#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jvi n MET 2 N 0.00 -0.44 0.47 2.12 2.00 -1.26 -4.98 117.12 115.03 2jvi n MET 2 Ca 0.00 -0.42 -0.20 0.00 0.00 0.00 0.00 57.70 57.08 2jvi n MET 2 Cb 0.00 -0.29 -0.10 0.00 0.00 0.00 0.00 33.22 32.83 2jvi n MET 2 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 175.97 175.00 2jvi h ASN 3 N -0.51 -1.17 0.00 7.83 -1.24 -1.97 -3.47 115.58 115.06 2jvi h ASN 3 Ca -0.09 0.05 0.00 0.00 0.71 0.00 0.00 56.30 56.98 2jvi h ASN 3 Cb 0.25 0.32 0.00 0.00 0.73 0.00 0.00 38.32 39.62 2jvi h ASN 3 CO 0.06 -0.77 0.00 -1.84 -1.29 0.00 0.00 177.43 173.60 2jvi n GLU 4 N -5.63 0.00 -3.62 6.67 0.00 -1.26 -4.52 120.64 112.27 2jvi n GLU 4 Ca -0.16 0.00 -0.12 0.00 0.00 0.00 0.00 57.16 56.88 2jvi n GLU 4 Cb 0.51 0.00 -0.07 0.00 0.00 0.00 0.00 31.44 31.88 2jvi n GLU 4 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.13 177.34 2jvi s LYS 5 N -1.04 0.72 0.05 3.44 2.47 -1.26 -3.30 119.74 120.81 2jvi s LYS 5 Ca 0.00 0.73 0.02 0.00 -1.56 0.00 0.00 55.97 55.16 2jvi s LYS 5 Cb 0.00 0.35 -0.03 0.00 -1.46 0.00 0.00 37.83 36.69 2jvi s LYS 5 CO 0.00 -0.11 -0.07 0.42 0.16 0.00 0.00 175.35 175.75 2jvi s ILE 6 N 0.10 0.51 -0.09 5.43 1.01 0.71 -1.29 121.20 127.57 2jvi s ILE 6 Ca 0.00 -1.32 -0.02 0.00 0.00 0.00 0.00 60.65 59.31 2jvi s ILE 6 Cb -0.04 -0.89 0.04 0.00 0.01 0.00 0.00 42.46 41.57 2jvi s ILE 6 CO -0.01 -0.55 0.03 -0.22 0.00 0.00 0.00 174.94 174.19 2jvi s LEU 7 N -2.01 0.51 -0.39 2.97 0.20 -0.30 0.46 118.68 120.12 2jvi s LEU 7 Ca -0.04 -0.20 -0.09 0.00 0.69 0.00 0.00 54.13 54.48 2jvi s LEU 7 Cb -0.05 -0.35 0.05 0.00 -0.43 0.00 0.00 46.19 45.41 2jvi s LEU 7 CO -0.02 -0.24 0.21 -0.63 -0.29 0.00 0.00 176.35 175.38 2jvi s ILE 8 N 2.03 4.28 -1.18 6.68 1.09 0.61 0.11 121.20 134.83 2jvi s ILE 8 Ca 0.04 -1.13 -0.10 0.00 -1.10 0.00 0.00 60.65 58.36 2jvi s ILE 8 Cb -0.13 -3.49 0.22 0.00 -1.06 0.00 0.00 42.46 38.00 2jvi s ILE 8 CO -0.05 -0.33 1.46 0.52 -0.10 0.00 0.00 174.94 176.43 2jvi n VAL 9 N 4.93 4.54 -5.00 2.92 0.31 0.22 0.62 118.33 126.87 2jvi n VAL 9 Ca -0.11 -5.02 -0.29 0.00 -0.01 0.00 0.00 64.34 58.91 2jvi n VAL 9 Cb 0.44 -2.41 -0.16 0.00 -0.91 0.00 0.00 33.84 30.80 2jvi n VAL 9 CO 0.00 0.00 0.00 -1.81 -1.32 0.00 0.00 176.83 173.70 2jvi s ASP 10 N 1.24 2.56 0.06 4.52 1.11 0.15 -0.91 116.67 125.39 2jvi s ASP 10 Ca 0.37 -0.44 -0.13 0.00 0.18 0.00 0.00 52.55 52.54 2jvi s ASP 10 Cb -0.01 -0.91 -0.29 0.00 1.07 0.00 0.00 42.92 42.79 2jvi s ASP 10 CO -0.00 0.16 1.10 -0.78 1.18 0.00 0.00 175.17 176.83 2jvi h ASP 11 N 6.45 0.80 -0.21 0.27 3.58 -1.80 -3.33 116.42 122.18 2jvi h ASP 11 Ca -0.29 -0.77 -0.22 0.00 0.42 0.00 0.00 57.03 56.18 2jvi h ASP 11 Cb 1.19 -0.25 0.00 0.00 1.72 0.00 0.00 39.33 41.99 2jvi h ASP 11 CO 0.47 1.58 0.68 0.00 -2.88 0.00 0.00 179.24 179.09 2jvi n GLN 12 N -3.74 0.72 0.21 0.28 3.00 -1.26 -4.71 117.38 111.88 2jvi n GLN 12 Ca -0.13 -1.93 0.11 0.00 -0.01 0.00 0.00 57.00 55.04 2jvi n GLN 12 Cb 1.01 -3.67 0.60 0.00 0.00 0.00 0.00 30.24 28.18 2jvi n GLN 12 CO 0.00 0.00 0.00 0.10 0.00 0.00 0.00 177.06 177.16 2jvi h TYR 13 N 10.55 0.00 0.53 1.08 -0.00 -1.97 0.01 116.97 127.17 2jvi h TYR 13 Ca 0.13 0.00 -0.02 0.00 0.00 0.00 0.00 58.73 58.85 2jvi h TYR 13 Cb 0.93 0.00 -0.02 0.00 0.00 0.00 0.00 36.73 37.64 2jvi h TYR 13 CO 1.09 0.00 -0.50 0.78 -0.00 0.00 0.00 178.16 179.53 2jvi h GLY 14 N 0.00 -1.28 1.75 0.10 0.00 -1.92 0.88 103.07 102.60 2jvi h GLY 14 Ca 0.00 0.59 0.03 0.00 0.00 0.00 0.00 47.33 47.94 2jvi h GLY 14 CO 0.00 -0.38 0.10 -2.22 0.00 0.00 0.00 176.54 174.04 2jvi h ILE 15 N -1.02 0.50 0.07 2.60 1.08 -1.40 -1.27 117.51 118.07 2jvi h ILE 15 Ca -0.07 0.00 -0.11 0.00 -0.39 0.00 0.00 64.86 64.29 2jvi h ILE 15 Cb 0.88 0.92 0.01 0.00 -3.07 0.00 0.00 36.82 35.56 2jvi h ILE 15 CO -0.05 0.00 -0.47 -0.09 -0.69 0.00 0.00 178.15 176.85 2jvi h ARG 16 N 0.00 0.19 0.00 2.37 2.43 -1.05 0.17 114.38 118.50 2jvi h ARG 16 Ca 0.04 -0.30 -0.13 0.00 -0.81 0.00 0.00 59.98 58.78 2jvi h ARG 16 Cb 0.25 0.11 -0.02 0.00 -0.42 0.00 0.00 29.97 29.89 2jvi h ARG 16 CO -0.00 1.12 -0.62 -0.84 -1.51 0.00 0.00 179.97 178.12 2jvi h ILE 17 N -0.59 1.16 0.22 1.20 3.07 -0.73 0.40 117.51 122.23 2jvi h ILE 17 Ca -0.08 -2.38 -0.01 0.00 1.55 0.00 0.00 64.86 63.94 2jvi h ILE 17 Cb 1.35 2.40 -0.00 0.00 -0.27 0.00 0.00 36.82 40.29 2jvi h ILE 17 CO 0.09 0.61 -0.16 0.25 -1.05 0.00 0.00 178.15 177.89 2jvi h LEU 18 N 0.00 -0.42 -0.78 0.16 5.85 -1.20 0.29 115.31 119.21 2jvi h LEU 18 Ca -0.01 0.03 0.12 0.00 0.84 0.00 0.00 57.88 58.86 2jvi h LEU 18 Cb 1.35 0.13 -0.08 0.00 0.37 0.00 0.00 40.66 42.42 2jvi h LEU 18 CO 0.08 -0.23 0.40 -0.07 -0.34 0.00 0.00 178.44 178.28 2jvi h LEU 19 N -0.36 0.50 0.00 2.25 4.07 -0.67 -0.09 115.31 121.01 2jvi h LEU 19 Ca -0.03 0.07 0.00 0.00 0.08 0.00 0.00 57.88 58.01 2jvi h LEU 19 Cb 0.30 -0.01 0.00 0.00 1.08 0.00 0.00 40.66 42.03 2jvi h LEU 19 CO 0.01 0.25 0.00 -3.20 -1.08 0.00 0.00 178.44 174.42 2jvi n ASN 20 N -4.86 0.00 -0.34 -0.43 5.15 0.14 -1.45 115.26 113.47 2jvi n ASN 20 Ca 0.14 1.00 0.07 0.00 -0.60 0.00 0.00 54.58 55.19 2jvi n ASN 20 Cb 0.35 -0.50 0.26 0.00 -0.53 0.00 0.00 39.78 39.36 2jvi n ASN 20 CO 0.00 0.00 0.00 -0.33 1.40 0.00 0.00 177.26 178.33 2jvi h GLU 21 N 0.00 0.93 0.23 1.20 4.39 -0.79 0.38 114.58 120.92 2jvi h GLU 21 Ca 0.00 -0.06 0.00 0.00 0.34 0.00 0.00 59.36 59.64 2jvi h GLU 21 Cb 0.00 -0.21 -0.01 0.00 -0.10 0.00 0.00 28.75 28.42 2jvi h GLU 21 CO 0.00 0.62 -0.20 0.28 -1.16 0.00 0.00 179.01 178.55 2jvi h VAL 22 N 0.96 0.57 0.09 3.13 2.07 -0.65 0.21 116.25 122.63 2jvi h VAL 22 Ca 0.47 0.00 -0.29 0.00 0.82 0.00 0.00 66.70 67.70 2jvi h VAL 22 Cb 0.47 0.57 0.03 0.00 -1.52 0.00 0.00 31.29 30.83 2jvi h VAL 22 CO -0.23 0.00 -1.18 -0.26 0.02 0.00 0.00 177.57 175.92 2jvi h PHE 23 N -0.45 1.01 -0.76 1.57 0.04 -1.01 -3.24 116.94 114.10 2jvi h PHE 23 Ca -0.01 -0.61 0.15 0.00 2.80 0.00 0.00 57.97 60.30 2jvi h PHE 23 Cb 0.41 -0.09 -0.10 0.00 2.20 0.00 0.00 35.95 38.37 2jvi h PHE 23 CO -0.14 1.45 0.29 -0.97 -0.60 0.00 0.00 178.31 178.35 2jvi h ASN 24 N 0.28 0.25 -0.68 2.17 -0.73 -0.12 0.40 115.58 117.15 2jvi h ASN 24 Ca -0.17 0.11 0.07 0.00 1.87 0.00 0.00 56.30 58.18 2jvi h ASN 24 Cb 1.85 0.10 -0.06 0.00 0.27 0.00 0.00 38.32 40.48 2jvi h ASN 24 CO 0.23 0.08 0.36 0.50 -0.37 0.00 0.00 177.43 178.23 2jvi h LYS 25 N 0.42 0.63 -0.66 6.67 3.11 -0.61 0.25 116.57 126.37 2jvi h LYS 25 Ca 0.42 -0.04 0.10 0.00 -2.81 0.00 0.00 60.65 58.32 2jvi h LYS 25 Cb 0.65 -0.14 -0.04 0.00 -1.00 0.00 0.00 32.23 31.70 2jvi h LYS 25 CO -0.42 0.42 0.44 0.93 -2.81 0.00 0.00 179.45 178.01 2jvi h GLU 26 N 0.65 0.48 0.00 1.90 4.39 -1.09 -3.44 114.58 117.47 2jvi h GLU 26 Ca 0.32 -0.03 0.00 0.00 0.34 0.00 0.00 59.36 59.99 2jvi h GLU 26 Cb 0.26 -0.11 0.00 0.00 -0.10 0.00 0.00 28.75 28.80 2jvi h GLU 26 CO -0.22 0.32 0.00 0.41 -1.16 0.00 0.00 179.01 178.36 2jvi n GLY 27 N -1.50 0.51 3.75 -3.84 0.00 0.78 -4.64 105.19 100.25 2jvi n GLY 27 Ca 0.11 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.72 2jvi n GLY 27 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2jvi s TYR 28 N 0.00 2.94 -1.29 1.61 2.02 -0.05 -4.87 117.35 117.70 2jvi s TYR 28 Ca 0.00 0.94 -0.15 0.00 -0.37 0.00 0.00 57.07 57.49 2jvi s TYR 28 Cb 0.00 -3.90 0.11 0.00 -0.40 0.00 0.00 41.96 37.77 2jvi s TYR 28 CO 0.00 -2.97 1.73 1.04 -1.57 0.00 0.00 175.55 173.78 2jvi n GLN 29 N 2.35 3.25 -3.31 -0.62 6.02 -1.21 -3.56 117.38 120.30 2jvi n GLN 29 Ca 0.07 -3.39 -0.38 0.00 -0.01 0.00 0.00 57.00 53.29 2jvi n GLN 29 Cb 0.39 -3.26 -0.06 0.00 1.02 0.00 0.00 30.24 28.34 2jvi n GLN 29 CO 0.00 0.00 0.00 0.95 -1.01 0.00 0.00 177.06 177.00 2jvi s THR 30 N 2.79 4.96 -0.06 5.09 -4.23 -1.25 -0.21 115.64 122.73 2jvi s THR 30 Ca 0.48 1.08 0.02 0.00 -1.18 0.00 0.00 61.69 62.10 2jvi s THR 30 Cb 0.04 -3.85 0.01 0.00 1.34 0.00 0.00 72.50 70.04 2jvi s THR 30 CO 0.02 0.47 -0.12 -0.36 -0.54 0.00 0.00 174.62 174.09 2jvi s PHE 31 N -0.43 1.44 -0.22 3.99 0.40 0.17 -4.89 117.98 118.44 2jvi s PHE 31 Ca 0.28 -0.52 -0.23 0.00 -0.60 0.00 0.00 56.93 55.85 2jvi s PHE 31 Cb -0.17 -1.06 -0.01 0.00 0.51 0.00 0.00 43.02 42.29 2jvi s PHE 31 CO 0.15 -0.27 0.76 1.14 0.70 0.00 0.00 175.22 177.71 2jvi s GLN 32 N 0.63 4.20 -0.03 0.44 -2.07 -1.26 -0.28 119.66 121.28 2jvi s GLN 32 Ca -0.14 0.83 0.06 0.00 -1.82 0.00 0.00 55.36 54.30 2jvi s GLN 32 Cb -0.15 -3.62 -0.01 0.00 -1.09 0.00 0.00 33.01 28.13 2jvi s GLN 32 CO 0.04 -0.42 -0.23 0.00 -1.32 0.00 0.00 175.29 173.36 2jvi s ALA 33 N 2.50 1.96 -0.79 2.60 0.00 0.20 -4.91 121.76 123.33 2jvi s ALA 33 Ca 0.33 -0.98 0.23 0.00 0.00 0.00 0.00 51.96 51.54 2jvi s ALA 33 Cb -0.16 -0.55 0.06 0.00 0.00 0.00 0.00 23.12 22.47 2jvi s ALA 33 CO 0.09 0.43 1.06 0.00 0.00 0.00 0.00 175.76 177.34 2jvi n ALA 34 N 2.73 3.80 -2.83 0.00 0.00 -1.25 0.30 120.51 123.26 2jvi n ALA 34 Ca -0.17 -0.45 -0.10 0.00 0.00 0.00 0.00 53.44 52.73 2jvi n ALA 34 Cb 0.52 -0.94 -0.07 0.00 0.00 0.00 0.00 19.45 18.96 2jvi n ALA 34 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 2jvi s ASN 35 N -3.47 -0.01 0.55 0.00 4.22 -1.26 -3.85 114.94 111.11 2jvi s ASN 35 Ca 0.06 -0.87 0.33 0.00 -2.14 0.00 0.00 52.86 50.24 2jvi s ASN 35 Cb 0.16 0.47 1.43 0.00 1.28 0.00 0.00 41.25 44.59 2jvi s ASN 35 CO 0.80 -0.95 2.01 1.23 -2.04 0.00 0.00 177.10 178.15 2jvi h GLY 36 N 2.46 0.00 0.76 0.45 0.00 -1.92 0.64 103.07 105.46 2jvi h GLY 36 Ca -0.31 0.00 -0.22 0.00 0.00 0.00 0.00 47.33 46.80 2jvi h GLY 36 CO 0.45 0.00 -1.02 1.41 0.00 0.00 0.00 176.54 177.38 2jvi h LEU 37 N 0.00 0.52 -1.15 3.11 -0.00 -1.98 0.27 115.31 116.08 2jvi h LEU 37 Ca -0.00 -0.93 -0.04 0.00 -0.00 0.00 0.00 57.88 56.90 2jvi h LEU 37 Cb 0.48 -0.17 -0.02 0.00 -0.00 0.00 0.00 40.66 40.95 2jvi h LEU 37 CO 0.00 1.48 0.13 -0.61 -0.00 0.00 0.00 178.44 179.45 2jvi h GLN 38 N -0.28 0.72 -0.24 1.13 4.15 -1.86 0.13 115.11 118.86 2jvi h GLN 38 Ca -0.19 -0.13 -0.03 0.00 0.77 0.00 0.00 58.65 59.08 2jvi h GLN 38 Cb 1.75 -0.12 -0.01 0.00 0.21 0.00 0.00 27.48 29.31 2jvi h GLN 38 CO 0.16 0.65 0.05 0.00 -1.93 0.00 0.00 178.83 177.76 2jvi h ALA 39 N 1.44 0.32 -0.42 3.38 0.00 0.38 0.29 119.26 124.65 2jvi h ALA 39 Ca 0.16 -0.17 0.07 0.00 0.00 0.00 0.00 54.91 54.98 2jvi h ALA 39 Cb 0.24 -0.09 -0.06 0.00 0.00 0.00 0.00 17.79 17.88 2jvi h ALA 39 CO -0.01 -0.02 0.04 1.25 0.00 0.00 0.00 179.25 180.51 2jvi h LEU 40 N 0.22 -0.10 -0.75 0.00 7.12 0.24 0.60 115.31 122.64 2jvi h LEU 40 Ca 0.08 0.09 0.05 0.00 0.13 0.00 0.00 57.88 58.23 2jvi h LEU 40 Cb 0.29 0.14 -0.05 0.00 -0.53 0.00 0.00 40.66 40.51 2jvi h LEU 40 CO 0.00 -0.02 0.45 -0.78 -0.13 0.00 0.00 178.44 177.97 2jvi h ASP 41 N 0.15 0.71 -0.40 1.25 3.58 -0.30 -0.33 116.42 121.09 2jvi h ASP 41 Ca 0.21 0.02 -0.02 0.00 0.42 0.00 0.00 57.03 57.65 2jvi h ASP 41 Cb 0.29 -0.13 -0.02 0.00 1.72 0.00 0.00 39.33 41.19 2jvi h ASP 41 CO -0.32 0.47 0.16 0.40 -2.88 0.00 0.00 179.24 177.07 2jvi h ILE 42 N 0.85 1.20 -0.79 2.25 1.08 0.10 0.22 117.51 122.41 2jvi h ILE 42 Ca 0.32 -0.61 -0.01 0.00 -0.39 0.00 0.00 64.86 64.18 2jvi h ILE 42 Cb 0.13 0.86 -0.04 0.00 -3.07 0.00 0.00 36.82 34.70 2jvi h ILE 42 CO -0.16 0.22 0.47 0.58 -0.69 0.00 0.00 178.15 178.58 2jvi h VAL 43 N 0.50 1.22 0.00 1.67 2.07 -0.55 0.30 116.25 121.45 2jvi h VAL 43 Ca 0.13 -0.50 -0.04 0.00 0.82 0.00 0.00 66.70 67.11 2jvi h VAL 43 Cb 0.19 0.12 -0.01 0.00 -1.52 0.00 0.00 31.29 30.08 2jvi h VAL 43 CO -0.01 0.24 -0.21 0.00 0.02 0.00 0.00 177.57 177.61 2jvi h THR 44 N 1.08 0.55 0.04 2.57 1.03 -0.58 0.63 112.91 118.24 2jvi h THR 44 Ca 0.28 -1.02 -0.27 0.00 -0.01 0.00 0.00 66.41 65.39 2jvi h THR 44 Cb -0.03 1.69 -0.03 0.00 -1.07 0.00 0.00 68.15 68.71 2jvi h THR 44 CO -0.05 0.20 -1.47 0.07 -0.01 0.00 0.00 175.52 174.26 2jvi h LYS 45 N 0.00 0.09 0.00 0.00 2.10 0.26 -3.43 116.57 115.59 2jvi h LYS 45 Ca -0.00 -0.15 -0.22 0.00 -2.00 0.00 0.00 60.65 58.28 2jvi h LYS 45 Cb 0.68 0.06 -0.04 0.00 -0.90 0.00 0.00 32.23 32.02 2jvi h LYS 45 CO 0.03 1.07 -1.85 0.39 -2.00 0.00 0.00 179.45 177.09 2jvi n GLU 46 N -4.14 0.73 -2.63 0.07 -0.58 0.97 -5.06 120.64 110.00 2jvi n GLU 46 Ca -0.32 0.07 -0.05 0.00 -0.42 0.00 0.00 57.16 56.45 2jvi n GLU 46 Cb 0.79 -1.30 0.02 0.00 -0.57 0.00 0.00 31.44 30.39 2jvi n GLU 46 CO 0.00 0.00 0.00 0.54 -0.48 0.00 0.00 177.13 177.19 2jvi n ARG 47 N -2.83 -1.19 -1.08 3.49 1.74 0.22 -5.02 116.66 111.99 2jvi n ARG 47 Ca -0.25 0.93 -0.32 0.00 -0.77 0.00 0.00 57.85 57.44 2jvi n ARG 47 Cb 0.80 -4.45 0.12 0.00 -1.02 0.00 0.00 32.46 27.91 2jvi n ARG 47 CO 0.00 0.00 0.00 -2.14 -1.52 0.00 0.00 177.63 173.97 2jvi s PRO 48 N -3.42 1.74 -0.16 5.56 0.02 -1.26 -4.89 135.00 132.59 2jvi s PRO 48 Ca 0.14 1.46 -0.01 0.00 0.02 0.00 0.00 61.00 62.61 2jvi s PRO 48 Cb -0.02 -1.82 -0.23 0.00 0.02 0.00 0.00 34.50 32.45 2jvi s PRO 48 CO 0.51 -2.08 0.21 -0.25 -0.33 0.00 0.00 177.00 175.07 2jvi n ASP 49 N -3.60 1.85 -4.19 2.53 9.92 -0.42 -4.67 116.55 117.98 2jvi n ASP 49 Ca 0.11 0.12 -0.35 0.00 -0.53 0.00 0.00 54.79 54.14 2jvi n ASP 49 Cb 0.52 -0.56 -0.14 0.00 -0.64 0.00 0.00 41.12 40.30 2jvi n ASP 49 CO 0.00 0.00 0.00 -0.76 0.13 0.00 0.00 177.20 176.57 2jvi s LEU 50 N -6.72 3.70 -0.30 0.64 1.02 -0.95 0.52 118.68 116.60 2jvi s LEU 50 Ca -0.24 -1.13 -0.04 0.00 0.02 0.00 0.00 54.13 52.74 2jvi s LEU 50 Cb 0.07 -1.71 0.04 0.00 0.02 0.00 0.00 46.19 44.61 2jvi s LEU 50 CO 0.73 -0.22 0.03 -0.69 0.02 0.00 0.00 176.35 176.22 2jvi s VAL 51 N 1.29 3.33 -0.90 -1.59 1.01 0.64 -1.15 120.40 123.03 2jvi s VAL 51 Ca -0.03 -1.13 -0.25 0.00 0.00 0.00 0.00 61.98 60.57 2jvi s VAL 51 Cb -0.19 -2.83 0.03 0.00 0.00 0.00 0.00 36.38 33.40 2jvi s VAL 51 CO -0.02 -0.03 1.46 -0.76 0.00 0.00 0.00 175.10 175.75 2jvi s LEU 52 N 1.35 3.35 -0.76 3.92 1.02 0.30 0.51 118.68 128.36 2jvi s LEU 52 Ca -0.02 -0.96 -0.22 0.00 0.02 0.00 0.00 54.13 52.94 2jvi s LEU 52 Cb -0.19 -2.56 0.08 0.00 0.02 0.00 0.00 46.19 43.54 2jvi s LEU 52 CO -0.00 -1.77 1.08 -0.22 0.02 0.00 0.00 176.35 175.46 2jvi s LEU 53 N 5.91 4.28 -0.11 1.79 1.98 -1.05 0.71 118.68 132.19 2jvi s LEU 53 Ca 0.46 -1.18 -0.29 0.00 -2.89 0.00 0.00 54.13 50.22 2jvi s LEU 53 Cb -0.04 -2.45 -0.06 0.00 0.66 0.00 0.00 46.19 44.31 2jvi s LEU 53 CO 0.00 -1.42 1.89 -0.62 -1.89 0.00 0.00 176.35 174.31 2jvi s ASP 54 N 3.80 6.21 0.00 3.68 -1.08 -0.08 -0.65 116.67 128.54 2jvi s ASP 54 Ca 0.28 2.11 0.19 0.00 -0.52 0.00 0.00 52.55 54.61 2jvi s ASP 54 Cb -0.12 -2.53 0.52 0.00 -1.46 0.00 0.00 42.92 39.34 2jvi s ASP 54 CO 0.05 -1.32 1.43 0.23 0.52 0.00 0.00 175.17 176.07 2jvi n MET 55 N 7.83 2.14 0.15 4.34 2.81 0.25 -4.43 117.12 130.22 2jvi n MET 55 Ca 0.22 -1.76 -0.06 0.00 -1.81 0.00 0.00 57.70 54.29 2jvi n MET 55 Cb 0.43 -1.42 -0.03 0.00 -0.71 0.00 0.00 33.22 31.49 2jvi n MET 55 CO 0.00 0.00 0.00 0.87 1.51 0.00 0.00 175.97 178.35 2jvi h LYS 56 N 3.12 -0.39 0.00 0.03 1.79 -1.81 -3.46 116.57 115.86 2jvi h LYS 56 Ca 0.00 0.03 0.00 0.00 -2.18 0.00 0.00 60.65 58.50 2jvi h LYS 56 Cb 0.70 0.09 0.00 0.00 -1.58 0.00 0.00 32.23 31.44 2jvi h LYS 56 CO 0.00 -0.26 0.00 1.51 -1.08 0.00 0.00 179.45 179.62 2jvi n ILE 57 N -3.27 0.00 -0.13 1.86 3.06 -1.26 -5.01 119.36 114.60 2jvi n ILE 57 Ca -0.05 0.00 0.01 0.00 -2.50 0.00 0.00 62.75 60.21 2jvi n ILE 57 Cb 0.16 0.00 0.03 0.00 0.54 0.00 0.00 39.64 40.37 2jvi n ILE 57 CO 0.00 0.00 0.00 -2.65 -2.50 0.00 0.00 176.55 171.40 2jvi n PRO 58 N 0.00 -0.06 0.11 9.51 -0.02 -1.26 -4.58 135.00 138.70 2jvi n PRO 58 Ca 0.00 0.55 0.00 0.00 -2.02 0.00 0.00 63.50 62.03 2jvi n PRO 58 Cb 0.00 -0.83 0.00 0.00 -0.02 0.00 0.00 33.50 32.65 2jvi n PRO 58 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2jvi n GLY 59 N -1.20 -1.19 3.40 -1.23 0.00 -1.26 -4.75 105.19 98.96 2jvi n GLY 59 Ca 0.05 0.20 -0.10 0.00 0.00 0.00 0.00 46.02 46.17 2jvi n GLY 59 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 2jvi s MET 60 N -2.00 1.28 0.29 1.61 -2.45 -1.26 -4.99 119.30 111.78 2jvi s MET 60 Ca 0.00 -1.20 -0.30 0.00 -1.25 0.00 0.00 55.69 52.94 2jvi s MET 60 Cb 0.00 0.40 -0.11 0.00 1.25 0.00 0.00 34.83 36.37 2jvi s MET 60 CO 0.00 -0.49 1.61 -0.51 1.05 0.00 0.00 175.02 176.68 2jvi s ASP 61 N -2.99 6.35 0.03 1.11 1.01 -1.26 -4.70 116.67 116.21 2jvi s ASP 61 Ca 0.20 2.97 0.06 0.00 0.71 0.00 0.00 52.55 56.48 2jvi s ASP 61 Cb 0.02 -2.64 0.25 0.00 1.01 0.00 0.00 42.92 41.57 2jvi s ASP 61 CO 0.03 -0.93 1.17 0.61 0.21 0.00 0.00 175.17 176.26 2jvi n GLY 62 N 2.18 -0.66 0.10 0.21 0.00 -1.26 -1.86 105.19 103.89 2jvi n GLY 62 Ca 0.08 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.93 2jvi n GLY 62 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 2jvi h ILE 63 N 0.00 1.44 -0.42 -0.61 2.04 -1.92 0.81 117.51 118.85 2jvi h ILE 63 Ca 0.00 -2.37 -0.06 0.00 1.00 0.00 0.00 64.86 63.43 2jvi h ILE 63 Cb 0.07 3.02 -0.02 0.00 -0.74 0.00 0.00 36.82 39.15 2jvi h ILE 63 CO 0.00 0.59 0.00 -0.33 0.00 0.00 0.00 178.15 178.42 2jvi h GLU 64 N -0.74 0.67 -0.20 2.37 4.39 -1.75 0.13 114.58 119.45 2jvi h GLU 64 Ca -0.15 -0.16 -0.19 0.00 0.34 0.00 0.00 59.36 59.20 2jvi h GLU 64 Cb 1.33 -0.09 0.00 0.00 -0.10 0.00 0.00 28.75 29.89 2jvi h GLU 64 CO 0.00 0.69 -0.65 0.82 -1.16 0.00 0.00 179.01 178.71 2jvi h ILE 65 N 0.64 1.30 -0.38 3.13 2.04 -1.49 -2.28 117.51 120.46 2jvi h ILE 65 Ca 0.13 -1.87 0.07 0.00 1.00 0.00 0.00 64.86 64.19 2jvi h ILE 65 Cb 0.39 1.83 -0.07 0.00 -0.74 0.00 0.00 36.82 38.24 2jvi h ILE 65 CO 0.01 0.59 -0.05 0.25 0.00 0.00 0.00 178.15 178.95 2jvi h LEU 66 N 0.53 -0.27 -0.43 1.44 6.46 0.10 -1.28 115.31 121.87 2jvi h LEU 66 Ca -0.01 0.10 -0.18 0.00 -0.12 0.00 0.00 57.88 57.67 2jvi h LEU 66 Cb 1.25 0.20 -0.00 0.00 -0.73 0.00 0.00 40.66 41.38 2jvi h LEU 66 CO 0.13 -0.09 -0.68 0.07 -0.62 0.00 0.00 178.44 177.25 2jvi h LYS 67 N 0.04 0.47 -0.29 1.25 2.10 -0.72 0.46 116.57 119.88 2jvi h LYS 67 Ca 0.19 -0.35 -0.05 0.00 -2.00 0.00 0.00 60.65 58.43 2jvi h LYS 67 Cb 0.28 0.07 -0.02 0.00 -0.90 0.00 0.00 32.23 31.66 2jvi h LYS 67 CO -0.36 0.98 -0.05 0.07 -2.00 0.00 0.00 179.45 178.09 2jvi h ARG 68 N 0.33 0.45 0.00 0.07 0.11 -1.16 0.43 114.38 114.61 2jvi h ARG 68 Ca -0.02 -0.10 0.00 0.00 0.10 0.00 0.00 59.98 59.95 2jvi h ARG 68 Cb 1.25 -0.06 0.00 0.00 1.11 0.00 0.00 29.97 32.27 2jvi h ARG 68 CO 0.12 0.53 -0.27 0.00 0.10 0.00 0.00 179.97 180.45 2jvi h MET 69 N 0.43 0.00 -0.20 0.08 -0.00 -0.78 -2.13 114.93 112.33 2jvi h MET 69 Ca 0.09 0.00 -0.20 0.00 -0.00 0.00 0.00 59.70 59.59 2jvi h MET 69 Cb 0.37 0.00 0.00 0.00 -0.00 0.00 0.00 31.60 31.97 2jvi h MET 69 CO 0.02 0.00 -0.66 0.87 -0.00 0.00 0.00 176.91 177.14 2jvi h LYS 70 N 0.00 0.75 -0.67 -0.10 6.56 0.76 0.59 116.57 124.46 2jvi h LYS 70 Ca 0.00 -0.54 -0.05 0.00 -1.06 0.00 0.00 60.65 59.00 2jvi h LYS 70 Cb 0.83 0.09 -0.03 0.00 -0.57 0.00 0.00 32.23 32.54 2jvi h LYS 70 CO 0.00 1.16 0.21 0.28 -2.06 0.00 0.00 179.45 179.04 2jvi h VAL 71 N 0.54 1.24 0.00 0.50 2.07 0.27 0.36 116.25 121.24 2jvi h VAL 71 Ca -0.02 -0.83 -0.24 0.00 0.82 0.00 0.00 66.70 66.43 2jvi h VAL 71 Cb 1.26 0.50 -0.04 0.00 -1.52 0.00 0.00 31.29 31.49 2jvi h VAL 71 CO 0.13 0.32 -1.26 0.16 0.02 0.00 0.00 177.57 176.95 2jvi h ILE 72 N 0.98 1.40 -1.22 4.57 3.07 -1.43 -3.44 117.51 121.45 2jvi h ILE 72 Ca 0.22 -3.16 -0.15 0.00 1.55 0.00 0.00 64.86 63.32 2jvi h ILE 72 Cb 0.27 2.69 -0.21 0.00 -0.27 0.00 0.00 36.82 39.30 2jvi h ILE 72 CO -0.01 0.80 -0.52 -1.81 -1.05 0.00 0.00 178.15 175.56 2jvi s ASP 73 N -6.48 -0.93 0.00 2.16 1.01 0.21 -4.97 116.67 107.66 2jvi s ASP 73 Ca -0.01 -1.16 0.10 0.00 0.71 0.00 0.00 52.55 52.18 2jvi s ASP 73 Cb 0.09 1.62 0.56 0.00 1.01 0.00 0.00 42.92 46.21 2jvi s ASP 73 CO 0.82 -0.17 1.11 -0.62 0.21 0.00 0.00 175.17 176.52 2jvi n GLU 74 N 4.08 0.25 0.18 8.23 1.02 0.12 -0.00 120.64 134.52 2jvi n GLU 74 Ca 0.13 0.08 0.05 0.00 -0.02 0.00 0.00 57.16 57.40 2jvi n GLU 74 Cb 0.54 -1.50 0.29 0.00 -0.02 0.00 0.00 31.44 30.75 2jvi n GLU 74 CO 0.00 0.00 0.00 -0.97 1.18 0.00 0.00 177.13 177.34 2jvi h ASN 75 N 0.00 0.00 -4.19 1.62 -1.24 -1.87 -3.45 115.58 106.45 2jvi h ASN 75 Ca 0.00 0.00 -0.50 0.00 0.71 0.00 0.00 56.30 56.51 2jvi h ASN 75 Cb 0.04 0.00 0.09 0.00 0.73 0.00 0.00 38.32 39.17 2jvi h ASN 75 CO 0.00 0.39 0.38 -0.51 -1.29 0.00 0.00 177.43 176.40 2jvi s ILE 76 N -3.49 3.44 0.29 2.57 2.07 1.00 -4.89 121.20 122.18 2jvi s ILE 76 Ca 0.01 0.69 0.04 0.00 -1.41 0.00 0.00 60.65 59.98 2jvi s ILE 76 Cb 0.10 -3.22 -0.03 0.00 0.13 0.00 0.00 42.46 39.44 2jvi s ILE 76 CO 0.69 -0.39 0.21 0.00 -1.91 0.00 0.00 174.94 173.54 2jvi s ARG 77 N -4.02 1.58 -0.00 3.50 1.70 0.19 -4.89 118.95 117.00 2jvi s ARG 77 Ca 0.66 -1.90 -0.02 0.00 -0.47 0.00 0.00 55.73 54.00 2jvi s ARG 77 Cb -0.19 0.18 -0.00 0.00 -0.57 0.00 0.00 34.95 34.37 2jvi s ARG 77 CO 0.39 -0.53 0.04 0.14 -1.08 0.00 0.00 175.30 174.25 2jvi s VAL 78 N -3.67 0.06 -0.88 4.99 -7.23 -0.45 -0.26 120.40 112.96 2jvi s VAL 78 Ca 0.39 -0.47 -0.00 0.00 -1.81 0.00 0.00 61.98 60.08 2jvi s VAL 78 Cb 0.04 -0.22 0.25 0.00 0.56 0.00 0.00 36.38 37.01 2jvi s VAL 78 CO 0.21 -0.26 0.92 -0.38 -0.31 0.00 0.00 175.10 175.27 2jvi n ILE 79 N 2.20 3.33 -2.11 -0.62 5.41 0.18 0.57 119.36 128.32 2jvi n ILE 79 Ca -0.19 -5.31 -0.41 0.00 1.00 0.00 0.00 62.75 57.85 2jvi n ILE 79 Cb 0.57 -2.25 -0.02 0.00 -0.71 0.00 0.00 39.64 37.23 2jvi n ILE 79 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 176.55 176.82 2jvi s ILE 80 N -1.93 2.72 -0.27 1.39 -0.00 -0.66 -2.52 121.20 119.94 2jvi s ILE 80 Ca 0.31 0.72 -0.10 0.00 -0.00 0.00 0.00 60.65 61.58 2jvi s ILE 80 Cb 0.01 -3.46 -0.05 0.00 -0.00 0.00 0.00 42.46 38.96 2jvi s ILE 80 CO -0.05 0.17 0.16 -0.04 -0.00 0.00 0.00 174.94 175.18 2jvi s MET 81 N -1.70 3.89 0.19 0.37 -1.94 0.17 -1.61 119.30 118.68 2jvi s MET 81 Ca 0.49 -0.35 0.03 0.00 -1.71 0.00 0.00 55.69 54.15 2jvi s MET 81 Cb -0.40 -3.59 -0.05 0.00 2.01 0.00 0.00 34.83 32.81 2jvi s MET 81 CO 0.52 -0.17 -0.01 -0.08 -0.01 0.00 0.00 175.02 175.27 2jvi s THR 82 N 1.71 0.85 -0.23 2.05 -1.32 0.58 0.86 115.64 120.13 2jvi s THR 82 Ca 0.07 -2.01 -0.02 0.00 -1.21 0.00 0.00 61.69 58.52 2jvi s THR 82 Cb -0.16 -2.19 -0.03 0.00 -1.51 0.00 0.00 72.50 68.61 2jvi s THR 82 CO 0.09 -0.43 1.33 0.00 -2.21 0.00 0.00 174.62 173.40 2jvi n ALA 83 N -0.31 2.30 -0.92 11.08 0.00 -1.26 -3.93 120.51 127.48 2jvi n ALA 83 Ca -0.06 -0.63 0.00 0.00 0.00 0.00 0.00 53.44 52.75 2jvi n ALA 83 Cb 0.63 -2.55 0.00 0.00 0.00 0.00 0.00 19.45 17.53 2jvi n ALA 83 CO 0.00 0.00 0.00 0.98 0.00 0.00 0.00 177.50 178.48 2jvi n TYR 84 N 4.13 0.00 -0.24 0.00 9.36 -1.26 -4.28 117.16 124.87 2jvi n TYR 84 Ca 0.14 0.00 0.00 0.00 3.32 0.00 0.00 57.90 61.36 2jvi n TYR 84 Cb 0.09 -0.99 0.00 0.00 -0.63 0.00 0.00 39.34 37.81 2jvi n TYR 84 CO 0.00 0.00 0.00 0.41 0.22 0.00 0.00 176.86 177.49 2jvi n GLY 85 N -1.21 -0.53 0.00 2.98 0.00 -1.26 -4.89 105.19 100.29 2jvi n GLY 85 Ca 0.00 -0.70 0.00 0.00 0.00 0.00 0.00 46.02 45.33 2jvi n GLY 85 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2jvi n GLU 86 N 0.29 0.58 0.00 1.61 1.02 -1.26 -4.96 120.64 117.92 2jvi n GLU 86 Ca 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.14 2jvi n GLU 86 Cb 0.00 -1.02 0.00 0.00 -0.02 0.00 0.00 31.44 30.40 2jvi n GLU 86 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59 2jvi n LEU 87 N -0.52 0.00 0.00 -4.62 4.77 -1.26 -4.80 117.00 110.57 2jvi n LEU 87 Ca 0.01 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.99 2jvi n LEU 87 Cb 0.00 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.09 2jvi n LEU 87 CO 0.00 -1.37 0.00 -0.67 -1.33 0.00 0.00 177.39 174.02 2jvi n ASP 88 N -3.05 0.00 0.27 -1.43 2.03 -1.26 -0.83 116.55 112.28 2jvi n ASP 88 Ca 0.00 0.00 0.14 0.00 0.52 0.00 0.00 54.79 55.45 2jvi n ASP 88 Cb 0.00 0.00 0.75 0.00 -0.72 0.00 0.00 41.12 41.15 2jvi n ASP 88 CO 0.00 0.00 0.00 0.24 -1.92 0.00 0.00 177.20 175.52 2jvi h MET 89 N 0.00 0.00 -0.53 -0.67 2.86 -1.97 -0.60 114.93 114.02 2jvi h MET 89 Ca 0.00 0.00 -0.09 0.00 -2.06 0.00 0.00 59.70 57.55 2jvi h MET 89 Cb 0.00 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 31.64 2jvi h MET 89 CO 0.00 0.10 -0.04 0.82 1.06 0.00 0.00 176.91 178.85 2jvi h ILE 90 N 0.00 1.27 -0.30 -1.22 1.08 -1.29 0.73 117.51 117.77 2jvi h ILE 90 Ca -0.00 -1.16 -0.10 0.00 -0.39 0.00 0.00 64.86 63.21 2jvi h ILE 90 Cb 0.34 0.96 -0.01 0.00 -3.07 0.00 0.00 36.82 35.03 2jvi h ILE 90 CO 0.01 0.41 -0.23 1.56 -0.69 0.00 0.00 178.15 179.22 2jvi h GLN 91 N 0.83 0.58 -0.04 2.37 4.20 -1.49 -2.91 115.11 118.65 2jvi h GLN 91 Ca 0.14 -0.22 -0.15 0.00 0.06 0.00 0.00 58.65 58.49 2jvi h GLN 91 Cb 0.58 -0.04 -0.01 0.00 0.30 0.00 0.00 27.48 28.31 2jvi h GLN 91 CO 0.03 0.76 -0.66 1.49 -0.67 0.00 0.00 178.83 179.79 2jvi h GLU 92 N 0.51 0.16 0.60 1.46 4.81 -0.69 -1.33 114.58 120.12 2jvi h GLU 92 Ca 0.08 -0.13 -0.03 0.00 -0.13 0.00 0.00 59.36 59.15 2jvi h GLU 92 Cb 0.67 0.02 0.00 0.00 0.63 0.00 0.00 28.75 30.07 2jvi h GLU 92 CO 0.05 0.76 -0.32 1.03 -0.73 0.00 0.00 179.01 179.80 2jvi h SER 93 N 0.12 -0.79 -0.95 1.04 0.87 0.68 0.11 113.55 114.62 2jvi h SER 93 Ca -0.01 0.04 0.12 0.00 -1.23 0.00 0.00 61.79 60.70 2jvi h SER 93 Cb 1.18 0.22 -0.08 0.00 -0.44 0.00 0.00 62.40 63.28 2jvi h SER 93 CO 0.10 -0.52 0.61 0.07 -0.53 0.00 0.00 176.83 176.55 2jvi h LYS 94 N -0.85 0.88 0.00 2.24 2.10 -1.60 -1.00 116.57 118.33 2jvi h LYS 94 Ca -0.08 -0.05 -0.03 0.00 -2.00 0.00 0.00 60.65 58.49 2jvi h LYS 94 Cb 0.67 -0.20 -0.00 0.00 -0.90 0.00 0.00 32.23 31.80 2jvi h LYS 94 CO 0.11 0.58 -0.14 1.05 -2.00 0.00 0.00 179.45 179.06 2jvi h GLU 95 N 0.90 0.00 0.00 0.07 4.11 -0.88 -1.86 114.58 116.92 2jvi h GLU 95 Ca 0.46 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.89 2jvi h GLU 95 Cb 0.51 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.76 2jvi h GLU 95 CO -0.23 0.14 -0.59 -0.07 0.07 0.00 0.00 179.01 178.33 2jvi h LEU 96 N 0.00 0.00 0.00 3.06 3.38 0.48 -3.46 115.31 118.77 2jvi h LEU 96 Ca -0.00 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.95 2jvi h LEU 96 Cb 0.34 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.09 2jvi h LEU 96 CO 0.02 0.01 0.00 0.61 0.09 0.00 0.00 178.44 179.17 2jvi n GLY 97 N 1.18 -0.03 3.83 0.83 0.00 -0.74 -5.00 105.19 105.26 2jvi n GLY 97 Ca 0.02 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.66 2jvi n GLY 97 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2jvi s ALA 98 N 0.00 3.65 -0.15 4.61 0.00 -0.70 -1.34 121.76 127.82 2jvi s ALA 98 Ca 0.00 -0.12 -0.26 0.00 0.00 0.00 0.00 51.96 51.58 2jvi s ALA 98 Cb 0.00 -2.49 -0.25 0.00 0.00 0.00 0.00 23.12 20.38 2jvi s ALA 98 CO 0.00 0.45 0.62 -0.07 0.00 0.00 0.00 175.76 176.77 2jvi h LEU 99 N 4.45 0.06 -7.83 0.00 3.38 -0.14 -3.37 115.31 111.87 2jvi h LEU 99 Ca -0.50 -0.86 -0.15 0.00 0.09 0.00 0.00 57.88 56.46 2jvi h LEU 99 Cb 1.21 -0.02 -0.20 0.00 0.09 0.00 0.00 40.66 41.74 2jvi h LEU 99 CO 0.63 1.20 -0.55 0.42 0.09 0.00 0.00 178.44 180.23 2jvi s THR 100 N -2.29 0.10 -0.48 0.22 -4.23 -1.25 -4.98 115.64 102.73 2jvi s THR 100 Ca -0.21 -0.80 -0.04 0.00 -1.18 0.00 0.00 61.69 59.46 2jvi s THR 100 Cb 0.00 -0.45 0.13 0.00 1.34 0.00 0.00 72.50 73.52 2jvi s THR 100 CO 0.68 -0.44 0.29 0.00 -0.54 0.00 0.00 174.62 174.61 2jvi s ALA 101 N -1.56 3.31 0.24 3.99 0.00 -1.25 -1.65 121.76 124.83 2jvi s ALA 101 Ca -0.14 -2.74 -0.10 0.00 0.00 0.00 0.00 51.96 48.98 2jvi s ALA 101 Cb -0.07 -2.53 -0.07 0.00 0.00 0.00 0.00 23.12 20.44 2jvi s ALA 101 CO 0.00 -1.90 0.57 -0.06 0.00 0.00 0.00 175.76 174.37 2jvi s PHE 102 N 0.83 3.42 0.08 0.00 0.08 -0.63 -4.79 117.98 116.97 2jvi s PHE 102 Ca 0.10 0.89 0.00 0.00 0.12 0.00 0.00 56.93 58.04 2jvi s PHE 102 Cb -0.22 -2.27 -0.00 0.00 -0.57 0.00 0.00 43.02 39.95 2jvi s PHE 102 CO -0.04 0.25 0.00 0.00 -0.10 0.00 0.00 175.22 175.33 2jvi n ALA 103 N -0.21 0.07 -0.12 5.36 0.00 -1.25 -0.31 120.51 124.05 2jvi n ALA 103 Ca 0.01 -0.36 -0.06 0.00 0.00 0.00 0.00 53.44 53.03 2jvi n ALA 103 Cb 0.53 0.20 0.03 0.00 0.00 0.00 0.00 19.45 20.20 2jvi n ALA 103 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.50 177.28 2jvi h LYS 104 N 0.00 0.31 -6.02 0.00 3.64 -1.98 -3.32 116.57 109.21 2jvi h LYS 104 Ca -0.06 -0.02 -0.47 0.00 -1.27 0.00 0.00 60.65 58.82 2jvi h LYS 104 Cb 0.20 -0.07 -0.06 0.00 -0.41 0.00 0.00 32.23 31.90 2jvi h LYS 104 CO 0.11 0.21 1.17 -1.25 -2.27 0.00 0.00 179.45 177.41 2jvi s PRO 105 N -6.15 2.85 -0.01 1.90 0.04 -1.26 -4.94 135.00 127.43 2jvi s PRO 105 Ca -0.13 0.02 0.01 0.00 0.04 0.00 0.00 61.00 60.94 2jvi s PRO 105 Cb 0.12 -4.60 0.00 0.00 0.04 0.00 0.00 34.50 30.06 2jvi s PRO 105 CO 0.72 -2.68 -0.03 -0.59 0.04 0.00 0.00 177.00 174.45 2jvi s PHE 106 N 8.07 0.33 -1.83 0.56 -0.71 -1.25 -5.02 117.98 118.14 2jvi s PHE 106 Ca 0.58 -0.06 0.26 0.00 -1.04 0.00 0.00 56.93 56.67 2jvi s PHE 106 Cb -0.09 -0.25 1.49 0.00 -1.21 0.00 0.00 43.02 42.97 2jvi s PHE 106 CO 0.11 -0.03 1.91 -3.47 -1.34 0.00 0.00 175.22 172.40 2jvi n ASP 107 N 3.17 0.00 0.00 1.98 2.03 -1.26 -4.88 116.55 117.59 2jvi n ASP 107 Ca -0.15 -0.60 0.00 0.00 0.52 0.00 0.00 54.79 54.56 2jvi n ASP 107 Cb 0.57 -0.08 0.00 0.00 -0.72 0.00 0.00 41.12 40.89 2jvi n ASP 107 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2jvi n ILE 108 N -1.08 0.00 0.20 5.18 0.00 -1.26 -4.09 119.36 118.31 2jvi n ILE 108 Ca 0.18 0.00 0.06 0.00 0.00 0.00 0.00 62.75 62.99 2jvi n ILE 108 Cb 0.12 0.00 0.41 0.00 0.00 0.00 0.00 39.64 40.17 2jvi n ILE 108 CO 0.00 0.00 0.00 -0.78 0.00 0.00 0.00 176.55 175.77 2jvi h ASP 109 N 0.00 0.00 0.60 9.51 3.58 -1.99 -0.06 116.42 128.06 2jvi h ASP 109 Ca 0.00 0.00 -0.04 0.00 0.42 0.00 0.00 57.03 57.41 2jvi h ASP 109 Cb 0.00 0.00 -0.01 0.00 1.72 0.00 0.00 39.33 41.04 2jvi h ASP 109 CO 0.00 0.33 -0.19 1.05 -2.88 0.00 0.00 179.24 177.55 2jvi h GLU 110 N 0.00 0.00 0.23 0.28 4.11 -1.96 0.45 114.58 117.69 2jvi h GLU 110 Ca -0.00 0.00 -0.32 0.00 0.07 0.00 0.00 59.36 59.11 2jvi h GLU 110 Cb 0.76 0.00 0.03 0.00 0.50 0.00 0.00 28.75 30.05 2jvi h GLU 110 CO 0.04 0.19 -1.43 0.82 0.07 0.00 0.00 179.01 178.70 2jvi h ILE 111 N 0.00 1.25 -0.34 -1.06 2.04 -1.38 0.13 117.51 118.14 2jvi h ILE 111 Ca -0.00 -2.64 -0.13 0.00 1.00 0.00 0.00 64.86 63.09 2jvi h ILE 111 Cb 0.54 3.02 -0.01 0.00 -0.74 0.00 0.00 36.82 39.63 2jvi h ILE 111 CO 0.02 0.80 -0.32 0.08 0.00 0.00 0.00 178.15 178.74 2jvi h ARG 112 N 0.05 0.74 -0.11 2.37 -0.00 -1.09 -1.12 114.38 115.22 2jvi h ARG 112 Ca -0.26 -0.34 -0.10 0.00 -0.00 0.00 0.00 59.98 59.28 2jvi h ARG 112 Cb 2.08 -0.01 -0.01 0.00 -0.00 0.00 0.00 29.97 32.02 2jvi h ARG 112 CO 0.24 0.96 -0.38 0.22 -0.00 0.00 0.00 179.97 181.01 2jvi h ASP 113 N 0.63 0.24 -0.44 0.08 3.58 -0.14 -2.08 116.42 118.29 2jvi h ASP 113 Ca 0.07 -0.09 -0.04 0.00 0.42 0.00 0.00 57.03 57.39 2jvi h ASP 113 Cb 0.84 -0.07 -0.02 0.00 1.72 0.00 0.00 39.33 41.81 2jvi h ASP 113 CO 0.07 0.60 0.13 0.00 -2.88 0.00 0.00 179.24 177.17 2jvi h ALA 114 N 1.41 0.58 -0.67 -0.78 0.00 -0.38 0.10 119.26 119.51 2jvi h ALA 114 Ca 0.02 -0.18 -0.07 0.00 0.00 0.00 0.00 54.91 54.68 2jvi h ALA 114 Cb 0.76 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 18.35 2jvi h ALA 114 CO 0.06 0.23 0.14 -0.39 0.00 0.00 0.00 179.25 179.28 2jvi h VAL 115 N 0.57 1.26 0.00 0.00 -1.51 -0.72 -1.31 116.25 114.54 2jvi h VAL 115 Ca 0.14 -0.99 -0.03 0.00 -1.23 0.00 0.00 66.70 64.59 2jvi h VAL 115 Cb 0.27 0.59 -0.00 0.00 -2.13 0.00 0.00 31.29 30.02 2jvi h VAL 115 CO -0.00 0.38 -0.13 0.07 -1.23 0.00 0.00 177.57 176.65 2jvi h LYS 116 N 1.03 0.00 0.00 5.19 5.09 -1.27 -0.21 116.57 126.40 2jvi h LYS 116 Ca 0.21 0.00 -0.09 0.00 0.09 0.00 0.00 60.65 60.86 2jvi h LYS 116 Cb 0.40 0.00 -0.01 0.00 0.10 0.00 0.00 32.23 32.72 2jvi h LYS 116 CO 0.01 0.13 -0.42 1.57 -2.09 0.00 0.00 179.45 178.65 2jvi h LYS 117 N 0.00 0.00 0.00 0.07 2.10 -0.41 -3.31 116.57 115.02 2jvi h LYS 117 Ca -0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 2jvi h LYS 117 Cb 1.02 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.35 2jvi h LYS 117 CO 0.02 0.42 0.00 0.66 -2.00 0.00 0.00 179.45 178.55 2jvi n TYR 118 N -3.22 0.00 -3.78 0.07 4.02 -0.53 -4.88 117.16 108.84 2jvi n TYR 118 Ca 0.02 0.00 -0.30 0.00 -0.01 0.00 0.00 57.90 57.62 2jvi n TYR 118 Cb 0.69 -0.18 -0.13 0.00 -0.02 0.00 0.00 39.34 39.69 2jvi n TYR 118 CO 0.00 0.00 0.00 -1.17 -1.01 0.00 0.00 176.86 174.68 2jvi s LEU 119 N -4.47 3.15 0.37 7.72 1.98 -0.10 -5.10 118.68 122.23 2jvi s LEU 119 Ca 0.00 -2.75 -0.09 0.00 -2.89 0.00 0.00 54.13 48.41 2jvi s LEU 119 Cb 0.00 -1.20 -0.06 0.00 0.66 0.00 0.00 46.19 45.59 2jvi s LEU 119 CO 0.00 -0.25 0.70 -2.16 -1.89 0.00 0.00 176.35 172.75 2jvi s PRO 120 N 0.15 3.72 -0.03 0.98 0.04 -1.23 -4.49 135.00 134.14 2jvi s PRO 120 Ca 0.18 0.31 -0.02 0.00 0.04 0.00 0.00 61.00 61.51 2jvi s PRO 120 Cb -0.24 -2.47 -0.01 0.00 0.04 0.00 0.00 34.50 31.82 2jvi s PRO 120 CO -0.00 0.03 -0.04 1.25 0.04 0.00 0.00 177.00 178.28 2jvi h LEU 121 N 1.33 0.00 0.00 -3.56 5.85 -1.89 -3.47 115.31 113.58 2jvi h LEU 121 Ca -0.47 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.25 2jvi h LEU 121 Cb 1.19 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.22 2jvi h LEU 121 CO 0.64 0.17 0.00 0.29 -0.34 0.00 0.00 178.44 179.20 2jvi n LYS 122 N -2.78 0.00 0.00 1.25 4.76 -1.26 -5.04 118.16 115.08 2jvi n LYS 122 Ca -0.01 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.43 2jvi n LYS 122 Cb 0.05 0.00 0.00 0.00 -1.84 0.00 0.00 35.03 33.24 2jvi n LYS 122 CO 0.00 0.00 0.00 0.45 -1.37 0.00 0.00 177.40 176.48 2jvi n SER 123 N -2.98 0.00 -3.03 4.39 2.88 -1.26 -4.76 113.62 108.86 2jvi n SER 123 Ca 0.00 0.00 -0.13 0.00 -1.33 0.00 0.00 58.87 57.41 2jvi n SER 123 Cb 0.00 0.00 0.01 0.00 -0.75 0.00 0.00 64.21 63.47 2jvi n SER 123 CO 0.00 0.00 0.00 0.59 -1.23 0.00 0.00 175.04 174.40 2jvi n ASN 124 N 1.30 -7.19 -0.09 -3.46 4.13 -1.26 -5.00 115.26 103.70 2jvi n ASN 124 Ca 0.00 0.56 -0.15 0.00 1.68 0.00 0.00 54.58 56.67 2jvi n ASN 124 Cb 0.00 -3.93 -0.05 0.00 -1.54 0.00 0.00 39.78 34.26 2jvi n ASN 124 CO 0.00 0.00 0.00 0.18 0.28 0.00 0.00 177.26 177.72 2jvi n LEU 125 N 0.19 1.66 -4.06 3.41 4.77 -1.26 -5.06 117.00 116.66 2jvi n LEU 125 Ca 0.02 0.28 -0.10 0.00 -0.03 0.00 0.00 56.01 56.19 2jvi n LEU 125 Cb 0.41 -0.65 -0.11 0.00 -2.33 0.00 0.00 43.42 40.74 2jvi n LEU 125 CO 0.42 0.04 -0.37 -1.83 -1.33 0.00 0.00 177.39 174.32 2jvi s GLU 126 N -2.57 0.51 0.40 3.23 4.04 -1.26 -5.15 118.70 117.90 2jvi s GLU 126 Ca -0.27 -0.90 -0.06 0.00 0.04 0.00 0.00 54.97 53.79 2jvi s GLU 126 Cb 0.07 -0.02 -0.05 0.00 0.02 0.00 0.00 34.13 34.16 2jvi s GLU 126 CO 0.36 -0.03 0.69 -1.01 -1.84 0.00 0.00 175.26 173.44 2jvi s HIS 127 N -2.32 3.51 -0.50 4.83 3.76 -1.26 -5.05 115.29 118.26 2jvi s HIS 127 Ca -0.05 0.77 0.07 0.00 -0.15 0.00 0.00 55.06 55.70 2jvi s HIS 127 Cb -0.04 -2.23 0.27 0.00 1.11 0.00 0.00 32.58 31.69 2jvi s HIS 127 CO -0.03 -0.07 0.68 1.58 -0.85 0.00 0.00 174.74 176.05 2jvi n HIS 128 N -1.62 1.71 -0.04 1.40 -0.00 -1.26 -4.70 115.22 110.72 2jvi n HIS 128 Ca -0.00 -3.87 -0.07 0.00 0.46 0.00 0.00 57.72 54.24 2jvi n HIS 128 Cb 0.55 -0.45 -0.02 0.00 -0.12 0.00 0.00 29.99 29.94 2jvi n HIS 128 CO 0.00 0.00 0.00 0.72 0.46 0.00 0.00 176.34 177.52 2jvi n HIS 129 N 0.85 0.00 -4.67 1.57 8.25 -1.26 -5.12 115.22 114.84 2jvi n HIS 129 Ca 0.26 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.72 2jvi n HIS 129 Cb 0.49 -0.34 0.00 0.00 1.12 0.00 0.00 29.99 31.26 2jvi n HIS 129 CO 0.00 0.00 0.00 0.72 0.64 0.00 0.00 176.34 177.70 2jvi n HIS 130 N -3.96 -1.03 -4.04 4.41 8.25 -1.26 -4.62 115.22 112.96 2jvi n HIS 130 Ca -0.12 0.00 -0.33 0.00 -0.26 0.00 0.00 57.72 57.00 2jvi n HIS 130 Cb 0.38 0.20 -0.15 0.00 1.12 0.00 0.00 29.99 31.53 2jvi n HIS 130 CO 0.00 0.00 0.00 -1.58 0.64 0.00 0.00 176.34 175.40 2jvi s HIS 131 N 0.00 3.02 0.00 4.41 5.65 -1.26 -5.28 115.29 121.83 2jvi s HIS 131 Ca 0.00 -1.77 0.00 0.00 0.25 0.00 0.00 55.06 53.54 2jvi s HIS 131 Cb 0.00 -1.98 0.00 0.00 -1.18 0.00 0.00 32.58 29.42 2jvi s HIS 131 CO 0.00 -0.79 0.00 -2.39 -0.65 0.00 0.00 174.74 170.91