#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2vil n GLU 2 N 0.00 -1.00 -0.42 5.55 0.28 -1.26 -4.67 120.64 119.12 2vil n GLU 2 Ca 0.00 0.10 0.40 0.00 -0.16 0.00 0.00 57.16 57.49 2vil n GLU 2 Cb 0.00 -3.60 0.70 0.00 1.43 0.00 0.00 31.44 29.97 2vil n GLU 2 CO 0.00 0.00 0.00 1.37 -0.16 0.00 0.00 177.13 178.34 2vil h LEU 3 N -1.80 0.00 -9.85 -1.84 8.10 -1.99 -3.39 115.31 104.54 2vil h LEU 3 Ca -0.66 0.00 -0.56 0.00 0.11 0.00 0.00 57.88 56.77 2vil h LEU 3 Cb 1.40 0.00 0.13 0.00 -0.44 0.00 0.00 40.66 41.75 2vil h LEU 3 CO 0.71 0.00 0.50 -1.54 -4.11 0.00 0.00 178.44 173.99 2vil n SER 4 N -3.78 2.53 0.00 0.17 3.41 -1.26 -0.44 113.62 114.26 2vil n SER 4 Ca 0.31 1.09 0.00 0.00 -0.26 0.00 0.00 58.87 60.01 2vil n SER 4 Cb 1.59 -1.51 0.00 0.00 -0.26 0.00 0.00 64.21 64.03 2vil n SER 4 CO 0.00 0.00 0.00 1.17 -0.16 0.00 0.00 175.04 176.05 2vil n LYS 5 N -0.07 0.00 -0.22 4.33 4.81 -1.26 -4.15 118.16 121.59 2vil n LYS 5 Ca 0.07 0.00 0.31 0.00 -0.87 0.00 0.00 58.31 57.82 2vil n LYS 5 Cb 0.40 0.00 0.65 0.00 0.02 0.00 0.00 35.03 36.10 2vil n LYS 5 CO 0.00 0.00 0.00 0.87 1.17 0.00 0.00 177.40 179.44 2vil h LYS 6 N 0.00 0.00 0.00 1.64 1.57 -1.75 0.15 116.57 118.18 2vil h LYS 6 Ca 0.00 0.00 -0.25 0.00 -1.87 0.00 0.00 60.65 58.53 2vil h LYS 6 Cb 0.00 0.00 -0.05 0.00 0.08 0.00 0.00 32.23 32.26 2vil h LYS 6 CO 0.00 0.00 -1.94 0.28 -0.57 0.00 0.00 179.45 177.22 2vil n VAL 7 N -3.67 0.94 -0.48 0.50 0.31 0.42 -5.00 118.33 111.35 2vil n VAL 7 Ca 0.22 -0.49 0.00 0.00 -0.01 0.00 0.00 64.34 64.06 2vil n VAL 7 Cb 1.29 -0.83 0.00 0.00 -0.91 0.00 0.00 33.84 33.39 2vil n VAL 7 CO 0.00 0.00 0.00 0.35 -1.32 0.00 0.00 176.83 175.86 2vil n THR 8 N -2.69 0.00 0.00 2.52 -2.24 0.53 -4.21 114.28 108.19 2vil n THR 8 Ca -0.25 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.53 2vil n THR 8 Cb 0.89 -0.52 0.00 0.00 -2.10 0.00 0.00 70.33 68.60 2vil n THR 8 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2vil n GLY 9 N 5.00 1.61 2.70 3.38 0.00 -1.26 -4.36 105.19 112.26 2vil n GLY 9 Ca 0.00 -0.17 -0.06 0.00 0.00 0.00 0.00 46.02 45.79 2vil n GLY 9 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 2vil n LYS 10 N 0.00 0.61 0.00 1.61 0.00 -1.26 -5.05 118.16 114.07 2vil n LYS 10 Ca 0.00 -1.37 0.00 0.00 -0.00 0.00 0.00 58.31 56.94 2vil n LYS 10 Cb 0.00 -0.67 0.00 0.00 -0.00 0.00 0.00 35.03 34.36 2vil n LYS 10 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.40 178.68 2vil n LEU 11 N 0.55 0.00 -3.15 -5.58 4.32 -1.26 -4.25 117.00 107.64 2vil n LEU 11 Ca 0.01 0.93 -0.20 0.00 -0.02 0.00 0.00 56.01 56.74 2vil n LEU 11 Cb 0.72 -0.43 -0.05 0.00 -1.62 0.00 0.00 43.42 42.03 2vil n LEU 11 CO -0.03 -0.43 -0.18 0.47 -1.22 0.00 0.00 177.39 176.00 2vil n ASP 12 N -2.65 -1.11 -4.68 -1.43 8.00 -1.26 -5.03 116.55 108.40 2vil n ASP 12 Ca 0.00 -2.67 -0.39 0.00 0.71 0.00 0.00 54.79 52.44 2vil n ASP 12 Cb 0.00 0.11 -0.06 0.00 -0.02 0.00 0.00 41.12 41.15 2vil n ASP 12 CO 0.00 0.00 0.00 -0.54 -0.39 0.00 0.00 177.20 176.27 2vil s LYS 13 N -0.08 4.23 -1.22 -1.24 -0.14 -1.26 -4.28 119.74 115.75 2vil s LYS 13 Ca 0.33 0.44 -0.17 0.00 -1.36 0.00 0.00 55.97 55.21 2vil s LYS 13 Cb 0.09 -3.53 -0.00 0.00 -1.68 0.00 0.00 37.83 32.71 2vil s LYS 13 CO -0.15 -0.08 0.69 0.25 -0.76 0.00 0.00 175.35 175.29 2vil n THR 14 N 4.35 -4.83 -3.15 2.17 -2.24 -1.26 -4.96 114.28 104.37 2vil n THR 14 Ca -0.05 -0.81 0.04 0.00 -2.27 0.00 0.00 64.05 60.97 2vil n THR 14 Cb 0.51 -3.71 -0.01 0.00 -2.10 0.00 0.00 70.33 65.02 2vil n THR 14 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 2vil s THR 15 N -3.60 -0.87 0.05 4.28 2.01 -1.26 -5.14 115.64 111.11 2vil s THR 15 Ca 0.35 0.00 -0.30 0.00 0.31 0.00 0.00 61.69 62.05 2vil s THR 15 Cb -0.14 -0.93 -0.05 0.00 0.01 0.00 0.00 72.50 71.40 2vil s THR 15 CO 0.88 0.00 1.09 -2.16 -0.69 0.00 0.00 174.62 173.74 2vil s PRO 16 N 2.86 4.51 0.00 4.92 0.04 -1.26 -4.67 135.00 141.41 2vil s PRO 16 Ca 0.15 1.61 0.00 0.00 0.04 0.00 0.00 61.00 62.80 2vil s PRO 16 Cb -0.11 -3.39 0.00 0.00 0.04 0.00 0.00 34.50 31.04 2vil s PRO 16 CO -0.22 -0.12 0.00 0.41 0.04 0.00 0.00 177.00 177.11 2vil n GLY 17 N 2.93 2.47 3.22 0.56 0.00 -0.63 -4.99 105.19 108.76 2vil n GLY 17 Ca 0.07 -1.88 -0.24 0.00 0.00 0.00 0.00 46.02 43.97 2vil n GLY 17 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 2vil s ILE 18 N -1.70 1.53 0.37 -0.61 -0.00 -1.26 -1.71 121.20 117.82 2vil s ILE 18 Ca 0.00 -1.15 0.08 0.00 -0.00 0.00 0.00 60.65 59.58 2vil s ILE 18 Cb 0.00 -1.34 -0.04 0.00 -0.00 0.00 0.00 42.46 41.07 2vil s ILE 18 CO 0.00 0.16 0.16 -1.10 -0.00 0.00 0.00 174.94 174.16 2vil s GLN 19 N -1.16 2.31 0.16 0.37 -0.21 -0.21 -4.90 119.66 116.00 2vil s GLN 19 Ca 0.06 -1.67 0.04 0.00 0.02 0.00 0.00 55.36 53.81 2vil s GLN 19 Cb -0.09 -2.10 -0.05 0.00 1.00 0.00 0.00 33.01 31.78 2vil s GLN 19 CO 0.02 0.01 -0.08 0.42 -2.12 0.00 0.00 175.29 173.54 2vil s ILE 20 N -2.50 1.06 -0.15 1.08 1.01 -1.10 -0.98 121.20 119.62 2vil s ILE 20 Ca 0.39 -2.04 0.02 0.00 0.00 0.00 0.00 60.65 59.02 2vil s ILE 20 Cb -0.00 -1.92 0.02 0.00 0.01 0.00 0.00 42.46 40.56 2vil s ILE 20 CO 0.23 -0.68 -0.20 0.26 0.00 0.00 0.00 174.94 174.55 2vil s TRP 21 N -3.40 2.60 0.01 3.97 0.51 0.18 0.99 118.94 123.80 2vil s TRP 21 Ca 0.18 -1.41 -0.30 0.00 -2.12 0.00 0.00 56.10 52.45 2vil s TRP 21 Cb 0.04 -1.80 -0.03 0.00 -0.81 0.00 0.00 33.47 30.86 2vil s TRP 21 CO 0.01 -0.68 0.99 -0.98 -0.51 0.00 0.00 176.95 175.78 2vil s ARG 22 N 1.06 4.56 -0.25 4.98 1.70 0.14 -1.77 118.95 129.38 2vil s ARG 22 Ca -0.02 1.43 0.06 0.00 -0.47 0.00 0.00 55.73 56.74 2vil s ARG 22 Cb -0.14 -3.45 0.53 0.00 -0.57 0.00 0.00 34.95 31.31 2vil s ARG 22 CO -0.07 -0.04 1.54 -0.89 -1.08 0.00 0.00 175.30 174.76 2vil n ILE 23 N 3.84 2.30 -0.59 4.99 2.08 0.18 -0.98 119.36 131.18 2vil n ILE 23 Ca 0.06 -1.20 -0.30 0.00 0.56 0.00 0.00 62.75 61.87 2vil n ILE 23 Cb 0.51 -0.50 0.21 0.00 -0.75 0.00 0.00 39.64 39.11 2vil n ILE 23 CO 0.00 0.00 0.00 -1.84 0.56 0.00 0.00 176.55 175.27 2vil n GLU 24 N -0.17 -1.73 -2.16 0.38 0.28 -1.21 -1.93 120.64 114.11 2vil n GLU 24 Ca 0.32 -0.47 -0.03 0.00 -0.16 0.00 0.00 57.16 56.83 2vil n GLU 24 Cb 1.15 -2.05 -0.00 0.00 1.43 0.00 0.00 31.44 31.97 2vil n GLU 24 CO 0.00 0.00 0.00 0.27 -0.16 0.00 0.00 177.13 177.24 2vil n ASN 25 N -3.66 -1.44 -3.61 -1.84 0.23 -1.26 -0.06 115.26 103.62 2vil n ASN 25 Ca 0.04 0.35 -0.24 0.00 -0.53 0.00 0.00 54.58 54.20 2vil n ASN 25 Cb 0.56 -1.42 0.04 0.00 -2.08 0.00 0.00 39.78 36.88 2vil n ASN 25 CO 0.00 0.00 0.00 0.23 -0.93 0.00 0.00 177.26 176.56 2vil n MET 26 N -2.25 -3.13 -3.58 -3.83 2.81 -0.81 -4.99 117.12 101.35 2vil n MET 26 Ca -0.03 0.61 -0.16 0.00 -1.81 0.00 0.00 57.70 56.31 2vil n MET 26 Cb 0.42 -4.94 -0.06 0.00 -0.71 0.00 0.00 33.22 27.93 2vil n MET 26 CO 0.00 0.00 0.00 -2.00 1.51 0.00 0.00 175.97 175.48 2vil s GLU 27 N -5.68 0.93 0.18 0.03 2.12 0.91 -5.05 118.70 112.14 2vil s GLU 27 Ca 0.25 0.63 -0.30 0.00 0.36 0.00 0.00 54.97 55.91 2vil s GLU 27 Cb -0.07 0.45 -0.08 0.00 0.26 0.00 0.00 34.13 34.69 2vil s GLU 27 CO 0.82 -0.21 1.06 1.41 -0.54 0.00 0.00 175.26 177.80 2vil s MET 28 N -0.39 4.64 0.01 4.30 -2.45 -1.26 -3.32 119.30 120.83 2vil s MET 28 Ca -0.05 1.66 -0.11 0.00 -1.25 0.00 0.00 55.69 55.94 2vil s MET 28 Cb -0.03 -3.29 0.01 0.00 1.25 0.00 0.00 34.83 32.78 2vil s MET 28 CO 0.05 0.15 0.22 0.08 1.05 0.00 0.00 175.02 176.57 2vil s VAL 29 N -0.37 0.08 0.17 10.11 1.01 -0.15 -2.33 120.40 128.92 2vil s VAL 29 Ca 0.48 -0.69 -0.30 0.00 0.00 0.00 0.00 61.98 61.47 2vil s VAL 29 Cb -0.28 -0.67 -0.08 0.00 0.00 0.00 0.00 36.38 35.35 2vil s VAL 29 CO 0.34 -0.38 1.20 -2.16 0.00 0.00 0.00 175.10 174.10 2vil s PRO 30 N -1.80 4.48 -0.30 2.72 0.04 -1.26 0.28 135.00 139.16 2vil s PRO 30 Ca -0.11 1.86 0.03 0.00 0.04 0.00 0.00 61.00 62.82 2vil s PRO 30 Cb -0.04 -3.26 0.08 0.00 0.04 0.00 0.00 34.50 31.32 2vil s PRO 30 CO 0.00 -0.11 -0.03 0.08 0.04 0.00 0.00 177.00 176.99 2vil s VAL 31 N 0.12 2.18 0.00 -0.36 1.01 0.28 -4.66 120.40 118.96 2vil s VAL 31 Ca 0.54 -1.97 0.00 0.00 0.00 0.00 0.00 61.98 60.55 2vil s VAL 31 Cb -0.32 -2.45 0.00 0.00 0.00 0.00 0.00 36.38 33.61 2vil s VAL 31 CO 0.35 -0.32 0.00 -0.81 0.00 0.00 0.00 175.10 174.32 2vil n PRO 32 N 4.36 1.49 0.14 2.72 -0.04 -1.26 -2.70 135.00 139.70 2vil n PRO 32 Ca -0.05 0.00 0.02 0.00 -0.04 0.00 0.00 63.50 63.43 2vil n PRO 32 Cb 0.42 0.00 0.06 0.00 -0.04 0.00 0.00 33.50 33.94 2vil n PRO 32 CO 0.00 0.00 0.00 1.79 -0.04 0.00 0.00 175.50 177.25 2vil h THR 33 N -0.11 1.00 -0.42 0.52 1.35 -1.99 -2.67 112.91 110.59 2vil h THR 33 Ca 0.00 -2.27 -0.23 0.00 -0.55 0.00 0.00 66.41 63.35 2vil h THR 33 Cb 0.00 2.40 -0.13 0.00 -1.73 0.00 0.00 68.15 68.69 2vil h THR 33 CO 0.00 0.54 0.30 0.29 -0.25 0.00 0.00 175.52 176.40 2vil n LYS 34 N -3.30 1.57 0.00 4.72 5.02 -1.26 -4.04 118.16 120.87 2vil n LYS 34 Ca 0.01 -1.29 0.00 0.00 -2.02 0.00 0.00 58.31 55.02 2vil n LYS 34 Cb 0.72 -1.50 0.00 0.00 -0.02 0.00 0.00 35.03 34.23 2vil n LYS 34 CO 0.00 0.00 0.00 0.43 -0.52 0.00 0.00 177.40 177.31 2vil n SER 35 N -0.02 0.00 -0.33 4.39 7.64 -1.20 -4.92 113.62 119.18 2vil n SER 35 Ca 0.25 0.00 -0.03 0.00 1.01 0.00 0.00 58.87 60.10 2vil n SER 35 Cb 0.89 0.00 0.09 0.00 -1.01 0.00 0.00 64.21 64.18 2vil n SER 35 CO 0.00 0.00 0.00 0.10 -3.01 0.00 0.00 175.04 172.13 2vil h TYR 36 N 0.00 1.11 -0.36 1.43 -0.00 -1.61 -1.09 116.97 116.45 2vil h TYR 36 Ca 0.00 0.02 0.10 0.00 -0.00 0.00 0.00 58.73 58.86 2vil h TYR 36 Cb 0.00 -0.38 -0.01 0.00 -0.00 0.00 0.00 36.73 36.34 2vil h TYR 36 CO 0.00 0.71 0.49 0.78 -0.00 0.00 0.00 178.16 180.14 2vil h GLY 37 N 1.20 0.00 -6.05 0.10 0.00 -1.80 -3.38 103.07 93.14 2vil h GLY 37 Ca 0.32 0.00 -0.46 0.00 0.00 0.00 0.00 47.33 47.20 2vil h GLY 37 CO -0.07 0.00 -0.79 -1.31 0.00 0.00 0.00 176.54 174.37 2vil s ASN 38 N -4.89 1.31 -0.13 0.19 -0.87 -0.41 -2.46 114.94 107.67 2vil s ASN 38 Ca -0.04 -0.20 -0.07 0.00 -1.57 0.00 0.00 52.86 50.98 2vil s ASN 38 Cb 0.13 -0.62 0.05 0.00 -0.02 0.00 0.00 41.25 40.80 2vil s ASN 38 CO 0.47 -0.01 0.31 0.72 -2.57 0.00 0.00 177.10 176.01 2vil s PHE 39 N 0.79 -0.46 0.27 2.20 -0.12 -1.07 -4.84 117.98 114.76 2vil s PHE 39 Ca -0.13 1.01 -0.28 0.00 -0.05 0.00 0.00 56.93 57.49 2vil s PHE 39 Cb -0.15 0.13 -0.15 0.00 -0.63 0.00 0.00 43.02 42.22 2vil s PHE 39 CO 0.02 -0.30 0.88 0.66 -0.05 0.00 0.00 175.22 176.44 2vil n TYR 40 N 4.42 0.82 -0.24 3.49 4.01 -1.26 -3.44 117.16 124.95 2vil n TYR 40 Ca -0.22 0.77 -0.12 0.00 -0.16 0.00 0.00 57.90 58.17 2vil n TYR 40 Cb 0.53 -2.18 0.11 0.00 -0.31 0.00 0.00 39.34 37.50 2vil n TYR 40 CO 0.00 0.00 0.00 -0.85 -0.46 0.00 0.00 176.86 175.55 2vil n GLU 41 N 0.78 1.84 -2.85 -0.72 0.28 -0.61 -4.18 120.64 115.19 2vil n GLU 41 Ca 0.12 -1.71 -0.12 0.00 -0.16 0.00 0.00 57.16 55.29 2vil n GLU 41 Cb 0.30 -1.69 0.03 0.00 1.43 0.00 0.00 31.44 31.52 2vil n GLU 41 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 2vil n GLY 42 N -0.36 2.02 0.00 -1.84 0.00 -1.26 -4.56 105.19 99.18 2vil n GLY 42 Ca 0.32 -1.03 0.00 0.00 0.00 0.00 0.00 46.02 45.31 2vil n GLY 42 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2vil n ASP 43 N 0.02 4.04 -3.84 1.61 9.92 0.22 -4.10 116.55 124.42 2vil n ASP 43 Ca 0.12 0.00 -0.09 0.00 -0.53 0.00 0.00 54.79 54.28 2vil n ASP 43 Cb 0.76 0.00 -0.07 0.00 -0.64 0.00 0.00 41.12 41.16 2vil n ASP 43 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 2vil s TYR 45 N -3.57 0.50 -0.17 0.00 1.51 -0.41 -0.65 117.35 114.56 2vil s TYR 45 Ca 0.03 -0.83 -0.02 0.00 -1.01 0.00 0.00 57.07 55.24 2vil s TYR 45 Cb 0.03 0.04 0.05 0.00 -0.11 0.00 0.00 41.96 41.98 2vil s TYR 45 CO -0.09 -0.91 -0.00 0.08 -1.11 0.00 0.00 175.55 173.51 2vil s VAL 46 N -4.04 0.77 -0.43 0.71 1.01 -0.73 -0.49 120.40 117.21 2vil s VAL 46 Ca 0.25 -0.54 -0.12 0.00 0.00 0.00 0.00 61.98 61.57 2vil s VAL 46 Cb 0.01 -1.10 0.06 0.00 0.00 0.00 0.00 36.38 35.35 2vil s VAL 46 CO 0.09 -0.03 0.30 -0.22 0.00 0.00 0.00 175.10 175.23 2vil s LEU 47 N 1.77 5.21 -0.21 3.92 0.20 -0.78 -0.65 118.68 128.14 2vil s LEU 47 Ca -0.00 -1.31 -0.16 0.00 0.69 0.00 0.00 54.13 53.36 2vil s LEU 47 Cb -0.16 -2.07 -0.04 0.00 -0.43 0.00 0.00 46.19 43.49 2vil s LEU 47 CO -0.07 -0.54 0.40 -0.22 -0.29 0.00 0.00 176.35 175.63 2vil s LEU 48 N 1.54 4.15 -0.07 -0.68 2.96 -0.15 -0.58 118.68 125.84 2vil s LEU 48 Ca 0.03 0.51 0.03 0.00 -0.22 0.00 0.00 54.13 54.48 2vil s LEU 48 Cb -0.22 -2.51 -0.02 0.00 0.50 0.00 0.00 46.19 43.93 2vil s LEU 48 CO 0.05 -0.09 -0.16 -0.55 -1.32 0.00 0.00 176.35 174.28 2vil s SER 49 N 1.08 3.85 -0.09 3.68 0.15 -0.41 -1.05 113.70 120.92 2vil s SER 49 Ca 0.19 -0.29 0.00 0.00 0.70 0.00 0.00 55.95 56.55 2vil s SER 49 Cb -0.15 -1.07 0.02 0.00 -1.71 0.00 0.00 66.02 63.12 2vil s SER 49 CO 0.08 0.27 -0.08 -0.89 1.20 0.00 0.00 173.24 173.83 2vil s THR 50 N -0.31 0.93 -0.03 6.45 2.01 -0.70 -0.05 115.64 123.94 2vil s THR 50 Ca 0.02 -0.28 0.04 0.00 0.31 0.00 0.00 61.69 61.79 2vil s THR 50 Cb -0.13 -0.93 -0.01 0.00 0.01 0.00 0.00 72.50 71.45 2vil s THR 50 CO 0.03 0.33 -0.15 0.00 -0.69 0.00 0.00 174.62 174.14 2vil s ARG 51 N 1.32 1.42 1.02 4.92 1.70 -0.97 -1.60 118.95 126.76 2vil s ARG 51 Ca -0.03 -0.54 -0.14 0.00 -0.47 0.00 0.00 55.73 54.55 2vil s ARG 51 Cb -0.14 -1.30 0.11 0.00 -0.57 0.00 0.00 34.95 33.05 2vil s ARG 51 CO -0.03 0.27 0.54 0.36 -1.08 0.00 0.00 175.30 175.35 2vil n LYS 52 N 2.95 -1.00 -2.01 3.89 2.85 -1.26 -1.53 118.16 122.05 2vil n LYS 52 Ca -0.16 -0.25 -0.01 0.00 -1.05 0.00 0.00 58.31 56.83 2vil n LYS 52 Cb 0.54 -1.96 0.01 0.00 -0.65 0.00 0.00 35.03 32.96 2vil n LYS 52 CO 0.00 0.00 0.00 0.25 -0.05 0.00 0.00 177.40 177.60 2vil n THR 53 N -4.15 0.00 0.06 0.58 -2.24 -1.17 -4.69 114.28 102.67 2vil n THR 53 Ca 0.06 -0.21 -0.06 0.00 -2.27 0.00 0.00 64.05 61.57 2vil n THR 53 Cb 0.56 0.25 -0.10 0.00 -2.10 0.00 0.00 70.33 68.93 2vil n THR 53 CO 0.00 0.00 0.00 1.23 -0.57 0.00 0.00 175.07 175.73 2vil h GLY 54 N 0.57 0.00 1.73 3.38 0.00 -1.97 -3.23 103.07 103.56 2vil h GLY 54 Ca -0.09 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.24 2vil h GLY 54 CO 0.11 0.00 -0.24 1.76 0.00 0.00 0.00 176.54 178.17 2vil h SER 55 N 0.00 0.00 0.00 0.19 0.02 -2.00 -3.48 113.55 108.28 2vil h SER 55 Ca -0.05 -0.03 0.00 0.00 -0.84 0.00 0.00 61.79 60.87 2vil h SER 55 Cb 1.74 0.00 0.00 0.00 0.14 0.00 0.00 62.40 64.28 2vil h SER 55 CO 0.11 0.02 0.00 0.61 -1.14 0.00 0.00 176.83 176.43 2vil n GLY 56 N 1.21 1.98 3.45 -3.77 0.00 -1.22 -5.09 105.19 101.75 2vil n GLY 56 Ca 0.04 -0.33 -0.14 0.00 0.00 0.00 0.00 46.02 45.59 2vil n GLY 56 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2vil s PHE 57 N 0.00 -0.57 -0.21 1.61 0.08 -1.26 -3.03 117.98 114.59 2vil s PHE 57 Ca 0.00 0.56 0.01 0.00 0.12 0.00 0.00 56.93 57.61 2vil s PHE 57 Cb 0.00 0.52 0.05 0.00 -0.57 0.00 0.00 43.02 43.02 2vil s PHE 57 CO 0.00 -0.78 -0.07 0.45 -0.10 0.00 0.00 175.22 174.72 2vil s SER 58 N -2.30 3.57 0.28 1.36 0.15 -0.58 -4.89 113.70 111.28 2vil s SER 58 Ca -0.02 -1.01 -0.06 0.00 0.70 0.00 0.00 55.95 55.55 2vil s SER 58 Cb -0.01 -1.16 -0.05 0.00 -1.71 0.00 0.00 66.02 63.09 2vil s SER 58 CO -0.06 -0.20 0.56 -0.31 1.20 0.00 0.00 173.24 174.42 2vil s TYR 59 N 1.43 3.47 -0.33 3.44 2.02 -1.18 -2.29 117.35 123.90 2vil s TYR 59 Ca -0.03 0.68 0.01 0.00 -0.37 0.00 0.00 57.07 57.36 2vil s TYR 59 Cb -0.18 -2.13 0.15 0.00 -0.40 0.00 0.00 41.96 39.40 2vil s TYR 59 CO -0.07 0.18 0.34 -0.80 -1.57 0.00 0.00 175.55 173.63 2vil s ASN 60 N -3.04 1.39 -0.03 2.29 -0.87 0.92 -1.99 114.94 113.62 2vil s ASN 60 Ca 0.45 -1.16 -0.27 0.00 -1.57 0.00 0.00 52.86 50.31 2vil s ASN 60 Cb -0.11 0.55 -0.04 0.00 -0.02 0.00 0.00 41.25 41.63 2vil s ASN 60 CO 0.29 -0.32 0.83 -0.63 -2.57 0.00 0.00 177.10 174.70 2vil s ILE 61 N 1.90 4.94 0.33 0.60 1.01 0.24 -1.29 121.20 128.93 2vil s ILE 61 Ca 0.13 1.74 0.09 0.00 0.00 0.00 0.00 60.65 62.62 2vil s ILE 61 Cb -0.15 -4.18 -0.05 0.00 0.01 0.00 0.00 42.46 38.10 2vil s ILE 61 CO -0.18 0.22 0.02 -1.00 0.00 0.00 0.00 174.94 173.99 2vil s HIS 62 N 0.82 2.57 -0.32 3.97 3.76 0.25 -0.70 115.29 125.64 2vil s HIS 62 Ca 0.44 -0.40 -0.02 0.00 -0.15 0.00 0.00 55.06 54.93 2vil s HIS 62 Cb -0.19 -1.46 0.11 0.00 1.11 0.00 0.00 32.58 32.15 2vil s HIS 62 CO 0.23 0.49 0.15 1.52 -0.85 0.00 0.00 174.74 176.28 2vil s TYR 63 N -2.49 0.78 0.32 1.40 1.13 -0.30 -1.87 117.35 116.32 2vil s TYR 63 Ca 0.35 -1.32 -0.28 0.00 -1.41 0.00 0.00 57.07 54.40 2vil s TYR 63 Cb -0.01 -1.11 -0.09 0.00 -1.10 0.00 0.00 41.96 39.64 2vil s TYR 63 CO 0.20 -0.84 1.14 -0.46 -2.51 0.00 0.00 175.55 173.08 2vil s TRP 64 N 1.64 3.37 -0.55 -3.49 -0.00 0.36 -2.27 118.94 118.00 2vil s TRP 64 Ca 0.12 1.63 0.07 0.00 -0.00 0.00 0.00 56.10 57.91 2vil s TRP 64 Cb -0.19 -3.35 0.29 0.00 -0.00 0.00 0.00 33.47 30.23 2vil s TRP 64 CO -0.23 -0.89 0.78 1.28 -0.00 0.00 0.00 176.95 177.89 2vil n LEU 65 N 0.79 3.11 -4.53 5.86 7.99 -0.05 -1.29 117.00 128.87 2vil n LEU 65 Ca 0.01 -5.36 -0.19 0.00 -0.01 0.00 0.00 56.01 50.46 2vil n LEU 65 Cb 0.45 -0.26 -0.15 0.00 -0.11 0.00 0.00 43.42 43.35 2vil n LEU 65 CO 0.53 2.19 1.69 0.61 -1.51 0.00 0.00 177.39 180.91 2vil n GLY 66 N 0.48 -0.33 3.35 -0.72 0.00 0.48 -3.87 105.19 104.58 2vil n GLY 66 Ca 0.28 0.18 -0.24 0.00 0.00 0.00 0.00 46.02 46.25 2vil n GLY 66 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 2vil n LYS 67 N 7.15 0.00 0.00 1.61 3.00 -1.26 -0.61 118.16 128.05 2vil n LYS 67 Ca 0.58 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.89 2vil n LYS 67 Cb 0.28 -1.03 0.00 0.00 0.00 0.00 0.00 35.03 34.28 2vil n LYS 67 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.40 177.49 2vil n ASN 68 N 5.98 0.00 -3.81 3.14 4.13 -1.26 -4.82 115.26 118.62 2vil n ASN 68 Ca 0.65 0.00 0.00 0.00 1.68 0.00 0.00 54.58 56.91 2vil n ASN 68 Cb 0.12 0.11 0.00 0.00 -1.54 0.00 0.00 39.78 38.46 2vil n ASN 68 CO 0.00 0.00 0.00 -1.54 0.28 0.00 0.00 177.26 176.00 2vil n SER 69 N -1.63 0.00 -4.66 6.41 3.41 -1.25 -4.95 113.62 110.95 2vil n SER 69 Ca 0.00 0.00 -0.31 0.00 -0.26 0.00 0.00 58.87 58.30 2vil n SER 69 Cb 0.00 0.00 -0.08 0.00 -0.26 0.00 0.00 64.21 63.87 2vil n SER 69 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 2vil s SER 70 N -1.81 3.91 0.26 4.04 1.04 -1.26 -4.98 113.70 114.90 2vil s SER 70 Ca 0.00 -1.60 -0.02 0.00 0.48 0.00 0.00 55.95 54.81 2vil s SER 70 Cb 0.00 0.33 0.45 0.00 0.10 0.00 0.00 66.02 66.91 2vil s SER 70 CO 0.00 -0.78 1.82 -0.61 0.98 0.00 0.00 173.24 174.65 2vil h GLN 71 N 1.49 0.87 -0.67 4.02 4.15 -2.00 -1.03 115.11 121.94 2vil h GLN 71 Ca -0.43 -0.05 0.00 0.00 0.77 0.00 0.00 58.65 58.94 2vil h GLN 71 Cb 1.30 -0.20 -0.03 0.00 0.21 0.00 0.00 27.48 28.76 2vil h GLN 71 CO 0.74 0.57 0.43 0.38 -1.93 0.00 0.00 178.83 179.02 2vil h ASP 72 N 0.89 0.78 -0.79 -0.69 3.04 -1.98 -0.89 116.42 116.78 2vil h ASP 72 Ca 0.44 -0.03 0.09 0.00 -3.24 0.00 0.00 57.03 54.28 2vil h ASP 72 Cb 0.39 -0.20 -0.05 0.00 -1.04 0.00 0.00 39.33 38.43 2vil h ASP 72 CO -0.25 0.58 0.52 -0.08 -2.04 0.00 0.00 179.24 177.97 2vil h GLU 73 N 0.91 0.72 -0.52 4.15 4.57 -1.58 0.46 114.58 123.29 2vil h GLU 73 Ca 0.24 -0.04 -0.03 0.00 -1.18 0.00 0.00 59.36 58.35 2vil h GLU 73 Cb -0.08 -0.16 -0.02 0.00 -0.16 0.00 0.00 28.75 28.32 2vil h GLU 73 CO -0.05 0.47 0.18 0.37 -1.18 0.00 0.00 179.01 178.81 2vil h GLN 74 N 0.74 0.75 0.00 1.92 4.15 -0.74 0.34 115.11 122.27 2vil h GLN 74 Ca 0.36 -0.12 0.00 0.00 0.77 0.00 0.00 58.65 59.66 2vil h GLN 74 Cb 0.42 -0.13 0.00 0.00 0.21 0.00 0.00 27.48 27.98 2vil h GLN 74 CO -0.14 0.64 -0.00 0.41 -1.93 0.00 0.00 178.83 177.81 2vil n GLY 75 N -1.03 -1.67 0.07 2.39 0.00 0.13 -1.90 105.19 103.18 2vil n GLY 75 Ca 0.04 -0.04 -0.09 0.00 0.00 0.00 0.00 46.02 45.93 2vil n GLY 75 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2vil h ALA 76 N 2.62 -0.04 0.00 4.61 0.00 0.16 -1.40 119.26 125.22 2vil h ALA 76 Ca 0.00 -0.29 -0.08 0.00 0.00 0.00 0.00 54.91 54.54 2vil h ALA 76 Cb 0.69 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.48 2vil h ALA 76 CO 0.00 -0.05 -0.40 0.00 0.00 0.00 0.00 179.25 178.80 2vil h ALA 77 N -0.37 0.98 0.00 0.00 0.00 -1.43 -1.63 119.26 116.81 2vil h ALA 77 Ca -0.00 -0.36 -0.04 0.00 0.00 0.00 0.00 54.91 54.50 2vil h ALA 77 Cb 0.59 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.32 2vil h ALA 77 CO 0.01 0.50 -0.18 0.00 0.00 0.00 0.00 179.25 179.58 2vil h ALA 78 N 1.60 0.02 -0.61 0.00 0.00 -1.48 -2.44 119.26 116.36 2vil h ALA 78 Ca -0.00 -0.46 -0.08 0.00 0.00 0.00 0.00 54.91 54.36 2vil h ALA 78 Cb 0.93 0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.71 2vil h ALA 78 CO 0.05 0.03 0.04 0.82 0.00 0.00 0.00 179.25 180.20 2vil h ILE 79 N -0.62 1.26 -0.87 0.00 5.03 -1.26 -1.60 117.51 119.46 2vil h ILE 79 Ca -0.02 -1.08 -0.02 0.00 -0.12 0.00 0.00 64.86 63.62 2vil h ILE 79 Cb 0.97 0.75 -0.04 0.00 -3.03 0.00 0.00 36.82 35.46 2vil h ILE 79 CO 0.03 0.39 0.48 1.88 -0.68 0.00 0.00 178.15 180.26 2vil h TYR 80 N 0.95 1.18 0.00 1.37 -1.99 -1.36 0.52 116.97 117.64 2vil h TYR 80 Ca 0.18 -0.02 -0.04 0.00 2.00 0.00 0.00 58.73 60.85 2vil h TYR 80 Cb 0.49 -0.38 -0.01 0.00 2.00 0.00 0.00 36.73 38.83 2vil h TYR 80 CO 0.03 0.81 -0.17 1.15 -0.00 0.00 0.00 178.16 179.99 2vil h THR 81 N 1.21 0.60 0.04 -2.88 2.02 -0.91 -2.48 112.91 110.51 2vil h THR 81 Ca 0.31 -0.77 -0.25 0.00 0.77 0.00 0.00 66.41 66.47 2vil h THR 81 Cb 0.02 1.50 0.01 0.00 -1.74 0.00 0.00 68.15 67.94 2vil h THR 81 CO -0.05 0.17 -1.06 0.74 0.37 0.00 0.00 175.52 175.69 2vil h THR 82 N 0.00 1.37 -0.39 3.16 2.02 0.02 -2.65 112.91 116.45 2vil h THR 82 Ca -0.00 -2.51 -0.10 0.00 0.77 0.00 0.00 66.41 64.58 2vil h THR 82 Cb 0.49 2.54 -0.02 0.00 -1.74 0.00 0.00 68.15 69.42 2vil h THR 82 CO 0.02 0.75 -0.15 1.56 0.37 0.00 0.00 175.52 178.07 2vil h GLN 83 N 0.24 0.71 -0.13 6.66 1.08 -0.80 -2.77 115.11 120.11 2vil h GLN 83 Ca -0.11 -0.25 -0.16 0.00 -1.45 0.00 0.00 58.65 56.68 2vil h GLN 83 Cb 1.71 -0.05 -0.01 0.00 -0.05 0.00 0.00 27.48 29.08 2vil h GLN 83 CO 0.19 0.83 -0.59 0.52 -0.95 0.00 0.00 178.83 178.83 2vil h MET 84 N 0.64 0.42 0.75 1.46 2.86 -1.50 -1.60 114.93 117.96 2vil h MET 84 Ca 0.10 -0.28 -0.03 0.00 -2.06 0.00 0.00 59.70 57.43 2vil h MET 84 Cb 0.62 0.04 -0.00 0.00 0.06 0.00 0.00 31.60 32.32 2vil h MET 84 CO 0.04 0.89 -0.43 0.22 1.06 0.00 0.00 176.91 178.69 2vil h ASP 85 N 0.32 -1.07 -0.07 1.22 3.58 -1.19 0.11 116.42 119.31 2vil h ASP 85 Ca -0.00 0.06 -0.06 0.00 0.42 0.00 0.00 57.03 57.44 2vil h ASP 85 Cb 1.12 0.31 -0.01 0.00 1.72 0.00 0.00 39.33 42.46 2vil h ASP 85 CO 0.10 -0.68 -0.12 1.05 -2.88 0.00 0.00 179.24 176.71 2vil h GLU 86 N -1.10 0.38 0.00 0.28 4.11 -1.57 -1.24 114.58 115.44 2vil h GLU 86 Ca -0.10 -0.10 0.00 0.00 0.07 0.00 0.00 59.36 59.23 2vil h GLU 86 Cb 0.87 -0.05 0.00 0.00 0.50 0.00 0.00 28.75 30.08 2vil h GLU 86 CO 0.12 0.51 0.00 0.66 0.07 0.00 0.00 179.01 180.36 2vil n TYR 87 N -4.24 0.09 -0.01 2.06 4.02 -0.60 -2.78 117.16 115.71 2vil n TYR 87 Ca 0.00 0.03 -0.11 0.00 -0.01 0.00 0.00 57.90 57.81 2vil n TYR 87 Cb 0.29 -0.55 -0.14 0.00 -0.02 0.00 0.00 39.34 38.92 2vil n TYR 87 CO 0.00 0.00 0.00 -0.07 -1.01 0.00 0.00 176.86 175.78 2vil h LEU 88 N 0.00 0.10 0.00 7.72 3.38 0.45 -3.48 115.31 123.48 2vil h LEU 88 Ca 0.00 -0.21 0.00 0.00 0.09 0.00 0.00 57.88 57.76 2vil h LEU 88 Cb 0.35 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 41.06 2vil h LEU 88 CO 0.00 1.19 0.00 0.61 0.09 0.00 0.00 178.44 180.33 2vil n GLY 89 N 1.63 1.56 3.22 0.83 0.00 -1.12 -4.59 105.19 106.73 2vil n GLY 89 Ca -0.19 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.83 2vil n GLY 89 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2vil n SER 90 N 0.00 0.00 -0.01 1.61 7.64 -1.17 -4.81 113.62 116.88 2vil n SER 90 Ca 0.00 0.00 0.13 0.00 1.01 0.00 0.00 58.87 60.01 2vil n SER 90 Cb 0.00 -0.52 0.51 0.00 -1.01 0.00 0.00 64.21 63.19 2vil n SER 90 CO 0.00 0.00 0.00 1.33 -3.01 0.00 0.00 175.04 173.36 2vil n VAL 91 N -2.00 0.00 -2.52 0.44 0.24 -1.26 -4.85 118.33 108.38 2vil n VAL 91 Ca 0.00 -0.00 -0.24 0.00 -2.04 0.00 0.00 64.34 62.06 2vil n VAL 91 Cb 0.00 -0.24 0.11 0.00 -1.47 0.00 0.00 33.84 32.24 2vil n VAL 91 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2vil s ALA 92 N -2.95 3.59 0.37 2.33 0.00 -1.26 -3.11 121.76 120.72 2vil s ALA 92 Ca 0.15 -1.62 0.04 0.00 0.00 0.00 0.00 51.96 50.53 2vil s ALA 92 Cb 0.19 -2.10 -0.03 0.00 0.00 0.00 0.00 23.12 21.18 2vil s ALA 92 CO 0.58 -1.46 0.17 0.08 0.00 0.00 0.00 175.76 175.12 2vil s VAL 93 N -3.17 0.41 -0.04 0.00 1.01 -0.84 -4.88 120.40 112.88 2vil s VAL 93 Ca 0.66 -2.00 0.04 0.00 0.00 0.00 0.00 61.98 60.68 2vil s VAL 93 Cb -0.06 -2.42 -0.00 0.00 0.00 0.00 0.00 36.38 33.90 2vil s VAL 93 CO 0.44 0.00 -0.17 -1.58 0.00 0.00 0.00 175.10 173.79 2vil s GLN 94 N -3.68 1.83 0.05 2.72 -0.44 -1.25 -0.59 119.66 118.30 2vil s GLN 94 Ca 0.30 -0.62 0.04 0.00 -2.50 0.00 0.00 55.36 52.58 2vil s GLN 94 Cb 0.03 -1.58 -0.03 0.00 -1.64 0.00 0.00 33.01 29.79 2vil s GLN 94 CO 0.18 0.25 -0.11 -1.01 0.50 0.00 0.00 175.29 175.09 2vil s HIS 95 N 0.04 0.97 -0.09 1.67 3.76 0.12 -4.95 115.29 116.80 2vil s HIS 95 Ca -0.04 -0.45 -0.00 0.00 -0.15 0.00 0.00 55.06 54.42 2vil s HIS 95 Cb -0.12 -0.56 -0.03 0.00 1.11 0.00 0.00 32.58 32.99 2vil s HIS 95 CO 0.02 -0.00 -0.07 -0.98 -0.85 0.00 0.00 174.74 172.86 2vil s ARG 96 N -1.53 2.98 0.13 1.40 1.70 -1.26 -1.15 118.95 121.22 2vil s ARG 96 Ca -0.05 -0.57 -0.03 0.00 -0.47 0.00 0.00 55.73 54.62 2vil s ARG 96 Cb -0.09 -2.65 -0.03 0.00 -0.57 0.00 0.00 34.95 31.61 2vil s ARG 96 CO 0.01 0.53 0.11 -1.21 -1.08 0.00 0.00 175.30 173.66 2vil s GLU 97 N -0.45 0.94 0.00 3.89 0.41 -0.96 -4.87 118.70 117.66 2vil s GLU 97 Ca 0.07 -1.32 0.00 0.00 -0.41 0.00 0.00 54.97 53.30 2vil s GLU 97 Cb -0.12 0.28 0.00 0.00 -1.78 0.00 0.00 34.13 32.51 2vil s GLU 97 CO 0.02 -0.28 0.00 0.28 -0.49 0.00 0.00 175.26 174.79 2vil n VAL 98 N -0.10 0.00 -2.15 2.63 0.31 -1.26 -0.88 118.33 116.89 2vil n VAL 98 Ca -0.07 0.00 -0.41 0.00 -0.01 0.00 0.00 64.34 63.84 2vil n VAL 98 Cb 0.63 0.00 -0.01 0.00 -0.91 0.00 0.00 33.84 33.55 2vil n VAL 98 CO 0.00 0.00 0.00 1.67 -1.32 0.00 0.00 176.83 177.18 2vil n GLN 99 N 0.00 2.81 0.00 5.55 7.27 -1.25 -2.36 117.38 129.40 2vil n GLN 99 Ca 0.00 -2.87 0.00 0.00 0.07 0.00 0.00 57.00 54.20 2vil n GLN 99 Cb 0.00 -3.41 0.00 0.00 2.41 0.00 0.00 30.24 29.24 2vil n GLN 99 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 2vil n GLY 100 N 4.94 0.93 0.01 1.69 0.00 -1.26 -4.95 105.19 106.55 2vil n GLY 100 Ca 0.50 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.62 2vil n GLY 100 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 2vil n HIS 101 N 0.00 0.06 -0.13 1.61 8.25 -0.99 -4.17 115.22 119.84 2vil n HIS 101 Ca 0.00 0.02 -0.12 0.00 -0.26 0.00 0.00 57.72 57.35 2vil n HIS 101 Cb 0.00 -0.22 0.09 0.00 1.12 0.00 0.00 29.99 30.98 2vil n HIS 101 CO 0.00 0.00 0.00 -0.85 0.64 0.00 0.00 176.34 176.13 2vil n GLU 102 N -1.77 1.63 0.00 -0.41 0.28 -1.16 -4.51 120.64 114.71 2vil n GLU 102 Ca 0.02 -1.52 0.00 0.00 -0.16 0.00 0.00 57.16 55.50 2vil n GLU 102 Cb 0.41 -1.59 0.00 0.00 1.43 0.00 0.00 31.44 31.68 2vil n GLU 102 CO 0.00 0.00 0.00 -1.13 -0.16 0.00 0.00 177.13 175.84 2vil n SER 103 N -0.32 0.00 -0.26 -1.84 3.41 -1.26 -1.90 113.62 111.45 2vil n SER 103 Ca 0.30 0.00 0.30 0.00 -0.26 0.00 0.00 58.87 59.21 2vil n SER 103 Cb 1.08 0.00 0.46 0.00 -0.26 0.00 0.00 64.21 65.49 2vil n SER 103 CO 0.00 0.00 0.00 -1.84 -0.16 0.00 0.00 175.04 173.04 2vil n GLU 104 N 0.00 0.01 0.25 4.33 0.00 -1.26 -0.49 120.64 123.48 2vil n GLU 104 Ca 0.00 0.98 -0.13 0.00 0.00 0.00 0.00 57.16 58.00 2vil n GLU 104 Cb 0.00 -2.41 -0.07 0.00 0.00 0.00 0.00 31.44 28.96 2vil n GLU 104 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.13 178.28 2vil h THR 105 N 0.00 0.32 -0.33 3.84 2.02 -1.89 0.88 112.91 117.76 2vil h THR 105 Ca 0.52 -0.47 -0.06 0.00 0.77 0.00 0.00 66.41 67.17 2vil h THR 105 Cb 2.90 0.47 -0.01 0.00 -1.74 0.00 0.00 68.15 69.76 2vil h THR 105 CO -0.01 0.05 -0.03 0.15 0.37 0.00 0.00 175.52 176.06 2vil h PHE 106 N -1.01 0.67 0.00 3.16 3.57 -0.07 -1.33 116.94 121.93 2vil h PHE 106 Ca -0.07 -0.13 0.00 0.00 3.53 0.00 0.00 57.97 61.31 2vil h PHE 106 Cb 0.60 -0.17 0.00 0.00 2.79 0.00 0.00 35.95 39.17 2vil h PHE 106 CO 0.01 0.74 0.00 -0.09 -2.23 0.00 0.00 178.31 176.74 2vil h ARG 107 N 0.40 0.00 -0.14 1.11 2.43 -1.35 -1.92 114.38 114.91 2vil h ARG 107 Ca 0.09 0.00 -0.08 0.00 -0.81 0.00 0.00 59.98 59.18 2vil h ARG 107 Cb 0.49 0.00 -0.00 0.00 -0.42 0.00 0.00 29.97 30.04 2vil h ARG 107 CO 0.02 0.00 -0.24 0.00 -1.51 0.00 0.00 179.97 178.24 2vil h ALA 108 N 2.08 0.22 0.00 2.80 0.00 0.20 -2.96 119.26 121.60 2vil h ALA 108 Ca 0.00 -0.38 0.00 0.00 0.00 0.00 0.00 54.91 54.53 2vil h ALA 108 Cb 0.30 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.05 2vil h ALA 108 CO 0.00 0.19 0.00 1.88 0.00 0.00 0.00 179.25 181.32 2vil h TYR 109 N 0.02 0.00 -3.49 0.00 0.05 -1.10 -3.39 116.97 109.07 2vil h TYR 109 Ca 0.01 0.00 -0.70 0.00 0.05 0.00 0.00 58.73 58.09 2vil h TYR 109 Cb 0.82 0.00 -0.34 0.00 1.01 0.00 0.00 36.73 38.22 2vil h TYR 109 CO 0.10 0.00 -0.46 -0.06 -1.05 0.00 0.00 178.16 176.69 2vil s PHE 110 N -3.30 3.51 -0.99 4.88 0.08 -0.77 -4.86 117.98 116.53 2vil s PHE 110 Ca 0.06 -2.46 -0.24 0.00 0.12 0.00 0.00 56.93 54.41 2vil s PHE 110 Cb 0.08 -3.25 -0.09 0.00 -0.57 0.00 0.00 43.02 39.19 2vil s PHE 110 CO 0.58 -0.93 2.02 0.15 -0.10 0.00 0.00 175.22 176.94 2vil s LYS 111 N 0.72 2.30 -0.22 0.44 1.02 -1.26 -3.77 119.74 118.98 2vil s LYS 111 Ca 0.11 -0.47 -0.03 0.00 0.02 0.00 0.00 55.97 55.61 2vil s LYS 111 Cb -0.22 -5.07 0.00 0.00 -0.52 0.00 0.00 37.83 32.02 2vil s LYS 111 CO -0.04 -3.88 0.24 1.04 -0.92 0.00 0.00 175.35 171.80 2vil n GLN 112 N 8.62 -0.67 -2.66 1.68 1.13 -1.26 -5.04 117.38 119.18 2vil n GLN 112 Ca 0.43 0.98 -0.03 0.00 -1.94 0.00 0.00 57.00 56.43 2vil n GLN 112 Cb 0.46 -3.05 0.11 0.00 0.11 0.00 0.00 30.24 27.87 2vil n GLN 112 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 2vil n GLY 113 N -0.87 -1.77 2.76 1.08 0.00 -1.25 -5.06 105.19 100.08 2vil n GLY 113 Ca 0.02 0.99 -0.27 0.00 0.00 0.00 0.00 46.02 46.76 2vil n GLY 113 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2vil n LEU 114 N 0.78 4.12 -4.90 0.99 7.99 -1.26 -4.54 117.00 120.18 2vil n LEU 114 Ca -0.05 -5.59 -0.28 0.00 -0.01 0.00 0.00 56.01 50.09 2vil n LEU 114 Cb 0.75 -0.54 0.01 0.00 -0.11 0.00 0.00 43.42 43.53 2vil n LEU 114 CO -0.13 2.27 0.51 -0.51 -1.51 0.00 0.00 177.39 178.02 2vil s ILE 115 N -3.80 4.62 0.13 -0.08 2.07 -1.03 -5.00 121.20 118.11 2vil s ILE 115 Ca 0.46 0.27 -0.01 0.00 -1.41 0.00 0.00 60.65 59.96 2vil s ILE 115 Cb 0.24 -3.78 -0.04 0.00 0.13 0.00 0.00 42.46 39.01 2vil s ILE 115 CO -0.10 -0.82 0.05 -0.31 -1.91 0.00 0.00 174.94 171.85 2vil s TYR 116 N -2.87 0.86 0.00 3.50 2.02 -1.26 -2.58 117.35 117.03 2vil s TYR 116 Ca 0.50 -1.22 0.00 0.00 -0.37 0.00 0.00 57.07 55.98 2vil s TYR 116 Cb -0.10 -0.49 0.00 0.00 -0.40 0.00 0.00 41.96 40.97 2vil s TYR 116 CO 0.46 -0.50 0.00 1.63 -1.57 0.00 0.00 175.55 175.58 2vil n LYS 117 N -0.09 0.00 -2.57 -0.62 4.76 -1.22 -4.76 118.16 113.66 2vil n LYS 117 Ca -0.06 0.00 -0.22 0.00 -2.87 0.00 0.00 58.31 55.16 2vil n LYS 117 Cb 0.63 0.00 0.04 0.00 -1.84 0.00 0.00 35.03 33.87 2vil n LYS 117 CO 0.00 0.00 0.00 -1.14 -1.37 0.00 0.00 177.40 174.89 2vil s GLN 118 N 1.37 2.52 0.00 1.97 0.74 -1.26 -1.57 119.66 123.43 2vil s GLN 118 Ca 0.00 -0.63 0.00 0.00 0.05 0.00 0.00 55.36 54.78 2vil s GLN 118 Cb 0.00 -2.42 0.00 0.00 1.10 0.00 0.00 33.01 31.69 2vil s GLN 118 CO 0.00 -0.79 0.00 0.41 -0.55 0.00 0.00 175.29 174.36 2vil n GLY 119 N -2.45 1.80 2.95 2.59 0.00 -1.26 -4.50 105.19 104.32 2vil n GLY 119 Ca 0.07 -2.11 -0.01 0.00 0.00 0.00 0.00 46.02 43.97 2vil n GLY 119 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2vil n GLY 120 N 5.00 -1.81 3.46 -0.02 0.00 -1.26 -4.81 105.19 105.75 2vil n GLY 120 Ca 0.00 0.47 -0.43 0.00 0.00 0.00 0.00 46.02 46.05 2vil n GLY 120 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2vil s VAL 121 N -0.68 4.60 0.00 1.61 1.01 -1.26 -4.96 120.40 120.72 2vil s VAL 121 Ca -0.06 -0.26 0.00 0.00 0.00 0.00 0.00 61.98 61.65 2vil s VAL 121 Cb 0.00 -4.47 0.00 0.00 0.00 0.00 0.00 36.38 31.91 2vil s VAL 121 CO 0.30 -1.07 0.43 0.00 0.00 0.00 0.00 175.10 174.75 2vil n ALA 122 N 6.92 0.00 -1.93 5.51 0.00 -1.26 -4.64 120.51 125.11 2vil n ALA 122 Ca -0.04 0.00 -0.06 0.00 0.00 0.00 0.00 53.44 53.34 2vil n ALA 122 Cb 0.46 0.21 -0.01 0.00 0.00 0.00 0.00 19.45 20.11 2vil n ALA 122 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 2vil n SER 123 N -0.86 -2.17 0.00 0.00 3.41 -1.26 -4.76 113.62 107.99 2vil n SER 123 Ca 0.00 0.26 0.00 0.00 -0.26 0.00 0.00 58.87 58.87 2vil n SER 123 Cb 0.00 -2.05 0.00 0.00 -0.26 0.00 0.00 64.21 61.90 2vil n SER 123 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2vil n GLY 124 N -0.43 -0.08 3.93 5.00 0.00 -1.26 -5.05 105.19 107.29 2vil n GLY 124 Ca -0.07 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.68 2vil n GLY 124 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2vil s MET 125 N 0.00 3.51 0.00 1.61 -1.94 -1.26 -5.32 119.30 115.89 2vil s MET 125 Ca 0.00 -0.39 0.00 0.00 -1.71 0.00 0.00 55.69 53.59 2vil s MET 125 Cb 0.00 -2.86 0.00 0.00 2.01 0.00 0.00 34.83 33.98 2vil s MET 125 CO 0.00 0.42 0.00 1.63 -0.01 0.00 0.00 175.02 177.06