#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1vk2 s THR 3 N 0.00 4.07 0.27 -3.48 -4.23 -1.26 -4.92 115.64 106.09 1vk2 s THR 3 Ca 0.00 -0.15 -0.00 0.00 -1.18 0.00 0.00 61.69 60.36 1vk2 s THR 3 Cb 0.00 -3.56 0.25 0.00 1.34 0.00 0.00 72.50 70.53 1vk2 s THR 3 CO 0.00 -0.50 1.77 0.03 -0.54 0.00 0.00 174.62 175.39 1vk2 h ARG 4 N 0.14 0.67 -0.47 3.99 3.08 -1.99 -0.47 114.38 119.34 1vk2 h ARG 4 Ca -0.46 -0.04 -0.00 0.00 0.07 0.00 0.00 59.98 59.55 1vk2 h ARG 4 Cb 1.24 -0.15 -0.02 0.00 0.08 0.00 0.00 29.97 31.12 1vk2 h ARG 4 CO 0.60 0.45 0.29 0.93 -1.07 0.00 0.00 179.97 181.16 1vk2 h GLU 5 N 0.69 0.63 -0.54 0.04 3.07 -1.99 -2.65 114.58 113.83 1vk2 h GLU 5 Ca 0.48 -0.05 -0.09 0.00 -0.50 0.00 0.00 59.36 59.19 1vk2 h GLU 5 Cb 0.65 -0.13 -0.02 0.00 -0.84 0.00 0.00 28.75 28.41 1vk2 h GLU 5 CO -0.35 0.45 -0.03 0.93 -1.40 0.00 0.00 179.01 178.61 1vk2 h GLU 6 N 0.62 0.96 -1.10 2.33 5.08 -1.83 -1.39 114.58 119.24 1vk2 h GLU 6 Ca 0.17 -0.30 0.00 0.00 -1.00 0.00 0.00 59.36 58.22 1vk2 h GLU 6 Cb -0.02 -0.09 0.00 0.00 0.50 0.00 0.00 28.75 29.14 1vk2 h GLU 6 CO -0.03 0.97 0.00 1.28 -1.00 0.00 0.00 179.01 180.22 1vk2 n LEU 7 N -4.18 0.35 0.00 1.33 4.77 -0.22 -1.42 117.00 117.63 1vk2 n LEU 7 Ca 0.02 -0.17 0.00 0.00 -0.03 0.00 0.00 56.01 55.83 1vk2 n LEU 7 Cb 0.35 -0.08 0.00 0.00 -2.33 0.00 0.00 43.42 41.36 1vk2 n LEU 7 CO 0.44 0.06 0.00 1.21 -1.33 0.00 0.00 177.39 177.77 1vk2 n GLU 9 N 0.70 0.00 -0.10 3.23 4.07 -0.53 -1.66 120.64 126.35 1vk2 n GLU 9 Ca 0.00 0.00 -0.09 0.00 -0.06 0.00 0.00 57.16 57.01 1vk2 n GLU 9 Cb 0.06 0.00 -0.01 0.00 -0.06 0.00 0.00 31.44 31.43 1vk2 n GLU 9 CO 0.00 0.00 0.00 0.82 -0.06 0.00 0.00 177.13 177.89 1vk2 h ILE 10 N 0.00 1.12 -0.22 6.31 2.04 -1.51 -0.36 117.51 124.89 1vk2 h ILE 10 Ca 0.00 -0.29 0.05 0.00 1.00 0.00 0.00 64.86 65.62 1vk2 h ILE 10 Cb 0.00 0.72 -0.05 0.00 -0.74 0.00 0.00 36.82 36.75 1vk2 h ILE 10 CO 0.00 0.12 -0.09 0.58 0.00 0.00 0.00 178.15 178.76 1vk2 h VAL 11 N 0.42 0.71 -0.64 1.67 2.07 -1.60 -1.54 116.25 117.35 1vk2 h VAL 11 Ca 0.12 0.00 0.05 0.00 0.82 0.00 0.00 66.70 67.69 1vk2 h VAL 11 Cb 0.02 0.71 -0.05 0.00 -1.52 0.00 0.00 31.29 30.45 1vk2 h VAL 11 CO -0.02 0.00 0.36 -1.28 0.02 0.00 0.00 177.57 176.65 1vk2 h SER 12 N -0.05 0.56 -0.36 0.57 0.87 -1.73 -0.27 113.55 113.14 1vk2 h SER 12 Ca 0.11 0.02 -0.09 0.00 -1.23 0.00 0.00 61.79 60.60 1vk2 h SER 12 Cb 0.22 -0.09 -0.02 0.00 -0.44 0.00 0.00 62.40 62.07 1vk2 h SER 12 CO -0.25 0.37 -0.09 -0.33 -0.53 0.00 0.00 176.83 176.00 1vk2 h GLU 13 N 0.69 0.79 -0.61 2.24 4.39 -0.85 -1.21 114.58 120.02 1vk2 h GLU 13 Ca 0.28 -0.25 -0.10 0.00 0.34 0.00 0.00 59.36 59.62 1vk2 h GLU 13 Cb 0.13 -0.07 -0.02 0.00 -0.10 0.00 0.00 28.75 28.69 1vk2 h GLU 13 CO -0.15 0.86 0.00 0.00 -1.16 0.00 0.00 179.01 178.55 1vk2 h ARG 14 N 0.72 1.08 -0.18 2.33 3.08 -0.85 -2.54 114.38 118.03 1vk2 h ARG 14 Ca 0.13 -0.34 -0.00 0.00 0.07 0.00 0.00 59.98 59.83 1vk2 h ARG 14 Cb 0.56 -0.10 -0.01 0.00 0.08 0.00 0.00 29.97 30.51 1vk2 h ARG 14 CO 0.03 1.05 0.11 0.28 -1.07 0.00 0.00 179.97 180.37 1vk2 h VAL 15 N 0.98 1.08 -0.23 2.04 2.07 -0.67 -2.00 116.25 119.53 1vk2 h VAL 15 Ca 0.17 -0.21 0.06 0.00 0.82 0.00 0.00 66.70 67.54 1vk2 h VAL 15 Cb 0.56 0.90 -0.01 0.00 -1.52 0.00 0.00 31.29 31.23 1vk2 h VAL 15 CO 0.03 0.08 0.16 0.11 0.02 0.00 0.00 177.57 177.97 1vk2 h LYS 16 N 0.21 0.06 -0.01 1.57 1.57 -1.10 -1.14 116.57 117.72 1vk2 h LYS 16 Ca 0.06 -0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.84 1vk2 h LYS 16 Cb 0.04 -0.01 0.00 0.00 0.08 0.00 0.00 32.23 32.33 1vk2 h LYS 16 CO -0.01 0.04 -0.29 1.63 -0.57 0.00 0.00 179.45 180.25 1vk2 n LYS 17 N -4.48 0.80 -2.33 3.15 5.02 -0.97 -4.98 118.16 114.38 1vk2 n LYS 17 Ca 0.02 -0.48 -0.42 0.00 -2.02 0.00 0.00 58.31 55.41 1vk2 n LYS 17 Cb 0.27 -1.49 -0.03 0.00 -0.02 0.00 0.00 35.03 33.76 1vk2 n LYS 17 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1vk2 n THR 19 N 3.32 1.17 0.45 0.00 -2.24 -1.26 -4.79 114.28 110.93 1vk2 n THR 19 Ca 0.08 -1.99 0.11 0.00 -2.27 0.00 0.00 64.05 59.98 1vk2 n THR 19 Cb 0.44 0.26 0.46 0.00 -2.10 0.00 0.00 70.33 69.40 1vk2 n THR 19 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1vk2 n ALA 20 N -0.49 1.74 -2.41 6.98 0.00 -1.26 -4.78 120.51 120.29 1vk2 n ALA 20 Ca 0.12 0.05 -0.11 0.00 0.00 0.00 0.00 53.44 53.50 1vk2 n ALA 20 Cb 0.84 -1.38 -0.09 0.00 0.00 0.00 0.00 19.45 18.82 1vk2 n ALA 20 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1vk2 h PRO 22 N 2.59 0.00 0.00 0.00 0.11 -1.99 -3.07 132.00 129.65 1vk2 h PRO 22 Ca -0.34 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 65.75 1vk2 h PRO 22 Cb 1.24 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.35 1vk2 h PRO 22 CO 0.51 0.00 -0.10 -0.07 -0.21 0.00 0.00 178.00 178.13 1vk2 h LEU 23 N 0.00 0.00 -2.48 2.35 3.38 -1.93 -2.37 115.31 114.26 1vk2 h LEU 23 Ca 0.00 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.97 1vk2 h LEU 23 Cb 0.25 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.00 1vk2 h LEU 23 CO 0.00 0.10 -0.01 1.12 0.09 0.00 0.00 178.44 179.74 1vk2 h HIS 24 N 0.00 0.00 0.00 1.13 2.07 -1.84 -1.47 115.15 115.04 1vk2 h HIS 24 Ca -0.00 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.52 1vk2 h HIS 24 Cb 0.28 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.26 1vk2 h HIS 24 CO 0.00 0.01 0.00 -0.07 -3.07 0.00 0.00 177.93 174.80 1vk2 h LEU 25 N 0.00 0.00 0.00 6.12 3.38 -1.68 -3.35 115.31 119.79 1vk2 h LEU 25 Ca -0.00 0.00 -0.37 0.00 0.09 0.00 0.00 57.88 57.60 1vk2 h LEU 25 Cb 0.01 0.00 -0.07 0.00 0.09 0.00 0.00 40.66 40.70 1vk2 h LEU 25 CO 0.00 0.00 -2.36 -3.20 0.09 0.00 0.00 178.44 172.98 1vk2 n ASN 26 N -2.97 0.46 -4.80 -0.43 5.15 -0.56 -5.02 115.26 107.08 1vk2 n ASN 26 Ca 0.02 0.01 -0.36 0.00 -0.60 0.00 0.00 54.58 53.65 1vk2 n ASN 26 Cb 0.40 0.64 -0.06 0.00 -0.53 0.00 0.00 39.78 40.22 1vk2 n ASN 26 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1vk2 s ARG 27 N -2.50 4.42 -0.06 1.20 3.03 -1.14 -4.95 118.95 118.94 1vk2 s ARG 27 Ca -0.14 1.16 -0.24 0.00 2.03 0.00 0.00 55.73 58.54 1vk2 s ARG 27 Cb 0.07 -2.68 -0.28 0.00 -1.03 0.00 0.00 34.95 31.03 1vk2 s ARG 27 CO 0.79 0.24 0.92 1.15 -1.13 0.00 0.00 175.30 177.26 1vk2 h THR 28 N 2.46 1.57 -3.82 4.99 2.02 -1.93 -3.47 112.91 114.73 1vk2 h THR 28 Ca -0.47 -2.34 -0.26 0.00 0.77 0.00 0.00 66.41 64.10 1vk2 h THR 28 Cb 1.19 3.10 -0.28 0.00 -1.74 0.00 0.00 68.15 70.42 1vk2 h THR 28 CO 0.64 0.65 -0.73 0.20 0.37 0.00 0.00 175.52 176.65 1vk2 s ASN 29 N -6.67 0.27 0.69 4.18 0.01 -1.17 -5.05 114.94 107.20 1vk2 s ASN 29 Ca -0.15 -0.08 -0.14 0.00 -0.71 0.00 0.00 52.86 51.78 1vk2 s ASN 29 Cb 0.00 -0.02 0.02 0.00 0.41 0.00 0.00 41.25 41.66 1vk2 s ASN 29 CO 0.79 0.00 1.11 0.68 -1.51 0.00 0.00 177.10 178.16 1vk2 s VAL 30 N -0.17 3.25 -0.34 1.60 -7.23 -1.26 -4.72 120.40 111.54 1vk2 s VAL 30 Ca -0.00 0.53 0.01 0.00 -1.81 0.00 0.00 61.98 60.71 1vk2 s VAL 30 Cb -0.02 -3.05 0.10 0.00 0.56 0.00 0.00 36.38 33.98 1vk2 s VAL 30 CO -0.00 -0.41 0.10 -0.69 -0.31 0.00 0.00 175.10 173.79 1vk2 s VAL 31 N -2.49 1.52 -0.06 1.32 1.01 -0.12 -4.54 120.40 117.05 1vk2 s VAL 31 Ca 0.65 -1.93 -0.25 0.00 0.00 0.00 0.00 61.98 60.46 1vk2 s VAL 31 Cb -0.20 -2.13 -0.24 0.00 0.00 0.00 0.00 36.38 33.82 1vk2 s VAL 31 CO 0.45 -0.67 1.02 0.58 0.00 0.00 0.00 175.10 176.48 1vk2 h VAL 32 N 6.39 1.56 0.00 2.92 2.07 -1.85 -3.42 116.25 123.91 1vk2 h VAL 32 Ca -0.09 -1.94 0.00 0.00 0.82 0.00 0.00 66.70 65.50 1vk2 h VAL 32 Cb 1.00 2.78 0.00 0.00 -1.52 0.00 0.00 31.29 33.56 1vk2 h VAL 32 CO 0.50 0.53 0.00 0.61 0.02 0.00 0.00 177.57 179.23 1vk2 n GLY 33 N 1.05 4.25 3.33 2.17 0.00 -1.26 -4.60 105.19 110.13 1vk2 n GLY 33 Ca -0.10 -1.40 -0.15 0.00 0.00 0.00 0.00 46.02 44.37 1vk2 n GLY 33 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1vk2 s GLU 34 N -2.90 0.78 0.00 1.61 2.12 -0.64 -4.90 118.70 114.77 1vk2 s GLU 34 Ca 0.00 0.00 0.00 0.00 0.36 0.00 0.00 54.97 55.33 1vk2 s GLU 34 Cb 0.00 0.35 0.00 0.00 0.26 0.00 0.00 34.13 34.74 1vk2 s GLU 34 CO 0.00 -0.22 0.00 0.41 -0.54 0.00 0.00 175.26 174.91 1vk2 n GLY 35 N 1.28 0.22 3.59 -1.50 0.00 -1.26 -1.26 105.19 106.26 1vk2 n GLY 35 Ca -0.20 -1.85 -0.42 0.00 0.00 0.00 0.00 46.02 43.55 1vk2 n GLY 35 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1vk2 s ASN 36 N -4.00 6.59 0.00 1.61 2.47 -0.15 -4.90 114.94 116.56 1vk2 s ASN 36 Ca 0.00 0.45 0.14 0.00 0.42 0.00 0.00 52.86 53.87 1vk2 s ASN 36 Cb 0.00 -2.40 0.65 0.00 -1.45 0.00 0.00 41.25 38.05 1vk2 s ASN 36 CO 0.00 -0.72 1.41 0.18 -3.72 0.00 0.00 177.10 174.25 1vk2 n LEU 37 N 6.40 0.00 -0.92 3.21 4.77 -1.26 -2.31 117.00 126.90 1vk2 n LEU 37 Ca 0.04 0.39 0.08 0.00 -0.03 0.00 0.00 56.01 56.48 1vk2 n LEU 37 Cb 0.48 -0.39 0.26 0.00 -2.33 0.00 0.00 43.42 41.44 1vk2 n LEU 37 CO 0.53 -0.21 0.71 0.47 -1.33 0.00 0.00 177.39 177.57 1vk2 n ASP 38 N -1.39 3.87 -4.76 -1.43 8.00 -1.26 -4.55 116.55 115.03 1vk2 n ASP 38 Ca 0.05 -2.90 -0.36 0.00 0.71 0.00 0.00 54.79 52.29 1vk2 n ASP 38 Cb 0.13 -0.52 0.02 0.00 -0.02 0.00 0.00 41.12 40.74 1vk2 n ASP 38 CO 0.00 0.00 0.00 0.28 -0.39 0.00 0.00 177.20 177.09 1vk2 s THR 39 N -2.62 2.77 -2.14 -3.53 -1.32 -0.98 -4.94 115.64 102.89 1vk2 s THR 39 Ca 0.41 0.50 0.27 0.00 -1.21 0.00 0.00 61.69 61.66 1vk2 s THR 39 Cb 0.32 -3.22 0.35 0.00 -1.51 0.00 0.00 72.50 68.44 1vk2 s THR 39 CO 0.10 -0.08 1.58 0.54 -2.21 0.00 0.00 174.62 174.54 1vk2 n ARG 40 N -1.32 1.28 -3.75 7.08 5.12 -1.26 -4.46 116.66 119.35 1vk2 n ARG 40 Ca 0.12 -0.81 -0.18 0.00 -1.93 0.00 0.00 57.85 55.05 1vk2 n ARG 40 Cb 0.49 -1.48 -0.17 0.00 -1.16 0.00 0.00 32.46 30.14 1vk2 n ARG 40 CO 0.00 0.00 0.00 -1.50 -1.93 0.00 0.00 177.63 174.20 1vk2 s ILE 41 N -2.28 -0.02 -0.06 0.55 2.07 -1.26 -1.06 121.20 119.15 1vk2 s ILE 41 Ca 0.29 0.28 0.03 0.00 -1.41 0.00 0.00 60.65 59.84 1vk2 s ILE 41 Cb 0.20 -0.16 -0.03 0.00 0.13 0.00 0.00 42.46 42.60 1vk2 s ILE 41 CO 0.44 0.14 -0.14 -0.69 -1.91 0.00 0.00 174.94 172.78 1vk2 s VAL 42 N 1.54 3.10 -0.15 4.00 1.01 -0.88 -3.68 120.40 125.34 1vk2 s VAL 42 Ca -0.03 -0.70 -0.04 0.00 0.00 0.00 0.00 61.98 61.21 1vk2 s VAL 42 Cb -0.13 -2.22 -0.03 0.00 0.00 0.00 0.00 36.38 34.00 1vk2 s VAL 42 CO -0.03 0.59 -0.02 -0.36 0.00 0.00 0.00 175.10 175.28 1vk2 s PHE 43 N -0.63 3.08 -0.11 5.22 0.40 -0.15 -0.94 117.98 124.85 1vk2 s PHE 43 Ca 0.09 -0.16 -0.00 0.00 -0.60 0.00 0.00 56.93 56.27 1vk2 s PHE 43 Cb -0.11 -1.95 0.02 0.00 0.51 0.00 0.00 43.02 41.49 1vk2 s PHE 43 CO 0.01 0.07 -0.08 0.08 0.70 0.00 0.00 175.22 176.00 1vk2 s VAL 44 N 0.17 1.05 0.00 -0.44 1.01 -0.14 -1.08 120.40 120.96 1vk2 s VAL 44 Ca -0.00 -0.32 0.00 0.00 0.00 0.00 0.00 61.98 61.65 1vk2 s VAL 44 Cb -0.13 -1.05 0.00 0.00 0.00 0.00 0.00 36.38 35.20 1vk2 s VAL 44 CO 0.02 0.37 0.00 0.61 0.00 0.00 0.00 175.10 176.10 1vk2 n GLY 45 N 4.77 4.39 0.06 4.51 0.00 0.02 -0.13 105.19 118.81 1vk2 n GLY 45 Ca -0.14 -2.04 -0.04 0.00 0.00 0.00 0.00 46.02 43.79 1vk2 n GLY 45 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1vk2 h GLU 46 N 0.00 0.00 0.00 1.61 4.81 -1.86 -1.39 114.58 117.75 1vk2 h GLU 46 Ca 0.00 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 1vk2 h GLU 46 Cb 0.00 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.38 1vk2 h GLU 46 CO 0.00 0.12 0.00 0.41 -0.73 0.00 0.00 179.01 178.81 1vk2 n GLY 47 N 1.68 -0.46 3.78 1.92 0.00 -1.26 -1.84 105.19 109.01 1vk2 n GLY 47 Ca -0.06 -0.97 -0.36 0.00 0.00 0.00 0.00 46.02 44.63 1vk2 n GLY 47 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 1vk2 s PRO 48 N -2.00 4.01 0.00 1.61 0.02 -1.26 -5.00 135.00 132.38 1vk2 s PRO 48 Ca 0.00 1.55 0.00 0.00 0.02 0.00 0.00 61.00 62.57 1vk2 s PRO 48 Cb 0.00 -2.44 0.00 0.00 0.02 0.00 0.00 34.50 32.08 1vk2 s PRO 48 CO 0.00 -0.28 0.00 0.41 -0.33 0.00 0.00 177.00 176.80 1vk2 n GLY 49 N 0.28 1.97 0.19 0.52 0.00 -1.26 -4.52 105.19 102.37 1vk2 n GLY 49 Ca 0.06 -2.08 -0.08 0.00 0.00 0.00 0.00 46.02 43.92 1vk2 n GLY 49 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1vk2 h GLU 50 N 0.00 0.60 -0.18 1.61 5.08 -1.98 -1.59 114.58 118.12 1vk2 h GLU 50 Ca 0.00 -0.07 -0.19 0.00 -1.00 0.00 0.00 59.36 58.10 1vk2 h GLU 50 Cb 0.00 -0.12 0.00 0.00 0.50 0.00 0.00 28.75 29.13 1vk2 h GLU 50 CO 0.00 0.48 -0.65 0.93 -1.00 0.00 0.00 179.01 178.77 1vk2 h GLU 51 N 0.55 0.68 -0.34 2.33 3.07 -1.96 -1.95 114.58 116.97 1vk2 h GLU 51 Ca 0.15 -0.49 0.02 0.00 -0.50 0.00 0.00 59.36 58.55 1vk2 h GLU 51 Cb 0.06 0.08 -0.03 0.00 -0.84 0.00 0.00 28.75 28.02 1vk2 h GLU 51 CO -0.02 1.11 0.16 0.93 -1.40 0.00 0.00 179.01 179.79 1vk2 h GLU 52 N 0.49 0.33 -0.77 2.33 3.07 -1.72 -2.36 114.58 115.96 1vk2 h GLU 52 Ca -0.02 -0.02 -0.02 0.00 -0.50 0.00 0.00 59.36 58.81 1vk2 h GLU 52 Cb 1.24 -0.07 -0.04 0.00 -0.84 0.00 0.00 28.75 29.04 1vk2 h GLU 52 CO 0.13 0.22 0.40 0.22 -1.40 0.00 0.00 179.01 178.58 1vk2 h ASP 53 N 0.34 0.97 0.54 1.42 3.58 -1.11 0.24 116.42 122.40 1vk2 h ASP 53 Ca 0.14 -0.09 -0.11 0.00 0.42 0.00 0.00 57.03 57.40 1vk2 h ASP 53 Cb 0.06 -0.25 -0.02 0.00 1.72 0.00 0.00 39.33 40.85 1vk2 h ASP 53 CO -0.10 0.79 -0.51 0.11 -2.88 0.00 0.00 179.24 176.65 1vk2 h LYS 54 N 1.08 0.00 0.00 0.28 6.56 -1.20 -3.09 116.57 120.20 1vk2 h LYS 54 Ca 0.27 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.86 1vk2 h LYS 54 Cb 0.05 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 31.71 1vk2 h LYS 54 CO -0.04 0.51 -1.28 0.25 -2.06 0.00 0.00 179.45 176.82 1vk2 n THR 55 N -3.89 0.00 -1.00 -0.16 -2.24 -0.90 -4.97 114.28 101.12 1vk2 n THR 55 Ca -0.01 -0.26 -0.00 0.00 -2.27 0.00 0.00 64.05 61.50 1vk2 n THR 55 Cb 0.53 0.43 -0.00 0.00 -2.10 0.00 0.00 70.33 69.19 1vk2 n THR 55 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1vk2 n GLY 56 N 1.67 0.40 3.35 3.38 0.00 0.82 -5.04 105.19 109.77 1vk2 n GLY 56 Ca -0.01 -0.01 -0.30 0.00 0.00 0.00 0.00 46.02 45.70 1vk2 n GLY 56 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1vk2 s ARG 57 N -0.45 1.72 0.34 1.61 0.52 -1.18 -4.24 118.95 117.26 1vk2 s ARG 57 Ca 0.00 -1.15 -0.19 0.00 -0.52 0.00 0.00 55.73 53.87 1vk2 s ARG 57 Cb 0.00 -1.96 -0.10 0.00 0.52 0.00 0.00 34.95 33.42 1vk2 s ARG 57 CO 0.00 0.50 0.83 -1.25 0.02 0.00 0.00 175.30 175.40 1vk2 s PRO 58 N -1.39 4.19 -1.18 3.54 0.04 -1.26 -4.25 135.00 134.69 1vk2 s PRO 58 Ca 0.12 0.93 -0.19 0.00 0.04 0.00 0.00 61.00 61.90 1vk2 s PRO 58 Cb -0.10 -2.48 -0.00 0.00 0.04 0.00 0.00 34.50 31.95 1vk2 s PRO 58 CO 0.03 0.16 0.74 1.19 0.04 0.00 0.00 177.00 179.15 1vk2 n PHE 59 N -0.13 -1.83 0.15 0.56 3.72 -1.26 -4.91 117.46 113.76 1vk2 n PHE 59 Ca 0.03 0.46 0.02 0.00 -0.05 0.00 0.00 57.45 57.91 1vk2 n PHE 59 Cb 0.53 -3.44 -0.02 0.00 -0.94 0.00 0.00 39.48 35.60 1vk2 n PHE 59 CO 0.00 0.00 0.00 1.33 -0.05 0.00 0.00 176.76 178.04 1vk2 n VAL 60 N -4.29 0.00 -0.26 -4.37 0.24 -1.26 -4.37 118.33 104.03 1vk2 n VAL 60 Ca -0.12 -0.35 0.00 0.00 -2.04 0.00 0.00 64.34 61.83 1vk2 n VAL 60 Cb 0.60 0.88 0.00 0.00 -1.47 0.00 0.00 33.84 33.86 1vk2 n VAL 60 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1vk2 n GLY 61 N 1.32 0.13 0.23 7.63 0.00 -1.26 -4.83 105.19 108.42 1vk2 n GLY 61 Ca 0.00 -1.65 -0.08 0.00 0.00 0.00 0.00 46.02 44.30 1vk2 n GLY 61 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 1vk2 h ARG 62 N 0.00 0.76 -0.40 1.61 2.47 -2.03 -1.93 114.38 114.86 1vk2 h ARG 62 Ca 0.00 -0.11 -0.06 0.00 -1.26 0.00 0.00 59.98 58.56 1vk2 h ARG 62 Cb 0.00 -0.14 -0.02 0.00 -1.65 0.00 0.00 29.97 28.16 1vk2 h ARG 62 CO 0.00 0.62 0.01 0.00 0.56 0.00 0.00 179.97 181.16 1vk2 h ALA 63 N 1.10 1.29 0.00 0.04 0.00 -1.93 -2.12 119.26 117.64 1vk2 h ALA 63 Ca 0.18 -0.22 0.00 0.00 0.00 0.00 0.00 54.91 54.87 1vk2 h ALA 63 Cb 0.11 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 17.73 1vk2 h ALA 63 CO -0.02 0.48 0.00 0.41 0.00 0.00 0.00 179.25 180.12 1vk2 n GLY 64 N -0.81 0.95 0.91 0.00 0.00 -0.73 -0.70 105.19 104.82 1vk2 n GLY 64 Ca 0.02 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.04 1vk2 n GLY 64 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1vk2 n LEU 66 N 0.72 0.00 -0.15 0.99 7.94 -0.80 -1.27 117.00 124.43 1vk2 n LEU 66 Ca 0.00 0.00 -0.05 0.00 -1.11 0.00 0.00 56.01 54.85 1vk2 n LEU 66 Cb 0.23 0.00 0.04 0.00 0.53 0.00 0.00 43.42 44.22 1vk2 n LEU 66 CO 0.00 0.00 1.02 0.25 -1.11 0.00 0.00 177.39 177.55 1vk2 h LEU 67 N 0.00 0.36 -0.95 -1.96 5.85 -1.19 -0.12 115.31 117.31 1vk2 h LEU 67 Ca 0.00 0.02 0.19 0.00 0.84 0.00 0.00 57.88 58.93 1vk2 h LEU 67 Cb 0.00 -0.05 -0.11 0.00 0.37 0.00 0.00 40.66 40.87 1vk2 h LEU 67 CO 0.00 0.26 0.54 0.74 -0.34 0.00 0.00 178.44 179.64 1vk2 h THR 68 N 0.49 0.66 -0.01 1.05 2.02 -1.45 -0.68 112.91 114.98 1vk2 h THR 68 Ca 0.20 -0.23 -0.24 0.00 0.77 0.00 0.00 66.41 66.92 1vk2 h THR 68 Cb 0.09 -0.06 0.01 0.00 -1.74 0.00 0.00 68.15 66.45 1vk2 h THR 68 CO -0.13 0.12 -0.96 -0.33 0.37 0.00 0.00 175.52 174.59 1vk2 h GLU 69 N 0.66 0.54 -0.74 6.66 4.39 -1.44 -0.92 114.58 123.72 1vk2 h GLU 69 Ca 0.56 -0.56 0.03 0.00 0.34 0.00 0.00 59.36 59.73 1vk2 h GLU 69 Cb 0.91 0.16 -0.05 0.00 -0.10 0.00 0.00 28.75 29.67 1vk2 h GLU 69 CO -0.41 1.19 0.47 -0.07 -1.16 0.00 0.00 179.01 179.03 1vk2 h LEU 70 N 0.31 0.78 -0.10 1.33 3.38 -0.44 -1.12 115.31 119.45 1vk2 h LEU 70 Ca -0.09 -0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.87 1vk2 h LEU 70 Cb 1.60 -0.17 -0.00 0.00 0.09 0.00 0.00 40.66 42.17 1vk2 h LEU 70 CO 0.18 0.54 0.04 -0.07 0.09 0.00 0.00 178.44 179.21 1vk2 h LEU 71 N 0.92 0.13 -0.83 1.67 3.38 -1.04 -0.96 115.31 118.59 1vk2 h LEU 71 Ca 0.30 -0.16 0.11 0.00 0.09 0.00 0.00 57.88 58.22 1vk2 h LEU 71 Cb 0.01 -0.03 -0.08 0.00 0.09 0.00 0.00 40.66 40.65 1vk2 h LEU 71 CO -0.11 0.25 0.46 -0.09 0.09 0.00 0.00 178.44 179.04 1vk2 h ARG 72 N 0.00 0.72 0.00 1.13 2.43 -0.95 0.14 114.38 117.86 1vk2 h ARG 72 Ca 0.03 -0.04 0.00 0.00 -0.81 0.00 0.00 59.98 59.16 1vk2 h ARG 72 Cb 0.16 -0.16 0.00 0.00 -0.42 0.00 0.00 29.97 29.55 1vk2 h ARG 72 CO -0.00 0.48 0.00 0.39 -1.51 0.00 0.00 179.97 179.33 1vk2 n GLU 73 N -4.78 0.20 -0.26 0.20 1.02 -0.44 -1.76 120.64 114.82 1vk2 n GLU 73 Ca 0.14 0.32 0.11 0.00 -0.02 0.00 0.00 57.16 57.71 1vk2 n GLU 73 Cb 0.32 -1.81 0.27 0.00 -0.02 0.00 0.00 31.44 30.20 1vk2 n GLU 73 CO 0.00 0.00 0.00 0.43 1.18 0.00 0.00 177.13 178.74 1vk2 n SER 74 N -2.18 3.30 -0.87 1.62 7.64 0.12 -4.96 113.62 118.29 1vk2 n SER 74 Ca 0.04 -1.97 -0.06 0.00 1.01 0.00 0.00 58.87 57.88 1vk2 n SER 74 Cb 0.30 -0.34 0.00 0.00 -1.01 0.00 0.00 64.21 63.16 1vk2 n SER 74 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1vk2 n GLY 75 N 1.49 0.20 3.10 0.23 0.00 -0.61 -5.01 105.19 104.59 1vk2 n GLY 75 Ca 0.20 -0.58 -0.28 0.00 0.00 0.00 0.00 46.02 45.37 1vk2 n GLY 75 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1vk2 s ILE 76 N -2.48 1.52 -0.04 -0.61 1.01 0.27 -4.99 121.20 115.87 1vk2 s ILE 76 Ca 0.04 -0.70 -0.21 0.00 0.00 0.00 0.00 60.65 59.77 1vk2 s ILE 76 Cb -0.02 -1.35 -0.05 0.00 0.01 0.00 0.00 42.46 41.06 1vk2 s ILE 76 CO 0.05 0.44 0.62 -0.13 0.00 0.00 0.00 174.94 175.92 1vk2 s ARG 77 N 0.57 4.37 0.38 2.79 0.52 -1.26 -3.04 118.95 123.28 1vk2 s ARG 77 Ca -0.16 0.75 0.11 0.00 -0.52 0.00 0.00 55.73 55.92 1vk2 s ARG 77 Cb -0.17 -3.40 0.89 0.00 0.52 0.00 0.00 34.95 32.80 1vk2 s ARG 77 CO 0.05 0.22 1.90 0.00 0.02 0.00 0.00 175.30 177.49 1vk2 h ARG 78 N 6.24 0.58 0.00 3.54 3.08 -1.93 -0.49 114.38 125.40 1vk2 h ARG 78 Ca -0.43 -0.03 -0.02 0.00 0.07 0.00 0.00 59.98 59.57 1vk2 h ARG 78 Cb 1.20 -0.13 -0.00 0.00 0.08 0.00 0.00 29.97 31.11 1vk2 h ARG 78 CO 0.73 0.38 -0.10 0.93 -1.07 0.00 0.00 179.97 180.85 1vk2 h GLU 79 N 0.60 0.00 0.00 0.04 3.07 -1.97 -2.70 114.58 113.62 1vk2 h GLU 79 Ca 0.40 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.26 1vk2 h GLU 79 Cb 0.71 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.62 1vk2 h GLU 79 CO -0.16 0.10 -0.31 -0.25 -1.40 0.00 0.00 179.01 176.98 1vk2 n ASP 80 N -4.07 0.56 -4.39 1.42 8.00 -0.19 -3.61 116.55 114.26 1vk2 n ASP 80 Ca -0.02 0.25 -0.27 0.00 0.71 0.00 0.00 54.79 55.45 1vk2 n ASP 80 Cb 0.18 -0.21 -0.05 0.00 -0.02 0.00 0.00 41.12 41.03 1vk2 n ASP 80 CO 0.00 0.00 0.00 1.33 -0.39 0.00 0.00 177.20 178.14 1vk2 n VAL 81 N -1.92 0.00 -5.10 2.53 0.24 -1.02 -4.53 118.33 108.53 1vk2 n VAL 81 Ca 0.05 -2.07 -0.29 0.00 -2.04 0.00 0.00 64.34 59.99 1vk2 n VAL 81 Cb 0.40 0.30 -0.16 0.00 -1.47 0.00 0.00 33.84 32.91 1vk2 n VAL 81 CO 0.00 0.00 0.00 -0.47 -2.14 0.00 0.00 176.83 174.22 1vk2 s TYR 82 N -2.56 2.12 -0.05 6.34 5.04 -1.24 -0.97 117.35 126.01 1vk2 s TYR 82 Ca 0.06 -0.57 0.02 0.00 -2.44 0.00 0.00 57.07 54.15 1vk2 s TYR 82 Cb -0.01 -1.39 0.02 0.00 0.35 0.00 0.00 41.96 40.93 1vk2 s TYR 82 CO 0.04 -0.15 -0.09 0.42 -1.34 0.00 0.00 175.55 174.43 1vk2 s ILE 83 N -0.20 0.87 0.00 3.14 1.01 -0.39 -0.98 121.20 124.65 1vk2 s ILE 83 Ca -0.00 -0.33 0.00 0.00 0.00 0.00 0.00 60.65 60.32 1vk2 s ILE 83 Cb -0.12 -0.82 0.00 0.00 0.01 0.00 0.00 42.46 41.53 1vk2 s ILE 83 CO 0.02 0.29 0.00 0.00 0.00 0.00 0.00 174.94 175.26 1vk2 s ASN 85 N -0.67 0.19 0.12 0.00 0.01 -1.26 -0.80 114.94 112.53 1vk2 s ASN 85 Ca 0.00 -0.85 -0.15 0.00 -0.71 0.00 0.00 52.86 51.15 1vk2 s ASN 85 Cb 0.00 0.33 -0.03 0.00 0.41 0.00 0.00 41.25 41.96 1vk2 s ASN 85 CO 0.00 -0.75 1.55 0.58 -1.51 0.00 0.00 177.10 176.97 1vk2 h VAL 86 N 2.79 1.26 -3.74 1.60 2.07 -1.10 -3.44 116.25 115.69 1vk2 h VAL 86 Ca -0.34 -1.03 -0.68 0.00 0.82 0.00 0.00 66.70 65.48 1vk2 h VAL 86 Cb 1.20 1.19 -0.19 0.00 -1.52 0.00 0.00 31.29 31.97 1vk2 h VAL 86 CO 0.56 0.34 -0.77 0.68 0.02 0.00 0.00 177.57 178.40 1vk2 s VAL 87 N -4.95 3.07 -0.25 2.57 -7.23 -0.77 -4.41 120.40 108.43 1vk2 s VAL 87 Ca -0.13 -1.25 0.22 0.00 -1.81 0.00 0.00 61.98 59.01 1vk2 s VAL 87 Cb 0.09 -2.38 -0.20 0.00 0.56 0.00 0.00 36.38 34.46 1vk2 s VAL 87 CO 0.79 0.21 0.76 0.29 -0.31 0.00 0.00 175.10 176.84 1vk2 n LYS 88 N 1.08 0.54 -4.83 4.82 4.01 -1.26 -4.19 118.16 118.33 1vk2 n LYS 88 Ca -0.15 -0.06 -0.33 0.00 -0.51 0.00 0.00 58.31 57.26 1vk2 n LYS 88 Cb 0.52 -1.62 -0.13 0.00 -0.51 0.00 0.00 35.03 33.29 1vk2 n LYS 88 CO 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 177.40 176.29 1vk2 s ARG 90 N -0.30 4.25 0.59 0.00 3.52 -1.26 -4.60 118.95 121.15 1vk2 s ARG 90 Ca 0.03 2.10 -0.18 0.00 -0.13 0.00 0.00 55.73 57.55 1vk2 s ARG 90 Cb -0.13 -3.60 -0.04 0.00 -1.56 0.00 0.00 34.95 29.63 1vk2 s ARG 90 CO 0.03 -0.64 1.13 -2.14 -0.81 0.00 0.00 175.30 172.87 1vk2 s PRO 91 N 2.55 3.12 0.20 5.12 0.02 -1.26 -4.17 135.00 140.58 1vk2 s PRO 91 Ca 0.68 1.58 -0.32 0.00 0.02 0.00 0.00 61.00 62.95 1vk2 s PRO 91 Cb -0.34 -1.98 -0.15 0.00 0.02 0.00 0.00 34.50 32.05 1vk2 s PRO 91 CO 0.28 -1.03 1.27 -2.30 -0.33 0.00 0.00 177.00 174.89 1vk2 n PRO 92 N -1.69 1.55 -1.65 5.54 -0.02 -1.26 -1.46 135.00 136.01 1vk2 n PRO 92 Ca 0.12 0.55 -0.18 0.00 -2.02 0.00 0.00 63.50 61.96 1vk2 n PRO 92 Cb 0.51 -2.12 -0.07 0.00 -0.02 0.00 0.00 33.50 31.80 1vk2 n PRO 92 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 1vk2 n ASN 93 N 2.07 -4.91 -2.31 2.55 4.13 -1.26 -1.99 115.26 113.53 1vk2 n ASN 93 Ca 0.13 0.40 -0.18 0.00 1.68 0.00 0.00 54.58 56.62 1vk2 n ASN 93 Cb 0.28 -4.35 -0.02 0.00 -1.54 0.00 0.00 39.78 34.15 1vk2 n ASN 93 CO 0.00 0.00 0.00 0.59 0.28 0.00 0.00 177.26 178.13 1vk2 n ASN 94 N -1.21 -5.15 -4.74 6.41 3.02 -0.54 -4.96 115.26 108.11 1vk2 n ASN 94 Ca -0.19 0.10 -0.31 0.00 -0.03 0.00 0.00 54.58 54.15 1vk2 n ASN 94 Cb 0.61 -4.34 0.11 0.00 -0.61 0.00 0.00 39.78 35.55 1vk2 n ASN 94 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1vk2 s ARG 95 N -4.86 1.88 0.30 3.52 1.70 -0.84 -4.93 118.95 115.71 1vk2 s ARG 95 Ca 0.00 1.33 -0.30 0.00 -0.47 0.00 0.00 55.73 56.29 1vk2 s ARG 95 Cb 0.00 -1.84 -0.12 0.00 -0.57 0.00 0.00 34.95 32.42 1vk2 s ARG 95 CO 0.00 -1.95 1.48 2.41 -1.08 0.00 0.00 175.30 176.16 1vk2 n THR 96 N -3.66 1.27 -2.04 4.99 -1.04 -1.26 -4.61 114.28 107.93 1vk2 n THR 96 Ca 0.10 -0.32 -0.38 0.00 -2.04 0.00 0.00 64.05 61.41 1vk2 n THR 96 Cb 0.53 -1.76 0.01 0.00 -1.82 0.00 0.00 70.33 67.28 1vk2 n THR 96 CO 0.00 0.00 0.00 -2.16 -0.64 0.00 0.00 175.07 172.27 1vk2 s PRO 97 N -0.88 3.59 0.69 -2.82 0.04 -1.26 -4.99 135.00 129.37 1vk2 s PRO 97 Ca 0.63 2.03 -0.12 0.00 0.04 0.00 0.00 61.00 63.58 1vk2 s PRO 97 Cb -0.55 -2.44 0.01 0.00 0.04 0.00 0.00 34.50 31.56 1vk2 s PRO 97 CO 0.53 -0.76 1.07 0.95 0.04 0.00 0.00 177.00 178.82 1vk2 s THR 98 N -1.39 3.86 0.38 1.26 -4.23 -1.26 -4.81 115.64 109.45 1vk2 s THR 98 Ca 0.65 0.66 0.13 0.00 -1.18 0.00 0.00 61.69 61.95 1vk2 s THR 98 Cb -0.35 -3.31 0.35 0.00 1.34 0.00 0.00 72.50 70.53 1vk2 s THR 98 CO 0.43 -0.74 1.85 -0.65 -0.54 0.00 0.00 174.62 174.97 1vk2 h PRO 99 N -0.56 0.53 -0.55 3.99 0.11 -1.99 0.10 132.00 133.63 1vk2 h PRO 99 Ca -0.44 -0.03 -0.11 0.00 0.11 0.00 0.00 66.00 65.53 1vk2 h PRO 99 Cb 1.22 -0.12 -0.02 0.00 0.11 0.00 0.00 31.00 32.19 1vk2 h PRO 99 CO 0.56 0.35 -0.08 0.93 -0.21 0.00 0.00 178.00 179.55 1vk2 h GLU 100 N 0.55 1.03 -0.39 1.05 3.07 -1.99 -0.19 114.58 117.71 1vk2 h GLU 100 Ca 0.48 -0.37 -0.11 0.00 -0.50 0.00 0.00 59.36 58.86 1vk2 h GLU 100 Cb 0.99 -0.07 -0.01 0.00 -0.84 0.00 0.00 28.75 28.82 1vk2 h GLU 100 CO -0.22 1.05 -0.19 0.93 -1.40 0.00 0.00 179.01 179.19 1vk2 h GLU 101 N 0.90 0.81 -0.56 2.33 5.08 -1.55 -1.41 114.58 120.19 1vk2 h GLU 101 Ca 0.15 -0.36 0.00 0.00 -1.00 0.00 0.00 59.36 58.15 1vk2 h GLU 101 Cb 0.64 -0.02 -0.03 0.00 0.50 0.00 0.00 28.75 29.84 1vk2 h GLU 101 CO 0.04 0.98 0.36 1.96 -1.00 0.00 0.00 179.01 181.36 1vk2 h GLN 102 N 0.61 0.74 -0.71 2.33 4.20 -0.78 -2.04 115.11 119.47 1vk2 h GLN 102 Ca 0.09 -0.05 -0.03 0.00 0.06 0.00 0.00 58.65 58.72 1vk2 h GLN 102 Cb 0.74 -0.16 -0.03 0.00 0.30 0.00 0.00 27.48 28.33 1vk2 h GLN 102 CO 0.06 0.51 0.34 0.00 -0.67 0.00 0.00 178.83 179.07 1vk2 h ALA 103 N 1.19 0.91 -0.48 3.87 0.00 -0.88 -2.20 119.26 121.66 1vk2 h ALA 103 Ca 0.20 -0.14 -0.07 0.00 0.00 0.00 0.00 54.91 54.90 1vk2 h ALA 103 Cb -0.06 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 17.43 1vk2 h ALA 103 CO -0.04 0.47 0.01 0.00 0.00 0.00 0.00 179.25 179.70 1vk2 h ALA 104 N 1.16 1.13 0.00 0.00 0.00 -0.87 -3.16 119.26 117.52 1vk2 h ALA 104 Ca 0.24 -0.25 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1vk2 h ALA 104 Cb 0.12 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 17.71 1vk2 h ALA 104 CO -0.03 0.56 -0.62 0.00 0.00 0.00 0.00 179.25 179.16 1vk2 h GLY 106 N 4.15 0.03 1.25 0.00 0.00 -1.37 -1.44 103.07 105.70 1vk2 h GLY 106 Ca 0.00 -0.02 0.10 0.00 0.00 0.00 0.00 47.33 47.40 1vk2 h GLY 106 CO 0.00 0.02 0.29 1.12 0.00 0.00 0.00 176.54 177.97 1vk2 h HIS 107 N 0.03 0.14 -0.38 5.60 2.07 -1.78 -1.53 115.15 119.30 1vk2 h HIS 107 Ca 0.00 0.00 -0.06 0.00 -2.85 0.00 0.00 60.37 57.47 1vk2 h HIS 107 Cb 0.50 -0.05 -0.01 0.00 2.57 0.00 0.00 27.41 30.42 1vk2 h HIS 107 CO 0.00 0.07 -0.00 0.74 -3.07 0.00 0.00 177.93 175.67 1vk2 h PHE 108 N 0.13 0.73 -0.74 6.12 0.04 -1.58 -1.57 116.94 120.08 1vk2 h PHE 108 Ca 0.19 -0.13 -0.02 0.00 2.80 0.00 0.00 57.97 60.82 1vk2 h PHE 108 Cb 0.60 -0.19 -0.03 0.00 2.20 0.00 0.00 35.95 38.52 1vk2 h PHE 108 CO -0.00 0.76 0.40 1.25 -0.60 0.00 0.00 178.31 180.12 1vk2 h LEU 109 N 0.49 0.93 -0.65 1.54 5.85 -1.50 -0.73 115.31 121.25 1vk2 h LEU 109 Ca 0.11 -0.10 -0.01 0.00 0.84 0.00 0.00 57.88 58.71 1vk2 h LEU 109 Cb 0.47 -0.24 -0.03 0.00 0.37 0.00 0.00 40.66 41.23 1vk2 h LEU 109 CO 0.02 0.77 0.35 -0.07 -0.34 0.00 0.00 178.44 179.17 1vk2 h LEU 110 N 1.02 0.81 -1.05 2.25 3.38 -1.18 -1.26 115.31 119.29 1vk2 h LEU 110 Ca 0.26 -0.10 -0.02 0.00 0.09 0.00 0.00 57.88 58.12 1vk2 h LEU 110 Cb 0.05 -0.21 -0.04 0.00 0.09 0.00 0.00 40.66 40.55 1vk2 h LEU 110 CO -0.04 0.68 0.43 0.00 0.09 0.00 0.00 178.44 179.59 1vk2 h ALA 111 N 1.17 1.27 -0.45 1.53 0.00 -0.73 -0.85 119.26 121.20 1vk2 h ALA 111 Ca 0.23 -0.12 -0.10 0.00 0.00 0.00 0.00 54.91 54.92 1vk2 h ALA 111 Cb 0.05 -0.32 -0.02 0.00 0.00 0.00 0.00 17.79 17.50 1vk2 h ALA 111 CO -0.04 0.59 -0.11 1.96 0.00 0.00 0.00 179.25 181.65 1vk2 h GLN 112 N 1.10 0.82 -0.29 0.00 4.20 -0.28 -1.50 115.11 119.14 1vk2 h GLN 112 Ca 0.28 -0.28 -0.16 0.00 0.06 0.00 0.00 58.65 58.55 1vk2 h GLN 112 Cb 0.03 -0.07 -0.01 0.00 0.30 0.00 0.00 27.48 27.74 1vk2 h GLN 112 CO -0.04 0.89 -0.45 0.82 -0.67 0.00 0.00 178.83 179.38 1vk2 h ILE 113 N 0.74 1.29 -0.78 2.54 2.04 -1.08 -2.17 117.51 120.09 1vk2 h ILE 113 Ca 0.12 -1.63 -0.02 0.00 1.00 0.00 0.00 64.86 64.33 1vk2 h ILE 113 Cb 0.60 1.54 -0.04 0.00 -0.74 0.00 0.00 36.82 38.18 1vk2 h ILE 113 CO 0.04 0.53 0.41 -0.33 0.00 0.00 0.00 178.15 178.80 1vk2 h GLU 114 N 0.61 1.10 -0.32 2.37 5.08 -0.86 0.26 114.58 122.82 1vk2 h GLU 114 Ca 0.04 -0.14 -0.04 0.00 -1.00 0.00 0.00 59.36 58.22 1vk2 h GLU 114 Cb 1.01 -0.21 -0.01 0.00 0.50 0.00 0.00 28.75 30.04 1vk2 h GLU 114 CO 0.10 0.83 0.04 0.82 -1.00 0.00 0.00 179.01 179.80 1vk2 h ILE 115 N 1.09 1.24 0.12 3.13 2.04 -1.08 -3.30 117.51 120.74 1vk2 h ILE 115 Ca 0.27 -0.84 -0.27 0.00 1.00 0.00 0.00 64.86 65.02 1vk2 h ILE 115 Cb 0.06 1.17 0.00 0.00 -0.74 0.00 0.00 36.82 37.31 1vk2 h ILE 115 CO -0.04 0.28 -1.22 0.40 0.00 0.00 0.00 178.15 177.57 1vk2 h ILE 116 N 0.36 1.51 -5.97 -0.67 2.04 -1.25 -3.49 117.51 110.04 1vk2 h ILE 116 Ca 0.10 -3.05 -0.38 0.00 1.00 0.00 0.00 64.86 62.53 1vk2 h ILE 116 Cb 0.36 2.92 0.12 0.00 -0.74 0.00 0.00 36.82 39.48 1vk2 h ILE 116 CO 0.01 0.89 -0.90 -3.20 0.00 0.00 0.00 178.15 174.95 1vk2 n ASN 117 N -3.54 -5.03 -4.78 1.72 5.15 0.91 -4.81 115.26 104.89 1vk2 n ASN 117 Ca -0.08 -0.89 -0.30 0.00 -0.60 0.00 0.00 54.58 52.71 1vk2 n ASN 117 Cb 1.01 -4.04 0.10 0.00 -0.53 0.00 0.00 39.78 36.31 1vk2 n ASN 117 CO 0.00 0.00 0.00 -2.16 1.40 0.00 0.00 177.26 176.50 1vk2 s PRO 118 N -5.50 2.02 0.11 1.20 0.04 -1.26 -4.96 135.00 126.65 1vk2 s PRO 118 Ca 0.39 0.84 0.02 0.00 0.04 0.00 0.00 61.00 62.29 1vk2 s PRO 118 Cb -0.11 -1.90 -0.20 0.00 0.04 0.00 0.00 34.50 32.33 1vk2 s PRO 118 CO 0.82 -1.72 1.25 -0.44 0.04 0.00 0.00 177.00 176.95 1vk2 h ASP 119 N -1.17 0.18 -4.56 6.66 3.32 -1.40 -3.46 116.42 115.99 1vk2 h ASP 119 Ca -0.47 -0.19 -0.16 0.00 0.02 0.00 0.00 57.03 56.24 1vk2 h ASP 119 Cb 1.26 -0.06 -0.23 0.00 0.22 0.00 0.00 39.33 40.52 1vk2 h ASP 119 CO 0.56 1.12 -0.50 0.54 -1.72 0.00 0.00 179.24 179.25 1vk2 s VAL 120 N -2.76 0.05 -0.05 -1.35 0.11 -0.96 -1.92 120.40 113.52 1vk2 s VAL 120 Ca -0.01 -0.45 0.03 0.00 -2.93 0.00 0.00 61.98 58.62 1vk2 s VAL 120 Cb 0.09 -0.37 0.01 0.00 -1.53 0.00 0.00 36.38 34.57 1vk2 s VAL 120 CO 0.84 -0.24 -0.13 -0.63 -3.33 0.00 0.00 175.10 171.61 1vk2 s ILE 121 N -0.87 1.16 -0.29 7.04 1.01 0.18 -2.08 121.20 127.36 1vk2 s ILE 121 Ca -0.10 -0.53 -0.11 0.00 0.00 0.00 0.00 60.65 59.91 1vk2 s ILE 121 Cb -0.05 -1.03 -0.04 0.00 0.01 0.00 0.00 42.46 41.34 1vk2 s ILE 121 CO 0.01 0.35 0.19 -0.69 0.00 0.00 0.00 174.94 174.80 1vk2 s VAL 122 N 0.38 5.18 -0.40 2.92 1.01 -0.12 -0.71 120.40 128.67 1vk2 s VAL 122 Ca -0.09 0.04 -0.16 0.00 0.00 0.00 0.00 61.98 61.77 1vk2 s VAL 122 Cb -0.13 -3.51 0.01 0.00 0.00 0.00 0.00 36.38 32.76 1vk2 s VAL 122 CO 0.03 0.20 0.39 0.00 0.00 0.00 0.00 175.10 175.72 1vk2 s ALA 123 N 1.73 3.45 -0.59 5.51 0.00 -0.73 -0.97 121.76 130.17 1vk2 s ALA 123 Ca 0.07 -1.51 -0.19 0.00 0.00 0.00 0.00 51.96 50.33 1vk2 s ALA 123 Cb -0.16 -2.96 0.11 0.00 0.00 0.00 0.00 23.12 20.10 1vk2 s ALA 123 CO 0.10 -1.45 0.68 -0.51 0.00 0.00 0.00 175.76 174.58 1vk2 s LEU 124 N 1.99 5.47 0.00 0.00 1.43 0.81 -0.83 118.68 127.56 1vk2 s LEU 124 Ca 0.10 -1.47 0.00 0.00 -1.03 0.00 0.00 54.13 51.73 1vk2 s LEU 124 Cb -0.17 -2.29 0.00 0.00 0.03 0.00 0.00 46.19 43.75 1vk2 s LEU 124 CO 0.12 -1.09 0.00 0.61 0.23 0.00 0.00 176.35 176.23 1vk2 n GLY 125 N 5.28 0.73 0.25 -3.19 0.00 -0.37 -4.30 105.19 103.59 1vk2 n GLY 125 Ca -0.10 -1.99 -0.10 0.00 0.00 0.00 0.00 46.02 43.83 1vk2 n GLY 125 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1vk2 h ALA 126 N 0.00 0.73 -0.10 4.61 0.00 -1.90 -1.58 119.26 121.03 1vk2 h ALA 126 Ca 0.00 -0.44 -0.01 0.00 0.00 0.00 0.00 54.91 54.47 1vk2 h ALA 126 Cb 0.00 -0.12 -0.00 0.00 0.00 0.00 0.00 17.79 17.67 1vk2 h ALA 126 CO 0.00 0.66 0.04 1.15 0.00 0.00 0.00 179.25 181.10 1vk2 h THR 127 N 0.62 1.14 -0.42 0.00 2.02 -1.94 -0.28 112.91 114.05 1vk2 h THR 127 Ca 0.06 -0.41 0.03 0.00 0.77 0.00 0.00 66.41 66.86 1vk2 h THR 127 Cb 0.92 1.23 -0.04 0.00 -1.74 0.00 0.00 68.15 68.52 1vk2 h THR 127 CO 0.08 0.12 0.21 0.00 0.37 0.00 0.00 175.52 176.31 1vk2 h ALA 128 N 0.89 0.53 -0.99 6.16 0.00 -1.75 -2.12 119.26 121.99 1vk2 h ALA 128 Ca 0.03 0.02 0.04 0.00 0.00 0.00 0.00 54.91 55.00 1vk2 h ALA 128 Cb 0.16 -0.06 -0.06 0.00 0.00 0.00 0.00 17.79 17.82 1vk2 h ALA 128 CO -0.00 -0.14 0.64 1.25 0.00 0.00 0.00 179.25 181.00 1vk2 h LEU 129 N 0.43 1.06 -1.11 0.00 5.85 -1.02 -2.14 115.31 118.38 1vk2 h LEU 129 Ca 0.18 -0.00 -0.02 0.00 0.84 0.00 0.00 57.88 58.88 1vk2 h LEU 129 Cb 0.09 -0.24 -0.03 0.00 0.37 0.00 0.00 40.66 40.85 1vk2 h LEU 129 CO -0.13 0.71 0.38 -1.28 -0.34 0.00 0.00 178.44 177.79 1vk2 h SER 130 N 1.22 0.90 -0.78 1.25 0.87 -0.42 -1.53 113.55 115.06 1vk2 h SER 130 Ca 0.40 -0.08 0.05 0.00 -1.23 0.00 0.00 61.79 60.93 1vk2 h SER 130 Cb 0.05 -0.23 -0.05 0.00 -0.44 0.00 0.00 62.40 61.73 1vk2 h SER 130 CO -0.14 0.74 0.51 0.15 -0.53 0.00 0.00 176.83 177.56 1vk2 h PHE 131 N 1.01 0.88 -0.02 2.24 3.57 -0.79 0.17 116.94 124.00 1vk2 h PHE 131 Ca 0.25 0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.78 1vk2 h PHE 131 Cb 0.05 -0.29 0.00 0.00 2.79 0.00 0.00 35.95 38.49 1vk2 h PHE 131 CO 0.01 0.49 -0.08 1.19 -2.23 0.00 0.00 178.31 177.69 1vk2 n PHE 132 N -4.47 0.00 -2.33 0.41 3.72 -0.61 -3.66 117.46 110.52 1vk2 n PHE 132 Ca 0.11 0.00 -0.25 0.00 -0.05 0.00 0.00 57.45 57.26 1vk2 n PHE 132 Cb 0.17 -0.02 0.01 0.00 -0.94 0.00 0.00 39.48 38.70 1vk2 n PHE 132 CO 0.00 0.00 0.00 1.33 -0.05 0.00 0.00 176.76 178.04 1vk2 n VAL 133 N 0.32 2.38 -4.03 -4.37 0.24 -0.90 -4.97 118.33 107.01 1vk2 n VAL 133 Ca 0.16 -4.62 -0.32 0.00 -2.04 0.00 0.00 64.34 57.52 1vk2 n VAL 133 Cb 0.42 -1.15 0.01 0.00 -1.47 0.00 0.00 33.84 31.65 1vk2 n VAL 133 CO 0.00 0.00 0.00 0.47 -2.14 0.00 0.00 176.83 175.16 1vk2 n ASP 134 N -0.55 -4.04 0.00 -1.34 8.00 -1.19 -2.63 116.55 114.79 1vk2 n ASP 134 Ca 0.40 -0.87 0.00 0.00 0.71 0.00 0.00 54.79 55.02 1vk2 n ASP 134 Cb 0.77 -3.45 0.00 0.00 -0.02 0.00 0.00 41.12 38.42 1vk2 n ASP 134 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1vk2 n GLY 135 N -1.59 1.28 3.77 0.44 0.00 0.53 -5.00 105.19 104.62 1vk2 n GLY 135 Ca 0.04 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.66 1vk2 n GLY 135 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1vk2 s LYS 136 N -0.13 3.93 -0.12 1.61 1.02 -1.08 -4.94 119.74 120.04 1vk2 s LYS 136 Ca 0.00 2.16 -0.30 0.00 0.02 0.00 0.00 55.97 57.86 1vk2 s LYS 136 Cb 0.00 -2.74 -0.02 0.00 -0.52 0.00 0.00 37.83 34.55 1vk2 s LYS 136 CO 0.00 -0.52 1.22 -1.59 -0.92 0.00 0.00 175.35 173.53 1vk2 s LYS 137 N -2.27 4.29 -0.09 1.68 0.00 -1.26 -4.51 119.74 117.58 1vk2 s LYS 137 Ca 0.57 1.65 -0.06 0.00 0.00 0.00 0.00 55.97 58.13 1vk2 s LYS 137 Cb -0.38 -3.66 0.03 0.00 0.00 0.00 0.00 37.83 33.82 1vk2 s LYS 137 CO 0.49 -0.58 0.23 0.08 0.00 0.00 0.00 175.35 175.57 1vk2 s VAL 138 N 2.86 -0.02 -0.07 1.79 1.01 -1.26 -5.13 120.40 119.58 1vk2 s VAL 138 Ca 0.55 0.07 -0.30 0.00 0.00 0.00 0.00 61.98 62.30 1vk2 s VAL 138 Cb -0.23 -0.34 -0.05 0.00 0.00 0.00 0.00 36.38 35.77 1vk2 s VAL 138 CO 0.18 0.03 1.53 -0.55 0.00 0.00 0.00 175.10 176.29 1vk2 s SER 139 N 0.63 6.75 0.19 3.32 0.15 -1.26 -4.88 113.70 118.60 1vk2 s SER 139 Ca -0.04 2.09 -0.10 0.00 0.70 0.00 0.00 55.95 58.61 1vk2 s SER 139 Cb -0.06 -2.54 0.10 0.00 -1.71 0.00 0.00 66.02 61.81 1vk2 s SER 139 CO -0.04 -0.87 1.70 -0.29 1.20 0.00 0.00 173.24 174.95 1vk2 h ILE 140 N 5.48 1.26 -0.78 6.45 6.09 -1.95 -2.50 117.51 131.57 1vk2 h ILE 140 Ca -0.36 -0.95 0.10 0.00 -1.37 0.00 0.00 64.86 62.29 1vk2 h ILE 140 Cb 1.16 0.60 -0.05 0.00 0.47 0.00 0.00 36.82 38.99 1vk2 h ILE 140 CO 0.95 0.36 0.51 0.74 -3.07 0.00 0.00 178.15 177.64 1vk2 h THR 141 N 0.99 0.92 0.09 2.19 2.02 -1.97 -0.34 112.91 116.81 1vk2 h THR 141 Ca 0.21 -0.23 -0.26 0.00 0.77 0.00 0.00 66.41 66.90 1vk2 h THR 141 Cb 0.36 0.19 0.01 0.00 -1.74 0.00 0.00 68.15 66.97 1vk2 h THR 141 CO 0.00 0.12 -1.15 0.11 0.37 0.00 0.00 175.52 174.97 1vk2 h LYS 142 N 0.67 0.35 -0.01 6.66 6.56 -1.85 -3.37 116.57 125.58 1vk2 h LYS 142 Ca 0.36 -0.50 0.00 0.00 -1.06 0.00 0.00 60.65 59.45 1vk2 h LYS 142 Cb 0.51 0.17 0.00 0.00 -0.57 0.00 0.00 32.23 32.34 1vk2 h LYS 142 CO -0.14 1.20 -0.12 1.33 -2.06 0.00 0.00 179.45 179.66 1vk2 n VAL 143 N -3.63 0.00 -1.65 0.50 0.24 -1.09 -5.03 118.33 107.67 1vk2 n VAL 143 Ca -0.09 -0.44 -0.40 0.00 -2.04 0.00 0.00 64.34 61.38 1vk2 n VAL 143 Cb 0.96 1.14 0.03 0.00 -1.47 0.00 0.00 33.84 34.50 1vk2 n VAL 143 CO 0.00 0.00 0.00 -2.11 -2.14 0.00 0.00 176.83 172.58 1vk2 n ARG 144 N 0.01 1.37 0.00 7.34 1.85 -0.16 -2.35 116.66 124.73 1vk2 n ARG 144 Ca 0.04 0.50 0.00 0.00 -1.00 0.00 0.00 57.85 57.40 1vk2 n ARG 144 Cb 0.21 -2.23 0.00 0.00 -1.05 0.00 0.00 32.46 29.39 1vk2 n ARG 144 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 1vk2 n GLY 145 N 1.08 2.56 3.62 2.89 0.00 0.13 -4.99 105.19 110.48 1vk2 n GLY 145 Ca 0.10 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.72 1vk2 n GLY 145 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1vk2 s ASN 146 N -2.73 6.49 0.35 1.61 0.01 -0.99 -4.93 114.94 114.75 1vk2 s ASN 146 Ca 0.00 0.60 -0.28 0.00 -0.71 0.00 0.00 52.86 52.46 1vk2 s ASN 146 Cb 0.00 -2.30 -0.10 0.00 0.41 0.00 0.00 41.25 39.26 1vk2 s ASN 146 CO 0.00 -0.30 1.35 -2.84 -1.51 0.00 0.00 177.10 173.80 1vk2 s PRO 147 N 2.29 4.26 -0.10 -0.60 0.02 -1.26 -4.45 135.00 135.15 1vk2 s PRO 147 Ca 0.23 2.29 -0.00 0.00 0.02 0.00 0.00 61.00 63.54 1vk2 s PRO 147 Cb -0.16 -3.01 -0.03 0.00 0.02 0.00 0.00 34.50 31.33 1vk2 s PRO 147 CO 0.09 -0.30 -0.08 0.42 -0.33 0.00 0.00 177.00 176.80 1vk2 s ILE 148 N -1.15 3.53 -0.40 2.83 1.01 0.43 -4.94 121.20 122.51 1vk2 s ILE 148 Ca 0.51 -0.52 -0.24 0.00 0.00 0.00 0.00 60.65 60.39 1vk2 s ILE 148 Cb -0.41 -2.47 0.02 0.00 0.01 0.00 0.00 42.46 39.60 1vk2 s ILE 148 CO 0.55 0.55 0.85 -1.81 0.00 0.00 0.00 174.94 175.08 1vk2 s ASP 149 N -0.25 6.55 0.00 3.58 1.01 -1.26 -0.79 116.67 125.51 1vk2 s ASP 149 Ca 0.03 0.30 0.00 0.00 0.71 0.00 0.00 52.55 53.59 1vk2 s ASP 149 Cb -0.13 -2.42 0.00 0.00 1.01 0.00 0.00 42.92 41.38 1vk2 s ASP 149 CO 0.03 -0.86 0.00 1.87 0.21 0.00 0.00 175.17 176.42 1vk2 n TRP 150 N 6.71 -0.81 -1.76 4.23 -0.00 0.08 -4.98 117.44 120.92 1vk2 n TRP 150 Ca 0.05 0.00 -0.42 0.00 -0.00 0.00 0.00 57.50 57.13 1vk2 n TRP 150 Cb 0.48 0.00 -0.00 0.00 -0.00 0.00 0.00 31.31 31.79 1vk2 n TRP 150 CO 0.00 0.00 0.00 1.28 -0.00 0.00 0.00 177.69 178.97 1vk2 n LEU 151 N 0.00 4.47 -2.12 5.87 4.77 -1.26 -3.15 117.00 125.58 1vk2 n LEU 151 Ca 0.00 1.21 -0.18 0.00 -0.03 0.00 0.00 56.01 57.01 1vk2 n LEU 151 Cb 0.00 -1.59 -0.00 0.00 -2.33 0.00 0.00 43.42 39.50 1vk2 n LEU 151 CO 0.00 0.05 -0.18 0.61 -1.33 0.00 0.00 177.39 176.54 1vk2 n GLY 152 N 0.88 -0.35 2.60 -0.72 0.00 -1.26 -1.97 105.19 104.37 1vk2 n GLY 152 Ca 0.03 -0.12 0.00 0.00 0.00 0.00 0.00 46.02 45.94 1vk2 n GLY 152 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1vk2 n GLY 153 N -1.10 0.40 3.76 -0.02 0.00 -1.19 -5.01 105.19 102.04 1vk2 n GLY 153 Ca -0.19 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.45 1vk2 n GLY 153 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1vk2 s LYS 154 N -0.62 3.69 -0.09 1.61 1.02 -0.83 -4.86 119.74 119.66 1vk2 s LYS 154 Ca 0.00 1.97 -0.02 0.00 0.02 0.00 0.00 55.97 57.94 1vk2 s LYS 154 Cb 0.00 -2.48 -0.03 0.00 -0.52 0.00 0.00 37.83 34.80 1vk2 s LYS 154 CO 0.00 -0.66 -0.01 0.15 -0.92 0.00 0.00 175.35 173.91 1vk2 s LYS 155 N -2.61 3.03 -0.16 1.68 -0.14 -0.81 -0.74 119.74 120.00 1vk2 s LYS 155 Ca 0.63 -0.43 -0.01 0.00 -1.36 0.00 0.00 55.97 54.81 1vk2 s LYS 155 Cb -0.34 -2.79 -0.01 0.00 -1.68 0.00 0.00 37.83 33.01 1vk2 s LYS 155 CO 0.41 0.66 -0.12 0.08 -0.76 0.00 0.00 175.35 175.62 1vk2 s VAL 156 N -0.76 3.04 -0.29 3.17 1.01 0.03 -0.65 120.40 125.96 1vk2 s VAL 156 Ca 0.12 -0.64 -0.02 0.00 0.00 0.00 0.00 61.98 61.43 1vk2 s VAL 156 Cb -0.11 -2.31 0.04 0.00 0.00 0.00 0.00 36.38 34.00 1vk2 s VAL 156 CO 0.02 0.50 -0.00 -0.63 0.00 0.00 0.00 175.10 174.99 1vk2 s ILE 157 N 0.70 3.08 0.27 2.22 -1.09 0.12 -0.43 121.20 126.07 1vk2 s ILE 157 Ca -0.06 -1.22 -0.25 0.00 -2.23 0.00 0.00 60.65 56.89 1vk2 s ILE 157 Cb -0.15 -2.70 -0.09 0.00 -1.58 0.00 0.00 42.46 37.93 1vk2 s ILE 157 CO 0.02 -0.02 0.87 -2.16 -1.23 0.00 0.00 174.94 172.42 1vk2 s PRO 158 N 1.30 4.53 0.29 2.79 0.04 -1.26 -1.77 135.00 140.92 1vk2 s PRO 158 Ca -0.03 1.22 -0.01 0.00 0.04 0.00 0.00 61.00 62.22 1vk2 s PRO 158 Cb -0.19 -2.92 0.00 0.00 0.04 0.00 0.00 34.50 31.44 1vk2 s PRO 158 CO -0.01 0.37 0.39 -2.37 0.04 0.00 0.00 177.00 175.41 1vk2 n THR 159 N 0.81 0.00 -1.98 1.26 5.66 -0.01 -0.69 114.28 119.33 1vk2 n THR 159 Ca -0.00 -1.50 -0.39 0.00 -3.05 0.00 0.00 64.05 59.11 1vk2 n THR 159 Cb 0.50 0.91 0.01 0.00 -1.55 0.00 0.00 70.33 70.20 1vk2 n THR 159 CO 0.00 0.00 0.00 -0.36 -3.05 0.00 0.00 175.07 171.66 1vk2 s PHE 160 N -3.28 2.63 0.33 1.09 0.08 -1.26 -1.24 117.98 116.34 1vk2 s PHE 160 Ca 0.24 1.40 -0.29 0.00 0.12 0.00 0.00 56.93 58.41 1vk2 s PHE 160 Cb -0.01 -3.70 -0.10 0.00 -0.57 0.00 0.00 43.02 38.65 1vk2 s PHE 160 CO 0.18 -2.34 1.25 -1.58 -0.10 0.00 0.00 175.22 172.63 1vk2 s HIS 161 N -1.31 3.16 0.57 0.36 5.65 -1.26 -4.28 115.29 118.18 1vk2 s HIS 161 Ca 0.62 1.49 0.28 0.00 0.25 0.00 0.00 55.06 57.69 1vk2 s HIS 161 Cb -0.38 -3.58 1.54 0.00 -1.18 0.00 0.00 32.58 28.98 1vk2 s HIS 161 CO 0.47 -1.54 2.03 -1.00 -0.65 0.00 0.00 174.74 174.05 1vk2 h PRO 162 N 3.42 0.00 -0.88 2.88 0.13 -1.91 -1.46 132.00 134.18 1vk2 h PRO 162 Ca -0.48 0.00 0.17 0.00 -0.87 0.00 0.00 66.00 64.82 1vk2 h PRO 162 Cb 1.22 0.00 -0.10 0.00 0.13 0.00 0.00 31.00 32.25 1vk2 h PRO 162 CO 0.65 0.00 0.44 0.77 -0.23 0.00 0.00 178.00 179.63 1vk2 h SER 163 N 0.00 0.49 -0.87 1.44 0.02 -1.92 -1.70 113.55 111.01 1vk2 h SER 163 Ca 0.15 0.11 0.00 0.00 -0.84 0.00 0.00 61.79 61.22 1vk2 h SER 163 Cb 0.77 0.04 -0.04 0.00 0.14 0.00 0.00 62.40 63.31 1vk2 h SER 163 CO -0.00 0.16 0.56 0.22 -1.14 0.00 0.00 176.83 176.62 1vk2 h TYR 164 N 0.57 1.11 0.00 3.45 3.20 -1.64 -1.68 116.97 121.98 1vk2 h TYR 164 Ca 0.50 0.02 0.00 0.00 3.14 0.00 0.00 58.73 62.39 1vk2 h TYR 164 Cb 0.80 -0.37 0.00 0.00 1.54 0.00 0.00 36.73 38.70 1vk2 h TYR 164 CO -0.10 0.72 0.00 1.28 -1.64 0.00 0.00 178.16 178.42 1vk2 n LEU 165 N -4.39 0.54 -0.09 2.82 4.32 -0.70 -1.46 117.00 118.05 1vk2 n LEU 165 Ca 0.10 0.56 -0.10 0.00 -0.02 0.00 0.00 56.01 56.55 1vk2 n LEU 165 Cb 0.04 -0.41 0.05 0.00 -1.62 0.00 0.00 43.42 41.48 1vk2 n LEU 165 CO 0.37 -0.18 0.63 -0.07 -1.22 0.00 0.00 177.39 176.92 1vk2 h LEU 166 N 0.00 0.83 0.00 2.23 3.38 -0.70 -3.32 115.31 117.73 1vk2 h LEU 166 Ca 0.00 -0.34 -0.25 0.00 0.09 0.00 0.00 57.88 57.38 1vk2 h LEU 166 Cb 0.61 -0.23 -0.04 0.00 0.09 0.00 0.00 40.66 41.08 1vk2 h LEU 166 CO 0.00 1.08 -1.48 0.03 0.09 0.00 0.00 178.44 178.15 1vk2 h ARG 167 N 0.68 0.00 -4.44 1.13 2.47 -1.33 -3.42 114.38 109.47 1vk2 h ARG 167 Ca 0.08 0.00 -0.64 0.00 -1.26 0.00 0.00 59.98 58.15 1vk2 h ARG 167 Cb 0.85 0.00 -0.40 0.00 -1.65 0.00 0.00 29.97 28.77 1vk2 h ARG 167 CO 0.07 0.57 -0.73 1.21 0.56 0.00 0.00 179.97 181.65 1vk2 s ASN 168 N -6.19 4.57 -0.04 7.04 3.84 -0.53 -4.99 114.94 118.65 1vk2 s ASN 168 Ca -0.03 -2.00 0.06 0.00 0.21 0.00 0.00 52.86 51.11 1vk2 s ASN 168 Cb 0.08 -1.45 0.25 0.00 -0.55 0.00 0.00 41.25 39.58 1vk2 s ASN 168 CO 0.82 -0.38 1.04 0.54 -2.79 0.00 0.00 177.10 176.34 1vk2 n ARG 169 N 4.40 1.94 -2.06 0.43 1.74 -1.26 -4.43 116.66 117.43 1vk2 n ARG 169 Ca 0.02 -0.97 -0.41 0.00 -0.77 0.00 0.00 57.85 55.72 1vk2 n ARG 169 Cb 0.42 -1.48 -0.02 0.00 -1.02 0.00 0.00 32.46 30.36 1vk2 n ARG 169 CO 0.00 0.00 0.00 -1.54 -1.52 0.00 0.00 177.63 174.57 1vk2 s SER 170 N -0.62 6.70 0.38 0.55 1.04 -1.26 -4.91 113.70 115.58 1vk2 s SER 170 Ca 0.17 2.74 0.06 0.00 0.48 0.00 0.00 55.95 59.40 1vk2 s SER 170 Cb 0.11 -2.65 0.78 0.00 0.10 0.00 0.00 66.02 64.36 1vk2 s SER 170 CO 0.08 -0.60 2.00 0.78 0.98 0.00 0.00 173.24 176.48 1vk2 h ASN 171 N 3.48 0.60 -0.42 7.02 2.35 -1.99 -2.70 115.58 123.92 1vk2 h ASN 171 Ca -0.49 -0.01 -0.03 0.00 -0.55 0.00 0.00 56.30 55.23 1vk2 h ASN 171 Cb 1.23 -0.14 -0.02 0.00 0.05 0.00 0.00 38.32 39.44 1vk2 h ASN 171 CO 0.66 0.41 0.15 -0.08 -1.65 0.00 0.00 177.43 176.92 1vk2 h GLU 172 N 0.69 0.64 -0.59 0.81 4.57 -1.99 0.39 114.58 119.10 1vk2 h GLU 172 Ca 0.25 -0.13 -0.04 0.00 -1.18 0.00 0.00 59.36 58.26 1vk2 h GLU 172 Cb 0.11 -0.10 -0.03 0.00 -0.16 0.00 0.00 28.75 28.58 1vk2 h GLU 172 CO -0.07 0.61 0.22 1.25 -1.18 0.00 0.00 179.01 179.85 1vk2 h LEU 173 N 0.53 0.83 -0.57 1.64 5.85 -1.90 -1.07 115.31 120.61 1vk2 h LEU 173 Ca 0.14 -0.18 -0.03 0.00 0.84 0.00 0.00 57.88 58.65 1vk2 h LEU 173 Cb 0.23 -0.22 -0.03 0.00 0.37 0.00 0.00 40.66 41.02 1vk2 h LEU 173 CO -0.01 0.78 0.25 -0.09 -0.34 0.00 0.00 178.44 179.04 1vk2 h ARG 174 N 0.83 0.84 -0.64 1.25 2.43 -1.35 -2.42 114.38 115.32 1vk2 h ARG 174 Ca 0.20 -0.14 -0.04 0.00 -0.81 0.00 0.00 59.98 59.19 1vk2 h ARG 174 Cb 0.22 -0.14 -0.03 0.00 -0.42 0.00 0.00 29.97 29.60 1vk2 h ARG 174 CO -0.01 0.71 0.26 -0.09 -1.51 0.00 0.00 179.97 179.32 1vk2 h ARG 175 N 0.79 0.94 -0.59 0.20 2.43 -0.52 -1.52 114.38 116.10 1vk2 h ARG 175 Ca 0.19 -0.15 -0.00 0.00 -0.81 0.00 0.00 59.98 59.21 1vk2 h ARG 175 Cb 0.16 -0.16 -0.03 0.00 -0.42 0.00 0.00 29.97 29.52 1vk2 h ARG 175 CO -0.02 0.77 0.36 0.82 -1.51 0.00 0.00 179.97 180.39 1vk2 h ILE 176 N 0.92 1.17 -0.50 1.20 2.04 -0.96 -0.56 117.51 120.83 1vk2 h ILE 176 Ca 0.22 -0.36 -0.08 0.00 1.00 0.00 0.00 64.86 65.64 1vk2 h ILE 176 Cb 0.18 0.35 -0.02 0.00 -0.74 0.00 0.00 36.82 36.59 1vk2 h ILE 176 CO -0.02 0.17 0.01 0.58 0.00 0.00 0.00 178.15 178.89 1vk2 h VAL 177 N 0.79 1.26 -0.86 1.67 2.07 -1.06 -1.66 116.25 118.47 1vk2 h VAL 177 Ca 0.21 -1.06 -0.00 0.00 0.82 0.00 0.00 66.70 66.67 1vk2 h VAL 177 Cb -0.04 0.96 -0.04 0.00 -1.52 0.00 0.00 31.29 30.65 1vk2 h VAL 177 CO -0.04 0.37 0.52 -0.07 0.02 0.00 0.00 177.57 178.38 1vk2 h LEU 178 N 0.74 1.02 -1.07 2.57 3.38 -1.10 -1.13 115.31 119.71 1vk2 h LEU 178 Ca 0.14 -0.05 -0.04 0.00 0.09 0.00 0.00 57.88 58.02 1vk2 h LEU 178 Cb 0.50 -0.26 -0.03 0.00 0.09 0.00 0.00 40.66 40.97 1vk2 h LEU 178 CO 0.02 0.78 0.18 -0.08 0.09 0.00 0.00 178.44 179.43 1vk2 h GLU 179 N 1.18 0.84 -0.42 1.13 4.81 -0.86 -1.74 114.58 119.51 1vk2 h GLU 179 Ca 0.31 -0.15 -0.13 0.00 -0.13 0.00 0.00 59.36 59.26 1vk2 h GLU 179 Cb -0.06 -0.14 -0.01 0.00 0.63 0.00 0.00 28.75 29.17 1vk2 h GLU 179 CO -0.06 0.73 -0.25 -0.44 -0.73 0.00 0.00 179.01 178.26 1vk2 h ASP 180 N 0.82 0.91 -0.35 1.04 3.32 -0.67 -1.28 116.42 120.22 1vk2 h ASP 180 Ca 0.19 -0.35 -0.13 0.00 0.02 0.00 0.00 57.03 56.75 1vk2 h ASP 180 Cb 0.23 -0.25 -0.01 0.00 0.22 0.00 0.00 39.33 39.52 1vk2 h ASP 180 CO -0.01 1.11 -0.28 0.40 -1.72 0.00 0.00 179.24 178.73 1vk2 h ILE 181 N 0.76 1.27 -0.39 0.35 2.04 -1.01 -1.08 117.51 119.45 1vk2 h ILE 181 Ca 0.10 -1.44 -0.09 0.00 1.00 0.00 0.00 64.86 64.42 1vk2 h ILE 181 Cb 0.80 1.26 -0.02 0.00 -0.74 0.00 0.00 36.82 38.13 1vk2 h ILE 181 CO 0.07 0.48 -0.13 -0.08 0.00 0.00 0.00 178.15 178.49 1vk2 h GLU 182 N 0.74 0.71 -0.59 2.37 4.57 -1.18 -1.02 114.58 120.18 1vk2 h GLU 182 Ca 0.08 -0.24 -0.06 0.00 -1.18 0.00 0.00 59.36 57.97 1vk2 h GLU 182 Cb 0.84 -0.06 -0.03 0.00 -0.16 0.00 0.00 28.75 29.35 1vk2 h GLU 182 CO 0.07 0.81 0.12 -0.22 -1.18 0.00 0.00 179.01 178.62 1vk2 h LYS 183 N 0.64 0.93 -0.04 1.92 3.64 -0.90 -2.04 116.57 120.72 1vk2 h LYS 183 Ca 0.11 -0.21 0.00 0.00 -1.27 0.00 0.00 60.65 59.28 1vk2 h LYS 183 Cb 0.60 -0.13 -0.00 0.00 -0.41 0.00 0.00 32.23 32.29 1vk2 h LYS 183 CO 0.04 0.84 0.03 0.00 -2.27 0.00 0.00 179.45 178.09 1vk2 h ALA 184 N 1.24 0.06 -0.65 5.00 0.00 -0.63 -2.84 119.26 121.44 1vk2 h ALA 184 Ca 0.19 -0.02 0.11 0.00 0.00 0.00 0.00 54.91 55.19 1vk2 h ALA 184 Cb 0.35 -0.02 -0.04 0.00 0.00 0.00 0.00 17.79 18.09 1vk2 h ALA 184 CO 0.00 -0.43 0.44 0.87 0.00 0.00 0.00 179.25 180.13 1vk2 h LYS 185 N 0.03 0.42 0.00 0.00 1.57 -0.86 -1.27 116.57 116.47 1vk2 h LYS 185 Ca 0.02 -0.03 0.00 0.00 -1.87 0.00 0.00 60.65 58.77 1vk2 h LYS 185 Cb 0.02 -0.09 0.00 0.00 0.08 0.00 0.00 32.23 32.24 1vk2 h LYS 185 CO -0.00 0.28 0.00 0.66 -0.57 0.00 0.00 179.45 179.81 1vk2 h SER 186 N 0.43 0.00 0.05 0.86 4.64 -1.12 -2.27 113.55 116.14 1vk2 h SER 186 Ca 0.31 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.63 1vk2 h SER 186 Cb 0.61 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.70 1vk2 h SER 186 CO -0.09 0.00 -0.12 0.49 -0.87 0.00 0.00 176.83 176.24 1vk2 n PHE 187 N -2.46 0.00 -2.38 4.77 3.72 -0.48 -4.90 117.46 115.73 1vk2 n PHE 187 Ca 0.02 0.00 -0.42 0.00 -0.05 0.00 0.00 57.45 57.00 1vk2 n PHE 187 Cb 0.25 -0.03 -0.03 0.00 -0.94 0.00 0.00 39.48 38.72 1vk2 n PHE 187 CO 0.00 0.00 0.00 0.42 -0.05 0.00 0.00 176.76 177.13 1vk2 s ILE 188 N -2.19 3.79 0.58 4.37 1.01 -0.86 -4.79 121.20 123.12 1vk2 s ILE 188 Ca 0.30 1.36 -0.18 0.00 0.00 0.00 0.00 60.65 62.13 1vk2 s ILE 188 Cb 0.20 -3.87 -0.04 0.00 0.01 0.00 0.00 42.46 38.76 1vk2 s ILE 188 CO 0.41 0.15 1.13 -0.54 0.00 0.00 0.00 174.94 176.09 1vk2 s LYS 189 N 0.60 3.14 0.54 2.79 1.02 -1.26 -4.97 119.74 121.60 1vk2 s LYS 189 Ca 0.57 1.58 0.30 0.00 0.02 0.00 0.00 55.97 58.44 1vk2 s LYS 189 Cb -0.31 -1.98 1.47 0.00 -0.52 0.00 0.00 37.83 36.49 1vk2 s LYS 189 CO 0.32 -1.02 1.91 1.57 -0.92 0.00 0.00 175.35 177.21 1vk2 h LYS 190 N 0.81 0.00 0.00 1.68 5.09 -1.99 -3.53 116.57 118.64 1vk2 h LYS 190 Ca -0.49 0.00 0.00 0.00 0.09 0.00 0.00 60.65 60.25 1vk2 h LYS 190 Cb 1.26 0.00 0.00 0.00 0.10 0.00 0.00 32.23 33.59 1vk2 h LYS 190 CO 0.56 0.00 0.00 0.39 -2.09 0.00 0.00 179.45 178.31