#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 0.62 -0.16 5.55 0.28 -1.26 -4.67 120.64 121.01 2vil n GLU 2 Ca 0.00 0.23 0.02 0.00 -0.16 0.00 0.00 57.16 57.25 2vil n GLU 2 Cb 0.00 -1.81 0.09 0.00 1.43 0.00 0.00 31.44 31.15 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 3.07 1.58 -4.89 -1.84 -0.00 -1.26 -4.82 117.00 108.84 2vil n LEU 3 Ca 0.23 -0.79 -0.30 0.00 -0.00 0.00 0.00 56.01 55.14 2vil n LEU 3 Cb 0.10 -0.32 -0.04 0.00 -0.00 0.00 0.00 43.42 43.16 2vil n LEU 3 CO 0.70 0.30 0.17 -0.94 -0.00 0.00 0.00 177.39 177.62 2vil s SER 4 N -0.62 6.51 0.00 1.45 1.04 -1.26 -1.65 113.70 119.17 2vil s SER 4 Ca 0.13 0.75 0.00 0.00 0.48 0.00 0.00 55.95 57.31 2vil s SER 4 Cb 0.08 -2.16 0.00 0.00 0.10 0.00 0.00 66.02 64.05 2vil s SER 4 CO 0.06 -0.10 0.00 1.17 0.98 0.00 0.00 173.24 175.35 2vil n LYS 5 N -0.47 0.00 -0.07 4.02 3.00 -1.26 -4.36 118.16 119.02 2vil n LYS 5 Ca -0.01 0.00 0.01 0.00 -0.00 0.00 0.00 58.31 58.31 2vil n LYS 5 Cb 0.53 0.00 0.04 0.00 0.00 0.00 0.00 35.03 35.60 2vil n LYS 5 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.40 178.57 2vil n LYS 6 N 0.00 1.31 0.24 1.64 4.81 -1.26 -3.75 118.16 121.15 2vil n LYS 6 Ca 0.00 -0.30 0.00 0.00 -0.87 0.00 0.00 58.31 57.14 2vil n LYS 6 Cb 0.00 -1.39 0.00 0.00 0.02 0.00 0.00 35.03 33.66 2vil n LYS 6 CO 0.00 0.00 0.00 0.28 1.17 0.00 0.00 177.40 178.85 2vil n VAL 7 N -0.06 0.00 0.13 3.15 0.31 -1.24 -4.88 118.33 115.74 2vil n VAL 7 Ca 0.03 0.00 0.08 0.00 -0.01 0.00 0.00 64.34 64.43 2vil n VAL 7 Cb 0.24 -0.03 0.41 0.00 -0.91 0.00 0.00 33.84 33.55 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 -3.47 1.31 0.31 2.52 -2.24 -0.66 -0.63 114.28 111.42 2vil n THR 8 Ca 0.00 0.64 0.14 0.00 -2.27 0.00 0.00 64.05 62.56 2vil n THR 8 Cb 0.00 -1.64 0.72 0.00 -2.10 0.00 0.00 70.33 67.32 2vil n THR 8 CO 0.00 0.00 0.00 1.23 -0.57 0.00 0.00 175.07 175.73 2vil h GLY 9 N 0.13 0.00 0.00 3.38 0.00 -1.86 -3.38 103.07 101.34 2vil h GLY 9 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 2vil h GLY 9 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 176.54 177.12 2vil n LYS 10 N -2.91 0.00 -0.71 4.80 2.85 -0.89 -4.99 118.16 116.32 2vil n LYS 10 Ca -0.01 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.25 2vil n LYS 10 Cb 0.47 0.00 0.00 0.00 -0.65 0.00 0.00 35.03 34.85 2vil n LYS 10 CO 0.00 0.00 0.00 1.28 -0.05 0.00 0.00 177.40 178.63 2vil n LEU 11 N -0.50 0.50 -1.79 -5.58 4.32 0.19 -4.65 117.00 109.49 2vil n LEU 11 Ca 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 56.01 55.99 2vil n LEU 11 Cb 0.00 -0.76 0.00 0.00 -1.62 0.00 0.00 43.42 41.04 2vil n LEU 11 CO 0.00 -0.25 -0.47 0.47 -1.22 0.00 0.00 177.39 175.92 2vil n ASP 12 N 0.00 -8.91 0.31 -1.43 8.00 -1.26 -4.40 116.55 108.86 2vil n ASP 12 Ca 0.00 1.32 0.18 0.00 0.71 0.00 0.00 54.79 57.00 2vil n ASP 12 Cb 0.00 -5.10 0.95 0.00 -0.02 0.00 0.00 41.12 36.95 2vil n ASP 12 CO 0.00 0.00 0.00 0.11 -0.39 0.00 0.00 177.20 176.92 2vil h LYS 13 N 2.33 0.00 -1.56 -1.24 1.79 -2.04 -3.43 116.57 112.42 2vil h LYS 13 Ca 0.00 0.00 -0.10 0.00 -2.18 0.00 0.00 60.65 58.37 2vil h LYS 13 Cb 0.00 0.00 -0.04 0.00 -1.58 0.00 0.00 32.23 30.61 2vil h LYS 13 CO 0.00 0.00 -0.09 -2.37 -1.08 0.00 0.00 179.45 175.91 2vil n THR 14 N -2.87 0.00 -0.94 -0.16 5.66 -1.26 -4.61 114.28 110.10 2vil n THR 14 Ca -0.02 0.00 0.05 0.00 -3.05 0.00 0.00 64.05 61.03 2vil n THR 14 Cb 0.22 -0.47 -0.01 0.00 -1.55 0.00 0.00 70.33 68.51 2vil n THR 14 CO 0.00 0.00 0.00 1.07 -3.05 0.00 0.00 175.07 173.09 2vil n THR 15 N -1.25 0.00 -2.57 1.09 5.66 -1.26 -3.89 114.28 112.05 2vil n THR 15 Ca -0.05 0.00 -0.41 0.00 -3.05 0.00 0.00 64.05 60.54 2vil n THR 15 Cb 0.17 -0.14 -0.03 0.00 -1.55 0.00 0.00 70.33 68.78 2vil n THR 15 CO 0.00 0.00 0.00 -2.16 -3.05 0.00 0.00 175.07 169.86 2vil s PRO 16 N -1.06 3.59 0.00 1.09 0.04 -1.25 -4.66 135.00 132.75 2vil s PRO 16 Ca 0.00 -1.13 0.00 0.00 0.04 0.00 0.00 61.00 59.91 2vil s PRO 16 Cb 0.00 -5.33 0.00 0.00 0.04 0.00 0.00 34.50 29.21 2vil s PRO 16 CO 0.00 -2.19 0.00 0.41 0.04 0.00 0.00 177.00 175.26 2vil n GLY 17 N 6.83 1.77 0.00 0.56 0.00 0.62 -4.91 105.19 110.06 2vil n GLY 17 Ca 0.32 0.31 0.00 0.00 0.00 0.00 0.00 46.02 46.65 2vil n GLY 17 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 2vil n ILE 18 N 0.00 0.00 -3.76 -0.61 -5.35 -1.26 -1.09 119.36 107.29 2vil n ILE 18 Ca 0.00 0.00 -0.01 0.00 -0.27 0.00 0.00 62.75 62.47 2vil n ILE 18 Cb 0.00 0.00 -0.00 0.00 -1.74 0.00 0.00 39.64 37.90 2vil n ILE 18 CO 0.00 0.00 0.00 -1.10 -1.76 0.00 0.00 176.55 173.69 2vil s GLN 19 N -0.62 0.89 0.20 6.28 -0.21 -0.87 -4.87 119.66 120.46 2vil s GLN 19 Ca 0.00 -0.53 -0.07 0.00 0.02 0.00 0.00 55.36 54.78 2vil s GLN 19 Cb 0.00 0.28 -0.02 0.00 1.00 0.00 0.00 33.01 34.27 2vil s GLN 19 CO 0.00 -0.41 0.28 0.42 -2.12 0.00 0.00 175.29 173.45 2vil s ILE 20 N -2.64 0.03 -0.10 1.08 1.01 -1.08 -0.87 121.20 118.64 2vil s ILE 20 Ca 0.17 -1.63 -0.01 0.00 0.00 0.00 0.00 60.65 59.18 2vil s ILE 20 Cb 0.00 -2.17 0.03 0.00 0.01 0.00 0.00 42.46 40.33 2vil s ILE 20 CO 0.01 -0.13 -0.01 0.26 0.00 0.00 0.00 174.94 175.06 2vil s TRP 21 N -4.05 0.91 -0.19 3.97 0.51 0.15 0.26 118.94 120.50 2vil s TRP 21 Ca 0.26 -0.39 -0.29 0.00 -2.12 0.00 0.00 56.10 53.56 2vil s TRP 21 Cb 0.04 -0.93 0.00 0.00 -0.81 0.00 0.00 33.47 31.76 2vil s TRP 21 CO 0.07 -0.41 1.07 1.03 -0.51 0.00 0.00 176.95 178.20 2vil s ARG 22 N 1.90 4.29 -0.38 4.98 0.52 0.11 -2.11 118.95 128.26 2vil s ARG 22 Ca 0.04 1.42 0.07 0.00 -0.52 0.00 0.00 55.73 56.74 2vil s ARG 22 Cb -0.13 -3.64 0.68 0.00 0.52 0.00 0.00 34.95 32.38 2vil s ARG 22 CO -0.06 -0.58 1.81 -0.89 0.02 0.00 0.00 175.30 175.60 2vil n ILE 23 N 5.16 3.01 -0.28 1.52 -0.00 -0.57 0.61 119.36 128.81 2vil n ILE 23 Ca 0.12 -1.91 -0.29 0.00 -0.00 0.00 0.00 62.75 60.67 2vil n ILE 23 Cb 0.46 -0.40 0.28 0.00 -0.00 0.00 0.00 39.64 39.98 2vil n ILE 23 CO 0.00 0.00 0.00 -1.84 -0.00 0.00 0.00 176.55 174.71 2vil n GLU 24 N -0.75 -4.46 -2.13 0.38 0.28 -1.26 -1.58 120.64 111.12 2vil n GLU 24 Ca 0.49 -1.32 -0.02 0.00 -0.16 0.00 0.00 57.16 56.14 2vil n GLU 24 Cb 1.47 -1.88 -0.00 0.00 1.43 0.00 0.00 31.44 32.46 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 -5.22 -1.29 -3.56 -1.84 0.23 -1.26 0.04 115.26 102.36 2vil n ASN 25 Ca 0.12 0.35 -0.22 0.00 -0.53 0.00 0.00 54.58 54.29 2vil n ASN 25 Cb 0.57 -1.31 0.05 0.00 -2.08 0.00 0.00 39.78 37.01 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 -2.20 -3.32 0.00 -3.83 2.81 -1.06 -4.94 117.12 104.58 2vil n MET 26 Ca -0.03 0.65 0.00 0.00 -1.81 0.00 0.00 57.70 56.52 2vil n MET 26 Cb 0.41 -5.09 0.00 0.00 -0.71 0.00 0.00 33.22 27.82 2vil n MET 26 CO 0.00 0.00 0.00 0.39 1.51 0.00 0.00 175.97 177.87 2vil n GLU 27 N -3.98 0.00 -3.52 0.03 -0.58 0.11 -5.07 120.64 107.62 2vil n GLU 27 Ca -0.18 0.00 -0.18 0.00 -0.42 0.00 0.00 57.16 56.38 2vil n GLU 27 Cb 0.64 0.00 -0.06 0.00 -0.57 0.00 0.00 31.44 31.45 2vil n GLU 27 CO 0.00 0.00 0.00 1.41 -0.48 0.00 0.00 177.13 178.06 2vil s MET 28 N 4.44 1.05 -0.07 3.49 1.75 -1.23 -4.06 119.30 124.67 2vil s MET 28 Ca 0.00 0.28 -0.31 0.00 -1.25 0.00 0.00 55.69 54.41 2vil s MET 28 Cb 0.00 0.50 0.07 0.00 2.84 0.00 0.00 34.83 38.24 2vil s MET 28 CO 0.00 -0.32 0.69 0.08 -0.65 0.00 0.00 175.02 174.81 2vil s VAL 29 N -1.15 0.00 -0.05 10.11 1.01 0.20 -1.16 120.40 129.36 2vil s VAL 29 Ca -0.11 0.00 -0.30 0.00 0.00 0.00 0.00 61.98 61.57 2vil s VAL 29 Cb -0.00 -1.00 -0.03 0.00 0.00 0.00 0.00 36.38 35.35 2vil s VAL 29 CO 0.10 0.00 1.15 -2.16 0.00 0.00 0.00 175.10 174.19 2vil s PRO 30 N -1.09 4.38 -0.37 2.72 0.04 -1.26 0.07 135.00 139.49 2vil s PRO 30 Ca -0.10 1.61 -0.05 0.00 0.04 0.00 0.00 61.00 62.50 2vil s PRO 30 Cb -0.00 -3.53 0.07 0.00 0.04 0.00 0.00 34.50 31.08 2vil s PRO 30 CO 0.09 -0.39 0.15 0.08 0.04 0.00 0.00 177.00 176.97 2vil s VAL 31 N 2.02 3.54 0.00 -0.36 1.01 0.14 -4.82 120.40 121.94 2vil s VAL 31 Ca 0.54 -1.55 0.00 0.00 0.00 0.00 0.00 61.98 60.98 2vil s VAL 31 Cb -0.24 -3.18 0.00 0.00 0.00 0.00 0.00 36.38 32.96 2vil s VAL 31 CO 0.22 -0.40 0.00 -0.81 0.00 0.00 0.00 175.10 174.11 2vil n PRO 32 N 4.72 1.22 0.18 2.72 -0.04 -1.26 -2.64 135.00 139.90 2vil n PRO 32 Ca -0.09 0.00 0.12 0.00 -0.04 0.00 0.00 63.50 63.49 2vil n PRO 32 Cb 0.43 0.00 0.18 0.00 -0.04 0.00 0.00 33.50 34.07 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 -0.15 0.00 -0.41 0.52 1.35 -1.96 -3.08 112.91 109.18 2vil h THR 33 Ca 0.00 -0.89 -0.23 0.00 -0.55 0.00 0.00 66.41 64.74 2vil h THR 33 Cb 0.00 1.80 -0.12 0.00 -1.73 0.00 0.00 68.15 68.09 2vil h THR 33 CO 0.00 0.00 0.29 1.17 -0.25 0.00 0.00 175.52 176.73 2vil n LYS 34 N -2.86 1.55 0.00 4.72 4.81 -1.26 -4.05 118.16 121.07 2vil n LYS 34 Ca 0.04 -1.26 0.00 0.00 -0.87 0.00 0.00 58.31 56.22 2vil n LYS 34 Cb 0.51 -1.49 0.00 0.00 0.02 0.00 0.00 35.03 34.07 2vil n LYS 34 CO 0.00 0.00 0.00 0.43 1.17 0.00 0.00 177.40 179.00 2vil n SER 35 N -0.01 0.00 -4.57 3.14 7.64 -1.23 -5.10 113.62 113.49 2vil n SER 35 Ca 0.25 0.00 -0.55 0.00 1.01 0.00 0.00 58.87 59.58 2vil n SER 35 Cb 0.88 0.00 -0.07 0.00 -1.01 0.00 0.00 64.21 64.02 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 -1.38 1.27 0.00 1.43 4.11 -1.16 -3.45 117.16 117.98 2vil n TYR 36 Ca 0.00 0.77 0.00 0.00 -0.00 0.00 0.00 57.90 58.67 2vil n TYR 36 Cb 0.00 -2.26 0.00 0.00 -0.00 0.00 0.00 39.34 37.08 2vil n TYR 36 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.86 177.27 2vil n GLY 37 N 2.29 1.87 3.51 -7.48 0.00 -1.26 -5.03 105.19 99.09 2vil n GLY 37 Ca 0.19 -0.48 -0.43 0.00 0.00 0.00 0.00 46.02 45.30 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 -2.84 6.32 -0.01 1.61 0.01 -1.22 -0.96 114.94 117.85 2vil s ASN 38 Ca 0.00 -0.45 0.01 0.00 -0.71 0.00 0.00 52.86 51.72 2vil s ASN 38 Cb 0.00 -2.38 0.00 0.00 0.41 0.00 0.00 41.25 39.28 2vil s ASN 38 CO 0.00 -1.05 -0.04 0.72 -1.51 0.00 0.00 177.10 175.21 2vil s PHE 39 N 3.41 0.50 0.61 2.20 -0.12 -1.04 -4.93 117.98 118.60 2vil s PHE 39 Ca 0.26 -0.10 -0.18 0.00 -0.05 0.00 0.00 56.93 56.87 2vil s PHE 39 Cb -0.14 -0.37 -0.13 0.00 -0.63 0.00 0.00 43.02 41.74 2vil s PHE 39 CO 0.18 -0.05 -0.08 0.66 -0.05 0.00 0.00 175.22 175.88 2vil n TYR 40 N 3.27 -2.75 -0.01 3.49 4.02 -1.26 -3.22 117.16 120.70 2vil n TYR 40 Ca -0.17 0.37 -0.19 0.00 -0.01 0.00 0.00 57.90 57.91 2vil n TYR 40 Cb 0.56 -1.71 -0.14 0.00 -0.02 0.00 0.00 39.34 38.03 2vil n TYR 40 CO 0.00 0.00 0.00 -0.85 -1.01 0.00 0.00 176.86 175.00 2vil n GLU 41 N 1.22 0.73 -1.95 -0.72 0.28 -0.49 -4.43 120.64 115.28 2vil n GLU 41 Ca 0.07 0.26 -0.41 0.00 -0.16 0.00 0.00 57.16 56.92 2vil n GLU 41 Cb 0.49 -1.71 -0.00 0.00 1.43 0.00 0.00 31.44 31.64 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 1.92 4.69 0.00 -1.84 0.00 -1.26 -4.29 105.19 104.42 2vil n GLY 42 Ca -0.30 -1.87 0.00 0.00 0.00 0.00 0.00 46.02 43.86 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 3.96 0.00 -3.98 1.61 9.92 -0.36 -4.12 116.55 123.58 2vil n ASP 43 Ca 0.54 0.00 -0.11 0.00 -0.53 0.00 0.00 54.79 54.69 2vil n ASP 43 Cb 0.33 0.00 -0.12 0.00 -0.64 0.00 0.00 41.12 40.69 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 -1.17 -0.29 -0.16 0.00 1.51 -0.48 -1.51 117.35 115.24 2vil s TYR 45 Ca -0.12 0.19 -0.29 0.00 -1.01 0.00 0.00 57.07 55.84 2vil s TYR 45 Cb -0.08 -0.37 -0.00 0.00 -0.11 0.00 0.00 41.96 41.40 2vil s TYR 45 CO -0.01 -0.63 1.05 0.08 -1.11 0.00 0.00 175.55 174.94 2vil s VAL 46 N 2.33 4.67 -0.21 0.71 1.01 -0.90 -1.45 120.40 126.56 2vil s VAL 46 Ca 0.07 1.97 -0.06 0.00 0.00 0.00 0.00 61.98 63.97 2vil s VAL 46 Cb -0.16 -4.27 -0.02 0.00 0.00 0.00 0.00 36.38 31.93 2vil s VAL 46 CO -0.14 -0.09 0.01 -0.22 0.00 0.00 0.00 175.10 174.67 2vil s LEU 47 N 2.66 3.29 -0.49 3.92 0.20 -0.82 0.34 118.68 127.78 2vil s LEU 47 Ca 0.47 -0.21 -0.11 0.00 0.69 0.00 0.00 54.13 54.97 2vil s LEU 47 Cb -0.17 -1.84 0.12 0.00 -0.43 0.00 0.00 46.19 43.86 2vil s LEU 47 CO 0.13 0.04 0.39 -0.22 -0.29 0.00 0.00 176.35 176.40 2vil s LEU 48 N 1.14 5.84 -0.09 -0.68 2.96 -0.05 -0.08 118.68 127.72 2vil s LEU 48 Ca 0.03 -1.85 -0.26 0.00 -0.22 0.00 0.00 54.13 51.82 2vil s LEU 48 Cb -0.14 -2.08 -0.02 0.00 0.50 0.00 0.00 46.19 44.44 2vil s LEU 48 CO 0.02 -0.74 0.85 -0.55 -1.32 0.00 0.00 176.35 174.61 2vil s SER 49 N 2.95 7.10 -0.21 3.68 0.15 -0.92 -2.06 113.70 124.40 2vil s SER 49 Ca 0.05 1.34 0.01 0.00 0.70 0.00 0.00 55.95 58.05 2vil s SER 49 Cb -0.27 -2.48 0.04 0.00 -1.71 0.00 0.00 66.02 61.60 2vil s SER 49 CO 0.01 -0.29 -0.11 -0.89 1.20 0.00 0.00 173.24 173.15 2vil s THR 50 N 1.47 1.79 -0.14 6.45 2.01 -0.25 -0.16 115.64 126.81 2vil s THR 50 Ca 0.43 -1.12 0.01 0.00 0.31 0.00 0.00 61.69 61.31 2vil s THR 50 Cb -0.18 -1.84 -0.00 0.00 0.01 0.00 0.00 72.50 70.49 2vil s THR 50 CO 0.18 0.17 -0.16 -0.60 -0.69 0.00 0.00 174.62 173.52 2vil s ARG 51 N 1.33 3.21 0.74 4.92 3.52 -0.70 -0.27 118.95 131.70 2vil s ARG 51 Ca -0.02 -0.76 -0.10 0.00 -0.13 0.00 0.00 55.73 54.72 2vil s ARG 51 Cb -0.17 -2.58 0.15 0.00 -1.56 0.00 0.00 34.95 30.80 2vil s ARG 51 CO -0.08 0.06 0.35 0.36 -0.81 0.00 0.00 175.30 175.18 2vil n LYS 52 N 3.92 -1.48 -3.64 5.12 2.85 -1.26 0.12 118.16 123.79 2vil n LYS 52 Ca -0.19 -0.58 -0.02 0.00 -1.05 0.00 0.00 58.31 56.46 2vil n LYS 52 Cb 0.52 -1.05 -0.03 0.00 -0.65 0.00 0.00 35.03 33.81 2vil n LYS 52 CO 0.00 0.00 0.00 0.95 -0.05 0.00 0.00 177.40 178.30 2vil s THR 53 N -1.60 0.00 0.59 0.58 -4.23 -0.74 -4.27 115.64 105.97 2vil s THR 53 Ca 0.27 0.00 0.33 0.00 -1.18 0.00 0.00 61.69 61.11 2vil s THR 53 Cb -0.05 -1.00 0.47 0.00 1.34 0.00 0.00 72.50 73.27 2vil s THR 53 CO 0.23 0.00 1.56 1.23 -0.54 0.00 0.00 174.62 177.10 2vil h GLY 54 N 2.04 0.00 0.77 3.99 0.00 -1.96 0.73 103.07 108.64 2vil h GLY 54 Ca -0.06 0.00 -0.35 0.00 0.00 0.00 0.00 47.33 46.92 2vil h GLY 54 CO 0.21 0.00 -1.80 0.23 0.00 0.00 0.00 176.54 175.18 2vil h SER 55 N 0.00 0.52 0.00 0.19 0.87 -2.00 -3.49 113.55 109.64 2vil h SER 55 Ca 0.51 -0.93 0.00 0.00 -1.23 0.00 0.00 61.79 60.14 2vil h SER 55 Cb 2.56 -0.17 0.00 0.00 -0.44 0.00 0.00 62.40 64.35 2vil h SER 55 CO -0.01 1.80 0.00 0.61 -0.53 0.00 0.00 176.83 178.70 2vil n GLY 56 N 1.89 -0.88 3.26 5.77 0.00 0.25 -5.14 105.19 110.34 2vil n GLY 56 Ca -0.27 0.40 -0.17 0.00 0.00 0.00 0.00 46.02 45.98 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 1.53 -0.38 1.61 0.08 -1.26 -1.80 117.98 117.76 2vil s PHE 57 Ca 0.00 -1.55 0.04 0.00 0.12 0.00 0.00 56.93 55.54 2vil s PHE 57 Cb 0.00 -0.67 0.16 0.00 -0.57 0.00 0.00 43.02 41.94 2vil s PHE 57 CO 0.00 -0.77 0.40 -1.12 -0.10 0.00 0.00 175.22 173.63 2vil s SER 58 N -3.29 0.96 0.58 1.36 0.01 0.32 -4.63 113.70 109.00 2vil s SER 58 Ca 0.40 -1.63 -0.14 0.00 1.31 0.00 0.00 55.95 55.89 2vil s SER 58 Cb 0.04 0.63 -0.05 0.00 0.21 0.00 0.00 66.02 66.85 2vil s SER 58 CO 0.21 -0.24 1.02 -0.31 0.41 0.00 0.00 173.24 174.33 2vil s TYR 59 N 1.35 3.42 -0.41 2.43 2.02 -1.13 -1.71 117.35 123.33 2vil s TYR 59 Ca 0.18 1.40 0.05 0.00 -0.37 0.00 0.00 57.07 58.33 2vil s TYR 59 Cb -0.14 -2.80 0.17 0.00 -0.40 0.00 0.00 41.96 38.79 2vil s TYR 59 CO -0.03 -0.68 0.48 -0.80 -1.57 0.00 0.00 175.55 172.95 2vil s ASN 60 N -3.54 0.22 0.32 2.29 0.01 0.77 -2.40 114.94 112.62 2vil s ASN 60 Ca 0.58 -1.60 -0.28 0.00 -0.71 0.00 0.00 52.86 50.85 2vil s ASN 60 Cb -0.11 0.96 -0.10 0.00 0.41 0.00 0.00 41.25 42.41 2vil s ASN 60 CO 0.43 -0.20 1.18 -0.63 -1.51 0.00 0.00 177.10 176.37 2vil s ILE 61 N 1.28 3.17 0.21 0.60 1.01 0.13 -2.16 121.20 125.45 2vil s ILE 61 Ca 0.20 1.15 0.08 0.00 0.00 0.00 0.00 60.65 62.08 2vil s ILE 61 Cb -0.09 -3.72 -0.05 0.00 0.01 0.00 0.00 42.46 38.62 2vil s ILE 61 CO -0.05 0.25 -0.15 -1.00 0.00 0.00 0.00 174.94 173.99 2vil s HIS 62 N -1.20 1.77 -0.34 3.97 3.76 0.88 -0.41 115.29 123.72 2vil s HIS 62 Ca 0.48 -0.56 -0.01 0.00 -0.15 0.00 0.00 55.06 54.83 2vil s HIS 62 Cb -0.34 -0.82 0.11 0.00 1.11 0.00 0.00 32.58 32.64 2vil s HIS 62 CO 0.45 0.39 0.15 1.52 -0.85 0.00 0.00 174.74 176.39 2vil s TYR 63 N -2.94 1.26 0.10 1.40 1.13 -0.30 -1.95 117.35 116.05 2vil s TYR 63 Ca 0.23 -1.65 -0.30 0.00 -1.41 0.00 0.00 57.07 53.94 2vil s TYR 63 Cb -0.01 -1.41 -0.06 0.00 -1.10 0.00 0.00 41.96 39.38 2vil s TYR 63 CO 0.08 -0.84 1.18 -0.46 -2.51 0.00 0.00 175.55 173.00 2vil s TRP 64 N 1.38 3.46 -0.57 -3.49 -0.00 -0.53 -2.39 118.94 116.81 2vil s TRP 64 Ca 0.13 1.37 0.06 0.00 -0.00 0.00 0.00 56.10 57.65 2vil s TRP 64 Cb -0.19 -3.40 0.33 0.00 -0.00 0.00 0.00 33.47 30.21 2vil s TRP 64 CO -0.18 -1.15 0.91 1.28 -0.00 0.00 0.00 176.95 177.81 2vil n LEU 65 N 3.45 4.15 -4.53 5.86 7.99 -0.63 -1.38 117.00 131.91 2vil n LEU 65 Ca 0.07 -5.61 -0.19 0.00 -0.01 0.00 0.00 56.01 50.27 2vil n LEU 65 Cb 0.46 -0.47 -0.15 0.00 -0.11 0.00 0.00 43.42 43.14 2vil n LEU 65 CO 0.55 2.33 1.71 0.61 -1.51 0.00 0.00 177.39 181.08 2vil n GLY 66 N -0.10 -0.33 3.23 -0.72 0.00 0.43 -4.32 105.19 103.36 2vil n GLY 66 Ca 0.30 0.18 -0.26 0.00 0.00 0.00 0.00 46.02 46.24 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 7.08 0.00 0.00 1.61 3.00 -1.26 -1.22 118.16 127.37 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 0.27 -1.08 0.00 0.00 0.00 0.00 0.00 35.03 34.22 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 6.66 0.00 -3.89 3.14 3.02 -1.26 -4.82 115.26 118.11 2vil n ASN 68 Ca 0.62 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 55.17 2vil n ASN 68 Cb 0.09 0.25 0.00 0.00 -0.61 0.00 0.00 39.78 39.51 2vil n ASN 68 CO 0.00 0.00 0.00 -1.54 -2.62 0.00 0.00 177.26 173.10 2vil n SER 69 N -1.98 0.00 -4.74 6.41 3.41 -1.26 -4.94 113.62 110.52 2vil n SER 69 Ca 0.00 0.00 -0.22 0.00 -0.26 0.00 0.00 58.87 58.39 2vil n SER 69 Cb 0.00 0.00 -0.06 0.00 -0.26 0.00 0.00 64.21 63.89 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 -2.03 5.03 0.27 4.04 1.04 -1.26 -4.96 113.70 115.82 2vil s SER 70 Ca 0.00 -0.47 -0.02 0.00 0.48 0.00 0.00 55.95 55.94 2vil s SER 70 Cb 0.00 -1.09 0.59 0.00 0.10 0.00 0.00 66.02 65.62 2vil s SER 70 CO 0.00 -0.06 1.65 0.06 0.98 0.00 0.00 173.24 175.87 2vil h GLN 71 N 1.65 0.20 -0.85 4.02 -0.00 -2.01 0.49 115.11 118.62 2vil h GLN 71 Ca -0.46 -0.01 0.05 0.00 -0.00 0.00 0.00 58.65 58.22 2vil h GLN 71 Cb 1.25 -0.05 -0.06 0.00 -0.00 0.00 0.00 27.48 28.62 2vil h GLN 71 CO 0.61 0.13 0.54 0.38 -0.00 0.00 0.00 178.83 180.49 2vil h ASP 72 N 0.21 0.87 -1.00 0.06 3.04 -1.99 -0.24 116.42 117.37 2vil h ASP 72 Ca 0.49 0.01 0.12 0.00 -3.24 0.00 0.00 57.03 54.41 2vil h ASP 72 Cb 0.92 -0.18 -0.08 0.00 -1.04 0.00 0.00 39.33 38.95 2vil h ASP 72 CO -0.62 0.58 0.63 -0.08 -2.04 0.00 0.00 179.24 177.71 2vil h GLU 73 N 1.01 0.94 -0.76 4.15 4.57 -0.39 0.52 114.58 124.62 2vil h GLU 73 Ca 0.36 -0.06 0.00 0.00 -1.18 0.00 0.00 59.36 58.48 2vil h GLU 73 Cb 0.09 -0.21 -0.04 0.00 -0.16 0.00 0.00 28.75 28.43 2vil h GLU 73 CO -0.14 0.63 0.48 0.37 -1.18 0.00 0.00 179.01 179.16 2vil h GLN 74 N 0.97 1.01 0.00 1.92 -0.00 -0.59 0.15 115.11 118.57 2vil h GLN 74 Ca 0.50 -0.08 -0.04 0.00 -0.00 0.00 0.00 58.65 59.03 2vil h GLN 74 Cb 0.51 -0.22 -0.01 0.00 0.00 0.00 0.00 27.48 27.76 2vil h GLN 74 CO -0.26 0.69 -0.19 0.78 0.00 0.00 0.00 178.83 179.85 2vil h GLY 75 N 1.05 0.00 0.06 2.39 0.00 0.36 -2.56 103.07 104.37 2vil h GLY 75 Ca 0.27 0.00 -0.00 0.00 0.00 0.00 0.00 47.33 47.60 2vil h GLY 75 CO -0.06 0.00 -0.03 0.00 0.00 0.00 0.00 176.54 176.46 2vil h ALA 76 N 1.81 -0.24 -1.09 3.60 0.00 0.15 -0.81 119.26 122.69 2vil h ALA 76 Ca -0.00 -0.02 0.33 0.00 0.00 0.00 0.00 54.91 55.22 2vil h ALA 76 Cb 0.68 0.03 -0.13 0.00 0.00 0.00 0.00 17.79 18.37 2vil h ALA 76 CO 0.02 -0.23 0.67 0.00 0.00 0.00 0.00 179.25 179.71 2vil h ALA 77 N -1.74 2.21 -0.33 0.00 0.00 -1.33 0.68 119.26 118.74 2vil h ALA 77 Ca -0.01 0.13 -0.18 0.00 0.00 0.00 0.00 54.91 54.86 2vil h ALA 77 Cb 0.06 0.13 -0.00 0.00 0.00 0.00 0.00 17.79 17.98 2vil h ALA 77 CO 0.01 -0.77 -0.48 0.00 0.00 0.00 0.00 179.25 178.01 2vil h ALA 78 N 1.72 0.51 -0.13 0.00 0.00 -1.52 -2.66 119.26 117.19 2vil h ALA 78 Ca 0.72 -0.49 -0.00 0.00 0.00 0.00 0.00 54.91 55.14 2vil h ALA 78 Cb 1.83 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 19.52 2vil h ALA 78 CO -0.47 0.68 0.08 0.82 0.00 0.00 0.00 179.25 180.35 2vil h ILE 79 N 0.71 1.06 -0.80 0.00 2.04 0.19 0.11 117.51 120.82 2vil h ILE 79 Ca 0.03 -0.16 0.06 0.00 1.00 0.00 0.00 64.86 65.80 2vil h ILE 79 Cb 1.08 0.94 -0.06 0.00 -0.74 0.00 0.00 36.82 38.05 2vil h ILE 79 CO 0.11 0.06 0.48 1.88 0.00 0.00 0.00 178.15 180.68 2vil h TYR 80 N 0.14 0.89 0.00 1.37 0.05 -1.24 0.19 116.97 118.36 2vil h TYR 80 Ca 0.05 0.03 -0.03 0.00 0.05 0.00 0.00 58.73 58.82 2vil h TYR 80 Cb 0.03 -0.28 -0.00 0.00 1.01 0.00 0.00 36.73 37.48 2vil h TYR 80 CO -0.06 0.44 -0.16 1.15 -1.05 0.00 0.00 178.16 178.48 2vil h THR 81 N 0.87 0.48 0.00 -2.88 2.02 -1.06 -1.57 112.91 110.77 2vil h THR 81 Ca 0.35 -0.82 -0.07 0.00 0.77 0.00 0.00 66.41 66.64 2vil h THR 81 Cb 0.19 1.57 -0.01 0.00 -1.74 0.00 0.00 68.15 68.16 2vil h THR 81 CO -0.18 0.16 -0.33 0.74 0.37 0.00 0.00 175.52 176.27 2vil h THR 82 N 0.00 0.60 0.06 3.16 2.02 0.19 -3.11 112.91 115.84 2vil h THR 82 Ca -0.00 -1.74 -0.32 0.00 0.77 0.00 0.00 66.41 65.12 2vil h THR 82 Cb 0.56 2.21 -0.03 0.00 -1.74 0.00 0.00 68.15 69.15 2vil h THR 82 CO 0.02 0.33 -1.82 1.56 0.37 0.00 0.00 175.52 175.98 2vil h GLN 83 N 0.00 0.12 -0.24 6.66 4.20 -0.58 -3.35 115.11 121.92 2vil h GLN 83 Ca -0.00 -0.21 -0.01 0.00 0.06 0.00 0.00 58.65 58.48 2vil h GLN 83 Cb 1.19 0.08 -0.01 0.00 0.30 0.00 0.00 27.48 29.03 2vil h GLN 83 CO 0.04 0.83 0.10 0.52 -0.67 0.00 0.00 178.83 179.65 2vil h MET 84 N 0.03 0.36 -0.19 1.46 2.86 -1.37 0.39 114.93 118.47 2vil h MET 84 Ca -0.34 -0.06 0.05 0.00 -2.06 0.00 0.00 59.70 57.29 2vil h MET 84 Cb 2.02 -0.06 -0.07 0.00 0.06 0.00 0.00 31.60 33.56 2vil h MET 84 CO 0.09 0.40 -0.33 0.22 1.06 0.00 0.00 176.91 178.35 2vil h ASP 85 N 0.24 -1.03 1.02 1.22 1.82 -1.71 0.78 116.42 118.76 2vil h ASP 85 Ca 0.08 0.16 0.00 0.00 -0.39 0.00 0.00 57.03 56.88 2vil h ASP 85 Cb 0.17 0.45 0.00 0.00 0.68 0.00 0.00 39.33 40.63 2vil h ASP 85 CO -0.01 -0.35 0.00 -0.62 -1.61 0.00 0.00 179.24 176.65 2vil n GLU 86 N -5.41 0.11 0.00 0.28 1.02 -1.16 -0.97 120.64 114.51 2vil n GLU 86 Ca -0.02 0.18 0.12 0.00 -0.02 0.00 0.00 57.16 57.41 2vil n GLU 86 Cb 0.33 -1.65 0.15 0.00 -0.02 0.00 0.00 31.44 30.24 2vil n GLU 86 CO 0.00 0.00 0.00 0.66 1.18 0.00 0.00 177.13 178.97 2vil n TYR 87 N -1.85 0.00 -0.08 -0.32 4.02 0.14 -4.00 117.16 115.07 2vil n TYR 87 Ca 0.05 0.00 0.07 0.00 -0.01 0.00 0.00 57.90 58.01 2vil n TYR 87 Cb 0.32 -0.02 0.17 0.00 -0.02 0.00 0.00 39.34 39.79 2vil n TYR 87 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 176.86 177.13 2vil n LEU 88 N 0.29 2.98 0.00 7.72 4.77 0.24 -4.91 117.00 128.09 2vil n LEU 88 Ca 0.12 -1.82 0.00 0.00 -0.03 0.00 0.00 56.01 54.28 2vil n LEU 88 Cb 0.47 -0.24 0.00 0.00 -2.33 0.00 0.00 43.42 41.33 2vil n LEU 88 CO 0.23 0.72 0.00 0.61 -1.33 0.00 0.00 177.39 177.62 2vil n GLY 89 N 0.77 0.79 3.23 -0.72 0.00 -1.24 -4.30 105.19 103.72 2vil n GLY 89 Ca 0.13 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.15 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 0.00 0.00 -0.78 1.61 3.41 -0.15 -4.82 113.62 112.89 2vil n SER 90 Ca 0.00 0.00 0.03 0.00 -0.26 0.00 0.00 58.87 58.64 2vil n SER 90 Cb 0.00 -0.58 0.14 0.00 -0.26 0.00 0.00 64.21 63.51 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 -2.00 0.72 -3.04 -3.33 0.24 -1.26 -4.87 118.33 104.79 2vil n VAL 91 Ca 0.00 -0.44 -0.20 0.00 -2.04 0.00 0.00 64.34 61.66 2vil n VAL 91 Cb 0.00 -0.15 0.07 0.00 -1.47 0.00 0.00 33.84 32.28 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 -1.64 4.73 0.33 2.33 0.00 -1.26 -2.82 121.76 123.44 2vil s ALA 92 Ca 0.19 -2.19 0.04 0.00 0.00 0.00 0.00 51.96 50.00 2vil s ALA 92 Cb 0.13 -1.44 -0.03 0.00 0.00 0.00 0.00 23.12 21.77 2vil s ALA 92 CO 0.09 -0.91 0.17 0.08 0.00 0.00 0.00 175.76 175.19 2vil s VAL 93 N -2.70 0.34 -0.07 0.00 1.01 -1.01 -4.85 120.40 113.12 2vil s VAL 93 Ca 0.62 -2.00 0.03 0.00 0.00 0.00 0.00 61.98 60.64 2vil s VAL 93 Cb -0.05 -2.48 0.01 0.00 0.00 0.00 0.00 36.38 33.85 2vil s VAL 93 CO 0.39 0.00 -0.18 -1.58 0.00 0.00 0.00 175.10 173.74 2vil s GLN 94 N -3.74 2.22 0.07 2.72 0.74 -1.25 0.17 119.66 120.60 2vil s GLN 94 Ca 0.34 -0.63 0.05 0.00 0.05 0.00 0.00 55.36 55.18 2vil s GLN 94 Cb 0.04 -1.77 -0.03 0.00 1.10 0.00 0.00 33.01 32.35 2vil s GLN 94 CO 0.19 0.13 -0.15 -1.01 -0.55 0.00 0.00 175.29 173.90 2vil s HIS 95 N 0.42 1.26 -0.10 1.67 3.76 0.46 -4.96 115.29 117.80 2vil s HIS 95 Ca -0.14 -0.46 -0.01 0.00 -0.15 0.00 0.00 55.06 54.30 2vil s HIS 95 Cb -0.16 -0.71 -0.03 0.00 1.11 0.00 0.00 32.58 32.79 2vil s HIS 95 CO 0.05 0.07 -0.05 -0.98 -0.85 0.00 0.00 174.74 172.98 2vil s ARG 96 N -1.76 3.12 0.15 1.40 1.70 -1.26 -1.15 118.95 121.16 2vil s ARG 96 Ca -0.01 -0.53 -0.01 0.00 -0.47 0.00 0.00 55.73 54.71 2vil s ARG 96 Cb -0.10 -2.72 -0.04 0.00 -0.57 0.00 0.00 34.95 31.52 2vil s ARG 96 CO 0.02 0.50 0.07 -1.21 -1.08 0.00 0.00 175.30 173.60 2vil s GLU 97 N -0.36 0.99 0.25 3.89 0.41 -1.00 -4.85 118.70 118.02 2vil s GLU 97 Ca 0.05 -1.48 -0.06 0.00 -0.41 0.00 0.00 54.97 53.07 2vil s GLU 97 Cb -0.12 0.22 0.03 0.00 -1.78 0.00 0.00 34.13 32.48 2vil s GLU 97 CO 0.02 -0.28 0.44 0.28 -0.49 0.00 0.00 175.26 175.23 2vil n VAL 98 N -0.13 0.00 0.59 2.63 0.31 -1.26 -1.61 118.33 118.86 2vil n VAL 98 Ca -0.04 -0.85 0.06 0.00 -0.01 0.00 0.00 64.34 63.49 2vil n VAL 98 Cb 0.64 0.68 0.31 0.00 -0.91 0.00 0.00 33.84 34.55 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 -0.36 0.21 -0.22 5.55 10.64 -1.26 -1.80 117.38 130.14 2vil n GLN 99 Ca -0.03 0.14 0.00 0.00 -1.83 0.00 0.00 57.00 55.28 2vil n GLN 99 Cb 0.39 -1.50 0.00 0.00 -0.86 0.00 0.00 30.24 28.27 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 -0.29 -1.46 0.00 2.61 0.00 -1.26 -4.81 105.19 99.98 2vil n GLY 100 Ca 0.06 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.08 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 0.00 0.86 1.61 8.25 -0.85 -4.65 115.22 120.44 2vil n HIS 101 Ca 0.00 0.00 0.07 0.00 -0.26 0.00 0.00 57.72 57.53 2vil n HIS 101 Cb 0.59 0.00 0.21 0.00 1.12 0.00 0.00 29.99 31.91 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 -1.32 1.87 0.27 -0.41 0.00 -0.74 -4.46 120.64 115.84 2vil n GLU 102 Ca 0.00 -1.34 -0.14 0.00 0.00 0.00 0.00 57.16 55.69 2vil n GLU 102 Cb 0.04 -1.32 -0.07 0.00 0.00 0.00 0.00 31.44 30.09 2vil n GLU 102 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.13 177.79 2vil h SER 103 N 2.27 -0.92 0.10 -1.84 4.64 -1.82 -0.68 113.55 115.29 2vil h SER 103 Ca 0.00 0.06 -0.00 0.00 -0.47 0.00 0.00 61.79 61.38 2vil h SER 103 Cb 0.51 0.28 0.00 0.00 -0.31 0.00 0.00 62.40 62.89 2vil h SER 103 CO 0.00 -0.51 -0.05 -0.33 -0.87 0.00 0.00 176.83 175.07 2vil h GLU 104 N -0.80 -0.13 0.25 4.77 5.08 -1.96 -2.17 114.58 119.62 2vil h GLU 104 Ca -0.06 0.01 -0.01 0.00 -1.00 0.00 0.00 59.36 58.29 2vil h GLU 104 Cb 0.66 0.03 0.00 0.00 0.50 0.00 0.00 28.75 29.94 2vil h GLU 104 CO 0.03 0.28 -0.12 1.15 -1.00 0.00 0.00 179.01 179.35 2vil h THR 105 N -0.96 0.77 0.38 1.13 2.02 -1.80 0.62 112.91 115.07 2vil h THR 105 Ca -0.01 -0.13 -0.02 0.00 0.77 0.00 0.00 66.41 67.02 2vil h THR 105 Cb 0.47 0.85 0.00 0.00 -1.74 0.00 0.00 68.15 67.73 2vil h THR 105 CO 0.02 0.03 -0.18 0.15 0.37 0.00 0.00 175.52 175.91 2vil h PHE 106 N -0.40 -0.48 0.00 3.16 3.57 -1.31 -1.90 116.94 119.58 2vil h PHE 106 Ca -0.03 -0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.45 2vil h PHE 106 Cb 0.31 0.16 0.00 0.00 2.79 0.00 0.00 35.95 39.20 2vil h PHE 106 CO -0.04 -0.17 0.00 -0.09 -2.23 0.00 0.00 178.31 175.78 2vil h ARG 107 N -0.76 0.00 0.69 1.11 2.43 -0.86 -2.13 114.38 114.87 2vil h ARG 107 Ca -0.05 0.00 -0.03 0.00 -0.81 0.00 0.00 59.98 59.08 2vil h ARG 107 Cb 0.52 0.00 0.01 0.00 -0.42 0.00 0.00 29.97 30.08 2vil h ARG 107 CO 0.09 0.00 -0.33 0.00 -1.51 0.00 0.00 179.97 178.21 2vil h ALA 108 N 2.02 -0.93 0.00 2.80 0.00 0.11 -2.46 119.26 120.79 2vil h ALA 108 Ca 0.00 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 54.70 2vil h ALA 108 Cb 0.07 0.36 0.00 0.00 0.00 0.00 0.00 17.79 18.22 2vil h ALA 108 CO 0.00 -0.87 0.00 1.88 0.00 0.00 0.00 179.25 180.26 2vil h TYR 109 N -1.24 0.00 -3.35 0.00 0.05 -1.17 -3.35 116.97 107.91 2vil h TYR 109 Ca -0.10 0.00 -0.72 0.00 0.05 0.00 0.00 58.73 57.97 2vil h TYR 109 Cb 0.72 0.00 -0.31 0.00 1.01 0.00 0.00 36.73 38.15 2vil h TYR 109 CO 0.00 0.00 -0.41 -0.06 -1.05 0.00 0.00 178.16 176.64 2vil s PHE 110 N -3.61 3.47 -2.00 4.88 0.40 -0.84 -4.91 117.98 115.37 2vil s PHE 110 Ca -0.01 -2.02 0.20 0.00 -0.60 0.00 0.00 56.93 54.50 2vil s PHE 110 Cb 0.08 -3.44 1.19 0.00 0.51 0.00 0.00 43.02 41.36 2vil s PHE 110 CO 0.32 -0.99 1.61 1.63 0.70 0.00 0.00 175.22 178.49 2vil n LYS 111 N 4.78 0.74 0.00 0.44 5.02 -1.25 -4.14 118.16 123.75 2vil n LYS 111 Ca -0.06 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.23 2vil n LYS 111 Cb 0.41 -1.42 0.00 0.00 -0.02 0.00 0.00 35.03 34.00 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 -0.92 0.00 0.00 1.97 6.02 -1.26 -5.05 117.38 118.14 2vil n GLN 112 Ca 0.15 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 57.14 2vil n GLN 112 Cb 0.07 -0.25 0.00 0.00 1.02 0.00 0.00 30.24 31.08 2vil n GLN 112 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2vil n GLY 113 N 2.59 0.05 0.94 1.08 0.00 -1.26 -5.12 105.19 103.48 2vil n GLY 113 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 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 -1.83 -4.97 0.99 4.77 -1.26 -4.93 117.00 109.78 2vil n LEU 114 Ca 0.00 0.00 -0.23 0.00 -0.03 0.00 0.00 56.01 55.75 2vil n LEU 114 Cb 0.00 -0.91 0.06 0.00 -2.33 0.00 0.00 43.42 40.24 2vil n LEU 114 CO 0.00 0.00 0.48 -0.63 -1.33 0.00 0.00 177.39 175.91 2vil s ILE 115 N 0.00 2.43 -0.16 -0.08 1.01 -0.13 -4.95 121.20 119.31 2vil s ILE 115 Ca 0.00 -0.55 -0.07 0.00 0.00 0.00 0.00 60.65 60.03 2vil s ILE 115 Cb 0.00 -2.88 0.07 0.00 0.01 0.00 0.00 42.46 39.66 2vil s ILE 115 CO 0.00 0.00 0.36 -0.31 0.00 0.00 0.00 174.94 174.99 2vil s TYR 116 N -2.98 -0.59 0.00 3.97 1.51 -1.26 -2.51 117.35 115.49 2vil s TYR 116 Ca 0.61 1.22 0.00 0.00 -1.01 0.00 0.00 57.07 57.89 2vil s TYR 116 Cb -0.09 0.18 0.00 0.00 -0.11 0.00 0.00 41.96 41.94 2vil s TYR 116 CO 0.41 -0.37 0.00 1.63 -1.11 0.00 0.00 175.55 176.11 2vil n LYS 117 N 4.83 2.34 -2.92 -0.62 4.76 -1.20 -4.70 118.16 120.65 2vil n LYS 117 Ca -0.16 0.00 -0.24 0.00 -2.87 0.00 0.00 58.31 55.04 2vil n LYS 117 Cb 0.52 0.00 0.01 0.00 -1.84 0.00 0.00 35.03 33.72 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 0.23 3.19 0.00 1.97 2.00 -1.26 -1.40 119.66 124.39 2vil s GLN 118 Ca 0.00 -0.29 0.00 0.00 -2.00 0.00 0.00 55.36 53.07 2vil s GLN 118 Cb 0.00 -2.51 0.00 0.00 0.80 0.00 0.00 33.01 31.30 2vil s GLN 118 CO 0.00 -0.25 0.00 0.41 -0.50 0.00 0.00 175.29 174.95 2vil n GLY 119 N -2.13 -0.31 2.70 2.59 0.00 -1.26 -4.71 105.19 102.08 2vil n GLY 119 Ca 0.01 -1.46 -0.03 0.00 0.00 0.00 0.00 46.02 44.53 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 4.14 -3.45 0.00 -0.02 0.00 -1.26 -5.00 105.19 99.60 2vil n GLY 120 Ca 0.00 1.03 0.00 0.00 0.00 0.00 0.00 46.02 47.05 2vil n GLY 120 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 2vil n VAL 121 N 2.01 0.00 0.07 1.61 0.31 -1.26 -4.73 118.33 116.34 2vil n VAL 121 Ca -0.24 0.00 -0.03 0.00 -0.01 0.00 0.00 64.34 64.07 2vil n VAL 121 Cb 0.37 0.00 0.22 0.00 -0.91 0.00 0.00 33.84 33.52 2vil n VAL 121 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2vil h ALA 122 N -1.49 1.10 -0.90 3.52 0.00 -1.98 -2.87 119.26 116.65 2vil h ALA 122 Ca 0.00 -0.39 -0.58 0.00 0.00 0.00 0.00 54.91 53.94 2vil h ALA 122 Cb 0.00 -0.10 -0.30 0.00 0.00 0.00 0.00 17.79 17.40 2vil h ALA 122 CO 0.00 0.57 0.50 0.43 0.00 0.00 0.00 179.25 180.76 2vil n SER 123 N -4.06 5.96 -0.06 0.00 7.64 -1.26 -4.53 113.62 117.30 2vil n SER 123 Ca -0.01 -3.75 -0.12 0.00 1.01 0.00 0.00 58.87 56.00 2vil n SER 123 Cb 0.45 -0.83 -0.04 0.00 -1.01 0.00 0.00 64.21 62.79 2vil n SER 123 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2vil n GLY 124 N -0.96 -0.31 3.74 0.23 0.00 -1.08 -5.01 105.19 101.80 2vil n GLY 124 Ca 0.57 -0.14 -0.29 0.00 0.00 0.00 0.00 46.02 46.16 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 -2.42 1.15 0.00 1.61 1.00 -1.26 -4.94 119.30 114.44 2vil s MET 125 Ca -0.21 0.55 0.00 0.00 0.00 0.00 0.00 55.69 56.03 2vil s MET 125 Cb 0.06 -1.82 0.00 0.00 0.00 0.00 0.00 34.83 33.07 2vil s MET 125 CO 0.28 -2.25 0.00 1.63 0.00 0.00 0.00 175.02 174.68