#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3n3v s ILE 4 N 0.00 4.90 -0.27 12.58 1.01 0.63 -4.92 121.20 135.12 3n3v s ILE 4 Ca 0.00 0.28 -0.25 0.00 0.00 0.00 0.00 60.65 60.67 3n3v s ILE 4 Cb 0.00 -4.11 0.00 0.00 0.01 0.00 0.00 42.46 38.37 3n3v s ILE 4 CO 0.00 -0.42 0.88 -0.75 0.00 0.00 0.00 174.94 174.65 3n3v s LYS 5 N 2.66 4.10 -0.21 2.79 2.20 -1.26 -0.05 119.74 129.98 3n3v s LYS 5 Ca 0.22 0.91 -0.01 0.00 -0.36 0.00 0.00 55.97 56.72 3n3v s LYS 5 Cb -0.15 -3.69 0.01 0.00 -1.51 0.00 0.00 37.83 32.50 3n3v s LYS 5 CO 0.16 -0.65 -0.12 0.00 -0.36 0.00 0.00 175.35 174.38 3n3v s VAL 7 N 1.36 3.48 -0.26 0.00 1.01 -0.89 -0.14 120.40 124.97 3n3v s VAL 7 Ca 0.05 -0.50 -0.11 0.00 0.00 0.00 0.00 61.98 61.42 3n3v s VAL 7 Cb -0.14 -2.51 -0.05 0.00 0.00 0.00 0.00 36.38 33.68 3n3v s VAL 7 CO -0.08 0.49 0.19 -0.69 0.00 0.00 0.00 175.10 175.01 3n3v s VAL 8 N 0.55 5.32 0.27 2.92 1.01 0.66 -1.22 120.40 129.91 3n3v s VAL 8 Ca -0.05 0.20 0.06 0.00 0.00 0.00 0.00 61.98 62.19 3n3v s VAL 8 Cb -0.15 -3.53 -0.06 0.00 0.00 0.00 0.00 36.38 32.65 3n3v s VAL 8 CO 0.03 0.28 -0.05 0.68 0.00 0.00 0.00 175.10 176.05 3n3v s VAL 9 N 1.49 1.50 0.00 2.92 -7.23 -0.15 -3.41 120.40 115.52 3n3v s VAL 9 Ca 0.08 -2.10 0.00 0.00 -1.81 0.00 0.00 61.98 58.14 3n3v s VAL 9 Cb -0.15 -2.41 0.00 0.00 0.56 0.00 0.00 36.38 34.38 3n3v s VAL 9 CO 0.08 -0.31 0.00 0.61 -0.31 0.00 0.00 175.10 175.17 3n3v n GLY 10 N -0.54 3.18 3.58 2.32 0.00 -1.26 -0.90 105.19 111.57 3n3v n GLY 10 Ca -0.05 -1.58 -0.34 0.00 0.00 0.00 0.00 46.02 44.04 3n3v n GLY 10 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3n3v n ASP 11 N 0.00 -0.04 -4.75 1.61 8.00 -1.26 -4.10 116.55 116.01 3n3v n ASP 11 Ca 0.00 0.57 -0.38 0.00 0.71 0.00 0.00 54.79 55.69 3n3v n ASP 11 Cb 0.00 -1.38 0.03 0.00 -0.02 0.00 0.00 41.12 39.75 3n3v n ASP 11 CO 0.00 0.00 0.00 -0.83 -0.39 0.00 0.00 177.20 175.98 3n3v s GLY 12 N -1.86 2.85 0.00 0.44 0.00 -1.26 -3.17 107.32 104.32 3n3v s GLY 12 Ca 0.69 1.22 0.00 0.00 0.00 0.00 0.00 44.72 46.63 3n3v s GLY 12 CO 0.55 1.71 0.00 0.00 0.00 0.00 0.00 173.10 175.35 3n3v n ALA 13 N -1.02 0.00 0.61 3.20 0.00 -1.26 -4.87 120.51 117.16 3n3v n ALA 13 Ca 0.10 0.00 0.13 0.00 0.00 0.00 0.00 53.44 53.67 3n3v n ALA 13 Cb 0.46 -0.09 0.43 0.00 0.00 0.00 0.00 19.45 20.24 3n3v n ALA 13 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.50 178.83 3n3v n VAL 14 N -2.22 0.61 0.00 0.00 0.24 -1.19 -4.91 118.33 110.87 3n3v n VAL 14 Ca 0.00 -0.20 0.00 0.00 -2.04 0.00 0.00 64.34 62.10 3n3v n VAL 14 Cb 0.01 -0.67 0.00 0.00 -1.47 0.00 0.00 33.84 31.71 3n3v n VAL 14 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3n3v n GLY 15 N 1.13 1.62 0.22 7.63 0.00 -1.26 -4.55 105.19 109.97 3n3v n GLY 15 Ca 0.05 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 46.02 3n3v n GLY 15 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3n3v h LYS 16 N 0.00 0.59 -0.06 1.61 1.57 -1.90 -2.27 116.57 116.11 3n3v h LYS 16 Ca 0.00 -0.04 -0.19 0.00 -1.87 0.00 0.00 60.65 58.55 3n3v h LYS 16 Cb 0.00 -0.13 0.01 0.00 0.08 0.00 0.00 32.23 32.19 3n3v h LYS 16 CO 0.00 0.39 -0.71 1.15 -0.57 0.00 0.00 179.45 179.71 3n3v h THR 17 N 0.61 1.35 -0.22 -0.16 2.02 -1.91 -3.14 112.91 111.46 3n3v h THR 17 Ca 0.22 -2.02 -0.05 0.00 0.77 0.00 0.00 66.41 65.33 3n3v h THR 17 Cb 0.05 2.32 -0.01 0.00 -1.74 0.00 0.00 68.15 68.76 3n3v h THR 17 CO -0.11 0.61 -0.09 0.00 0.37 0.00 0.00 175.52 176.31 3n3v h LEU 19 N 0.33 0.43 -0.28 0.00 8.10 -1.48 0.92 115.31 123.32 3n3v h LEU 19 Ca 0.07 -0.29 -0.05 0.00 0.11 0.00 0.00 57.88 57.72 3n3v h LEU 19 Cb 0.36 -0.13 -0.01 0.00 -0.44 0.00 0.00 40.66 40.44 3n3v h LEU 19 CO 0.02 1.03 -0.01 -0.07 -4.11 0.00 0.00 178.44 175.30 3n3v h LEU 20 N 0.24 0.48 -0.49 0.17 3.38 -1.40 -1.05 115.31 116.64 3n3v h LEU 20 Ca -0.03 -0.32 -0.14 0.00 0.09 0.00 0.00 57.88 57.48 3n3v h LEU 20 Cb 1.33 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 41.94 3n3v h LEU 20 CO 0.13 0.68 -0.27 0.40 0.09 0.00 0.00 178.44 179.47 3n3v h ILE 21 N 0.27 1.27 -0.62 1.22 2.04 -1.15 -1.44 117.51 119.10 3n3v h ILE 21 Ca 0.08 -1.43 -0.07 0.00 1.00 0.00 0.00 64.86 64.43 3n3v h ILE 21 Cb 0.44 1.21 -0.03 0.00 -0.74 0.00 0.00 36.82 37.70 3n3v h ILE 21 CO 0.02 0.49 0.09 -1.28 0.00 0.00 0.00 178.15 177.46 3n3v h SER 22 N 0.81 0.97 -0.15 1.72 0.87 -0.79 -1.35 113.55 115.63 3n3v h SER 22 Ca 0.09 -0.23 -0.04 0.00 -1.23 0.00 0.00 61.79 60.39 3n3v h SER 22 Cb 0.84 -0.26 -0.00 0.00 -0.44 0.00 0.00 62.40 62.54 3n3v h SER 22 CO 0.07 0.97 -0.07 0.22 -0.53 0.00 0.00 176.83 177.50 3n3v h TYR 23 N 0.95 0.36 0.00 2.24 3.20 -1.05 0.90 116.97 123.56 3n3v h TYR 23 Ca 0.19 -0.09 -0.15 0.00 3.14 0.00 0.00 58.73 61.82 3n3v h TYR 23 Cb 0.43 -0.08 -0.02 0.00 1.54 0.00 0.00 36.73 38.59 3n3v h TYR 23 CO 0.03 0.63 -0.72 1.79 -1.64 0.00 0.00 178.16 178.26 3n3v h THR 24 N -0.03 1.40 -0.00 1.81 1.35 -1.21 -3.31 112.91 112.92 3n3v h THR 24 Ca 0.03 -2.56 0.00 0.00 -0.55 0.00 0.00 66.41 63.33 3n3v h THR 24 Cb 0.54 2.43 0.00 0.00 -1.73 0.00 0.00 68.15 69.39 3n3v h THR 24 CO 0.02 0.70 -0.50 0.35 -0.25 0.00 0.00 175.52 175.85 3n3v n THR 25 N -3.51 0.00 -1.43 6.82 -2.24 -0.52 -4.98 114.28 108.42 3n3v n THR 25 Ca -0.00 -0.25 -0.15 0.00 -2.27 0.00 0.00 64.05 61.38 3n3v n THR 25 Cb 0.74 1.02 -0.06 0.00 -2.10 0.00 0.00 70.33 69.93 3n3v n THR 25 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 3n3v n ASN 26 N -1.10 -5.26 -3.92 3.42 4.13 0.31 -4.97 115.26 107.86 3n3v n ASN 26 Ca 0.03 0.37 -0.18 0.00 1.68 0.00 0.00 54.58 56.47 3n3v n ASN 26 Cb 0.19 -4.06 -0.15 0.00 -1.54 0.00 0.00 39.78 34.21 3n3v n ASN 26 CO 0.00 0.00 0.00 -0.54 0.28 0.00 0.00 177.26 177.00 3n3v s LYS 27 N -3.20 0.62 -0.25 3.52 1.02 -1.21 -5.03 119.74 115.21 3n3v s LYS 27 Ca 0.00 -0.14 -0.28 0.00 0.02 0.00 0.00 55.97 55.56 3n3v s LYS 27 Cb 0.00 -0.64 0.01 0.00 -0.52 0.00 0.00 37.83 36.68 3n3v s LYS 27 CO 0.00 0.01 1.02 0.12 -0.92 0.00 0.00 175.35 175.58 3n3v s PHE 28 N 0.43 3.30 0.27 3.18 5.36 -1.26 -3.79 117.98 125.46 3n3v s PHE 28 Ca -0.05 1.37 -0.30 0.00 -0.96 0.00 0.00 56.93 57.00 3n3v s PHE 28 Cb -0.09 -3.32 -0.10 0.00 -0.34 0.00 0.00 43.02 39.17 3n3v s PHE 28 CO -0.00 -0.53 1.40 -2.14 -1.46 0.00 0.00 175.22 172.49 3n3v s PRO 29 N 3.24 4.29 -0.01 10.12 0.02 -1.26 -4.93 135.00 146.47 3n3v s PRO 29 Ca 0.43 2.27 0.10 0.00 0.02 0.00 0.00 61.00 63.83 3n3v s PRO 29 Cb -0.14 -3.10 -0.14 0.00 0.02 0.00 0.00 34.50 31.13 3n3v s PRO 29 CO 0.08 -0.36 0.29 -1.13 -0.33 0.00 0.00 177.00 175.55 3n3v n SER 30 N 1.92 1.93 0.00 2.53 3.41 -1.26 -5.03 113.62 117.12 3n3v n SER 30 Ca 0.05 -0.24 0.00 0.00 -0.26 0.00 0.00 58.87 58.42 3n3v n SER 30 Cb 0.41 1.32 0.00 0.00 -0.26 0.00 0.00 64.21 65.67 3n3v n SER 30 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 3n3v n GLU 31 N -1.65 3.16 -2.01 4.33 -0.58 -1.26 -5.05 120.64 117.57 3n3v n GLU 31 Ca -0.01 0.00 -0.38 0.00 -0.42 0.00 0.00 57.16 56.35 3n3v n GLU 31 Cb 0.23 0.00 0.01 0.00 -0.57 0.00 0.00 31.44 31.11 3n3v n GLU 31 CO 0.00 0.00 0.00 0.71 -0.48 0.00 0.00 177.13 177.36 3n3v s TYR 32 N 4.62 2.63 0.02 -0.32 2.02 -1.26 -5.04 117.35 120.02 3n3v s TYR 32 Ca 0.00 1.43 0.01 0.00 -0.37 0.00 0.00 57.07 58.14 3n3v s TYR 32 Cb 0.00 -3.64 -0.02 0.00 -0.40 0.00 0.00 41.96 37.91 3n3v s TYR 32 CO 0.00 -2.23 -0.05 0.54 -1.57 0.00 0.00 175.55 172.24 3n3v s VAL 33 N -1.36 0.30 0.64 0.71 0.11 -1.26 -5.08 120.40 114.46 3n3v s VAL 33 Ca 0.64 -0.76 -0.18 0.00 -2.93 0.00 0.00 61.98 58.75 3n3v s VAL 33 Cb -0.36 -0.37 -0.01 0.00 -1.53 0.00 0.00 36.38 34.10 3n3v s VAL 33 CO 0.44 -0.31 1.30 -2.84 -3.33 0.00 0.00 175.10 170.37 3n3v s PRO 34 N -1.14 2.57 0.29 1.54 0.02 -1.26 -4.89 135.00 132.14 3n3v s PRO 34 Ca -0.09 2.08 0.05 0.00 0.02 0.00 0.00 61.00 63.06 3n3v s PRO 34 Cb -0.08 -1.86 0.46 0.00 0.02 0.00 0.00 34.50 33.04 3n3v s PRO 34 CO -0.00 -1.59 1.72 1.79 -0.33 0.00 0.00 177.00 178.59 3n3v h THR 35 N 0.59 1.29 -3.16 0.99 1.35 -2.00 -3.41 112.91 108.56 3n3v h THR 35 Ca -0.51 -1.40 -0.51 0.00 -0.55 0.00 0.00 66.41 63.44 3n3v h THR 35 Cb 1.34 1.56 -0.40 0.00 -1.73 0.00 0.00 68.15 68.92 3n3v h THR 35 CO 0.53 0.43 -0.76 -0.69 -0.25 0.00 0.00 175.52 174.78 3n3v s VAL 36 N -4.28 0.31 0.14 6.82 1.01 -1.26 -4.82 120.40 118.33 3n3v s VAL 36 Ca -0.05 -0.51 -0.34 0.00 0.00 0.00 0.00 61.98 61.08 3n3v s VAL 36 Cb 0.14 -0.93 -0.13 0.00 0.00 0.00 0.00 36.38 35.45 3n3v s VAL 36 CO 0.78 -0.31 1.62 0.33 0.00 0.00 0.00 175.10 177.52 3n3v n PHE 37 N 5.12 2.32 -1.90 5.22 -0.00 -1.26 -4.92 117.46 122.04 3n3v n PHE 37 Ca -0.08 0.22 -0.42 0.00 -0.00 0.00 0.00 57.45 57.18 3n3v n PHE 37 Cb 0.47 -2.57 -0.03 0.00 -0.00 0.00 0.00 39.48 37.36 3n3v n PHE 37 CO 0.00 0.00 0.00 -0.51 -0.00 0.00 0.00 176.76 176.25 3n3v s ASP 38 N 1.22 6.54 0.28 -2.13 -0.00 -1.26 -4.03 116.67 117.29 3n3v s ASP 38 Ca 0.80 2.72 -0.30 0.00 -0.00 0.00 0.00 52.55 55.77 3n3v s ASP 38 Cb -0.66 -2.61 -0.13 0.00 -0.00 0.00 0.00 42.92 39.51 3n3v s ASP 38 CO 0.39 -0.83 1.32 -0.46 -0.00 0.00 0.00 175.17 175.58 3n3v n ASN 39 N 3.22 2.55 -3.81 0.27 6.94 -1.26 -4.92 115.26 118.25 3n3v n ASN 39 Ca 0.11 1.17 -0.13 0.00 -0.02 0.00 0.00 54.58 55.71 3n3v n ASN 39 Cb 0.38 -1.42 -0.13 0.00 -2.36 0.00 0.00 39.78 36.25 3n3v n ASN 39 CO 0.00 0.00 0.00 -0.47 -1.03 0.00 0.00 177.26 175.76 3n3v s TYR 40 N -0.52 -0.16 0.03 -2.53 5.04 -0.69 -4.95 117.35 113.56 3n3v s TYR 40 Ca 0.63 0.41 -0.07 0.00 -2.44 0.00 0.00 57.07 55.59 3n3v s TYR 40 Cb -0.63 0.03 -0.05 0.00 0.35 0.00 0.00 41.96 41.65 3n3v s TYR 40 CO 0.55 -0.10 0.31 0.00 -1.34 0.00 0.00 175.55 174.98 3n3v s ALA 41 N 0.31 3.81 0.03 3.97 0.00 -1.26 -0.51 121.76 128.11 3n3v s ALA 41 Ca -0.02 -0.52 0.00 0.00 0.00 0.00 0.00 51.96 51.42 3n3v s ALA 41 Cb -0.03 -2.13 -0.02 0.00 0.00 0.00 0.00 23.12 20.94 3n3v s ALA 41 CO -0.01 0.63 -0.03 0.54 0.00 0.00 0.00 175.76 176.88 3n3v s VAL 42 N -1.34 0.16 -0.22 0.00 0.11 -0.55 -4.97 120.40 113.60 3n3v s VAL 42 Ca 0.29 -1.01 -0.16 0.00 -2.93 0.00 0.00 61.98 58.18 3n3v s VAL 42 Cb -0.13 -0.40 -0.04 0.00 -1.53 0.00 0.00 36.38 34.27 3n3v s VAL 42 CO 0.17 -0.53 0.40 -0.89 -3.33 0.00 0.00 175.10 170.92 3n3v s THR 43 N -1.67 5.19 -0.12 5.04 2.01 -1.26 -0.54 115.64 124.30 3n3v s THR 43 Ca -0.13 0.69 0.02 0.00 0.31 0.00 0.00 61.69 62.58 3n3v s THR 43 Cb -0.08 -3.73 -0.00 0.00 0.01 0.00 0.00 72.50 68.69 3n3v s THR 43 CO -0.02 0.22 -0.20 -0.69 -0.69 0.00 0.00 174.62 173.25 3n3v s VAL 44 N 1.52 2.42 -0.27 3.82 1.01 0.13 -4.91 120.40 124.13 3n3v s VAL 44 Ca 0.18 -0.89 -0.17 0.00 0.00 0.00 0.00 61.98 61.11 3n3v s VAL 44 Cb -0.15 -1.97 -0.03 0.00 0.00 0.00 0.00 36.38 34.23 3n3v s VAL 44 CO 0.08 0.54 0.46 -0.04 0.00 0.00 0.00 175.10 176.15 3n3v s MET 45 N 0.40 4.02 -0.17 2.72 -1.94 -1.26 0.25 119.30 123.32 3n3v s MET 45 Ca -0.15 0.18 -0.00 0.00 -1.71 0.00 0.00 55.69 54.01 3n3v s MET 45 Cb -0.17 -3.66 0.04 0.00 2.01 0.00 0.00 34.83 33.04 3n3v s MET 45 CO 0.07 -0.34 -0.07 0.42 -0.01 0.00 0.00 175.02 175.08 3n3v s ILE 46 N 2.22 1.27 -1.42 2.53 -1.09 -0.40 -4.81 121.20 119.51 3n3v s ILE 46 Ca 0.19 -0.69 -0.09 0.00 -2.23 0.00 0.00 60.65 57.83 3n3v s ILE 46 Cb -0.16 -1.38 0.04 0.00 -1.58 0.00 0.00 42.46 39.38 3n3v s ILE 46 CO 0.10 0.19 1.00 0.61 -1.23 0.00 0.00 174.94 175.60 3n3v n GLY 47 N 4.83 -0.46 2.76 6.18 0.00 -1.26 -1.74 105.19 115.50 3n3v n GLY 47 Ca -0.13 0.19 0.00 0.00 0.00 0.00 0.00 46.02 46.08 3n3v n GLY 47 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3n3v n GLY 48 N -1.72 0.65 3.36 -0.02 0.00 -1.26 -5.01 105.19 101.20 3n3v n GLY 48 Ca -0.06 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.64 3n3v n GLY 48 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 3n3v s GLU 49 N -0.25 3.27 -0.02 1.61 2.56 -0.71 -5.10 118.70 120.05 3n3v s GLU 49 Ca 0.00 -0.71 -0.30 0.00 0.00 0.00 0.00 54.97 53.96 3n3v s GLU 49 Cb 0.00 -2.57 -0.03 0.00 2.00 0.00 0.00 34.13 33.53 3n3v s GLU 49 CO 0.00 0.25 1.05 -2.14 -0.56 0.00 0.00 175.26 173.85 3n3v s PRO 50 N 0.25 4.48 -0.05 4.30 0.02 -1.26 -1.27 135.00 141.47 3n3v s PRO 50 Ca -0.10 1.50 0.05 0.00 0.02 0.00 0.00 61.00 62.47 3n3v s PRO 50 Cb -0.16 -3.47 -0.02 0.00 0.02 0.00 0.00 34.50 30.87 3n3v s PRO 50 CO 0.06 -0.19 -0.21 0.71 -0.33 0.00 0.00 177.00 177.04 3n3v s TYR 51 N 1.39 2.53 -0.36 6.54 2.02 0.14 -4.93 117.35 124.68 3n3v s TYR 51 Ca 0.53 -0.44 -0.19 0.00 -0.37 0.00 0.00 57.07 56.60 3n3v s TYR 51 Cb -0.22 -1.60 0.00 0.00 -0.40 0.00 0.00 41.96 39.74 3n3v s TYR 51 CO 0.25 -0.03 0.57 0.99 -1.57 0.00 0.00 175.55 175.76 3n3v s THR 52 N -0.44 4.95 -0.31 -0.71 2.01 -1.26 0.21 115.64 120.09 3n3v s THR 52 Ca 0.05 0.39 -0.07 0.00 0.31 0.00 0.00 61.69 62.37 3n3v s THR 52 Cb -0.12 -4.03 0.02 0.00 0.01 0.00 0.00 72.50 68.38 3n3v s THR 52 CO 0.01 -0.29 0.10 -0.22 -0.69 0.00 0.00 174.62 173.53 3n3v s LEU 53 N 2.54 4.03 -0.38 4.42 2.96 0.30 -0.27 118.68 132.28 3n3v s LEU 53 Ca 0.21 -0.83 -0.23 0.00 -0.22 0.00 0.00 54.13 53.06 3n3v s LEU 53 Cb -0.15 -1.89 0.01 0.00 0.50 0.00 0.00 46.19 44.66 3n3v s LEU 53 CO 0.14 -0.24 0.80 -0.83 -1.32 0.00 0.00 176.35 174.90 3n3v s GLY 54 N 1.48 1.64 -0.23 7.98 0.00 0.93 -1.49 107.32 117.63 3n3v s GLY 54 Ca 0.02 -0.70 -0.14 0.00 0.00 0.00 0.00 44.72 43.90 3n3v s GLY 54 CO 0.03 1.79 0.32 1.08 0.00 0.00 0.00 173.10 176.32 3n3v s LEU 55 N 3.17 4.11 -0.11 0.66 1.43 0.34 0.43 118.68 128.71 3n3v s LEU 55 Ca 0.32 0.34 0.02 0.00 -1.03 0.00 0.00 54.13 53.78 3n3v s LEU 55 Cb -0.13 -2.37 0.01 0.00 0.03 0.00 0.00 46.19 43.73 3n3v s LEU 55 CO 0.18 -0.06 -0.19 -0.36 0.23 0.00 0.00 176.35 176.15 3n3v s PHE 56 N 1.43 2.26 0.46 0.29 0.08 0.81 -1.70 117.98 121.61 3n3v s PHE 56 Ca 0.15 -1.06 0.03 0.00 0.12 0.00 0.00 56.93 56.16 3n3v s PHE 56 Cb -0.15 -1.58 0.01 0.00 -0.57 0.00 0.00 43.02 40.74 3n3v s PHE 56 CO 0.08 -0.50 0.66 0.34 -0.10 0.00 0.00 175.22 175.69 3n3v s ASP 57 N 0.81 5.65 0.15 1.36 -1.08 -1.26 -0.24 116.67 122.05 3n3v s ASP 57 Ca -0.09 0.01 -0.08 0.00 -0.52 0.00 0.00 52.55 51.86 3n3v s ASP 57 Cb -0.16 -1.14 -0.01 0.00 -1.46 0.00 0.00 42.92 40.15 3n3v s ASP 57 CO 0.00 -0.81 0.24 0.42 0.52 0.00 0.00 175.17 175.55 3n3v s THR 58 N -2.53 0.08 -0.35 1.71 -4.23 -1.22 -4.82 115.64 104.28 3n3v s THR 58 Ca 0.52 -1.40 -0.19 0.00 -1.18 0.00 0.00 61.69 59.43 3n3v s THR 58 Cb -0.10 -1.77 -0.00 0.00 1.34 0.00 0.00 72.50 71.97 3n3v s THR 58 CO 0.36 -0.38 0.58 0.00 -0.54 0.00 0.00 174.62 174.64 3n3v s ALA 59 N -3.96 3.47 0.04 3.99 0.00 -1.26 -4.87 121.76 119.17 3n3v s ALA 59 Ca 0.16 -0.93 0.14 0.00 0.00 0.00 0.00 51.96 51.32 3n3v s ALA 59 Cb 0.04 -3.10 0.18 0.00 0.00 0.00 0.00 23.12 20.24 3n3v s ALA 59 CO -0.02 -1.28 1.49 0.78 0.00 0.00 0.00 175.76 176.73 3n3v h GLY 60 N 9.24 0.00 -1.38 0.00 0.00 -1.88 -3.45 103.07 105.60 3n3v h GLY 60 Ca -0.27 0.00 -0.52 0.00 0.00 0.00 0.00 47.33 46.54 3n3v h GLY 60 CO 0.81 0.00 0.28 1.20 0.00 0.00 0.00 176.54 178.83 3n3v s GLN 61 N -3.13 1.57 0.43 4.80 1.11 -1.26 -4.55 119.66 118.63 3n3v s GLN 61 Ca 0.02 1.49 0.17 0.00 0.01 0.00 0.00 55.36 57.05 3n3v s GLN 61 Cb 0.10 -1.79 0.97 0.00 -1.01 0.00 0.00 33.01 31.27 3n3v s GLN 61 CO 0.75 -2.21 1.92 1.49 0.01 0.00 0.00 175.29 177.25 3n3v h GLU 62 N -1.36 0.00 -0.91 2.91 4.81 -2.01 -2.65 114.58 115.37 3n3v h GLU 62 Ca -0.44 0.00 0.21 0.00 -0.13 0.00 0.00 59.36 59.00 3n3v h GLU 62 Cb 1.26 0.00 -0.07 0.00 0.63 0.00 0.00 28.75 30.58 3n3v h GLU 62 CO 0.46 0.26 0.61 -0.44 -0.73 0.00 0.00 179.01 179.16 3n3v h ASP 63 N 0.00 0.39 -0.57 1.04 3.32 -1.96 -1.28 116.42 117.36 3n3v h ASP 63 Ca -0.00 0.04 0.00 0.00 0.02 0.00 0.00 57.03 57.09 3n3v h ASP 63 Cb 0.51 -0.03 0.00 0.00 0.22 0.00 0.00 39.33 40.03 3n3v h ASP 63 CO 0.03 0.15 0.00 -1.22 -1.72 0.00 0.00 179.24 176.48 3n3v n TYR 64 N -4.51 1.66 -0.21 4.55 4.01 -1.00 -4.50 117.16 117.16 3n3v n TYR 64 Ca 0.20 -0.61 -0.03 0.00 -0.16 0.00 0.00 57.90 57.29 3n3v n TYR 64 Cb 0.73 -0.36 0.07 0.00 -0.31 0.00 0.00 39.34 39.47 3n3v n TYR 64 CO 0.00 0.00 0.00 -0.44 -0.46 0.00 0.00 176.86 175.96 3n3v h ASP 65 N 3.76 0.56 -0.47 7.72 3.32 -1.37 0.30 116.42 130.24 3n3v h ASP 65 Ca 0.00 0.02 -0.10 0.00 0.02 0.00 0.00 57.03 56.97 3n3v h ASP 65 Cb 1.62 -0.10 -0.02 0.00 0.22 0.00 0.00 39.33 41.05 3n3v h ASP 65 CO 0.34 0.38 -0.06 -0.09 -1.72 0.00 0.00 179.24 178.09 3n3v h ARG 66 N 0.69 0.93 0.11 3.56 2.43 -1.82 -3.31 114.38 116.97 3n3v h ARG 66 Ca 0.26 -0.30 -0.16 0.00 -0.81 0.00 0.00 59.98 58.97 3n3v h ARG 66 Cb 0.09 -0.08 0.02 0.00 -0.42 0.00 0.00 29.97 29.58 3n3v h ARG 66 CO -0.14 0.95 -0.70 1.25 -1.51 0.00 0.00 179.97 179.83 3n3v h LEU 67 N 0.84 0.42 -0.81 3.80 6.46 -1.80 -3.40 115.31 120.82 3n3v h LEU 67 Ca 0.15 -0.94 0.16 0.00 -0.12 0.00 0.00 57.88 57.13 3n3v h LEU 67 Cb 0.58 -0.14 -0.15 0.00 -0.73 0.00 0.00 40.66 40.22 3n3v h LEU 67 CO 0.03 1.33 -0.22 -0.09 -0.62 0.00 0.00 178.44 178.87 3n3v h ARG 68 N -0.42 -0.01 -0.03 1.25 2.43 -1.03 -0.53 114.38 116.05 3n3v h ARG 68 Ca -0.12 0.00 0.01 0.00 -0.81 0.00 0.00 59.98 59.06 3n3v h ARG 68 Cb 1.53 0.00 -0.00 0.00 -0.42 0.00 0.00 29.97 31.09 3n3v h ARG 68 CO 0.13 -0.01 0.03 -1.35 -1.51 0.00 0.00 179.97 177.26 3n3v h PRO 69 N -0.01 0.00 0.00 0.20 0.11 -1.77 -2.22 132.00 128.31 3n3v h PRO 69 Ca 0.38 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.49 3n3v h PRO 69 Cb 0.60 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.71 3n3v h PRO 69 CO -0.84 0.00 0.10 -0.07 -0.21 0.00 0.00 178.00 176.98 3n3v h LEU 70 N 0.00 0.00 -0.90 2.35 -0.00 -1.34 0.88 115.31 116.29 3n3v h LEU 70 Ca 0.01 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 57.89 3n3v h LEU 70 Cb 0.07 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 40.73 3n3v h LEU 70 CO -0.00 0.00 -0.13 -1.20 -0.00 0.00 0.00 178.44 177.11 3n3v n SER 71 N -2.70 1.53 0.07 -0.43 7.64 -0.84 -4.41 113.62 114.48 3n3v n SER 71 Ca -0.02 -1.34 -0.07 0.00 1.01 0.00 0.00 58.87 58.46 3n3v n SER 71 Cb 0.15 0.09 -0.09 0.00 -1.01 0.00 0.00 64.21 63.35 3n3v n SER 71 CO 0.00 0.00 0.00 1.88 -3.01 0.00 0.00 175.04 173.91 3n3v h TYR 72 N 2.20 0.02 -1.64 1.43 0.05 -1.00 -3.46 116.97 114.57 3n3v h TYR 72 Ca 0.00 -0.01 -0.65 0.00 0.05 0.00 0.00 58.73 58.12 3n3v h TYR 72 Cb 0.58 -0.00 0.11 0.00 1.01 0.00 0.00 36.73 38.42 3n3v h TYR 72 CO 0.00 0.97 -0.20 -2.30 -1.05 0.00 0.00 178.16 175.58 3n3v n PRO 73 N -3.41 0.61 -2.60 4.88 -0.02 -1.26 -1.05 135.00 132.14 3n3v n PRO 73 Ca -0.00 0.21 -0.11 0.00 -2.02 0.00 0.00 63.50 61.58 3n3v n PRO 73 Cb 0.91 -1.41 -0.00 0.00 -0.02 0.00 0.00 33.50 32.97 3n3v n PRO 73 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3n3v n GLN 74 N 0.96 -2.55 -2.14 -0.52 0.00 -1.26 -4.97 117.38 106.89 3n3v n GLN 74 Ca 0.15 0.44 -0.41 0.00 0.00 0.00 0.00 57.00 57.18 3n3v n GLN 74 Cb 0.27 -5.04 -0.02 0.00 0.00 0.00 0.00 30.24 25.45 3n3v n GLN 74 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.06 178.05 3n3v s THR 75 N -2.53 2.81 -0.19 -0.39 2.01 -0.22 -4.65 115.64 112.47 3n3v s THR 75 Ca 0.06 0.79 0.18 0.00 0.31 0.00 0.00 61.69 63.03 3n3v s THR 75 Cb -0.03 -3.50 -0.25 0.00 0.01 0.00 0.00 72.50 68.72 3n3v s THR 75 CO 0.08 0.18 0.08 0.47 -0.69 0.00 0.00 174.62 174.74 3n3v n ASP 76 N 1.07 0.03 -3.63 3.53 8.00 -0.23 -4.96 116.55 120.36 3n3v n ASP 76 Ca 0.01 0.00 -0.14 0.00 0.71 0.00 0.00 54.79 55.36 3n3v n ASP 76 Cb 0.42 1.03 -0.07 0.00 -0.02 0.00 0.00 41.12 42.48 3n3v n ASP 76 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 3n3v s VAL 77 N -2.52 0.00 0.01 2.53 0.11 -0.94 -4.14 120.40 115.45 3n3v s VAL 77 Ca -0.10 -0.01 0.01 0.00 -2.93 0.00 0.00 61.98 58.95 3n3v s VAL 77 Cb 0.06 -0.95 -0.04 0.00 -1.53 0.00 0.00 36.38 33.92 3n3v s VAL 77 CO 0.83 -0.00 0.06 -0.36 -3.33 0.00 0.00 175.10 172.29 3n3v s PHE 78 N 0.15 3.21 -0.36 1.54 0.08 -0.29 -2.10 117.98 120.20 3n3v s PHE 78 Ca -0.02 0.15 -0.06 0.00 0.12 0.00 0.00 56.93 57.12 3n3v s PHE 78 Cb -0.04 -1.70 0.06 0.00 -0.57 0.00 0.00 43.02 40.77 3n3v s PHE 78 CO 0.02 0.52 0.14 -0.51 -0.10 0.00 0.00 175.22 175.29 3n3v s LEU 79 N -1.79 4.59 -0.51 -0.37 1.02 -0.36 -0.55 118.68 120.72 3n3v s LEU 79 Ca 0.23 -1.35 -0.18 0.00 0.02 0.00 0.00 54.13 52.84 3n3v s LEU 79 Cb -0.12 -1.88 0.07 0.00 0.02 0.00 0.00 46.19 44.28 3n3v s LEU 79 CO 0.14 -0.40 0.60 -0.69 0.02 0.00 0.00 176.35 176.02 3n3v s VAL 80 N 1.36 4.93 -0.07 -1.59 1.01 -0.16 -0.97 120.40 124.91 3n3v s VAL 80 Ca 0.00 -0.66 -0.04 0.00 0.00 0.00 0.00 61.98 61.28 3n3v s VAL 80 Cb -0.21 -4.29 -0.04 0.00 0.00 0.00 0.00 36.38 31.84 3n3v s VAL 80 CO 0.01 -0.81 0.14 0.00 0.00 0.00 0.00 175.10 174.45 3n3v s PHE 82 N -1.14 0.07 0.00 0.00 -0.12 -0.37 -4.18 117.98 112.24 3n3v s PHE 82 Ca 0.20 -0.17 -0.30 0.00 -0.05 0.00 0.00 56.93 56.61 3n3v s PHE 82 Cb -0.12 -0.07 -0.03 0.00 -0.63 0.00 0.00 43.02 42.17 3n3v s PHE 82 CO 0.10 -0.24 1.00 0.45 -0.05 0.00 0.00 175.22 176.48 3n3v s SER 83 N -1.23 7.35 0.15 1.98 0.15 -1.26 -0.16 113.70 120.67 3n3v s SER 83 Ca -0.13 1.68 0.16 0.00 0.70 0.00 0.00 55.95 58.36 3n3v s SER 83 Cb -0.07 -2.57 0.72 0.00 -1.71 0.00 0.00 66.02 62.38 3n3v s SER 83 CO 0.01 -0.28 1.48 1.33 1.20 0.00 0.00 173.24 176.98 3n3v n VAL 84 N 3.91 1.17 -0.71 4.45 0.24 -0.76 -1.03 118.33 125.59 3n3v n VAL 84 Ca 0.06 0.41 0.08 0.00 -2.04 0.00 0.00 64.34 62.85 3n3v n VAL 84 Cb 0.51 -1.32 0.24 0.00 -1.47 0.00 0.00 33.84 31.79 3n3v n VAL 84 CO 0.00 0.00 0.00 1.33 -2.14 0.00 0.00 176.83 176.02 3n3v n VAL 85 N -1.89 1.87 -3.78 3.34 0.24 -1.26 -0.11 118.33 116.74 3n3v n VAL 85 Ca 0.01 -1.55 -0.30 0.00 -2.04 0.00 0.00 64.34 60.47 3n3v n VAL 85 Cb 0.12 0.00 -0.14 0.00 -1.47 0.00 0.00 33.84 32.36 3n3v n VAL 85 CO 0.00 0.00 0.00 -0.55 -2.14 0.00 0.00 176.83 174.14 3n3v s SER 86 N -1.54 3.89 0.39 -1.34 0.15 -0.20 -4.92 113.70 110.13 3n3v s SER 86 Ca 0.37 -2.59 0.12 0.00 0.70 0.00 0.00 55.95 54.56 3n3v s SER 86 Cb 0.27 -1.18 0.94 0.00 -1.71 0.00 0.00 66.02 64.34 3n3v s SER 86 CO 0.12 -0.28 1.90 -0.65 1.20 0.00 0.00 173.24 175.53 3n3v h PRO 87 N 6.86 0.54 -0.40 5.44 0.11 -1.84 -1.89 132.00 140.82 3n3v h PRO 87 Ca -0.04 -0.03 -0.12 0.00 0.11 0.00 0.00 66.00 65.92 3n3v h PRO 87 Cb 0.93 -0.12 -0.01 0.00 0.11 0.00 0.00 31.00 31.91 3n3v h PRO 87 CO 0.53 0.36 -0.25 0.66 -0.21 0.00 0.00 178.00 179.08 3n3v h SER 88 N 0.55 0.84 0.54 -2.05 4.64 -1.93 -0.98 113.55 115.17 3n3v h SER 88 Ca 0.41 -0.32 -0.08 0.00 -0.47 0.00 0.00 61.79 61.32 3n3v h SER 88 Cb 0.78 -0.23 -0.01 0.00 -0.31 0.00 0.00 62.40 62.62 3n3v h SER 88 CO -0.16 1.05 -0.40 0.77 -0.87 0.00 0.00 176.83 177.22 3n3v h SER 89 N 0.71 0.00 -0.09 4.97 4.64 -1.69 -1.90 113.55 120.19 3n3v h SER 89 Ca 0.09 0.00 -0.22 0.00 -0.47 0.00 0.00 61.79 61.19 3n3v h SER 89 Cb 0.78 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 62.88 3n3v h SER 89 CO 0.06 0.40 -0.80 0.15 -0.87 0.00 0.00 176.83 175.78 3n3v h PHE 90 N 0.00 0.97 -0.59 4.77 3.57 -1.16 -2.99 116.94 121.51 3n3v h PHE 90 Ca -0.00 -0.47 -0.03 0.00 3.53 0.00 0.00 57.97 61.00 3n3v h PHE 90 Cb 0.78 -0.13 -0.03 0.00 2.79 0.00 0.00 35.95 39.36 3n3v h PHE 90 CO 0.00 1.29 0.23 0.93 -2.23 0.00 0.00 178.31 178.53 3n3v h GLU 91 N 0.37 0.87 0.00 1.11 4.39 -0.99 -2.53 114.58 117.80 3n3v h GLU 91 Ca -0.08 -0.14 -0.04 0.00 0.34 0.00 0.00 59.36 59.45 3n3v h GLU 91 Cb 1.45 -0.15 -0.01 0.00 -0.10 0.00 0.00 28.75 29.94 3n3v h GLU 91 CO 0.16 0.72 -0.19 -0.91 -1.16 0.00 0.00 179.01 177.63 3n3v h ASN 92 N 0.85 0.00 -0.64 1.42 -0.26 -1.32 -1.59 115.58 114.04 3n3v h ASN 92 Ca 0.20 0.00 0.13 0.00 -0.56 0.00 0.00 56.30 56.07 3n3v h ASN 92 Cb 0.18 0.00 -0.10 0.00 -1.06 0.00 0.00 38.32 37.34 3n3v h ASN 92 CO -0.02 0.19 0.09 0.58 -1.06 0.00 0.00 177.43 177.22 3n3v h VAL 93 N 0.00 0.55 0.23 2.81 2.07 -1.30 0.31 116.25 120.92 3n3v h VAL 93 Ca -0.00 -0.07 -0.33 0.00 0.82 0.00 0.00 66.70 67.12 3n3v h VAL 93 Cb 0.49 0.32 0.03 0.00 -1.52 0.00 0.00 31.29 30.62 3n3v h VAL 93 CO 0.02 0.04 -1.47 0.50 0.02 0.00 0.00 177.57 176.68 3n3v h LYS 94 N 0.21 0.50 0.03 1.57 3.64 -1.49 -2.42 116.57 118.60 3n3v h LYS 94 Ca 0.35 -0.85 -0.21 0.00 -1.27 0.00 0.00 60.65 58.66 3n3v h LYS 94 Cb 0.56 0.32 -0.01 0.00 -0.41 0.00 0.00 32.23 32.68 3n3v h LYS 94 CO -0.48 1.40 -0.97 0.93 -2.27 0.00 0.00 179.45 178.06 3n3v h GLU 95 N 0.14 0.16 0.00 1.90 4.39 -1.05 -3.42 114.58 116.69 3n3v h GLU 95 Ca -0.25 -0.21 0.00 0.00 0.34 0.00 0.00 59.36 59.24 3n3v h GLU 95 Cb 2.14 0.07 0.00 0.00 -0.10 0.00 0.00 28.75 30.86 3n3v h GLU 95 CO 0.26 1.01 -0.35 1.17 -1.16 0.00 0.00 179.01 179.94 3n3v n LYS 96 N -3.56 0.00 0.13 2.33 4.81 1.00 -4.83 118.16 118.04 3n3v n LYS 96 Ca -0.04 0.00 -0.12 0.00 -0.87 0.00 0.00 58.31 57.28 3n3v n LYS 96 Cb 0.88 -0.33 -0.07 0.00 0.02 0.00 0.00 35.03 35.53 3n3v n LYS 96 CO 0.00 0.00 0.00 -1.49 1.17 0.00 0.00 177.40 177.08 3n3v h TRP 97 N 0.00 -0.34 -0.74 5.64 4.06 -1.33 0.54 115.95 123.77 3n3v h TRP 97 Ca 0.00 -0.01 -0.02 0.00 2.06 0.00 0.00 58.89 60.92 3n3v h TRP 97 Cb 0.35 0.11 -0.03 0.00 -1.00 0.00 0.00 29.16 28.59 3n3v h TRP 97 CO 0.00 0.02 0.38 -0.24 -3.56 0.00 0.00 178.44 175.04 3n3v h VAL 98 N -0.85 1.23 -0.51 1.49 3.04 -1.70 -1.30 116.25 117.65 3n3v h VAL 98 Ca -0.04 -0.62 -0.01 0.00 -1.01 0.00 0.00 66.70 65.01 3n3v h VAL 98 Cb 0.51 0.28 -0.03 0.00 -2.01 0.00 0.00 31.29 30.05 3n3v h VAL 98 CO 0.06 0.27 0.26 -0.65 -1.01 0.00 0.00 177.57 176.50 3n3v h PRO 99 N 1.03 0.71 -0.11 4.17 0.11 -1.80 -1.13 132.00 134.98 3n3v h PRO 99 Ca 0.26 -0.08 -0.01 0.00 0.11 0.00 0.00 66.00 66.28 3n3v h PRO 99 Cb 0.08 -0.14 -0.00 0.00 0.11 0.00 0.00 31.00 31.04 3n3v h PRO 99 CO -0.04 0.54 0.04 1.49 -0.21 0.00 0.00 178.00 179.83 3n3v h GLU 100 N 0.72 0.18 0.00 1.05 4.81 -0.19 -2.14 114.58 119.01 3n3v h GLU 100 Ca 0.18 -0.04 -0.09 0.00 -0.13 0.00 0.00 59.36 59.28 3n3v h GLU 100 Cb 0.06 -0.03 -0.01 0.00 0.63 0.00 0.00 28.75 29.40 3n3v h GLU 100 CO -0.03 0.31 -0.44 -0.84 -0.73 0.00 0.00 179.01 177.28 3n3v h ILE 101 N 0.01 0.88 0.00 2.32 3.07 -1.06 0.63 117.51 123.35 3n3v h ILE 101 Ca 0.04 -1.85 -0.17 0.00 1.55 0.00 0.00 64.86 64.42 3n3v h ILE 101 Cb 0.20 2.16 -0.02 0.00 -0.27 0.00 0.00 36.82 38.88 3n3v h ILE 101 CO -0.00 0.43 -0.83 0.71 -1.05 0.00 0.00 178.15 177.41 3n3v h THR 102 N 0.00 1.54 0.16 0.16 1.35 -1.22 -0.36 112.91 114.54 3n3v h THR 102 Ca -0.00 -2.88 -0.22 0.00 -0.55 0.00 0.00 66.41 62.75 3n3v h THR 102 Cb 1.12 2.57 0.02 0.00 -1.73 0.00 0.00 68.15 70.14 3n3v h THR 102 CO 0.06 0.81 -1.01 -0.74 -0.25 0.00 0.00 175.52 174.39 3n3v h HIS 103 N 0.00 0.61 -0.01 4.73 -0.00 -1.19 -3.24 115.15 116.04 3n3v h HIS 103 Ca -0.01 -0.45 0.00 0.00 -0.00 0.00 0.00 60.37 59.92 3n3v h HIS 103 Cb 1.51 -0.02 0.00 0.00 -0.00 0.00 0.00 27.41 28.89 3n3v h HIS 103 CO 0.00 1.39 -0.28 0.72 -0.00 0.00 0.00 177.93 179.76 3n3v n HIS 104 N -4.03 0.00 -2.73 5.26 8.25 0.20 -4.58 115.22 117.59 3n3v n HIS 104 Ca -0.16 0.00 -0.08 0.00 -0.26 0.00 0.00 57.72 57.22 3n3v n HIS 104 Cb 0.88 -0.04 0.07 0.00 1.12 0.00 0.00 29.99 32.02 3n3v n HIS 104 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 3n3v s PRO 106 N 0.46 2.15 -1.60 0.00 0.02 -1.22 -3.57 135.00 131.23 3n3v s PRO 106 Ca 0.27 1.66 0.00 0.00 0.02 0.00 0.00 61.00 62.95 3n3v s PRO 106 Cb 0.25 -1.84 0.00 0.00 0.02 0.00 0.00 34.50 32.93 3n3v s PRO 106 CO -0.16 -1.81 0.00 1.63 -0.33 0.00 0.00 177.00 176.33 3n3v n LYS 107 N -2.83 -1.24 -4.48 5.54 4.76 -1.26 -4.99 118.16 113.66 3n3v n LYS 107 Ca 0.13 0.95 -0.34 0.00 -2.87 0.00 0.00 58.31 56.18 3n3v n LYS 107 Cb 0.51 -5.26 -0.14 0.00 -1.84 0.00 0.00 35.03 28.30 3n3v n LYS 107 CO 0.00 0.00 0.00 0.99 -1.37 0.00 0.00 177.40 177.02 3n3v s THR 108 N -2.72 3.16 0.55 -0.18 2.01 -1.23 -5.10 115.64 112.12 3n3v s THR 108 Ca 0.00 -0.60 -0.20 0.00 0.31 0.00 0.00 61.69 61.19 3n3v s THR 108 Cb 0.00 -2.36 -0.05 0.00 0.01 0.00 0.00 72.50 70.10 3n3v s THR 108 CO 0.00 0.50 1.22 -2.84 -0.69 0.00 0.00 174.62 172.80 3n3v s PRO 109 N 0.69 3.21 0.01 4.92 0.02 -1.26 -4.83 135.00 137.77 3n3v s PRO 109 Ca -0.05 1.86 -0.00 0.00 0.02 0.00 0.00 61.00 62.83 3n3v s PRO 109 Cb -0.15 -2.09 -0.01 0.00 0.02 0.00 0.00 34.50 32.26 3n3v s PRO 109 CO 0.02 -1.03 -0.01 -0.59 -0.33 0.00 0.00 177.00 175.06 3n3v s PHE 110 N -1.55 0.19 -0.00 6.54 -0.12 -1.26 -1.14 117.98 120.63 3n3v s PHE 110 Ca 0.73 -0.38 -0.02 0.00 -0.05 0.00 0.00 56.93 57.20 3n3v s PHE 110 Cb -0.31 -0.14 -0.04 0.00 -0.63 0.00 0.00 43.02 41.90 3n3v s PHE 110 CO 0.35 -0.15 0.18 -0.51 -0.05 0.00 0.00 175.22 175.05 3n3v s LEU 111 N -1.11 4.37 -0.23 -1.99 1.02 0.29 -1.24 118.68 119.79 3n3v s LEU 111 Ca -0.12 0.34 -0.16 0.00 0.02 0.00 0.00 54.13 54.21 3n3v s LEU 111 Cb -0.08 -2.64 -0.04 0.00 0.02 0.00 0.00 46.19 43.46 3n3v s LEU 111 CO -0.01 0.26 0.41 -0.22 0.02 0.00 0.00 176.35 176.81 3n3v s LEU 112 N -1.98 4.11 -0.23 1.79 2.96 -0.86 -0.99 118.68 123.48 3n3v s LEU 112 Ca 0.28 0.46 0.02 0.00 -0.22 0.00 0.00 54.13 54.67 3n3v s LEU 112 Cb -0.13 -2.52 0.05 0.00 0.50 0.00 0.00 46.19 44.10 3n3v s LEU 112 CO 0.19 -0.14 -0.11 -0.69 -1.32 0.00 0.00 176.35 174.29 3n3v s VAL 113 N 1.65 1.91 -0.07 1.68 1.01 0.33 -1.44 120.40 125.47 3n3v s VAL 113 Ca 0.18 -1.30 -0.26 0.00 0.00 0.00 0.00 61.98 60.60 3n3v s VAL 113 Cb -0.15 -1.99 -0.03 0.00 0.00 0.00 0.00 36.38 34.21 3n3v s VAL 113 CO 0.09 0.09 0.84 -0.83 0.00 0.00 0.00 175.10 175.29 3n3v s GLY 114 N 1.26 2.57 0.33 4.51 0.00 -0.21 -1.24 107.32 114.53 3n3v s GLY 114 Ca -0.04 0.25 0.08 0.00 0.00 0.00 0.00 44.72 45.01 3n3v s GLY 114 CO -0.07 1.50 0.11 -0.51 0.00 0.00 0.00 173.10 174.14 3n3v s THR 115 N 1.27 3.11 -1.31 0.90 -4.23 0.77 -0.81 115.64 115.34 3n3v s THR 115 Ca 0.43 -1.74 -0.03 0.00 -1.18 0.00 0.00 61.69 59.17 3n3v s THR 115 Cb -0.18 -2.96 0.01 0.00 1.34 0.00 0.00 72.50 70.71 3n3v s THR 115 CO 0.20 -0.22 0.90 0.00 -0.54 0.00 0.00 174.62 174.95 3n3v n GLN 116 N -1.10 -5.94 0.22 3.99 6.02 -0.96 -1.84 117.38 117.78 3n3v n GLN 116 Ca -0.04 0.72 0.15 0.00 -0.01 0.00 0.00 57.00 57.82 3n3v n GLN 116 Cb 0.61 -5.53 0.55 0.00 1.02 0.00 0.00 30.24 26.88 3n3v n GLN 116 CO 0.00 0.00 0.00 -0.84 -1.01 0.00 0.00 177.06 175.21 3n3v h ILE 117 N -2.02 0.00 0.00 5.09 3.07 -1.81 -2.37 117.51 119.47 3n3v h ILE 117 Ca -0.60 -0.51 -0.01 0.00 1.55 0.00 0.00 64.86 65.29 3n3v h ILE 117 Cb 1.36 1.44 -0.00 0.00 -0.27 0.00 0.00 36.82 39.35 3n3v h ILE 117 CO 0.56 0.00 -0.07 -2.24 -1.05 0.00 0.00 178.15 175.35 3n3v h ASP 118 N 0.00 0.00 0.70 2.16 2.03 -1.89 -2.67 116.42 116.75 3n3v h ASP 118 Ca 0.00 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.30 3n3v h ASP 118 Cb 0.56 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.06 3n3v h ASP 118 CO 0.00 0.07 0.00 0.18 -1.03 0.00 0.00 179.24 178.46 3n3v n LEU 119 N -3.85 0.00 0.11 0.15 4.77 -0.89 -2.15 117.00 115.14 3n3v n LEU 119 Ca -0.02 0.49 0.11 0.00 -0.03 0.00 0.00 56.01 56.56 3n3v n LEU 119 Cb 0.16 -0.49 0.46 0.00 -2.33 0.00 0.00 43.42 41.23 3n3v n LEU 119 CO 0.30 -0.14 0.83 0.54 -1.33 0.00 0.00 177.39 177.59 3n3v n ARG 120 N -1.49 0.16 -0.12 3.23 1.74 -1.01 -1.97 116.66 117.21 3n3v n ARG 120 Ca 0.05 0.40 0.07 0.00 -0.77 0.00 0.00 57.85 57.59 3n3v n ARG 120 Cb 0.24 -1.81 0.13 0.00 -1.02 0.00 0.00 32.46 29.99 3n3v n ARG 120 CO 0.00 0.00 0.00 -0.25 -1.52 0.00 0.00 177.63 175.86 3n3v n ASP 121 N -2.12 2.67 -4.62 0.55 8.00 -0.91 -4.93 116.55 115.19 3n3v n ASP 121 Ca 0.02 -1.81 -0.42 0.00 0.71 0.00 0.00 54.79 53.30 3n3v n ASP 121 Cb 0.22 -0.16 -0.05 0.00 -0.02 0.00 0.00 41.12 41.11 3n3v n ASP 121 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 3n3v s ASP 122 N -1.04 6.68 0.26 -2.24 2.15 -0.83 -4.95 116.67 116.70 3n3v s ASP 122 Ca 0.22 0.74 -0.02 0.00 0.43 0.00 0.00 52.55 53.93 3n3v s ASP 122 Cb 0.13 -2.40 0.48 0.00 -0.30 0.00 0.00 42.92 40.83 3n3v s ASP 122 CO 0.18 -0.55 1.79 -0.65 -0.17 0.00 0.00 175.17 175.77 3n3v h PRO 123 N 7.99 0.71 -0.16 4.34 0.11 -1.93 -1.51 132.00 141.55 3n3v h PRO 123 Ca -0.24 -0.04 -0.08 0.00 0.11 0.00 0.00 66.00 65.74 3n3v h PRO 123 Cb 1.10 -0.16 -0.00 0.00 0.11 0.00 0.00 31.00 32.05 3n3v h PRO 123 CO 0.86 0.47 -0.23 1.03 -0.21 0.00 0.00 178.00 179.92 3n3v h SER 124 N 0.74 0.48 0.11 -2.05 0.87 -1.95 -1.64 113.55 110.10 3n3v h SER 124 Ca 0.44 -0.52 0.00 0.00 -1.23 0.00 0.00 61.79 60.48 3n3v h SER 124 Cb 0.52 -0.14 -0.01 0.00 -0.44 0.00 0.00 62.40 62.33 3n3v h SER 124 CO -0.30 0.90 -0.11 0.74 -0.53 0.00 0.00 176.83 177.53 3n3v h THR 125 N 0.06 0.76 -0.13 2.23 2.02 -1.74 -1.75 112.91 114.36 3n3v h THR 125 Ca 0.02 0.00 -0.11 0.00 0.77 0.00 0.00 66.41 67.08 3n3v h THR 125 Cb 0.80 0.76 -0.01 0.00 -1.74 0.00 0.00 68.15 67.96 3n3v h THR 125 CO 0.05 0.00 -0.42 0.16 0.37 0.00 0.00 175.52 175.69 3n3v h ILE 126 N -0.24 1.31 -0.27 3.11 3.07 -1.35 -1.74 117.51 121.40 3n3v h ILE 126 Ca 0.00 -1.55 -0.01 0.00 1.55 0.00 0.00 64.86 64.86 3n3v h ILE 126 Cb 0.23 1.68 -0.01 0.00 -0.27 0.00 0.00 36.82 38.44 3n3v h ILE 126 CO -0.03 0.47 0.14 -0.08 -1.05 0.00 0.00 178.15 177.60 3n3v h GLU 127 N 0.24 0.39 -0.28 0.16 4.57 -1.15 -1.59 114.58 116.91 3n3v h GLU 127 Ca 0.02 -0.05 -0.00 0.00 -1.18 0.00 0.00 59.36 58.15 3n3v h GLU 127 Cb 0.84 -0.07 -0.01 0.00 -0.16 0.00 0.00 28.75 29.34 3n3v h GLU 127 CO 0.07 0.36 0.17 -0.22 -1.18 0.00 0.00 179.01 178.21 3n3v h LYS 128 N 0.32 0.39 -0.59 1.92 1.63 -1.04 -1.70 116.57 117.50 3n3v h LYS 128 Ca 0.10 -0.03 0.03 0.00 -0.85 0.00 0.00 60.65 59.89 3n3v h LYS 128 Cb 0.09 -0.08 -0.04 0.00 -0.60 0.00 0.00 32.23 31.60 3n3v h LYS 128 CO -0.01 0.30 0.35 -0.07 -3.45 0.00 0.00 179.45 176.56 3n3v h LEU 129 N 0.36 0.56 -0.94 5.20 3.38 -1.22 -2.20 115.31 120.47 3n3v h LEU 129 Ca 0.10 0.01 -0.09 0.00 0.09 0.00 0.00 57.88 57.99 3n3v h LEU 129 Cb 0.01 -0.11 -0.02 0.00 0.09 0.00 0.00 40.66 40.63 3n3v h LEU 129 CO -0.02 0.39 -0.18 0.00 0.09 0.00 0.00 178.44 178.72 3n3v h ALA 130 N 1.27 1.10 0.00 1.53 0.00 -1.09 0.45 119.26 122.53 3n3v h ALA 130 Ca 0.24 -0.32 -0.01 0.00 0.00 0.00 0.00 54.91 54.83 3n3v h ALA 130 Cb 0.05 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 17.70 3n3v h ALA 130 CO -0.11 0.56 -0.03 0.87 0.00 0.00 0.00 179.25 180.53 3n3v h LYS 131 N 0.52 0.00 -0.69 0.00 1.57 -0.91 -2.57 116.57 114.48 3n3v h LYS 131 Ca 0.09 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.87 3n3v h LYS 131 Cb 0.60 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.91 3n3v h LYS 131 CO 0.04 0.03 0.00 -1.71 -0.57 0.00 0.00 179.45 177.24 3n3v n ASN 132 N -3.12 4.46 -2.71 0.86 5.15 -0.86 -4.93 115.26 114.11 3n3v n ASN 132 Ca 0.01 -2.26 -0.22 0.00 -0.60 0.00 0.00 54.58 51.52 3n3v n ASN 132 Cb 0.38 -0.55 0.01 0.00 -0.53 0.00 0.00 39.78 39.09 3n3v n ASN 132 CO 0.00 0.00 0.00 0.29 1.40 0.00 0.00 177.26 178.95 3n3v n LYS 133 N 1.37 -3.29 -3.66 1.20 5.02 -0.97 -5.00 118.16 112.83 3n3v n LYS 133 Ca 0.26 0.97 -0.24 0.00 -2.02 0.00 0.00 58.31 57.27 3n3v n LYS 133 Cb 0.78 -5.73 -0.01 0.00 -0.02 0.00 0.00 35.03 30.05 3n3v n LYS 133 CO 0.00 0.00 0.00 1.04 -0.52 0.00 0.00 177.40 177.92 3n3v n GLN 134 N -3.53 0.81 -3.47 1.97 6.02 0.15 -5.01 117.38 114.34 3n3v n GLN 134 Ca -0.18 -3.02 -0.15 0.00 -0.01 0.00 0.00 57.00 53.64 3n3v n GLN 134 Cb 0.66 0.42 -0.04 0.00 1.02 0.00 0.00 30.24 32.29 3n3v n GLN 134 CO 0.00 0.00 0.00 -1.59 -1.01 0.00 0.00 177.06 174.46 3n3v s LYS 135 N -3.89 1.18 0.62 -1.09 -2.85 -1.26 -3.98 119.74 108.47 3n3v s LYS 135 Ca 0.22 -0.15 -0.17 0.00 -1.00 0.00 0.00 55.97 54.87 3n3v s LYS 135 Cb -0.02 0.55 -0.02 0.00 -2.06 0.00 0.00 37.83 36.28 3n3v s LYS 135 CO 0.14 -0.46 1.16 -2.14 0.10 0.00 0.00 175.35 174.15 3n3v s PRO 136 N -2.62 2.89 0.12 1.78 0.02 -1.26 -4.72 135.00 131.21 3n3v s PRO 136 Ca -0.04 1.63 -0.30 0.00 0.02 0.00 0.00 61.00 62.30 3n3v s PRO 136 Cb -0.01 -1.94 -0.07 0.00 0.02 0.00 0.00 34.50 32.50 3n3v s PRO 136 CO -0.03 -1.22 1.25 0.42 -0.33 0.00 0.00 177.00 177.09 3n3v s ILE 137 N -1.92 3.66 0.41 2.83 -1.09 0.84 -5.01 121.20 120.91 3n3v s ILE 137 Ca 0.73 1.26 -0.05 0.00 -2.23 0.00 0.00 60.65 60.35 3n3v s ILE 137 Cb -0.25 -3.80 -0.04 0.00 -1.58 0.00 0.00 42.46 36.78 3n3v s ILE 137 CO 0.36 0.14 0.70 0.42 -1.23 0.00 0.00 174.94 175.33 3n3v s THR 138 N 0.67 4.94 0.44 2.92 -4.23 -1.26 -4.91 115.64 114.21 3n3v s THR 138 Ca 0.58 0.12 0.11 0.00 -1.18 0.00 0.00 61.69 61.33 3n3v s THR 138 Cb -0.33 -3.82 0.29 0.00 1.34 0.00 0.00 72.50 69.98 3n3v s THR 138 CO 0.32 -0.66 2.04 -0.65 -0.54 0.00 0.00 174.62 175.13 3n3v h PRO 139 N 0.72 0.40 -0.06 3.99 0.11 -1.99 -2.06 132.00 133.12 3n3v h PRO 139 Ca -0.48 -0.02 -0.01 0.00 0.11 0.00 0.00 66.00 65.60 3n3v h PRO 139 Cb 1.20 -0.09 -0.00 0.00 0.11 0.00 0.00 31.00 32.22 3n3v h PRO 139 CO 0.63 0.27 -0.00 0.93 -0.21 0.00 0.00 178.00 179.61 3n3v h GLU 140 N 0.42 0.10 0.00 1.05 3.07 -1.99 0.19 114.58 117.42 3n3v h GLU 140 Ca 0.18 -0.03 -0.06 0.00 -0.50 0.00 0.00 59.36 58.95 3n3v h GLU 140 Cb 0.20 -0.01 -0.01 0.00 -0.84 0.00 0.00 28.75 28.09 3n3v h GLU 140 CO -0.04 0.38 -0.29 0.00 -1.40 0.00 0.00 179.01 177.66 3n3v h THR 141 N -0.19 0.69 -0.11 1.13 1.03 -1.93 -1.81 112.91 111.74 3n3v h THR 141 Ca 0.02 -1.32 -0.03 0.00 -0.01 0.00 0.00 66.41 65.07 3n3v h THR 141 Cb 0.34 1.85 -0.00 0.00 -1.07 0.00 0.00 68.15 69.27 3n3v h THR 141 CO 0.00 0.29 -0.07 0.00 -0.01 0.00 0.00 175.52 175.73 3n3v h ALA 142 N 1.71 0.15 -0.86 0.00 0.00 -1.17 -2.37 119.26 116.71 3n3v h ALA 142 Ca -0.00 -0.27 0.08 0.00 0.00 0.00 0.00 54.91 54.72 3n3v h ALA 142 Cb 0.83 -0.04 -0.06 0.00 0.00 0.00 0.00 17.79 18.53 3n3v h ALA 142 CO 0.04 -0.05 0.56 0.93 0.00 0.00 0.00 179.25 180.73 3n3v h GLU 143 N -0.14 0.87 -0.42 0.00 5.08 -0.40 -0.15 114.58 119.43 3n3v h GLU 143 Ca 0.02 -0.05 -0.04 0.00 -1.00 0.00 0.00 59.36 58.29 3n3v h GLU 143 Cb 0.55 -0.20 -0.02 0.00 0.50 0.00 0.00 28.75 29.58 3n3v h GLU 143 CO 0.02 0.58 0.11 -0.22 -1.00 0.00 0.00 179.01 178.49 3n3v h LYS 144 N 0.90 0.67 -0.79 2.33 1.63 -1.29 -2.21 116.57 117.81 3n3v h LYS 144 Ca 0.38 -0.16 -0.02 0.00 -0.85 0.00 0.00 60.65 60.00 3n3v h LYS 144 Cb 0.31 -0.09 -0.04 0.00 -0.60 0.00 0.00 32.23 31.82 3n3v h LYS 144 CO -0.15 0.68 0.40 1.25 -3.45 0.00 0.00 179.45 178.18 3n3v h LEU 145 N 0.54 1.01 -0.21 5.20 6.46 -0.77 -1.06 115.31 126.48 3n3v h LEU 145 Ca 0.13 -0.10 -0.00 0.00 -0.12 0.00 0.00 57.88 57.78 3n3v h LEU 145 Cb 0.31 -0.26 -0.01 0.00 -0.73 0.00 0.00 40.66 39.97 3n3v h LEU 145 CO 0.00 0.84 0.12 0.00 -0.62 0.00 0.00 178.44 178.77 3n3v h ALA 146 N 1.32 0.27 -0.19 1.25 0.00 -0.74 -0.13 119.26 121.04 3n3v h ALA 146 Ca 0.28 -0.06 -0.16 0.00 0.00 0.00 0.00 54.91 54.96 3n3v h ALA 146 Cb 0.08 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 3n3v h ALA 146 CO -0.04 -0.19 -0.54 0.07 0.00 0.00 0.00 179.25 178.55 3n3v h ARG 147 N 0.24 0.57 -0.53 0.00 0.11 -1.24 0.34 114.38 113.87 3n3v h ARG 147 Ca 0.07 -0.35 0.04 0.00 0.10 0.00 0.00 59.98 59.84 3n3v h ARG 147 Cb 0.07 0.04 -0.04 0.00 1.11 0.00 0.00 29.97 31.15 3n3v h ARG 147 CO -0.01 0.96 0.29 -0.44 0.10 0.00 0.00 179.97 180.87 3n3v h ASP 148 N 0.44 0.45 -0.01 0.08 5.19 -0.97 -2.72 116.42 118.88 3n3v h ASP 148 Ca 0.01 0.02 0.00 0.00 -0.62 0.00 0.00 57.03 56.44 3n3v h ASP 148 Cb 1.08 -0.07 0.00 0.00 0.18 0.00 0.00 39.33 40.52 3n3v h ASP 148 CO 0.10 0.31 -0.01 0.18 -3.12 0.00 0.00 179.24 176.71 3n3v n LEU 149 N -4.83 1.46 -1.94 1.55 4.77 -0.08 -4.94 117.00 112.99 3n3v n LEU 149 Ca 0.05 -0.49 -0.13 0.00 -0.03 0.00 0.00 56.01 55.41 3n3v n LEU 149 Cb 0.11 -0.00 0.03 0.00 -2.33 0.00 0.00 43.42 41.23 3n3v n LEU 149 CO 0.30 0.24 0.04 0.29 -1.33 0.00 0.00 177.39 176.94 3n3v n LYS 150 N 0.14 -3.28 -2.56 3.23 5.02 -0.31 -5.02 118.16 115.38 3n3v n LYS 150 Ca 0.19 0.51 -0.36 0.00 -2.02 0.00 0.00 58.31 56.63 3n3v n LYS 150 Cb 0.35 -4.53 -0.04 0.00 -0.02 0.00 0.00 35.03 30.79 3n3v n LYS 150 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3n3v s ALA 151 N -2.98 3.03 0.26 7.82 0.00 0.11 -4.83 121.76 125.18 3n3v s ALA 151 Ca 0.22 0.66 -0.01 0.00 0.00 0.00 0.00 51.96 52.83 3n3v s ALA 151 Cb -0.10 -3.26 0.50 0.00 0.00 0.00 0.00 23.12 20.27 3n3v s ALA 151 CO 0.27 -0.22 1.78 0.28 0.00 0.00 0.00 175.76 177.88 3n3v h VAL 152 N 2.03 0.80 -1.33 0.00 2.07 -1.47 -3.42 116.25 114.93 3n3v h VAL 152 Ca -0.49 -0.25 0.37 0.00 0.82 0.00 0.00 66.70 67.16 3n3v h VAL 152 Cb 1.21 0.02 -0.12 0.00 -1.52 0.00 0.00 31.29 30.88 3n3v h VAL 152 CO 0.61 0.13 0.92 -1.59 0.02 0.00 0.00 177.57 177.67 3n3v s LYS 153 N -5.98 0.19 -0.18 1.57 -2.85 -1.26 -5.05 119.74 106.18 3n3v s LYS 153 Ca -0.12 -0.11 -0.09 0.00 -1.00 0.00 0.00 55.97 54.65 3n3v s LYS 153 Cb 0.21 0.06 -0.05 0.00 -2.06 0.00 0.00 37.83 36.00 3n3v s LYS 153 CO 0.78 -0.09 0.11 -0.47 0.10 0.00 0.00 175.35 175.78 3n3v s TYR 154 N -2.17 3.38 0.14 1.78 5.04 -1.26 -2.03 117.35 122.22 3n3v s TYR 154 Ca 0.17 0.27 0.04 0.00 -2.44 0.00 0.00 57.07 55.11 3n3v s TYR 154 Cb 0.06 -2.09 -0.04 0.00 0.35 0.00 0.00 41.96 40.23 3n3v s TYR 154 CO -0.05 0.31 -0.10 0.14 -1.34 0.00 0.00 175.55 174.51 3n3v s VAL 155 N 0.15 1.14 0.05 3.14 -7.23 -0.52 -4.99 120.40 112.14 3n3v s VAL 155 Ca 0.07 -2.02 -0.07 0.00 -1.81 0.00 0.00 61.98 58.15 3n3v s VAL 155 Cb -0.12 -1.81 -0.01 0.00 0.56 0.00 0.00 36.38 35.01 3n3v s VAL 155 CO -0.00 -0.73 0.13 -1.83 -0.31 0.00 0.00 175.10 172.35 3n3v s GLU 156 N -3.67 0.67 0.31 4.82 -1.05 -1.26 -1.05 118.70 117.48 3n3v s GLU 156 Ca 0.16 -0.81 -0.15 0.00 -0.15 0.00 0.00 54.97 54.02 3n3v s GLU 156 Cb 0.02 0.27 0.02 0.00 -0.44 0.00 0.00 34.13 34.00 3n3v s GLU 156 CO 0.00 -0.18 0.65 0.00 0.95 0.00 0.00 175.26 176.68 3n3v s SER 158 N -3.04 2.10 0.30 0.00 0.15 -0.48 -2.26 113.70 110.47 3n3v s SER 158 Ca 0.18 -0.30 0.06 0.00 0.70 0.00 0.00 55.95 56.58 3n3v s SER 158 Cb -0.04 -0.84 0.48 0.00 -1.71 0.00 0.00 66.02 63.91 3n3v s SER 158 CO 0.11 -0.09 1.73 0.00 1.20 0.00 0.00 173.24 176.19 3n3v h ALA 159 N 7.95 1.15 -0.08 5.45 0.00 -1.90 0.55 119.26 132.36 3n3v h ALA 159 Ca -0.30 -0.37 -0.02 0.00 0.00 0.00 0.00 54.91 54.22 3n3v h ALA 159 Cb 1.14 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 18.83 3n3v h ALA 159 CO 0.42 0.55 -0.03 1.25 0.00 0.00 0.00 179.25 181.44 3n3v h LEU 160 N 0.27 0.18 0.00 0.00 5.85 -1.94 -3.28 115.31 116.38 3n3v h LEU 160 Ca 0.03 -0.40 0.00 0.00 0.84 0.00 0.00 57.88 58.35 3n3v h LEU 160 Cb 0.72 -0.05 0.00 0.00 0.37 0.00 0.00 40.66 41.70 3n3v h LEU 160 CO 0.06 0.54 -1.13 0.35 -0.34 0.00 0.00 178.44 177.91 3n3v n THR 161 N -4.76 0.08 -0.88 1.05 -2.24 -1.23 -4.79 114.28 101.51 3n3v n THR 161 Ca -0.07 -0.19 0.00 0.00 -2.27 0.00 0.00 64.05 61.52 3n3v n THR 161 Cb 0.25 0.42 0.00 0.00 -2.10 0.00 0.00 70.33 68.90 3n3v n THR 161 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3n3v n GLN 162 N -1.84 -0.67 -1.76 -0.78 6.02 0.19 -4.97 117.38 113.58 3n3v n GLN 162 Ca 0.02 0.17 -0.42 0.00 -0.01 0.00 0.00 57.00 56.76 3n3v n GLN 162 Cb 0.42 -3.94 -0.03 0.00 1.02 0.00 0.00 30.24 27.71 3n3v n GLN 162 CO 0.00 0.00 0.00 0.21 -1.01 0.00 0.00 177.06 176.26 3n3v s LYS 163 N -0.91 4.14 0.00 -1.09 2.20 -1.21 -1.77 119.74 121.10 3n3v s LYS 163 Ca 0.00 2.58 0.00 0.00 -0.36 0.00 0.00 55.97 58.19 3n3v s LYS 163 Cb 0.00 -3.10 0.00 0.00 -1.51 0.00 0.00 37.83 33.22 3n3v s LYS 163 CO 0.00 -0.74 0.00 0.41 -0.36 0.00 0.00 175.35 174.66 3n3v n GLY 164 N 3.96 0.75 0.07 5.54 0.00 -1.26 -1.39 105.19 112.86 3n3v n GLY 164 Ca 0.16 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 46.05 3n3v n GLY 164 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 3n3v h LEU 165 N 0.00 -0.05 -0.55 0.99 5.85 -1.62 -2.83 115.31 117.10 3n3v h LEU 165 Ca 0.00 -0.27 0.04 0.00 0.84 0.00 0.00 57.88 58.48 3n3v h LEU 165 Cb 0.00 0.01 -0.04 0.00 0.37 0.00 0.00 40.66 41.00 3n3v h LEU 165 CO 0.00 0.25 0.31 0.50 -0.34 0.00 0.00 178.44 179.16 3n3v h LYS 166 N -0.35 0.59 -0.81 1.25 3.64 -1.90 -2.76 116.57 116.22 3n3v h LYS 166 Ca -0.01 -0.04 0.08 0.00 -1.27 0.00 0.00 60.65 59.42 3n3v h LYS 166 Cb 0.32 -0.13 -0.05 0.00 -0.41 0.00 0.00 32.23 31.95 3n3v h LYS 166 CO 0.01 0.39 0.53 -0.97 -2.27 0.00 0.00 179.45 177.14 3n3v h ASN 167 N 0.61 0.74 -0.52 4.20 -0.73 -1.92 -2.35 115.58 115.60 3n3v h ASN 167 Ca 0.23 0.01 0.09 0.00 1.87 0.00 0.00 56.30 58.51 3n3v h ASN 167 Cb 0.08 -0.15 -0.07 0.00 0.27 0.00 0.00 38.32 38.45 3n3v h ASN 167 CO -0.13 0.46 0.09 0.58 -0.37 0.00 0.00 177.43 178.06 3n3v h VAL 168 N 0.83 0.69 0.00 2.57 2.07 -1.23 0.97 116.25 122.14 3n3v h VAL 168 Ca 0.36 -0.08 -0.06 0.00 0.82 0.00 0.00 66.70 67.75 3n3v h VAL 168 Cb 0.32 0.45 -0.01 0.00 -1.52 0.00 0.00 31.29 30.53 3n3v h VAL 168 CO -0.14 0.04 -0.29 -0.26 0.02 0.00 0.00 177.57 176.95 3n3v h PHE 169 N 0.22 0.00 -0.10 1.57 0.04 -1.55 -1.60 116.94 115.52 3n3v h PHE 169 Ca 0.26 0.00 -0.00 0.00 2.80 0.00 0.00 57.97 61.03 3n3v h PHE 169 Cb 0.37 0.00 -0.00 0.00 2.20 0.00 0.00 35.95 38.52 3n3v h PHE 169 CO -0.25 0.28 0.05 -0.44 -0.60 0.00 0.00 178.31 177.35 3n3v h ASP 170 N 0.00 0.14 -0.55 2.17 3.32 -0.83 -2.55 116.42 118.12 3n3v h ASP 170 Ca -0.00 -0.13 -0.06 0.00 0.02 0.00 0.00 57.03 56.85 3n3v h ASP 170 Cb 1.21 -0.03 -0.03 0.00 0.22 0.00 0.00 39.33 40.70 3n3v h ASP 170 CO 0.04 0.23 0.12 -0.33 -1.72 0.00 0.00 179.24 177.58 3n3v h GLU 171 N 0.03 0.94 -0.81 3.56 4.39 -0.70 -2.47 114.58 119.52 3n3v h GLU 171 Ca 0.03 -0.21 0.07 0.00 0.34 0.00 0.00 59.36 59.59 3n3v h GLU 171 Cb 0.13 -0.13 -0.06 0.00 -0.10 0.00 0.00 28.75 28.59 3n3v h GLU 171 CO -0.00 0.85 0.48 0.00 -1.16 0.00 0.00 179.01 179.18 3n3v h ALA 172 N 1.24 1.12 -0.30 3.43 0.00 -1.20 0.10 119.26 123.66 3n3v h ALA 172 Ca 0.19 0.01 -0.07 0.00 0.00 0.00 0.00 54.91 55.04 3n3v h ALA 172 Cb 0.35 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.95 3n3v h ALA 172 CO 0.00 0.17 -0.08 0.82 0.00 0.00 0.00 179.25 180.17 3n3v h ILE 173 N 0.86 1.28 -0.80 0.00 2.04 -1.13 -2.06 117.51 117.69 3n3v h ILE 173 Ca 0.37 -1.11 0.02 0.00 1.00 0.00 0.00 64.86 65.13 3n3v h ILE 173 Cb 0.24 1.40 -0.04 0.00 -0.74 0.00 0.00 36.82 37.67 3n3v h ILE 173 CO -0.20 0.36 0.53 -0.07 0.00 0.00 0.00 178.15 178.76 3n3v h LEU 174 N 0.34 0.89 -1.16 1.44 3.38 -0.99 -1.28 115.31 117.94 3n3v h LEU 174 Ca 0.07 -0.02 0.04 0.00 0.09 0.00 0.00 57.88 58.07 3n3v h LEU 174 Cb 0.56 -0.21 -0.05 0.00 0.09 0.00 0.00 40.66 41.05 3n3v h LEU 174 CO 0.03 0.64 0.58 0.00 0.09 0.00 0.00 178.44 179.77 3n3v h ALA 175 N 1.31 1.46 0.00 1.53 0.00 -0.64 -0.70 119.26 122.22 3n3v h ALA 175 Ca 0.31 -0.04 -0.04 0.00 0.00 0.00 0.00 54.91 55.14 3n3v h ALA 175 Cb -0.07 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 17.41 3n3v h ALA 175 CO -0.08 0.45 -0.19 0.00 0.00 0.00 0.00 179.25 179.43 3n3v h ALA 176 N 1.49 0.92 0.00 0.00 0.00 -0.66 -3.32 119.26 117.69 3n3v h ALA 176 Ca 0.35 -0.17 -0.28 0.00 0.00 0.00 0.00 54.91 54.81 3n3v h ALA 176 Cb 0.04 -0.03 -0.05 0.00 0.00 0.00 0.00 17.79 17.75 3n3v h ALA 176 CO -0.11 0.23 -1.74 1.28 0.00 0.00 0.00 179.25 178.92 3n3v n LEU 177 N -3.20 0.78 0.00 0.00 4.77 -0.55 -5.04 117.00 113.76 3n3v n LEU 177 Ca 0.02 0.37 0.03 0.00 -0.03 0.00 0.00 56.01 56.40 3n3v n LEU 177 Cb 0.53 0.19 0.20 0.00 -2.33 0.00 0.00 43.42 42.01 3n3v n LEU 177 CO 0.35 0.36 0.44 -0.62 -1.33 0.00 0.00 177.39 176.58