 35.95 39.56 2i2d h PHE 74 CO 0.00 0.81 -1.10 0.66 -1.61 0.00 0.00 178.31 177.08 2i2d n TYR 75 N -3.17 0.26 -2.89 -0.55 4.01 -1.26 -4.82 117.16 108.74 2i2d n TYR 75 Ca -0.05 0.07 -0.19 0.00 -0.16 0.00 0.00 57.90 57.57 2i2d n TYR 75 Cb 0.90 -0.43 0.04 0.00 -0.31 0.00 0.00 39.34 39.54 2i2d n TYR 75 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 2i2d s ALA 76 N -3.22 4.34 0.00 -0.72 0.00 -1.25 -3.63 121.76 117.29 2i2d s ALA 76 Ca 0.03 -1.72 0.00 0.00 0.00 0.00 0.00 51.96 50.27 2i2d s ALA 76 Cb 0.14 -1.73 0.00 0.00 0.00 0.00 0.00 23.12 21.53 2i2d s ALA 76 CO 0.81 -0.66 0.00 -0.25 0.00 0.00 0.00 175.76 175.66 2i2d n ASP 77 N -2.17 0.00 -3.93 0.00 8.00 -1.26 -4.67 116.55 112.53 2i2d n ASP 77 Ca 0.11 0.00 -0.17 0.00 0.71 0.00 0.00 54.79 55.44 2i2d n ASP 77 Cb 0.60 0.00 -0.15 0.00 -0.02 0.00 0.00 41.12 41.55 2i2d n ASP 77 CO 0.00 0.00 0.00 0.26 -0.39 0.00 0.00 177.20 177.07 2i2d s TRP 78 N 0.00 0.53 0.56 1.24 0.52 -1.02 -5.02 118.94 115.75 2i2d s TRP 78 Ca 0.00 -0.11 -0.15 0.00 0.02 0.00 0.00 56.10 55.87 2i2d s TRP 78 Cb 0.00 -0.41 -0.06 0.00 -1.15 0.00 0.00 33.47 31.85 2i2d s TRP 78 CO 0.00 -0.07 1.01 1.03 0.02 0.00 0.00 176.95 178.94 2i2d s ARG 79 N 0.26 3.73 0.61 4.98 0.52 -1.26 -0.99 118.95 126.80 2i2d s ARG 79 Ca -0.03 0.93 0.35 0.00 -0.52 0.00 0.00 55.73 56.46 2i2d s ARG 79 Cb -0.07 -2.10 1.98 0.00 0.52 0.00 0.00 34.95 35.28 2i2d s ARG 79 CO -0.00 -0.46 2.27 -1.35 0.02 0.00 0.00 175.30 175.78 2i2d h PRO 80 N 0.46 0.00 0.00 3.54 0.11 -1.96 -1.91 132.00 132.24 2i2d h PRO 80 Ca -0.46 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.65 2i2d h PRO 80 Cb 1.19 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.30 2i2d h PRO 80 CO 0.61 0.02 0.00 0.00 -0.21 0.00 0.00 178.00 178.41 2i2d h ALA 81 N 1.98 1.00 -0.11 -0.75 0.00 -1.95 -3.16 119.26 116.27 2i2d h ALA 81 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2i2d h ALA 81 Cb 0.06 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.85 2i2d h ALA 81 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 179.25 179.64 2i2d n GLU 82 N -2.72 1.59 -0.37 0.00 1.02 -0.72 -4.48 120.64 114.97 2i2d n GLU 82 Ca 0.04 -0.88 -0.02 0.00 -0.02 0.00 0.00 57.16 56.28 2i2d n GLU 82 Cb 0.46 -1.40 0.12 0.00 -0.02 0.00 0.00 31.44 30.60 2i2d n GLU 82 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2i2d h ALA 83 N 4.03 1.29 -0.56 0.62 0.00 -1.65 -1.96 119.26 121.03 2i2d h ALA 83 Ca 0.00 -0.07 -0.10 0.00 0.00 0.00 0.00 54.91 54.74 2i2d h ALA 83 Cb 0.40 -0.40 -0.02 0.00 0.00 0.00 0.00 17.79 17.77 2i2d h ALA 83 CO 0.00 0.66 -0.04 -0.44 0.00 0.00 0.00 179.25 179.43 2i2d h ASP 84 N 1.35 0.98 -0.33 0.00 3.32 -1.87 -1.55 116.42 118.33 2i2d h ASP 84 Ca 0.37 -0.29 -0.07 0.00 0.02 0.00 0.00 57.03 57.05 2i2d h ASP 84 Cb -0.16 -0.27 -0.02 0.00 0.22 0.00 0.00 39.33 39.11 2i2d h ASP 84 CO -0.08 1.06 -0.04 0.11 -1.72 0.00 0.00 179.24 178.57 2i2d h LYS 85 N 0.91 0.71 -0.44 3.56 6.56 -1.79 -2.81 116.57 123.28 2i2d h LYS 85 Ca 0.16 -0.20 -0.04 0.00 -1.06 0.00 0.00 60.65 59.51 2i2d h LYS 85 Cb 0.59 -0.08 -0.02 0.00 -0.57 0.00 0.00 32.23 32.15 2i2d h LYS 85 CO 0.04 0.76 0.14 1.25 -2.06 0.00 0.00 179.45 179.57 2i2d h LEU 86 N 0.66 0.64 -0.12 2.94 5.85 -0.95 -1.38 115.31 122.95 2i2d h LEU 86 Ca 0.13 -0.21 0.04 0.00 0.84 0.00 0.00 57.88 58.68 2i2d h LEU 86 Cb 0.48 -0.17 -0.05 0.00 0.37 0.00 0.00 40.66 41.29 2i2d h LEU 86 CO 0.02 0.68 -0.16 0.58 -0.34 0.00 0.00 178.44 179.22 2i2d h VAL 87 N 0.57 0.58 0.37 1.05 2.07 -1.16 -0.20 116.25 119.53 2i2d h VAL 87 Ca 0.14 0.00 -0.02 0.00 0.82 0.00 0.00 66.70 67.64 2i2d h VAL 87 Cb 0.27 0.58 0.00 0.00 -1.52 0.00 0.00 31.29 30.62 2i2d h VAL 87 CO -0.00 0.00 -0.18 0.11 0.02 0.00 0.00 177.57 177.52 2i2d h LYS 88 N -0.21 -0.48 -0.69 1.57 6.56 -1.44 0.14 116.57 122.03 2i2d h LYS 88 Ca 0.09 0.03 0.05 0.00 -1.06 0.00 0.00 60.65 59.76 2i2d h LYS 88 Cb 0.34 0.11 -0.05 0.00 -0.57 0.00 0.00 32.23 32.05 2i2d h LYS 88 CO -0.24 -0.26 0.41 -0.07 -2.06 0.00 0.00 179.45 177.23 2i2d h LEU 89 N -0.60 0.63 -0.86 2.94 3.38 -1.21 0.37 115.31 119.96 2i2d h LEU 89 Ca -0.05 0.02 -0.09 0.00 0.09 0.00 0.00 57.88 57.84 2i2d h LEU 89 Cb 0.44 -0.11 -0.02 0.00 0.09 0.00 0.00 40.66 41.06 2i2d h LEU 89 CO 0.08 0.42 -0.17 0.25 0.09 0.00 0.00 178.44 179.11 2i2d h LEU 90 N 0.77 0.65 -0.33 1.67 6.46 -0.94 -1.99 115.31 121.59 2i2d h LEU 90 Ca 0.30 -0.21 -0.07 0.00 -0.12 0.00 0.00 57.88 57.78 2i2d h LEU 90 Cb 0.13 -0.18 -0.01 0.00 -0.73 0.00 0.00 40.66 39.87 2i2d h LEU 90 CO -0.15 0.83 -0.07 0.00 -0.62 0.00 0.00 178.44 178.43 2i2d h ALA 91 N 1.22 0.45 0.00 1.25 0.00 0.24 -3.13 119.26 119.30 2i2d h ALA 91 Ca 0.09 -0.29 0.00 0.00 0.00 0.00 0.00 54.91 54.72 2i2d h ALA 91 Cb 0.62 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.30 2i2d h ALA 91 CO 0.04 0.28 0.00 0.36 0.00 0.00 0.00 179.25 179.93 2i2d n LYS 92 N -4.45 0.78 -2.96 0.00 2.85 0.03 -4.90 118.16 109.50 2i2d n LYS 92 Ca -0.02 0.01 -0.20 0.00 -1.05 0.00 0.00 58.31 57.05 2i2d n LYS 92 Cb 0.32 -1.50 0.03 0.00 -0.65 0.00 0.00 35.03 33.24 2i2d n LYS 92 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 2i2d n GLY 93 N 0.89 -0.36 2.56 2.58 0.00 -0.97 -4.92 105.19 104.98 2i2d n GLY 93 Ca 0.20 0.02 -0.33 0.00 0.00 0.00 0.00 46.02 45.91 2i2d n GLY 93 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2i2d n GLU 94 N -3.67 3.19 -3.88 1.61 1.02 -0.79 -4.91 120.64 113.21 2i2d n GLU 94 Ca -0.09 -2.95 -0.11 0.00 -0.02 0.00 0.00 57.16 53.99 2i2d n GLU 94 Cb 0.60 -2.30 -0.11 0.00 -0.02 0.00 0.00 31.44 29.61 2i2d n GLU 94 CO 0.00 0.00 0.00 1.52 1.18 0.00 0.00 177.13 179.83 2i2d s TYR 95 N -2.11 0.04 0.19 -0.32 -0.85 -1.26 -4.49 117.35 108.54 2i2d s TYR 95 Ca 0.55 -0.07 0.05 0.00 -0.52 0.00 0.00 57.07 57.09 2i2d s TYR 95 Cb 0.33 -0.05 -0.04 0.00 0.38 0.00 0.00 41.96 42.59 2i2d s TYR 95 CO -0.21 -0.16 0.17 1.14 -1.52 0.00 0.00 175.55 174.97 2i2d s GLN 96 N -0.80 2.97 -0.09 -3.49 1.03 -0.44 -4.93 119.66 113.91 2i2d s GLN 96 Ca -0.09 -0.90 -0.03 0.00 0.04 0.00 0.00 55.36 54.38 2i2d s GLN 96 Cb -0.05 -2.65 -0.03 0.00 0.03 0.00 0.00 33.01 30.30 2i2d s GLN 96 CO 0.00 0.46 0.04 0.15 -2.54 0.00 0.00 175.29 173.40 2i2d s LYS 97 N -3.37 3.08 -0.00 9.60 1.02 -1.26 -2.52 119.74 126.29 2i2d s LYS 97 Ca 0.32 -0.35 0.08 0.00 0.02 0.00 0.00 55.97 56.04 2i2d s LYS 97 Cb -0.09 -2.88 -0.02 0.00 -0.52 0.00 0.00 37.83 34.31 2i2d s LYS 97 CO 0.24 0.72 -0.26 0.08 -0.92 0.00 0.00 175.35 175.22 2i2d s VAL 98 N -0.93 2.12 -0.07 3.17 1.01 -0.72 -4.96 120.40 120.02 2i2d s VAL 98 Ca 0.14 -1.17 0.04 0.00 0.00 0.00 0.00 61.98 60.99 2i2d s VAL 98 Cb -0.11 -1.76 -0.02 0.00 0.00 0.00 0.00 36.38 34.49 2i2d s VAL 98 CO 0.03 0.52 -0.17 -0.44 0.00 0.00 0.00 175.10 175.04 2i2d s SER 99 N -0.79 3.76 0.07 3.32 0.01 -1.26 0.27 113.70 119.07 2i2d s SER 99 Ca 0.11 -0.31 0.07 0.00 1.31 0.00 0.00 55.95 57.13 2i2d s SER 99 Cb -0.10 -0.97 -0.04 0.00 0.21 0.00 0.00 66.02 65.13 2i2d s SER 99 CO -0.00 0.29 -0.15 -0.31 0.41 0.00 0.00 173.24 173.48 2i2d s TYR 100 N -0.38 2.63 0.63 2.43 1.51 -0.47 -4.82 117.35 118.88 2i2d s TYR 100 Ca 0.04 -0.21 -0.15 0.00 -1.01 0.00 0.00 57.07 55.73 2i2d s TYR 100 Cb -0.12 -1.45 -0.01 0.00 -0.11 0.00 0.00 41.96 40.26 2i2d s TYR 100 CO 0.02 0.33 1.09 -2.14 -1.11 0.00 0.00 175.55 173.75 2i2d s PRO 101 N -1.76 3.00 0.24 -1.71 0.02 -1.26 -1.92 135.00 131.62 2i2d s PRO 101 Ca 0.17 1.32 0.06 0.00 0.02 0.00 0.00 61.00 62.58 2i2d s PRO 101 Cb -0.11 -1.98 -0.05 0.00 0.02 0.00 0.00 34.50 32.38 2i2d s PRO 101 CO 0.08 -1.08 -0.08 -0.51 -0.33 0.00 0.00 177.00 175.08 2i2d s LEU 102 N -4.72 2.46 -0.16 -5.54 1.43 -1.25 -4.68 118.68 106.21 2i2d s LEU 102 Ca 0.66 -1.14 -0.04 0.00 -1.03 0.00 0.00 54.13 52.57 2i2d s LEU 102 Cb -0.19 -0.57 -0.03 0.00 0.03 0.00 0.00 46.19 45.43 2i2d s LEU 102 CO 0.40 -0.32 -0.02 -0.22 0.23 0.00 0.00 176.35 176.42 2i2d s LEU 103 N -3.37 3.35 -0.17 1.79 2.96 -0.95 -0.69 118.68 121.61 2i2d s LEU 103 Ca 0.27 -0.10 -0.17 0.00 -0.22 0.00 0.00 54.13 53.91 2i2d s LEU 103 Cb 0.03 -1.82 -0.04 0.00 0.50 0.00 0.00 46.19 44.86 2i2d s LEU 103 CO 0.09 0.16 0.46 -0.75 -1.32 0.00 0.00 176.35 175.00 2i2d s LYS 104 N 0.40 4.25 -0.15 1.98 2.20 0.25 -1.44 119.74 127.23 2i2d s LYS 104 Ca -0.03 0.36 -0.04 0.00 -0.36 0.00 0.00 55.97 55.90 2i2d s LYS 104 Cb -0.14 -3.50 -0.03 0.00 -1.51 0.00 0.00 37.83 32.65 2i2d s LYS 104 CO 0.02 0.02 -0.04 0.99 -0.36 0.00 0.00 175.35 175.98 2i2d s THR 105 N 1.10 3.86 -0.14 3.43 2.01 -0.29 -2.19 115.64 123.42 2i2d s THR 105 Ca 0.23 -0.37 0.02 0.00 0.31 0.00 0.00 61.69 61.88 2i2d s THR 105 Cb -0.15 -2.69 0.00 0.00 0.01 0.00 0.00 72.50 69.68 2i2d s THR 105 CO 0.09 0.50 -0.19 -0.89 -0.69 0.00 0.00 174.62 173.43 2i2d s THR 106 N 0.34 2.31 -0.25 -0.82 2.01 0.44 -1.11 115.64 118.56 2i2d s THR 106 Ca -0.04 -0.90 -0.04 0.00 0.31 0.00 0.00 61.69 61.02 2i2d s THR 106 Cb -0.14 -1.94 0.00 0.00 0.01 0.00 0.00 72.50 70.43 2i2d s THR 106 CO 0.03 0.54 0.00 -0.69 -0.69 0.00 0.00 174.62 173.81 2i2d s VAL 107 N 0.78 3.50 -0.03 3.82 1.01 0.12 -0.12 120.40 129.48 2i2d s VAL 107 Ca -0.07 -0.67 -0.02 0.00 0.00 0.00 0.00 61.98 61.22 2i2d s VAL 107 Cb -0.16 -2.72 -0.04 0.00 0.00 0.00 0.00 36.38 33.47 2i2d s VAL 107 CO -0.00 0.25 0.08 -0.54 0.00 0.00 0.00 175.10 174.88 2i2d s LYS 108 N 1.46 3.12 0.00 2.72 1.02 -0.17 -0.20 119.74 127.68 2i2d s LYS 108 Ca 0.03 -0.42 0.00 0.00 0.02 0.00 0.00 55.97 55.61 2i2d s LYS 108 Cb -0.16 -2.90 0.00 0.00 -0.52 0.00 0.00 37.83 34.25 2i2d s LYS 108 CO -0.01 0.68 0.00 0.66 -0.92 0.00 0.00 175.35 175.75 2i2d n TYR 109 N 1.45 0.00 -4.07 3.18 4.01 -1.26 -0.69 117.16 119.78 2i2d n TYR 109 Ca -0.15 0.00 -0.23 0.00 -0.16 0.00 0.00 57.90 57.36 2i2d n TYR 109 Cb 0.53 0.01 -0.17 0.00 -0.31 0.00 0.00 39.34 39.40 2i2d n TYR 109 CO 0.00 0.00 0.00 -2.00 -0.46 0.00 0.00 176.86 174.40 2i2d s GLU 115 N -1.98 1.05 -0.02 -0.72 2.12 -1.26 -4.71 118.70 113.17 2i2d s GLU 115 Ca 0.00 -0.13 0.06 0.00 0.36 0.00 0.00 54.97 55.26 2i2d s GLU 115 Cb 0.00 -1.12 -0.02 0.00 0.26 0.00 0.00 34.13 33.25 2i2d s GLU 115 CO 0.00 -0.16 -0.20 0.00 -0.54 0.00 0.00 175.26 174.36 2i2d s ALA 116 N 1.31 2.42 -0.05 6.30 0.00 0.72 -4.97 121.76 127.49 2i2d s ALA 116 Ca -0.04 -1.07 0.04 0.00 0.00 0.00 0.00 51.96 50.89 2i2d s ALA 116 Cb -0.14 -0.74 -0.00 0.00 0.00 0.00 0.00 23.12 22.24 2i2d s ALA 116 CO -0.02 0.55 -0.18 0.99 0.00 0.00 0.00 175.76 177.09 2i2d s THR 117 N -0.70 1.55 0.04 0.00 2.01 -1.26 0.15 115.64 117.43 2i2d s THR 117 Ca 0.11 -0.77 0.03 0.00 0.31 0.00 0.00 61.69 61.37 2i2d s THR 117 Cb -0.10 -1.34 -0.02 0.00 0.01 0.00 0.00 72.50 71.05 2i2d s THR 117 CO 0.00 0.44 -0.09 -0.31 -0.69 0.00 0.00 174.62 173.98 2i2d s TYR 118 N 0.12 0.78 -0.12 4.92 2.02 -0.27 -5.00 117.35 119.81 2i2d s TYR 118 Ca -0.07 -0.40 -0.03 0.00 -0.37 0.00 0.00 57.07 56.20 2i2d s TYR 118 Cb -0.13 -0.47 -0.03 0.00 -0.40 0.00 0.00 41.96 40.93 2i2d s TYR 118 CO 0.03 -0.04 -0.01 -0.51 -1.57 0.00 0.00 175.55 173.46 2i2d s LEU 119 N -1.29 3.48 0.04 -1.29 1.43 -1.26 -1.14 118.68 118.65 2i2d s LEU 119 Ca -0.05 0.04 0.07 0.00 -1.03 0.00 0.00 54.13 53.16 2i2d s LEU 119 Cb -0.08 -1.82 -0.03 0.00 0.03 0.00 0.00 46.19 44.29 2i2d s LEU 119 CO 0.01 0.28 -0.20 0.00 0.23 0.00 0.00 176.35 176.67 2i2d s ALA 120 N -0.31 2.52 -0.20 4.21 0.00 -0.52 -4.90 121.76 122.56 2i2d s ALA 120 Ca 0.06 -1.20 0.13 0.00 0.00 0.00 0.00 51.96 50.96 2i2d s ALA 120 Cb -0.12 -0.69 -0.21 0.00 0.00 0.00 0.00 23.12 22.09 2i2d s ALA 120 CO 0.02 0.56 0.00 -0.11 0.00 0.00 0.00 175.76 176.24 2i2d n LEU 121 N 1.65 0.66 -0.01 0.00 7.94 -1.26 -2.23 117.00 123.76 2i2d n LEU 121 Ca -0.16 -0.03 -0.01 0.00 -1.11 0.00 0.00 56.01 54.70 2i2d n LEU 121 Cb 0.52 0.17 -0.00 0.00 0.53 0.00 0.00 43.42 44.64 2i2d n LEU 121 CO 0.26 0.56 -0.05 0.59 -1.11 0.00 0.00 177.39 177.64 2i2d n ASN 122 N -2.80 0.14 -3.68 1.96 3.02 -1.26 -3.80 115.26 108.84 2i2d n ASN 122 Ca -0.33 0.07 -0.05 0.00 -0.03 0.00 0.00 54.58 54.24 2i2d n ASN 122 Cb 1.07 -0.52 -0.02 0.00 -0.61 0.00 0.00 39.78 39.71 2i2d n ASN 122 CO 0.00 0.00 0.00 -1.83 -2.62 0.00 0.00 177.26 172.81 2i2d s GLU 123 N -1.14 1.09 -0.04 3.52 1.03 -1.26 -1.77 118.70 120.14 2i2d s GLU 123 Ca -0.02 -0.56 0.04 0.00 0.03 0.00 0.00 54.97 54.46 2i2d s GLU 123 Cb 0.00 0.40 -0.00 0.00 -0.80 0.00 0.00 34.13 33.73 2i2d s GLU 123 CO 0.03 -0.49 -0.15 0.45 -1.33 0.00 0.00 175.26 173.76 2i2d s SER 124 N -2.82 1.96 0.21 0.83 0.15 -0.00 -0.30 113.70 113.73 2i2d s SER 124 Ca 0.10 -0.32 0.09 0.00 0.70 0.00 0.00 55.95 56.52 2i2d s SER 124 Cb -0.01 -0.53 -0.05 0.00 -1.71 0.00 0.00 66.02 63.72 2i2d s SER 124 CO -0.01 0.14 -0.17 0.42 1.20 0.00 0.00 173.24 174.81 2i2d s THR 125 N 0.06 1.95 -0.07 6.45 -4.23 -0.62 -0.62 115.64 118.57 2i2d s THR 125 Ca -0.03 -2.18 0.02 0.00 -1.18 0.00 0.00 61.69 58.32 2i2d s THR 125 Cb -0.11 -2.05 0.02 0.00 1.34 0.00 0.00 72.50 71.70 2i2d s THR 125 CO 0.02 -0.46 -0.10 -0.69 -0.54 0.00 0.00 174.62 172.84 2i2d s VAL 126 N -2.58 1.01 0.36 2.29 1.01 -0.47 -1.05 120.40 120.96 2i2d s VAL 126 Ca 0.22 -0.38 0.03 0.00 0.00 0.00 0.00 61.98 61.86 2i2d s VAL 126 Cb -0.03 -0.95 -0.04 0.00 0.00 0.00 0.00 36.38 35.36 2i2d s VAL 126 CO 0.09 0.33 0.12 -0.54 0.00 0.00 0.00 175.10 175.10 2i2d s LYS 127 N 0.88 1.77 0.52 2.72 1.02 -0.46 -1.48 119.74 124.71 2i2d s LYS 127 Ca -0.11 -2.04 -0.01 0.00 0.02 0.00 0.00 55.97 53.83 2i2d s LYS 127 Cb -0.15 -0.55 0.01 0.00 -0.52 0.00 0.00 37.83 36.63 2i2d s LYS 127 CO 0.01 -0.39 0.77 -1.54 -0.92 0.00 0.00 175.35 173.27 2i2d s SER 128 N -3.51 5.60 0.40 2.83 1.04 -1.26 -1.27 113.70 117.52 2i2d s SER 128 Ca 0.30 0.33 0.28 0.00 0.48 0.00 0.00 55.95 57.34 2i2d s SER 128 Cb 0.05 -1.40 1.01 0.00 0.10 0.00 0.00 66.02 65.77 2i2d s SER 128 CO 0.15 -0.93 1.82 0.77 0.98 0.00 0.00 173.24 176.03 2i2d h SER 129 N 0.14 0.00 0.00 7.02 4.64 -1.90 -3.38 113.55 120.07 2i2d h SER 129 Ca -0.45 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.87 2i2d h SER 129 Cb 1.27 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.36 2i2d h SER 129 CO 0.57 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 177.14 2i2d n GLY 130 N 0.38 0.72 0.39 -0.77 0.00 -1.26 -5.05 105.19 99.60 2i2d n GLY 130 Ca 0.02 -0.71 0.00 0.00 0.00 0.00 0.00 46.02 45.34 2i2d n GLY 130 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2i2d n GLY 131 N 0.00 -0.55 3.76 -0.02 0.00 -1.26 -5.17 105.19 101.95 2i2d n GLY 131 Ca 0.00 -0.79 -0.41 0.00 0.00 0.00 0.00 46.02 44.82 2i2d n GLY 131 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2i2d s PRO 132 N -0.90 4.46 -0.30 1.61 0.04 -1.26 -4.76 135.00 133.90 2i2d s PRO 132 Ca 0.00 2.03 -0.16 0.00 0.04 0.00 0.00 61.00 62.91 2i2d s PRO 132 Cb 0.00 -3.15 -0.02 0.00 0.04 0.00 0.00 34.50 31.37 2i2d s PRO 132 CO 0.00 -0.06 0.40 0.12 0.04 0.00 0.00 177.00 177.49 2i2d s PHE 133 N -0.81 3.22 -0.07 0.56 5.36 -1.24 -4.90 117.98 120.11 2i2d s PHE 133 Ca 0.49 0.26 -0.01 0.00 -0.96 0.00 0.00 56.93 56.71 2i2d s PHE 133 Cb -0.36 -2.67 0.03 0.00 -0.34 0.00 0.00 43.02 39.68 2i2d s PHE 133 CO 0.45 -0.34 0.01 0.08 -1.46 0.00 0.00 175.22 173.95 2i2d s VAL 134 N 2.12 0.33 0.07 3.12 1.01 -1.26 -2.40 120.40 123.39 2i2d s VAL 134 Ca 0.15 0.15 0.01 0.00 0.00 0.00 0.00 61.98 62.29 2i2d s VAL 134 Cb -0.16 -0.50 -0.03 0.00 0.00 0.00 0.00 36.38 35.69 2i2d s VAL 134 CO 0.11 0.25 -0.06 0.68 0.00 0.00 0.00 175.10 176.08 2i2d s VAL 135 N 1.96 0.51 -0.18 2.92 -7.23 -0.66 -3.34 120.40 114.38 2i2d s VAL 135 Ca 0.05 -1.59 -0.16 0.00 -1.81 0.00 0.00 61.98 58.47 2i2d s VAL 135 Cb -0.12 -1.23 -0.04 0.00 0.56 0.00 0.00 36.38 35.54 2i2d s VAL 135 CO -0.05 -0.73 0.38 -1.81 -0.31 0.00 0.00 175.10 172.58 2i2d s ASP 136 N -2.48 6.46 -0.30 4.85 -0.00 0.14 -0.05 116.67 125.30 2i2d s ASP 136 Ca 0.02 0.55 -0.15 0.00 -0.00 0.00 0.00 52.55 52.97 2i2d s ASP 136 Cb 0.00 -2.23 -0.03 0.00 -0.00 0.00 0.00 42.92 40.67 2i2d s ASP 136 CO -0.04 -0.02 0.37 -0.69 -0.00 0.00 0.00 175.17 174.78 2i2d s VAL 137 N 1.02 5.17 -0.24 -1.27 1.01 0.93 -1.61 120.40 125.42 2i2d s VAL 137 Ca 0.19 0.37 0.01 0.00 0.00 0.00 0.00 61.98 62.55 2i2d s VAL 137 Cb -0.14 -3.74 0.04 0.00 0.00 0.00 0.00 36.38 32.54 2i2d s VAL 137 CO 0.07 0.06 -0.11 -0.69 0.00 0.00 0.00 175.10 174.44 2i2d s VAL 138 N 2.06 2.41 -0.25 2.92 1.01 0.24 -0.14 120.40 128.64 2i2d s VAL 138 Ca 0.14 -1.31 -0.10 0.00 0.00 0.00 0.00 61.98 60.71 2i2d s VAL 138 Cb -0.16 -2.28 -0.04 0.00 0.00 0.00 0.00 36.38 33.90 2i2d s VAL 138 CO 0.11 0.14 0.14 -0.63 0.00 0.00 0.00 175.10 174.86 2i2d s ILE 139 N 1.21 4.98 -1.52 2.22 1.01 0.09 -0.20 121.20 129.00 2i2d s ILE 139 Ca -0.03 0.05 -0.06 0.00 0.00 0.00 0.00 60.65 60.62 2i2d s ILE 139 Cb -0.18 -3.34 0.05 0.00 0.01 0.00 0.00 42.46 39.00 2i2d s ILE 139 CO -0.06 0.31 0.45 0.59 0.00 0.00 0.00 174.94 176.23 2i2d n ASN 140 N 4.74 -0.94 0.00 3.58 3.02 -0.09 -0.59 115.26 124.98 2i2d n ASN 140 Ca -0.15 -1.06 0.00 0.00 -0.03 0.00 0.00 54.58 53.34 2i2d n ASN 140 Cb 0.52 -2.69 0.00 0.00 -0.61 0.00 0.00 39.78 37.00 2i2d n ASN 140 CO 0.00 0.00 0.00 0.47 -2.62 0.00 0.00 177.26 175.11 2i2d n ASP 141 N -2.87 0.00 -4.71 6.41 8.00 -1.26 -5.00 116.55 117.13 2i2d n ASP 141 Ca -0.20 0.00 -0.39 0.00 0.71 0.00 0.00 54.79 54.91 2i2d n ASP 141 Cb 0.63 -0.37 -0.05 0.00 -0.02 0.00 0.00 41.12 41.31 2i2d n ASP 141 CO 0.00 0.00 0.00 0.27 -0.39 0.00 0.00 177.20 177.08 2i2d s ILE 142 N -2.24 5.07 -0.24 0.53 -4.36 0.24 -5.02 121.20 115.18 2i2d s ILE 142 Ca 0.00 1.32 -0.29 0.00 -0.26 0.00 0.00 60.65 61.42 2i2d s ILE 142 Cb 0.00 -3.99 -0.02 0.00 1.25 0.00 0.00 42.46 39.70 2i2d s ILE 142 CO 0.00 0.24 1.63 -1.00 0.24 0.00 0.00 174.94 176.05 2i2d s HIS 143 N 0.97 2.07 -0.22 1.37 3.76 -1.26 -0.73 115.29 121.25 2i2d s HIS 143 Ca 0.34 0.55 -0.11 0.00 -0.15 0.00 0.00 55.06 55.69 2i2d s HIS 143 Cb -0.17 -4.01 -0.18 0.00 1.11 0.00 0.00 32.58 29.33 2i2d s HIS 143 CO 0.15 -2.93 -0.01 0.34 -0.85 0.00 0.00 174.74 171.44 2i2d n PHE 144 N 8.66 0.56 -3.54 1.40 7.35 0.80 -4.96 117.46 127.73 2i2d n PHE 144 Ca 0.19 0.18 -0.11 0.00 -0.76 0.00 0.00 57.45 56.95 2i2d n PHE 144 Cb 0.45 -1.06 -0.04 0.00 0.35 0.00 0.00 39.48 39.18 2i2d n PHE 144 CO 0.00 0.00 0.00 -1.83 -0.76 0.00 0.00 176.76 174.17 2i2d s GLU 145 N -2.49 0.78 -0.36 -4.13 -1.05 -1.16 -5.01 118.70 105.28 2i2d s GLU 145 Ca -0.32 -0.00 -0.15 0.00 -0.15 0.00 0.00 54.97 54.35 2i2d s GLU 145 Cb 0.09 0.36 -0.00 0.00 -0.44 0.00 0.00 34.13 34.14 2i2d s GLU 145 CO 0.61 -0.28 0.34 0.50 0.95 0.00 0.00 175.26 177.38 2i2d s ARG 146 N -1.88 3.40 -0.20 -4.83 3.52 -1.26 -0.05 118.95 117.66 2i2d s ARG 146 Ca -0.01 -0.59 -0.21 0.00 -0.13 0.00 0.00 55.73 54.79 2i2d s ARG 146 Cb -0.01 -3.85 -0.03 0.00 -1.56 0.00 0.00 34.95 29.51 2i2d s ARG 146 CO -0.01 -0.59 0.62 0.12 -0.81 0.00 0.00 175.30 174.63 2i2d s PHE 147 N 1.94 3.37 -0.11 5.12 2.19 0.93 -4.62 117.98 126.81 2i2d s PHE 147 Ca 0.10 0.91 0.04 0.00 0.33 0.00 0.00 56.93 58.31 2i2d s PHE 147 Cb -0.17 -2.79 0.00 0.00 -1.31 0.00 0.00 43.02 38.75 2i2d s PHE 147 CO 0.12 -0.18 -0.23 1.03 1.83 0.00 0.00 175.22 177.79 2i2d s ARG 148 N 1.93 2.98 0.00 10.12 0.52 -1.26 -1.66 118.95 131.58 2i2d s ARG 148 Ca 0.28 -0.85 0.00 0.00 -0.52 0.00 0.00 55.73 54.64 2i2d s ARG 148 Cb -0.16 -2.30 0.00 0.00 0.52 0.00 0.00 34.95 33.02 2i2d s ARG 148 CO 0.10 0.12 0.00 0.41 0.02 0.00 0.00 175.30 175.95 2i2d n GLY 149 N 3.68 -0.59 0.08 -3.53 0.00 -1.01 -0.83 105.19 102.99 2i2d n GLY 149 Ca -0.19 -0.67 -0.09 0.00 0.00 0.00 0.00 46.02 45.06 2i2d n GLY 149 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 2i2d h ASP 150 N 0.00 0.07 0.00 1.61 3.32 -1.22 -3.27 116.42 116.93 2i2d h ASP 150 Ca 0.00 -0.10 0.00 0.00 0.02 0.00 0.00 57.03 56.95 2i2d h ASP 150 Cb 0.00 -0.02 0.00 0.00 0.22 0.00 0.00 39.33 39.53 2i2d h ASP 150 CO 0.00 1.09 0.00 0.61 -1.72 0.00 0.00 179.24 179.22 2i2d n GLY 151 N 1.50 -2.08 3.13 2.75 0.00 -1.22 -4.33 105.19 104.93 2i2d n GLY 151 Ca -0.10 -1.23 -0.17 0.00 0.00 0.00 0.00 46.02 44.52 2i2d n GLY 151 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2i2d s LEU 152 N 0.00 2.25 -0.08 0.99 1.43 -0.55 -1.11 118.68 121.61 2i2d s LEU 152 Ca 0.00 -0.56 0.03 0.00 -1.03 0.00 0.00 54.13 52.57 2i2d s LEU 152 Cb 0.00 -0.41 0.01 0.00 0.03 0.00 0.00 46.19 45.82 2i2d s LEU 152 CO 0.00 -0.10 -0.16 0.00 0.23 0.00 0.00 176.35 176.33 2i2d s MET 154 N 0.66 3.17 0.04 0.00 1.75 0.21 -0.79 119.30 124.33 2i2d s MET 154 Ca -0.14 -0.75 0.08 0.00 -1.25 0.00 0.00 55.69 53.63 2i2d s MET 154 Cb -0.16 -2.69 -0.03 0.00 2.84 0.00 0.00 34.83 34.79 2i2d s MET 154 CO 0.04 -0.11 -0.22 0.45 -0.65 0.00 0.00 175.02 174.53 2i2d s SER 155 N 1.12 3.48 0.82 1.11 0.15 0.17 -0.82 113.70 119.73 2i2d s SER 155 Ca 0.01 -0.51 -0.12 0.00 0.70 0.00 0.00 55.95 56.03 2i2d s SER 155 Cb -0.14 -0.45 0.09 0.00 -1.71 0.00 0.00 66.02 63.80 2i2d s SER 155 CO -0.05 0.26 1.13 0.42 1.20 0.00 0.00 173.24 176.20 2i2d s THR 156 N -0.86 2.56 0.22 6.45 -4.23 -0.73 -1.08 115.64 117.98 2i2d s THR 156 Ca 0.13 0.18 -0.09 0.00 -1.18 0.00 0.00 61.69 60.74 2i2d s THR 156 Cb -0.10 -3.02 0.18 0.00 1.34 0.00 0.00 72.50 70.89 2i2d s THR 156 CO 0.03 -0.24 1.87 -0.65 -0.54 0.00 0.00 174.62 175.10 2i2d h PRO 157 N -1.15 0.98 0.00 3.99 0.11 -1.84 -2.37 132.00 131.73 2i2d h PRO 157 Ca -0.48 -0.06 -0.04 0.00 0.11 0.00 0.00 66.00 65.54 2i2d h PRO 157 Cb 1.30 -0.22 -0.01 0.00 0.11 0.00 0.00 31.00 32.18 2i2d h PRO 157 CO 0.62 0.65 -0.17 0.66 -0.21 0.00 0.00 178.00 179.55 2i2d h SER 158 N 1.01 0.00 0.78 -2.05 4.64 -1.83 -2.57 113.55 113.54 2i2d h SER 158 Ca 0.31 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.63 2i2d h SER 158 Cb -0.02 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.07 2i2d h SER 158 CO -0.10 0.17 0.00 0.61 -0.87 0.00 0.00 176.83 176.64 2i2d n GLY 159 N 0.41 -1.27 0.27 -0.77 0.00 -0.93 -3.80 105.19 99.10 2i2d n GLY 159 Ca 0.01 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.18 2i2d n GLY 159 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 2i2d h THR 160 N 0.00 0.44 -0.00 2.61 1.35 -1.09 -1.25 112.91 114.98 2i2d h THR 160 Ca 0.00 -0.46 0.00 0.00 -0.55 0.00 0.00 66.41 65.40 2i2d h THR 160 Cb 0.39 1.32 0.00 0.00 -1.73 0.00 0.00 68.15 68.13 2i2d h THR 160 CO 0.00 0.09 -0.03 0.35 -0.25 0.00 0.00 175.52 175.68 2i2d n THR 161 N -3.53 0.00 0.00 6.82 -2.24 -1.25 -2.10 114.28 111.98 2i2d n THR 161 Ca -0.02 -0.02 0.00 0.00 -2.27 0.00 0.00 64.05 61.74 2i2d n THR 161 Cb 0.22 -0.36 0.00 0.00 -2.10 0.00 0.00 70.33 68.10 2i2d n THR 161 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2i2d n ALA 162 N -1.10 0.00 -0.19 6.98 0.00 -0.47 -4.66 120.51 121.06 2i2d n ALA 162 Ca 0.16 0.00 -0.01 0.00 0.00 0.00 0.00 53.44 53.60 2i2d n ALA 162 Cb 0.23 0.00 0.07 0.00 0.00 0.00 0.00 19.45 19.75 2i2d n ALA 162 CO 0.00 0.00 0.00 -0.92 0.00 0.00 0.00 177.50 176.58 2i2d h TYR 163 N 0.00 -0.18 -0.98 0.00 3.20 -1.88 -0.40 116.97 116.74 2i2d h TYR 163 Ca 0.00 0.05 0.25 0.00 3.14 0.00 0.00 58.73 62.17 2i2d h TYR 163 Cb 0.00 0.17 -0.18 0.00 1.54 0.00 0.00 36.73 38.26 2i2d h TYR 163 CO 0.00 -0.21 -0.03 -0.97 -1.64 0.00 0.00 178.16 175.31 2i2d h ASN 164 N 0.05 -0.57 -0.29 -2.11 -1.24 -1.80 -1.80 115.58 107.83 2i2d h ASN 164 Ca 0.29 0.28 0.00 0.00 0.71 0.00 0.00 56.30 57.59 2i2d h ASN 164 Cb 0.46 0.51 -0.01 0.00 0.73 0.00 0.00 38.32 40.01 2i2d h ASN 164 CO -0.56 -0.34 0.19 0.50 -1.29 0.00 0.00 177.43 175.93 2i2d h LYS 165 N 0.01 0.38 0.00 6.67 3.64 -0.51 -0.48 116.57 126.29 2i2d h LYS 165 Ca 0.56 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.92 2i2d h LYS 165 Cb 1.10 -0.08 0.00 0.00 -0.41 0.00 0.00 32.23 32.83 2i2d h LYS 165 CO -0.93 0.26 0.00 0.77 -2.27 0.00 0.00 179.45 177.28 2i2d h SER 166 N 0.38 0.00 -0.51 4.20 0.02 -1.25 -2.05 113.55 114.35 2i2d h SER 166 Ca 0.10 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.05 2i2d h SER 166 Cb -0.03 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.51 2i2d h SER 166 CO -0.02 0.00 0.00 0.18 -1.14 0.00 0.00 176.83 175.85 2i2d n LEU 167 N -2.86 3.24 0.00 5.07 4.77 -0.73 -4.92 117.00 121.58 2i2d n LEU 167 Ca -0.01 -1.53 0.00 0.00 -0.03 0.00 0.00 56.01 54.44 2i2d n LEU 167 Cb 0.14 -0.33 0.00 0.00 -2.33 0.00 0.00 43.42 40.89 2i2d n LEU 167 CO 0.20 0.76 0.00 0.61 -1.33 0.00 0.00 177.39 177.63 2i2d n GLY 168 N 1.47 0.75 3.71 -0.72 0.00 -0.77 -4.78 105.19 104.85 2i2d n GLY 168 Ca 0.20 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.90 2i2d n GLY 168 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2i2d s GLY 169 N -1.71 1.88 0.44 -0.02 0.00 -0.27 -4.90 107.32 102.74 2i2d s GLY 169 Ca 0.00 0.61 -0.21 0.00 0.00 0.00 0.00 44.72 45.11 2i2d s GLY 169 CO 0.00 1.00 0.99 0.00 0.00 0.00 0.00 173.10 175.10 2i2d s ALA 170 N -2.51 2.99 -0.20 3.20 0.00 -1.26 -4.59 121.76 119.39 2i2d s ALA 170 Ca 0.68 0.51 -0.21 0.00 0.00 0.00 0.00 51.96 52.94 2i2d s ALA 170 Cb -0.23 -3.20 -0.02 0.00 0.00 0.00 0.00 23.12 19.66 2i2d s ALA 170 CO 0.54 -0.06 0.62 -0.51 0.00 0.00 0.00 175.76 176.35 2i2d s LEU 171 N -3.18 4.14 -0.10 0.00 1.43 -1.26 -4.83 118.68 114.88 2i2d s LEU 171 Ca 0.63 0.82 0.00 0.00 -1.03 0.00 0.00 54.13 54.55 2i2d s LEU 171 Cb -0.13 -2.88 -0.03 0.00 0.03 0.00 0.00 46.19 43.18 2i2d s LEU 171 CO 0.17 -0.27 -0.09 -0.04 0.23 0.00 0.00 176.35 176.35 2i2d s MET 172 N 1.93 3.05 0.20 1.70 -1.94 -1.26 -5.09 119.30 117.90 2i2d s MET 172 Ca 0.28 -0.59 -0.32 0.00 -1.71 0.00 0.00 55.69 53.35 2i2d s MET 172 Cb -0.16 -2.64 -0.12 0.00 2.01 0.00 0.00 34.83 33.93 2i2d s MET 172 CO 0.10 0.47 1.73 -1.58 -0.01 0.00 0.00 175.02 175.73 2i2d s HIS 173 N -0.29 2.83 -1.39 -0.03 2.46 -1.26 -4.59 115.29 113.02 2i2d s HIS 173 Ca 0.04 0.31 0.15 0.00 0.47 0.00 0.00 55.06 56.03 2i2d s HIS 173 Cb -0.13 -4.14 0.74 0.00 -0.13 0.00 0.00 32.58 28.93 2i2d s HIS 173 CO 0.03 -4.34 1.42 -0.35 -2.47 0.00 0.00 174.74 169.02 2i2d n PRO 174 N 4.17 0.19 0.01 2.88 -0.04 -1.26 -1.62 135.00 139.33 2i2d n PRO 174 Ca 0.16 0.15 0.09 0.00 -0.04 0.00 0.00 63.50 63.86 2i2d n PRO 174 Cb 0.36 -1.50 0.38 0.00 -0.04 0.00 0.00 33.50 32.70 2i2d n PRO 174 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 2i2d n SER 175 N -1.31 0.03 -4.65 3.54 3.41 -1.26 -4.27 113.62 109.12 2i2d n SER 175 Ca 0.07 0.51 -0.40 0.00 -0.26 0.00 0.00 58.87 58.79 2i2d n SER 175 Cb 0.12 -0.51 -0.06 0.00 -0.26 0.00 0.00 64.21 63.50 2i2d n SER 175 CO 0.00 0.00 0.00 -0.63 -0.16 0.00 0.00 175.04 174.25 2i2d s ILE 176 N -3.01 5.04 -0.90 -1.33 1.01 -0.64 -4.99 121.20 116.39 2i2d s ILE 176 Ca 0.08 1.07 -0.21 0.00 0.00 0.00 0.00 60.65 61.59 2i2d s ILE 176 Cb 0.11 -3.90 0.09 0.00 0.01 0.00 0.00 42.46 38.78 2i2d s ILE 176 CO 0.33 0.11 1.21 -1.61 0.00 0.00 0.00 174.94 174.98 2i2d s GLU 177 N 2.00 3.48 0.28 2.79 2.02 -1.26 -4.77 118.70 123.25 2i2d s GLU 177 Ca 0.26 -1.29 -0.14 0.00 0.02 0.00 0.00 54.97 53.82 2i2d s GLU 177 Cb -0.16 -4.89 0.01 0.00 0.10 0.00 0.00 34.13 29.20 2i2d s GLU 177 CO 0.10 -1.95 0.58 0.00 0.02 0.00 0.00 175.26 174.01 2i2d s ALA 178 N 3.86 -0.41 0.03 5.21 0.00 -1.26 -2.89 121.76 126.29 2i2d s ALA 178 Ca 0.35 -0.81 -0.01 0.00 0.00 0.00 0.00 51.96 51.50 2i2d s ALA 178 Cb -0.06 0.98 -0.02 0.00 0.00 0.00 0.00 23.12 24.02 2i2d s ALA 178 CO -0.05 -0.91 -0.02 0.00 0.00 0.00 0.00 175.76 174.79 2i2d s MET 179 N -3.65 0.39 -0.07 0.00 0.23 -0.60 -4.19 119.30 111.40 2i2d s MET 179 Ca 0.20 -0.72 0.02 0.00 -1.03 0.00 0.00 55.69 54.16 2i2d s MET 179 Cb -0.02 0.14 0.01 0.00 -1.53 0.00 0.00 34.83 33.42 2i2d s MET 179 CO 0.10 -0.07 -0.13 -1.14 -2.03 0.00 0.00 175.02 171.75 2i2d s GLN 180 N -1.97 1.81 -0.20 3.16 0.74 -0.24 -0.40 119.66 122.56 2i2d s GLN 180 Ca -0.11 -0.45 -0.06 0.00 0.05 0.00 0.00 55.36 54.79 2i2d s GLN 180 Cb -0.06 -1.48 -0.03 0.00 1.10 0.00 0.00 33.01 32.53 2i2d s GLN 180 CO -0.03 0.04 0.03 -1.17 -0.55 0.00 0.00 175.29 173.61 2i2d s LEU 181 N 0.65 3.46 0.19 3.68 2.96 0.13 -0.65 118.68 129.09 2i2d s LEU 181 Ca -0.15 -0.12 0.10 0.00 -0.22 0.00 0.00 54.13 53.74 2i2d s LEU 181 Cb -0.16 -1.89 -0.04 0.00 0.50 0.00 0.00 46.19 44.60 2i2d s LEU 181 CO 0.04 0.08 -0.17 0.42 -1.32 0.00 0.00 176.35 175.39 2i2d s THR 182 N 0.94 2.74 0.12 3.68 -4.23 0.03 -0.95 115.64 117.98 2i2d s THR 182 Ca 0.02 -1.86 -0.12 0.00 -1.18 0.00 0.00 61.69 58.56 2i2d s THR 182 Cb -0.14 -2.34 -0.06 0.00 1.34 0.00 0.00 72.50 71.30 2i2d s THR 182 CO 0.02 -0.11 0.48 -1.61 -0.54 0.00 0.00 174.62 172.86 2i2d s GLU 183 N -2.74 3.87 -0.27 3.99 2.02 -1.26 -1.42 118.70 122.89 2i2d s GLU 183 Ca 0.23 0.33 -0.06 0.00 0.02 0.00 0.00 54.97 55.49 2i2d s GLU 183 Cb -0.08 -2.94 0.00 0.00 0.10 0.00 0.00 34.13 31.21 2i2d s GLU 183 CO 0.12 0.50 0.03 -1.64 0.02 0.00 0.00 175.26 174.30 2i2d s MET 184 N -2.01 3.21 -0.78 1.61 -1.94 -0.26 -4.84 119.30 114.28 2i2d s MET 184 Ca 0.37 -0.76 -0.03 0.00 -1.71 0.00 0.00 55.69 53.55 2i2d s MET 184 Cb -0.14 -3.24 0.00 0.00 2.01 0.00 0.00 34.83 33.46 2i2d s MET 184 CO 0.19 -0.34 0.55 0.00 -0.01 0.00 0.00 175.02 175.41 2i2d n ALA 185 N 4.84 -2.63 -1.76 3.03 0.00 -1.26 -1.71 120.51 121.01 2i2d n ALA 185 Ca -0.16 -0.28 -0.39 0.00 0.00 0.00 0.00 53.44 52.61 2i2d n ALA 185 Cb 0.49 -0.77 -0.06 0.00 0.00 0.00 0.00 19.45 19.11 2i2d n ALA 185 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 2i2d s SER 186 N -2.97 7.49 -0.07 0.00 1.04 -1.26 -2.97 113.70 114.95 2i2d s SER 186 Ca 0.04 1.94 -0.29 0.00 0.48 0.00 0.00 55.95 58.12 2i2d s SER 186 Cb -0.02 -2.60 -0.02 0.00 0.10 0.00 0.00 66.02 63.48 2i2d s SER 186 CO 0.82 0.04 0.98 -0.63 0.98 0.00 0.00 173.24 175.42 2i2d s ILE 187 N -1.34 4.83 -0.08 -1.02 1.01 -0.01 -4.96 121.20 119.62 2i2d s ILE 187 Ca 0.45 2.00 -0.00 0.00 0.00 0.00 0.00 60.65 63.10 2i2d s ILE 187 Cb -0.24 -4.29 0.02 0.00 0.01 0.00 0.00 42.46 37.96 2i2d s ILE 187 CO 0.30 0.07 -0.05 0.20 0.00 0.00 0.00 174.94 175.45 2i2d s ASN 188 N 1.06 1.71 0.00 3.58 0.01 -1.26 -4.33 114.94 115.71 2i2d s ASN 188 Ca 0.49 -0.20 0.00 0.00 -0.71 0.00 0.00 52.86 52.43 2i2d s ASN 188 Cb -0.19 -0.64 0.00 0.00 0.41 0.00 0.00 41.25 40.83 2i2d s ASN 188 CO 0.21 -0.11 0.00 -0.46 -1.51 0.00 0.00 177.10 175.23 2i2d n ASN 189 N 4.69 0.03 0.28 -1.22 0.23 0.17 -4.96 115.26 114.48 2i2d n ASN 189 Ca -0.14 -0.13 0.16 0.00 -0.53 0.00 0.00 54.58 53.93 2i2d n ASN 189 Cb 0.50 0.00 0.77 0.00 -2.08 0.00 0.00 39.78 38.97 2i2d n ASN 189 CO 0.00 0.00 0.00 0.08 -0.93 0.00 0.00 177.26 176.41 2i2d h ARG 190 N 0.00 0.00 0.00 -3.83 -0.00 -2.06 -3.31 114.38 105.18 2i2d h ARG 190 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 59.98 59.98 2i2d h ARG 190 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 29.97 29.97 2i2d h ARG 190 CO 0.00 0.07 -0.20 -0.24 -0.00 0.00 0.00 179.97 179.59 2i2d h VAL 191 N 0.00 0.00 -3.09 0.08 3.04 -2.01 -3.48 116.25 110.79 2i2d h VAL 191 Ca -0.00 -0.45 -0.60 0.00 -1.01 0.00 0.00 66.70 64.63 2i2d h VAL 191 Cb 0.40 0.00 -0.07 0.00 -2.01 0.00 0.00 31.29 29.61 2i2d h VAL 191 CO 0.01 0.00 -0.22 -0.31 -1.01 0.00 0.00 177.57 176.03 2i2d s TYR 192 N -1.53 3.64 -0.09 3.17 2.02 -1.25 -5.08 117.35 118.24 2i2d s TYR 192 Ca -0.06 0.89 -0.04 0.00 -0.37 0.00 0.00 57.07 57.49 2i2d s TYR 192 Cb 0.01 -2.33 0.05 0.00 -0.40 0.00 0.00 41.96 39.29 2i2d s TYR 192 CO 0.09 0.50 0.17 1.03 -1.57 0.00 0.00 175.55 175.77 2i2d s ARG 193 N -0.53 0.06 0.41 -0.62 0.52 -1.26 -0.66 118.95 116.87 2i2d s ARG 193 Ca 0.23 0.56 0.07 0.00 -0.52 0.00 0.00 55.73 56.07 2i2d s ARG 193 Cb -0.16 -0.22 -0.08 0.00 0.52 0.00 0.00 34.95 35.01 2i2d s ARG 193 CO 0.11 -0.28 0.02 0.95 0.02 0.00 0.00 175.30 176.12 2i2d s THR 194 N 2.11 2.03 0.42 0.02 -4.23 -1.26 -4.48 115.64 110.24 2i2d s THR 194 Ca 0.01 -1.99 0.13 0.00 -1.18 0.00 0.00 61.69 58.66 2i2d s THR 194 Cb -0.12 -2.99 0.15 0.00 1.34 0.00 0.00 72.50 70.89 2i2d s THR 194 CO -0.06 -0.01 1.93 -0.29 -0.54 0.00 0.00 174.62 175.65 2i2d h ILE 195 N 1.76 1.18 -5.16 2.99 6.09 -1.97 -3.47 117.51 118.94 2i2d h ILE 195 Ca -0.44 -0.84 -0.41 0.00 -1.37 0.00 0.00 64.86 61.81 2i2d h ILE 195 Cb 1.24 1.42 0.09 0.00 0.47 0.00 0.00 36.82 40.04 2i2d h ILE 195 CO 0.80 0.24 -0.64 0.61 -3.07 0.00 0.00 178.15 176.09 2i2d n GLY 196 N -0.83 -0.53 3.53 8.18 0.00 -1.26 -4.97 105.19 109.31 2i2d n GLY 196 Ca -0.02 0.19 -0.13 0.00 0.00 0.00 0.00 46.02 46.06 2i2d n GLY 196 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2i2d s SER 197 N -2.99 -0.67 0.55 1.61 0.01 -1.26 -5.12 113.70 105.84 2i2d s SER 197 Ca 0.44 1.27 -0.21 0.00 1.31 0.00 0.00 55.95 58.76 2i2d s SER 197 Cb -0.20 1.27 -0.05 0.00 0.21 0.00 0.00 66.02 67.25 2i2d s SER 197 CO 0.55 -0.22 1.27 -2.65 0.41 0.00 0.00 173.24 172.60 2i2d n PRO 198 N 2.93 1.50 -4.89 12.44 -0.02 -1.26 -4.86 135.00 140.84 2i2d n PRO 198 Ca -0.15 0.56 -0.32 0.00 -2.02 0.00 0.00 63.50 61.57 2i2d n PRO 198 Cb 0.56 -2.47 -0.16 0.00 -0.02 0.00 0.00 33.50 31.40 2i2d n PRO 198 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 2i2d s LEU 199 N -3.08 2.20 -0.23 2.45 1.43 -0.12 -4.95 118.68 116.37 2i2d s LEU 199 Ca 0.73 -0.55 -0.06 0.00 -1.03 0.00 0.00 54.13 53.21 2i2d s LEU 199 Cb -0.42 -1.46 -0.03 0.00 0.03 0.00 0.00 46.19 44.31 2i2d s LEU 199 CO 0.49 0.12 0.04 -0.69 0.23 0.00 0.00 176.35 176.54 2i2d s VAL 200 N 0.58 4.15 -0.08 -1.59 1.01 -1.26 0.19 120.40 123.40 2i2d s VAL 200 Ca -0.12 -0.23 0.01 0.00 0.00 0.00 0.00 61.98 61.63 2i2d s VAL 200 Cb -0.17 -2.92 -0.03 0.00 0.00 0.00 0.00 36.38 33.27 2i2d s VAL 200 CO 0.03 0.38 -0.08 -0.36 0.00 0.00 0.00 175.10 175.07 2i2d s PHE 201 N 1.37 2.90 0.95 5.22 0.40 0.47 -4.96 117.98 124.34 2i2d s PHE 201 Ca 0.05 -0.10 -0.15 0.00 -0.60 0.00 0.00 56.93 56.14 2i2d s PHE 201 Cb -0.15 -1.74 0.17 0.00 0.51 0.00 0.00 43.02 41.81 2i2d s PHE 201 CO 0.02 0.22 1.21 -1.25 0.70 0.00 0.00 175.22 176.12 2i2d s PRO 202 N -0.56 0.80 0.45 0.24 0.04 -1.26 -1.56 135.00 133.14 2i2d s PRO 202 Ca 0.08 -0.04 -0.25 0.00 0.04 0.00 0.00 61.00 60.83 2i2d s PRO 202 Cb -0.12 -1.83 -0.08 0.00 0.04 0.00 0.00 34.50 32.51 2i2d s PRO 202 CO 0.02 -2.37 1.43 0.21 0.04 0.00 0.00 177.00 176.33 2i2d s LYS 203 N -5.57 3.68 0.00 4.56 2.20 -1.14 -3.03 119.74 120.43 2i2d s LYS 203 Ca 0.68 2.42 0.00 0.00 -0.36 0.00 0.00 55.97 58.71 2i2d s LYS 203 Cb -0.09 -2.65 0.00 0.00 -1.51 0.00 0.00 37.83 33.57 2i2d s LYS 203 CO 0.53 -0.83 0.00 0.72 -0.36 0.00 0.00 175.35 175.41 2i2d n HIS 204 N -0.20 0.00 -2.57 4.03 8.25 -1.26 -5.02 115.22 118.44 2i2d n HIS 204 Ca 0.05 0.00 -0.40 0.00 -0.26 0.00 0.00 57.72 57.11 2i2d n HIS 204 Cb 0.42 0.00 -0.05 0.00 1.12 0.00 0.00 29.99 31.48 2i2d n HIS 204 CO 0.00 0.00 0.00 -1.01 0.64 0.00 0.00 176.34 175.97 2i2d s HIS 205 N -2.19 3.71 -0.19 4.41 3.76 -1.17 -5.04 115.29 118.58 2i2d s HIS 205 Ca 0.00 1.75 0.01 0.00 -0.15 0.00 0.00 55.06 56.67 2i2d s HIS 205 Cb 0.00 -3.19 0.02 0.00 1.11 0.00 0.00 32.58 30.52 2i2d s HIS 205 CO 0.00 -0.24 -0.17 0.08 -0.85 0.00 0.00 174.74 173.56 2i2d s VAL 206 N -1.01 2.22 -0.24 -0.90 1.01 -1.26 -4.50 120.40 115.72 2i2d s VAL 206 Ca 0.44 -0.94 -0.10 0.00 0.00 0.00 0.00 61.98 61.39 2i2d s VAL 206 Cb -0.30 -1.97 -0.05 0.00 0.00 0.00 0.00 36.38 34.07 2i2d s VAL 206 CO 0.37 0.48 0.14 -0.69 0.00 0.00 0.00 175.10 175.40 2i2d s VAL 207 N 1.30 5.09 -0.12 2.92 1.01 -0.56 -0.91 120.40 129.13 2i2d s VAL 207 Ca 0.04 0.09 0.02 0.00 0.00 0.00 0.00 61.98 62.13 2i2d s VAL 207 Cb -0.14 -3.37 -0.00 0.00 0.00 0.00 0.00 36.38 32.86 2i2d s VAL 207 CO -0.11 0.34 -0.19 -0.55 0.00 0.00 0.00 175.10 174.59 2i2d s SER 208 N 1.17 3.48 -0.14 3.32 0.15 0.73 0.32 113.70 122.72 2i2d s SER 208 Ca 0.06 -0.48 -0.04 0.00 0.70 0.00 0.00 55.95 56.20 2i2d s SER 208 Cb -0.14 -1.50 -0.03 0.00 -1.71 0.00 0.00 66.02 62.64 2i2d s SER 208 CO 0.05 0.14 -0.01 -0.76 1.20 0.00 0.00 173.24 173.86 2i2d s LEU 209 N 0.46 3.43 -0.04 3.45 1.43 0.13 -0.59 118.68 126.96 2i2d s LEU 209 Ca -0.13 -0.03 0.03 0.00 -1.03 0.00 0.00 54.13 52.97 2i2d s LEU 209 Cb -0.17 -1.82 0.00 0.00 0.03 0.00 0.00 46.19 44.23 2i2d s LEU 209 CO 0.05 0.22 -0.13 -1.10 0.23 0.00 0.00 176.35 175.63 2i2d s GLN 210 N 0.07 1.46 0.62 1.70 -0.21 -0.63 -1.28 119.66 121.40 2i2d s GLN 210 Ca 0.01 -0.43 -0.18 0.00 0.02 0.00 0.00 55.36 54.78 2i2d s GLN 210 Cb -0.13 -1.27 -0.02 0.00 1.00 0.00 0.00 33.01 32.58 2i2d s GLN 210 CO 0.02 0.12 1.25 -2.14 -2.12 0.00 0.00 175.29 172.43 2i2d s PRO 211 N 0.31 2.76 -0.21 2.91 0.02 -1.26 -0.68 135.00 138.85 2i2d s PRO 211 Ca -0.07 1.96 0.03 0.00 0.02 0.00 0.00 61.00 62.93 2i2d s PRO 211 Cb -0.12 -1.89 -0.14 0.00 0.02 0.00 0.00 34.50 32.37 2i2d s PRO 211 CO 0.02 -1.41 -0.17 0.28 -0.33 0.00 0.00 177.00 175.40 2i2d n VAL 212 N -1.74 1.21 0.00 3.83 0.31 -1.21 -4.75 118.33 115.97 2i2d n VAL 212 Ca 0.15 -0.48 0.00 0.00 -0.01 0.00 0.00 64.34 63.99 2i2d n VAL 212 Cb 0.49 -1.20 0.00 0.00 -0.91 0.00 0.00 33.84 32.22 2i2d n VAL 212 CO 0.00 0.00 0.00 0.59 -1.32 0.00 0.00 176.83 176.10 2i2d n ASN 213 N -3.08 0.00 -2.86 4.52 5.03 -1.26 -5.05 115.26 112.55 2i2d n ASN 213 Ca -0.37 0.00 -0.01 0.00 0.87 0.00 0.00 54.58 55.07 2i2d n ASN 213 Cb 0.91 0.00 0.00 0.00 -1.02 0.00 0.00 39.78 39.67 2i2d n ASN 213 CO 0.00 0.00 0.00 -0.67 -1.83 0.00 0.00 177.26 174.76 2i2d n ASP 214 N 0.00 -7.62 -0.17 6.41 4.64 -1.26 -5.04 116.55 113.51 2i2d n ASP 214 Ca 0.00 1.10 0.02 0.00 -1.38 0.00 0.00 54.79 54.52 2i2d n ASP 214 Cb 0.00 -4.31 0.03 0.00 -1.04 0.00 0.00 41.12 35.80 2i2d n ASP 214 CO 0.00 0.00 0.00 0.29 -0.82 0.00 0.00 177.20 176.67 2i2d n LYS 215 N 0.79 1.14 -3.46 -0.67 5.02 -1.26 -4.76 118.16 114.97 2i2d n LYS 215 Ca 0.00 -1.17 -0.37 0.00 -2.02 0.00 0.00 58.31 54.75 2i2d n LYS 215 Cb 0.17 -1.08 -0.06 0.00 -0.02 0.00 0.00 35.03 34.04 2i2d n LYS 215 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 2i2d s ASP 216 N -0.63 6.61 -0.02 4.39 1.01 -1.26 -1.47 116.67 125.30 2i2d s ASP 216 Ca 0.06 0.72 -0.01 0.00 0.71 0.00 0.00 52.55 54.03 2i2d s ASP 216 Cb 0.03 -2.23 0.01 0.00 1.01 0.00 0.00 42.92 41.74 2i2d s ASP 216 CO 0.05 0.12 0.04 -0.36 0.21 0.00 0.00 175.17 175.23 2i2d s PHE 217 N 0.14 -0.03 -0.51 4.23 0.08 -0.62 -3.72 117.98 117.54 2i2d s PHE 217 Ca 0.22 0.14 -0.29 0.00 0.12 0.00 0.00 56.93 57.12 2i2d s PHE 217 Cb -0.15 -0.06 0.03 0.00 -0.57 0.00 0.00 43.02 42.28 2i2d s PHE 217 CO 0.08 -0.05 1.17 -1.14 -0.10 0.00 0.00 175.22 175.18 2i2d s GLN 218 N 0.38 3.65 -0.17 0.44 2.00 -0.40 -0.30 119.66 125.26 2i2d s GLN 218 Ca -0.03 0.47 -0.04 0.00 -2.00 0.00 0.00 55.36 53.76 2i2d s GLN 218 Cb -0.04 -3.95 -0.03 0.00 0.80 0.00 0.00 33.01 29.79 2i2d s GLN 218 CO -0.01 -1.49 -0.02 0.42 -0.50 0.00 0.00 175.29 173.69 2i2d s ILE 219 N 4.66 4.04 -0.02 -2.34 1.01 -0.20 -1.36 121.20 126.99 2i2d s ILE 219 Ca 0.47 -0.30 0.02 0.00 0.00 0.00 0.00 60.65 60.83 2i2d s ILE 219 Cb -0.07 -2.79 -0.03 0.00 0.01 0.00 0.00 42.46 39.58 2i2d s ILE 219 CO 0.30 0.48 -0.03 -0.94 0.00 0.00 0.00 174.94 174.75 2i2d s SER 220 N 0.45 4.89 -0.22 3.58 1.04 -0.22 -1.40 113.70 121.83 2i2d s SER 220 Ca -0.02 -0.04 -0.00 0.00 0.48 0.00 0.00 55.95 56.37 2i2d s SER 220 Cb -0.14 -1.24 0.06 0.00 0.10 0.00 0.00 66.02 64.80 2i2d s SER 220 CO 0.02 0.31 -0.03 -0.69 0.98 0.00 0.00 173.24 173.83 2i2d s VAL 221 N -0.99 1.23 0.00 5.02 1.01 0.93 -1.59 120.40 126.01 2i2d s VAL 221 Ca 0.17 -1.01 0.00 0.00 0.00 0.00 0.00 61.98 61.14 2i2d s VAL 221 Cb -0.11 -1.56 0.00 0.00 0.00 0.00 0.00 36.38 34.71 2i2d s VAL 221 CO 0.07 -0.12 0.00 0.47 0.00 0.00 0.00 175.10 175.52 2i2d n ASP 222 N 4.79 0.00 0.12 3.32 8.00 0.59 -1.42 116.55 131.95 2i2d n ASP 222 Ca -0.11 0.00 -0.00 0.00 0.71 0.00 0.00 54.79 55.38 2i2d n ASP 222 Cb 0.45 0.00 0.01 0.00 -0.02 0.00 0.00 41.12 41.56 2i2d n ASP 222 CO 0.00 0.00 0.00 -0.74 -0.39 0.00 0.00 177.20 176.07 2i2d h HIS 223 N 0.00 0.00 -3.41 1.24 2.76 -1.96 -3.46 115.15 110.32 2i2d h HIS 223 Ca 0.00 0.00 -0.52 0.00 -2.20 0.00 0.00 60.37 57.65 2i2d h HIS 223 Cb 0.00 0.00 0.02 0.00 1.55 0.00 0.00 27.41 28.98 2i2d h HIS 223 CO 0.00 0.66 0.57 -1.17 -1.30 0.00 0.00 177.93 176.69 2i2d s LEU 224 N -6.62 4.43 -0.18 0.26 2.96 -0.51 -5.02 118.68 114.01 2i2d s LEU 224 Ca 0.03 2.22 -0.05 0.00 -0.22 0.00 0.00 54.13 56.10 2i2d s LEU 224 Cb 0.09 -3.60 0.06 0.00 0.50 0.00 0.00 46.19 43.24 2i2d s LEU 224 CO 0.76 -0.41 0.09 -0.55 -1.32 0.00 0.00 176.35 174.92 2i2d s SER 225 N 0.33 2.40 0.01 3.68 0.15 -1.26 -0.05 113.70 118.97 2i2d s SER 225 Ca 0.55 -0.64 0.05 0.00 0.70 0.00 0.00 55.95 56.60 2i2d s SER 225 Cb -0.33 -0.25 -0.02 0.00 -1.71 0.00 0.00 66.02 63.72 2i2d s SER 225 CO 0.35 -0.35 -0.14 0.27 1.20 0.00 0.00 173.24 174.57 2i2d s ILE 226 N 2.13 1.14 -0.22 6.45 -4.36 -0.49 -4.97 121.20 120.89 2i2d s ILE 226 Ca 0.02 -0.78 -0.29 0.00 -0.26 0.00 0.00 60.65 59.34 2i2d s ILE 226 Cb -0.16 -0.98 0.00 0.00 1.25 0.00 0.00 42.46 42.57 2i2d s ILE 226 CO -0.10 0.19 1.15 -0.22 0.24 0.00 0.00 174.94 176.19 2i2d s LEU 227 N -0.68 4.11 -0.17 0.37 2.96 -1.26 -1.03 118.68 122.97 2i2d s LEU 227 Ca 0.04 1.47 -0.10 0.00 -0.22 0.00 0.00 54.13 55.32 2i2d s LEU 227 Cb -0.06 -3.54 -0.05 0.00 0.50 0.00 0.00 46.19 43.04 2i2d s LEU 227 CO 0.00 -0.75 0.15 -1.00 -1.32 0.00 0.00 176.35 173.44 2i2d s HIS 228 N 3.42 3.47 0.03 5.38 3.76 0.58 -4.97 115.29 126.96 2i2d s HIS 228 Ca 0.49 0.42 0.03 0.00 -0.15 0.00 0.00 55.06 55.85 2i2d s HIS 228 Cb -0.17 -2.12 -0.04 0.00 1.11 0.00 0.00 32.58 31.36 2i2d s HIS 228 CO 0.11 0.42 -0.02 1.03 -0.85 0.00 0.00 174.74 175.43 2i2d s ARG 229 N -0.05 2.64 -1.27 1.40 0.52 -1.26 -1.58 118.95 119.34 2i2d s ARG 229 Ca 0.11 -0.71 -0.01 0.00 -0.52 0.00 0.00 55.73 54.60 2i2d s ARG 229 Cb -0.12 -2.58 0.00 0.00 0.52 0.00 0.00 34.95 32.78 2i2d s ARG 229 CO 0.01 0.59 0.85 -3.47 0.02 0.00 0.00 175.30 173.29 2i2d n ASP 230 N 1.20 -1.73 -4.73 0.23 2.03 -1.20 -4.97 116.55 107.38 2i2d n ASP 230 Ca -0.14 -0.73 -0.41 0.00 0.52 0.00 0.00 54.79 54.04 2i2d n ASP 230 Cb 0.52 -4.54 -0.04 0.00 -0.72 0.00 0.00 41.12 36.34 2i2d n ASP 230 CO 0.00 0.00 0.00 -0.69 -1.92 0.00 0.00 177.20 174.59 2i2d s VAL 231 N -3.52 4.18 -0.13 5.18 1.01 -0.54 -4.45 120.40 122.13 2i2d s VAL 231 Ca 0.03 1.86 0.16 0.00 0.00 0.00 0.00 61.98 64.02 2i2d s VAL 231 Cb -0.01 -4.19 -0.22 0.00 0.00 0.00 0.00 36.38 31.96 2i2d s VAL 231 CO 0.77 0.31 0.14 0.00 0.00 0.00 0.00 175.10 176.32 2i2d n GLN 232 N 2.55 1.10 -3.64 2.72 0.00 0.13 -4.76 117.38 115.49 2i2d n GLN 232 Ca 0.02 -0.05 -0.10 0.00 0.00 0.00 0.00 57.00 56.88 2i2d n GLN 232 Cb 0.48 -1.43 -0.07 0.00 0.00 0.00 0.00 30.24 29.22 2i2d n GLN 232 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.06 175.06 2i2d s GLU 233 N -2.61 0.62 -0.10 2.61 2.12 -1.18 -4.36 118.70 115.80 2i2d s GLU 233 Ca -0.08 0.78 0.02 0.00 0.36 0.00 0.00 54.97 56.05 2i2d s GLU 233 Cb 0.07 0.28 -0.01 0.00 0.26 0.00 0.00 34.13 34.72 2i2d s GLU 233 CO 0.70 -0.08 -0.18 0.42 -0.54 0.00 0.00 175.26 175.58 2i2d s ILE 234 N 0.47 2.66 -0.09 -3.70 1.01 -0.40 -1.00 121.20 120.14 2i2d s ILE 234 Ca 0.00 -0.82 0.02 0.00 0.00 0.00 0.00 60.65 59.86 2i2d s ILE 234 Cb -0.05 -2.07 0.01 0.00 0.01 0.00 0.00 42.46 40.37 2i2d s ILE 234 CO -0.06 0.55 -0.15 -0.60 0.00 0.00 0.00 174.94 174.69 2i2d s ARG 235 N 0.14 2.08 -0.06 2.79 3.52 0.83 0.22 118.95 128.46 2i2d s ARG 235 Ca -0.09 -0.52 0.04 0.00 -0.13 0.00 0.00 55.73 55.03 2i2d s ARG 235 Cb -0.15 -1.73 -0.02 0.00 -1.56 0.00 0.00 34.95 31.48 2i2d s ARG 235 CO 0.06 -0.01 -0.18 0.71 -0.81 0.00 0.00 175.30 175.06 2i2d s TYR 236 N 0.83 2.61 0.01 5.12 2.02 0.15 -0.42 117.35 127.67 2i2d s TYR 236 Ca -0.10 -0.42 -0.29 0.00 -0.37 0.00 0.00 57.07 55.89 2i2d s TYR 236 Cb -0.15 -1.64 0.07 0.00 -0.40 0.00 0.00 41.96 39.83 2i2d s TYR 236 CO 0.01 -0.01 0.66 -1.83 -1.57 0.00 0.00 175.55 172.81 2i2d s GLU 237 N -0.39 1.12 0.06 -0.62 -1.05 -0.93 -1.49 118.70 115.39 2i2d s GLU 237 Ca 0.04 0.06 -0.30 0.00 -0.15 0.00 0.00 54.97 54.61 2i2d s GLU 237 Cb -0.12 0.52 -0.08 0.00 -0.44 0.00 0.00 34.13 34.01 2i2d s GLU 237 CO 0.02 -0.39 1.76 0.08 0.95 0.00 0.00 175.26 177.68 2i2d s VAL 238 N -1.89 2.99 0.59 1.83 1.01 -1.26 -0.58 120.40 123.09 2i2d s VAL 238 Ca -0.08 0.31 -0.19 0.00 0.00 0.00 0.00 61.98 62.03 2i2d s VAL 238 Cb -0.00 -3.20 -0.04 0.00 0.00 0.00 0.00 36.38 33.14 2i2d s VAL 238 CO 0.04 -0.01 1.21 -0.55 0.00 0.00 0.00 175.10 175.79 2i2d s SER 239 N 3.05 5.21 0.38 3.32 0.15 0.13 -4.69 113.70 121.25 2i2d s SER 239 Ca 0.79 2.39 0.26 0.00 0.70 0.00 0.00 55.95 60.09 2i2d s SER 239 Cb -0.41 -2.60 0.76 0.00 -1.71 0.00 0.00 66.02 62.06 2i2d s SER 239 CO 0.35 -1.58 1.74 0.00 1.20 0.00 0.00 173.24 174.95 2i2d h ALA 240 N 0.92 1.00 -2.51 5.45 0.00 -1.92 -3.43 119.26 118.77 2i2d h ALA 240 Ca -0.50 0.00 -0.54 0.00 0.00 0.00 0.00 54.91 53.87 2i2d h ALA 240 Cb 1.30 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 19.06 2i2d h ALA 240 CO 0.55 0.00 -0.06 0.15 0.00 0.00 0.00 179.25 179.89 2i2d s LYS 241 N -3.29 3.90 0.07 0.00 1.02 -1.26 -5.09 119.74 115.09 2i2d s LYS 241 Ca 0.06 0.42 0.05 0.00 0.02 0.00 0.00 55.97 56.53 2i2d s LYS 241 Cb 0.08 -2.70 -0.03 0.00 -0.52 0.00 0.00 37.83 34.66 2i2d s LYS 241 CO 0.59 0.34 -0.14 0.15 -0.92 0.00 0.00 175.35 175.37 2i2d s LYS 242 N -2.56 0.84 0.16 1.68 1.02 -1.26 -3.90 119.74 115.73 2i2d s LYS 242 Ca 0.45 -0.92 -0.22 0.00 0.02 0.00 0.00 55.97 55.31 2i2d s LYS 242 Cb -0.12 -0.86 -0.08 0.00 -0.52 0.00 0.00 37.83 36.25 2i2d s LYS 242 CO 0.20 0.19 0.71 -1.50 -0.92 0.00 0.00 175.35 174.03 2i2d s ILE 243 N -1.19 4.53 -0.12 2.17 2.07 -0.81 -4.65 121.20 123.21 2i2d s ILE 243 Ca -0.01 1.44 0.00 0.00 -1.41 0.00 0.00 60.65 60.67 2i2d s ILE 243 Cb -0.10 -3.99 -0.02 0.00 0.13 0.00 0.00 42.46 38.49 2i2d s ILE 243 CO 0.02 0.43 -0.12 -1.00 -1.91 0.00 0.00 174.94 172.36 2i2d s HIS 244 N -1.26 2.83 -0.08 3.50 3.76 -1.26 -1.37 115.29 121.40 2i2d s HIS 244 Ca 0.36 -0.48 -0.01 0.00 -0.15 0.00 0.00 55.06 54.78 2i2d s HIS 244 Cb -0.20 -1.82 -0.03 0.00 1.11 0.00 0.00 32.58 31.64 2i2d s HIS 244 CO 0.23 -0.09 -0.01 -0.06 -0.85 0.00 0.00 174.74 173.95 2i2d s PHE 245 N 0.11 3.12 -0.02 1.40 0.08 0.14 -0.92 117.98 121.89 2i2d s PHE 245 Ca -0.05 0.16 -0.18 0.00 0.12 0.00 0.00 56.93 56.98 2i2d s PHE 245 Cb -0.15 -1.77 -0.05 0.00 -0.57 0.00 0.00 43.02 40.48 2i2d s PHE 245 CO 0.04 0.44 0.51 0.00 -0.10 0.00 0.00 175.22 176.12 2i2d s ALA 246 N -0.87 3.55 -0.10 5.36 0.00 -0.57 -1.76 121.76 127.38 2i2d s ALA 246 Ca 0.13 -0.09 -0.33 0.00 0.00 0.00 0.00 51.96 51.68 2i2d s ALA 246 Cb -0.11 -2.61 0.13 0.00 0.00 0.00 0.00 23.12 20.52 2i2d s ALA 246 CO 0.02 0.24 1.20 -0.98 0.00 0.00 0.00 175.76 176.24 2i2d s ARG 247 N -0.33 0.42 0.00 0.00 1.04 -1.05 -4.78 118.95 114.24 2i2d s ARG 247 Ca 0.28 -0.19 0.00 0.00 -1.04 0.00 0.00 55.73 54.78 2i2d s ARG 247 Cb -0.17 0.17 0.00 0.00 -2.04 0.00 0.00 34.95 32.91 2i2d s ARG 247 CO 0.15 -0.19 0.00 1.19 -0.04 0.00 0.00 175.30 176.41 2i2d n PHE 248 N -0.26 0.00 -3.83 5.89 0.99 -1.26 -1.32 117.46 117.67 2i2d n PHE 248 Ca -0.04 0.00 -0.10 0.00 -0.00 0.00 0.00 57.45 57.32 2i2d n PHE 248 Cb 0.60 0.00 -0.06 0.00 -1.00 0.00 0.00 39.48 39.02 2i2d n PHE 248 CO 0.00 0.00 0.00 1.03 -0.00 0.00 0.00 176.76 177.79 2i2d s ARG 249 N 0.00 1.12 -0.04 -1.08 3.00 -1.26 -5.03 118.95 115.66 2i2d s ARG 249 Ca 0.00 -0.97 -0.30 0.00 0.00 0.00 0.00 55.73 54.46 2i2d s ARG 249 Cb 0.00 0.42 -0.05 0.00 0.00 0.00 0.00 34.95 35.31 2i2d s ARG 249 CO 0.00 -0.42 1.54 0.45 0.00 0.00 0.00 175.30 176.87 2i2d s SER 250 N -2.89 6.74 -0.39 0.23 0.15 -1.26 -4.95 113.70 111.33 2i2d s SER 250 Ca 0.10 2.17 0.03 0.00 0.70 0.00 0.00 55.95 58.95 2i2d s SER 250 Cb 0.02 -2.55 0.16 0.00 -1.71 0.00 0.00 66.02 61.95 2i2d s SER 250 CO -0.05 -0.84 0.32 0.12 1.20 0.00 0.00 173.24 173.99 2i2d s PHE 251 N 3.32 0.69 0.38 3.44 5.36 -1.26 -5.14 117.98 124.77 2i2d s PHE 251 Ca 0.69 -1.87 -0.27 0.00 -0.96 0.00 0.00 56.93 54.51 2i2d s PHE 251 Cb -0.32 -0.79 -0.10 0.00 -0.34 0.00 0.00 43.02 41.46 2i2d s PHE 251 CO 0.27 -0.87 1.42 -2.14 -1.46 0.00 0.00 175.22 172.44 2i2d s PRO 252 N 0.55 4.06 0.25 10.12 0.02 -1.26 -4.78 135.00 143.97 2i2d s PRO 252 Ca 0.27 2.42 -0.08 0.00 0.02 0.00 0.00 61.00 63.63 2i2d s PRO 252 Cb -0.07 -2.91 0.42 0.00 0.02 0.00 0.00 34.50 31.96 2i2d s PRO 252 CO -0.11 -0.51 1.62 0.35 -0.33 0.00 0.00 177.00 178.02 2i2d h PHE 253 N 2.91 -0.19 -0.28 6.54 3.57 -2.01 0.64 116.94 128.13 2i2d h PHE 253 Ca -0.50 0.06 -0.07 0.00 3.53 0.00 0.00 57.97 60.99 2i2d h PHE 253 Cb 1.24 0.21 -0.02 0.00 2.79 0.00 0.00 35.95 40.17 2i2d h PHE 253 CO 0.53 -0.29 -0.14 -1.49 -2.23 0.00 0.00 178.31 174.69 2i2d h TRP 254 N 0.05 0.51 -0.27 0.41 -0.00 -1.98 0.16 115.95 114.83 2i2d h TRP 254 Ca 0.41 -0.08 -0.01 0.00 -0.00 0.00 0.00 58.89 59.21 2i2d h TRP 254 Cb 0.70 -0.14 -0.01 0.00 -0.00 0.00 0.00 29.16 29.71 2i2d h TRP 254 CO -0.50 0.60 0.12 -0.09 -0.00 0.00 0.00 178.44 178.57 2i2d h ARG 255 N 0.44 0.40 -0.73 0.49 2.43 -1.51 -0.50 114.38 115.39 2i2d h ARG 255 Ca 0.08 -0.07 0.07 0.00 -0.81 0.00 0.00 59.98 59.26 2i2d h ARG 255 Cb 0.51 -0.07 -0.06 0.00 -0.42 0.00 0.00 29.97 29.93 2i2d h ARG 255 CO 0.03 0.41 0.40 -0.09 -1.51 0.00 0.00 179.97 179.21 2i2d h ARG 256 N 0.30 0.70 -0.69 0.20 2.43 -0.14 0.17 114.38 117.34 2i2d h ARG 256 Ca 0.09 -0.04 -0.04 0.00 -0.81 0.00 0.00 59.98 59.18 2i2d h ARG 256 Cb 0.15 -0.16 -0.03 0.00 -0.42 0.00 0.00 29.97 29.51 2i2d h ARG 256 CO -0.01 0.46 0.26 0.28 -1.51 0.00 0.00 179.97 179.45 2i2d h VAL 257 N 0.72 1.25 -0.27 0.20 2.07 -0.62 -2.26 116.25 117.33 2i2d h VAL 257 Ca 0.34 -0.80 -0.03 0.00 0.82 0.00 0.00 66.70 67.03 2i2d h VAL 257 Cb 0.26 0.48 -0.01 0.00 -1.52 0.00 0.00 31.29 30.50 2i2d h VAL 257 CO -0.21 0.32 0.07 -0.74 0.02 0.00 0.00 177.57 177.02 2i2d h HIS 258 N 0.98 0.45 -0.42 1.57 -0.00 -0.16 -1.97 115.15 115.61 2i2d h HIS 258 Ca 0.23 -0.05 -0.04 0.00 -0.00 0.00 0.00 60.37 60.50 2i2d h HIS 258 Cb 0.24 -0.13 -0.02 0.00 -0.00 0.00 0.00 27.41 27.50 2i2d h HIS 258 CO 0.02 0.50 0.09 -0.44 -0.00 0.00 0.00 177.93 178.10 2i2d h ASP 259 N 0.27 0.58 0.89 3.26 3.32 -0.64 0.41 116.42 124.50 2i2d h ASP 259 Ca 0.08 -0.09 -0.22 0.00 0.02 0.00 0.00 57.03 56.82 2i2d h ASP 259 Cb 0.28 -0.15 -0.03 0.00 0.22 0.00 0.00 39.33 39.64 2i2d h ASP 259 CO 0.00 0.59 -1.17 0.28 -1.72 0.00 0.00 179.24 177.22 2i2d h SER 260 N 0.61 0.00 0.00 6.45 0.02 -1.33 -3.40 113.55 115.90 2i2d h SER 260 Ca 0.14 0.00 -0.02 0.00 -0.84 0.00 0.00 61.79 61.07 2i2d h SER 260 Cb 0.25 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 62.79 2i2d h SER 260 CO -0.00 0.94 -1.12 0.49 -1.14 0.00 0.00 176.83 176.00 2i2d n PHE 261 N -3.24 0.00 -0.07 3.45 3.01 -0.75 -4.92 117.46 114.94 2i2d n PHE 261 Ca -0.05 0.00 -0.06 0.00 1.01 0.00 0.00 57.45 58.35 2i2d n PHE 261 Cb 0.95 -0.08 -0.02 0.00 -0.01 0.00 0.00 39.48 40.32 2i2d n PHE 261 CO 0.00 0.00 0.00 -0.89 1.01 0.00 0.00 176.76 176.88 2i2d n ILE 262 N -1.86 1.10 -1.74 4.37 2.08 0.11 -5.07 119.36 118.35 2i2d n ILE 262 Ca -0.02 0.24 0.00 0.00 0.56 0.00 0.00 62.75 63.53 2i2d n ILE 262 Cb 0.35 -2.13 0.00 0.00 -0.75 0.00 0.00 39.64 37.11 2i2d n ILE 262 CO 0.00 0.00 0.00 -1.84 0.56 0.00 0.00 176.55 175.27