#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 0.00 0.00 5.55 0.28 -1.26 -5.00 120.64 120.21 2vil n GLU 2 Ca 0.00 0.00 0.08 0.00 -0.16 0.00 0.00 57.16 57.08 2vil n GLU 2 Cb 0.00 0.00 0.45 0.00 1.43 0.00 0.00 31.44 33.32 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 0.00 0.00 -4.89 -1.84 -0.00 -1.26 -4.04 117.00 104.97 2vil n LEU 3 Ca 0.00 0.00 -0.31 0.00 -0.00 0.00 0.00 56.01 55.70 2vil n LEU 3 Cb 0.00 0.00 -0.05 0.00 -0.00 0.00 0.00 43.42 43.37 2vil n LEU 3 CO 0.00 0.00 0.15 -0.94 -0.00 0.00 0.00 177.39 176.60 2vil s SER 4 N -1.76 6.55 0.00 1.45 1.04 -1.26 -3.29 113.70 116.42 2vil s SER 4 Ca 0.23 0.77 0.00 0.00 0.48 0.00 0.00 55.95 57.42 2vil s SER 4 Cb 0.10 -2.16 0.00 0.00 0.10 0.00 0.00 66.02 64.06 2vil s SER 4 CO 0.18 -0.05 0.00 1.17 0.98 0.00 0.00 173.24 175.51 2vil n LYS 5 N -0.21 0.00 -0.44 4.02 4.81 -1.26 -2.68 118.16 122.40 2vil n LYS 5 Ca -0.01 0.00 0.40 0.00 -0.87 0.00 0.00 58.31 57.83 2vil n LYS 5 Cb 0.52 0.00 0.63 0.00 0.02 0.00 0.00 35.03 36.20 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 1.79 -1.87 0.36 116.57 118.50 2vil h LYS 6 Ca 0.00 0.00 -0.20 0.00 -2.18 0.00 0.00 60.65 58.27 2vil h LYS 6 Cb 0.00 0.00 -0.04 0.00 -1.58 0.00 0.00 32.23 30.61 2vil h LYS 6 CO 0.00 0.00 -1.76 0.28 -1.08 0.00 0.00 179.45 176.89 2vil n VAL 7 N -3.59 0.76 1.01 0.50 0.31 -1.09 -4.38 118.33 111.85 2vil n VAL 7 Ca 0.33 -0.44 0.09 0.00 -0.01 0.00 0.00 64.34 64.31 2vil n VAL 7 Cb 1.73 -0.76 0.51 0.00 -0.91 0.00 0.00 33.84 34.41 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 -2.50 0.27 -2.09 2.52 -2.24 0.10 -4.50 114.28 105.84 2vil n THR 8 Ca -0.19 0.07 -0.28 0.00 -2.27 0.00 0.00 64.05 61.37 2vil n THR 8 Cb 0.84 -0.76 -0.05 0.00 -2.10 0.00 0.00 70.33 68.25 2vil n THR 8 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 2vil s GLY 9 N -2.35 0.26 0.00 3.38 0.00 0.34 -3.77 107.32 105.17 2vil s GLY 9 Ca 0.22 -1.89 0.00 0.00 0.00 0.00 0.00 44.72 43.05 2vil s GLY 9 CO 0.26 3.47 0.00 0.28 0.00 0.00 0.00 173.10 177.11 2vil n LYS 10 N 8.57 0.00 -0.66 2.90 5.02 -1.26 -4.93 118.16 127.80 2vil n LYS 10 Ca 0.42 0.48 -0.13 0.00 -2.02 0.00 0.00 58.31 57.07 2vil n LYS 10 Cb 0.47 -1.45 0.07 0.00 -0.02 0.00 0.00 35.03 34.10 2vil n LYS 10 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 2vil n LEU 11 N -0.76 5.20 -1.65 -0.35 4.77 -1.25 -4.79 117.00 118.18 2vil n LEU 11 Ca 0.00 -2.70 -0.01 0.00 -0.03 0.00 0.00 56.01 53.27 2vil n LEU 11 Cb 0.28 -0.77 0.00 0.00 -2.33 0.00 0.00 43.42 40.61 2vil n LEU 11 CO 0.00 0.88 0.01 -0.67 -1.33 0.00 0.00 177.39 176.28 2vil n ASP 12 N -0.10 -2.41 0.01 -1.43 2.03 -1.26 -4.95 116.55 108.44 2vil n ASP 12 Ca 0.28 -0.05 0.14 0.00 0.52 0.00 0.00 54.79 55.68 2vil n ASP 12 Cb 0.93 -0.98 0.54 0.00 -0.72 0.00 0.00 41.12 40.89 2vil n ASP 12 CO 0.00 0.00 0.00 0.29 -1.92 0.00 0.00 177.20 175.57 2vil n LYS 13 N -1.54 0.02 -2.80 -0.67 5.02 -1.26 -4.33 118.16 112.59 2vil n LYS 13 Ca -0.00 0.02 -0.10 0.00 -2.02 0.00 0.00 58.31 56.20 2vil n LYS 13 Cb 0.51 -1.52 0.04 0.00 -0.02 0.00 0.00 35.03 34.04 2vil n LYS 13 CO 0.00 0.00 0.00 0.25 -0.52 0.00 0.00 177.40 177.13 2vil n THR 14 N -1.56 -0.07 -3.53 -0.18 -2.24 -1.26 -4.77 114.28 100.66 2vil n THR 14 Ca 0.07 -1.85 0.00 0.00 -2.27 0.00 0.00 64.05 60.00 2vil n THR 14 Cb 0.35 1.10 -0.04 0.00 -2.10 0.00 0.00 70.33 69.64 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 0.32 -0.90 -1.04 4.28 2.01 -1.26 -5.09 115.64 113.95 2vil s THR 15 Ca 0.30 0.00 -0.23 0.00 0.31 0.00 0.00 61.69 62.08 2vil s THR 15 Cb 0.24 -1.00 0.02 0.00 0.01 0.00 0.00 72.50 71.77 2vil s THR 15 CO -0.19 0.00 1.65 -2.16 -0.69 0.00 0.00 174.62 173.23 2vil s PRO 16 N 2.82 3.33 0.00 4.92 0.04 -1.26 -4.49 135.00 140.35 2vil s PRO 16 Ca -0.02 -1.06 0.00 0.00 0.04 0.00 0.00 61.00 59.97 2vil s PRO 16 Cb -0.11 -5.31 0.00 0.00 0.04 0.00 0.00 34.50 29.12 2vil s PRO 16 CO -0.19 -2.62 0.00 0.41 0.04 0.00 0.00 177.00 174.64 2vil n GLY 17 N 6.58 2.18 3.51 0.56 0.00 -1.09 -5.00 105.19 111.93 2vil n GLY 17 Ca 0.38 -0.19 -0.14 0.00 0.00 0.00 0.00 46.02 46.07 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 -0.25 0.00 -0.19 -0.61 -4.36 -1.26 -1.85 121.20 112.68 2vil s ILE 18 Ca 0.00 -0.03 0.01 0.00 -0.26 0.00 0.00 60.65 60.37 2vil s ILE 18 Cb 0.00 -0.87 0.03 0.00 1.25 0.00 0.00 42.46 42.87 2vil s ILE 18 CO 0.00 -0.02 -0.15 -1.58 0.24 0.00 0.00 174.94 173.43 2vil s GLN 19 N -0.02 2.53 0.75 0.37 0.74 -0.57 -4.70 119.66 118.76 2vil s GLN 19 Ca -0.03 -0.86 -0.02 0.00 0.05 0.00 0.00 55.36 54.50 2vil s GLN 19 Cb -0.04 -2.50 0.14 0.00 1.10 0.00 0.00 33.01 31.71 2vil s GLN 19 CO 0.03 -0.32 1.03 0.42 -0.55 0.00 0.00 175.29 175.90 2vil s ILE 20 N 1.32 2.10 -0.06 -2.34 1.01 -0.30 -1.49 121.20 121.44 2vil s ILE 20 Ca 0.01 -0.54 -0.01 0.00 0.00 0.00 0.00 60.65 60.11 2vil s ILE 20 Cb -0.15 -2.56 0.03 0.00 0.01 0.00 0.00 42.46 39.79 2vil s ILE 20 CO -0.10 0.00 0.02 0.26 0.00 0.00 0.00 174.94 175.12 2vil s TRP 21 N -3.22 0.41 -0.06 3.97 0.51 0.24 0.78 118.94 121.56 2vil s TRP 21 Ca 0.67 0.01 -0.26 0.00 -2.12 0.00 0.00 56.10 54.40 2vil s TRP 21 Cb -0.05 -0.64 -0.03 0.00 -0.81 0.00 0.00 33.47 31.94 2vil s TRP 21 CO 0.45 -0.25 0.83 -0.98 -0.51 0.00 0.00 176.95 176.49 2vil s ARG 22 N 1.93 4.45 -0.62 4.98 1.70 0.12 -1.88 118.95 129.62 2vil s ARG 22 Ca 0.03 1.10 0.02 0.00 -0.47 0.00 0.00 55.73 56.42 2vil s ARG 22 Cb -0.12 -3.48 0.39 0.00 -0.57 0.00 0.00 34.95 31.17 2vil s ARG 22 CO -0.04 -0.06 1.50 -0.89 -1.08 0.00 0.00 175.30 174.73 2vil n ILE 23 N 4.02 2.97 -0.03 4.99 2.08 0.82 -1.09 119.36 133.11 2vil n ILE 23 Ca 0.03 -4.72 -0.19 0.00 0.56 0.00 0.00 62.75 58.42 2vil n ILE 23 Cb 0.51 -1.27 -0.14 0.00 -0.75 0.00 0.00 39.64 37.99 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 -0.49 0.72 -1.05 0.38 0.28 -1.25 -3.81 120.64 115.43 2vil n GLU 24 Ca 0.45 0.23 -0.18 0.00 -0.16 0.00 0.00 57.16 57.50 2vil n GLU 24 Cb 0.47 -1.67 -0.01 0.00 1.43 0.00 0.00 31.44 31.66 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 -3.38 6.29 -1.82 -1.84 0.23 -1.26 -3.87 115.26 109.60 2vil n ASN 25 Ca -0.34 -3.01 -0.11 0.00 -0.53 0.00 0.00 54.58 50.59 2vil n ASN 25 Cb 1.04 -1.15 -0.03 0.00 -2.08 0.00 0.00 39.78 37.56 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 0.77 -1.72 -3.70 -3.83 2.81 -1.26 -4.87 117.12 105.32 2vil n MET 26 Ca 0.34 0.58 -0.13 0.00 -1.81 0.00 0.00 57.70 56.69 2vil n MET 26 Cb 0.59 -4.96 -0.07 0.00 -0.71 0.00 0.00 33.22 28.08 2vil n MET 26 CO 0.00 0.00 0.00 -1.83 1.51 0.00 0.00 175.97 175.65 2vil s GLU 27 N -3.86 0.85 -0.14 0.03 -1.05 -1.26 -5.03 118.70 108.25 2vil s GLU 27 Ca 0.00 -0.35 -0.12 0.00 -0.15 0.00 0.00 54.97 54.36 2vil s GLU 27 Cb 0.00 0.38 -0.05 0.00 -0.44 0.00 0.00 34.13 34.02 2vil s GLU 27 CO 0.00 -0.28 0.24 0.00 0.95 0.00 0.00 175.26 176.17 2vil s MET 28 N -2.24 4.01 0.12 -4.83 0.23 -1.25 -3.78 119.30 111.56 2vil s MET 28 Ca -0.07 0.02 0.10 0.00 -1.03 0.00 0.00 55.69 54.72 2vil s MET 28 Cb -0.02 -3.34 -0.04 0.00 -1.53 0.00 0.00 34.83 29.90 2vil s MET 28 CO -0.01 0.44 -0.26 0.08 -2.03 0.00 0.00 175.02 173.24 2vil s VAL 29 N -0.11 2.17 -0.99 5.16 1.01 -0.25 -3.41 120.40 123.98 2vil s VAL 29 Ca 0.15 -1.68 -0.24 0.00 0.00 0.00 0.00 61.98 60.21 2vil s VAL 29 Cb -0.13 -1.92 -0.03 0.00 0.00 0.00 0.00 36.38 34.30 2vil s VAL 29 CO 0.04 0.10 1.85 -2.16 0.00 0.00 0.00 175.10 174.93 2vil s PRO 30 N -1.94 2.78 -0.32 2.72 0.04 -1.26 -0.71 135.00 136.31 2vil s PRO 30 Ca 0.13 -0.67 -0.29 0.00 0.04 0.00 0.00 61.00 60.21 2vil s PRO 30 Cb -0.10 -5.17 -0.01 0.00 0.04 0.00 0.00 34.50 29.27 2vil s PRO 30 CO 0.05 -3.24 1.48 0.08 0.04 0.00 0.00 177.00 175.41 2vil s VAL 31 N 9.13 3.86 0.00 -0.36 1.01 0.23 -4.94 120.40 129.33 2vil s VAL 31 Ca 0.65 0.93 0.00 0.00 0.00 0.00 0.00 61.98 63.56 2vil s VAL 31 Cb -0.04 -3.99 0.00 0.00 0.00 0.00 0.00 36.38 32.35 2vil s VAL 31 CO 0.01 -0.52 0.00 -0.81 0.00 0.00 0.00 175.10 173.78 2vil n PRO 32 N 7.80 1.13 0.11 2.72 -0.04 -1.26 -1.15 135.00 144.32 2vil n PRO 32 Ca 0.17 0.00 0.09 0.00 -0.04 0.00 0.00 63.50 63.72 2vil n PRO 32 Cb 0.47 0.00 0.01 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 -0.07 0.14 0.00 0.52 1.35 -1.95 -2.89 112.91 110.01 2vil h THR 33 Ca 0.00 -1.25 0.00 0.00 -0.55 0.00 0.00 66.41 64.61 2vil h THR 33 Cb 0.00 1.72 0.00 0.00 -1.73 0.00 0.00 68.15 68.14 2vil h THR 33 CO 0.00 0.08 0.00 0.29 -0.25 0.00 0.00 175.52 175.64 2vil n LYS 34 N -2.81 0.95 0.00 4.72 5.02 -1.26 -3.76 118.16 121.02 2vil n LYS 34 Ca -0.01 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.28 2vil n LYS 34 Cb 0.61 -1.28 0.00 0.00 -0.02 0.00 0.00 35.03 34.34 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 -0.78 2.54 -4.09 4.39 7.64 -1.23 -5.08 113.62 117.01 2vil n SER 35 Ca 0.13 0.00 -0.36 0.00 1.01 0.00 0.00 58.87 59.65 2vil n SER 35 Cb 0.06 0.09 0.06 0.00 -1.01 0.00 0.00 64.21 63.41 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 -1.88 -3.99 0.00 1.43 4.11 -1.09 -3.65 117.16 112.09 2vil n TYR 36 Ca 0.00 0.09 0.00 0.00 -0.00 0.00 0.00 57.90 57.99 2vil n TYR 36 Cb 0.30 -1.50 0.00 0.00 -0.00 0.00 0.00 39.34 38.14 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 3.06 2.64 3.35 -7.48 0.00 -1.26 -4.98 105.19 100.53 2vil n GLY 37 Ca -0.00 -0.74 -0.42 0.00 0.00 0.00 0.00 46.02 44.86 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 0.00 5.84 -0.04 1.61 0.02 -1.24 -0.63 114.94 120.49 2vil s ASN 38 Ca 0.00 -1.26 0.02 0.00 -1.02 0.00 0.00 52.86 50.61 2vil s ASN 38 Cb 0.00 -2.06 0.01 0.00 0.02 0.00 0.00 41.25 39.22 2vil s ASN 38 CO 0.00 -0.51 -0.10 0.72 0.02 0.00 0.00 177.10 177.23 2vil s PHE 39 N 1.54 1.15 0.03 2.20 -0.71 -1.01 -4.64 117.98 116.53 2vil s PHE 39 Ca 0.03 -0.35 -0.39 0.00 -1.04 0.00 0.00 56.93 55.18 2vil s PHE 39 Cb -0.22 -0.85 -0.20 0.00 -1.21 0.00 0.00 43.02 40.55 2vil s PHE 39 CO 0.05 -0.18 1.01 0.66 -1.34 0.00 0.00 175.22 175.42 2vil n TYR 40 N 3.62 0.52 -3.09 3.49 4.02 -1.26 -2.07 117.16 122.39 2vil n TYR 40 Ca -0.21 1.04 -0.42 0.00 -0.01 0.00 0.00 57.90 58.29 2vil n TYR 40 Cb 0.52 -2.08 -0.06 0.00 -0.02 0.00 0.00 39.34 37.70 2vil n TYR 40 CO 0.00 0.00 0.00 -1.83 -1.01 0.00 0.00 176.86 174.02 2vil s GLU 41 N -0.11 3.48 0.00 -0.72 1.03 -0.23 -4.16 118.70 117.98 2vil s GLU 41 Ca 0.88 -0.14 0.00 0.00 0.03 0.00 0.00 54.97 55.73 2vil s GLU 41 Cb -1.22 -3.89 0.00 0.00 -0.80 0.00 0.00 34.13 28.22 2vil s GLU 41 CO 0.57 -0.90 0.00 0.41 -1.33 0.00 0.00 175.26 174.00 2vil n GLY 42 N 4.86 0.93 0.00 -3.83 0.00 -1.23 -4.50 105.19 101.43 2vil n GLY 42 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.01 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 0.00 1.69 -3.78 1.61 9.92 0.39 -2.08 116.55 124.30 2vil n ASP 43 Ca 0.00 0.00 -0.13 0.00 -0.53 0.00 0.00 54.79 54.13 2vil n ASP 43 Cb 0.00 0.00 -0.12 0.00 -0.64 0.00 0.00 41.12 40.36 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 0.43 0.17 -0.06 0.00 1.51 -0.67 -0.13 117.35 118.60 2vil s TYR 45 Ca -0.03 -0.37 -0.30 0.00 -1.01 0.00 0.00 57.07 55.37 2vil s TYR 45 Cb -0.04 -0.70 -0.02 0.00 -0.11 0.00 0.00 41.96 41.09 2vil s TYR 45 CO -0.02 -0.58 1.05 0.08 -1.11 0.00 0.00 175.55 174.97 2vil s VAL 46 N 2.15 4.67 -0.21 0.71 1.01 -0.79 -1.47 120.40 126.46 2vil s VAL 46 Ca 0.04 1.93 -0.01 0.00 0.00 0.00 0.00 61.98 63.94 2vil s VAL 46 Cb -0.16 -4.24 0.02 0.00 0.00 0.00 0.00 36.38 32.00 2vil s VAL 46 CO -0.14 0.05 -0.12 -0.22 0.00 0.00 0.00 175.10 174.67 2vil s LEU 47 N 1.76 2.71 -0.36 3.92 0.20 -0.86 0.81 118.68 126.85 2vil s LEU 47 Ca 0.51 -0.70 -0.13 0.00 0.69 0.00 0.00 54.13 54.50 2vil s LEU 47 Cb -0.21 -1.60 -0.01 0.00 -0.43 0.00 0.00 46.19 43.95 2vil s LEU 47 CO 0.22 -0.05 0.25 -0.22 -0.29 0.00 0.00 176.35 176.25 2vil s LEU 48 N 1.33 4.66 -0.18 -0.68 2.96 -0.56 -0.48 118.68 125.73 2vil s LEU 48 Ca 0.03 -0.57 -0.08 0.00 -0.22 0.00 0.00 54.13 53.29 2vil s LEU 48 Cb -0.15 -2.13 -0.04 0.00 0.50 0.00 0.00 46.19 44.37 2vil s LEU 48 CO -0.08 -0.29 0.09 -0.55 -1.32 0.00 0.00 176.35 174.20 2vil s SER 49 N 1.70 5.85 0.02 3.68 0.15 -0.70 -1.52 113.70 122.88 2vil s SER 49 Ca 0.06 0.15 0.08 0.00 0.70 0.00 0.00 55.95 56.94 2vil s SER 49 Cb -0.18 -2.00 -0.02 0.00 -1.71 0.00 0.00 66.02 62.11 2vil s SER 49 CO 0.10 0.19 -0.25 -0.89 1.20 0.00 0.00 173.24 173.60 2vil s THR 50 N 0.26 1.99 0.11 6.45 2.01 -0.77 -0.06 115.64 125.62 2vil s THR 50 Ca 0.05 -1.23 0.03 0.00 0.31 0.00 0.00 61.69 60.85 2vil s THR 50 Cb -0.12 -1.68 -0.01 0.00 0.01 0.00 0.00 72.50 70.70 2vil s THR 50 CO -0.00 0.41 0.09 -1.14 -0.69 0.00 0.00 174.62 173.28 2vil n ARG 51 N 2.05 0.20 -3.86 4.92 0.63 -0.76 -2.66 116.66 117.19 2vil n ARG 51 Ca -0.16 -1.13 -0.22 0.00 -0.92 0.00 0.00 57.85 55.41 2vil n ARG 51 Cb 0.52 0.89 -0.05 0.00 0.45 0.00 0.00 32.46 34.27 2vil n ARG 51 CO 0.00 0.00 0.00 -1.59 -2.51 0.00 0.00 177.63 173.53 2vil s LYS 52 N -2.46 2.42 0.03 -0.14 -2.85 -1.26 -1.94 119.74 113.53 2vil s LYS 52 Ca 0.13 -1.63 -0.02 0.00 -1.00 0.00 0.00 55.97 53.46 2vil s LYS 52 Cb 0.01 -2.22 0.01 0.00 -2.06 0.00 0.00 37.83 33.57 2vil s LYS 52 CO 0.09 -0.10 0.08 0.25 0.10 0.00 0.00 175.35 175.77 2vil n THR 53 N -1.37 0.00 0.36 3.79 -2.24 0.55 -4.64 114.28 110.74 2vil n THR 53 Ca 0.01 -0.08 0.12 0.00 -2.27 0.00 0.00 64.05 61.83 2vil n THR 53 Cb 0.62 0.08 0.20 0.00 -2.10 0.00 0.00 70.33 69.14 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 0.18 0.00 0.00 3.38 0.00 -2.00 -3.36 103.07 101.27 2vil h GLY 54 Ca -0.03 0.00 -0.37 0.00 0.00 0.00 0.00 47.33 46.93 2vil h GLY 54 CO 0.04 0.00 -2.33 1.44 0.00 0.00 0.00 176.54 175.69 2vil n SER 55 N -2.66 2.04 0.00 0.19 7.64 -1.26 -5.11 113.62 114.47 2vil n SER 55 Ca 0.04 0.03 0.00 0.00 1.01 0.00 0.00 58.87 59.95 2vil n SER 55 Cb 0.49 -0.50 0.00 0.00 -1.01 0.00 0.00 64.21 63.20 2vil n SER 55 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2vil n GLY 56 N 2.05 0.86 3.63 0.23 0.00 -1.26 -5.15 105.19 105.55 2vil n GLY 56 Ca -0.43 0.31 -0.29 0.00 0.00 0.00 0.00 46.02 45.60 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 1.93 2.84 -0.28 1.61 0.40 -1.26 -0.33 117.98 122.89 2vil s PHE 57 Ca 0.00 -0.11 -0.04 0.00 -0.60 0.00 0.00 56.93 56.18 2vil s PHE 57 Cb 0.00 -1.46 0.02 0.00 0.51 0.00 0.00 43.02 42.09 2vil s PHE 57 CO 0.00 0.46 0.02 -1.12 0.70 0.00 0.00 175.22 175.28 2vil s SER 58 N -2.35 4.81 0.33 1.36 0.01 -0.82 -4.88 113.70 112.15 2vil s SER 58 Ca 0.24 -0.84 -0.05 0.00 1.31 0.00 0.00 55.95 56.61 2vil s SER 58 Cb -0.11 -1.78 -0.05 0.00 0.21 0.00 0.00 66.02 64.29 2vil s SER 58 CO 0.16 -0.18 0.61 -0.31 0.41 0.00 0.00 173.24 173.93 2vil s TYR 59 N 1.41 3.48 -0.35 2.43 1.51 -1.26 -1.83 117.35 122.74 2vil s TYR 59 Ca 0.01 0.69 0.02 0.00 -1.01 0.00 0.00 57.07 56.78 2vil s TYR 59 Cb -0.17 -2.15 0.15 0.00 -0.11 0.00 0.00 41.96 39.67 2vil s TYR 59 CO -0.00 0.09 0.34 -0.80 -1.11 0.00 0.00 175.55 174.07 2vil s ASN 60 N -3.32 1.42 0.13 2.29 -0.87 0.91 -1.84 114.94 113.65 2vil s ASN 60 Ca 0.45 -1.43 -0.30 0.00 -1.57 0.00 0.00 52.86 50.01 2vil s ASN 60 Cb -0.10 0.48 -0.06 0.00 -0.02 0.00 0.00 41.25 41.54 2vil s ASN 60 CO 0.32 -0.29 1.04 -0.63 -2.57 0.00 0.00 177.10 174.97 2vil s ILE 61 N 1.62 4.22 0.30 0.60 1.01 0.77 -1.73 121.20 128.00 2vil s ILE 61 Ca 0.15 1.83 0.10 0.00 0.00 0.00 0.00 60.65 62.73 2vil s ILE 61 Cb -0.16 -4.17 -0.06 0.00 0.01 0.00 0.00 42.46 38.09 2vil s ILE 61 CO -0.10 0.27 -0.14 -1.00 0.00 0.00 0.00 174.94 173.97 2vil s HIS 62 N 0.06 2.28 -0.32 3.97 3.76 0.37 -0.63 115.29 124.78 2vil s HIS 62 Ca 0.49 -0.45 -0.02 0.00 -0.15 0.00 0.00 55.06 54.94 2vil s HIS 62 Cb -0.26 -1.16 0.11 0.00 1.11 0.00 0.00 32.58 32.38 2vil s HIS 62 CO 0.32 0.61 0.14 1.52 -0.85 0.00 0.00 174.74 176.47 2vil s TYR 63 N -2.62 0.88 0.22 1.40 1.13 -0.76 -2.04 117.35 115.56 2vil s TYR 63 Ca 0.31 -1.34 -0.30 0.00 -1.41 0.00 0.00 57.07 54.33 2vil s TYR 63 Cb -0.01 -1.20 -0.08 0.00 -1.10 0.00 0.00 41.96 39.57 2vil s TYR 63 CO 0.15 -0.84 1.12 -0.46 -2.51 0.00 0.00 175.55 173.01 2vil s TRP 64 N 1.68 3.54 -0.53 -3.49 -0.00 -0.55 -2.43 118.94 117.16 2vil s TRP 64 Ca 0.11 1.59 0.07 0.00 -0.00 0.00 0.00 56.10 57.88 2vil s TRP 64 Cb -0.18 -3.32 0.30 0.00 -0.00 0.00 0.00 33.47 30.27 2vil s TRP 64 CO -0.25 -0.74 0.78 1.28 -0.00 0.00 0.00 176.95 178.03 2vil n LEU 65 N 1.95 2.98 -4.52 5.86 7.99 -0.34 -1.67 117.00 129.25 2vil n LEU 65 Ca 0.02 -5.34 -0.33 0.00 -0.01 0.00 0.00 56.01 50.34 2vil n LEU 65 Cb 0.45 -0.19 -0.11 0.00 -0.11 0.00 0.00 43.42 43.46 2vil n LEU 65 CO 0.54 2.21 2.01 0.61 -1.51 0.00 0.00 177.39 181.26 2vil n GLY 66 N 0.43 -0.21 3.54 -0.72 0.00 0.24 -3.85 105.19 104.61 2vil n GLY 66 Ca 0.28 0.72 -0.15 0.00 0.00 0.00 0.00 46.02 46.87 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 8.30 0.42 0.00 1.61 3.00 -1.26 0.15 118.16 130.38 2vil n LYS 67 Ca 0.54 -0.67 0.00 0.00 -0.00 0.00 0.00 58.31 58.17 2vil n LYS 67 Cb 0.28 -3.07 0.00 0.00 0.00 0.00 0.00 35.03 32.23 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 15.69 0.00 -2.27 3.14 4.13 -1.25 -4.81 115.26 129.89 2vil n ASN 68 Ca 0.51 0.00 0.00 0.00 1.68 0.00 0.00 54.58 56.77 2vil n ASN 68 Cb 0.36 0.00 0.00 0.00 -1.54 0.00 0.00 39.78 38.60 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 -1.26 0.00 -4.60 6.41 3.41 -0.89 -4.97 113.62 111.73 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 -1.63 4.35 0.42 4.04 1.04 -1.26 -5.00 113.70 115.67 2vil s SER 70 Ca 0.00 -0.68 0.19 0.00 0.48 0.00 0.00 55.95 55.94 2vil s SER 70 Cb 0.00 -0.74 1.13 0.00 0.10 0.00 0.00 66.02 66.50 2vil s SER 70 CO 0.00 0.03 1.83 1.56 0.98 0.00 0.00 173.24 177.64 2vil h GLN 71 N 2.18 0.36 -0.45 4.02 4.20 -2.00 0.14 115.11 123.57 2vil h GLN 71 Ca -0.44 -0.02 0.03 0.00 0.06 0.00 0.00 58.65 58.28 2vil h GLN 71 Cb 1.24 -0.08 -0.03 0.00 0.30 0.00 0.00 27.48 28.91 2vil h GLN 71 CO 0.59 0.24 0.24 0.38 -0.67 0.00 0.00 178.83 179.61 2vil h ASP 72 N 0.37 0.37 -0.73 1.46 3.04 -1.98 0.52 116.42 119.47 2vil h ASP 72 Ca 0.51 0.02 0.08 0.00 -3.24 0.00 0.00 57.03 54.39 2vil h ASP 72 Cb 1.33 -0.06 -0.05 0.00 -1.04 0.00 0.00 39.33 39.52 2vil h ASP 72 CO -0.19 0.26 0.48 -0.33 -2.04 0.00 0.00 179.24 177.42 2vil h GLU 73 N 0.48 0.70 -0.48 4.15 4.39 -1.11 0.47 114.58 123.18 2vil h GLU 73 Ca 0.19 -0.04 -0.04 0.00 0.34 0.00 0.00 59.36 59.81 2vil h GLU 73 Cb 0.06 -0.16 -0.02 0.00 -0.10 0.00 0.00 28.75 28.53 2vil h GLU 73 CO -0.11 0.46 0.14 0.37 -1.16 0.00 0.00 179.01 178.71 2vil h GLN 74 N 0.72 0.72 0.00 2.33 -0.00 -0.64 0.10 115.11 118.34 2vil h GLN 74 Ca 0.32 -0.12 0.00 0.00 -0.00 0.00 0.00 58.65 58.85 2vil h GLN 74 Cb 0.33 -0.12 0.00 0.00 0.00 0.00 0.00 27.48 27.69 2vil h GLN 74 CO -0.11 0.63 -0.11 0.41 0.00 0.00 0.00 178.83 179.65 2vil n GLY 75 N -0.99 -1.54 0.08 2.39 0.00 0.12 -2.10 105.19 103.16 2vil n GLY 75 Ca 0.03 -0.11 -0.09 0.00 0.00 0.00 0.00 46.02 45.85 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 2.79 -0.05 -0.07 4.61 0.00 0.17 -0.82 119.26 125.89 2vil h ALA 76 Ca 0.00 -0.28 -0.17 0.00 0.00 0.00 0.00 54.91 54.46 2vil h ALA 76 Cb 0.60 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.41 2vil h ALA 76 CO 0.00 -0.07 -0.69 0.00 0.00 0.00 0.00 179.25 178.49 2vil h ALA 77 N -0.37 0.68 -0.17 0.00 0.00 -1.50 -1.80 119.26 116.10 2vil h ALA 77 Ca -0.01 -0.59 -0.17 0.00 0.00 0.00 0.00 54.91 54.14 2vil h ALA 77 Cb 0.57 -0.07 0.01 0.00 0.00 0.00 0.00 17.79 18.30 2vil h ALA 77 CO 0.01 0.76 -0.57 0.00 0.00 0.00 0.00 179.25 179.45 2vil h ALA 78 N 1.03 0.30 -0.22 0.00 0.00 -1.55 -0.32 119.26 118.51 2vil h ALA 78 Ca -0.02 -0.52 -0.08 0.00 0.00 0.00 0.00 54.91 54.29 2vil h ALA 78 Cb 1.24 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 19.00 2vil h ALA 78 CO 0.11 0.53 -0.17 0.82 0.00 0.00 0.00 179.25 180.55 2vil h ILE 79 N 0.38 1.32 0.00 0.00 2.04 -1.14 -1.23 117.51 118.88 2vil h ILE 79 Ca -0.02 -1.30 -0.08 0.00 1.00 0.00 0.00 64.86 64.46 2vil h ILE 79 Cb 1.20 1.69 -0.01 0.00 -0.74 0.00 0.00 36.82 38.95 2vil h ILE 79 CO 0.12 0.40 -0.40 1.88 0.00 0.00 0.00 178.15 180.15 2vil h TYR 80 N 0.19 0.00 0.00 1.37 -1.99 -1.38 -0.98 116.97 114.18 2vil h TYR 80 Ca 0.04 0.00 -0.04 0.00 2.00 0.00 0.00 58.73 60.73 2vil h TYR 80 Cb 0.70 0.00 -0.01 0.00 2.00 0.00 0.00 36.73 39.42 2vil h TYR 80 CO 0.07 0.40 -0.20 1.15 -0.00 0.00 0.00 178.16 179.58 2vil h THR 81 N 0.00 0.56 -0.02 -2.88 2.02 -0.78 -2.44 112.91 109.37 2vil h THR 81 Ca -0.00 -0.97 -0.02 0.00 0.77 0.00 0.00 66.41 66.18 2vil h THR 81 Cb 0.73 1.65 0.00 0.00 -1.74 0.00 0.00 68.15 68.79 2vil h THR 81 CO 0.05 0.20 -0.07 0.74 0.37 0.00 0.00 175.52 176.81 2vil h THR 82 N 0.00 1.48 -0.68 3.16 2.02 0.06 -2.95 112.91 116.00 2vil h THR 82 Ca -0.00 -1.52 0.02 0.00 0.77 0.00 0.00 66.41 65.67 2vil h THR 82 Cb 0.64 2.45 -0.04 0.00 -1.74 0.00 0.00 68.15 69.46 2vil h THR 82 CO 0.03 0.41 0.44 1.56 0.37 0.00 0.00 175.52 178.32 2vil h GLN 83 N -0.51 0.85 -0.90 6.66 4.20 -1.32 -1.53 115.11 122.56 2vil h GLN 83 Ca -0.00 -0.05 0.12 0.00 0.06 0.00 0.00 58.65 58.77 2vil h GLN 83 Cb 0.70 -0.19 -0.07 0.00 0.30 0.00 0.00 27.48 28.22 2vil h GLN 83 CO 0.01 0.56 0.58 0.52 -0.67 0.00 0.00 178.83 179.84 2vil h MET 84 N 0.87 0.79 -0.69 1.46 2.86 -1.46 0.41 114.93 119.17 2vil h MET 84 Ca 0.26 -0.05 -0.04 0.00 -2.06 0.00 0.00 59.70 57.82 2vil h MET 84 Cb -0.04 -0.18 -0.03 0.00 0.06 0.00 0.00 31.60 31.41 2vil h MET 84 CO -0.08 0.52 0.29 0.22 1.06 0.00 0.00 176.91 178.92 2vil h ASP 85 N 0.82 0.94 -0.18 1.22 3.58 -1.10 -1.03 116.42 120.66 2vil h ASP 85 Ca 0.44 -0.16 0.00 0.00 0.42 0.00 0.00 57.03 57.73 2vil h ASP 85 Cb 0.54 -0.24 0.00 0.00 1.72 0.00 0.00 39.33 41.35 2vil h ASP 85 CO -0.20 0.84 0.00 -0.62 -2.88 0.00 0.00 179.24 176.38 2vil n GLU 86 N -4.40 1.77 -0.00 0.28 1.02 -0.22 -3.32 120.64 115.76 2vil n GLU 86 Ca 0.05 -1.15 0.06 0.00 -0.02 0.00 0.00 57.16 56.10 2vil n GLU 86 Cb 0.16 -1.39 -0.08 0.00 -0.02 0.00 0.00 31.44 30.10 2vil n GLU 86 CO 0.00 0.00 0.00 0.98 1.18 0.00 0.00 177.13 179.29 2vil n TYR 87 N 0.38 0.00 -0.02 -0.32 4.19 0.13 -4.71 117.16 116.80 2vil n TYR 87 Ca 0.16 0.00 -0.01 0.00 3.31 0.00 0.00 57.90 61.36 2vil n TYR 87 Cb 0.34 -0.12 -0.00 0.00 0.49 0.00 0.00 39.34 40.05 2vil n TYR 87 CO 0.00 0.00 0.00 -0.07 0.91 0.00 0.00 176.86 177.70 2vil h LEU 88 N 0.00 0.00 0.00 2.98 3.38 -1.30 -3.49 115.31 116.88 2vil h LEU 88 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2vil h LEU 88 Cb 0.42 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.17 2vil h LEU 88 CO 0.00 0.23 0.00 0.61 0.09 0.00 0.00 178.44 179.37 2vil n GLY 89 N 1.77 0.00 1.94 0.83 0.00 -1.26 -4.92 105.19 103.55 2vil n GLY 89 Ca -0.02 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.90 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 -2.82 -0.03 1.61 7.64 -1.21 -4.68 113.62 114.12 2vil n SER 90 Ca 0.00 0.25 -0.01 0.00 1.01 0.00 0.00 58.87 60.12 2vil n SER 90 Cb 0.00 -2.67 -0.07 0.00 -1.01 0.00 0.00 64.21 60.45 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 -2.04 0.38 -0.81 0.44 0.24 -1.26 -5.01 118.33 110.26 2vil n VAL 91 Ca -0.11 -0.33 -0.29 0.00 -2.04 0.00 0.00 64.34 61.58 2vil n VAL 91 Cb 0.39 -0.34 0.23 0.00 -1.47 0.00 0.00 33.84 32.66 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 -2.41 0.05 0.44 2.33 0.00 -1.26 -4.24 121.76 116.67 2vil s ALA 92 Ca -0.04 -0.46 0.03 0.00 0.00 0.00 0.00 51.96 51.49 2vil s ALA 92 Cb 0.04 -3.10 -0.02 0.00 0.00 0.00 0.00 23.12 20.04 2vil s ALA 92 CO 0.39 -3.63 0.08 0.08 0.00 0.00 0.00 175.76 172.69 2vil s VAL 93 N -2.69 0.82 -0.07 0.00 1.01 -0.77 -4.87 120.40 113.84 2vil s VAL 93 Ca 0.68 -2.00 0.03 0.00 0.00 0.00 0.00 61.98 60.69 2vil s VAL 93 Cb -0.19 -2.31 0.00 0.00 0.00 0.00 0.00 36.38 33.88 2vil s VAL 93 CO 0.60 0.00 -0.17 -1.58 0.00 0.00 0.00 175.10 173.95 2vil s GLN 94 N -3.77 2.11 0.11 2.72 0.74 -1.25 -0.16 119.66 120.16 2vil s GLN 94 Ca 0.19 -0.61 0.06 0.00 0.05 0.00 0.00 55.36 55.05 2vil s GLN 94 Cb 0.03 -1.71 -0.04 0.00 1.10 0.00 0.00 33.01 32.39 2vil s GLN 94 CO 0.11 0.14 -0.16 -1.01 -0.55 0.00 0.00 175.29 173.83 2vil s HIS 95 N 0.36 1.46 -0.10 1.67 3.76 0.20 -4.96 115.29 117.68 2vil s HIS 95 Ca -0.12 -0.50 0.01 0.00 -0.15 0.00 0.00 55.06 54.31 2vil s HIS 95 Cb -0.15 -0.78 -0.02 0.00 1.11 0.00 0.00 32.58 32.74 2vil s HIS 95 CO 0.05 0.15 -0.14 0.50 -0.85 0.00 0.00 174.74 174.44 2vil s ARG 96 N -2.31 3.07 0.13 1.40 3.52 -1.26 -1.83 118.95 121.67 2vil s ARG 96 Ca 0.06 -0.71 -0.01 0.00 -0.13 0.00 0.00 55.73 54.94 2vil s ARG 96 Cb -0.07 -2.52 -0.04 0.00 -1.56 0.00 0.00 34.95 30.76 2vil s ARG 96 CO 0.03 0.34 0.06 -1.21 -0.81 0.00 0.00 175.30 173.72 2vil s GLU 97 N 0.00 0.92 0.00 5.12 2.02 -1.02 -4.85 118.70 120.89 2vil s GLU 97 Ca -0.04 -1.42 0.00 0.00 0.02 0.00 0.00 54.97 53.53 2vil s GLU 97 Cb -0.14 0.25 0.00 0.00 0.10 0.00 0.00 34.13 34.33 2vil s GLU 97 CO 0.04 -0.26 0.00 0.28 0.02 0.00 0.00 175.26 175.34 2vil n VAL 98 N -0.09 0.00 -2.08 2.63 0.31 -1.26 -1.19 118.33 116.64 2vil n VAL 98 Ca -0.06 0.00 -0.42 0.00 -0.01 0.00 0.00 64.34 63.85 2vil n VAL 98 Cb 0.64 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 33.57 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 0.00 3.08 0.00 5.55 10.64 -1.25 -2.96 117.38 132.44 2vil n GLN 99 Ca 0.00 -2.97 0.00 0.00 -1.83 0.00 0.00 57.00 52.20 2vil n GLN 99 Cb 0.00 -3.26 0.00 0.00 -0.86 0.00 0.00 30.24 26.12 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 4.17 1.16 0.13 2.61 0.00 -1.26 -4.94 105.19 107.06 2vil n GLY 100 Ca 0.48 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.58 2vil n GLY 100 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 173.32 173.77 2vil h HIS 101 N 0.00 0.00 -0.35 1.61 3.86 -1.89 -3.27 115.15 115.11 2vil h HIS 101 Ca 0.00 0.00 -0.06 0.00 -1.16 0.00 0.00 60.37 59.15 2vil h HIS 101 Cb 0.00 0.00 -0.04 0.00 1.06 0.00 0.00 27.41 28.43 2vil h HIS 101 CO 0.00 0.20 0.08 -0.85 0.86 0.00 0.00 177.93 178.22 2vil n GLU 102 N -2.86 2.70 0.00 2.45 0.00 -1.17 -4.58 120.64 117.17 2vil n GLU 102 Ca -0.01 -1.61 0.00 0.00 0.00 0.00 0.00 57.16 55.53 2vil n GLU 102 Cb 0.64 -1.83 0.00 0.00 0.00 0.00 0.00 31.44 30.25 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 0.16 0.00 0.27 -1.84 3.41 -1.24 -1.39 113.62 112.99 2vil n SER 103 Ca 0.18 0.00 0.18 0.00 -0.26 0.00 0.00 58.87 58.97 2vil n SER 103 Cb 0.83 0.00 0.91 0.00 -0.26 0.00 0.00 64.21 65.69 2vil n SER 103 CO 0.00 0.00 0.00 1.05 -0.16 0.00 0.00 175.04 175.93 2vil h GLU 104 N 0.00 0.00 0.02 4.33 4.11 -1.90 -1.91 114.58 119.23 2vil h GLU 104 Ca 0.00 0.00 -0.00 0.00 0.07 0.00 0.00 59.36 59.43 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 -0.01 1.15 0.07 0.00 0.00 179.01 180.22 2vil h THR 105 N 0.00 0.00 0.55 -1.06 2.02 -1.82 -0.79 112.91 111.81 2vil h THR 105 Ca 0.00 -0.84 -0.02 0.00 0.77 0.00 0.00 66.41 66.32 2vil h THR 105 Cb 0.14 0.00 -0.00 0.00 -1.74 0.00 0.00 68.15 66.54 2vil h THR 105 CO 0.00 0.00 -0.33 0.15 0.37 0.00 0.00 175.52 175.71 2vil h PHE 106 N -0.86 -0.86 -0.38 3.16 3.57 -1.21 -1.25 116.94 119.12 2vil h PHE 106 Ca -0.00 -0.01 0.08 0.00 3.53 0.00 0.00 57.97 61.57 2vil h PHE 106 Cb 0.02 0.30 -0.02 0.00 2.79 0.00 0.00 35.95 39.04 2vil h PHE 106 CO 0.00 -0.50 0.26 -0.09 -2.23 0.00 0.00 178.31 175.75 2vil h ARG 107 N -0.83 0.15 -0.16 1.11 2.43 -1.30 -1.66 114.38 114.13 2vil h ARG 107 Ca -0.07 -0.01 0.05 0.00 -0.81 0.00 0.00 59.98 59.15 2vil h ARG 107 Cb 0.67 -0.03 -0.06 0.00 -0.42 0.00 0.00 29.97 30.12 2vil h ARG 107 CO 0.07 0.10 -0.28 0.00 -1.51 0.00 0.00 179.97 178.36 2vil h ALA 108 N 1.81 -0.27 0.00 2.80 0.00 0.09 0.61 119.26 124.29 2vil h ALA 108 Ca 0.17 0.04 -0.02 0.00 0.00 0.00 0.00 54.91 55.10 2vil h ALA 108 Cb 0.49 0.55 -0.00 0.00 0.00 0.00 0.00 17.79 18.82 2vil h ALA 108 CO -0.02 -0.74 -0.10 1.88 0.00 0.00 0.00 179.25 180.27 2vil h TYR 109 N -0.33 0.00 -3.62 0.00 0.05 -1.05 -3.33 116.97 108.69 2vil h TYR 109 Ca 0.11 0.00 -0.76 0.00 0.05 0.00 0.00 58.73 58.13 2vil h TYR 109 Cb 0.50 0.00 -0.28 0.00 1.01 0.00 0.00 36.73 37.97 2vil h TYR 109 CO -0.39 0.10 -0.08 -0.06 -1.05 0.00 0.00 178.16 176.68 2vil s PHE 110 N -4.15 3.59 -1.01 4.88 0.40 0.21 -5.00 117.98 116.91 2vil s PHE 110 Ca -0.03 -2.01 -0.22 0.00 -0.60 0.00 0.00 56.93 54.07 2vil s PHE 110 Cb 0.13 -3.67 0.07 0.00 0.51 0.00 0.00 43.02 40.05 2vil s PHE 110 CO 0.57 -0.97 1.38 0.15 0.70 0.00 0.00 175.22 177.05 2vil s LYS 111 N 0.44 3.61 0.00 0.44 1.02 -1.22 -4.18 119.74 119.84 2vil s LYS 111 Ca 0.14 -1.30 0.00 0.00 0.02 0.00 0.00 55.97 54.84 2vil s LYS 111 Cb -0.16 -5.26 0.00 0.00 -0.52 0.00 0.00 37.83 31.88 2vil s LYS 111 CO -0.05 -2.11 0.00 0.94 -0.92 0.00 0.00 175.35 173.21 2vil n GLN 112 N 8.32 0.00 0.00 1.68 7.27 -1.26 -5.14 117.38 128.25 2vil n GLN 112 Ca 0.31 0.00 0.00 0.00 0.07 0.00 0.00 57.00 57.38 2vil n GLN 112 Cb 0.50 0.00 0.00 0.00 2.41 0.00 0.00 30.24 33.15 2vil n GLN 112 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 2vil n GLY 113 N 0.00 3.68 0.00 1.69 0.00 -1.26 -5.16 105.19 104.14 2vil n GLY 113 Ca 0.00 -0.22 0.00 0.00 0.00 0.00 0.00 46.02 45.80 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 -4.96 0.99 4.77 -1.26 -4.86 117.00 111.68 2vil n LEU 114 Ca 0.00 0.00 -0.22 0.00 -0.03 0.00 0.00 56.01 55.76 2vil n LEU 114 Cb 0.00 0.00 0.01 0.00 -2.33 0.00 0.00 43.42 41.10 2vil n LEU 114 CO 0.00 0.00 0.28 -0.63 -1.33 0.00 0.00 177.39 175.71 2vil s ILE 115 N 0.00 3.88 -0.15 -0.08 1.01 0.19 -5.01 121.20 121.04 2vil s ILE 115 Ca 0.00 -0.54 -0.04 0.00 0.00 0.00 0.00 60.65 60.07 2vil s ILE 115 Cb 0.00 -3.43 0.06 0.00 0.01 0.00 0.00 42.46 39.10 2vil s ILE 115 CO 0.00 -0.29 0.14 -0.31 0.00 0.00 0.00 174.94 174.47 2vil s TYR 116 N -2.55 -0.02 0.00 3.97 2.02 -1.26 -2.40 117.35 117.11 2vil s TYR 116 Ca 0.49 0.08 0.00 0.00 -0.37 0.00 0.00 57.07 57.27 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 0.37 -0.45 0.00 1.63 -1.57 0.00 0.00 175.55 175.53 2vil n LYS 117 N 5.30 0.02 -3.51 -0.62 4.01 -0.88 -4.49 118.16 118.00 2vil n LYS 117 Ca -0.06 0.00 -0.33 0.00 -0.51 0.00 0.00 58.31 57.42 2vil n LYS 117 Cb 0.49 0.00 -0.05 0.00 -0.51 0.00 0.00 35.03 34.96 2vil n LYS 117 CO 0.00 0.00 0.00 -1.14 -1.11 0.00 0.00 177.40 175.15 2vil s GLN 118 N -2.77 3.77 0.50 1.97 2.00 -1.26 -1.06 119.66 122.80 2vil s GLN 118 Ca 0.00 0.19 -0.08 0.00 -2.00 0.00 0.00 55.36 53.46 2vil s GLN 118 Cb 0.00 -2.80 0.13 0.00 0.80 0.00 0.00 33.01 31.13 2vil s GLN 118 CO 0.00 0.42 0.39 0.41 -0.50 0.00 0.00 175.29 176.01 2vil n GLY 119 N 0.25 -3.01 2.18 2.59 0.00 -1.26 -4.64 105.19 101.29 2vil n GLY 119 Ca -0.03 -1.39 0.00 0.00 0.00 0.00 0.00 46.02 44.60 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 -0.96 -5.41 0.00 -0.02 0.00 -1.25 -5.03 105.19 92.52 2vil n GLY 120 Ca 0.06 -0.11 0.00 0.00 0.00 0.00 0.00 46.02 45.96 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 1.95 0.00 0.00 1.61 0.31 -1.25 -4.98 118.33 115.97 2vil n VAL 121 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.33 2vil n VAL 121 Cb 0.00 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 32.93 2vil n VAL 121 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2vil n ALA 122 N -3.00 0.00 -1.06 3.52 0.00 -1.26 -4.95 120.51 113.77 2vil n ALA 122 Ca 0.00 -0.04 -0.02 0.00 0.00 0.00 0.00 53.44 53.38 2vil n ALA 122 Cb 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 19.45 19.44 2vil n ALA 122 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 2vil n SER 123 N -1.85 -3.57 -3.61 0.00 7.64 -1.26 -3.61 113.62 107.35 2vil n SER 123 Ca 0.00 0.05 -0.23 0.00 1.01 0.00 0.00 58.87 59.69 2vil n SER 123 Cb 0.00 -1.24 0.04 0.00 -1.01 0.00 0.00 64.21 62.00 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 -2.31 -0.68 1.78 0.23 0.00 -1.26 -4.89 105.19 98.06 2vil n GLY 124 Ca -0.02 0.32 0.00 0.00 0.00 0.00 0.00 46.02 46.32 2vil n GLY 124 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 2vil n MET 125 N -4.04 0.00 0.00 1.61 2.00 -1.24 -5.30 117.12 110.14 2vil n MET 125 Ca -0.19 0.00 0.04 0.00 0.00 0.00 0.00 57.70 57.54 2vil n MET 125 Cb 0.64 -0.01 0.03 0.00 0.00 0.00 0.00 33.22 33.88 2vil n MET 125 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 175.97 177.14