#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2vil n GLU 2 N 0.00 -1.29 -0.33 1.45 1.02 -1.26 -4.84 120.64 115.39 2vil n GLU 2 Ca 0.00 1.03 0.21 0.00 -0.02 0.00 0.00 57.16 58.39 2vil n GLU 2 Cb 0.00 -4.80 0.43 0.00 -0.02 0.00 0.00 31.44 27.05 2vil n GLU 2 CO 0.00 0.00 0.00 1.37 1.18 0.00 0.00 177.13 179.68 2vil h LEU 3 N -0.11 0.38 -9.14 -4.62 -0.00 -1.95 -3.41 115.31 96.45 2vil h LEU 3 Ca -0.18 0.19 -0.59 0.00 -0.00 0.00 0.00 57.88 57.30 2vil h LEU 3 Cb 1.09 0.17 0.18 0.00 -0.00 0.00 0.00 40.66 42.11 2vil h LEU 3 CO 0.27 -0.14 -0.98 -0.24 -0.00 0.00 0.00 178.44 177.35 2vil n SER 4 N -5.10 -3.05 0.00 0.17 2.88 -1.26 0.82 113.62 108.08 2vil n SER 4 Ca 0.29 0.66 0.00 0.00 -1.33 0.00 0.00 58.87 58.49 2vil n SER 4 Cb 0.91 -0.94 0.00 0.00 -0.75 0.00 0.00 64.21 63.44 2vil n SER 4 CO 0.00 0.00 0.00 1.17 -1.23 0.00 0.00 175.04 174.98 2vil n LYS 5 N 1.10 0.00 -0.26 -1.46 4.81 -1.26 -4.14 118.16 116.94 2vil n LYS 5 Ca 0.08 0.00 0.04 0.00 -0.87 0.00 0.00 58.31 57.57 2vil n LYS 5 Cb 0.48 0.00 0.15 0.00 0.02 0.00 0.00 35.03 35.68 2vil n LYS 5 CO 0.00 0.00 0.00 1.63 1.17 0.00 0.00 177.40 180.20 2vil n LYS 6 N 0.00 2.14 0.00 1.64 4.76 -1.00 -4.06 118.16 121.65 2vil n LYS 6 Ca 0.00 -1.21 0.00 0.00 -2.87 0.00 0.00 58.31 54.23 2vil n LYS 6 Cb 0.00 -1.51 0.00 0.00 -1.84 0.00 0.00 35.03 31.68 2vil n LYS 6 CO 0.00 0.00 0.00 0.28 -1.37 0.00 0.00 177.40 176.31 2vil n VAL 7 N 0.34 0.00 0.15 -0.18 0.31 0.24 -4.89 118.33 114.31 2vil n VAL 7 Ca 0.11 0.00 0.18 0.00 -0.01 0.00 0.00 64.34 64.62 2vil n VAL 7 Cb 0.44 0.00 0.63 0.00 -0.91 0.00 0.00 33.84 33.99 2vil n VAL 7 CO 0.00 0.00 0.00 0.74 -1.32 0.00 0.00 176.83 176.25 2vil h THR 8 N 0.00 0.15 -0.47 2.52 2.02 -1.73 0.48 112.91 115.88 2vil h THR 8 Ca 0.00 0.00 -0.27 0.00 0.77 0.00 0.00 66.41 66.91 2vil h THR 8 Cb 0.00 0.46 -0.14 0.00 -1.74 0.00 0.00 68.15 66.73 2vil h THR 8 CO 0.00 0.00 0.34 0.61 0.37 0.00 0.00 175.52 176.84 2vil n GLY 9 N -1.45 3.44 0.00 2.16 0.00 -1.26 -4.19 105.19 103.89 2vil n GLY 9 Ca 0.06 -0.68 0.00 0.00 0.00 0.00 0.00 46.02 45.41 2vil n GLY 9 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2vil n LYS 10 N -0.09 0.00 0.00 1.61 4.76 0.16 -4.95 118.16 119.66 2vil n LYS 10 Ca 0.29 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.73 2vil n LYS 10 Cb 0.92 0.00 0.00 0.00 -1.84 0.00 0.00 35.03 34.11 2vil n LYS 10 CO 0.00 0.00 0.00 1.28 -1.37 0.00 0.00 177.40 177.31 2vil n LEU 11 N 0.00 0.00 -4.64 -0.35 4.77 -0.94 -4.88 117.00 110.95 2vil n LEU 11 Ca 0.00 0.00 -0.42 0.00 -0.03 0.00 0.00 56.01 55.56 2vil n LEU 11 Cb 0.00 0.00 -0.04 0.00 -2.33 0.00 0.00 43.42 41.05 2vil n LEU 11 CO 0.00 0.00 0.71 -1.81 -1.33 0.00 0.00 177.39 174.96 2vil s ASP 12 N -1.55 6.88 0.00 -1.43 1.01 -1.26 -4.85 116.67 115.46 2vil s ASP 12 Ca 0.00 1.08 0.00 0.00 0.71 0.00 0.00 52.55 54.34 2vil s ASP 12 Cb 0.00 -2.46 0.00 0.00 1.01 0.00 0.00 42.92 41.47 2vil s ASP 12 CO 0.00 -0.57 0.00 0.29 0.21 0.00 0.00 175.17 175.10 2vil n LYS 13 N 6.13 4.95 -2.75 8.23 4.76 -1.26 -4.89 118.16 133.33 2vil n LYS 13 Ca 0.07 0.00 -0.08 0.00 -2.87 0.00 0.00 58.31 55.43 2vil n LYS 13 Cb 0.47 -0.53 0.05 0.00 -1.84 0.00 0.00 35.03 33.19 2vil n LYS 13 CO 0.00 0.00 0.00 0.25 -1.37 0.00 0.00 177.40 176.28 2vil n THR 14 N -0.94 0.00 -3.43 -0.18 -2.24 -1.26 -4.82 114.28 101.42 2vil n THR 14 Ca 0.00 -1.46 0.02 0.00 -2.27 0.00 0.00 64.05 60.34 2vil n THR 14 Cb 0.00 1.48 -0.05 0.00 -2.10 0.00 0.00 70.33 69.66 2vil n THR 14 CO 0.00 0.00 0.00 0.28 -0.57 0.00 0.00 175.07 174.78 2vil s THR 15 N 0.67 -0.14 -0.55 4.28 -1.32 -1.26 -5.11 115.64 112.21 2vil s THR 15 Ca 0.32 0.00 -0.28 0.00 -1.21 0.00 0.00 61.69 60.52 2vil s THR 15 Cb 0.23 -1.00 0.02 0.00 -1.51 0.00 0.00 72.50 70.24 2vil s THR 15 CO -0.24 0.00 1.32 -2.16 -2.21 0.00 0.00 174.62 171.33 2vil s PRO 16 N 1.76 3.41 0.00 7.08 0.04 -1.26 -4.69 135.00 141.35 2vil s PRO 16 Ca -0.04 0.42 0.00 0.00 0.04 0.00 0.00 61.00 61.42 2vil s PRO 16 Cb -0.03 -4.07 0.00 0.00 0.04 0.00 0.00 34.50 30.44 2vil s PRO 16 CO -0.15 -1.80 0.00 0.41 0.04 0.00 0.00 177.00 175.51 2vil n GLY 17 N 5.16 -0.42 3.16 0.56 0.00 -0.97 -5.01 105.19 107.67 2vil n GLY 17 Ca 0.11 -1.05 -0.28 0.00 0.00 0.00 0.00 46.02 44.80 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 1.59 -0.04 -0.61 -4.36 -1.26 -1.10 121.20 113.42 2vil s ILE 18 Ca 0.00 -0.79 0.03 0.00 -0.26 0.00 0.00 60.65 59.63 2vil s ILE 18 Cb 0.00 -1.36 -0.03 0.00 1.25 0.00 0.00 42.46 42.32 2vil s ILE 18 CO 0.00 0.45 -0.12 -1.58 0.24 0.00 0.00 174.94 173.94 2vil s GLN 19 N 0.07 2.55 0.49 0.37 0.74 -0.71 -4.87 119.66 118.29 2vil s GLN 19 Ca -0.06 -0.68 0.02 0.00 0.05 0.00 0.00 55.36 54.70 2vil s GLN 19 Cb -0.13 -2.44 0.02 0.00 1.10 0.00 0.00 33.01 31.57 2vil s GLN 19 CO 0.03 0.63 0.18 -0.89 -0.55 0.00 0.00 175.29 174.69 2vil n ILE 20 N 2.16 0.00 -3.66 -2.34 5.41 -0.99 0.43 119.36 120.36 2vil n ILE 20 Ca -0.17 -2.12 -0.19 0.00 1.00 0.00 0.00 62.75 61.27 2vil n ILE 20 Cb 0.52 0.20 -0.17 0.00 -0.71 0.00 0.00 39.64 39.48 2vil n ILE 20 CO 0.00 0.00 0.00 0.26 0.00 0.00 0.00 176.55 176.81 2vil s TRP 21 N -2.60 -0.04 -0.03 1.39 0.51 0.29 -0.21 118.94 118.24 2vil s TRP 21 Ca 0.14 0.38 -0.30 0.00 -2.12 0.00 0.00 56.10 54.20 2vil s TRP 21 Cb -0.01 -0.40 -0.03 0.00 -0.81 0.00 0.00 33.47 32.22 2vil s TRP 21 CO 0.09 -0.24 1.03 -0.98 -0.51 0.00 0.00 176.95 176.34 2vil s ARG 22 N 2.22 4.48 -0.61 4.98 1.70 0.64 -1.89 118.95 130.48 2vil s ARG 22 Ca 0.04 1.48 -0.02 0.00 -0.47 0.00 0.00 55.73 56.76 2vil s ARG 22 Cb -0.12 -3.48 0.32 0.00 -0.57 0.00 0.00 34.95 31.10 2vil s ARG 22 CO -0.05 -0.20 2.14 -0.89 -1.08 0.00 0.00 175.30 175.23 2vil n ILE 23 N 4.18 3.41 -1.21 4.99 2.08 0.33 -0.09 119.36 133.04 2vil n ILE 23 Ca 0.08 -3.01 -0.29 0.00 0.56 0.00 0.00 62.75 60.09 2vil n ILE 23 Cb 0.49 -1.28 0.16 0.00 -0.75 0.00 0.00 39.64 38.26 2vil n ILE 23 CO 0.00 0.00 0.00 -0.70 0.56 0.00 0.00 176.55 176.41 2vil s GLU 24 N -3.17 0.76 -0.73 0.38 2.12 -1.26 -3.10 118.70 113.70 2vil s GLU 24 Ca 0.54 0.59 0.00 0.00 0.36 0.00 0.00 54.97 56.46 2vil s GLU 24 Cb 0.42 -1.77 0.00 0.00 0.26 0.00 0.00 34.13 33.04 2vil s GLU 24 CO -0.14 -2.52 0.00 0.27 -0.54 0.00 0.00 175.26 172.33 2vil n ASN 25 N -4.04 -2.35 -3.52 -1.70 0.23 -1.26 -0.38 115.26 102.24 2vil n ASN 25 Ca 0.06 0.24 -0.19 0.00 -0.53 0.00 0.00 54.58 54.17 2vil n ASN 25 Cb 0.57 -2.23 0.07 0.00 -2.08 0.00 0.00 39.78 36.10 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 -2.05 -5.78 0.00 -3.83 2.81 -1.18 -4.92 117.12 102.18 2vil n MET 26 Ca -0.08 0.77 0.00 0.00 -1.81 0.00 0.00 57.70 56.57 2vil n MET 26 Cb 0.40 -5.60 0.00 0.00 -0.71 0.00 0.00 33.22 27.30 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 -4.14 0.00 0.00 0.03 -0.58 0.49 -5.02 120.64 111.42 2vil n GLU 27 Ca -0.28 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.46 2vil n GLU 27 Cb 0.67 0.00 0.00 0.00 -0.57 0.00 0.00 31.44 31.54 2vil n GLU 27 CO 0.00 0.00 0.00 -0.12 -0.48 0.00 0.00 177.13 176.53 2vil n MET 28 N 0.00 0.00 -3.55 3.49 1.56 -1.24 -4.53 117.12 112.86 2vil n MET 28 Ca 0.00 0.00 -0.17 0.00 -0.27 0.00 0.00 57.70 57.26 2vil n MET 28 Cb 0.00 0.00 -0.06 0.00 2.15 0.00 0.00 33.22 35.31 2vil n MET 28 CO 0.00 0.00 0.00 0.08 -0.73 0.00 0.00 175.97 175.32 2vil s VAL 29 N -2.00 0.00 -0.82 1.12 1.01 0.87 -2.43 120.40 118.15 2vil s VAL 29 Ca 0.00 0.00 -0.25 0.00 0.00 0.00 0.00 61.98 61.73 2vil s VAL 29 Cb 0.00 -1.00 -0.00 0.00 0.00 0.00 0.00 36.38 35.38 2vil s VAL 29 CO 0.00 0.00 1.68 -2.16 0.00 0.00 0.00 175.10 174.62 2vil s PRO 30 N -0.81 2.93 -0.37 2.72 0.04 -1.26 -0.26 135.00 137.99 2vil s PRO 30 Ca -0.08 -0.22 -0.29 0.00 0.04 0.00 0.00 61.00 60.45 2vil s PRO 30 Cb -0.01 -4.77 0.01 0.00 0.04 0.00 0.00 34.50 29.77 2vil s PRO 30 CO 0.08 -2.70 1.29 0.08 0.04 0.00 0.00 177.00 175.79 2vil s VAL 31 N 7.83 4.10 0.00 -0.36 1.01 0.71 -4.91 120.40 128.77 2vil s VAL 31 Ca 0.57 1.20 0.00 0.00 0.00 0.00 0.00 61.98 63.75 2vil s VAL 31 Cb -0.07 -4.27 0.00 0.00 0.00 0.00 0.00 36.38 32.04 2vil s VAL 31 CO 0.06 -0.65 0.00 -0.81 0.00 0.00 0.00 175.10 173.70 2vil n PRO 32 N 7.61 0.80 0.00 2.72 -0.04 -1.26 -2.35 135.00 142.48 2vil n PRO 32 Ca 0.15 0.00 0.14 0.00 -0.04 0.00 0.00 63.50 63.74 2vil n PRO 32 Cb 0.47 0.00 0.49 0.00 -0.04 0.00 0.00 33.50 34.43 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 -0.42 0.00 1.19 0.52 -2.24 -1.26 -3.34 114.28 108.74 2vil n THR 33 Ca 0.00 -0.13 0.06 0.00 -2.27 0.00 0.00 64.05 61.71 2vil n THR 33 Cb 0.00 0.25 0.21 0.00 -2.10 0.00 0.00 70.33 68.69 2vil n THR 33 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 2vil n LYS 34 N -0.57 1.62 -0.55 -0.78 4.76 -1.26 -4.03 118.16 117.35 2vil n LYS 34 Ca 0.15 -0.96 -0.01 0.00 -2.87 0.00 0.00 58.31 54.62 2vil n LYS 34 Cb 0.32 -1.26 -0.01 0.00 -1.84 0.00 0.00 35.03 32.24 2vil n LYS 34 CO 0.00 0.00 0.00 0.43 -1.37 0.00 0.00 177.40 176.46 2vil n SER 35 N 0.25 -0.11 -1.69 4.39 7.64 -1.24 -4.93 113.62 117.93 2vil n SER 35 Ca 0.11 -1.11 -0.13 0.00 1.01 0.00 0.00 58.87 58.75 2vil n SER 35 Cb 0.25 0.03 0.08 0.00 -1.01 0.00 0.00 64.21 63.56 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 0.00 1.56 0.00 1.43 4.11 -1.21 -3.69 117.16 119.35 2vil n TYR 36 Ca -0.03 -1.40 0.00 0.00 -0.00 0.00 0.00 57.90 56.47 2vil n TYR 36 Cb 0.52 -0.70 0.00 0.00 -0.00 0.00 0.00 39.34 39.16 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 -0.16 0.99 2.79 -7.48 0.00 -1.26 -4.96 105.19 95.11 2vil n GLY 37 Ca 0.30 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 46.17 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 -0.84 1.41 -0.11 1.61 0.01 -1.24 -1.09 114.94 114.68 2vil s ASN 38 Ca 0.00 -0.63 0.01 0.00 -0.71 0.00 0.00 52.86 51.53 2vil s ASN 38 Cb 0.00 0.62 -0.01 0.00 0.41 0.00 0.00 41.25 42.27 2vil s ASN 38 CO 0.00 -0.38 -0.15 0.72 -1.51 0.00 0.00 177.10 175.78 2vil s PHE 39 N 2.40 2.74 0.74 2.20 -0.71 -0.77 -4.86 117.98 119.71 2vil s PHE 39 Ca 0.09 -0.64 -0.17 0.00 -1.04 0.00 0.00 56.93 55.18 2vil s PHE 39 Cb -0.14 -1.78 -0.15 0.00 -1.21 0.00 0.00 43.02 39.74 2vil s PHE 39 CO -0.31 -0.19 -0.46 0.66 -1.34 0.00 0.00 175.22 173.58 2vil n TYR 40 N 3.33 -3.99 -0.07 3.49 4.02 -1.26 -3.53 117.16 119.15 2vil n TYR 40 Ca -0.18 0.19 -0.22 0.00 -0.01 0.00 0.00 57.90 57.68 2vil n TYR 40 Cb 0.53 -1.51 -0.12 0.00 -0.02 0.00 0.00 39.34 38.21 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 1.96 0.64 -1.81 -0.72 0.28 -0.53 -4.46 120.64 115.99 2vil n GLU 41 Ca 0.03 0.44 -0.41 0.00 -0.16 0.00 0.00 57.16 57.05 2vil n GLU 41 Cb 0.50 -1.71 -0.00 0.00 1.43 0.00 0.00 31.44 31.66 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 1.63 4.54 0.00 -1.84 0.00 -1.26 -4.24 105.19 104.02 2vil n GLY 42 Ca -0.34 -1.73 0.00 0.00 0.00 0.00 0.00 46.02 43.95 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 4.76 0.81 -3.82 1.61 9.92 -0.41 -4.21 116.55 125.22 2vil n ASP 43 Ca 0.55 0.00 -0.12 0.00 -0.53 0.00 0.00 54.79 54.68 2vil n ASP 43 Cb 0.34 0.00 -0.13 0.00 -0.64 0.00 0.00 41.12 40.70 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 0.10 0.63 0.04 0.00 1.51 -0.37 -0.51 117.35 118.76 2vil s TYR 45 Ca -0.00 -0.62 -0.30 0.00 -1.01 0.00 0.00 57.07 55.14 2vil s TYR 45 Cb -0.01 -0.88 -0.04 0.00 -0.11 0.00 0.00 41.96 40.92 2vil s TYR 45 CO 0.00 -0.57 1.03 0.08 -1.11 0.00 0.00 175.55 174.98 2vil s VAL 46 N 1.99 4.57 0.31 0.71 1.01 -0.79 -1.34 120.40 126.86 2vil s VAL 46 Ca 0.01 1.91 0.08 0.00 0.00 0.00 0.00 61.98 63.98 2vil s VAL 46 Cb -0.17 -4.22 -0.04 0.00 0.00 0.00 0.00 36.38 31.95 2vil s VAL 46 CO -0.09 0.19 0.11 -0.22 0.00 0.00 0.00 175.10 175.08 2vil s LEU 47 N 0.75 3.28 -0.37 3.92 0.20 -0.54 0.10 118.68 126.03 2vil s LEU 47 Ca 0.52 -0.70 0.05 0.00 0.69 0.00 0.00 54.13 54.69 2vil s LEU 47 Cb -0.24 -1.77 0.17 0.00 -0.43 0.00 0.00 46.19 43.92 2vil s LEU 47 CO 0.29 -0.20 0.49 -0.22 -0.29 0.00 0.00 176.35 176.41 2vil s LEU 48 N -3.80 -0.79 0.38 -0.68 2.96 0.17 -1.19 118.68 115.74 2vil s LEU 48 Ca 0.36 -1.03 -0.21 0.00 -0.22 0.00 0.00 54.13 53.03 2vil s LEU 48 Cb -0.04 1.23 -0.10 0.00 0.50 0.00 0.00 46.19 47.78 2vil s LEU 48 CO 0.22 -0.24 0.90 -0.55 -1.32 0.00 0.00 176.35 175.36 2vil s SER 49 N 1.81 6.98 -0.08 3.68 0.15 -0.38 -1.74 113.70 124.12 2vil s SER 49 Ca 0.15 1.63 -0.03 0.00 0.70 0.00 0.00 55.95 58.40 2vil s SER 49 Cb -0.10 -2.51 0.04 0.00 -1.71 0.00 0.00 66.02 61.73 2vil s SER 49 CO -0.10 -0.27 0.08 -0.89 1.20 0.00 0.00 173.24 173.26 2vil s THR 50 N -2.02 -0.11 0.49 6.45 2.01 -0.26 -0.59 115.64 121.61 2vil s THR 50 Ca 0.58 0.25 0.05 0.00 0.31 0.00 0.00 61.69 62.88 2vil s THR 50 Cb -0.11 -0.28 -0.00 0.00 0.01 0.00 0.00 72.50 72.11 2vil s THR 50 CO 0.16 0.04 0.26 -0.13 -0.69 0.00 0.00 174.62 174.26 2vil s ARG 51 N 2.17 2.25 0.21 4.92 0.52 -1.02 -2.30 118.95 125.71 2vil s ARG 51 Ca 0.04 -2.01 0.07 0.00 -0.52 0.00 0.00 55.73 53.31 2vil s ARG 51 Cb -0.13 -1.97 -0.04 0.00 0.52 0.00 0.00 34.95 33.33 2vil s ARG 51 CO -0.05 -0.39 0.08 -1.59 0.02 0.00 0.00 175.30 173.37 2vil s LYS 52 N -4.08 2.62 0.01 3.54 -2.85 -1.26 -1.80 119.74 115.92 2vil s LYS 52 Ca 0.31 -1.11 0.00 0.00 -1.00 0.00 0.00 55.97 54.17 2vil s LYS 52 Cb 0.00 -2.43 0.00 0.00 -2.06 0.00 0.00 37.83 33.35 2vil s LYS 52 CO 0.18 0.43 0.02 0.25 0.10 0.00 0.00 175.35 176.33 2vil n THR 53 N -0.62 0.00 1.51 3.79 -2.24 -0.02 -4.83 114.28 111.88 2vil n THR 53 Ca -0.08 -0.08 0.02 0.00 -2.27 0.00 0.00 64.05 61.64 2vil n THR 53 Cb 0.57 0.05 0.07 0.00 -2.10 0.00 0.00 70.33 68.91 2vil n THR 53 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2vil n GLY 54 N -0.02 -0.27 1.69 3.38 0.00 -1.26 -4.23 105.19 104.48 2vil n GLY 54 Ca 0.00 -0.16 0.00 0.00 0.00 0.00 0.00 46.02 45.86 2vil n GLY 54 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2vil n SER 55 N -0.06 0.10 0.00 1.61 3.41 -1.26 -5.15 113.62 112.27 2vil n SER 55 Ca 0.05 0.18 0.00 0.00 -0.26 0.00 0.00 58.87 58.84 2vil n SER 55 Cb 0.13 0.09 0.00 0.00 -0.26 0.00 0.00 64.21 64.17 2vil n SER 55 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2vil n GLY 56 N 2.04 3.62 3.34 5.00 0.00 -1.26 -5.16 105.19 112.77 2vil n GLY 56 Ca 0.00 -0.15 -0.30 0.00 0.00 0.00 0.00 46.02 45.58 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 0.80 2.29 -0.44 1.61 0.40 -1.26 -0.84 117.98 120.54 2vil s PHE 57 Ca 0.00 -0.41 -0.14 0.00 -0.60 0.00 0.00 56.93 55.78 2vil s PHE 57 Cb 0.00 -1.38 0.06 0.00 0.51 0.00 0.00 43.02 42.21 2vil s PHE 57 CO 0.00 0.12 0.34 -1.12 0.70 0.00 0.00 175.22 175.26 2vil s SER 58 N -1.23 6.05 0.46 1.36 0.01 -0.74 -4.87 113.70 114.74 2vil s SER 58 Ca 0.12 -1.21 -0.10 0.00 1.31 0.00 0.00 55.95 56.06 2vil s SER 58 Cb -0.10 -2.14 -0.06 0.00 0.21 0.00 0.00 66.02 63.93 2vil s SER 58 CO 0.02 -0.56 0.84 -0.31 0.41 0.00 0.00 173.24 173.64 2vil s TYR 59 N 1.62 3.50 -0.26 2.43 2.02 -1.25 -2.42 117.35 122.99 2vil s TYR 59 Ca 0.04 1.10 -0.03 0.00 -0.37 0.00 0.00 57.07 57.81 2vil s TYR 59 Cb -0.22 -2.51 0.11 0.00 -0.40 0.00 0.00 41.96 38.94 2vil s TYR 59 CO 0.07 -0.25 0.21 -0.80 -1.57 0.00 0.00 175.55 173.20 2vil s ASN 60 N -3.45 2.34 -0.40 2.29 0.01 0.24 -1.74 114.94 114.24 2vil s ASN 60 Ca 0.52 -0.84 -0.20 0.00 -0.71 0.00 0.00 52.86 51.63 2vil s ASN 60 Cb -0.10 0.12 0.01 0.00 0.41 0.00 0.00 41.25 41.69 2vil s ASN 60 CO 0.37 -0.39 0.60 -0.63 -1.51 0.00 0.00 177.10 175.53 2vil s ILE 61 N 2.24 4.90 0.37 0.60 1.01 -0.20 -1.25 121.20 128.87 2vil s ILE 61 Ca 0.08 0.25 0.07 0.00 0.00 0.00 0.00 60.65 61.05 2vil s ILE 61 Cb -0.15 -4.11 -0.02 0.00 0.01 0.00 0.00 42.46 38.19 2vil s ILE 61 CO -0.29 -0.43 0.36 -1.00 0.00 0.00 0.00 174.94 173.59 2vil s HIS 62 N 2.65 2.86 -0.22 3.97 3.76 -0.33 -1.50 115.29 126.48 2vil s HIS 62 Ca 0.21 -0.36 -0.04 0.00 -0.15 0.00 0.00 55.06 54.73 2vil s HIS 62 Cb -0.15 -1.98 0.07 0.00 1.11 0.00 0.00 32.58 31.63 2vil s HIS 62 CO 0.16 0.02 0.09 1.52 -0.85 0.00 0.00 174.74 175.68 2vil s TYR 63 N -2.34 0.55 0.01 1.40 -0.85 -0.75 -1.46 117.35 113.90 2vil s TYR 63 Ca 0.45 -0.70 -0.28 0.00 -0.52 0.00 0.00 57.07 56.02 2vil s TYR 63 Cb -0.06 -0.91 -0.04 0.00 0.38 0.00 0.00 41.96 41.33 2vil s TYR 63 CO 0.28 -0.65 0.87 -0.46 -1.52 0.00 0.00 175.55 174.08 2vil s TRP 64 N 2.02 3.68 -0.63 -3.49 -0.00 -0.45 -1.77 118.94 118.30 2vil s TRP 64 Ca 0.04 1.57 0.05 0.00 -0.00 0.00 0.00 56.10 57.76 2vil s TRP 64 Cb -0.16 -2.98 0.29 0.00 -0.00 0.00 0.00 33.47 30.62 2vil s TRP 64 CO -0.17 0.10 0.87 1.28 -0.00 0.00 0.00 176.95 179.03 2vil n LEU 65 N 3.49 4.22 -4.53 5.86 7.99 -0.52 -1.23 117.00 132.29 2vil n LEU 65 Ca 0.02 -5.56 -0.20 0.00 -0.01 0.00 0.00 56.01 50.27 2vil n LEU 65 Cb 0.51 -0.64 -0.15 0.00 -0.11 0.00 0.00 43.42 43.03 2vil n LEU 65 CO 0.50 2.19 1.72 0.61 -1.51 0.00 0.00 177.39 180.90 2vil n GLY 66 N 0.33 -0.32 3.02 -0.72 0.00 0.50 -3.63 105.19 104.38 2vil n GLY 66 Ca 0.31 0.23 -0.16 0.00 0.00 0.00 0.00 46.02 46.40 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 7.26 0.00 0.00 1.61 4.81 -1.26 -1.29 118.16 129.30 2vil n LYS 67 Ca 0.57 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 58.01 2vil n LYS 67 Cb 0.28 -0.89 0.00 0.00 0.02 0.00 0.00 35.03 34.44 2vil n LYS 67 CO 0.00 0.00 0.00 0.09 1.17 0.00 0.00 177.40 178.66 2vil n ASN 68 N 4.70 0.00 -4.49 3.14 3.02 -1.26 -4.81 115.26 115.56 2vil n ASN 68 Ca 0.48 0.00 -0.28 0.00 -0.03 0.00 0.00 54.58 54.75 2vil n ASN 68 Cb 0.19 0.16 0.25 0.00 -0.61 0.00 0.00 39.78 39.77 2vil n ASN 68 CO 0.00 0.00 0.00 -0.94 -2.62 0.00 0.00 177.26 173.70 2vil s SER 69 N -1.37 0.93 0.91 6.41 1.04 -1.24 -4.92 113.70 115.46 2vil s SER 69 Ca 0.00 1.59 -0.12 0.00 0.48 0.00 0.00 55.95 57.90 2vil s SER 69 Cb 0.00 -2.36 0.14 0.00 0.10 0.00 0.00 66.02 63.90 2vil s SER 69 CO 0.00 -4.24 1.12 -0.94 0.98 0.00 0.00 173.24 170.16 2vil s SER 70 N -2.45 3.50 0.15 7.02 1.04 -1.26 -4.82 113.70 116.88 2vil s SER 70 Ca 0.69 1.08 -0.20 0.00 0.48 0.00 0.00 55.95 57.99 2vil s SER 70 Cb -0.25 -1.70 0.03 0.00 0.10 0.00 0.00 66.02 64.20 2vil s SER 70 CO 0.65 -2.57 1.67 -0.61 0.98 0.00 0.00 173.24 173.35 2vil h GLN 71 N -1.51 -0.11 -0.97 4.02 4.15 -2.01 -0.36 115.11 118.33 2vil h GLN 71 Ca -0.51 0.01 0.11 0.00 0.77 0.00 0.00 58.65 59.03 2vil h GLN 71 Cb 1.32 0.02 -0.08 0.00 0.21 0.00 0.00 27.48 28.96 2vil h GLN 71 CO 0.60 -0.07 0.62 0.38 -1.93 0.00 0.00 178.83 178.43 2vil h ASP 72 N -0.11 0.90 -0.92 -0.69 3.04 -1.98 0.10 116.42 116.76 2vil h ASP 72 Ca 0.14 0.04 0.08 0.00 -3.24 0.00 0.00 57.03 54.05 2vil h ASP 72 Cb 0.32 -0.15 -0.06 0.00 -1.04 0.00 0.00 39.33 38.39 2vil h ASP 72 CO -0.32 0.50 0.59 -0.33 -2.04 0.00 0.00 179.24 177.64 2vil h GLU 73 N 0.98 0.95 -0.26 4.15 3.07 -1.41 0.61 114.58 122.67 2vil h GLU 73 Ca 0.47 -0.06 -0.05 0.00 -0.50 0.00 0.00 59.36 59.22 2vil h GLU 73 Cb 0.44 -0.21 -0.02 0.00 -0.84 0.00 0.00 28.75 28.12 2vil h GLU 73 CO -0.23 0.63 -0.06 1.96 -1.40 0.00 0.00 179.01 179.92 2vil h GLN 74 N 0.98 0.41 0.00 2.33 4.20 -0.33 -0.12 115.11 122.58 2vil h GLN 74 Ca 0.42 -0.09 0.00 0.00 0.06 0.00 0.00 58.65 59.03 2vil h GLN 74 Cb 0.32 -0.06 0.00 0.00 0.30 0.00 0.00 27.48 28.04 2vil h GLN 74 CO -0.17 0.49 -0.17 0.41 -0.67 0.00 0.00 178.83 178.72 2vil n GLY 75 N -0.87 -1.46 0.12 3.46 0.00 0.13 -2.41 105.19 104.17 2vil n GLY 75 Ca 0.01 -0.16 -0.21 0.00 0.00 0.00 0.00 46.02 45.65 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 2.91 0.12 -0.10 4.61 0.00 0.18 -2.23 119.26 124.74 2vil h ALA 76 Ca 0.00 -0.99 -0.10 0.00 0.00 0.00 0.00 54.91 53.82 2vil h ALA 76 Cb 0.55 0.39 0.00 0.00 0.00 0.00 0.00 17.79 18.73 2vil h ALA 76 CO 0.00 0.70 -0.31 0.00 0.00 0.00 0.00 179.25 179.64 2vil h ALA 77 N -0.04 0.17 -0.67 0.00 0.00 -1.40 -1.55 119.26 115.78 2vil h ALA 77 Ca -0.26 -0.43 -0.07 0.00 0.00 0.00 0.00 54.91 54.16 2vil h ALA 77 Cb 1.69 -0.02 -0.03 0.00 0.00 0.00 0.00 17.79 19.43 2vil h ALA 77 CO 0.06 0.21 0.15 0.00 0.00 0.00 0.00 179.25 179.68 2vil h ALA 78 N 0.48 1.01 -0.57 0.00 0.00 -1.64 -2.13 119.26 116.42 2vil h ALA 78 Ca -0.01 -0.24 -0.08 0.00 0.00 0.00 0.00 54.91 54.58 2vil h ALA 78 Cb 0.93 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 18.44 2vil h ALA 78 CO 0.07 0.64 0.06 0.82 0.00 0.00 0.00 179.25 180.84 2vil h ILE 79 N 1.01 1.26 0.00 0.00 5.03 -1.38 -1.57 117.51 121.85 2vil h ILE 79 Ca 0.21 -1.03 -0.01 0.00 -0.12 0.00 0.00 64.86 63.91 2vil h ILE 79 Cb 0.36 0.81 -0.00 0.00 -3.03 0.00 0.00 36.82 34.96 2vil h ILE 79 CO 0.00 0.37 -0.07 1.88 -0.68 0.00 0.00 178.15 179.66 2vil h TYR 80 N 0.86 0.00 0.00 1.37 0.05 -0.91 0.13 116.97 118.47 2vil h TYR 80 Ca 0.17 0.00 -0.09 0.00 0.05 0.00 0.00 58.73 58.86 2vil h TYR 80 Cb 0.46 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 38.19 2vil h TYR 80 CO 0.03 0.07 -0.43 1.15 -1.05 0.00 0.00 178.16 177.94 2vil h THR 81 N 0.00 0.86 0.00 -2.88 2.02 -0.68 -2.60 112.91 109.62 2vil h THR 81 Ca -0.00 -1.81 -0.16 0.00 0.77 0.00 0.00 66.41 65.21 2vil h THR 81 Cb 0.13 2.14 -0.02 0.00 -1.74 0.00 0.00 68.15 68.65 2vil h THR 81 CO 0.01 0.42 -0.80 0.74 0.37 0.00 0.00 175.52 176.25 2vil h THR 82 N 0.00 1.16 0.09 3.16 2.02 0.11 -2.78 112.91 116.67 2vil h THR 82 Ca -0.00 -2.68 -0.27 0.00 0.77 0.00 0.00 66.41 64.23 2vil h THR 82 Cb 1.10 2.55 0.01 0.00 -1.74 0.00 0.00 68.15 70.08 2vil h THR 82 CO 0.06 0.66 -1.15 1.56 0.37 0.00 0.00 175.52 177.02 2vil h GLN 83 N 0.00 0.41 -0.00 6.66 1.08 -1.01 -3.15 115.11 119.10 2vil h GLN 83 Ca -0.03 -0.56 0.00 0.00 -1.45 0.00 0.00 58.65 56.61 2vil h GLN 83 Cb 1.57 0.19 0.00 0.00 -0.05 0.00 0.00 27.48 29.19 2vil h GLN 83 CO 0.09 1.23 -0.09 0.00 -0.95 0.00 0.00 178.83 179.10 2vil n MET 84 N -3.68 0.21 0.02 1.46 0.00 -0.99 -2.25 117.12 111.89 2vil n MET 84 Ca -0.09 -0.04 -0.19 0.00 0.00 0.00 0.00 57.70 57.38 2vil n MET 84 Cb 0.95 -1.50 -0.10 0.00 0.00 0.00 0.00 33.22 32.57 2vil n MET 84 CO 0.00 0.00 0.00 0.22 0.00 0.00 0.00 175.97 176.19 2vil h ASP 85 N 0.10 0.78 0.54 3.17 3.58 -1.44 -2.29 116.42 120.85 2vil h ASP 85 Ca 0.00 -0.73 -0.27 0.00 0.42 0.00 0.00 57.03 56.45 2vil h ASP 85 Cb 0.43 -0.24 -0.05 0.00 1.72 0.00 0.00 39.33 41.19 2vil h ASP 85 CO 0.00 1.40 -1.65 -0.62 -2.88 0.00 0.00 179.24 175.50 2vil n GLU 86 N -4.00 0.63 0.10 0.28 -0.58 -1.23 -2.53 120.64 113.30 2vil n GLU 86 Ca -0.10 0.29 -0.03 0.00 -0.42 0.00 0.00 57.16 56.90 2vil n GLU 86 Cb 0.79 -1.80 0.19 0.00 -0.57 0.00 0.00 31.44 30.04 2vil n GLU 86 CO 0.00 0.00 0.00 1.88 -0.48 0.00 0.00 177.13 178.53 2vil h TYR 87 N 0.00 0.26 0.00 -0.32 0.05 -1.54 -2.60 116.97 112.81 2vil h TYR 87 Ca -0.26 -0.08 -0.02 0.00 0.05 0.00 0.00 58.73 58.42 2vil h TYR 87 Cb 1.93 -0.05 -0.00 0.00 1.01 0.00 0.00 36.73 39.62 2vil h TYR 87 CO 0.00 0.66 -0.07 -0.07 -1.05 0.00 0.00 178.16 177.63 2vil h LEU 88 N 0.17 0.00 0.00 3.88 3.38 -1.53 -3.45 115.31 117.75 2vil h LEU 88 Ca 0.01 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.98 2vil h LEU 88 Cb 0.93 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.68 2vil h LEU 88 CO 0.07 0.07 0.00 0.61 0.09 0.00 0.00 178.44 179.29 2vil n GLY 89 N -0.46 1.60 3.00 0.83 0.00 -0.98 -4.58 105.19 104.60 2vil n GLY 89 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.01 2vil n GLY 89 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2vil n SER 90 N 0.00 -1.65 0.13 1.61 2.88 -1.05 -4.81 113.62 110.73 2vil n SER 90 Ca 0.00 0.00 0.12 0.00 -1.33 0.00 0.00 58.87 57.66 2vil n SER 90 Cb 0.00 -1.25 0.05 0.00 -0.75 0.00 0.00 64.21 62.26 2vil n SER 90 CO 0.00 0.00 0.00 -0.37 -1.23 0.00 0.00 175.04 173.44 2vil h VAL 91 N 0.00 0.00 -4.40 2.46 -1.51 -1.81 -3.47 116.25 107.53 2vil h VAL 91 Ca 0.00 -0.97 -0.46 0.00 -1.23 0.00 0.00 66.70 64.03 2vil h VAL 91 Cb 0.15 1.59 0.12 0.00 -2.13 0.00 0.00 31.29 31.02 2vil h VAL 91 CO 0.00 0.00 0.35 0.00 -1.23 0.00 0.00 177.57 176.69 2vil s ALA 92 N -3.32 2.15 0.38 5.19 0.00 -1.26 -3.81 121.76 121.08 2vil s ALA 92 Ca 0.02 -0.59 0.01 0.00 0.00 0.00 0.00 51.96 51.39 2vil s ALA 92 Cb 0.09 -3.00 -0.00 0.00 0.00 0.00 0.00 23.12 20.21 2vil s ALA 92 CO 0.76 -2.04 0.02 0.28 0.00 0.00 0.00 175.76 174.79 2vil n VAL 93 N -3.58 0.00 -4.71 0.00 0.31 -0.71 -4.90 118.33 104.74 2vil n VAL 93 Ca 0.07 -1.84 -0.23 0.00 -0.01 0.00 0.00 64.34 62.33 2vil n VAL 93 Cb 0.60 0.42 -0.15 0.00 -0.91 0.00 0.00 33.84 33.80 2vil n VAL 93 CO 0.00 0.00 0.00 -1.10 -1.32 0.00 0.00 176.83 174.41 2vil s GLN 94 N -3.37 1.24 0.02 5.55 -0.21 -1.26 -1.03 119.66 120.60 2vil s GLN 94 Ca 0.03 -0.55 -0.03 0.00 0.02 0.00 0.00 55.36 54.83 2vil s GLN 94 Cb 0.00 -1.20 -0.01 0.00 1.00 0.00 0.00 33.01 32.80 2vil s GLN 94 CO 0.02 0.33 0.03 -1.01 -2.12 0.00 0.00 175.29 172.54 2vil s HIS 95 N -0.37 0.21 -0.06 0.91 3.76 -0.56 -4.93 115.29 114.26 2vil s HIS 95 Ca 0.06 -0.46 0.01 0.00 -0.15 0.00 0.00 55.06 54.52 2vil s HIS 95 Cb -0.06 -0.16 -0.03 0.00 1.11 0.00 0.00 32.58 33.44 2vil s HIS 95 CO -0.01 -0.25 -0.05 -0.98 -0.85 0.00 0.00 174.74 172.61 2vil s ARG 96 N -1.70 2.76 0.15 1.40 1.70 -1.26 -1.81 118.95 120.18 2vil s ARG 96 Ca -0.13 -0.55 -0.10 0.00 -0.47 0.00 0.00 55.73 54.48 2vil s ARG 96 Cb -0.07 -2.62 -0.00 0.00 -0.57 0.00 0.00 34.95 31.68 2vil s ARG 96 CO -0.01 0.66 0.29 -1.21 -1.08 0.00 0.00 175.30 173.95 2vil s GLU 97 N -0.97 1.10 0.20 3.89 0.41 -0.73 -4.85 118.70 117.75 2vil s GLU 97 Ca 0.14 -1.07 -0.05 0.00 -0.41 0.00 0.00 54.97 53.57 2vil s GLU 97 Cb -0.11 0.39 0.02 0.00 -1.78 0.00 0.00 34.13 32.65 2vil s GLU 97 CO 0.03 -0.40 0.35 0.28 -0.49 0.00 0.00 175.26 175.03 2vil n VAL 98 N -0.19 0.00 0.88 2.63 0.31 -1.26 -1.43 118.33 119.26 2vil n VAL 98 Ca -0.10 -0.70 0.08 0.00 -0.01 0.00 0.00 64.34 63.61 2vil n VAL 98 Cb 0.63 0.55 0.43 0.00 -0.91 0.00 0.00 33.84 34.54 2vil n VAL 98 CO 0.00 0.00 0.00 1.67 -1.32 0.00 0.00 176.83 177.18 2vil n GLN 99 N -0.29 0.39 -0.31 5.55 7.27 -1.24 -2.34 117.38 126.41 2vil n GLN 99 Ca -0.03 0.05 0.00 0.00 0.07 0.00 0.00 57.00 57.09 2vil n GLN 99 Cb 0.31 -1.50 0.00 0.00 2.41 0.00 0.00 30.24 31.46 2vil n GLN 99 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 2vil n GLY 100 N -0.03 -0.44 0.00 1.69 0.00 -1.26 -4.83 105.19 100.33 2vil n GLY 100 Ca 0.10 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.12 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 -0.03 1.61 8.25 -0.99 -4.64 115.22 119.42 2vil n HIS 101 Ca 0.00 0.00 -0.03 0.00 -0.26 0.00 0.00 57.72 57.43 2vil n HIS 101 Cb 0.59 0.00 0.16 0.00 1.12 0.00 0.00 29.99 31.86 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 -1.16 2.41 0.00 -0.41 0.00 -1.03 -4.52 120.64 115.93 2vil n GLU 102 Ca 0.00 -1.57 0.00 0.00 0.00 0.00 0.00 57.16 55.59 2vil n GLU 102 Cb 0.00 -1.77 0.00 0.00 0.00 0.00 0.00 31.44 29.67 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 0.04 0.00 0.22 -1.84 3.41 -1.26 -1.55 113.62 112.64 2vil n SER 103 Ca 0.21 0.00 0.15 0.00 -0.26 0.00 0.00 58.87 58.98 2vil n SER 103 Cb 0.89 0.00 0.69 0.00 -0.26 0.00 0.00 64.21 65.53 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 0.20 4.33 5.08 -1.97 -2.59 114.58 119.63 2vil h GLU 104 Ca 0.00 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.35 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 -0.10 1.15 -1.00 0.00 0.00 179.01 179.06 2vil h THR 105 N 0.00 0.75 0.63 1.13 2.02 -1.84 0.27 112.91 115.86 2vil h THR 105 Ca 0.00 -1.02 -0.03 0.00 0.77 0.00 0.00 66.41 66.13 2vil h THR 105 Cb 0.31 1.24 0.01 0.00 -1.74 0.00 0.00 68.15 67.97 2vil h THR 105 CO 0.00 0.19 -0.30 0.15 0.37 0.00 0.00 175.52 175.93 2vil h PHE 106 N -0.87 -0.78 -0.68 3.16 3.57 -1.23 -1.90 116.94 118.21 2vil h PHE 106 Ca -0.03 -0.02 0.19 0.00 3.53 0.00 0.00 57.97 61.65 2vil h PHE 106 Cb 0.51 0.26 -0.03 0.00 2.79 0.00 0.00 35.95 39.48 2vil h PHE 106 CO 0.07 -0.44 0.49 -0.09 -2.23 0.00 0.00 178.31 176.11 2vil h ARG 107 N -1.02 0.01 -0.55 1.11 2.43 -1.51 0.18 114.38 115.03 2vil h ARG 107 Ca -0.09 -0.00 0.03 0.00 -0.81 0.00 0.00 59.98 59.12 2vil h ARG 107 Cb 0.69 -0.00 -0.04 0.00 -0.42 0.00 0.00 29.97 30.20 2vil h ARG 107 CO 0.14 0.01 0.32 0.00 -1.51 0.00 0.00 179.97 178.93 2vil h ALA 108 N 1.66 0.71 0.00 2.80 0.00 0.34 0.46 119.26 125.23 2vil h ALA 108 Ca 0.32 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.23 2vil h ALA 108 Cb 1.28 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.93 2vil h ALA 108 CO -0.01 0.01 0.00 0.66 0.00 0.00 0.00 179.25 179.91 2vil n TYR 109 N -4.80 0.79 -3.90 0.00 4.01 0.55 -4.39 117.16 109.42 2vil n TYR 109 Ca 0.05 0.25 -0.33 0.00 -0.16 0.00 0.00 57.90 57.71 2vil n TYR 109 Cb 0.10 -0.91 -0.13 0.00 -0.31 0.00 0.00 39.34 38.09 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 -3.15 3.56 -1.35 -0.72 0.40 0.15 -4.91 117.98 111.96 2vil s PHE 110 Ca 0.09 -2.83 -0.13 0.00 -0.60 0.00 0.00 56.93 53.46 2vil s PHE 110 Cb 0.12 -3.03 0.10 0.00 0.51 0.00 0.00 43.02 40.71 2vil s PHE 110 CO 0.52 -0.91 1.95 1.17 0.70 0.00 0.00 175.22 178.65 2vil n LYS 111 N 4.05 3.19 0.00 0.44 4.81 -1.25 -4.35 118.16 125.05 2vil n LYS 111 Ca 0.03 -3.13 0.00 0.00 -0.87 0.00 0.00 58.31 54.34 2vil n LYS 111 Cb 0.39 -3.20 0.00 0.00 0.02 0.00 0.00 35.03 32.25 2vil n LYS 111 CO 0.00 0.00 0.00 1.04 1.17 0.00 0.00 177.40 179.61 2vil n GLN 112 N 5.86 0.00 0.00 1.64 6.02 -1.26 -5.15 117.38 124.49 2vil n GLN 112 Ca 0.46 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 57.45 2vil n GLN 112 Cb 0.40 0.00 0.00 0.00 1.02 0.00 0.00 30.24 31.66 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 -0.69 0.93 3.72 1.08 0.00 -1.26 -5.15 105.19 103.82 2vil n GLY 113 Ca 0.00 0.33 -0.35 0.00 0.00 0.00 0.00 46.02 45.99 2vil n GLY 113 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2vil s LEU 114 N 0.00 3.92 0.34 0.99 1.43 -1.26 -4.74 118.68 119.36 2vil s LEU 114 Ca 0.00 0.21 0.08 0.00 -1.03 0.00 0.00 54.13 53.39 2vil s LEU 114 Cb 0.00 -1.95 -0.03 0.00 0.03 0.00 0.00 46.19 44.24 2vil s LEU 114 CO 0.00 0.30 0.26 -0.63 0.23 0.00 0.00 176.35 176.51 2vil s ILE 115 N -0.40 3.35 -0.26 -0.59 1.01 -0.25 -4.97 121.20 119.08 2vil s ILE 115 Ca 0.10 -1.45 -0.04 0.00 0.00 0.00 0.00 60.65 59.26 2vil s ILE 115 Cb -0.12 -3.12 0.10 0.00 0.01 0.00 0.00 42.46 39.33 2vil s ILE 115 CO 0.02 -0.16 0.15 -0.31 0.00 0.00 0.00 174.94 174.64 2vil s TYR 116 N -2.35 0.14 0.00 3.97 1.51 -1.25 -1.85 117.35 117.52 2vil s TYR 116 Ca 0.41 -0.60 0.00 0.00 -1.01 0.00 0.00 57.07 55.87 2vil s TYR 116 Cb -0.05 -0.76 0.00 0.00 -0.11 0.00 0.00 41.96 41.04 2vil s TYR 116 CO 0.26 -0.77 0.00 1.63 -1.11 0.00 0.00 175.55 175.55 2vil n LYS 117 N 5.27 2.10 -2.59 -0.62 4.76 -1.23 -4.34 118.16 121.50 2vil n LYS 117 Ca -0.06 0.00 -0.24 0.00 -2.87 0.00 0.00 58.31 55.15 2vil n LYS 117 Cb 0.44 0.00 0.12 0.00 -1.84 0.00 0.00 35.03 33.76 2vil n LYS 117 CO 0.00 0.00 0.00 1.04 -1.37 0.00 0.00 177.40 177.07 2vil n GLN 118 N 0.00 -0.15 -1.60 1.97 6.02 -1.26 -1.45 117.38 120.90 2vil n GLN 118 Ca 0.00 -2.76 0.00 0.00 -0.01 0.00 0.00 57.00 54.23 2vil n GLN 118 Cb 0.00 -0.69 0.00 0.00 1.02 0.00 0.00 30.24 30.57 2vil n GLN 118 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2vil n GLY 119 N -2.85 3.51 3.27 1.08 0.00 -1.26 -4.35 105.19 104.59 2vil n GLY 119 Ca 0.17 -2.18 -0.19 0.00 0.00 0.00 0.00 46.02 43.82 2vil n GLY 119 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2vil n GLY 120 N 5.00 -0.35 0.75 -0.02 0.00 -1.26 -4.79 105.19 104.52 2vil n GLY 120 Ca 0.00 0.67 0.05 0.00 0.00 0.00 0.00 46.02 46.74 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 0.45 0.66 0.16 1.61 3.14 -1.26 -3.77 118.33 119.32 2vil n VAL 121 Ca -0.03 -0.48 0.06 0.00 -2.96 0.00 0.00 64.34 60.92 2vil n VAL 121 Cb 0.54 0.03 0.07 0.00 -1.06 0.00 0.00 33.84 33.42 2vil n VAL 121 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 2vil h ALA 122 N 3.38 0.78 -3.19 1.55 0.00 -1.98 -3.46 119.26 116.32 2vil h ALA 122 Ca 0.00 -0.31 -0.12 0.00 0.00 0.00 0.00 54.91 54.48 2vil h ALA 122 Cb 0.64 -0.05 -0.03 0.00 0.00 0.00 0.00 17.79 18.36 2vil h ALA 122 CO 0.06 0.42 -0.14 0.43 0.00 0.00 0.00 179.25 180.03 2vil n SER 123 N -3.17 -2.07 -0.02 0.00 7.64 -1.25 -4.68 113.62 110.07 2vil n SER 123 Ca 0.02 0.26 0.02 0.00 1.01 0.00 0.00 58.87 60.18 2vil n SER 123 Cb 0.67 -1.99 0.03 0.00 -1.01 0.00 0.00 64.21 61.91 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 -0.41 3.00 0.00 0.23 0.00 -1.26 -5.03 105.19 101.72 2vil n GLY 124 Ca -0.07 -0.25 0.00 0.00 0.00 0.00 0.00 46.02 45.70 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 -0.67 3.83 0.00 1.61 2.81 -1.26 -5.26 117.12 118.18 2vil n MET 125 Ca 0.03 0.00 0.12 0.00 -1.81 0.00 0.00 57.70 56.04 2vil n MET 125 Cb 0.36 0.00 0.10 0.00 -0.71 0.00 0.00 33.22 32.96 2vil n MET 125 CO 0.00 0.00 0.00 1.63 1.51 0.00 0.00 175.97 179.11