#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1v5k s SER 2 N 0.00 1.18 -0.11 1.61 0.01 -1.26 -5.12 113.70 110.02 1v5k s SER 2 Ca 0.00 -0.69 -0.30 0.00 1.31 0.00 0.00 55.95 56.27 1v5k s SER 2 Cb 0.00 0.02 -0.02 0.00 0.21 0.00 0.00 66.02 66.23 1v5k s SER 2 CO 0.00 -0.24 1.23 -0.44 0.41 0.00 0.00 173.24 174.20 1v5k s SER 3 N -2.04 7.00 0.00 2.44 0.01 -1.26 -4.82 113.70 115.03 1v5k s SER 3 Ca -0.02 1.76 0.00 0.00 1.31 0.00 0.00 55.95 59.00 1v5k s SER 3 Cb -0.06 -2.55 0.00 0.00 0.21 0.00 0.00 66.02 63.62 1v5k s SER 3 CO -0.00 -0.67 0.00 0.61 0.41 0.00 0.00 173.24 173.59 1v5k n GLY 4 N 3.48 0.78 3.64 3.44 0.00 -1.26 -5.18 105.19 110.09 1v5k n GLY 4 Ca 0.12 0.21 -0.03 0.00 0.00 0.00 0.00 46.02 46.32 1v5k n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1v5k s SER 5 N 0.00 -0.33 0.14 1.61 0.15 -1.26 -5.08 113.70 108.93 1v5k s SER 5 Ca 0.00 0.56 0.00 0.00 0.70 0.00 0.00 55.95 57.21 1v5k s SER 5 Cb 0.00 0.90 0.00 0.00 -1.71 0.00 0.00 66.02 65.21 1v5k s SER 5 CO 0.00 -0.09 0.00 -1.20 1.20 0.00 0.00 173.24 173.15 1v5k n SER 6 N 2.85 -0.27 -3.71 5.45 7.64 -1.26 -5.03 113.62 119.29 1v5k n SER 6 Ca -0.15 0.24 -0.29 0.00 1.01 0.00 0.00 58.87 59.67 1v5k n SER 6 Cb 0.57 0.37 -0.13 0.00 -1.01 0.00 0.00 64.21 64.01 1v5k n SER 6 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 1v5k s GLY 7 N -4.70 1.79 0.32 0.23 0.00 -1.26 -4.84 107.32 98.87 1v5k s GLY 7 Ca 0.00 -2.73 0.00 0.00 0.00 0.00 0.00 44.72 41.99 1v5k s GLY 7 CO 0.00 1.52 0.00 -1.06 0.00 0.00 0.00 173.10 173.56 1v5k n GLN 8 N 3.32 0.00 -3.04 2.90 3.00 -1.26 -5.11 117.38 117.19 1v5k n GLN 8 Ca 0.11 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 57.10 1v5k n GLN 8 Cb 0.36 0.00 0.00 0.00 0.00 0.00 0.00 30.24 30.60 1v5k n GLN 8 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.06 177.60 1v5k n ARG 9 N -3.18 -0.37 0.10 -1.09 1.74 -1.26 -4.87 116.66 107.72 1v5k n ARG 9 Ca 0.00 0.78 0.00 0.00 -0.77 0.00 0.00 57.85 57.86 1v5k n ARG 9 Cb 0.00 -0.90 0.00 0.00 -1.02 0.00 0.00 32.46 30.54 1v5k n ARG 9 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 1v5k n ARG 10 N 1.42 0.00 0.17 5.56 1.74 -1.26 -4.90 116.66 119.38 1v5k n ARG 10 Ca 0.00 0.00 0.12 0.00 -0.77 0.00 0.00 57.85 57.20 1v5k n ARG 10 Cb 0.41 0.00 0.62 0.00 -1.02 0.00 0.00 32.46 32.47 1v5k n ARG 10 CO 0.00 0.00 0.00 0.45 -1.52 0.00 0.00 177.63 176.56 1v5k h HIS 11 N 0.00 0.00 -0.96 -1.55 3.86 -1.89 -0.75 115.15 113.86 1v5k h HIS 11 Ca 0.00 0.00 0.03 0.00 -1.16 0.00 0.00 60.37 59.24 1v5k h HIS 11 Cb 0.00 0.00 -0.05 0.00 1.06 0.00 0.00 27.41 28.42 1v5k h HIS 11 CO 0.00 0.00 0.63 0.22 0.86 0.00 0.00 177.93 179.64 1v5k h ASP 12 N 0.00 1.06 0.00 2.45 3.58 -1.98 -1.29 116.42 120.24 1v5k h ASP 12 Ca 0.00 -0.01 -0.14 0.00 0.42 0.00 0.00 57.03 57.30 1v5k h ASP 12 Cb 0.01 -0.25 -0.02 0.00 1.72 0.00 0.00 39.33 40.79 1v5k h ASP 12 CO 0.00 0.73 -0.85 0.24 -2.88 0.00 0.00 179.24 176.48 1v5k h MET 13 N 1.23 0.00 -0.99 0.28 2.86 -1.54 -3.24 114.93 113.53 1v5k h MET 13 Ca 0.37 0.00 0.29 0.00 -2.06 0.00 0.00 59.70 58.31 1v5k h MET 13 Cb -0.03 0.00 -0.18 0.00 0.06 0.00 0.00 31.60 31.45 1v5k h MET 13 CO -0.11 0.77 0.10 -0.07 1.06 0.00 0.00 176.91 178.66 1v5k h LEU 14 N -1.00 -0.37 -0.16 1.22 3.38 -1.47 1.39 115.31 118.30 1v5k h LEU 14 Ca -0.21 0.28 -0.01 0.00 0.09 0.00 0.00 57.88 58.03 1v5k h LEU 14 Cb 1.04 0.46 -0.01 0.00 0.09 0.00 0.00 40.66 42.24 1v5k h LEU 14 CO -0.13 -0.37 0.06 0.00 0.09 0.00 0.00 178.44 178.10 1v5k h ALA 15 N 1.99 0.21 -0.08 1.53 0.00 -1.39 0.18 119.26 121.70 1v5k h ALA 15 Ca 0.64 -0.10 0.01 0.00 0.00 0.00 0.00 54.91 55.45 1v5k h ALA 15 Cb 1.38 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 19.09 1v5k h ALA 15 CO -0.90 -0.21 -0.08 2.35 0.00 0.00 0.00 179.25 180.41 1v5k h TRP 16 N 0.10 -0.24 0.17 0.00 7.01 0.18 1.48 115.95 124.65 1v5k h TRP 16 Ca 0.05 0.01 0.01 0.00 2.11 0.00 0.00 58.89 61.08 1v5k h TRP 16 Cb 0.17 0.12 -0.04 0.00 -2.10 0.00 0.00 29.16 27.30 1v5k h TRP 16 CO -0.02 -0.06 -0.53 0.82 -2.79 0.00 0.00 178.44 175.86 1v5k h ILE 17 N -0.04 0.01 0.00 2.65 5.03 -1.21 0.25 117.51 124.20 1v5k h ILE 17 Ca 0.01 0.00 0.00 0.00 -0.12 0.00 0.00 64.86 64.75 1v5k h ILE 17 Cb 0.08 0.01 0.00 0.00 -3.03 0.00 0.00 36.82 33.87 1v5k h ILE 17 CO -0.09 0.00 0.00 0.59 -0.68 0.00 0.00 178.15 177.97 1v5k n ASN 18 N -5.50 0.00 0.00 1.72 3.02 0.64 0.15 115.26 115.29 1v5k n ASN 18 Ca -0.09 0.55 0.00 0.00 -0.03 0.00 0.00 54.58 55.01 1v5k n ASN 18 Cb 0.42 -0.05 0.00 0.00 -0.61 0.00 0.00 39.78 39.55 1v5k n ASN 18 CO 0.00 0.00 0.00 1.21 -2.62 0.00 0.00 177.26 175.85 1v5k n GLU 19 N -1.08 0.00 -0.31 3.52 0.00 0.50 0.64 120.64 123.91 1v5k n GLU 19 Ca 0.00 0.88 0.16 0.00 0.00 0.00 0.00 57.16 58.19 1v5k n GLU 19 Cb 0.00 -1.34 0.30 0.00 0.00 0.00 0.00 31.44 30.40 1v5k n GLU 19 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.13 177.56 1v5k n SER 20 N -2.72 -0.05 0.00 4.31 7.64 0.88 -4.39 113.62 119.29 1v5k n SER 20 Ca 0.00 1.54 0.00 0.00 1.01 0.00 0.00 58.87 61.42 1v5k n SER 20 Cb 0.00 -0.58 0.00 0.00 -1.01 0.00 0.00 64.21 62.62 1v5k n SER 20 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 1v5k n LEU 21 N -5.29 0.00 -2.80 -3.43 4.77 0.39 -5.04 117.00 105.60 1v5k n LEU 21 Ca 0.23 0.00 -0.01 0.00 -0.03 0.00 0.00 56.01 56.20 1v5k n LEU 21 Cb 0.76 0.00 0.07 0.00 -2.33 0.00 0.00 43.42 41.92 1v5k n LEU 21 CO -0.06 0.00 0.13 0.00 -1.33 0.00 0.00 177.39 176.13 1v5k n GLN 22 N 0.00 1.63 -0.64 3.23 1.13 -0.80 -4.85 117.38 117.08 1v5k n GLN 22 Ca 0.00 -2.99 0.00 0.00 -1.94 0.00 0.00 57.00 52.07 1v5k n GLN 22 Cb 0.00 -1.14 0.00 0.00 0.11 0.00 0.00 30.24 29.21 1v5k n GLN 22 CO 0.00 0.00 0.00 1.28 -1.44 0.00 0.00 177.06 176.90 1v5k n LEU 23 N -0.79 0.00 -2.37 1.08 7.99 -1.23 -5.03 117.00 116.65 1v5k n LEU 23 Ca 0.02 0.00 -0.03 0.00 -0.01 0.00 0.00 56.01 55.99 1v5k n LEU 23 Cb 0.82 0.00 0.05 0.00 -0.11 0.00 0.00 43.42 44.18 1v5k n LEU 23 CO 0.02 -0.44 0.51 -3.20 -1.51 0.00 0.00 177.39 172.78 1v5k n ASN 24 N -2.62 -1.07 -4.78 -1.43 2.85 -1.26 -4.69 115.26 102.26 1v5k n ASN 24 Ca 0.00 -1.78 -0.36 0.00 -0.11 0.00 0.00 54.58 52.34 1v5k n ASN 24 Cb 0.00 0.67 -0.02 0.00 1.24 0.00 0.00 39.78 41.67 1v5k n ASN 24 CO 0.00 0.00 0.00 -0.76 -2.11 0.00 0.00 177.26 174.39 1v5k s LEU 25 N -2.29 3.93 -0.01 1.20 1.43 -1.26 -4.95 118.68 116.73 1v5k s LEU 25 Ca 0.07 2.14 0.16 0.00 -1.03 0.00 0.00 54.13 55.48 1v5k s LEU 25 Cb 0.21 -4.39 -0.22 0.00 0.03 0.00 0.00 46.19 41.82 1v5k s LEU 25 CO -0.05 -0.89 0.49 0.35 0.23 0.00 0.00 176.35 176.48 1v5k n THR 26 N -0.72 0.00 -4.28 5.49 -2.24 -1.26 -4.83 114.28 106.44 1v5k n THR 26 Ca 0.08 -0.27 -0.15 0.00 -2.27 0.00 0.00 64.05 61.44 1v5k n THR 26 Cb 0.50 0.49 -0.10 0.00 -2.10 0.00 0.00 70.33 69.12 1v5k n THR 26 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 1v5k s LYS 27 N -2.86 1.20 0.11 -0.78 -0.14 -1.26 -4.86 119.74 111.16 1v5k s LYS 27 Ca -0.01 -1.58 -0.01 0.00 -1.36 0.00 0.00 55.97 53.01 1v5k s LYS 27 Cb 0.11 -0.51 -0.18 0.00 -1.68 0.00 0.00 37.83 35.58 1v5k s LYS 27 CO 0.66 -0.07 1.25 0.82 -0.76 0.00 0.00 175.35 177.25 1v5k h ILE 28 N 2.61 1.52 0.00 2.17 1.08 -1.94 -3.05 117.51 119.90 1v5k h ILE 28 Ca -0.37 -2.93 0.00 0.00 -0.39 0.00 0.00 64.86 61.17 1v5k h ILE 28 Cb 1.21 2.74 0.00 0.00 -3.07 0.00 0.00 36.82 37.70 1v5k h ILE 28 CO 0.64 0.85 0.00 -0.62 -0.69 0.00 0.00 178.15 178.33 1v5k n GLU 29 N -3.56 0.12 0.07 2.37 1.02 -1.26 -0.94 120.64 118.46 1v5k n GLU 29 Ca -0.06 0.62 0.07 0.00 -0.02 0.00 0.00 57.16 57.77 1v5k n GLU 29 Cb 0.93 -1.90 0.33 0.00 -0.02 0.00 0.00 31.44 30.77 1v5k n GLU 29 CO 0.00 0.00 0.00 1.04 1.18 0.00 0.00 177.13 179.35 1v5k n GLN 30 N -2.17 0.08 -0.86 3.49 1.13 -1.15 -1.63 117.38 116.27 1v5k n GLN 30 Ca -0.01 0.46 -0.17 0.00 -1.94 0.00 0.00 57.00 55.34 1v5k n GLN 30 Cb 0.04 -1.70 0.10 0.00 0.11 0.00 0.00 30.24 28.79 1v5k n GLN 30 CO 0.00 0.00 0.00 1.28 -1.44 0.00 0.00 177.06 176.90 1v5k n LEU 31 N -1.85 5.79 -1.90 1.08 4.77 -0.11 -4.41 117.00 120.36 1v5k n LEU 31 Ca 0.01 -3.06 -0.18 0.00 -0.03 0.00 0.00 56.01 52.75 1v5k n LEU 31 Cb 0.10 -0.80 0.06 0.00 -2.33 0.00 0.00 43.42 40.45 1v5k n LEU 31 CO 0.10 0.97 1.18 0.00 -1.33 0.00 0.00 177.39 178.30 1v5k n SER 33 N -0.03 0.46 0.00 0.00 3.41 -1.26 -4.62 113.62 111.58 1v5k n SER 33 Ca 0.36 0.18 0.00 0.00 -0.26 0.00 0.00 58.87 59.14 1v5k n SER 33 Cb 0.75 -0.05 0.00 0.00 -0.26 0.00 0.00 64.21 64.64 1v5k n SER 33 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1v5k n GLY 34 N 2.82 0.75 0.97 5.00 0.00 -1.26 -4.12 105.19 109.36 1v5k n GLY 34 Ca 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.01 1v5k n GLY 34 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1v5k n ALA 35 N 0.00 2.92 -0.38 4.61 0.00 -1.26 -3.84 120.51 122.56 1v5k n ALA 35 Ca 0.00 -0.05 -0.10 0.00 0.00 0.00 0.00 53.44 53.29 1v5k n ALA 35 Cb 0.00 0.44 -0.08 0.00 0.00 0.00 0.00 19.45 19.81 1v5k n ALA 35 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1v5k h ALA 36 N -0.04 -0.49 -0.62 0.00 0.00 -1.97 0.39 119.26 116.53 1v5k h ALA 36 Ca -0.03 0.12 0.12 0.00 0.00 0.00 0.00 54.91 55.13 1v5k h ALA 36 Cb 0.84 1.30 -0.12 0.00 0.00 0.00 0.00 17.79 19.81 1v5k h ALA 36 CO -0.02 -0.94 -0.23 1.88 0.00 0.00 0.00 179.25 179.95 1v5k h TYR 37 N -0.05 -0.56 -0.50 0.00 0.05 -1.99 0.26 116.97 114.18 1v5k h TYR 37 Ca 0.17 0.06 0.10 0.00 0.05 0.00 0.00 58.73 59.11 1v5k h TYR 37 Cb 0.46 0.34 -0.10 0.00 1.01 0.00 0.00 36.73 38.44 1v5k h TYR 37 CO -0.97 -0.32 -0.14 0.00 -1.05 0.00 0.00 178.16 175.68 1v5k h GLN 39 N -0.02 -0.62 -1.01 0.00 4.15 0.13 -0.24 115.11 117.50 1v5k h GLN 39 Ca 0.24 0.04 0.22 0.00 0.77 0.00 0.00 58.65 59.92 1v5k h GLN 39 Cb 0.38 0.14 -0.11 0.00 0.21 0.00 0.00 27.48 28.10 1v5k h GLN 39 CO -0.52 -0.41 0.62 0.35 -1.93 0.00 0.00 178.83 176.93 1v5k h PHE 40 N -0.65 0.95 0.63 3.99 3.04 0.34 -0.36 116.94 124.89 1v5k h PHE 40 Ca 0.00 0.03 -0.03 0.00 3.98 0.00 0.00 57.97 61.95 1v5k h PHE 40 Cb 0.63 -0.28 0.01 0.00 2.56 0.00 0.00 35.95 38.86 1v5k h PHE 40 CO -0.26 0.14 -0.30 0.52 -2.02 0.00 0.00 178.31 176.39 1v5k h MET 41 N 0.62 -0.82 -1.19 1.11 2.86 0.31 -1.12 114.93 116.69 1v5k h MET 41 Ca 0.60 0.06 0.35 0.00 -2.06 0.00 0.00 59.70 58.64 1v5k h MET 41 Cb 1.14 0.19 -0.09 0.00 0.06 0.00 0.00 31.60 32.89 1v5k h MET 41 CO -0.39 -0.54 0.79 0.22 1.06 0.00 0.00 176.91 178.05 1v5k h ASP 42 N -1.01 0.28 -0.02 1.22 3.58 -0.44 1.82 116.42 121.84 1v5k h ASP 42 Ca -0.09 0.08 -0.14 0.00 0.42 0.00 0.00 57.03 57.30 1v5k h ASP 42 Cb 0.65 0.04 -0.01 0.00 1.72 0.00 0.00 39.33 41.73 1v5k h ASP 42 CO 0.14 -0.02 -0.44 0.24 -2.88 0.00 0.00 179.24 176.29 1v5k h MET 43 N 0.21 0.55 0.00 0.28 2.86 -0.85 -3.30 114.93 114.68 1v5k h MET 43 Ca 0.67 -0.29 0.00 0.00 -2.06 0.00 0.00 59.70 58.02 1v5k h MET 43 Cb 2.08 0.01 0.00 0.00 0.06 0.00 0.00 31.60 33.75 1v5k h MET 43 CO -0.26 0.88 -0.21 -0.07 1.06 0.00 0.00 176.91 178.31 1v5k h LEU 44 N 0.45 0.00 -8.26 1.22 3.38 0.33 -3.45 115.31 108.98 1v5k h LEU 44 Ca 0.03 0.00 -0.70 0.00 0.09 0.00 0.00 57.88 57.30 1v5k h LEU 44 Cb 0.95 0.00 -0.27 0.00 0.09 0.00 0.00 40.66 41.43 1v5k h LEU 44 CO 0.08 0.46 -0.55 -0.36 0.09 0.00 0.00 178.44 178.17 1v5k s PHE 45 N -1.67 3.26 -0.22 1.13 0.08 0.50 -5.06 117.98 116.01 1v5k s PHE 45 Ca -0.06 -1.24 -0.29 0.00 0.12 0.00 0.00 56.93 55.46 1v5k s PHE 45 Cb 0.01 -2.44 -0.01 0.00 -0.57 0.00 0.00 43.02 40.00 1v5k s PHE 45 CO 0.09 -0.71 1.31 -1.25 -0.10 0.00 0.00 175.22 174.55 1v5k s PRO 46 N 1.47 4.09 0.00 0.24 0.04 -1.24 -2.80 135.00 136.80 1v5k s PRO 46 Ca 0.01 1.51 0.00 0.00 0.04 0.00 0.00 61.00 62.56 1v5k s PRO 46 Cb -0.20 -3.83 0.00 0.00 0.04 0.00 0.00 34.50 30.51 1v5k s PRO 46 CO 0.04 -0.90 0.00 0.41 0.04 0.00 0.00 177.00 176.59 1v5k n GLY 47 N 3.95 0.99 0.11 0.56 0.00 -1.26 -4.97 105.19 104.56 1v5k n GLY 47 Ca 0.15 -0.55 -0.13 0.00 0.00 0.00 0.00 46.02 45.49 1v5k n GLY 47 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1v5k n SER 48 N 1.21 1.04 -1.32 1.61 3.41 -1.12 -5.02 113.62 113.44 1v5k n SER 48 Ca 0.00 -0.06 0.00 0.00 -0.26 0.00 0.00 58.87 58.55 1v5k n SER 48 Cb 0.29 0.38 0.00 0.00 -0.26 0.00 0.00 64.21 64.62 1v5k n SER 48 CO 0.00 0.00 0.00 -0.38 -0.16 0.00 0.00 175.04 174.50 1v5k n ILE 49 N -2.93 0.00 -3.06 -1.33 2.08 -1.26 -4.15 119.36 108.70 1v5k n ILE 49 Ca -0.37 0.00 -0.23 0.00 0.56 0.00 0.00 62.75 62.71 1v5k n ILE 49 Cb 1.06 -0.25 -0.04 0.00 -0.75 0.00 0.00 39.64 39.66 1v5k n ILE 49 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 1v5k n ALA 50 N -3.00 3.55 -0.10 -1.39 0.00 -1.26 -4.89 120.51 113.42 1v5k n ALA 50 Ca 0.00 -4.16 0.26 0.00 0.00 0.00 0.00 53.44 49.54 1v5k n ALA 50 Cb 0.00 -0.82 0.60 0.00 0.00 0.00 0.00 19.45 19.23 1v5k n ALA 50 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 1v5k h LEU 51 N 3.04 0.00 -3.57 0.00 3.38 -1.95 0.98 115.31 117.20 1v5k h LEU 51 Ca 0.12 0.00 -0.36 0.00 0.09 0.00 0.00 57.88 57.73 1v5k h LEU 51 Cb 0.70 0.00 -0.15 0.00 0.09 0.00 0.00 40.66 41.30 1v5k h LEU 51 CO 0.68 0.00 0.46 2.29 0.09 0.00 0.00 178.44 181.96 1v5k n LYS 52 N -3.49 1.90 0.00 1.13 -0.00 -1.26 -3.88 118.16 112.57 1v5k n LYS 52 Ca 0.17 -1.74 0.00 0.00 -0.00 0.00 0.00 58.31 56.74 1v5k n LYS 52 Cb 1.14 -1.69 0.00 0.00 -0.00 0.00 0.00 35.03 34.48 1v5k n LYS 52 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.40 178.57 1v5k n LYS 53 N 0.27 0.00 -1.21 -1.58 4.81 0.33 -5.13 118.16 115.65 1v5k n LYS 53 Ca 0.34 0.00 -0.37 0.00 -0.87 0.00 0.00 58.31 57.41 1v5k n LYS 53 Cb 0.58 -0.02 0.05 0.00 0.02 0.00 0.00 35.03 35.66 1v5k n LYS 53 CO 0.00 0.00 0.00 1.55 1.17 0.00 0.00 177.40 180.12 1v5k n VAL 54 N -2.04 0.95 -3.68 3.15 3.14 -0.82 -4.92 118.33 114.12 1v5k n VAL 54 Ca 0.00 -0.44 -0.38 0.00 -2.96 0.00 0.00 64.34 60.56 1v5k n VAL 54 Cb 0.00 -0.40 -0.09 0.00 -1.06 0.00 0.00 33.84 32.29 1v5k n VAL 54 CO 0.00 0.00 0.00 -0.54 -6.46 0.00 0.00 176.83 169.83 1v5k s LYS 55 N -2.13 2.52 0.22 1.45 -0.14 -1.26 -4.90 119.74 115.50 1v5k s LYS 55 Ca 0.59 -2.29 0.08 0.00 -1.36 0.00 0.00 55.97 52.99 1v5k s LYS 55 Cb -0.36 -3.78 0.17 0.00 -1.68 0.00 0.00 37.83 32.17 1v5k s LYS 55 CO 0.65 -1.17 1.50 0.74 -0.76 0.00 0.00 175.35 176.31 1v5k h PHE 56 N 7.48 0.07 -0.98 3.18 -1.00 -1.95 -3.15 116.94 120.59 1v5k h PHE 56 Ca -0.05 -0.04 -0.64 0.00 2.81 0.00 0.00 57.97 60.05 1v5k h PHE 56 Cb 0.99 -0.01 -0.27 0.00 3.61 0.00 0.00 35.95 40.27 1v5k h PHE 56 CO 0.69 0.77 0.83 1.04 -1.61 0.00 0.00 178.31 180.04 1v5k n GLN 57 N -3.69 2.59 -3.00 1.51 6.02 -1.26 -4.96 117.38 114.60 1v5k n GLN 57 Ca -0.01 -3.09 -0.40 0.00 -0.01 0.00 0.00 57.00 53.48 1v5k n GLN 57 Cb 0.72 -2.21 -0.05 0.00 1.02 0.00 0.00 30.24 29.72 1v5k n GLN 57 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1v5k s ALA 58 N -3.59 3.33 -0.06 -1.58 0.00 -1.19 -4.92 121.76 113.75 1v5k s ALA 58 Ca 0.61 0.22 0.05 0.00 0.00 0.00 0.00 51.96 52.84 1v5k s ALA 58 Cb 0.48 -3.00 -0.07 0.00 0.00 0.00 0.00 23.12 20.52 1v5k s ALA 58 CO -0.03 -0.05 0.01 1.63 0.00 0.00 0.00 175.76 177.32 1v5k n LYS 59 N 3.46 2.82 -2.33 0.00 5.02 -1.26 -4.96 118.16 120.90 1v5k n LYS 59 Ca -0.01 0.00 -0.30 0.00 -2.02 0.00 0.00 58.31 55.98 1v5k n LYS 59 Cb 0.51 -1.16 -0.00 0.00 -0.02 0.00 0.00 35.03 34.36 1v5k n LYS 59 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 1v5k s LEU 60 N -4.52 3.49 -0.03 -0.35 2.01 -1.26 -5.01 118.68 113.02 1v5k s LEU 60 Ca -0.04 1.23 -0.22 0.00 0.01 0.00 0.00 54.13 55.11 1v5k s LEU 60 Cb 0.02 -4.21 -0.15 0.00 0.01 0.00 0.00 46.19 41.86 1v5k s LEU 60 CO 0.24 -0.67 0.97 -0.33 1.01 0.00 0.00 176.35 177.58 1v5k h GLU 61 N 0.22 -0.31 -0.99 1.70 5.08 -1.94 -3.13 114.58 115.21 1v5k h GLU 61 Ca -0.46 0.02 0.41 0.00 -1.00 0.00 0.00 59.36 58.33 1v5k h GLU 61 Cb 1.19 0.07 -0.17 0.00 0.50 0.00 0.00 28.75 30.34 1v5k h GLU 61 CO 0.62 0.06 0.54 -2.39 -1.00 0.00 0.00 179.01 176.84 1v5k n HIS 62 N -5.02 1.11 0.34 4.33 1.44 -1.26 0.25 115.22 116.42 1v5k n HIS 62 Ca -0.08 1.12 -0.16 0.00 -2.01 0.00 0.00 57.72 56.59 1v5k n HIS 62 Cb 0.26 -1.53 -0.08 0.00 0.12 0.00 0.00 29.99 28.77 1v5k n HIS 62 CO 0.00 0.00 0.00 0.93 -2.81 0.00 0.00 176.34 174.46 1v5k h GLU 63 N 0.00 -0.92 -0.92 -1.40 4.39 -1.95 -2.94 114.58 110.84 1v5k h GLU 63 Ca 0.82 0.06 0.15 0.00 0.34 0.00 0.00 59.36 60.73 1v5k h GLU 63 Cb 2.21 0.21 -0.15 0.00 -0.10 0.00 0.00 28.75 30.91 1v5k h GLU 63 CO -0.73 -0.61 -0.34 0.66 -1.16 0.00 0.00 179.01 176.82 1v5k n TYR 64 N -4.87 0.07 -0.26 4.33 4.01 0.14 -0.37 117.16 120.21 1v5k n TYR 64 Ca -0.12 1.13 -0.07 0.00 -0.16 0.00 0.00 57.90 58.68 1v5k n TYR 64 Cb 0.40 -0.87 -0.06 0.00 -0.31 0.00 0.00 39.34 38.50 1v5k n TYR 64 CO 0.00 0.00 0.00 -0.89 -0.46 0.00 0.00 176.86 175.51 1v5k n ILE 65 N -5.37 -0.42 -0.03 -0.72 -0.00 -1.00 -0.27 119.36 111.55 1v5k n ILE 65 Ca 0.10 2.00 -0.09 0.00 -0.00 0.00 0.00 62.75 64.76 1v5k n ILE 65 Cb 0.38 -2.52 -0.03 0.00 -0.00 0.00 0.00 39.64 37.47 1v5k n ILE 65 CO 0.00 0.00 0.00 1.56 -0.00 0.00 0.00 176.55 178.11 1v5k h GLN 66 N 0.00 -0.31 -0.99 0.38 4.20 -0.66 0.25 115.11 117.97 1v5k h GLN 66 Ca 0.10 0.02 0.26 0.00 0.06 0.00 0.00 58.65 59.09 1v5k h GLN 66 Cb 0.25 0.07 -0.19 0.00 0.30 0.00 0.00 27.48 27.92 1v5k h GLN 66 CO -0.58 -0.21 -0.01 -0.91 -0.67 0.00 0.00 178.83 176.45 1v5k h ASN 67 N -0.32 -0.55 -0.15 1.46 4.21 0.40 0.72 115.58 121.35 1v5k h ASN 67 Ca 0.12 0.29 -0.09 0.00 1.21 0.00 0.00 56.30 57.82 1v5k h ASN 67 Cb 0.51 0.51 0.00 0.00 -1.12 0.00 0.00 38.32 38.22 1v5k h ASN 67 CO -0.38 -0.36 -0.26 -0.26 -1.29 0.00 0.00 177.43 174.88 1v5k h PHE 68 N 0.00 0.54 -0.88 1.19 0.04 0.88 -2.76 116.94 115.95 1v5k h PHE 68 Ca 0.59 -0.19 0.22 0.00 2.80 0.00 0.00 57.97 61.39 1v5k h PHE 68 Cb 1.17 -0.10 -0.16 0.00 2.20 0.00 0.00 35.95 39.06 1v5k h PHE 68 CO -0.54 0.88 0.02 0.87 -0.60 0.00 0.00 178.31 178.95 1v5k h LYS 69 N 0.05 0.07 0.59 1.51 1.57 0.37 0.89 116.57 121.61 1v5k h LYS 69 Ca 0.01 -0.00 -0.03 0.00 -1.87 0.00 0.00 60.65 58.76 1v5k h LYS 69 Cb 0.84 -0.01 0.01 0.00 0.08 0.00 0.00 32.23 33.15 1v5k h LYS 69 CO 0.06 0.04 -0.28 0.82 -0.57 0.00 0.00 179.45 179.52 1v5k h ILE 70 N 0.07 0.31 -0.53 1.86 2.04 -1.08 -1.98 117.51 118.19 1v5k h ILE 70 Ca 0.51 -0.29 0.09 0.00 1.00 0.00 0.00 64.86 66.17 1v5k h ILE 70 Cb 0.98 0.40 -0.10 0.00 -0.74 0.00 0.00 36.82 37.35 1v5k h ILE 70 CO -0.80 0.03 -0.39 0.25 0.00 0.00 0.00 178.15 177.24 1v5k h LEU 71 N -1.01 -1.34 -0.93 1.44 7.12 -0.49 0.49 115.31 120.58 1v5k h LEU 71 Ca -0.08 0.23 0.22 0.00 0.13 0.00 0.00 57.88 58.38 1v5k h LEU 71 Cb 0.67 0.62 -0.12 0.00 -0.53 0.00 0.00 40.66 41.29 1v5k h LEU 71 CO 0.13 -0.33 0.47 -0.61 -0.13 0.00 0.00 178.44 177.97 1v5k h GLN 72 N -0.23 0.48 0.00 1.25 5.75 0.70 1.46 115.11 124.51 1v5k h GLN 72 Ca 0.18 -0.03 -0.01 0.00 -0.15 0.00 0.00 58.65 58.65 1v5k h GLN 72 Cb 0.56 -0.11 -0.00 0.00 1.07 0.00 0.00 27.48 29.00 1v5k h GLN 72 CO -0.65 0.32 -0.03 0.00 -2.65 0.00 0.00 178.83 175.82 1v5k h ALA 73 N 1.70 1.74 0.00 3.38 0.00 0.74 0.13 119.26 126.94 1v5k h ALA 73 Ca 0.58 -0.03 -0.04 0.00 0.00 0.00 0.00 54.91 55.43 1v5k h ALA 73 Cb 1.08 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.86 1v5k h ALA 73 CO -0.49 0.03 -0.17 0.78 0.00 0.00 0.00 179.25 179.40 1v5k h GLY 74 N 0.11 0.00 0.17 0.00 0.00 0.31 -1.35 103.07 102.31 1v5k h GLY 74 Ca -0.00 0.00 -0.04 0.00 0.00 0.00 0.00 47.33 47.29 1v5k h GLY 74 CO 0.00 0.00 -0.19 0.74 0.00 0.00 0.00 176.54 177.09 1v5k h PHE 75 N 0.00 0.13 0.00 5.60 -1.00 -0.86 -2.77 116.94 118.04 1v5k h PHE 75 Ca -0.00 -0.09 0.00 0.00 2.81 0.00 0.00 57.97 60.68 1v5k h PHE 75 Cb 0.33 -0.01 0.00 0.00 3.61 0.00 0.00 35.95 39.88 1v5k h PHE 75 CO 0.00 1.07 0.00 1.57 -1.61 0.00 0.00 178.31 179.34 1v5k h LYS 76 N -0.84 0.00 0.04 1.51 5.09 -1.31 0.78 116.57 121.84 1v5k h LYS 76 Ca -0.03 0.00 -0.08 0.00 0.09 0.00 0.00 60.65 60.63 1v5k h LYS 76 Cb 1.14 0.00 0.00 0.00 0.10 0.00 0.00 32.23 33.48 1v5k h LYS 76 CO 0.04 0.00 -0.38 0.00 -2.09 0.00 0.00 179.45 177.01 1v5k h ARG 77 N 0.00 0.09 0.13 0.07 3.08 -1.26 -3.39 114.38 113.09 1v5k h ARG 77 Ca 0.00 -0.15 -0.01 0.00 0.07 0.00 0.00 59.98 59.89 1v5k h ARG 77 Cb 0.04 0.06 0.00 0.00 0.08 0.00 0.00 29.97 30.15 1v5k h ARG 77 CO 0.00 1.07 -0.06 0.52 -1.07 0.00 0.00 179.97 180.43 1v5k h MET 78 N -0.81 -0.17 0.00 0.04 2.86 -1.02 -3.49 114.93 112.35 1v5k h MET 78 Ca -0.08 0.01 0.00 0.00 -2.06 0.00 0.00 59.70 57.57 1v5k h MET 78 Cb 1.23 0.04 0.00 0.00 0.06 0.00 0.00 31.60 32.93 1v5k h MET 78 CO 0.02 0.14 0.00 0.41 1.06 0.00 0.00 176.91 178.55 1v5k n GLY 79 N 1.14 -0.14 3.03 8.32 0.00 0.25 -5.10 105.19 112.69 1v5k n GLY 79 Ca -0.05 -0.07 -0.31 0.00 0.00 0.00 0.00 46.02 45.59 1v5k n GLY 79 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1v5k s VAL 80 N 0.00 1.90 -1.22 1.61 1.01 -0.17 -5.01 120.40 118.51 1v5k s VAL 80 Ca 0.00 -1.33 -0.06 0.00 0.00 0.00 0.00 61.98 60.59 1v5k s VAL 80 Cb 0.00 -2.00 0.20 0.00 0.00 0.00 0.00 36.38 34.58 1v5k s VAL 80 CO 0.00 0.06 1.95 0.47 0.00 0.00 0.00 175.10 177.58 1v5k n ASP 81 N 4.56 6.55 -4.42 3.32 9.92 -1.26 -4.15 116.55 131.07 1v5k n ASP 81 Ca -0.14 -3.26 -0.33 0.00 -0.53 0.00 0.00 54.79 50.53 1v5k n ASP 81 Cb 0.44 -1.36 -0.14 0.00 -0.64 0.00 0.00 41.12 39.43 1v5k n ASP 81 CO 0.00 0.00 0.00 -0.75 0.13 0.00 0.00 177.20 176.58 1v5k s LYS 82 N -1.34 3.07 -0.45 -1.24 2.47 -1.26 -5.08 119.74 115.91 1v5k s LYS 82 Ca 0.42 -0.68 -0.24 0.00 -1.56 0.00 0.00 55.97 53.91 1v5k s LYS 82 Cb 0.13 -2.55 0.03 0.00 -1.46 0.00 0.00 37.83 33.97 1v5k s LYS 82 CO -0.02 0.37 0.82 0.42 0.16 0.00 0.00 175.35 177.10 1v5k s ILE 83 N -0.07 4.61 -0.33 5.43 -1.09 -1.26 -5.01 121.20 123.48 1v5k s ILE 83 Ca -0.02 0.54 -0.25 0.00 -2.23 0.00 0.00 60.65 58.68 1v5k s ILE 83 Cb -0.14 -4.35 0.01 0.00 -1.58 0.00 0.00 42.46 36.40 1v5k s ILE 83 CO 0.04 -0.73 0.89 -0.63 -1.23 0.00 0.00 174.94 173.27 1v5k s ILE 84 N 3.40 4.66 -1.12 2.92 1.01 -1.26 -4.94 121.20 125.87 1v5k s ILE 84 Ca 0.32 1.27 -0.16 0.00 0.00 0.00 0.00 60.65 62.08 1v5k s ILE 84 Cb -0.12 -4.27 -0.07 0.00 0.01 0.00 0.00 42.46 38.02 1v5k s ILE 84 CO 0.23 -0.41 2.16 -0.81 0.00 0.00 0.00 174.94 176.12 1v5k n PRO 85 N 6.55 2.29 0.35 2.79 -0.04 -1.26 -4.65 135.00 141.03 1v5k n PRO 85 Ca 0.06 -2.10 -0.15 0.00 -0.04 0.00 0.00 63.50 61.27 1v5k n PRO 85 Cb 0.48 -2.98 -0.08 0.00 -0.04 0.00 0.00 33.50 30.89 1v5k n PRO 85 CO 0.00 0.00 0.00 0.28 -0.04 0.00 0.00 175.50 175.74 1v5k h VAL 86 N 4.02 0.14 -1.47 0.52 2.07 -1.96 2.66 116.25 122.24 1v5k h VAL 86 Ca 0.53 -0.29 0.43 0.00 0.82 0.00 0.00 66.70 68.19 1v5k h VAL 86 Cb 0.55 0.19 -0.06 0.00 -1.52 0.00 0.00 31.29 30.45 1v5k h VAL 86 CO 1.85 0.02 1.22 -0.78 0.02 0.00 0.00 177.57 179.90 1v5k h ASP 87 N -1.16 0.00 0.00 0.57 3.58 -1.98 1.59 116.42 119.03 1v5k h ASP 87 Ca -0.09 0.00 -0.05 0.00 0.42 0.00 0.00 57.03 57.31 1v5k h ASP 87 Cb 0.73 0.00 -0.01 0.00 1.72 0.00 0.00 39.33 41.77 1v5k h ASP 87 CO 0.15 0.00 -0.93 0.29 -2.88 0.00 0.00 179.24 175.87 1v5k n LYS 88 N -3.73 0.50 -0.32 0.28 5.02 -0.93 -3.21 118.16 115.78 1v5k n LYS 88 Ca 0.33 0.37 0.18 0.00 -2.02 0.00 0.00 58.31 57.17 1v5k n LYS 88 Cb 1.67 -1.57 0.38 0.00 -0.02 0.00 0.00 35.03 35.49 1v5k n LYS 88 CO 0.00 0.00 0.00 -0.07 -0.52 0.00 0.00 177.40 176.81 1v5k h LEU 89 N -1.00 0.35 -0.74 -0.35 3.38 0.68 1.84 115.31 119.46 1v5k h LEU 89 Ca -0.08 0.18 -0.13 0.00 0.09 0.00 0.00 57.88 57.94 1v5k h LEU 89 Cb 0.86 0.17 -0.01 0.00 0.09 0.00 0.00 40.66 41.77 1v5k h LEU 89 CO -0.05 -0.09 -0.55 -0.37 0.09 0.00 0.00 178.44 177.47 1v5k h VAL 90 N 0.33 1.37 0.00 1.22 -1.51 0.20 -2.07 116.25 115.79 1v5k h VAL 90 Ca 0.64 -1.86 0.00 0.00 -1.23 0.00 0.00 66.70 64.26 1v5k h VAL 90 Cb 1.36 1.92 0.00 0.00 -2.13 0.00 0.00 31.29 32.44 1v5k h VAL 90 CO -0.60 0.55 0.00 0.29 -1.23 0.00 0.00 177.57 176.58 1v5k n LYS 91 N -3.91 0.12 -2.13 5.19 5.02 0.59 -4.89 118.16 118.15 1v5k n LYS 91 Ca -0.02 0.30 -0.02 0.00 -2.02 0.00 0.00 58.31 56.55 1v5k n LYS 91 Cb 0.58 -1.70 0.01 0.00 -0.02 0.00 0.00 35.03 33.89 1v5k n LYS 91 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1v5k n GLY 92 N 0.29 0.37 3.48 0.72 0.00 0.80 -4.97 105.19 105.88 1v5k n GLY 92 Ca 0.03 -0.40 -0.44 0.00 0.00 0.00 0.00 46.02 45.22 1v5k n GLY 92 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1v5k s LYS 93 N -4.09 3.93 0.16 1.61 1.02 -1.06 -4.87 119.74 116.43 1v5k s LYS 93 Ca 0.00 -2.24 -0.15 0.00 0.02 0.00 0.00 55.97 53.61 1v5k s LYS 93 Cb -0.00 -5.09 0.13 0.00 -0.52 0.00 0.00 37.83 32.35 1v5k s LYS 93 CO 0.08 -1.84 1.13 0.34 -0.92 0.00 0.00 175.35 174.14 1v5k n PHE 94 N 6.33 -0.05 -0.11 3.18 7.35 -1.26 0.22 117.46 133.13 1v5k n PHE 94 Ca 0.35 0.90 -0.05 0.00 -0.76 0.00 0.00 57.45 57.89 1v5k n PHE 94 Cb 0.45 -0.73 0.02 0.00 0.35 0.00 0.00 39.48 39.57 1v5k n PHE 94 CO 0.00 0.00 0.00 0.37 -0.76 0.00 0.00 176.76 176.37 1v5k h GLN 95 N 0.00 0.17 0.00 -4.13 5.75 -1.99 0.61 115.11 115.52 1v5k h GLN 95 Ca 0.23 -0.01 0.00 0.00 -0.15 0.00 0.00 58.65 58.72 1v5k h GLN 95 Cb 0.41 -0.04 0.00 0.00 1.07 0.00 0.00 27.48 28.92 1v5k h GLN 95 CO -0.72 0.11 0.00 -3.47 -2.65 0.00 0.00 178.83 172.10 1v5k n ASP 96 N -5.12 0.00 -0.13 -0.69 2.03 0.48 -1.01 116.55 112.12 1v5k n ASP 96 Ca 0.02 -1.34 -0.20 0.00 0.52 0.00 0.00 54.79 53.78 1v5k n ASP 96 Cb 0.17 0.00 -0.12 0.00 -0.72 0.00 0.00 41.12 40.46 1v5k n ASP 96 CO 0.00 0.00 0.00 -3.20 -1.92 0.00 0.00 177.20 172.08 1v5k n ASN 97 N -0.83 1.98 0.06 1.67 2.85 0.60 -4.03 115.26 117.57 1v5k n ASN 97 Ca 0.16 -0.05 -0.18 0.00 -0.11 0.00 0.00 54.58 54.40 1v5k n ASN 97 Cb 0.07 -0.50 -0.14 0.00 1.24 0.00 0.00 39.78 40.45 1v5k n ASN 97 CO 0.00 0.00 0.00 0.15 -2.11 0.00 0.00 177.26 175.30 1v5k h PHE 98 N -0.16 0.50 0.00 1.20 3.04 0.01 -2.48 116.94 119.04 1v5k h PHE 98 Ca -0.59 -0.36 0.00 0.00 3.98 0.00 0.00 57.97 60.99 1v5k h PHE 98 Cb 1.86 -0.02 0.00 0.00 2.56 0.00 0.00 35.95 40.35 1v5k h PHE 98 CO 0.01 1.45 0.00 0.39 -2.02 0.00 0.00 178.31 178.14 1v5k n GLU 99 N -3.47 0.36 -0.08 1.11 -0.58 -0.18 -1.27 120.64 116.52 1v5k n GLU 99 Ca -0.19 0.08 -0.12 0.00 -0.42 0.00 0.00 57.16 56.52 1v5k n GLU 99 Cb 1.05 -1.50 -0.08 0.00 -0.57 0.00 0.00 31.44 30.35 1v5k n GLU 99 CO 0.00 0.00 0.00 0.34 -0.48 0.00 0.00 177.13 176.99 1v5k n PHE 100 N -1.21 0.00 -0.08 -0.32 -0.00 -1.23 -4.42 117.46 110.20 1v5k n PHE 100 Ca 0.10 0.00 -0.13 0.00 -0.00 0.00 0.00 57.45 57.42 1v5k n PHE 100 Cb 0.13 -0.63 -0.05 0.00 -0.00 0.00 0.00 39.48 38.92 1v5k n PHE 100 CO 0.00 0.00 0.00 -0.24 -0.00 0.00 0.00 176.76 176.52 1v5k h VAL 101 N -0.03 1.32 -0.18 -2.13 3.04 -1.32 -1.30 116.25 115.65 1v5k h VAL 101 Ca -0.37 -1.46 0.05 0.00 -1.01 0.00 0.00 66.70 63.91 1v5k h VAL 101 Cb 1.56 1.69 -0.01 0.00 -2.01 0.00 0.00 31.29 32.53 1v5k h VAL 101 CO -0.07 0.46 0.32 0.06 -1.01 0.00 0.00 177.57 177.33 1v5k h GLN 102 N 0.33 0.00 0.00 4.17 3.07 -1.44 0.36 115.11 121.60 1v5k h GLN 102 Ca 0.03 0.00 -0.10 0.00 0.09 0.00 0.00 58.65 58.67 1v5k h GLN 102 Cb 0.84 0.00 -0.02 0.00 0.08 0.00 0.00 27.48 28.39 1v5k h GLN 102 CO 0.07 0.00 -0.70 2.35 0.09 0.00 0.00 178.83 180.63 1v5k h TRP 103 N 0.00 0.00 -1.08 0.06 7.01 -1.68 -3.22 115.95 117.04 1v5k h TRP 103 Ca 0.09 0.00 0.32 0.00 2.11 0.00 0.00 58.89 61.40 1v5k h TRP 103 Cb 0.72 0.00 -0.12 0.00 -2.10 0.00 0.00 29.16 27.66 1v5k h TRP 103 CO 0.00 0.84 0.66 0.74 -2.79 0.00 0.00 178.44 177.90 1v5k h PHE 104 N -1.00 0.77 -0.31 2.65 -1.00 -0.04 0.70 116.94 118.71 1v5k h PHE 104 Ca -0.16 0.03 -0.06 0.00 2.81 0.00 0.00 57.97 60.59 1v5k h PHE 104 Cb 0.89 -0.21 -0.01 0.00 3.61 0.00 0.00 35.95 40.23 1v5k h PHE 104 CO 0.03 -0.07 -0.04 -0.22 -1.61 0.00 0.00 178.31 176.40 1v5k h LYS 105 N 0.34 0.58 -0.02 1.51 3.64 -1.12 -2.27 116.57 119.22 1v5k h LYS 105 Ca 0.69 -0.21 0.03 0.00 -1.27 0.00 0.00 60.65 59.90 1v5k h LYS 105 Cb 1.74 -0.04 -0.05 0.00 -0.41 0.00 0.00 32.23 33.47 1v5k h LYS 105 CO -0.45 0.75 -0.29 0.87 -2.27 0.00 0.00 179.45 178.06 1v5k h LYS 106 N 0.36 -0.41 0.00 1.90 1.57 0.36 0.28 116.57 120.63 1v5k h LYS 106 Ca 0.08 0.03 0.00 0.00 -1.87 0.00 0.00 60.65 58.89 1v5k h LYS 106 Cb 0.51 0.09 0.00 0.00 0.08 0.00 0.00 32.23 32.92 1v5k h LYS 106 CO 0.02 -0.27 0.05 0.35 -0.57 0.00 0.00 179.45 179.03 1v5k h PHE 107 N -0.42 0.00 -0.65 -1.35 3.04 -1.14 -0.05 116.94 116.36 1v5k h PHE 107 Ca 0.07 0.00 -0.33 0.00 3.98 0.00 0.00 57.97 61.69 1v5k h PHE 107 Cb 0.52 0.00 -0.20 0.00 2.56 0.00 0.00 35.95 38.84 1v5k h PHE 107 CO -0.33 0.00 0.42 1.19 -2.02 0.00 0.00 178.31 177.57 1v5k n PHE 108 N -2.98 2.03 0.02 0.41 3.01 0.99 -4.14 117.46 116.80 1v5k n PHE 108 Ca -0.03 -1.35 0.00 0.00 1.01 0.00 0.00 57.45 57.08 1v5k n PHE 108 Cb 0.11 -0.70 0.00 0.00 -0.01 0.00 0.00 39.48 38.88 1v5k n PHE 108 CO 0.00 0.00 0.00 -3.47 1.01 0.00 0.00 176.76 174.30 1v5k n ASP 109 N -0.55 0.01 -4.46 4.37 2.03 -0.04 -4.99 116.55 112.92 1v5k n ASP 109 Ca 0.39 0.08 -0.43 0.00 0.52 0.00 0.00 54.79 55.35 1v5k n ASP 109 Cb 1.27 0.05 -0.03 0.00 -0.72 0.00 0.00 41.12 41.69 1v5k n ASP 109 CO 0.00 0.00 0.00 -0.55 -1.92 0.00 0.00 177.20 174.73 1v5k s SER 110 N -5.04 6.36 0.00 1.67 0.15 -1.14 -4.73 113.70 110.97 1v5k s SER 110 Ca 0.00 -1.39 0.00 0.00 0.70 0.00 0.00 55.95 55.26 1v5k s SER 110 Cb 0.00 -2.43 0.00 0.00 -1.71 0.00 0.00 66.02 61.88 1v5k s SER 110 CO 0.00 -1.32 0.00 0.61 1.20 0.00 0.00 173.24 173.73 1v5k n GLY 111 N 5.51 -0.79 3.81 9.45 0.00 -1.26 -4.90 105.19 117.00 1v5k n GLY 111 Ca 0.09 0.67 -0.33 0.00 0.00 0.00 0.00 46.02 46.46 1v5k n GLY 111 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1v5k s PRO 112 N 0.00 3.41 -0.27 1.61 0.04 -1.26 -5.07 135.00 133.45 1v5k s PRO 112 Ca 0.00 1.17 -0.13 0.00 0.04 0.00 0.00 61.00 62.08 1v5k s PRO 112 Cb 0.00 -2.05 0.09 0.00 0.04 0.00 0.00 34.50 32.59 1v5k s PRO 112 CO 0.00 -0.74 0.64 -1.12 0.04 0.00 0.00 177.00 175.82 1v5k s SER 113 N -2.82 -0.94 0.18 6.66 0.01 -1.26 -5.06 113.70 110.47 1v5k s SER 113 Ca 0.63 1.46 0.00 0.00 1.31 0.00 0.00 55.95 59.35 1v5k s SER 113 Cb -0.15 1.62 0.00 0.00 0.21 0.00 0.00 66.02 67.70 1v5k s SER 113 CO 0.36 -0.23 0.00 -0.24 0.41 0.00 0.00 173.24 173.54 1v5k n SER 114 N 4.72 0.41 0.00 2.44 2.88 -1.26 -5.26 113.62 117.56 1v5k n SER 114 Ca -0.17 0.29 0.00 0.00 -1.33 0.00 0.00 58.87 57.66 1v5k n SER 114 Cb 0.55 0.04 0.00 0.00 -0.75 0.00 0.00 64.21 64.05 1v5k n SER 114 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42