#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 0.47 -1.52 1.45 0.28 -1.26 -4.60 120.64 115.46 2vil n GLU 2 Ca 0.00 0.17 -0.52 0.00 -0.16 0.00 0.00 57.16 56.65 2vil n GLU 2 Cb 0.00 -1.74 -0.05 0.00 1.43 0.00 0.00 31.44 31.08 2vil n GLU 2 CO 0.00 0.00 0.00 1.47 -0.16 0.00 0.00 177.13 178.44 2vil n LEU 3 N 3.72 0.43 0.00 -1.84 -0.00 -1.26 -4.94 117.00 113.12 2vil n LEU 3 Ca 0.26 1.14 -0.16 0.00 -0.00 0.00 0.00 56.01 57.26 2vil n LEU 3 Cb 0.05 -1.06 0.09 0.00 -0.00 0.00 0.00 43.42 42.51 2vil n LEU 3 CO 0.78 -1.84 0.41 -1.20 -0.00 0.00 0.00 177.39 175.55 2vil n SER 4 N 1.87 0.66 0.11 1.45 7.64 -1.26 -4.83 113.62 119.27 2vil n SER 4 Ca 0.18 -1.62 -0.03 0.00 1.01 0.00 0.00 58.87 58.40 2vil n SER 4 Cb 0.19 -0.48 0.15 0.00 -1.01 0.00 0.00 64.21 63.06 2vil n SER 4 CO 0.00 0.00 0.00 0.07 -3.01 0.00 0.00 175.04 172.10 2vil h LYS 5 N 0.00 0.11 0.00 1.43 -0.00 -1.94 -1.81 116.57 114.36 2vil h LYS 5 Ca -0.23 -0.08 -0.15 0.00 -0.00 0.00 0.00 60.65 60.19 2vil h LYS 5 Cb 0.78 0.01 -0.02 0.00 -0.00 0.00 0.00 32.23 33.00 2vil h LYS 5 CO 0.22 0.69 -0.74 0.87 -0.00 0.00 0.00 179.45 180.49 2vil h LYS 6 N 0.08 0.00 0.36 0.07 1.79 -1.96 0.83 116.57 117.74 2vil h LYS 6 Ca -0.01 0.00 -0.02 0.00 -2.18 0.00 0.00 60.65 58.45 2vil h LYS 6 Cb 1.10 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.76 2vil h LYS 6 CO 0.09 0.74 -0.17 0.28 -1.08 0.00 0.00 179.45 179.30 2vil h VAL 7 N 0.00 0.00 -0.36 0.50 2.07 -1.86 -3.25 116.25 113.35 2vil h VAL 7 Ca -0.01 -0.42 0.00 0.00 0.82 0.00 0.00 66.70 67.10 2vil h VAL 7 Cb 1.41 0.00 0.00 0.00 -1.52 0.00 0.00 31.29 31.18 2vil h VAL 7 CO 0.10 0.00 0.00 1.07 0.02 0.00 0.00 177.57 178.76 2vil n THR 8 N -4.46 0.75 0.00 2.57 5.66 -0.70 -4.07 114.28 114.03 2vil n THR 8 Ca -0.06 -0.57 0.00 0.00 -3.05 0.00 0.00 64.05 60.37 2vil n THR 8 Cb 0.19 0.09 0.00 0.00 -1.55 0.00 0.00 70.33 69.06 2vil n THR 8 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 2vil n GLY 9 N 0.91 -0.03 0.21 1.09 0.00 0.29 -4.06 105.19 103.61 2vil n GLY 9 Ca 0.13 0.00 0.05 0.00 0.00 0.00 0.00 46.02 46.21 2vil n GLY 9 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2vil h LYS 10 N 0.00 0.00 -6.68 1.61 1.57 -1.77 -3.43 116.57 107.87 2vil h LYS 10 Ca 0.00 0.00 -0.54 0.00 -1.87 0.00 0.00 60.65 58.24 2vil h LYS 10 Cb 0.00 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.29 2vil h LYS 10 CO 0.00 0.24 -0.97 1.28 -0.57 0.00 0.00 179.45 179.43 2vil n LEU 11 N -4.15 -1.39 -1.07 2.94 4.77 -1.26 -4.37 117.00 112.48 2vil n LEU 11 Ca -0.02 -1.17 0.00 0.00 -0.03 0.00 0.00 56.01 54.79 2vil n LEU 11 Cb 0.30 -1.93 0.00 0.00 -2.33 0.00 0.00 43.42 39.46 2vil n LEU 11 CO 0.36 0.61 -0.30 -0.67 -1.33 0.00 0.00 177.39 176.07 2vil n ASP 12 N -2.53 -6.15 -3.93 -1.43 2.03 -1.26 -5.02 116.55 98.26 2vil n ASP 12 Ca -0.16 0.82 -0.10 0.00 0.52 0.00 0.00 54.79 55.86 2vil n ASP 12 Cb 0.61 -2.78 -0.11 0.00 -0.72 0.00 0.00 41.12 38.13 2vil n ASP 12 CO 0.00 0.00 0.00 -0.54 -1.92 0.00 0.00 177.20 174.74 2vil s LYS 13 N -4.07 0.38 -1.18 -0.67 -0.14 -1.26 -4.90 119.74 107.90 2vil s LYS 13 Ca 0.00 -0.50 -0.17 0.00 -1.36 0.00 0.00 55.97 53.94 2vil s LYS 13 Cb 0.00 0.15 -0.01 0.00 -1.68 0.00 0.00 37.83 36.29 2vil s LYS 13 CO 0.00 -0.08 0.74 0.25 -0.76 0.00 0.00 175.35 175.51 2vil n THR 14 N 1.57 -5.47 -3.38 2.17 -2.24 -1.26 -4.97 114.28 100.70 2vil n THR 14 Ca -0.23 -0.88 0.02 0.00 -2.27 0.00 0.00 64.05 60.68 2vil n THR 14 Cb 0.55 -4.13 -0.04 0.00 -2.10 0.00 0.00 70.33 64.61 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 -3.54 -0.38 -0.01 4.28 2.01 -1.26 -5.14 115.64 111.60 2vil s THR 15 Ca 0.39 0.00 -0.30 0.00 0.31 0.00 0.00 61.69 62.08 2vil s THR 15 Cb -0.14 -1.00 -0.04 0.00 0.01 0.00 0.00 72.50 71.34 2vil s THR 15 CO 0.86 0.00 1.11 -2.16 -0.69 0.00 0.00 174.62 173.74 2vil s PRO 16 N 2.29 4.45 0.00 4.92 0.04 -1.26 -4.79 135.00 140.65 2vil s PRO 16 Ca -0.02 1.59 0.00 0.00 0.04 0.00 0.00 61.00 62.61 2vil s PRO 16 Cb -0.05 -3.46 0.00 0.00 0.04 0.00 0.00 34.50 31.03 2vil s PRO 16 CO -0.17 -0.25 0.00 0.41 0.04 0.00 0.00 177.00 177.03 2vil n GLY 17 N 3.14 2.86 3.36 0.56 0.00 -0.99 -5.01 105.19 109.12 2vil n GLY 17 Ca 0.09 -1.49 -0.23 0.00 0.00 0.00 0.00 46.02 44.39 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 -2.00 1.96 0.24 -0.61 -0.00 -1.26 -1.71 121.20 117.82 2vil s ILE 18 Ca 0.00 -1.98 0.10 0.00 -0.00 0.00 0.00 60.65 58.77 2vil s ILE 18 Cb 0.00 -1.93 -0.04 0.00 -0.00 0.00 0.00 42.46 40.48 2vil s ILE 18 CO 0.00 -0.29 -0.08 -1.10 -0.00 0.00 0.00 174.94 173.47 2vil s GLN 19 N -2.84 2.07 0.11 0.37 -0.21 -0.54 -4.90 119.66 113.72 2vil s GLN 19 Ca 0.18 -1.46 0.06 0.00 0.02 0.00 0.00 55.36 54.16 2vil s GLN 19 Cb -0.06 -2.06 -0.04 0.00 1.00 0.00 0.00 33.01 31.85 2vil s GLN 19 CO 0.08 0.38 -0.15 0.42 -2.12 0.00 0.00 175.29 173.90 2vil s ILE 20 N -2.18 1.35 -0.10 1.08 1.01 -1.08 -0.95 121.20 120.33 2vil s ILE 20 Ca 0.29 -1.65 0.02 0.00 0.00 0.00 0.00 60.65 59.31 2vil s ILE 20 Cb -0.07 -1.47 -0.01 0.00 0.01 0.00 0.00 42.46 40.91 2vil s ILE 20 CO 0.17 -0.35 -0.16 0.26 0.00 0.00 0.00 174.94 174.86 2vil s TRP 21 N -1.91 2.72 -0.13 3.97 0.51 -0.28 0.94 118.94 124.76 2vil s TRP 21 Ca 0.07 -0.60 -0.20 0.00 -2.12 0.00 0.00 56.10 53.25 2vil s TRP 21 Cb -0.06 -1.76 -0.04 0.00 -0.81 0.00 0.00 33.47 30.80 2vil s TRP 21 CO 0.03 -0.16 0.56 -0.98 -0.51 0.00 0.00 176.95 175.89 2vil s ARG 22 N 0.08 4.32 -0.96 4.98 1.70 0.19 -1.80 118.95 127.46 2vil s ARG 22 Ca -0.07 0.57 -0.02 0.00 -0.47 0.00 0.00 55.73 55.74 2vil s ARG 22 Cb -0.15 -3.48 0.32 0.00 -0.57 0.00 0.00 34.95 31.07 2vil s ARG 22 CO 0.05 0.02 1.93 -0.89 -1.08 0.00 0.00 175.30 175.33 2vil n ILE 23 N 4.00 5.12 0.00 4.99 2.08 -0.02 -0.90 119.36 134.62 2vil n ILE 23 Ca -0.04 -5.28 0.00 0.00 0.56 0.00 0.00 62.75 57.99 2vil n ILE 23 Cb 0.51 -1.44 0.00 0.00 -0.75 0.00 0.00 39.64 37.96 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 -0.20 0.00 0.00 0.38 0.00 -1.24 -3.97 120.64 115.61 2vil n GLU 24 Ca 0.50 0.00 0.00 0.00 0.00 0.00 0.00 57.16 57.66 2vil n GLU 24 Cb 0.25 0.00 0.00 0.00 0.00 0.00 0.00 31.44 31.69 2vil n GLU 24 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.13 177.40 2vil n ASN 25 N 0.00 0.00 -1.99 -1.84 6.94 -1.26 -3.63 115.26 113.48 2vil n ASN 25 Ca 0.00 0.62 -0.03 0.00 -0.02 0.00 0.00 54.58 55.15 2vil n ASN 25 Cb 0.00 -0.12 0.06 0.00 -2.36 0.00 0.00 39.78 37.36 2vil n ASN 25 CO 0.00 0.00 0.00 0.23 -1.03 0.00 0.00 177.26 176.46 2vil n MET 26 N -1.30 0.78 -3.90 -3.83 2.81 -1.26 -4.36 117.12 106.06 2vil n MET 26 Ca 0.00 -0.96 -0.11 0.00 -1.81 0.00 0.00 57.70 54.83 2vil n MET 26 Cb 0.00 0.40 -0.12 0.00 -0.71 0.00 0.00 33.22 32.79 2vil n MET 26 CO 0.00 0.00 0.00 -1.21 1.51 0.00 0.00 175.97 176.27 2vil s GLU 27 N 0.07 0.22 0.26 0.03 2.02 -1.26 -4.94 118.70 115.11 2vil s GLU 27 Ca 0.05 -0.27 -0.29 0.00 0.02 0.00 0.00 54.97 54.48 2vil s GLU 27 Cb 0.26 0.09 -0.09 0.00 0.10 0.00 0.00 34.13 34.48 2vil s GLU 27 CO -0.07 -0.04 1.13 1.41 0.02 0.00 0.00 175.26 177.71 2vil s MET 28 N -0.77 4.59 0.05 1.61 -2.45 -1.26 -3.73 119.30 117.33 2vil s MET 28 Ca -0.08 1.85 0.00 0.00 -1.25 0.00 0.00 55.69 56.21 2vil s MET 28 Cb -0.05 -3.19 -0.03 0.00 1.25 0.00 0.00 34.83 32.81 2vil s MET 28 CO -0.00 0.12 -0.05 0.08 1.05 0.00 0.00 175.02 176.23 2vil s VAL 29 N -0.94 0.34 -0.07 10.11 1.01 -0.08 -2.00 120.40 128.77 2vil s VAL 29 Ca 0.46 -1.41 -0.30 0.00 0.00 0.00 0.00 61.98 60.73 2vil s VAL 29 Cb -0.33 -0.98 -0.02 0.00 0.00 0.00 0.00 36.38 35.04 2vil s VAL 29 CO 0.41 -0.70 1.12 -2.16 0.00 0.00 0.00 175.10 173.77 2vil s PRO 30 N -2.69 4.39 -0.40 2.72 0.04 -1.26 0.55 135.00 138.35 2vil s PRO 30 Ca -0.03 1.56 0.02 0.00 0.04 0.00 0.00 61.00 62.59 2vil s PRO 30 Cb -0.02 -3.54 0.11 0.00 0.04 0.00 0.00 34.50 31.09 2vil s PRO 30 CO -0.04 -0.38 0.13 0.08 0.04 0.00 0.00 177.00 176.83 2vil s VAL 31 N 2.08 2.59 0.00 -0.36 1.01 0.27 -4.71 120.40 121.27 2vil s VAL 31 Ca 0.53 -2.49 0.00 0.00 0.00 0.00 0.00 61.98 60.01 2vil s VAL 31 Cb -0.22 -2.85 0.00 0.00 0.00 0.00 0.00 36.38 33.31 2vil s VAL 31 CO 0.21 -0.67 0.00 -0.81 0.00 0.00 0.00 175.10 173.83 2vil n PRO 32 N 4.08 1.98 0.00 2.72 -0.04 -1.26 -2.64 135.00 139.84 2vil n PRO 32 Ca 0.03 0.00 0.10 0.00 -0.04 0.00 0.00 63.50 63.59 2vil n PRO 32 Cb 0.40 0.00 0.59 0.00 -0.04 0.00 0.00 33.50 34.45 2vil n PRO 32 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 2vil n THR 33 N -0.06 0.00 -0.03 0.52 -2.24 -1.26 -3.53 114.28 107.68 2vil n THR 33 Ca 0.00 0.00 -0.03 0.00 -2.27 0.00 0.00 64.05 61.75 2vil n THR 33 Cb 0.00 -0.42 0.20 0.00 -2.10 0.00 0.00 70.33 68.02 2vil n THR 33 CO 0.00 0.00 0.00 0.50 -0.57 0.00 0.00 175.07 175.00 2vil h LYS 34 N 0.00 0.60 0.00 -0.78 3.64 -1.99 -3.39 116.57 114.64 2vil h LYS 34 Ca 0.00 -0.18 -0.22 0.00 -1.27 0.00 0.00 60.65 58.97 2vil h LYS 34 Cb 0.00 -0.06 -0.14 0.00 -0.41 0.00 0.00 32.23 31.62 2vil h LYS 34 CO 0.00 0.71 -0.48 0.43 -2.27 0.00 0.00 179.45 177.84 2vil n SER 35 N -4.18 -2.81 -1.92 4.20 7.64 -1.23 -4.99 113.62 110.32 2vil n SER 35 Ca 0.01 -3.36 -0.18 0.00 1.01 0.00 0.00 58.87 56.35 2vil n SER 35 Cb 0.34 1.85 0.04 0.00 -1.01 0.00 0.00 64.21 65.43 2vil n SER 35 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2vil n TYR 36 N 1.44 1.69 0.01 1.43 0.18 -1.25 -4.23 117.16 116.43 2vil n TYR 36 Ca 0.08 -2.03 0.00 0.00 1.88 0.00 0.00 57.90 57.83 2vil n TYR 36 Cb 0.64 -0.99 0.00 0.00 -0.38 0.00 0.00 39.34 38.62 2vil n TYR 36 CO 0.00 0.00 0.00 0.41 -2.08 0.00 0.00 176.86 175.19 2vil n GLY 37 N 0.21 -0.20 3.56 -7.48 0.00 -1.26 -4.94 105.19 95.08 2vil n GLY 37 Ca 0.33 0.02 -0.41 0.00 0.00 0.00 0.00 46.02 45.97 2vil n GLY 37 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2vil s ASN 38 N -4.31 6.34 -0.07 1.61 0.01 -1.26 -1.09 114.94 116.17 2vil s ASN 38 Ca 0.00 -1.04 0.02 0.00 -0.71 0.00 0.00 52.86 51.13 2vil s ASN 38 Cb 0.00 -2.57 0.02 0.00 0.41 0.00 0.00 41.25 39.11 2vil s ASN 38 CO 0.00 -1.67 -0.10 0.72 -1.51 0.00 0.00 177.10 174.54 2vil s PHE 39 N 5.40 1.34 -0.25 2.20 -0.12 -0.74 -4.82 117.98 120.98 2vil s PHE 39 Ca 0.42 -0.50 -0.42 0.00 -0.05 0.00 0.00 56.93 56.38 2vil s PHE 39 Cb -0.03 -1.02 -0.19 0.00 -0.63 0.00 0.00 43.02 41.15 2vil s PHE 39 CO 0.00 -0.29 1.29 0.66 -0.05 0.00 0.00 175.22 176.83 2vil n TYR 40 N 3.98 1.17 1.96 3.49 4.01 -1.26 -3.18 117.16 127.33 2vil n TYR 40 Ca -0.22 1.06 0.16 0.00 -0.16 0.00 0.00 57.90 58.74 2vil n TYR 40 Cb 0.51 -2.07 0.92 0.00 -0.31 0.00 0.00 39.34 38.39 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 2.68 1.03 -2.76 -0.72 0.28 -0.32 -3.74 120.64 117.10 2vil n GLU 41 Ca 0.25 -0.06 -0.24 0.00 -0.16 0.00 0.00 57.16 56.95 2vil n GLU 41 Cb 0.01 -1.50 -0.02 0.00 1.43 0.00 0.00 31.44 31.36 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 1.02 5.06 0.00 -1.84 0.00 -1.24 -3.99 105.19 104.20 2vil n GLY 42 Ca 0.23 -2.48 0.00 0.00 0.00 0.00 0.00 46.02 43.77 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 -0.26 0.00 -3.66 1.61 9.92 0.46 -3.10 116.55 121.52 2vil n ASP 43 Ca 0.31 0.00 -0.12 0.00 -0.53 0.00 0.00 54.79 54.44 2vil n ASP 43 Cb 0.58 0.00 -0.06 0.00 -0.64 0.00 0.00 41.12 40.99 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 -2.65 -1.05 0.66 0.00 1.51 -0.28 -0.84 117.35 114.70 2vil s TYR 45 Ca -0.04 1.62 -0.11 0.00 -1.01 0.00 0.00 57.07 57.53 2vil s TYR 45 Cb -0.00 0.41 -0.02 0.00 -0.11 0.00 0.00 41.96 42.24 2vil s TYR 45 CO -0.04 -0.63 1.05 0.08 -1.11 0.00 0.00 175.55 174.90 2vil s VAL 46 N 2.71 4.34 -0.27 0.71 1.01 -0.74 -1.20 120.40 126.96 2vil s VAL 46 Ca 0.03 0.76 -0.00 0.00 0.00 0.00 0.00 61.98 62.77 2vil s VAL 46 Cb -0.13 -3.66 0.16 0.00 0.00 0.00 0.00 36.38 32.75 2vil s VAL 46 CO -0.16 -0.99 0.44 -0.22 0.00 0.00 0.00 175.10 174.17 2vil s LEU 47 N -5.34 -0.89 -0.44 3.92 0.20 -0.81 -1.12 118.68 114.20 2vil s LEU 47 Ca 0.56 0.17 -0.18 0.00 0.69 0.00 0.00 54.13 55.38 2vil s LEU 47 Cb -0.12 1.38 0.03 0.00 -0.43 0.00 0.00 46.19 47.04 2vil s LEU 47 CO 0.54 -0.31 0.48 -0.22 -0.29 0.00 0.00 176.35 176.56 2vil s LEU 48 N 2.62 4.88 -0.16 -0.68 2.96 -0.12 -0.86 118.68 127.32 2vil s LEU 48 Ca 0.13 -0.70 -0.10 0.00 -0.22 0.00 0.00 54.13 53.24 2vil s LEU 48 Cb -0.14 -2.43 -0.05 0.00 0.50 0.00 0.00 46.19 44.08 2vil s LEU 48 CO -0.22 -0.65 0.18 -0.55 -1.32 0.00 0.00 176.35 173.79 2vil s SER 49 N 1.99 6.34 0.01 3.68 0.15 -0.67 -1.46 113.70 123.74 2vil s SER 49 Ca 0.13 0.39 0.08 0.00 0.70 0.00 0.00 55.95 57.25 2vil s SER 49 Cb -0.17 -2.11 -0.02 0.00 -1.71 0.00 0.00 66.02 62.00 2vil s SER 49 CO 0.14 0.24 -0.23 -0.89 1.20 0.00 0.00 173.24 173.69 2vil s THR 50 N -0.11 1.87 -0.00 6.45 2.01 -0.69 0.23 115.64 125.40 2vil s THR 50 Ca 0.13 -1.15 -0.04 0.00 0.31 0.00 0.00 61.69 60.94 2vil s THR 50 Cb -0.12 -1.58 -0.00 0.00 0.01 0.00 0.00 72.50 70.80 2vil s THR 50 CO 0.02 0.40 0.08 -0.60 -0.69 0.00 0.00 174.62 173.83 2vil s ARG 51 N -0.88 0.35 0.67 4.92 3.52 -0.11 -2.34 118.95 125.07 2vil s ARG 51 Ca 0.09 -0.35 -0.10 0.00 -0.13 0.00 0.00 55.73 55.24 2vil s ARG 51 Cb -0.09 0.14 0.00 0.00 -1.56 0.00 0.00 34.95 33.44 2vil s ARG 51 CO 0.01 -0.07 1.05 -1.59 -0.81 0.00 0.00 175.30 173.88 2vil s LYS 52 N -1.10 3.05 0.00 5.12 0.00 -1.26 0.15 119.74 125.70 2vil s LYS 52 Ca -0.12 0.46 0.00 0.00 0.00 0.00 0.00 55.97 56.31 2vil s LYS 52 Cb -0.07 -2.08 0.00 0.00 0.00 0.00 0.00 37.83 35.69 2vil s LYS 52 CO 0.00 -0.87 0.00 0.25 0.00 0.00 0.00 175.35 174.74 2vil n THR 53 N -2.88 0.00 0.02 3.79 -2.24 0.16 -4.79 114.28 108.35 2vil n THR 53 Ca 0.06 0.00 -0.19 0.00 -2.27 0.00 0.00 64.05 61.65 2vil n THR 53 Cb 0.56 0.00 -0.10 0.00 -2.10 0.00 0.00 70.33 68.70 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 0.00 0.74 0.01 3.38 0.00 -1.97 -3.37 103.07 101.85 2vil h GLY 54 Ca 0.00 -1.22 -0.00 0.00 0.00 0.00 0.00 47.33 46.11 2vil h GLY 54 CO 0.00 1.08 -0.00 1.48 0.00 0.00 0.00 176.54 179.09 2vil h SER 55 N 0.32 -0.01 0.00 0.19 4.64 -2.02 -3.50 113.55 113.18 2vil h SER 55 Ca -0.10 -0.08 0.00 0.00 -0.47 0.00 0.00 61.79 61.14 2vil h SER 55 Cb 1.53 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.63 2vil h SER 55 CO 0.17 0.53 0.00 0.61 -0.87 0.00 0.00 176.83 177.28 2vil n GLY 56 N 1.74 3.24 0.00 -0.77 0.00 -1.26 -5.17 105.19 102.96 2vil n GLY 56 Ca -0.01 -0.05 0.00 0.00 0.00 0.00 0.00 46.02 45.96 2vil n GLY 56 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 2vil n PHE 57 N 0.00 -2.43 -3.37 1.61 3.01 -1.26 0.41 117.46 115.42 2vil n PHE 57 Ca 0.00 0.00 -0.11 0.00 1.01 0.00 0.00 57.45 58.35 2vil n PHE 57 Cb 0.00 0.00 -0.09 0.00 -0.01 0.00 0.00 39.48 39.38 2vil n PHE 57 CO 0.00 0.00 0.00 -1.12 1.01 0.00 0.00 176.76 176.65 2vil s SER 58 N -0.99 0.61 0.41 4.37 0.01 0.40 -4.74 113.70 113.77 2vil s SER 58 Ca 0.00 -0.05 -0.05 0.00 1.31 0.00 0.00 55.95 57.16 2vil s SER 58 Cb 0.00 0.93 -0.04 0.00 0.21 0.00 0.00 66.02 67.11 2vil s SER 58 CO 0.00 -0.32 0.70 -0.31 0.41 0.00 0.00 173.24 173.72 2vil s TYR 59 N 2.49 3.52 -0.37 2.43 1.51 -1.25 -0.94 117.35 124.75 2vil s TYR 59 Ca 0.11 0.75 0.05 0.00 -1.01 0.00 0.00 57.07 56.97 2vil s TYR 59 Cb -0.15 -2.22 0.17 0.00 -0.11 0.00 0.00 41.96 39.65 2vil s TYR 59 CO -0.19 -0.10 0.51 -0.80 -1.11 0.00 0.00 175.55 173.86 2vil s ASN 60 N -3.75 -0.36 0.04 2.29 0.01 0.13 -2.73 114.94 110.58 2vil s ASN 60 Ca 0.46 -0.88 -0.29 0.00 -0.71 0.00 0.00 52.86 51.44 2vil s ASN 60 Cb -0.10 1.38 -0.04 0.00 0.41 0.00 0.00 41.25 42.89 2vil s ASN 60 CO 0.38 -0.24 0.94 -0.63 -1.51 0.00 0.00 177.10 176.04 2vil s ILE 61 N 1.92 4.72 0.31 0.60 1.01 0.39 -1.67 121.20 128.48 2vil s ILE 61 Ca 0.15 1.99 0.11 0.00 0.00 0.00 0.00 60.65 62.89 2vil s ILE 61 Cb -0.10 -4.29 -0.06 0.00 0.01 0.00 0.00 42.46 38.03 2vil s ILE 61 CO -0.11 0.25 -0.14 -1.00 0.00 0.00 0.00 174.94 173.93 2vil s HIS 62 N 0.49 2.36 -0.35 3.97 3.76 -0.04 -0.59 115.29 124.90 2vil s HIS 62 Ca 0.48 -0.40 -0.01 0.00 -0.15 0.00 0.00 55.06 54.98 2vil s HIS 62 Cb -0.22 -1.19 0.12 0.00 1.11 0.00 0.00 32.58 32.41 2vil s HIS 62 CO 0.28 0.65 0.18 1.52 -0.85 0.00 0.00 174.74 176.51 2vil s TYR 63 N -2.55 1.02 0.32 1.40 1.13 -0.71 -1.93 117.35 116.03 2vil s TYR 63 Ca 0.31 -1.61 -0.29 0.00 -1.41 0.00 0.00 57.07 54.08 2vil s TYR 63 Cb -0.02 -1.22 -0.10 0.00 -1.10 0.00 0.00 41.96 39.52 2vil s TYR 63 CO 0.16 -0.83 1.21 -0.46 -2.51 0.00 0.00 175.55 173.12 2vil s TRP 64 N 1.28 3.25 -0.42 -3.49 -0.00 -0.34 -2.50 118.94 116.72 2vil s TRP 64 Ca 0.14 1.54 0.05 0.00 -0.00 0.00 0.00 56.10 57.84 2vil s TRP 64 Cb -0.21 -3.49 0.19 0.00 -0.00 0.00 0.00 33.47 29.96 2vil s TRP 64 CO -0.13 -1.29 0.40 1.28 -0.00 0.00 0.00 176.95 177.22 2vil n LEU 65 N 0.85 -0.10 -4.54 5.86 4.77 -0.50 -1.12 117.00 122.22 2vil n LEU 65 Ca 0.00 -4.51 -0.15 0.00 -0.03 0.00 0.00 56.01 51.32 2vil n LEU 65 Cb 0.43 0.49 -0.11 0.00 -2.33 0.00 0.00 43.42 41.91 2vil n LEU 65 CO 0.56 1.91 1.44 0.61 -1.33 0.00 0.00 177.39 180.58 2vil n GLY 66 N 2.41 -0.24 3.53 -0.72 0.00 0.20 -4.03 105.19 106.34 2vil n GLY 66 Ca 0.27 0.24 -0.36 0.00 0.00 0.00 0.00 46.02 46.17 2vil n GLY 66 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 2vil n LYS 67 N 7.96 0.57 0.00 1.61 2.85 -1.26 0.17 118.16 130.07 2vil n LYS 67 Ca 0.52 -0.06 0.00 0.00 -1.05 0.00 0.00 58.31 57.73 2vil n LYS 67 Cb 0.36 -2.62 0.00 0.00 -0.65 0.00 0.00 35.03 32.12 2vil n LYS 67 CO 0.00 0.00 0.00 0.09 -0.05 0.00 0.00 177.40 177.44 2vil n ASN 68 N 13.60 0.00 -1.56 -5.58 4.13 -1.26 -4.85 115.26 119.75 2vil n ASN 68 Ca 0.50 0.00 0.00 0.00 1.68 0.00 0.00 54.58 56.76 2vil n ASN 68 Cb 0.33 0.06 0.00 0.00 -1.54 0.00 0.00 39.78 38.63 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 -1.62 0.00 -4.61 6.41 3.41 -1.18 -5.00 113.62 111.03 2vil n SER 69 Ca 0.00 0.00 -0.24 0.00 -0.26 0.00 0.00 58.87 58.37 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 -1.64 4.20 0.49 4.04 1.04 -1.26 -4.99 113.70 115.59 2vil s SER 70 Ca 0.00 -0.91 0.28 0.00 0.48 0.00 0.00 55.95 55.81 2vil s SER 70 Cb 0.00 -0.58 1.37 0.00 0.10 0.00 0.00 66.02 66.91 2vil s SER 70 CO 0.00 -0.14 1.83 -0.61 0.98 0.00 0.00 173.24 175.30 2vil h GLN 71 N 1.88 0.14 -0.44 4.02 4.15 -2.00 0.28 115.11 123.14 2vil h GLN 71 Ca -0.43 -0.01 0.00 0.00 0.77 0.00 0.00 58.65 58.99 2vil h GLN 71 Cb 1.25 -0.03 -0.02 0.00 0.21 0.00 0.00 27.48 28.89 2vil h GLN 71 CO 0.64 0.09 0.28 0.38 -1.93 0.00 0.00 178.83 178.29 2vil h ASP 72 N 0.14 0.52 -0.81 -0.69 3.04 -1.98 -0.57 116.42 116.07 2vil h ASP 72 Ca 0.51 -0.03 0.08 0.00 -3.24 0.00 0.00 57.03 54.35 2vil h ASP 72 Cb 1.76 -0.13 -0.05 0.00 -1.04 0.00 0.00 39.33 39.87 2vil h ASP 72 CO -0.09 0.39 0.53 -0.08 -2.04 0.00 0.00 179.24 177.94 2vil h GLU 73 N 0.59 0.80 -0.51 4.15 4.81 -0.81 0.45 114.58 124.07 2vil h GLU 73 Ca 0.16 -0.05 -0.03 0.00 -0.13 0.00 0.00 59.36 59.32 2vil h GLU 73 Cb -0.04 -0.18 -0.02 0.00 0.63 0.00 0.00 28.75 29.13 2vil h GLU 73 CO -0.03 0.53 0.20 0.37 -0.73 0.00 0.00 179.01 179.35 2vil h GLN 74 N 0.82 0.73 0.00 1.92 4.15 -0.89 0.39 115.11 122.23 2vil h GLN 74 Ca 0.36 -0.10 0.00 0.00 0.77 0.00 0.00 58.65 59.67 2vil h GLN 74 Cb 0.32 -0.13 0.00 0.00 0.21 0.00 0.00 27.48 27.88 2vil h GLN 74 CO -0.13 0.60 -0.11 0.41 -1.93 0.00 0.00 178.83 177.67 2vil n GLY 75 N -1.11 -1.58 0.08 2.39 0.00 0.12 -1.67 105.19 103.42 2vil n GLY 75 Ca 0.04 -0.10 -0.11 0.00 0.00 0.00 0.00 46.02 45.86 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 2.70 -0.04 -0.00 4.61 0.00 0.18 -1.37 119.26 125.33 2vil h ALA 76 Ca 0.00 -0.33 -0.26 0.00 0.00 0.00 0.00 54.91 54.32 2vil h ALA 76 Cb 0.65 0.02 0.02 0.00 0.00 0.00 0.00 17.79 18.47 2vil h ALA 76 CO 0.00 -0.09 -1.02 0.00 0.00 0.00 0.00 179.25 178.15 2vil h ALA 77 N -0.18 0.19 -0.73 0.00 0.00 -1.47 -1.59 119.26 115.48 2vil h ALA 77 Ca -0.00 -0.70 -0.06 0.00 0.00 0.00 0.00 54.91 54.14 2vil h ALA 77 Cb 0.68 0.04 -0.03 0.00 0.00 0.00 0.00 17.79 18.48 2vil h ALA 77 CO 0.01 0.72 0.21 0.00 0.00 0.00 0.00 179.25 180.19 2vil h ALA 78 N 0.50 0.99 -0.17 0.00 0.00 -1.45 -1.28 119.26 117.84 2vil h ALA 78 Ca -0.12 -0.23 -0.12 0.00 0.00 0.00 0.00 54.91 54.44 2vil h ALA 78 Cb 1.66 -0.28 0.00 0.00 0.00 0.00 0.00 17.79 19.17 2vil h ALA 78 CO 0.19 0.67 -0.37 0.82 0.00 0.00 0.00 179.25 180.56 2vil h ILE 79 N 1.10 1.34 -0.64 0.00 2.04 -1.25 -2.46 117.51 117.64 2vil h ILE 79 Ca 0.23 -1.62 0.05 0.00 1.00 0.00 0.00 64.86 64.53 2vil h ILE 79 Cb 0.33 1.94 -0.04 0.00 -0.74 0.00 0.00 36.82 38.31 2vil h ILE 79 CO -0.00 0.49 0.43 1.88 0.00 0.00 0.00 178.15 180.94 2vil h TYR 80 N 0.21 0.67 -0.47 1.37 -1.99 -1.08 -0.27 116.97 115.41 2vil h TYR 80 Ca 0.00 0.02 -0.12 0.00 2.00 0.00 0.00 58.73 60.63 2vil h TYR 80 Cb 0.97 -0.22 -0.02 0.00 2.00 0.00 0.00 36.73 39.46 2vil h TYR 80 CO 0.10 0.37 -0.17 1.15 -0.00 0.00 0.00 178.16 179.60 2vil h THR 81 N 0.67 1.27 -0.72 -2.88 2.02 -1.08 -2.08 112.91 110.11 2vil h THR 81 Ca 0.27 -1.30 0.01 0.00 0.77 0.00 0.00 66.41 66.16 2vil h THR 81 Cb 0.22 1.09 -0.04 0.00 -1.74 0.00 0.00 68.15 67.68 2vil h THR 81 CO -0.08 0.45 0.48 0.74 0.37 0.00 0.00 175.52 177.47 2vil h THR 82 N 0.80 1.18 0.00 3.16 2.02 -0.59 -0.87 112.91 118.60 2vil h THR 82 Ca 0.12 -0.33 -0.06 0.00 0.77 0.00 0.00 66.41 66.90 2vil h THR 82 Cb 0.71 0.12 -0.01 0.00 -1.74 0.00 0.00 68.15 67.23 2vil h THR 82 CO 0.05 0.18 -0.30 1.56 0.37 0.00 0.00 175.52 177.38 2vil h GLN 83 N 0.97 0.00 -0.38 6.66 4.20 -1.12 -2.80 115.11 122.64 2vil h GLN 83 Ca 0.27 0.00 -0.02 0.00 0.06 0.00 0.00 58.65 58.96 2vil h GLN 83 Cb -0.10 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 27.67 2vil h GLN 83 CO -0.06 0.30 0.16 1.98 -0.67 0.00 0.00 178.83 180.54 2vil h MET 84 N 0.00 0.56 0.00 1.46 4.05 -0.46 -0.38 114.93 120.16 2vil h MET 84 Ca -0.00 -0.10 0.00 0.00 -0.28 0.00 0.00 59.70 59.32 2vil h MET 84 Cb 0.59 -0.09 0.00 0.00 -0.80 0.00 0.00 31.60 31.30 2vil h MET 84 CO 0.04 0.53 0.00 0.22 0.23 0.00 0.00 176.91 177.93 2vil h ASP 85 N 0.46 0.00 0.00 1.39 1.82 -1.18 -0.62 116.42 118.29 2vil h ASP 85 Ca 0.13 0.00 0.00 0.00 -0.39 0.00 0.00 57.03 56.77 2vil h ASP 85 Cb 0.18 0.00 0.00 0.00 0.68 0.00 0.00 39.33 40.19 2vil h ASP 85 CO -0.01 0.00 -0.23 -0.33 -1.61 0.00 0.00 179.24 177.06 2vil h GLU 86 N 0.00 0.00 -0.02 0.28 5.08 -1.10 -1.11 114.58 117.71 2vil h GLU 86 Ca 0.00 0.00 0.01 0.00 -1.00 0.00 0.00 59.36 58.37 2vil h GLU 86 Cb 0.02 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.27 2vil h GLU 86 CO 0.00 0.00 0.31 1.88 -1.00 0.00 0.00 179.01 180.20 2vil h TYR 87 N -0.63 0.00 0.00 4.33 0.05 -1.16 -2.68 116.97 116.88 2vil h TYR 87 Ca 0.00 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.78 2vil h TYR 87 Cb 0.23 0.00 0.00 0.00 1.01 0.00 0.00 36.73 37.97 2vil h TYR 87 CO -0.10 0.00 -0.37 1.28 -1.05 0.00 0.00 178.16 177.92 2vil n LEU 88 N -2.95 1.33 -3.32 3.88 4.77 -0.26 -4.74 117.00 115.71 2vil n LEU 88 Ca -0.02 0.54 -0.16 0.00 -0.03 0.00 0.00 56.01 56.34 2vil n LEU 88 Cb 0.36 -0.77 0.05 0.00 -2.33 0.00 0.00 43.42 40.73 2vil n LEU 88 CO 0.15 -0.48 0.06 0.61 -1.33 0.00 0.00 177.39 176.40 2vil n GLY 89 N 1.65 -1.15 0.00 -0.72 0.00 -0.42 -4.99 105.19 99.55 2vil n GLY 89 Ca -0.05 0.54 0.00 0.00 0.00 0.00 0.00 46.02 46.51 2vil n GLY 89 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2vil n SER 90 N -2.80 0.62 -1.14 1.61 3.41 -1.26 -4.98 113.62 109.07 2vil n SER 90 Ca -0.07 0.00 0.06 0.00 -0.26 0.00 0.00 58.87 58.60 2vil n SER 90 Cb 0.59 0.00 0.23 0.00 -0.26 0.00 0.00 64.21 64.77 2vil n SER 90 CO 0.00 0.00 0.00 1.33 -0.16 0.00 0.00 175.04 176.21 2vil n VAL 91 N 0.00 1.25 -0.59 -3.33 0.24 -1.26 -4.94 118.33 109.69 2vil n VAL 91 Ca 0.00 -0.75 -0.28 0.00 -2.04 0.00 0.00 64.34 61.26 2vil n VAL 91 Cb 0.00 -0.09 0.18 0.00 -1.47 0.00 0.00 33.84 32.46 2vil n VAL 91 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2vil n ALA 92 N 0.57 -3.33 -2.86 2.33 0.00 -1.25 -4.31 120.51 111.66 2vil n ALA 92 Ca 0.16 -1.29 -0.14 0.00 0.00 0.00 0.00 53.44 52.17 2vil n ALA 92 Cb 0.65 -1.36 -0.05 0.00 0.00 0.00 0.00 19.45 18.69 2vil n ALA 92 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 2vil s VAL 93 N -2.18 0.00 -0.04 0.00 1.01 -1.10 -4.86 120.40 113.22 2vil s VAL 93 Ca 0.52 -1.62 0.05 0.00 0.00 0.00 0.00 61.98 60.93 2vil s VAL 93 Cb -0.10 -2.58 -0.01 0.00 0.00 0.00 0.00 36.38 33.69 2vil s VAL 93 CO 0.57 0.00 -0.19 -1.10 0.00 0.00 0.00 175.10 174.37 2vil s GLN 94 N -3.24 1.92 0.07 2.72 -0.21 -1.25 -0.46 119.66 119.21 2vil s GLN 94 Ca 0.31 -0.69 0.04 0.00 0.02 0.00 0.00 55.36 55.04 2vil s GLN 94 Cb 0.00 -1.69 -0.03 0.00 1.00 0.00 0.00 33.01 32.29 2vil s GLN 94 CO 0.19 0.31 -0.12 -1.01 -2.12 0.00 0.00 175.29 172.53 2vil s HIS 95 N -0.10 1.09 -0.20 0.91 3.76 0.24 -4.95 115.29 116.04 2vil s HIS 95 Ca -0.02 -0.49 -0.05 0.00 -0.15 0.00 0.00 55.06 54.35 2vil s HIS 95 Cb -0.11 -0.62 -0.02 0.00 1.11 0.00 0.00 32.58 32.94 2vil s HIS 95 CO 0.02 0.03 -0.01 0.50 -0.85 0.00 0.00 174.74 174.43 2vil s ARG 96 N -1.85 3.60 0.19 1.40 3.52 -1.26 -1.75 118.95 122.81 2vil s ARG 96 Ca -0.02 -0.53 0.03 0.00 -0.13 0.00 0.00 55.73 55.08 2vil s ARG 96 Cb -0.09 -3.06 -0.05 0.00 -1.56 0.00 0.00 34.95 30.19 2vil s ARG 96 CO 0.02 0.01 -0.03 -1.21 -0.81 0.00 0.00 175.30 173.28 2vil s GLU 97 N 0.99 1.21 0.27 5.12 0.41 -1.04 -4.86 118.70 120.80 2vil s GLU 97 Ca 0.01 -1.58 -0.07 0.00 -0.41 0.00 0.00 54.97 52.92 2vil s GLU 97 Cb -0.14 -0.55 0.03 0.00 -1.78 0.00 0.00 34.13 31.68 2vil s GLU 97 CO 0.02 -0.05 0.49 0.28 -0.49 0.00 0.00 175.26 175.50 2vil n VAL 98 N -0.32 0.00 0.44 2.63 0.31 -1.26 -1.41 118.33 118.72 2vil n VAL 98 Ca -0.07 -0.90 0.05 0.00 -0.01 0.00 0.00 64.34 63.41 2vil n VAL 98 Cb 0.63 0.73 0.24 0.00 -0.91 0.00 0.00 33.84 34.52 2vil n VAL 98 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2vil n GLN 99 N -0.39 0.13 -0.25 5.55 10.64 -1.26 -1.78 117.38 130.02 2vil n GLN 99 Ca -0.04 0.20 0.01 0.00 -1.83 0.00 0.00 57.00 55.34 2vil n GLN 99 Cb 0.42 -1.50 0.01 0.00 -0.86 0.00 0.00 30.24 28.31 2vil n GLN 99 CO 0.00 0.00 0.00 0.41 -1.83 0.00 0.00 177.06 175.64 2vil n GLY 100 N -0.49 -0.55 0.00 2.61 0.00 -1.26 -4.79 105.19 100.72 2vil n GLY 100 Ca 0.04 -0.07 0.00 0.00 0.00 0.00 0.00 46.02 46.00 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 -0.11 0.00 -0.05 1.61 8.25 -0.73 -4.64 115.22 119.55 2vil n HIS 101 Ca 0.01 0.00 -0.03 0.00 -0.26 0.00 0.00 57.72 57.44 2vil n HIS 101 Cb 0.59 0.00 0.16 0.00 1.12 0.00 0.00 29.99 31.87 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 -1.28 2.47 0.00 -0.41 0.00 -0.82 -4.53 120.64 116.07 2vil n GLU 102 Ca 0.00 -1.60 0.00 0.00 0.00 0.00 0.00 57.16 55.56 2vil n GLU 102 Cb 0.00 -1.78 0.00 0.00 0.00 0.00 0.00 31.44 29.66 2vil n GLU 102 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.13 176.00 2vil n SER 103 N 0.05 0.00 0.25 -1.84 3.41 -1.26 -1.66 113.62 112.56 2vil n SER 103 Ca 0.21 0.00 0.16 0.00 -0.26 0.00 0.00 58.87 58.98 2vil n SER 103 Cb 0.89 0.00 0.60 0.00 -0.26 0.00 0.00 64.21 65.44 2vil n SER 103 CO 0.00 0.00 0.00 -0.33 -0.16 0.00 0.00 175.04 174.55 2vil h GLU 104 N 0.00 0.00 0.05 4.33 5.08 -1.97 -2.68 114.58 119.39 2vil h GLU 104 Ca 0.00 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.36 2vil h GLU 104 Cb 0.00 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.25 2vil h GLU 104 CO 0.00 0.00 -0.02 1.15 -1.00 0.00 0.00 179.01 179.14 2vil h THR 105 N 0.00 1.26 0.45 1.13 2.02 -1.85 0.41 112.91 116.32 2vil h THR 105 Ca 0.00 -1.07 -0.02 0.00 0.77 0.00 0.00 66.41 66.09 2vil h THR 105 Cb 0.54 1.96 0.00 0.00 -1.74 0.00 0.00 68.15 68.91 2vil h THR 105 CO 0.00 0.27 -0.22 0.15 0.37 0.00 0.00 175.52 176.09 2vil h PHE 106 N -0.54 -0.56 -0.25 3.16 3.57 -1.31 -2.41 116.94 118.59 2vil h PHE 106 Ca -0.01 -0.01 0.07 0.00 3.53 0.00 0.00 57.97 61.55 2vil h PHE 106 Cb 0.49 0.19 -0.01 0.00 2.79 0.00 0.00 35.95 39.40 2vil h PHE 106 CO 0.08 -0.24 0.31 -0.09 -2.23 0.00 0.00 178.31 176.14 2vil h ARG 107 N -1.00 0.00 0.80 1.11 2.43 -1.53 -1.35 114.38 114.85 2vil h ARG 107 Ca -0.06 0.00 -0.04 0.00 -0.81 0.00 0.00 59.98 59.07 2vil h ARG 107 Cb 0.57 0.00 0.01 0.00 -0.42 0.00 0.00 29.97 30.13 2vil h ARG 107 CO 0.10 0.00 -0.38 0.00 -1.51 0.00 0.00 179.97 178.18 2vil h ALA 108 N 1.61 -1.07 0.00 2.80 0.00 0.31 -1.54 119.26 121.37 2vil h ALA 108 Ca 0.12 -0.24 0.00 0.00 0.00 0.00 0.00 54.91 54.79 2vil h ALA 108 Cb 0.74 0.42 0.00 0.00 0.00 0.00 0.00 17.79 18.94 2vil h ALA 108 CO -0.00 -1.07 0.00 0.66 0.00 0.00 0.00 179.25 178.84 2vil n TYR 109 N -5.53 0.00 -3.78 0.00 4.01 -0.60 -4.20 117.16 107.06 2vil n TYR 109 Ca -0.14 0.00 -0.36 0.00 -0.16 0.00 0.00 57.90 57.24 2vil n TYR 109 Cb 0.43 -0.43 -0.11 0.00 -0.31 0.00 0.00 39.34 38.92 2vil n TYR 109 CO 0.00 0.00 0.00 -0.06 -0.46 0.00 0.00 176.86 176.34 2vil s PHE 110 N -2.87 3.53 -1.37 -0.72 0.40 -0.58 -4.80 117.98 111.57 2vil s PHE 110 Ca 0.08 -2.56 -0.06 0.00 -0.60 0.00 0.00 56.93 53.78 2vil s PHE 110 Cb 0.08 -3.19 0.09 0.00 0.51 0.00 0.00 43.02 40.51 2vil s PHE 110 CO 0.21 -0.92 2.46 1.63 0.70 0.00 0.00 175.22 179.30 2vil n LYS 111 N 4.18 4.42 0.00 0.44 5.02 -1.25 -4.52 118.16 126.45 2vil n LYS 111 Ca 0.01 -3.26 0.00 0.00 -2.02 0.00 0.00 58.31 53.04 2vil n LYS 111 Cb 0.40 -2.67 0.00 0.00 -0.02 0.00 0.00 35.03 32.74 2vil n LYS 111 CO 0.00 0.00 0.00 1.04 -0.52 0.00 0.00 177.40 177.92 2vil n GLN 112 N 2.10 0.00 0.00 1.97 1.13 -1.26 -5.16 117.38 116.16 2vil n GLN 112 Ca 0.64 0.00 0.00 0.00 -1.94 0.00 0.00 57.00 55.70 2vil n GLN 112 Cb 0.25 0.00 0.00 0.00 0.11 0.00 0.00 30.24 30.60 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 -0.10 3.49 0.00 1.08 0.00 -1.26 -5.15 105.19 103.25 2vil n GLY 113 Ca 0.00 -0.46 0.00 0.00 0.00 0.00 0.00 46.02 45.56 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 0.00 0.00 -4.99 0.99 7.99 -1.26 -4.89 117.00 114.84 2vil n LEU 114 Ca 0.00 0.00 -0.20 0.00 -0.01 0.00 0.00 56.01 55.80 2vil n LEU 114 Cb 0.00 0.00 0.04 0.00 -0.11 0.00 0.00 43.42 43.35 2vil n LEU 114 CO 0.00 0.00 0.33 -0.63 -1.51 0.00 0.00 177.39 175.58 2vil s ILE 115 N 0.00 2.67 -0.18 -0.08 1.01 -0.25 -4.94 121.20 119.44 2vil s ILE 115 Ca 0.00 -0.75 -0.09 0.00 0.00 0.00 0.00 60.65 59.80 2vil s ILE 115 Cb 0.00 -2.92 0.06 0.00 0.01 0.00 0.00 42.46 39.61 2vil s ILE 115 CO 0.00 0.00 0.42 -0.31 0.00 0.00 0.00 174.94 175.05 2vil s TYR 116 N -2.69 -0.63 0.38 3.97 1.51 -1.26 -1.79 117.35 116.84 2vil s TYR 116 Ca 0.58 1.33 0.07 0.00 -1.01 0.00 0.00 57.07 58.04 2vil s TYR 116 Cb -0.10 0.28 0.00 0.00 -0.11 0.00 0.00 41.96 42.04 2vil s TYR 116 CO 0.38 -0.35 0.52 0.15 -1.11 0.00 0.00 175.55 175.14 2vil s LYS 117 N 1.44 2.94 0.26 -0.62 -0.14 -1.19 -4.55 119.74 117.88 2vil s LYS 117 Ca -0.09 -1.15 -0.06 0.00 -1.36 0.00 0.00 55.97 53.31 2vil s LYS 117 Cb -0.08 -2.78 -0.06 0.00 -1.68 0.00 0.00 37.83 33.24 2vil s LYS 117 CO -0.13 -0.13 0.53 1.14 -0.76 0.00 0.00 175.35 176.00 2vil s GLN 118 N -4.27 3.66 0.35 1.68 -2.07 -1.26 -1.17 119.66 116.57 2vil s GLN 118 Ca 0.51 0.03 0.00 0.00 -1.82 0.00 0.00 55.36 54.08 2vil s GLN 118 Cb -0.10 -2.67 0.00 0.00 -1.09 0.00 0.00 33.01 29.15 2vil s GLN 118 CO 0.32 0.26 0.00 0.41 -1.32 0.00 0.00 175.29 174.96 2vil n GLY 119 N -0.69 -1.87 0.00 2.60 0.00 -1.26 -4.45 105.19 99.52 2vil n GLY 119 Ca -0.01 -0.64 0.00 0.00 0.00 0.00 0.00 46.02 45.37 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 -3.66 -3.07 0.86 -0.02 0.00 -1.24 -4.59 105.19 93.48 2vil n GLY 120 Ca -0.04 -0.40 0.05 0.00 0.00 0.00 0.00 46.02 45.63 2vil n GLY 120 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 173.32 174.87 2vil n VAL 121 N 0.00 0.79 1.61 1.61 3.14 -1.24 -3.98 118.33 120.26 2vil n VAL 121 Ca 0.00 -0.58 0.12 0.00 -2.96 0.00 0.00 64.34 60.92 2vil n VAL 121 Cb 0.00 0.06 0.72 0.00 -1.06 0.00 0.00 33.84 33.56 2vil n VAL 121 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 2vil n ALA 122 N 0.54 2.45 0.28 1.55 0.00 -1.26 -3.60 120.51 120.46 2vil n ALA 122 Ca 0.13 -0.15 0.15 0.00 0.00 0.00 0.00 53.44 53.57 2vil n ALA 122 Cb 0.45 -1.39 0.72 0.00 0.00 0.00 0.00 19.45 19.22 2vil n ALA 122 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 2vil h SER 123 N 0.00 0.00 -0.94 0.00 0.87 -1.78 -1.60 113.55 110.10 2vil h SER 123 Ca 0.00 0.00 0.28 0.00 -1.23 0.00 0.00 61.79 60.84 2vil h SER 123 Cb 0.00 0.00 -0.15 0.00 -0.44 0.00 0.00 62.40 61.81 2vil h SER 123 CO 0.00 0.00 0.31 1.23 -0.53 0.00 0.00 176.83 177.84 2vil h GLY 124 N 0.00 1.60 -0.34 5.77 0.00 -1.93 -3.39 103.07 104.77 2vil h GLY 124 Ca 0.05 -0.06 -0.17 0.00 0.00 0.00 0.00 47.33 47.15 2vil h GLY 124 CO -0.00 -0.47 0.15 1.03 0.00 0.00 0.00 176.54 177.25 2vil n MET 125 N -5.24 -0.67 0.00 4.80 2.00 -0.60 -5.28 117.12 112.13 2vil n MET 125 Ca 0.26 -0.81 0.00 0.00 0.00 0.00 0.00 57.70 57.15 2vil n MET 125 Cb 0.83 -0.56 0.00 0.00 0.00 0.00 0.00 33.22 33.50 2vil n MET 125 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 175.97 176.33