#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1vkw s SER -9 N 0.00 0.77 -0.24 1.61 1.04 -1.26 -5.16 113.70 110.46 1vkw s SER -9 Ca 0.00 -0.87 -0.32 0.00 0.48 0.00 0.00 55.95 55.24 1vkw s SER -9 Cb 0.00 0.12 0.16 0.00 0.10 0.00 0.00 66.02 66.40 1vkw s SER -9 CO 0.00 -0.45 1.26 -0.62 0.98 0.00 0.00 173.24 174.41 1vkw s ASP -8 N -2.56 -0.12 0.54 7.02 2.15 -1.26 -5.15 116.67 117.29 1vkw s ASP -8 Ca 0.03 0.08 -0.21 0.00 0.43 0.00 0.00 52.55 52.88 1vkw s ASP -8 Cb 0.02 0.11 -0.07 0.00 -0.30 0.00 0.00 42.92 42.68 1vkw s ASP -8 CO -0.05 -0.14 1.02 0.29 -0.17 0.00 0.00 175.17 176.11 1vkw n LYS -7 N 0.30 1.15 -0.13 4.34 5.02 -1.26 -4.91 118.16 122.67 1vkw n LYS -7 Ca -0.01 0.43 -0.05 0.00 -2.02 0.00 0.00 58.31 56.66 1vkw n LYS -7 Cb 0.58 -2.17 0.04 0.00 -0.02 0.00 0.00 35.03 33.46 1vkw n LYS -7 CO 0.00 0.00 0.00 0.82 -0.52 0.00 0.00 177.40 177.70 1vkw h ILE -6 N 0.95 0.87 -2.87 -0.18 2.04 -2.07 -3.41 117.51 112.84 1vkw h ILE -6 Ca -0.47 -0.11 -0.17 0.00 1.00 0.00 0.00 64.86 65.10 1vkw h ILE -6 Cb 1.35 0.52 -0.29 0.00 -0.74 0.00 0.00 36.82 37.66 1vkw h ILE -6 CO 0.53 0.06 -0.43 -1.00 0.00 0.00 0.00 178.15 177.31 1vkw s HIS -5 N -6.15 -0.44 0.29 1.37 3.76 -1.26 -5.14 115.29 107.72 1vkw s HIS -5 Ca -0.13 0.98 -0.24 0.00 -0.15 0.00 0.00 55.06 55.53 1vkw s HIS -5 Cb 0.13 0.11 -0.09 0.00 1.11 0.00 0.00 32.58 33.84 1vkw s HIS -5 CO 0.72 -0.29 0.87 -1.01 -0.85 0.00 0.00 174.74 174.18 1vkw s HIS -4 N 1.48 3.68 0.39 1.40 3.76 -1.26 -5.04 115.29 119.70 1vkw s HIS -4 Ca -0.08 1.65 -0.24 0.00 -0.15 0.00 0.00 55.06 56.23 1vkw s HIS -4 Cb -0.10 -2.82 -0.09 0.00 1.11 0.00 0.00 32.58 30.68 1vkw s HIS -4 CO -0.10 0.26 1.05 -1.58 -0.85 0.00 0.00 174.74 173.52 1vkw s HIS -3 N -1.58 3.29 0.02 1.40 2.46 -1.26 -5.06 115.29 114.56 1vkw s HIS -3 Ca 0.48 1.65 0.05 0.00 0.47 0.00 0.00 55.06 57.70 1vkw s HIS -3 Cb -0.18 -3.14 -0.02 0.00 -0.13 0.00 0.00 32.58 29.11 1vkw s HIS -3 CO 0.23 -0.63 -0.14 -1.01 -2.47 0.00 0.00 174.74 170.71 1vkw s HIS -2 N -1.62 1.27 -0.05 3.88 3.76 -1.26 -5.11 115.29 116.16 1vkw s HIS -2 Ca 0.57 -0.31 -0.30 0.00 -0.15 0.00 0.00 55.06 54.88 1vkw s HIS -2 Cb -0.23 -0.78 -0.07 0.00 1.11 0.00 0.00 32.58 32.62 1vkw s HIS -2 CO 0.29 0.02 1.86 -1.58 -0.85 0.00 0.00 174.74 174.47 1vkw s HIS -1 N -0.63 1.57 0.00 1.40 2.46 -1.26 -5.24 115.29 113.60 1vkw s HIS -1 Ca 0.03 -0.02 0.00 0.00 0.47 0.00 0.00 55.06 55.54 1vkw s HIS -1 Cb -0.07 -4.08 0.00 0.00 -0.13 0.00 0.00 32.58 28.30 1vkw s HIS -1 CO 0.01 -4.56 0.00 1.58 -2.47 0.00 0.00 174.74 169.30 1vkw n HIS 0 N 8.03 -2.57 -4.28 3.88 -0.00 -1.26 -5.05 115.22 113.96 1vkw n HIS 0 Ca 0.20 0.00 -0.16 0.00 -0.00 0.00 0.00 57.72 57.76 1vkw n HIS 0 Cb 0.43 0.00 -0.10 0.00 -0.00 0.00 0.00 29.99 30.32 1vkw n HIS 0 CO 0.00 0.00 0.00 0.54 -0.00 0.00 0.00 176.34 176.88 1vkw s ASN 2 N -1.22 1.02 0.33 0.26 2.20 -1.26 -5.13 114.94 111.14 1vkw s ASN 2 Ca 0.00 -1.47 0.06 0.00 -0.94 0.00 0.00 52.86 50.51 1vkw s ASN 2 Cb 0.00 0.34 0.73 0.00 -2.00 0.00 0.00 41.25 40.32 1vkw s ASN 2 CO 0.00 -0.84 1.84 -0.29 -2.94 0.00 0.00 177.10 174.87 1vkw h ILE 3 N 2.38 0.83 -0.46 0.54 6.09 -1.99 -0.66 117.51 124.23 1vkw h ILE 3 Ca -0.35 -0.27 -0.07 0.00 -1.37 0.00 0.00 64.86 62.80 1vkw h ILE 3 Cb 1.25 -0.03 -0.02 0.00 0.47 0.00 0.00 36.82 38.49 1vkw h ILE 3 CO 0.53 0.14 0.00 -0.26 -3.07 0.00 0.00 178.15 175.50 1vkw h PHE 4 N 0.79 0.89 -0.44 2.19 0.04 -1.99 -1.65 116.94 116.76 1vkw h PHE 4 Ca 0.49 -0.15 -0.14 0.00 2.80 0.00 0.00 57.97 60.96 1vkw h PHE 4 Cb 0.70 -0.23 -0.01 0.00 2.20 0.00 0.00 35.95 38.61 1vkw h PHE 4 CO -0.00 0.86 -0.28 0.93 -0.60 0.00 0.00 178.31 179.21 1vkw h GLU 5 N 0.67 0.97 -0.29 1.51 5.08 -1.76 -1.21 114.58 119.55 1vkw h GLU 5 Ca 0.13 -0.45 0.00 0.00 -1.00 0.00 0.00 59.36 58.04 1vkw h GLU 5 Cb 0.50 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.72 1vkw h GLU 5 CO 0.02 1.12 0.19 0.00 -1.00 0.00 0.00 179.01 179.33 1vkw h ALA 6 N 0.85 0.37 -0.42 3.43 0.00 -1.04 0.19 119.26 122.64 1vkw h ALA 6 Ca 0.09 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.96 1vkw h ALA 6 Cb 0.86 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.52 1vkw h ALA 6 CO 0.08 -0.15 0.23 0.82 0.00 0.00 0.00 179.25 180.23 1vkw h ILE 7 N 0.38 1.16 -0.01 0.00 2.04 -1.22 -1.27 117.51 118.60 1vkw h ILE 7 Ca 0.11 -0.40 -0.10 0.00 1.00 0.00 0.00 64.86 65.47 1vkw h ILE 7 Cb -0.02 0.65 -0.01 0.00 -0.74 0.00 0.00 36.82 36.70 1vkw h ILE 7 CO -0.02 0.16 -0.45 -0.08 0.00 0.00 0.00 178.15 177.76 1vkw h GLU 8 N 0.55 0.01 -0.02 2.37 4.81 -0.95 -2.94 114.58 118.41 1vkw h GLU 8 Ca 0.15 -0.01 0.00 0.00 -0.13 0.00 0.00 59.36 59.37 1vkw h GLU 8 Cb 0.05 -0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.43 1vkw h GLU 8 CO -0.02 0.46 -0.04 0.09 -0.73 0.00 0.00 179.01 178.77 1vkw n ASN 9 N -4.00 1.78 -4.65 1.04 3.02 0.65 -4.87 115.26 108.23 1vkw n ASN 9 Ca -0.02 -1.54 -0.42 0.00 -0.03 0.00 0.00 54.58 52.57 1vkw n ASN 9 Cb 0.48 0.03 -0.03 0.00 -0.61 0.00 0.00 39.78 39.65 1vkw n ASN 9 CO 0.00 0.00 0.00 -0.60 -2.62 0.00 0.00 177.26 174.04 1vkw s ARG 10 N -2.07 4.20 0.07 3.52 3.52 -0.50 -5.03 118.95 122.67 1vkw s ARG 10 Ca 0.34 1.15 0.04 0.00 -0.13 0.00 0.00 55.73 57.12 1vkw s ARG 10 Cb 0.21 -3.65 -0.03 0.00 -1.56 0.00 0.00 34.95 29.91 1vkw s ARG 10 CO 0.35 -0.61 -0.11 -1.01 -0.81 0.00 0.00 175.30 173.11 1vkw s HIS 11 N 3.09 1.03 -0.09 5.12 3.76 -1.26 -5.01 115.29 121.93 1vkw s HIS 11 Ca 0.40 -0.53 -0.30 0.00 -0.15 0.00 0.00 55.06 54.49 1vkw s HIS 11 Cb -0.15 -0.58 -0.03 0.00 1.11 0.00 0.00 32.58 32.93 1vkw s HIS 11 CO 0.07 0.01 1.31 -1.12 -0.85 0.00 0.00 174.74 174.16 1vkw s SER 12 N -1.92 6.93 -0.09 1.40 0.01 -1.26 -3.98 113.70 114.79 1vkw s SER 12 Ca -0.02 1.86 0.02 0.00 1.31 0.00 0.00 55.95 59.12 1vkw s SER 12 Cb -0.08 -2.55 0.01 0.00 0.21 0.00 0.00 66.02 63.62 1vkw s SER 12 CO 0.01 -0.72 -0.16 -0.69 0.41 0.00 0.00 173.24 172.09 1vkw s VAL 13 N 3.02 1.46 -0.03 3.43 1.01 -0.00 -4.99 120.40 124.30 1vkw s VAL 13 Ca 0.59 -0.64 0.12 0.00 0.00 0.00 0.00 61.98 62.04 1vkw s VAL 13 Cb -0.25 -1.32 -0.18 0.00 0.00 0.00 0.00 36.38 34.63 1vkw s VAL 13 CO 0.20 0.43 0.24 -1.14 0.00 0.00 0.00 175.10 174.83 1vkw n ARG 14 N 3.95 0.55 -3.62 2.72 0.63 -1.26 -4.11 116.66 115.52 1vkw n ARG 14 Ca -0.20 -0.10 -0.40 0.00 -0.92 0.00 0.00 57.85 56.23 1vkw n ARG 14 Cb 0.52 -1.29 -0.10 0.00 0.45 0.00 0.00 32.46 32.04 1vkw n ARG 14 CO 0.00 0.00 0.00 0.34 -2.51 0.00 0.00 177.63 175.46 1vkw s ASP 15 N -3.49 5.62 0.51 6.15 2.15 -1.26 -5.07 116.67 121.28 1vkw s ASP 15 Ca -0.05 -1.35 0.04 0.00 0.43 0.00 0.00 52.55 51.62 1vkw s ASP 15 Cb 0.07 -1.98 -0.00 0.00 -0.30 0.00 0.00 42.92 40.71 1vkw s ASP 15 CO 0.50 -0.48 0.17 -0.36 -0.17 0.00 0.00 175.17 174.83 1vkw s PHE 16 N 1.45 1.90 0.00 -5.34 0.08 -1.26 -2.72 117.98 112.08 1vkw s PHE 16 Ca 0.02 -0.86 0.00 0.00 0.12 0.00 0.00 56.93 56.22 1vkw s PHE 16 Cb -0.22 -1.77 0.00 0.00 -0.57 0.00 0.00 43.02 40.46 1vkw s PHE 16 CO 0.03 -0.03 0.00 1.28 -0.10 0.00 0.00 175.22 176.40 1vkw n LEU 17 N -1.43 0.00 0.00 -0.37 4.77 -0.05 -4.60 117.00 115.31 1vkw n LEU 17 Ca -0.10 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.88 1vkw n LEU 17 Cb 0.66 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.75 1vkw n LEU 17 CO 0.40 -0.00 0.25 -0.62 -1.33 0.00 0.00 177.39 176.08 1vkw n GLU 18 N -0.00 0.46 -0.37 3.23 1.02 -1.26 -4.73 120.64 118.98 1vkw n GLU 18 Ca 0.00 -0.58 0.32 0.00 -0.02 0.00 0.00 57.16 56.88 1vkw n GLU 18 Cb 0.00 -0.61 0.59 0.00 -0.02 0.00 0.00 31.44 31.40 1vkw n GLU 18 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1vkw h ARG 19 N 0.00 0.11 -2.22 3.49 -0.00 -1.98 -3.51 114.38 110.27 1vkw h ARG 19 Ca 0.00 -0.01 0.22 0.00 -0.50 0.00 0.00 59.98 59.70 1vkw h ARG 19 Cb 0.78 -0.02 -0.07 0.00 0.00 0.00 0.00 29.97 30.66 1vkw h ARG 19 CO 0.00 0.07 0.65 0.15 0.00 0.00 0.00 179.97 180.84 1vkw s LYS 20 N -5.47 0.97 0.35 0.04 3.01 -1.26 -5.19 119.74 112.20 1vkw s LYS 20 Ca -0.09 -0.59 -0.17 0.00 -1.01 0.00 0.00 55.97 54.11 1vkw s LYS 20 Cb 0.31 0.30 0.05 0.00 -1.01 0.00 0.00 37.83 37.48 1vkw s LYS 20 CO 0.80 -0.45 0.79 -1.25 0.51 0.00 0.00 175.35 175.74 1vkw s PRO 22 N -2.48 2.09 0.46 -1.68 0.04 -1.26 -4.88 135.00 127.29 1vkw s PRO 22 Ca 0.19 -1.31 0.24 0.00 0.04 0.00 0.00 61.00 60.16 1vkw s PRO 22 Cb -0.01 0.61 1.06 0.00 0.04 0.00 0.00 34.50 36.21 1vkw s PRO 22 CO 0.02 -0.97 1.90 1.05 0.04 0.00 0.00 177.00 179.04 1vkw h GLU 23 N 2.00 0.00 -0.95 4.56 9.09 -2.00 -3.01 114.58 124.26 1vkw h GLU 23 Ca -0.29 0.00 0.16 0.00 0.05 0.00 0.00 59.36 59.28 1vkw h GLU 23 Cb 1.25 0.00 -0.08 0.00 -1.65 0.00 0.00 28.75 28.26 1vkw h GLU 23 CO 0.36 0.22 0.60 -0.09 0.05 0.00 0.00 179.01 180.16 1vkw h ARG 24 N 0.00 0.74 -0.01 1.06 1.12 -2.05 0.23 114.38 115.47 1vkw h ARG 24 Ca -0.00 -0.04 -0.17 0.00 -1.11 0.00 0.00 59.98 58.66 1vkw h ARG 24 Cb 0.62 -0.17 -0.02 0.00 -0.01 0.00 0.00 29.97 30.39 1vkw h ARG 24 CO 0.03 0.49 -0.76 -0.39 -3.11 0.00 0.00 179.97 176.22 1vkw h VAL 25 N 0.76 1.51 -0.36 0.20 -1.51 -1.96 -0.42 116.25 114.48 1vkw h VAL 25 Ca 0.50 -2.52 -0.01 0.00 -1.23 0.00 0.00 66.70 63.43 1vkw h VAL 25 Cb 0.76 2.37 -0.02 0.00 -2.13 0.00 0.00 31.29 32.27 1vkw h VAL 25 CO -0.27 0.73 0.18 0.50 -1.23 0.00 0.00 177.57 177.48 1vkw h LYS 26 N 0.04 0.51 -0.30 5.19 3.64 -1.26 -2.09 116.57 122.30 1vkw h LYS 26 Ca -0.02 -0.07 0.05 0.00 -1.27 0.00 0.00 60.65 59.34 1vkw h LYS 26 Cb 1.34 -0.09 -0.05 0.00 -0.41 0.00 0.00 32.23 33.02 1vkw h LYS 26 CO 0.11 0.45 0.01 -0.44 -2.27 0.00 0.00 179.45 177.30 1vkw h ASP 27 N 0.44 -0.10 -0.66 4.20 3.32 -0.37 -1.37 116.42 121.88 1vkw h ASP 27 Ca 0.12 0.07 0.07 0.00 0.02 0.00 0.00 57.03 57.31 1vkw h ASP 27 Cb 0.10 0.11 -0.06 0.00 0.22 0.00 0.00 39.33 39.70 1vkw h ASP 27 CO -0.02 -0.02 0.35 0.44 -1.72 0.00 0.00 179.24 178.28 1vkw h ASP 28 N 0.10 0.51 -0.40 6.45 5.19 -0.94 -1.53 116.42 125.80 1vkw h ASP 28 Ca 0.14 0.04 -0.03 0.00 -0.62 0.00 0.00 57.03 56.56 1vkw h ASP 28 Cb 0.19 -0.06 -0.02 0.00 0.18 0.00 0.00 39.33 39.62 1vkw h ASP 28 CO -0.23 0.32 0.14 0.40 -3.12 0.00 0.00 179.24 176.74 1vkw h ILE 29 N 0.64 1.21 -0.08 0.35 2.04 -0.99 -2.64 117.51 118.05 1vkw h ILE 29 Ca 0.31 -0.68 -0.04 0.00 1.00 0.00 0.00 64.86 65.45 1vkw h ILE 29 Cb 0.23 0.89 -0.01 0.00 -0.74 0.00 0.00 36.82 37.20 1vkw h ILE 29 CO -0.20 0.24 -0.12 -0.33 0.00 0.00 0.00 178.15 177.73 1vkw h GLU 30 N 0.51 0.12 0.00 2.37 5.08 -0.69 -2.10 114.58 119.86 1vkw h GLU 30 Ca 0.13 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.47 1vkw h GLU 30 Cb 0.24 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.47 1vkw h GLU 30 CO -0.01 0.25 -0.01 -0.97 -1.00 0.00 0.00 179.01 177.27 1vkw h ASN 31 N 0.11 0.00 -2.07 1.42 -0.73 -1.13 -3.46 115.58 109.72 1vkw h ASN 31 Ca 0.02 -0.00 -0.62 0.00 1.87 0.00 0.00 56.30 57.58 1vkw h ASN 31 Cb 0.29 0.00 0.04 0.00 0.27 0.00 0.00 38.32 38.93 1vkw h ASN 31 CO 0.02 0.00 0.84 -0.11 -0.37 0.00 0.00 177.43 177.80 1vkw n LEU 32 N -2.89 2.93 -4.68 0.34 7.94 -0.79 -4.92 117.00 114.93 1vkw n LEU 32 Ca 0.04 1.06 -0.43 0.00 -1.11 0.00 0.00 56.01 55.57 1vkw n LEU 32 Cb 0.51 -1.36 -0.02 0.00 0.53 0.00 0.00 43.42 43.07 1vkw n LEU 32 CO 0.33 -0.35 0.92 -0.22 -1.11 0.00 0.00 177.39 176.96 1vkw s LEU 33 N 1.89 4.21 -0.10 -1.96 2.96 -1.26 -5.03 118.68 119.40 1vkw s LEU 33 Ca 0.85 1.60 0.01 0.00 -0.22 0.00 0.00 54.13 56.38 1vkw s LEU 33 Cb -0.75 -3.55 -0.02 0.00 0.50 0.00 0.00 46.19 42.37 1vkw s LEU 33 CO 0.45 -0.59 -0.13 0.54 -1.32 0.00 0.00 176.35 175.30 1vkw s VAL 34 N 2.59 3.09 0.22 1.68 0.11 -1.26 -5.09 120.40 121.74 1vkw s VAL 34 Ca 0.51 -0.68 -0.25 0.00 -2.93 0.00 0.00 61.98 58.63 1vkw s VAL 34 Cb -0.20 -2.26 -0.09 0.00 -1.53 0.00 0.00 36.38 32.31 1vkw s VAL 34 CO 0.16 0.55 0.83 -0.75 -3.33 0.00 0.00 175.10 172.56 1vkw s LYS 35 N -0.13 4.57 0.09 1.54 2.47 -1.26 -5.08 119.74 121.93 1vkw s LYS 35 Ca -0.01 1.20 0.02 0.00 -1.56 0.00 0.00 55.97 55.61 1vkw s LYS 35 Cb -0.14 -3.11 -0.04 0.00 -1.46 0.00 0.00 37.83 33.08 1vkw s LYS 35 CO 0.03 0.48 -0.07 -0.59 0.16 0.00 0.00 175.35 175.36 1vkw s PHE 36 N -1.31 0.84 -0.18 4.03 -0.12 -1.26 -4.63 117.98 115.35 1vkw s PHE 36 Ca 0.41 -0.83 -0.22 0.00 -0.05 0.00 0.00 56.93 56.24 1vkw s PHE 36 Cb -0.22 -0.49 -0.22 0.00 -0.63 0.00 0.00 43.02 41.46 1vkw s PHE 36 CO 0.26 -0.14 0.39 0.82 -0.05 0.00 0.00 175.22 176.50 1vkw h ILE 37 N 3.30 1.13 0.00 -4.49 2.04 -1.98 -3.46 117.51 114.05 1vkw h ILE 37 Ca -0.35 -2.25 0.00 0.00 1.00 0.00 0.00 64.86 63.25 1vkw h ILE 37 Cb 1.17 2.57 0.00 0.00 -0.74 0.00 0.00 36.82 39.82 1vkw h ILE 37 CO 0.60 0.45 -0.07 0.41 0.00 0.00 0.00 178.15 179.54 1vkw n THR 38 N -4.38 1.08 -3.96 -0.27 -1.04 -1.26 -5.10 114.28 99.35 1vkw n THR 38 Ca -0.26 0.36 -0.11 0.00 -2.04 0.00 0.00 64.05 62.00 1vkw n THR 38 Cb 0.67 -1.52 -0.13 0.00 -1.82 0.00 0.00 70.33 67.54 1vkw n THR 38 CO 0.00 0.00 0.00 -1.59 -0.64 0.00 0.00 175.07 172.84 1vkw s LYS 39 N -2.00 0.20 0.00 -2.82 -2.85 -1.26 -5.13 119.74 105.88 1vkw s LYS 39 Ca 0.00 -0.30 -0.30 0.00 -1.00 0.00 0.00 55.97 54.36 1vkw s LYS 39 Cb 0.00 -0.03 -0.04 0.00 -2.06 0.00 0.00 37.83 35.71 1vkw s LYS 39 CO 0.00 -0.00 1.06 0.21 0.10 0.00 0.00 175.35 176.72 1vkw s LYS 40 N -0.68 4.50 0.87 1.78 2.20 -1.26 -4.95 119.74 122.20 1vkw s LYS 40 Ca -0.06 1.54 -0.12 0.00 -0.36 0.00 0.00 55.97 56.96 1vkw s LYS 40 Cb -0.05 -3.44 0.11 0.00 -1.51 0.00 0.00 37.83 32.95 1vkw s LYS 40 CO -0.00 -0.16 1.14 -0.51 -0.36 0.00 0.00 175.35 175.45 1vkw s LEU 41 N 1.19 2.21 -0.99 5.43 1.43 -1.26 -4.99 118.68 121.70 1vkw s LEU 41 Ca 0.54 0.99 -0.12 0.00 -1.03 0.00 0.00 54.13 54.50 1vkw s LEU 41 Cb -0.23 -3.40 0.23 0.00 0.03 0.00 0.00 46.19 42.82 1vkw s LEU 41 CO 0.27 -2.32 1.00 -0.62 0.23 0.00 0.00 176.35 174.91 1vkw s ASP 42 N -4.11 7.03 0.21 2.29 2.15 -1.26 -5.04 116.67 117.93 1vkw s ASP 42 Ca 0.63 -3.06 -0.30 0.00 0.43 0.00 0.00 52.55 50.25 1vkw s ASP 42 Cb -0.14 -2.24 -0.08 0.00 -0.30 0.00 0.00 42.92 40.16 1vkw s ASP 42 CO 0.53 -0.50 1.07 0.26 -0.17 0.00 0.00 175.17 176.36 1vkw s TRP 43 N -0.16 3.66 0.04 -5.34 0.52 -1.26 -4.41 118.94 111.99 1vkw s TRP 43 Ca 0.27 1.68 0.07 0.00 0.02 0.00 0.00 56.10 58.14 1vkw s TRP 43 Cb -0.09 -3.22 -0.03 0.00 -1.15 0.00 0.00 33.47 28.98 1vkw s TRP 43 CO -0.08 -0.40 -0.21 0.15 0.02 0.00 0.00 176.95 176.44 1vkw s LYS 44 N -0.75 1.42 -0.15 4.98 -0.14 0.73 -4.99 119.74 120.84 1vkw s LYS 44 Ca 0.47 -0.94 0.00 0.00 -1.36 0.00 0.00 55.97 54.14 1vkw s LYS 44 Cb -0.29 -1.53 0.02 0.00 -1.68 0.00 0.00 37.83 34.35 1vkw s LYS 44 CO 0.36 0.39 -0.13 0.42 -0.76 0.00 0.00 175.35 175.63 1vkw s ILE 45 N -0.79 1.51 -0.31 2.17 1.09 -1.26 -1.23 121.20 122.37 1vkw s ILE 45 Ca 0.08 -0.62 -0.09 0.00 -1.10 0.00 0.00 60.65 58.92 1vkw s ILE 45 Cb -0.09 -1.44 -0.00 0.00 -1.06 0.00 0.00 42.46 39.87 1vkw s ILE 45 CO 0.02 0.42 0.13 0.21 -0.10 0.00 0.00 174.94 175.62 1vkw s ASN 46 N 1.51 5.42 -0.17 3.58 3.04 0.45 -4.93 114.94 123.84 1vkw s ASN 46 Ca 0.04 -0.59 0.14 0.00 0.04 0.00 0.00 52.86 52.49 1vkw s ASN 46 Cb -0.13 -1.96 0.43 0.00 -1.54 0.00 0.00 41.25 38.04 1vkw s ASN 46 CO -0.10 -0.20 1.20 0.00 -3.04 0.00 0.00 177.10 174.96 1vkw n LEU 47 N 4.95 2.54 -0.74 3.21 -0.00 -1.26 -1.68 117.00 124.02 1vkw n LEU 47 Ca -0.14 -3.55 0.08 0.00 -0.00 0.00 0.00 56.01 52.40 1vkw n LEU 47 Cb 0.49 -0.35 0.21 0.00 -0.00 0.00 0.00 43.42 43.77 1vkw n LEU 47 CO 0.33 1.27 0.67 -1.54 -0.00 0.00 0.00 177.39 178.13 1vkw n SER 48 N -0.69 3.46 -4.00 1.45 3.41 -1.26 -4.98 113.62 111.01 1vkw n SER 48 Ca 0.19 -2.70 -0.11 0.00 -0.26 0.00 0.00 58.87 55.98 1vkw n SER 48 Cb 0.83 -0.43 -0.12 0.00 -0.26 0.00 0.00 64.21 64.23 1vkw n SER 48 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 1vkw s SER 49 N -1.69 0.48 -0.23 4.04 1.04 -1.26 -5.13 113.70 110.95 1vkw s SER 49 Ca 0.35 -0.46 -0.05 0.00 0.48 0.00 0.00 55.95 56.27 1vkw s SER 49 Cb 0.26 0.06 -0.01 0.00 0.10 0.00 0.00 66.02 66.43 1vkw s SER 49 CO 0.10 -0.22 -0.01 0.12 0.98 0.00 0.00 173.24 174.21 1vkw s PHE 50 N -1.24 2.99 0.81 5.02 5.36 -1.26 -2.57 117.98 127.09 1vkw s PHE 50 Ca -0.11 -0.78 -0.12 0.00 -0.96 0.00 0.00 56.93 54.96 1vkw s PHE 50 Cb -0.09 -2.14 0.08 0.00 -0.34 0.00 0.00 43.02 40.53 1vkw s PHE 50 CO -0.00 -0.49 1.13 -1.25 -1.46 0.00 0.00 175.22 173.15 1vkw s PRO 51 N 1.51 1.95 0.41 10.12 0.04 -1.26 -5.14 135.00 142.63 1vkw s PRO 51 Ca 0.06 0.38 -0.24 0.00 0.04 0.00 0.00 61.00 61.23 1vkw s PRO 51 Cb -0.14 -1.93 -0.08 0.00 0.04 0.00 0.00 34.50 32.39 1vkw s PRO 51 CO -0.01 -1.66 1.12 -1.12 0.04 0.00 0.00 177.00 175.37 1vkw s SER 52 N -4.20 6.56 0.02 6.66 0.01 -1.06 -4.95 113.70 116.74 1vkw s SER 52 Ca 0.61 2.20 -0.12 0.00 1.31 0.00 0.00 55.95 59.96 1vkw s SER 52 Cb -0.13 -2.60 0.01 0.00 0.21 0.00 0.00 66.02 63.52 1vkw s SER 52 CO 0.52 -0.64 0.26 -0.72 0.41 0.00 0.00 173.24 173.07 1vkw s TYR 53 N -1.54 -0.07 0.08 2.43 -0.85 -0.67 -0.70 117.35 116.03 1vkw s TYR 53 Ca 0.58 -0.00 0.06 0.00 -0.52 0.00 0.00 57.07 57.20 1vkw s TYR 53 Cb -0.27 0.05 -0.04 0.00 0.38 0.00 0.00 41.96 42.08 1vkw s TYR 53 CO 0.33 -0.42 -0.10 0.42 -1.52 0.00 0.00 175.55 174.27 1vkw s ILE 54 N -1.96 3.39 0.13 -3.49 1.01 -0.05 -0.41 121.20 119.82 1vkw s ILE 54 Ca -0.09 -1.15 -0.25 0.00 0.00 0.00 0.00 60.65 59.15 1vkw s ILE 54 Cb -0.03 -2.55 0.07 0.00 0.01 0.00 0.00 42.46 39.96 1vkw s ILE 54 CO -0.00 0.19 0.91 -0.72 0.00 0.00 0.00 174.94 175.32 1vkw s TYR 55 N -1.15 -0.20 0.10 3.97 1.13 -0.37 -0.94 117.35 119.90 1vkw s TYR 55 Ca 0.20 -0.08 -0.09 0.00 -1.41 0.00 0.00 57.07 55.69 1vkw s TYR 55 Cb -0.11 0.62 0.00 0.00 -1.10 0.00 0.00 41.96 41.37 1vkw s TYR 55 CO 0.12 -0.80 0.22 0.00 -2.51 0.00 0.00 175.55 172.58 1vkw s ALA 56 N -3.32 -0.28 0.10 9.51 0.00 -1.26 -0.20 121.76 126.31 1vkw s ALA 56 Ca 0.10 -0.58 -0.30 0.00 0.00 0.00 0.00 51.96 51.19 1vkw s ALA 56 Cb -0.02 0.53 -0.06 0.00 0.00 0.00 0.00 23.12 23.58 1vkw s ALA 56 CO -0.01 -0.53 0.95 0.15 0.00 0.00 0.00 175.76 176.32 1vkw s LYS 57 N -3.86 4.68 0.04 0.00 1.02 -1.26 -4.53 119.74 115.83 1vkw s LYS 57 Ca 0.06 1.42 0.02 0.00 0.02 0.00 0.00 55.97 57.49 1vkw s LYS 57 Cb 0.04 -3.38 -0.02 0.00 -0.52 0.00 0.00 37.83 33.95 1vkw s LYS 57 CO -0.10 0.21 -0.08 0.00 -0.92 0.00 0.00 175.35 174.46 1vkw s ALA 58 N 0.01 0.63 0.47 5.17 0.00 -0.95 -4.76 121.76 122.32 1vkw s ALA 58 Ca 0.46 -0.77 -0.20 0.00 0.00 0.00 0.00 51.96 51.46 1vkw s ALA 58 Cb -0.23 0.02 -0.09 0.00 0.00 0.00 0.00 23.12 22.82 1vkw s ALA 58 CO 0.29 0.00 0.99 -1.21 0.00 0.00 0.00 175.76 175.84 1vkw s GLU 59 N -1.54 3.98 -1.37 0.00 2.02 -1.26 -4.71 118.70 115.82 1vkw s GLU 59 Ca -0.09 1.19 -0.10 0.00 0.02 0.00 0.00 54.97 55.99 1vkw s GLU 59 Cb -0.10 -2.13 0.10 0.00 0.10 0.00 0.00 34.13 32.10 1vkw s GLU 59 CO 0.01 -0.26 2.17 0.36 0.02 0.00 0.00 175.26 177.56 1vkw n LYS 60 N -0.97 3.57 -4.15 1.61 -0.00 -1.26 -4.30 118.16 112.66 1vkw n LYS 60 Ca 0.08 -3.12 -0.16 0.00 -0.00 0.00 0.00 58.31 55.11 1vkw n LYS 60 Cb 0.53 -2.97 -0.11 0.00 -0.00 0.00 0.00 35.03 32.48 1vkw n LYS 60 CO 0.00 0.00 0.00 -1.01 0.00 0.00 0.00 177.40 176.39 1vkw s HIS 61 N 1.10 1.06 0.12 5.58 3.76 -1.26 -5.07 115.29 120.57 1vkw s HIS 61 Ca 0.47 -0.53 -0.30 0.00 -0.15 0.00 0.00 55.06 54.56 1vkw s HIS 61 Cb 0.13 -0.59 -0.08 0.00 1.11 0.00 0.00 32.58 33.14 1vkw s HIS 61 CO -0.04 0.01 1.60 0.35 -0.85 0.00 0.00 174.74 175.81 1vkw h PHE 62 N 4.09 -1.06 -0.65 1.40 3.04 -1.99 -2.27 116.94 119.51 1vkw h PHE 62 Ca -0.39 0.03 -0.04 0.00 3.98 0.00 0.00 57.97 61.55 1vkw h PHE 62 Cb 1.19 0.45 -0.03 0.00 2.56 0.00 0.00 35.95 40.13 1vkw h PHE 62 CO 0.64 -0.48 0.24 -0.44 -2.02 0.00 0.00 178.31 176.25 1vkw h ASP 63 N -0.59 0.88 0.29 0.41 3.32 -1.96 -1.49 116.42 117.27 1vkw h ASP 63 Ca 0.03 -0.13 -0.13 0.00 0.02 0.00 0.00 57.03 56.83 1vkw h ASP 63 Cb 0.63 -0.23 -0.01 0.00 0.22 0.00 0.00 39.33 39.95 1vkw h ASP 63 CO -0.25 0.80 -0.50 -0.33 -1.72 0.00 0.00 179.24 177.24 1vkw h GLU 64 N 0.94 0.25 -0.05 3.56 3.07 -1.82 -1.90 114.58 118.63 1vkw h GLU 64 Ca 0.22 -0.14 -0.21 0.00 -0.50 0.00 0.00 59.36 58.73 1vkw h GLU 64 Cb 0.21 0.01 0.00 0.00 -0.84 0.00 0.00 28.75 28.13 1vkw h GLU 64 CO -0.02 0.69 -0.84 -0.07 -1.40 0.00 0.00 179.01 177.38 1vkw h LEU 65 N 0.20 0.56 -0.64 1.33 3.38 -0.91 -1.51 115.31 117.70 1vkw h LEU 65 Ca 0.01 -0.40 0.04 0.00 0.09 0.00 0.00 57.88 57.61 1vkw h LEU 65 Cb 0.95 -0.17 -0.05 0.00 0.09 0.00 0.00 40.66 41.49 1vkw h LEU 65 CO 0.08 1.18 0.38 0.58 0.09 0.00 0.00 178.44 180.75 1vkw h VAL 66 N 0.28 1.03 -0.47 1.22 2.07 -1.17 -1.20 116.25 118.00 1vkw h VAL 66 Ca -0.06 -0.25 0.06 0.00 0.82 0.00 0.00 66.70 67.28 1vkw h VAL 66 Cb 1.45 0.24 -0.05 0.00 -1.52 0.00 0.00 31.29 31.41 1vkw h VAL 66 CO 0.15 0.13 0.17 -0.08 0.02 0.00 0.00 177.57 177.96 1vkw h GLU 67 N 0.72 0.33 -0.09 1.57 4.57 -1.20 0.28 114.58 120.77 1vkw h GLU 67 Ca 0.27 -0.02 0.01 0.00 -1.18 0.00 0.00 59.36 58.44 1vkw h GLU 67 Cb 0.09 -0.08 -0.01 0.00 -0.16 0.00 0.00 28.75 28.60 1vkw h GLU 67 CO -0.14 0.22 0.01 -0.92 -1.18 0.00 0.00 179.01 177.01 1vkw h TYR 68 N 0.34 0.02 -0.63 0.92 3.20 -0.76 -0.36 116.97 119.71 1vkw h TYR 68 Ca 0.22 0.01 -0.00 0.00 3.14 0.00 0.00 58.73 62.10 1vkw h TYR 68 Cb 0.23 0.00 -0.03 0.00 1.54 0.00 0.00 36.73 38.47 1vkw h TYR 68 CO -0.16 0.01 0.38 0.78 -1.64 0.00 0.00 178.16 177.53 1vkw h GLY 69 N 0.05 0.92 0.81 1.82 0.00 -0.91 0.94 103.07 106.70 1vkw h GLY 69 Ca 0.04 -0.39 -0.00 0.00 0.00 0.00 0.00 47.33 46.98 1vkw h GLY 69 CO -0.05 0.37 -0.01 -2.75 0.00 0.00 0.00 176.54 174.10 1vkw h PHE 70 N 0.86 -0.02 -0.17 5.60 3.57 -0.15 -1.09 116.94 125.54 1vkw h PHE 70 Ca 0.23 -0.00 -0.22 0.00 3.53 0.00 0.00 57.97 61.51 1vkw h PHE 70 Cb -0.02 0.01 0.01 0.00 2.79 0.00 0.00 35.95 38.74 1vkw h PHE 70 CO -0.02 0.17 -0.76 1.96 -2.23 0.00 0.00 178.31 177.44 1vkw h GLN 71 N -0.21 0.81 -0.77 1.11 4.20 -1.09 -3.08 115.11 116.08 1vkw h GLN 71 Ca -0.00 -0.65 0.00 0.00 0.06 0.00 0.00 58.65 58.06 1vkw h GLN 71 Cb 0.20 0.13 -0.04 0.00 0.30 0.00 0.00 27.48 28.07 1vkw h GLN 71 CO 0.00 1.26 0.49 0.78 -0.67 0.00 0.00 178.83 180.69 1vkw h GLY 72 N 0.56 1.11 2.00 3.46 0.00 -0.77 -2.45 103.07 106.97 1vkw h GLY 72 Ca -0.05 -0.44 -0.12 0.00 0.00 0.00 0.00 47.33 46.73 1vkw h GLY 72 CO 0.16 0.43 -0.56 -2.09 0.00 0.00 0.00 176.54 174.48 1vkw h GLU 73 N 1.05 0.00 -0.77 4.80 4.57 -1.26 -1.29 114.58 121.67 1vkw h GLU 73 Ca 0.28 0.00 0.04 0.00 -1.18 0.00 0.00 59.36 58.50 1vkw h GLU 73 Cb -0.08 0.00 -0.05 0.00 -0.16 0.00 0.00 28.75 28.46 1vkw h GLU 73 CO -0.06 0.56 0.49 1.96 -1.18 0.00 0.00 179.01 180.78 1vkw h GLN 74 N 0.00 0.91 -0.36 1.92 4.20 -1.36 -0.68 115.11 119.74 1vkw h GLN 74 Ca -0.01 -0.05 -0.06 0.00 0.06 0.00 0.00 58.65 58.59 1vkw h GLN 74 Cb 1.00 -0.21 -0.01 0.00 0.30 0.00 0.00 27.48 28.56 1vkw h GLN 74 CO 0.07 0.60 -0.01 0.82 -0.67 0.00 0.00 178.83 179.64 1vkw h ILE 75 N 0.94 1.26 -0.37 2.54 2.04 -1.07 -1.71 117.51 121.14 1vkw h ILE 75 Ca 0.32 -1.01 0.06 0.00 1.00 0.00 0.00 64.86 65.23 1vkw h ILE 75 Cb 0.04 1.20 -0.06 0.00 -0.74 0.00 0.00 36.82 37.27 1vkw h ILE 75 CO -0.12 0.33 0.02 0.58 0.00 0.00 0.00 178.15 178.96 1vkw h VAL 76 N 0.46 0.74 -0.19 1.67 2.07 -0.94 0.53 116.25 120.58 1vkw h VAL 76 Ca 0.10 -0.04 -0.09 0.00 0.82 0.00 0.00 66.70 67.49 1vkw h VAL 76 Cb 0.48 0.61 -0.01 0.00 -1.52 0.00 0.00 31.29 30.85 1vkw h VAL 76 CO 0.02 0.02 -0.27 -0.07 0.02 0.00 0.00 177.57 177.29 1vkw h LEU 77 N 0.12 0.37 -0.28 2.57 3.38 -1.05 0.11 115.31 120.53 1vkw h LEU 77 Ca 0.18 -0.12 -0.03 0.00 0.09 0.00 0.00 57.88 58.00 1vkw h LEU 77 Cb 0.24 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 40.88 1vkw h LEU 77 CO -0.29 0.64 0.07 0.15 0.09 0.00 0.00 178.44 179.09 1vkw h PHE 78 N 0.33 0.47 -0.72 1.13 3.57 -0.78 -2.20 116.94 118.73 1vkw h PHE 78 Ca 0.05 -0.06 -0.05 0.00 3.53 0.00 0.00 57.97 61.44 1vkw h PHE 78 Cb 0.65 -0.13 -0.03 0.00 2.79 0.00 0.00 35.95 39.22 1vkw h PHE 78 CO 0.02 0.52 0.24 -0.07 -2.23 0.00 0.00 178.31 176.78 1vkw h LEU 79 N 0.28 1.03 -0.30 0.59 3.38 -0.38 -1.76 115.31 118.16 1vkw h LEU 79 Ca 0.09 -0.18 0.05 0.00 0.09 0.00 0.00 57.88 57.92 1vkw h LEU 79 Cb 0.29 -0.27 -0.05 0.00 0.09 0.00 0.00 40.66 40.72 1vkw h LEU 79 CO 0.00 0.95 0.01 0.74 0.09 0.00 0.00 178.44 180.23 1vkw h THR 80 N 1.07 0.80 0.00 0.22 2.02 -0.74 -0.35 112.91 115.93 1vkw h THR 80 Ca 0.24 -0.03 -0.03 0.00 0.77 0.00 0.00 66.41 67.35 1vkw h THR 80 Cb 0.28 0.69 -0.00 0.00 -1.74 0.00 0.00 68.15 67.37 1vkw h THR 80 CO -0.01 0.02 -0.13 0.00 0.37 0.00 0.00 175.52 175.77 1vkw h ALA 81 N 1.25 1.71 -0.00 6.16 0.00 -0.96 0.65 119.26 128.07 1vkw h ALA 81 Ca 0.14 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.93 1vkw h ALA 81 Cb 0.18 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.95 1vkw h ALA 81 CO -0.23 0.16 -0.00 1.04 0.00 0.00 0.00 179.25 180.22 1vkw n GLN 82 N -4.28 0.43 0.00 0.00 1.13 -0.70 -4.91 117.38 109.04 1vkw n GLN 82 Ca -0.03 -0.00 0.00 0.00 -1.94 0.00 0.00 57.00 55.03 1vkw n GLN 82 Cb 0.20 -1.50 0.00 0.00 0.11 0.00 0.00 30.24 29.05 1vkw n GLN 82 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1vkw n GLY 83 N 1.29 1.00 3.83 1.08 0.00 0.22 -5.08 105.19 107.52 1vkw n GLY 83 Ca 0.14 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.78 1vkw n GLY 83 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1vkw s PHE 84 N -2.00 3.73 0.49 1.61 0.08 -0.20 -4.68 117.98 117.01 1vkw s PHE 84 Ca 0.00 1.04 -0.20 0.00 0.12 0.00 0.00 56.93 57.88 1vkw s PHE 84 Cb 0.00 -2.34 -0.08 0.00 -0.57 0.00 0.00 43.02 40.03 1vkw s PHE 84 CO 0.00 0.61 1.04 0.20 -0.10 0.00 0.00 175.22 176.97 1vkw s GLY 85 N -0.99 2.52 0.12 4.36 0.00 0.55 -3.84 107.32 110.03 1vkw s GLY 85 Ca 0.25 0.62 0.01 0.00 0.00 0.00 0.00 44.72 45.60 1vkw s GLY 85 CO 0.14 0.94 -0.03 -0.51 0.00 0.00 0.00 173.10 173.65 1vkw s THR 86 N -1.97 0.53 -0.24 0.90 -4.23 -1.26 -1.48 115.64 107.90 1vkw s THR 86 Ca 0.68 -1.92 -0.13 0.00 -1.18 0.00 0.00 61.69 59.13 1vkw s THR 86 Cb -0.17 -1.83 0.07 0.00 1.34 0.00 0.00 72.50 71.92 1vkw s THR 86 CO 0.20 -0.73 0.59 0.00 -0.54 0.00 0.00 174.62 174.14 1vkw s TRP 88 N 1.62 2.29 -0.38 0.00 0.52 -1.26 -1.56 118.94 120.17 1vkw s TRP 88 Ca -0.10 0.80 0.12 0.00 0.02 0.00 0.00 56.10 56.94 1vkw s TRP 88 Cb -0.06 -3.44 0.39 0.00 -1.15 0.00 0.00 33.47 29.20 1vkw s TRP 88 CO -0.17 -2.51 1.00 0.00 0.02 0.00 0.00 176.95 175.28 1vkw n ALA 90 N -3.85 1.73 -1.35 0.98 0.00 -1.26 -4.95 120.51 111.80 1vkw n ALA 90 Ca 0.07 -2.52 0.00 0.00 0.00 0.00 0.00 53.44 51.00 1vkw n ALA 90 Cb 0.59 -0.99 0.00 0.00 0.00 0.00 0.00 19.45 19.05 1vkw n ALA 90 CO 0.00 0.00 0.00 2.89 0.00 0.00 0.00 177.50 180.39 1vkw n ARG 91 N 0.02 0.00 -1.80 0.00 1.85 -1.26 -4.99 116.66 110.49 1vkw n ARG 91 Ca 0.11 0.00 0.00 0.00 -1.00 0.00 0.00 57.85 56.96 1vkw n ARG 91 Cb 0.75 0.00 0.00 0.00 -1.05 0.00 0.00 32.46 32.16 1vkw n ARG 91 CO 0.00 0.00 0.00 0.43 -0.01 0.00 0.00 177.63 178.05 1vkw n SER 92 N -0.84 -8.28 0.11 2.89 7.64 -1.26 -4.88 113.62 109.00 1vkw n SER 92 Ca 0.00 1.20 0.13 0.00 1.01 0.00 0.00 58.87 61.21 1vkw n SER 92 Cb 0.00 -4.49 0.32 0.00 -1.01 0.00 0.00 64.21 59.03 1vkw n SER 92 CO 0.00 0.00 0.00 1.55 -3.01 0.00 0.00 175.04 173.58 1vkw h PRO 93 N 3.41 0.00 -5.49 1.43 0.13 -2.01 -3.44 132.00 126.04 1vkw h PRO 93 Ca 0.00 0.00 -0.62 0.00 -0.87 0.00 0.00 66.00 64.51 1vkw h PRO 93 Cb 0.00 0.00 -0.09 0.00 0.13 0.00 0.00 31.00 31.04 1vkw h PRO 93 CO 0.00 0.00 -0.44 -1.01 -0.23 0.00 0.00 178.00 176.32 1vkw s HIS 94 N -3.13 3.51 -2.00 1.56 3.76 -1.26 -5.01 115.29 112.71 1vkw s HIS 94 Ca 0.09 0.49 0.02 0.00 -0.15 0.00 0.00 55.06 55.51 1vkw s HIS 94 Cb 0.12 -2.13 0.13 0.00 1.11 0.00 0.00 32.58 31.81 1vkw s HIS 94 CO 0.64 0.46 1.07 -0.35 -0.85 0.00 0.00 174.74 175.71 1vkw n PRO 95 N 2.88 0.99 -0.29 8.40 -0.04 -1.26 -3.08 135.00 142.61 1vkw n PRO 95 Ca -0.16 0.00 0.08 0.00 -0.04 0.00 0.00 63.50 63.38 1vkw n PRO 95 Cb 0.53 -1.03 0.15 0.00 -0.04 0.00 0.00 33.50 33.11 1vkw n PRO 95 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 1vkw n ASP 96 N -0.53 2.01 -4.20 3.54 9.92 -1.26 -4.99 116.55 121.04 1vkw n ASP 96 Ca 0.02 -3.26 -0.34 0.00 -0.53 0.00 0.00 54.79 50.68 1vkw n ASP 96 Cb 0.01 -0.45 -0.15 0.00 -0.64 0.00 0.00 41.12 39.89 1vkw n ASP 96 CO 0.00 0.00 0.00 -0.69 0.13 0.00 0.00 177.20 176.64 1vkw s VAL 97 N -2.77 2.60 0.05 2.53 1.01 -1.18 -2.24 120.40 120.40 1vkw s VAL 97 Ca 0.32 -0.76 -0.21 0.00 0.00 0.00 0.00 61.98 61.33 1vkw s VAL 97 Cb 0.30 -2.14 -0.13 0.00 0.00 0.00 0.00 36.38 34.41 1vkw s VAL 97 CO -0.01 0.49 1.45 -0.65 0.00 0.00 0.00 175.10 176.39 1vkw h PRO 98 N 7.99 0.26 -3.67 2.72 0.11 -1.88 -3.45 132.00 134.08 1vkw h PRO 98 Ca -0.44 -0.09 -0.13 0.00 0.11 0.00 0.00 66.00 65.45 1vkw h PRO 98 Cb 1.15 -0.02 -0.18 0.00 0.11 0.00 0.00 31.00 32.06 1vkw h PRO 98 CO 0.62 0.53 -0.48 0.71 -0.21 0.00 0.00 178.00 179.18 1vkw s TYR 99 N -4.82 0.13 0.24 0.65 2.02 -1.26 -4.61 117.35 109.70 1vkw s TYR 99 Ca -0.14 -0.36 0.06 0.00 -0.37 0.00 0.00 57.07 56.26 1vkw s TYR 99 Cb 0.05 -0.09 -0.03 0.00 -0.40 0.00 0.00 41.96 41.49 1vkw s TYR 99 CO 0.72 -0.37 0.29 0.96 -1.57 0.00 0.00 175.55 175.58 1vkw s ILE 100 N -2.33 4.92 -0.34 2.71 -4.36 -1.26 -4.67 121.20 115.87 1vkw s ILE 100 Ca -0.07 -1.15 0.01 0.00 -0.26 0.00 0.00 60.65 59.17 1vkw s ILE 100 Cb -0.03 -3.67 0.09 0.00 1.25 0.00 0.00 42.46 40.11 1vkw s ILE 100 CO -0.03 -0.33 0.07 -0.63 0.24 0.00 0.00 174.94 174.26 1vkw s ILE 101 N -2.04 2.72 0.47 8.37 1.01 -0.11 -4.38 121.20 127.23 1vkw s ILE 101 Ca 0.33 -1.98 -0.18 0.00 0.00 0.00 0.00 60.65 58.82 1vkw s ILE 101 Cb -0.09 -2.82 -0.09 0.00 0.01 0.00 0.00 42.46 39.47 1vkw s ILE 101 CO 0.27 -0.46 0.96 0.68 0.00 0.00 0.00 174.94 176.39 1vkw s VAL 102 N 1.07 4.48 0.18 2.92 -7.23 -0.60 -0.87 120.40 120.34 1vkw s VAL 102 Ca 0.05 1.32 -0.17 0.00 -1.81 0.00 0.00 61.98 61.36 1vkw s VAL 102 Cb -0.20 -3.66 0.03 0.00 0.56 0.00 0.00 36.38 33.10 1vkw s VAL 102 CO -0.05 -0.51 0.49 0.72 -0.31 0.00 0.00 175.10 175.44 1vkw s PHE 103 N -2.41 -0.15 -4.52 2.82 -0.71 0.13 -1.73 117.98 111.42 1vkw s PHE 103 Ca 0.60 -0.18 0.00 0.00 -1.04 0.00 0.00 56.93 56.31 1vkw s PHE 103 Cb -0.10 0.35 0.00 0.00 -1.21 0.00 0.00 43.02 42.07 1vkw s PHE 103 CO 0.23 -0.85 0.00 0.41 -1.34 0.00 0.00 175.22 173.66 1vkw n GLY 104 N -0.31 -1.85 3.69 1.99 0.00 -0.55 -3.80 105.19 104.36 1vkw n GLY 104 Ca -0.12 -1.23 -0.41 0.00 0.00 0.00 0.00 46.02 44.26 1vkw n GLY 104 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1vkw s TYR 105 N -2.66 3.53 0.31 1.61 2.02 -1.26 0.20 117.35 121.10 1vkw s TYR 105 Ca 0.00 1.43 -0.30 0.00 -0.37 0.00 0.00 57.07 57.83 1vkw s TYR 105 Cb 0.00 -3.02 -0.11 0.00 -0.40 0.00 0.00 41.96 38.42 1vkw s TYR 105 CO 0.00 -0.10 1.59 -2.14 -1.57 0.00 0.00 175.55 173.33 1vkw s PRO 106 N 1.53 4.11 0.26 -1.71 0.02 -1.26 -0.87 135.00 137.07 1vkw s PRO 106 Ca 0.43 2.60 0.04 0.00 0.02 0.00 0.00 61.00 64.09 1vkw s PRO 106 Cb -0.18 -3.01 0.34 0.00 0.02 0.00 0.00 34.50 31.67 1vkw s PRO 106 CO 0.18 -0.64 1.64 -0.09 -0.33 0.00 0.00 177.00 177.77 1vkw h ARG 107 N 4.62 0.34 -6.74 5.54 2.43 -1.77 -3.44 114.38 115.37 1vkw h ARG 107 Ca -0.48 -0.18 -0.67 0.00 -0.81 0.00 0.00 59.98 57.85 1vkw h ARG 107 Cb 1.22 0.01 -0.19 0.00 -0.42 0.00 0.00 29.97 30.58 1vkw h ARG 107 CO 0.78 0.72 -0.82 0.99 -1.51 0.00 0.00 179.97 180.13 1vkw s THR 108 N -4.10 2.57 -0.20 0.20 2.01 -1.26 -5.06 115.64 109.80 1vkw s THR 108 Ca -0.05 -1.72 -0.16 0.00 0.31 0.00 0.00 61.69 60.06 1vkw s THR 108 Cb 0.13 -2.19 -0.20 0.00 0.01 0.00 0.00 72.50 70.25 1vkw s THR 108 CO 0.79 0.03 0.15 -2.11 -0.69 0.00 0.00 174.62 172.79 1vkw n ARG 109 N 0.65 0.62 -1.59 4.92 0.00 -1.26 -5.00 116.66 114.99 1vkw n ARG 109 Ca -0.15 0.44 -0.31 0.00 -0.00 0.00 0.00 57.85 57.83 1vkw n ARG 109 Cb 0.54 -1.69 0.05 0.00 -0.00 0.00 0.00 32.46 31.36 1vkw n ARG 109 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.63 176.83 1vkw s ASN 110 N -6.98 5.31 0.39 2.89 -0.87 -1.26 -5.06 114.94 109.37 1vkw s ASN 110 Ca -0.29 1.55 -0.15 0.00 -1.57 0.00 0.00 52.86 52.40 1vkw s ASN 110 Cb 0.07 -2.42 0.06 0.00 -0.02 0.00 0.00 41.25 38.94 1vkw s ASN 110 CO 0.62 -1.48 0.80 -0.36 -2.57 0.00 0.00 177.10 174.11 1vkw s PHE 111 N -3.07 0.14 0.06 2.20 2.99 -1.26 -5.17 117.98 113.86 1vkw s PHE 111 Ca 0.58 -0.83 0.03 0.00 0.00 0.00 0.00 56.93 56.71 1vkw s PHE 111 Cb -0.14 0.85 -0.03 0.00 0.00 0.00 0.00 43.02 43.71 1vkw s PHE 111 CO 0.55 -1.60 -0.10 0.95 -0.00 0.00 0.00 175.22 175.02 1vkw s THR 112 N -2.20 0.76 -0.16 0.64 -4.23 -1.26 -5.14 115.64 104.05 1vkw s THR 112 Ca 0.16 -1.21 -0.02 0.00 -1.18 0.00 0.00 61.69 59.44 1vkw s THR 112 Cb -0.05 -0.83 0.05 0.00 1.34 0.00 0.00 72.50 73.00 1vkw s THR 112 CO 0.12 -0.35 0.00 -0.60 -0.54 0.00 0.00 174.62 173.25 1vkw s ARG 113 N -1.76 0.86 -0.23 3.99 3.52 -1.26 -5.02 118.95 119.05 1vkw s ARG 113 Ca -0.06 -0.33 -0.06 0.00 -0.13 0.00 0.00 55.73 55.15 1vkw s ARG 113 Cb -0.09 -1.82 -0.03 0.00 -1.56 0.00 0.00 34.95 31.45 1vkw s ARG 113 CO 0.01 -0.51 0.04 0.15 -0.81 0.00 0.00 175.30 174.18 1vkw s LYS 114 N 1.82 3.66 0.01 5.12 1.02 -1.26 -5.08 119.74 125.03 1vkw s LYS 114 Ca 0.01 -0.49 -0.01 0.00 0.02 0.00 0.00 55.97 55.50 1vkw s LYS 114 Cb -0.15 -3.22 -0.01 0.00 -0.52 0.00 0.00 37.83 33.92 1vkw s LYS 114 CO -0.07 -0.08 0.01 1.03 -0.92 0.00 0.00 175.35 175.31 1vkw s ARG 115 N 1.30 0.30 0.79 1.68 1.81 -1.26 -5.11 118.95 118.45 1vkw s ARG 115 Ca 0.04 -0.47 -0.11 0.00 -1.72 0.00 0.00 55.73 53.48 1vkw s ARG 115 Cb -0.15 0.11 0.07 0.00 -0.45 0.00 0.00 34.95 34.53 1vkw s ARG 115 CO 0.02 -0.05 1.10 1.03 -0.68 0.00 0.00 175.30 176.72 1vkw s ARG 116 N -1.22 2.11 0.45 3.54 0.52 -1.26 -4.96 118.95 118.13 1vkw s ARG 116 Ca -0.13 1.22 -0.25 0.00 -0.52 0.00 0.00 55.73 56.05 1vkw s ARG 116 Cb -0.08 -1.88 -0.09 0.00 0.52 0.00 0.00 34.95 33.43 1vkw s ARG 116 CO -0.00 -1.77 1.40 -2.30 0.02 0.00 0.00 175.30 172.65 1vkw n PRO 117 N -3.59 2.19 -0.24 3.54 -0.02 -1.26 -4.89 135.00 130.74 1vkw n PRO 117 Ca 0.09 0.78 0.11 0.00 -2.02 0.00 0.00 63.50 62.47 1vkw n PRO 117 Cb 0.53 -2.59 0.38 0.00 -0.02 0.00 0.00 33.50 31.80 1vkw n PRO 117 CO 0.00 0.00 0.00 0.97 1.98 0.00 0.00 175.50 178.45 1vkw h ILE 118 N 2.25 0.88 0.00 4.25 2.10 -2.00 0.89 117.51 125.87 1vkw h ILE 118 Ca -0.50 -0.23 -0.01 0.00 1.08 0.00 0.00 64.86 65.20 1vkw h ILE 118 Cb 1.27 0.13 -0.00 0.00 -1.09 0.00 0.00 36.82 37.14 1vkw h ILE 118 CO 0.61 0.12 -0.03 0.71 -1.08 0.00 0.00 178.15 178.49 1vkw h THR 119 N 0.68 0.11 0.00 2.19 1.35 -1.91 -1.68 112.91 113.66 1vkw h THR 119 Ca 0.41 -0.34 0.00 0.00 -0.55 0.00 0.00 66.41 65.93 1vkw h THR 119 Cb 0.62 1.30 0.00 0.00 -1.73 0.00 0.00 68.15 68.35 1vkw h THR 119 CO -0.17 0.03 0.00 0.77 -0.25 0.00 0.00 175.52 175.89 1vkw h SER 120 N 0.00 0.00 0.40 5.36 4.64 -1.16 -3.16 113.55 119.63 1vkw h SER 120 Ca -0.00 0.00 -0.23 0.00 -0.47 0.00 0.00 61.79 61.09 1vkw h SER 120 Cb 0.30 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 62.35 1vkw h SER 120 CO 0.00 0.00 -1.79 0.49 -0.87 0.00 0.00 176.83 174.67 1vkw n PHE 121 N -2.85 0.63 -3.52 4.77 3.72 -0.65 -4.97 117.46 114.59 1vkw n PHE 121 Ca 0.02 0.22 -0.37 0.00 -0.05 0.00 0.00 57.45 57.27 1vkw n PHE 121 Cb 0.37 -1.02 -0.08 0.00 -0.94 0.00 0.00 39.48 37.81 1vkw n PHE 121 CO 0.00 0.00 0.00 -1.17 -0.05 0.00 0.00 176.76 175.54 1vkw s LEU 122 N -5.63 4.18 0.25 4.37 2.96 -1.11 -0.62 118.68 123.07 1vkw s LEU 122 Ca -0.06 0.40 0.07 0.00 -0.22 0.00 0.00 54.13 54.32 1vkw s LEU 122 Cb 0.08 -2.34 0.28 0.00 0.50 0.00 0.00 46.19 44.71 1vkw s LEU 122 CO 0.83 0.03 1.57 -0.33 -1.32 0.00 0.00 176.35 177.13 1vkw h GLU 123 N 7.13 0.12 -7.25 1.98 5.08 -1.06 -3.45 114.58 117.13 1vkw h GLU 123 Ca -0.39 -0.09 -0.49 0.00 -1.00 0.00 0.00 59.36 57.40 1vkw h GLU 123 Cb 1.16 0.02 0.04 0.00 0.50 0.00 0.00 28.75 30.47 1vkw h GLU 123 CO 0.72 0.71 0.39 -0.80 -1.00 0.00 0.00 179.01 179.03 1vkw s ASN 124 N -6.87 6.36 0.22 1.42 -0.87 -1.26 -5.03 114.94 108.90 1vkw s ASN 124 Ca -0.03 1.56 -0.30 0.00 -1.57 0.00 0.00 52.86 52.52 1vkw s ASN 124 Cb 0.12 -2.50 -0.09 0.00 -0.02 0.00 0.00 41.25 38.76 1vkw s ASN 124 CO 0.78 -0.77 1.25 -1.81 -2.57 0.00 0.00 177.10 173.98 1vkw s ASP 125 N -3.38 6.98 0.55 -1.22 1.01 -1.26 -4.89 116.67 114.46 1vkw s ASP 125 Ca 0.58 2.37 0.25 0.00 0.71 0.00 0.00 52.55 56.46 1vkw s ASP 125 Cb -0.11 -2.62 1.45 0.00 1.01 0.00 0.00 42.92 42.65 1vkw s ASP 125 CO 0.39 -0.43 2.04 0.25 0.21 0.00 0.00 175.17 177.63 1vkw h LEU 126 N 4.92 0.00 -1.34 1.23 5.85 -1.96 0.21 115.31 124.23 1vkw h LEU 126 Ca -0.45 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.27 1vkw h LEU 126 Cb 1.22 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.25 1vkw h LEU 126 CO 0.74 0.00 0.00 -0.33 -0.34 0.00 0.00 178.44 178.51 1vkw h GLU 127 N 0.00 0.00 0.00 1.25 3.07 -2.02 -2.72 114.58 114.16 1vkw h GLU 127 Ca 0.17 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.03 1vkw h GLU 127 Cb 0.74 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.65 1vkw h GLU 127 CO -0.00 0.00 0.00 0.39 -1.40 0.00 0.00 179.01 178.00 1vkw n GLU 128 N -3.06 0.87 -3.63 2.33 1.02 0.75 -4.81 120.64 114.12 1vkw n GLU 128 Ca 0.01 0.00 -0.36 0.00 -0.02 0.00 0.00 57.16 56.79 1vkw n GLU 128 Cb 0.32 -1.50 -0.08 0.00 -0.02 0.00 0.00 31.44 30.15 1vkw n GLU 128 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 1vkw s LEU 129 N -2.12 4.17 0.80 -4.62 1.02 -1.03 -5.03 118.68 111.87 1vkw s LEU 129 Ca 0.43 0.27 -0.11 0.00 0.02 0.00 0.00 54.13 54.74 1vkw s LEU 129 Cb 0.21 -2.20 0.07 0.00 0.02 0.00 0.00 46.19 44.30 1vkw s LEU 129 CO 0.39 0.09 1.12 -2.16 0.02 0.00 0.00 176.35 175.80 1vkw s PRO 130 N 0.76 1.96 0.41 1.29 0.05 -1.26 -4.75 135.00 133.47 1vkw s PRO 130 Ca 0.11 1.33 0.14 0.00 0.05 0.00 0.00 61.00 62.63 1vkw s PRO 130 Cb -0.13 -1.85 0.98 0.00 0.05 0.00 0.00 34.50 33.56 1vkw s PRO 130 CO 0.03 -1.89 1.91 -1.35 0.05 0.00 0.00 177.00 175.75 1vkw h PRO 131 N -1.17 0.48 -0.53 0.56 0.11 -1.98 -0.57 132.00 128.91 1vkw h PRO 131 Ca -0.44 -0.03 -0.05 0.00 0.11 0.00 0.00 66.00 65.59 1vkw h PRO 131 Cb 1.25 -0.11 -0.02 0.00 0.11 0.00 0.00 31.00 32.22 1vkw h PRO 131 CO 0.49 0.32 0.13 0.93 -0.21 0.00 0.00 178.00 179.66 1vkw h GLU 132 N 0.49 0.81 0.06 1.05 3.07 -2.00 -2.63 114.58 115.43 1vkw h GLU 132 Ca 0.39 -0.16 -0.27 0.00 -0.50 0.00 0.00 59.36 58.82 1vkw h GLU 132 Cb 0.81 -0.12 0.02 0.00 -0.84 0.00 0.00 28.75 28.61 1vkw h GLU 132 CO -0.14 0.72 -1.13 0.82 -1.40 0.00 0.00 179.01 177.88 1vkw h ILE 133 N 0.78 1.32 -0.53 3.13 1.08 -1.46 -2.15 117.51 119.69 1vkw h ILE 133 Ca 0.17 -2.45 0.10 0.00 -0.39 0.00 0.00 64.86 62.29 1vkw h ILE 133 Cb 0.28 2.57 -0.08 0.00 -3.07 0.00 0.00 36.82 36.52 1vkw h ILE 133 CO -0.00 0.74 0.04 0.58 -0.69 0.00 0.00 178.15 178.82 1vkw h VAL 134 N 0.28 0.63 -0.30 1.67 2.07 -1.35 0.13 116.25 119.38 1vkw h VAL 134 Ca -0.15 -0.06 -0.00 0.00 0.82 0.00 0.00 66.70 67.32 1vkw h VAL 134 Cb 1.79 0.45 -0.01 0.00 -1.52 0.00 0.00 31.29 31.99 1vkw h VAL 134 CO 0.21 0.03 0.18 0.50 0.02 0.00 0.00 177.57 178.51 1vkw h LYS 135 N 0.16 0.41 -0.68 1.57 3.64 -1.26 -0.87 116.57 119.55 1vkw h LYS 135 Ca 0.27 -0.04 -0.01 0.00 -1.27 0.00 0.00 60.65 59.60 1vkw h LYS 135 Cb 0.40 -0.08 -0.03 0.00 -0.41 0.00 0.00 32.23 32.10 1vkw h LYS 135 CO -0.41 0.32 0.39 0.82 -2.27 0.00 0.00 179.45 178.30 1vkw h ILE 136 N 0.38 1.21 -0.50 2.00 2.04 -0.85 -2.89 117.51 118.90 1vkw h ILE 136 Ca 0.11 -0.50 -0.05 0.00 1.00 0.00 0.00 64.86 65.43 1vkw h ILE 136 Cb 0.02 0.30 -0.02 0.00 -0.74 0.00 0.00 36.82 36.38 1vkw h ILE 136 CO -0.02 0.22 0.13 0.58 0.00 0.00 0.00 178.15 179.06 1vkw h VAL 137 N 0.93 1.24 0.00 1.67 2.07 -0.68 -0.42 116.25 121.05 1vkw h VAL 137 Ca 0.24 -0.83 0.00 0.00 0.82 0.00 0.00 66.70 66.94 1vkw h VAL 137 Cb 0.01 0.82 0.00 0.00 -1.52 0.00 0.00 31.29 30.61 1vkw h VAL 137 CO -0.04 0.30 0.00 -0.62 0.02 0.00 0.00 177.57 177.23 1vkw n GLU 138 N -4.47 0.00 0.00 1.57 1.02 -0.36 -1.34 120.64 117.06 1vkw n GLU 138 Ca 0.01 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.15 1vkw n GLU 138 Cb 0.22 -1.08 0.00 0.00 -0.02 0.00 0.00 31.44 30.55 1vkw n GLU 138 CO 0.00 0.00 0.00 2.41 1.18 0.00 0.00 177.13 180.72 1vkw n THR 140 N 0.59 0.00 0.26 2.62 -1.04 -0.17 -2.96 114.28 113.58 1vkw n THR 140 Ca 0.00 0.00 0.11 0.00 -2.04 0.00 0.00 64.05 62.12 1vkw n THR 140 Cb 0.00 0.00 0.70 0.00 -1.82 0.00 0.00 70.33 69.21 1vkw n THR 140 CO 0.00 0.00 0.00 0.40 -0.64 0.00 0.00 175.07 174.83 1vkw h ILE 141 N 0.00 0.71 0.00 12.58 1.08 -1.48 -1.67 117.51 128.73 1vkw h ILE 141 Ca 0.00 -0.47 0.00 0.00 -0.39 0.00 0.00 64.86 64.00 1vkw h ILE 141 Cb 0.00 1.29 0.00 0.00 -3.07 0.00 0.00 36.82 35.04 1vkw h ILE 141 CO 0.00 0.12 0.00 0.18 -0.69 0.00 0.00 178.15 177.76 1vkw n LEU 142 N -3.85 0.00 -4.73 1.44 4.77 -1.15 -4.85 117.00 108.62 1vkw n LEU 142 Ca -0.02 0.12 -0.36 0.00 -0.03 0.00 0.00 56.01 55.71 1vkw n LEU 142 Cb 0.21 -0.12 0.07 0.00 -2.33 0.00 0.00 43.42 41.26 1vkw n LEU 142 CO 0.31 -0.03 0.88 0.00 -1.33 0.00 0.00 177.39 177.23 1vkw s ALA 143 N -2.24 2.32 0.65 -1.18 0.00 -0.63 -5.00 121.76 115.68 1vkw s ALA 143 Ca 0.31 1.15 -0.11 0.00 0.00 0.00 0.00 51.96 53.30 1vkw s ALA 143 Cb 0.16 -3.54 -0.02 0.00 0.00 0.00 0.00 23.12 19.72 1vkw s ALA 143 CO 0.31 -1.65 1.04 -1.25 0.00 0.00 0.00 175.76 174.22 1vkw s PRO 144 N -3.48 3.37 -0.04 0.00 0.04 -1.26 -5.02 135.00 128.60 1vkw s PRO 144 Ca 0.81 0.79 -0.17 0.00 0.04 0.00 0.00 61.00 62.48 1vkw s PRO 144 Cb -0.36 -2.05 0.03 0.00 0.04 0.00 0.00 34.50 32.16 1vkw s PRO 144 CO 0.40 -0.75 0.37 -1.54 0.04 0.00 0.00 177.00 175.53 1vkw s SER 145 N -4.08 -0.29 -0.18 6.66 1.04 -1.26 -4.78 113.70 110.81 1vkw s SER 145 Ca 0.56 0.30 -0.40 0.00 0.48 0.00 0.00 55.95 56.90 1vkw s SER 145 Cb -0.12 0.44 -0.17 0.00 0.10 0.00 0.00 66.02 66.27 1vkw s SER 145 CO 0.54 -0.41 1.57 0.00 0.98 0.00 0.00 173.24 175.92 1vkw n ALA 146 N 1.53 -0.78 -1.87 5.32 0.00 -1.26 -0.95 120.51 122.51 1vkw n ALA 146 Ca -0.20 0.45 -0.17 0.00 0.00 0.00 0.00 53.44 53.53 1vkw n ALA 146 Cb 0.56 -2.12 -0.05 0.00 0.00 0.00 0.00 19.45 17.85 1vkw n ALA 146 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1vkw n LEU 147 N 4.14 -1.36 -3.20 0.00 4.77 -1.26 -2.27 117.00 117.82 1vkw n LEU 147 Ca 0.24 0.28 -0.21 0.00 -0.03 0.00 0.00 56.01 56.29 1vkw n LEU 147 Cb 0.12 -2.46 -0.00 0.00 -2.33 0.00 0.00 43.42 38.75 1vkw n LEU 147 CO 0.75 -0.59 -0.05 -3.20 -1.33 0.00 0.00 177.39 172.97 1vkw n ASN 148 N -1.32 -3.73 0.14 -1.43 5.15 -0.12 -4.87 115.26 109.07 1vkw n ASN 148 Ca -0.18 -0.28 0.13 0.00 -0.60 0.00 0.00 54.58 53.65 1vkw n ASN 148 Cb 0.59 -3.10 0.36 0.00 -0.53 0.00 0.00 39.78 37.10 1vkw n ASN 148 CO 0.00 0.00 0.00 0.08 1.40 0.00 0.00 177.26 178.74 1vkw h ARG 149 N -0.82 0.00 -5.89 1.20 0.11 -1.64 -3.48 114.38 103.86 1vkw h ARG 149 Ca -0.40 0.00 -0.36 0.00 0.10 0.00 0.00 59.98 59.32 1vkw h ARG 149 Cb 1.27 0.00 0.12 0.00 1.11 0.00 0.00 29.97 32.48 1vkw h ARG 149 CO 0.49 0.00 -0.88 1.04 0.10 0.00 0.00 179.97 180.72 1vkw n GLN 150 N -2.50 -2.64 -1.16 0.08 6.02 -1.26 -4.81 117.38 111.11 1vkw n GLN 150 Ca 0.05 0.66 -0.17 0.00 -0.01 0.00 0.00 57.00 57.53 1vkw n GLN 150 Cb 0.44 -5.04 -0.13 0.00 1.02 0.00 0.00 30.24 26.53 1vkw n GLN 150 CO 0.00 0.00 0.00 -0.35 -1.01 0.00 0.00 177.06 175.70 1vkw n PRO 151 N -3.86 2.11 -5.23 -1.09 -0.04 -1.26 -4.90 135.00 120.72 1vkw n PRO 151 Ca -0.14 -1.45 -0.31 0.00 -0.04 0.00 0.00 63.50 61.56 1vkw n PRO 151 Cb 0.62 -2.03 -0.16 0.00 -0.04 0.00 0.00 33.50 31.90 1vkw n PRO 151 CO 0.00 0.00 0.00 -1.58 -0.04 0.00 0.00 175.50 173.88 1vkw s TRP 152 N 0.02 2.41 -0.13 0.54 0.51 -1.26 -4.37 118.94 116.66 1vkw s TRP 152 Ca 0.63 -0.44 0.03 0.00 -2.12 0.00 0.00 56.10 54.20 1vkw s TRP 152 Cb 0.33 -1.54 0.01 0.00 -0.81 0.00 0.00 33.47 31.47 1vkw s TRP 152 CO -0.08 -0.03 -0.22 0.21 -0.51 0.00 0.00 176.95 176.33 1vkw s LYS 153 N -0.56 2.93 -0.05 4.98 2.20 -0.37 -4.73 119.74 124.13 1vkw s LYS 153 Ca 0.08 -0.83 0.06 0.00 -0.36 0.00 0.00 55.97 54.93 1vkw s LYS 153 Cb -0.11 -2.33 -0.01 0.00 -1.51 0.00 0.00 37.83 33.87 1vkw s LYS 153 CO -0.00 0.03 -0.25 0.42 -0.36 0.00 0.00 175.35 175.19 1vkw s ILE 154 N 0.71 2.05 -0.03 5.43 1.01 0.20 -0.82 121.20 129.76 1vkw s ILE 154 Ca -0.10 -1.07 0.01 0.00 0.00 0.00 0.00 60.65 59.48 1vkw s ILE 154 Cb -0.16 -1.73 0.02 0.00 0.01 0.00 0.00 42.46 40.61 1vkw s ILE 154 CO 0.01 0.57 -0.01 -0.75 0.00 0.00 0.00 174.94 174.76 1vkw s LYS 155 N -0.25 0.38 -0.19 2.79 2.20 0.18 -0.44 119.74 124.41 1vkw s LYS 155 Ca -0.01 0.03 -0.06 0.00 -0.36 0.00 0.00 55.97 55.57 1vkw s LYS 155 Cb -0.13 -0.51 -0.03 0.00 -1.51 0.00 0.00 37.83 35.64 1vkw s LYS 155 CO 0.03 -0.11 0.04 -0.47 -0.36 0.00 0.00 175.35 174.48 1vkw s TYR 156 N 0.89 3.16 -0.95 4.03 5.04 -1.26 0.08 117.35 128.33 1vkw s TYR 156 Ca -0.09 -0.12 0.09 0.00 -2.44 0.00 0.00 57.07 54.51 1vkw s TYR 156 Cb -0.13 -2.07 0.16 0.00 0.35 0.00 0.00 41.96 40.27 1vkw s TYR 156 CO -0.01 0.01 1.00 0.25 -1.34 0.00 0.00 175.55 175.45 1vkw n THR 157 N 3.79 0.49 0.00 4.34 -2.24 -0.36 -4.91 114.28 115.39 1vkw n THR 157 Ca -0.17 -0.75 0.00 0.00 -2.27 0.00 0.00 64.05 60.87 1vkw n THR 157 Cb 0.52 0.85 0.00 0.00 -2.10 0.00 0.00 70.33 69.60 1vkw n THR 157 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1vkw n GLY 158 N 0.43 2.05 0.16 3.38 0.00 -1.26 -4.71 105.19 105.24 1vkw n GLY 158 Ca 0.07 -0.69 0.08 0.00 0.00 0.00 0.00 46.02 45.48 1vkw n GLY 158 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1vkw h GLY 159 N 0.00 0.00 -3.85 -0.02 0.00 -1.96 -3.49 103.07 93.76 1vkw h GLY 159 Ca 0.00 0.00 -0.18 0.00 0.00 0.00 0.00 47.33 47.15 1vkw h GLY 159 CO 0.00 0.00 -0.70 -0.54 0.00 0.00 0.00 176.54 175.30 1vkw s GLU 160 N -3.14 0.57 -0.17 4.80 2.02 -1.26 -2.44 118.70 119.08 1vkw s GLU 160 Ca 0.04 -1.03 0.01 0.00 0.02 0.00 0.00 54.97 54.02 1vkw s GLU 160 Cb 0.07 0.03 0.02 0.00 0.10 0.00 0.00 34.13 34.35 1vkw s GLU 160 CO 0.73 -0.05 -0.20 -1.17 0.02 0.00 0.00 175.26 174.58 1vkw s LEU 161 N -2.39 2.09 -0.12 1.80 2.96 -0.75 -1.22 118.68 121.06 1vkw s LEU 161 Ca -0.00 -0.62 -0.01 0.00 -0.22 0.00 0.00 54.13 53.28 1vkw s LEU 161 Cb 0.00 -1.45 -0.02 0.00 0.50 0.00 0.00 46.19 45.23 1vkw s LEU 161 CO -0.05 0.02 -0.10 0.00 -1.32 0.00 0.00 176.35 174.90 1vkw s ILE 163 N 0.08 2.21 -0.01 0.00 1.01 -0.49 -0.64 121.20 123.36 1vkw s ILE 163 Ca -0.03 -0.92 0.06 0.00 0.00 0.00 0.00 60.65 59.75 1vkw s ILE 163 Cb -0.14 -1.90 -0.03 0.00 0.01 0.00 0.00 42.46 40.40 1vkw s ILE 163 CO 0.04 0.54 -0.19 -0.44 0.00 0.00 0.00 174.94 174.89 1vkw s SER 164 N 0.84 3.69 -0.07 3.58 0.01 0.00 -1.37 113.70 120.38 1vkw s SER 164 Ca -0.06 -0.34 -0.29 0.00 1.31 0.00 0.00 55.95 56.56 1vkw s SER 164 Cb -0.15 -0.63 0.07 0.00 0.21 0.00 0.00 66.02 65.51 1vkw s SER 164 CO -0.02 0.31 0.66 -0.55 0.41 0.00 0.00 173.24 174.05 1vkw s SER 165 N -0.93 -0.63 0.00 2.44 0.15 -0.60 -1.24 113.70 112.88 1vkw s SER 165 Ca 0.12 0.73 0.30 0.00 0.70 0.00 0.00 55.95 57.81 1vkw s SER 165 Cb -0.10 0.60 1.49 0.00 -1.71 0.00 0.00 66.02 66.30 1vkw s SER 165 CO 0.02 -0.57 2.04 -0.62 1.20 0.00 0.00 173.24 175.31 1vkw n GLU 166 N 1.09 0.41 -3.84 5.44 -0.58 -1.26 -4.66 120.64 117.23 1vkw n GLU 166 Ca -0.19 -0.01 -0.34 0.00 -0.42 0.00 0.00 57.16 56.20 1vkw n GLU 166 Cb 0.57 -1.50 -0.12 0.00 -0.57 0.00 0.00 31.44 29.82 1vkw n GLU 166 CO 0.00 0.00 0.00 1.03 -0.48 0.00 0.00 177.13 177.68 1vkw s ARG 167 N -2.60 2.04 0.27 3.49 1.81 -1.26 -5.00 118.95 117.71 1vkw s ARG 167 Ca 0.28 -2.17 -0.03 0.00 -1.72 0.00 0.00 55.73 52.09 1vkw s ARG 167 Cb 0.20 -3.50 0.34 0.00 -0.45 0.00 0.00 34.95 31.54 1vkw s ARG 167 CO 0.47 -1.08 1.87 -1.00 -0.68 0.00 0.00 175.30 174.87 1vkw h PRO 168 N 7.41 1.04 -0.02 3.54 0.13 -1.88 0.65 132.00 142.87 1vkw h PRO 168 Ca -0.07 -0.14 -0.00 0.00 -0.87 0.00 0.00 66.00 64.91 1vkw h PRO 168 Cb 0.99 -0.19 -0.00 0.00 0.13 0.00 0.00 31.00 31.93 1vkw h PRO 168 CO 0.67 0.80 0.01 0.28 -0.23 0.00 0.00 178.00 179.53 1vkw h VAL 169 N 1.03 1.16 -0.91 1.56 2.07 -1.89 -0.61 116.25 118.67 1vkw h VAL 169 Ca 0.25 -0.48 0.03 0.00 0.82 0.00 0.00 66.70 67.32 1vkw h VAL 169 Cb 0.11 1.44 -0.05 0.00 -1.52 0.00 0.00 31.29 31.27 1vkw h VAL 169 CO -0.03 0.13 0.59 0.44 0.02 0.00 0.00 177.57 178.72 1vkw h ASP 170 N -0.16 1.00 -0.26 0.57 3.32 -1.79 -0.51 116.42 118.59 1vkw h ASP 170 Ca 0.01 -0.01 0.06 0.00 0.02 0.00 0.00 57.03 57.10 1vkw h ASP 170 Cb 0.20 -0.23 -0.05 0.00 0.22 0.00 0.00 39.33 39.46 1vkw h ASP 170 CO -0.00 0.70 -0.09 0.25 -1.72 0.00 0.00 179.24 178.37 1vkw h LEU 171 N 1.17 -0.33 -0.72 1.55 6.46 -0.56 -1.41 115.31 121.48 1vkw h LEU 171 Ca 0.35 0.09 -0.01 0.00 -0.12 0.00 0.00 57.88 58.20 1vkw h LEU 171 Cb -0.04 0.20 -0.03 0.00 -0.73 0.00 0.00 40.66 40.05 1vkw h LEU 171 CO -0.10 -0.12 0.43 1.23 -0.62 0.00 0.00 178.44 179.25 1vkw h GLY 172 N -0.05 1.05 0.79 3.75 0.00 -0.41 -0.05 103.07 108.16 1vkw h GLY 172 Ca 0.13 -0.45 0.00 0.00 0.00 0.00 0.00 47.33 47.02 1vkw h GLY 172 CO -0.29 0.43 -0.16 -2.22 0.00 0.00 0.00 176.54 174.30 1vkw h ILE 173 N 0.99 0.64 -0.84 2.60 2.04 -0.79 -1.23 117.51 120.92 1vkw h ILE 173 Ca 0.26 0.00 -0.03 0.00 1.00 0.00 0.00 64.86 66.09 1vkw h ILE 173 Cb -0.02 0.64 -0.04 0.00 -0.74 0.00 0.00 36.82 36.66 1vkw h ILE 173 CO -0.05 0.00 0.41 0.00 0.00 0.00 0.00 178.15 178.51 1vkw h ALA 174 N 0.45 1.12 -0.47 1.87 0.00 -1.08 -2.54 119.26 118.61 1vkw h ALA 174 Ca 0.01 -0.16 -0.03 0.00 0.00 0.00 0.00 54.91 54.73 1vkw h ALA 174 Cb 0.34 -0.33 -0.02 0.00 0.00 0.00 0.00 17.79 17.77 1vkw h ALA 174 CO -0.05 0.66 0.18 1.25 0.00 0.00 0.00 179.25 181.30 1vkw h LEU 175 N 1.20 0.61 -0.75 0.00 5.85 -0.76 -1.96 115.31 119.52 1vkw h LEU 175 Ca 0.29 -0.07 -0.00 0.00 0.84 0.00 0.00 57.88 58.94 1vkw h LEU 175 Cb 0.12 -0.16 -0.04 0.00 0.37 0.00 0.00 40.66 40.95 1vkw h LEU 175 CO -0.04 0.56 0.45 0.77 -0.34 0.00 0.00 178.44 179.85 1vkw h SER 176 N 0.67 0.90 -0.51 1.25 4.64 -0.80 0.67 113.55 120.37 1vkw h SER 176 Ca 0.16 -0.06 -0.03 0.00 -0.47 0.00 0.00 61.79 61.39 1vkw h SER 176 Cb 0.15 -0.23 -0.02 0.00 -0.31 0.00 0.00 62.40 61.99 1vkw h SER 176 CO -0.01 0.69 0.19 0.45 -0.87 0.00 0.00 176.83 177.28 1vkw h HIS 177 N 1.02 0.80 -0.31 4.77 3.86 -1.22 -0.64 115.15 123.42 1vkw h HIS 177 Ca 0.27 -0.07 -0.06 0.00 -1.16 0.00 0.00 60.37 59.35 1vkw h HIS 177 Cb -0.04 -0.23 -0.01 0.00 1.06 0.00 0.00 27.41 28.19 1vkw h HIS 177 CO -0.01 0.67 -0.04 0.00 0.86 0.00 0.00 177.93 179.41 1vkw h ALA 178 N 1.04 0.43 0.14 2.45 0.00 -1.14 -1.87 119.26 120.31 1vkw h ALA 178 Ca 0.17 -0.27 -0.00 0.00 0.00 0.00 0.00 54.91 54.81 1vkw h ALA 178 Cb 0.23 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.90 1vkw h ALA 178 CO -0.01 0.22 -0.11 -0.92 0.00 0.00 0.00 179.25 178.43 1vkw h TYR 179 N 0.36 -0.27 -0.53 0.00 3.20 -0.80 -1.03 116.97 117.90 1vkw h TYR 179 Ca 0.08 -0.00 -0.08 0.00 3.14 0.00 0.00 58.73 61.87 1vkw h TYR 179 Cb 0.51 0.10 -0.02 0.00 1.54 0.00 0.00 36.73 38.86 1vkw h TYR 179 CO 0.04 -0.17 0.01 -0.07 -1.64 0.00 0.00 178.16 176.34 1vkw h LEU 180 N -0.25 0.87 -0.13 2.82 3.38 -1.11 -1.08 115.31 119.80 1vkw h LEU 180 Ca -0.01 -0.22 -0.23 0.00 0.09 0.00 0.00 57.88 57.51 1vkw h LEU 180 Cb 0.23 -0.23 0.01 0.00 0.09 0.00 0.00 40.66 40.76 1vkw h LEU 180 CO -0.01 0.93 -0.87 0.71 0.09 0.00 0.00 178.44 179.29 1vkw h THR 181 N 0.83 1.30 -0.65 0.22 1.35 -1.32 -2.62 112.91 112.02 1vkw h THR 181 Ca 0.16 -2.11 -0.04 0.00 -0.55 0.00 0.00 66.41 63.87 1vkw h THR 181 Cb 0.48 2.15 -0.03 0.00 -1.73 0.00 0.00 68.15 69.03 1vkw h THR 181 CO 0.02 0.66 0.26 0.00 -0.25 0.00 0.00 175.52 176.21 1vkw h ALA 182 N 0.56 1.24 -0.39 6.62 0.00 -1.09 0.75 119.26 126.95 1vkw h ALA 182 Ca -0.08 -0.16 -0.01 0.00 0.00 0.00 0.00 54.91 54.66 1vkw h ALA 182 Cb 1.51 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 19.02 1vkw h ALA 182 CO 0.17 0.56 0.21 -0.09 0.00 0.00 0.00 179.25 180.10 1vkw h ARG 183 N 0.93 0.54 -0.14 0.00 2.43 -1.17 -0.59 114.38 116.38 1vkw h ARG 183 Ca 0.22 -0.07 -0.01 0.00 -0.81 0.00 0.00 59.98 59.32 1vkw h ARG 183 Cb 0.17 -0.10 -0.01 0.00 -0.42 0.00 0.00 29.97 29.61 1vkw h ARG 183 CO -0.02 0.45 0.06 1.49 -1.51 0.00 0.00 179.97 180.44 1vkw h GLU 184 N 0.49 0.21 -0.02 0.20 4.57 -1.13 -1.19 114.58 117.71 1vkw h GLU 184 Ca 0.14 -0.04 -0.00 0.00 -1.18 0.00 0.00 59.36 58.28 1vkw h GLU 184 Cb 0.07 -0.03 -0.00 0.00 -0.16 0.00 0.00 28.75 28.62 1vkw h GLU 184 CO -0.02 0.29 0.00 0.82 -1.18 0.00 0.00 179.01 178.92 1vkw h ILE 185 N 0.08 1.19 0.00 2.32 2.04 -0.69 -3.24 117.51 119.21 1vkw h ILE 185 Ca 0.05 -0.57 0.00 0.00 1.00 0.00 0.00 64.86 65.34 1vkw h ILE 185 Cb 0.15 1.55 0.00 0.00 -0.74 0.00 0.00 36.82 37.78 1vkw h ILE 185 CO -0.00 0.15 -0.59 0.49 0.00 0.00 0.00 178.15 178.20 1vkw n PHE 186 N -4.96 0.08 -2.63 1.37 3.72 -0.24 -4.93 117.46 109.87 1vkw n PHE 186 Ca -0.07 0.02 -0.18 0.00 -0.05 0.00 0.00 57.45 57.17 1vkw n PHE 186 Cb 0.14 -0.29 0.00 0.00 -0.94 0.00 0.00 39.48 38.39 1vkw n PHE 186 CO 0.00 0.00 0.00 1.63 -0.05 0.00 0.00 176.76 178.34 1vkw n LYS 187 N -1.60 -2.65 -4.24 -1.08 4.76 -0.45 -4.98 118.16 107.92 1vkw n LYS 187 Ca 0.05 0.79 -0.13 0.00 -2.87 0.00 0.00 58.31 56.15 1vkw n LYS 187 Cb 0.35 -5.47 -0.10 0.00 -1.84 0.00 0.00 35.03 27.97 1vkw n LYS 187 CO 0.00 0.00 0.00 1.03 -1.37 0.00 0.00 177.40 177.06 1vkw s ARG 188 N -5.26 1.06 -0.51 1.97 1.81 -1.22 -5.06 118.95 111.74 1vkw s ARG 188 Ca 0.10 -1.49 -0.28 0.00 -1.72 0.00 0.00 55.73 52.34 1vkw s ARG 188 Cb -0.05 -0.36 0.03 0.00 -0.45 0.00 0.00 34.95 34.12 1vkw s ARG 188 CO 0.12 -0.06 1.14 -2.00 -0.68 0.00 0.00 175.30 173.82 1vkw s GLU 189 N -3.86 3.64 0.64 3.54 2.56 -1.26 -4.29 118.70 119.66 1vkw s GLU 189 Ca 0.20 0.42 -0.18 0.00 0.00 0.00 0.00 54.97 55.41 1vkw s GLU 189 Cb 0.05 -3.95 -0.01 0.00 2.00 0.00 0.00 34.13 32.22 1vkw s GLU 189 CO 0.02 -1.47 1.23 -2.14 -0.56 0.00 0.00 175.26 172.33 1vkw s PRO 190 N 4.56 2.67 -0.16 4.30 0.02 -1.26 -4.61 135.00 140.51 1vkw s PRO 190 Ca 0.45 1.86 -0.06 0.00 0.02 0.00 0.00 61.00 63.27 1vkw s PRO 190 Cb -0.07 -1.89 -0.04 0.00 0.02 0.00 0.00 34.50 32.52 1vkw s PRO 190 CO 0.29 -1.45 0.05 0.08 -0.33 0.00 0.00 177.00 175.64 1vkw s VAL 191 N -1.65 4.69 -0.18 3.83 1.01 -0.84 -4.93 120.40 122.33 1vkw s VAL 191 Ca 0.78 -0.08 -0.06 0.00 0.00 0.00 0.00 61.98 62.62 1vkw s VAL 191 Cb -0.32 -3.09 -0.03 0.00 0.00 0.00 0.00 36.38 32.94 1vkw s VAL 191 CO 0.38 0.50 0.02 -0.63 0.00 0.00 0.00 175.10 175.37 1vkw s ILE 192 N 0.10 4.39 -0.03 2.22 1.01 -1.26 0.09 121.20 127.71 1vkw s ILE 192 Ca 0.04 -0.18 0.01 0.00 0.00 0.00 0.00 60.65 60.53 1vkw s ILE 192 Cb -0.12 -2.96 0.02 0.00 0.01 0.00 0.00 42.46 39.40 1vkw s ILE 192 CO 0.01 0.46 -0.04 -1.10 0.00 0.00 0.00 174.94 174.27 1vkw s GLN 193 N 0.48 0.68 0.21 2.79 -0.21 -0.10 -5.00 119.66 118.51 1vkw s GLN 193 Ca 0.00 -0.10 -0.30 0.00 0.02 0.00 0.00 55.36 54.99 1vkw s GLN 193 Cb -0.13 -0.71 -0.08 0.00 1.00 0.00 0.00 33.01 33.09 1vkw s GLN 193 CO 0.02 -0.05 1.14 0.21 -2.12 0.00 0.00 175.29 174.49 1vkw s LYS 194 N 0.72 4.56 -0.17 2.91 2.20 -1.26 -0.59 119.74 128.11 1vkw s LYS 194 Ca -0.09 1.81 -0.00 0.00 -0.36 0.00 0.00 55.97 57.33 1vkw s LYS 194 Cb -0.12 -3.24 0.04 0.00 -1.51 0.00 0.00 37.83 33.01 1vkw s LYS 194 CO -0.00 0.04 -0.05 1.03 -0.36 0.00 0.00 175.35 176.01 1vkw s ARG 195 N -0.62 1.46 5.03 4.03 1.81 0.24 -4.91 118.95 125.98 1vkw s ARG 195 Ca 0.49 -0.55 0.00 0.00 -1.72 0.00 0.00 55.73 53.95 1vkw s ARG 195 Cb -0.31 -2.06 0.00 0.00 -0.45 0.00 0.00 34.95 32.13 1vkw s ARG 195 CO 0.38 -0.44 0.00 0.41 -0.68 0.00 0.00 175.30 174.96 1vkw n GLY 196 N 4.86 1.94 0.10 -3.53 0.00 -1.26 -3.03 105.19 104.27 1vkw n GLY 196 Ca -0.12 -0.54 -0.13 0.00 0.00 0.00 0.00 46.02 45.22 1vkw n GLY 196 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1vkw h GLU 197 N 0.00 0.11 0.00 1.61 5.08 -2.01 -3.42 114.58 115.94 1vkw h GLU 197 Ca 0.00 -0.18 -0.16 0.00 -1.00 0.00 0.00 59.36 58.02 1vkw h GLU 197 Cb 0.00 0.07 -0.30 0.00 0.50 0.00 0.00 28.75 29.02 1vkw h GLU 197 CO 0.00 0.79 -0.81 -0.40 -1.00 0.00 0.00 179.01 177.59 1vkw n ASP 198 N -3.23 0.42 -4.08 1.42 5.75 -1.26 -5.04 116.55 110.53 1vkw n ASP 198 Ca -0.21 -1.98 -0.21 0.00 -0.01 0.00 0.00 54.79 52.38 1vkw n ASP 198 Cb 1.05 -0.13 -0.15 0.00 -1.03 0.00 0.00 41.12 40.85 1vkw n ASP 198 CO 0.00 0.00 0.00 -0.89 -0.11 0.00 0.00 177.20 176.20 1vkw s THR 199 N 0.00 0.98 -0.07 2.12 2.01 -1.17 -1.56 115.64 117.95 1vkw s THR 199 Ca 0.23 -0.55 0.03 0.00 0.31 0.00 0.00 61.69 61.71 1vkw s THR 199 Cb 0.27 -0.82 0.01 0.00 0.01 0.00 0.00 72.50 71.96 1vkw s THR 199 CO -0.12 0.26 -0.16 -0.31 -0.69 0.00 0.00 174.62 173.60 1vkw s TYR 200 N -0.32 1.80 0.00 4.92 1.51 -0.47 -0.59 117.35 124.20 1vkw s TYR 200 Ca 0.05 -0.65 0.03 0.00 -1.01 0.00 0.00 57.07 55.48 1vkw s TYR 200 Cb -0.05 -1.25 -0.03 0.00 -0.11 0.00 0.00 41.96 40.51 1vkw s TYR 200 CO -0.00 -0.28 -0.07 0.00 -1.11 0.00 0.00 175.55 174.09 1vkw s LEU 202 N -1.41 3.56 -0.46 0.00 2.96 0.48 -0.92 118.68 122.87 1vkw s LEU 202 Ca 0.17 -0.42 -0.29 0.00 -0.22 0.00 0.00 54.13 53.37 1vkw s LEU 202 Cb -0.11 -1.89 0.03 0.00 0.50 0.00 0.00 46.19 44.72 1vkw s LEU 202 CO 0.07 -0.10 1.13 -0.63 -1.32 0.00 0.00 176.35 175.51 1vkw s ILE 203 N 1.56 4.23 -0.00 6.68 1.01 0.11 -1.80 121.20 132.99 1vkw s ILE 203 Ca 0.05 1.26 -0.22 0.00 0.00 0.00 0.00 60.65 61.74 1vkw s ILE 203 Cb -0.16 -4.59 -0.19 0.00 0.01 0.00 0.00 42.46 37.53 1vkw s ILE 203 CO 0.03 -0.97 1.19 -0.07 0.00 0.00 0.00 174.94 175.12 1vkw h LEU 204 N 11.13 0.32 -5.95 2.97 3.38 -1.78 -2.23 115.31 123.14 1vkw h LEU 204 Ca -0.23 -0.63 -0.58 0.00 0.09 0.00 0.00 57.88 56.54 1vkw h LEU 204 Cb 1.06 -0.09 -0.41 0.00 0.09 0.00 0.00 40.66 41.31 1vkw h LEU 204 CO 1.12 0.89 -0.75 -3.20 0.09 0.00 0.00 178.44 176.59 1vkw n ASN 205 N -4.51 2.99 0.00 -0.43 5.15 -1.26 -4.48 115.26 112.71 1vkw n ASN 205 Ca -0.08 -3.32 0.14 0.00 -0.60 0.00 0.00 54.58 50.73 1vkw n ASN 205 Cb 0.45 -0.64 0.85 0.00 -0.53 0.00 0.00 39.78 39.91 1vkw n ASN 205 CO 0.00 0.00 0.00 -0.81 1.40 0.00 0.00 177.26 177.85