#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2vjr s GLN 2 N 0.00 2.85 0.28 2.12 -0.21 -1.26 -5.05 119.66 118.39 2vjr s GLN 2 Ca 0.00 -0.71 0.01 0.00 0.02 0.00 0.00 55.36 54.67 2vjr s GLN 2 Cb 0.00 -2.70 -0.00 0.00 1.00 0.00 0.00 33.01 31.30 2vjr s GLN 2 CO 0.00 0.56 0.02 -0.40 -2.12 0.00 0.00 175.29 173.35 2vjr n ASP 3 N 0.44 2.40 0.23 5.90 5.68 -1.26 -4.67 116.55 125.28 2vjr n ASP 3 Ca -0.09 -2.29 0.09 0.00 -0.50 0.00 0.00 54.79 52.00 2vjr n ASP 3 Cb 0.52 0.30 0.57 0.00 -1.14 0.00 0.00 41.12 41.37 2vjr n ASP 3 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 2vjr h ALA 4 N 1.21 1.28 0.00 2.12 0.00 -1.47 -0.56 119.26 121.84 2vjr h ALA 4 Ca -0.23 -0.19 -0.00 0.00 0.00 0.00 0.00 54.91 54.49 2vjr h ALA 4 Cb 0.74 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.49 2vjr h ALA 4 CO 0.38 0.26 -0.00 0.74 0.00 0.00 0.00 179.25 180.63 2vjr h PHE 5 N 0.00 -0.01 -1.00 0.00 0.04 -1.93 -2.94 116.94 111.10 2vjr h PHE 5 Ca -0.00 -0.00 0.22 0.00 2.80 0.00 0.00 57.97 60.99 2vjr h PHE 5 Cb 0.50 0.00 -0.11 0.00 2.20 0.00 0.00 35.95 38.54 2vjr h PHE 5 CO 0.00 0.79 0.61 1.15 -0.60 0.00 0.00 178.31 180.26 2vjr h THR 6 N -0.98 0.63 -0.16 -1.55 2.02 -1.91 -0.05 112.91 110.91 2vjr h THR 6 Ca -0.00 -0.22 -0.01 0.00 0.77 0.00 0.00 66.41 66.95 2vjr h THR 6 Cb 0.79 -0.07 -0.01 0.00 -1.74 0.00 0.00 68.15 67.13 2vjr h THR 6 CO 0.00 0.12 0.07 0.50 0.37 0.00 0.00 175.52 176.58 2vjr h LYS 7 N 0.64 0.24 -0.27 6.66 3.64 -1.14 -1.48 116.57 124.86 2vjr h LYS 7 Ca 0.60 -0.04 0.06 0.00 -1.27 0.00 0.00 60.65 60.00 2vjr h LYS 7 Cb 1.10 -0.04 -0.07 0.00 -0.41 0.00 0.00 32.23 32.81 2vjr h LYS 7 CO -0.39 0.30 -0.19 0.00 -2.27 0.00 0.00 179.45 176.90 2vjr h ALA 8 N 0.92 -0.02 -0.75 5.00 0.00 -0.99 -2.44 119.26 120.99 2vjr h ALA 8 Ca 0.05 0.09 0.08 0.00 0.00 0.00 0.00 54.91 55.13 2vjr h ALA 8 Cb 0.15 0.43 -0.06 0.00 0.00 0.00 0.00 17.79 18.31 2vjr h ALA 8 CO -0.01 -0.61 0.42 0.82 0.00 0.00 0.00 179.25 179.87 2vjr h ILE 9 N -0.18 0.93 -0.63 0.00 2.04 -0.75 -1.17 117.51 117.76 2vjr h ILE 9 Ca 0.15 -0.25 -0.02 0.00 1.00 0.00 0.00 64.86 65.73 2vjr h ILE 9 Cb 0.40 0.14 -0.03 0.00 -0.74 0.00 0.00 36.82 36.59 2vjr h ILE 9 CO -0.38 0.13 0.31 0.58 0.00 0.00 0.00 178.15 178.80 2vjr h VAL 10 N 0.73 1.21 -0.51 1.67 2.07 -0.94 -0.87 116.25 119.61 2vjr h VAL 10 Ca 0.35 -0.59 -0.12 0.00 0.82 0.00 0.00 66.70 67.15 2vjr h VAL 10 Cb 0.28 0.45 -0.02 0.00 -1.52 0.00 0.00 31.29 30.48 2vjr h VAL 10 CO -0.22 0.25 -0.15 0.00 0.02 0.00 0.00 177.57 177.47 2vjr h ALA 11 N 1.14 0.71 -0.21 1.67 0.00 -0.94 -2.16 119.26 119.47 2vjr h ALA 11 Ca 0.22 -0.36 0.00 0.00 0.00 0.00 0.00 54.91 54.77 2vjr h ALA 11 Cb 0.10 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.70 2vjr h ALA 11 CO -0.03 0.65 0.14 0.00 0.00 0.00 0.00 179.25 180.01 2vjr h ALA 12 N 0.90 0.26 -0.78 0.00 0.00 -1.08 -2.95 119.26 115.60 2vjr h ALA 12 Ca 0.13 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.03 2vjr h ALA 12 Cb 0.72 -0.08 -0.04 0.00 0.00 0.00 0.00 17.79 18.39 2vjr h ALA 12 CO 0.06 -0.26 0.49 0.22 0.00 0.00 0.00 179.25 179.75 2vjr h ASP 13 N 0.28 0.92 0.59 0.00 3.58 -1.06 -1.07 116.42 119.66 2vjr h ASP 13 Ca 0.08 -0.04 -0.00 0.00 0.42 0.00 0.00 57.03 57.49 2vjr h ASP 13 Cb -0.03 -0.23 -0.00 0.00 1.72 0.00 0.00 39.33 40.79 2vjr h ASP 13 CO -0.02 0.69 -0.01 -0.07 -2.88 0.00 0.00 179.24 176.95 2vjr h LEU 14 N 1.07 0.00 0.00 2.28 3.38 -1.23 0.14 115.31 120.95 2vjr h LEU 14 Ca 0.28 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.25 2vjr h LEU 14 Cb -0.08 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.67 2vjr h LEU 14 CO -0.06 0.01 -0.55 0.03 0.09 0.00 0.00 178.44 177.96 2vjr h ARG 15 N 0.00 0.00 -0.42 1.13 3.08 -1.08 -3.48 114.38 113.61 2vjr h ARG 15 Ca -0.00 0.00 -0.02 0.00 0.07 0.00 0.00 59.98 60.03 2vjr h ARG 15 Cb 0.31 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.36 2vjr h ARG 15 CO 0.00 0.00 -0.02 0.41 -1.07 0.00 0.00 179.97 179.29 2vjr n GLY 16 N 1.25 0.48 3.20 0.04 0.00 0.47 -5.05 105.19 105.59 2vjr n GLY 16 Ca 0.03 -0.80 -0.17 0.00 0.00 0.00 0.00 46.02 45.08 2vjr n GLY 16 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2vjr s SER 17 N -2.97 1.74 0.56 1.61 0.01 -0.93 -5.01 113.70 108.69 2vjr s SER 17 Ca 0.01 -0.76 -0.18 0.00 1.31 0.00 0.00 55.95 56.33 2vjr s SER 17 Cb -0.00 -0.04 -0.05 0.00 0.21 0.00 0.00 66.02 66.14 2vjr s SER 17 CO 0.01 -0.16 1.07 -0.36 0.41 0.00 0.00 173.24 174.21 2vjr s PHE 18 N -2.00 2.89 0.29 2.43 0.08 -1.26 -4.28 117.98 116.12 2vjr s PHE 18 Ca 0.05 1.54 -0.30 0.00 0.12 0.00 0.00 56.93 58.35 2vjr s PHE 18 Cb -0.06 -3.10 -0.13 0.00 -0.57 0.00 0.00 43.02 39.17 2vjr s PHE 18 CO 0.02 -1.17 1.40 1.28 -0.10 0.00 0.00 175.22 176.64 2vjr n LEU 19 N -1.58 3.54 -4.77 -0.37 4.77 -1.26 -4.92 117.00 112.42 2vjr n LEU 19 Ca 0.10 1.17 -0.41 0.00 -0.03 0.00 0.00 56.01 56.84 2vjr n LEU 19 Cb 0.52 -1.48 -0.02 0.00 -2.33 0.00 0.00 43.42 40.10 2vjr n LEU 19 CO 0.44 -0.36 0.95 -0.94 -1.33 0.00 0.00 177.39 176.15 2vjr s SER 20 N 0.08 6.85 0.50 -1.43 1.04 -1.26 -4.80 113.70 114.68 2vjr s SER 20 Ca 0.62 2.63 0.36 0.00 0.48 0.00 0.00 55.95 60.04 2vjr s SER 20 Cb -0.59 -2.65 1.50 0.00 0.10 0.00 0.00 66.02 64.39 2vjr s SER 20 CO 0.55 -0.48 1.69 -0.08 0.98 0.00 0.00 173.24 175.90 2vjr h GLU 21 N 3.45 0.08 0.16 4.02 4.57 -1.98 0.43 114.58 125.30 2vjr h GLU 21 Ca -0.49 -0.00 -0.00 0.00 -1.18 0.00 0.00 59.36 57.69 2vjr h GLU 21 Cb 1.22 -0.02 -0.02 0.00 -0.16 0.00 0.00 28.75 29.78 2vjr h GLU 21 CO 0.66 0.05 -0.26 0.37 -1.18 0.00 0.00 179.01 178.65 2vjr h GLN 22 N 0.08 -0.42 -0.65 1.92 -0.00 -2.01 -2.99 115.11 111.04 2vjr h GLN 22 Ca 0.74 0.03 -0.02 0.00 -0.00 0.00 0.00 58.65 59.39 2vjr h GLN 22 Cb 2.64 0.10 -0.03 0.00 0.00 0.00 0.00 27.48 30.18 2vjr h GLN 22 CO -0.17 -0.28 0.30 0.93 0.00 0.00 0.00 178.83 179.62 2vjr h GLU 23 N -0.44 0.92 -0.32 1.69 5.08 -0.72 -2.79 114.58 118.00 2vjr h GLU 23 Ca -0.02 -0.12 0.06 0.00 -1.00 0.00 0.00 59.36 58.28 2vjr h GLU 23 Cb 0.40 -0.17 -0.06 0.00 0.50 0.00 0.00 28.75 29.42 2vjr h GLU 23 CO -0.09 0.71 -0.05 -0.07 -1.00 0.00 0.00 179.01 178.51 2vjr h LEU 24 N 0.91 -0.24 -0.45 1.33 3.38 -0.45 -2.32 115.31 117.47 2vjr h LEU 24 Ca 0.22 0.09 -0.16 0.00 0.09 0.00 0.00 57.88 58.12 2vjr h LEU 24 Cb 0.10 0.18 -0.02 0.00 0.09 0.00 0.00 40.66 41.01 2vjr h LEU 24 CO -0.03 -0.08 -0.77 0.78 0.09 0.00 0.00 178.44 178.43 2vjr h ASN 25 N 0.03 0.00 -0.72 -0.43 2.35 -1.35 -0.27 115.58 115.19 2vjr h ASN 25 Ca 0.16 0.00 0.07 0.00 -0.55 0.00 0.00 56.30 55.98 2vjr h ASN 25 Cb 0.23 0.00 -0.06 0.00 0.05 0.00 0.00 38.32 38.54 2vjr h ASN 25 CO -0.31 0.77 0.40 1.56 -1.65 0.00 0.00 177.43 178.20 2vjr h GLN 26 N 0.00 0.69 -0.04 0.81 1.08 -1.29 -0.77 115.11 115.58 2vjr h GLN 26 Ca -0.01 -0.04 -0.15 0.00 -1.45 0.00 0.00 58.65 57.00 2vjr h GLN 26 Cb 1.37 -0.15 -0.01 0.00 -0.05 0.00 0.00 27.48 28.63 2vjr h GLN 26 CO 0.10 0.45 -0.65 -0.07 -0.95 0.00 0.00 178.83 177.72 2vjr h LEU 27 N 0.71 0.21 -1.30 1.46 3.38 -1.05 -2.71 115.31 116.01 2vjr h LEU 27 Ca 0.33 -0.13 -0.04 0.00 0.09 0.00 0.00 57.88 58.13 2vjr h LEU 27 Cb 0.25 -0.06 -0.02 0.00 0.09 0.00 0.00 40.66 40.92 2vjr h LEU 27 CO -0.21 0.80 -0.00 0.74 0.09 0.00 0.00 178.44 179.86 2vjr h THR 28 N 0.13 1.18 -0.17 0.22 2.02 -0.56 -2.24 112.91 113.49 2vjr h THR 28 Ca -0.01 -0.72 -0.17 0.00 0.77 0.00 0.00 66.41 66.28 2vjr h THR 28 Cb 1.16 0.95 -0.01 0.00 -1.74 0.00 0.00 68.15 68.52 2vjr h THR 28 CO 0.10 0.25 -0.58 -1.13 0.37 0.00 0.00 175.52 174.52 2vjr h ASN 29 N 0.45 0.61 -0.60 4.18 -0.73 -1.00 -0.47 115.58 118.02 2vjr h ASN 29 Ca 0.10 -0.34 -0.04 0.00 1.87 0.00 0.00 56.30 57.89 2vjr h ASN 29 Cb 0.30 -0.18 -0.03 0.00 0.27 0.00 0.00 38.32 38.68 2vjr h ASN 29 CO 0.01 1.06 0.23 0.25 -0.37 0.00 0.00 177.43 178.61 2vjr h LEU 30 N 0.41 0.87 -0.75 0.34 6.46 -1.15 -0.54 115.31 120.95 2vjr h LEU 30 Ca 0.00 -0.13 -0.12 0.00 -0.12 0.00 0.00 57.88 57.51 2vjr h LEU 30 Cb 1.13 -0.23 -0.01 0.00 -0.73 0.00 0.00 40.66 40.82 2vjr h LEU 30 CO 0.11 0.79 -0.39 0.58 -0.62 0.00 0.00 178.44 178.91 2vjr h VAL 31 N 0.92 1.30 -0.90 1.05 2.07 -1.20 -2.74 116.25 116.75 2vjr h VAL 31 Ca 0.21 -1.53 0.01 0.00 0.82 0.00 0.00 66.70 66.21 2vjr h VAL 31 Cb 0.21 1.56 -0.04 0.00 -1.52 0.00 0.00 31.29 31.49 2vjr h VAL 31 CO -0.02 0.48 0.59 0.50 0.02 0.00 0.00 177.57 179.14 2vjr h LYS 32 N 0.41 1.18 -0.62 1.57 3.64 0.38 -2.82 116.57 120.32 2vjr h LYS 32 Ca 0.04 -0.07 0.00 0.00 -1.27 0.00 0.00 60.65 59.34 2vjr h LYS 32 Cb 0.86 -0.27 0.00 0.00 -0.41 0.00 0.00 32.23 32.42 2vjr h LYS 32 CO 0.07 0.79 0.00 0.39 -2.27 0.00 0.00 179.45 178.43 2vjr n GLU 33 N -4.45 3.02 0.12 1.90 -0.58 -0.39 -4.57 120.64 115.69 2vjr n GLU 33 Ca 0.10 -2.17 -0.02 0.00 -0.42 0.00 0.00 57.16 54.65 2vjr n GLU 33 Cb 0.02 -1.72 0.13 0.00 -0.57 0.00 0.00 31.44 29.29 2vjr n GLU 33 CO 0.00 0.00 0.00 0.66 -0.48 0.00 0.00 177.13 177.31 2vjr h SER 34 N 3.14 0.03 -0.74 1.62 4.64 -1.22 -2.03 113.55 118.99 2vjr h SER 34 Ca 0.00 -0.02 -0.01 0.00 -0.47 0.00 0.00 61.79 61.29 2vjr h SER 34 Cb 1.13 -0.01 -0.04 0.00 -0.31 0.00 0.00 62.40 63.18 2vjr h SER 34 CO 0.17 0.69 0.43 0.78 -0.87 0.00 0.00 176.83 178.03 2vjr h ASN 35 N 0.02 0.90 -0.83 4.97 2.35 -1.82 -0.41 115.58 120.76 2vjr h ASN 35 Ca -0.01 -0.07 -0.03 0.00 -0.55 0.00 0.00 56.30 55.64 2vjr h ASN 35 Cb 1.19 -0.23 -0.04 0.00 0.05 0.00 0.00 38.32 39.29 2vjr h ASN 35 CO 0.09 0.71 0.41 0.11 -1.65 0.00 0.00 177.43 177.10 2vjr h LYS 36 N 1.02 1.20 -0.29 0.81 1.57 -1.80 -1.95 116.57 117.12 2vjr h LYS 36 Ca 0.26 -0.17 -0.02 0.00 -1.87 0.00 0.00 60.65 58.86 2vjr h LYS 36 Cb -0.01 -0.22 -0.01 0.00 0.08 0.00 0.00 32.23 32.07 2vjr h LYS 36 CO -0.05 0.92 0.12 -0.09 -0.57 0.00 0.00 179.45 179.78 2vjr h ARG 37 N 1.19 0.43 -0.93 3.15 2.43 -0.71 -0.99 114.38 118.95 2vjr h ARG 37 Ca 0.29 -0.07 0.06 0.00 -0.81 0.00 0.00 59.98 59.45 2vjr h ARG 37 Cb 0.11 -0.07 -0.06 0.00 -0.42 0.00 0.00 29.97 29.52 2vjr h ARG 37 CO -0.04 0.44 0.59 -0.07 -1.51 0.00 0.00 179.97 179.38 2vjr h LEU 38 N 0.32 0.93 -1.18 3.80 3.38 -0.92 0.19 115.31 121.83 2vjr h LEU 38 Ca 0.10 0.01 -0.06 0.00 0.09 0.00 0.00 57.88 58.02 2vjr h LEU 38 Cb 0.17 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 40.72 2vjr h LEU 38 CO -0.01 0.59 -0.12 0.44 0.09 0.00 0.00 178.44 179.43 2vjr h ASP 39 N 1.07 0.41 -0.09 -0.43 3.32 -0.82 0.12 116.42 120.00 2vjr h ASP 39 Ca 0.41 -0.10 -0.06 0.00 0.02 0.00 0.00 57.03 57.29 2vjr h ASP 39 Cb 0.18 -0.11 0.00 0.00 0.22 0.00 0.00 39.33 39.62 2vjr h ASP 39 CO -0.18 0.56 -0.19 0.00 -1.72 0.00 0.00 179.24 177.72 2vjr h ALA 40 N 1.48 0.15 -0.71 3.45 0.00 -0.06 0.31 119.26 123.88 2vjr h ALA 40 Ca 0.08 -0.37 -0.02 0.00 0.00 0.00 0.00 54.91 54.60 2vjr h ALA 40 Cb 0.46 -0.02 -0.03 0.00 0.00 0.00 0.00 17.79 18.19 2vjr h ALA 40 CO 0.03 0.08 0.36 0.28 0.00 0.00 0.00 179.25 180.00 2vjr h VAL 41 N -0.17 1.23 -0.31 0.00 2.07 -0.95 -2.51 116.25 115.61 2vjr h VAL 41 Ca 0.00 -0.62 -0.04 0.00 0.82 0.00 0.00 66.70 66.86 2vjr h VAL 41 Cb 0.78 0.33 -0.02 0.00 -1.52 0.00 0.00 31.29 30.86 2vjr h VAL 41 CO 0.04 0.26 0.01 -1.13 0.02 0.00 0.00 177.57 176.77 2vjr h ASN 42 N 0.99 0.44 -0.84 0.57 -1.24 -0.52 -2.02 115.58 112.96 2vjr h ASN 42 Ca 0.25 -0.07 0.03 0.00 0.71 0.00 0.00 56.30 57.22 2vjr h ASN 42 Cb 0.09 -0.12 -0.05 0.00 0.73 0.00 0.00 38.32 38.97 2vjr h ASN 42 CO -0.03 0.50 0.56 0.00 -1.29 0.00 0.00 177.43 177.16 2vjr h ALA 43 N 1.56 1.48 0.01 1.57 0.00 0.07 -1.21 119.26 122.74 2vjr h ALA 43 Ca 0.10 -0.04 -0.09 0.00 0.00 0.00 0.00 54.91 54.89 2vjr h ALA 43 Cb 0.29 -0.30 0.01 0.00 0.00 0.00 0.00 17.79 17.79 2vjr h ALA 43 CO 0.01 0.44 -0.34 0.82 0.00 0.00 0.00 179.25 180.18 2vjr h ILE 44 N 1.05 1.55 -0.60 0.00 2.04 -1.26 -3.17 117.51 117.12 2vjr h ILE 44 Ca 0.33 -2.06 0.05 0.00 1.00 0.00 0.00 64.86 64.18 2vjr h ILE 44 Cb 0.03 2.84 -0.05 0.00 -0.74 0.00 0.00 36.82 38.90 2vjr h ILE 44 CO -0.10 0.57 0.33 0.74 0.00 0.00 0.00 178.15 179.69 2vjr h THR 45 N -0.47 0.97 0.00 -0.27 2.02 -1.28 -0.86 112.91 113.02 2vjr h THR 45 Ca -0.05 -0.21 0.00 0.00 0.77 0.00 0.00 66.41 66.92 2vjr h THR 45 Cb 1.12 0.30 0.00 0.00 -1.74 0.00 0.00 68.15 67.83 2vjr h THR 45 CO 0.07 0.11 0.00 0.61 0.37 0.00 0.00 175.52 176.68 2vjr n GLY 46 N -1.27 -1.13 0.48 2.16 0.00 -0.47 -2.86 105.19 102.10 2vjr n GLY 46 Ca 0.07 0.03 0.04 0.00 0.00 0.00 0.00 46.02 46.16 2vjr n GLY 46 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2vjr n ASN 47 N -1.93 0.89 0.08 1.61 4.13 -0.96 -4.91 115.26 114.18 2vjr n ASN 47 Ca 0.02 -2.43 -0.12 0.00 1.68 0.00 0.00 54.58 53.73 2vjr n ASN 47 Cb 0.19 -0.30 -0.05 0.00 -1.54 0.00 0.00 39.78 38.08 2vjr n ASN 47 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 2vjr h ALA 48 N 0.15 -0.49 -0.07 5.41 0.00 -1.02 0.11 119.26 123.35 2vjr h ALA 48 Ca -0.02 -0.03 0.04 0.00 0.00 0.00 0.00 54.91 54.89 2vjr h ALA 48 Cb 1.31 0.54 -0.04 0.00 0.00 0.00 0.00 17.79 19.59 2vjr h ALA 48 CO 0.01 -0.84 -0.19 0.00 0.00 0.00 0.00 179.25 178.23 2vjr h ALA 49 N 0.21 -0.19 -0.65 0.00 0.00 -1.88 -0.97 119.26 115.78 2vjr h ALA 49 Ca 0.05 0.03 -0.00 0.00 0.00 0.00 0.00 54.91 54.98 2vjr h ALA 49 Cb 0.56 0.36 -0.03 0.00 0.00 0.00 0.00 17.79 18.68 2vjr h ALA 49 CO -0.23 -0.67 0.40 1.49 0.00 0.00 0.00 179.25 180.24 2vjr h GLU 50 N -0.28 0.87 -0.43 0.00 4.57 -1.85 0.13 114.58 117.59 2vjr h GLU 50 Ca 0.08 -0.07 -0.01 0.00 -1.18 0.00 0.00 59.36 58.18 2vjr h GLU 50 Cb 0.39 -0.19 -0.02 0.00 -0.16 0.00 0.00 28.75 28.77 2vjr h GLU 50 CO -0.23 0.61 0.25 0.82 -1.18 0.00 0.00 179.01 179.28 2vjr h ILE 51 N 0.89 1.15 0.01 2.32 2.04 0.38 0.31 117.51 124.61 2vjr h ILE 51 Ca 0.23 -0.37 -0.00 0.00 1.00 0.00 0.00 64.86 65.72 2vjr h ILE 51 Cb -0.04 0.61 0.00 0.00 -0.74 0.00 0.00 36.82 36.65 2vjr h ILE 51 CO -0.05 0.16 -0.00 0.40 0.00 0.00 0.00 178.15 178.66 2vjr h ILE 52 N 0.57 1.28 0.01 -0.67 2.04 -0.69 -1.81 117.51 118.24 2vjr h ILE 52 Ca 0.15 -0.87 0.03 0.00 1.00 0.00 0.00 64.86 65.18 2vjr h ILE 52 Cb 0.03 1.87 -0.04 0.00 -0.74 0.00 0.00 36.82 37.94 2vjr h ILE 52 CO -0.03 0.22 -0.22 -1.28 0.00 0.00 0.00 178.15 176.84 2vjr h SER 53 N -0.38 -0.65 -0.52 1.72 0.87 -0.57 -0.13 113.55 113.89 2vjr h SER 53 Ca -0.00 0.09 -0.05 0.00 -1.23 0.00 0.00 61.79 60.60 2vjr h SER 53 Cb 0.37 0.27 -0.03 0.00 -0.44 0.00 0.00 62.40 62.58 2vjr h SER 53 CO 0.00 -0.29 0.16 -0.78 -0.53 0.00 0.00 176.83 175.39 2vjr h ASP 54 N -0.36 0.80 -0.50 6.23 3.58 -0.42 0.11 116.42 125.86 2vjr h ASP 54 Ca 0.06 -0.13 -0.00 0.00 0.42 0.00 0.00 57.03 57.37 2vjr h ASP 54 Cb 0.43 -0.21 -0.02 0.00 1.72 0.00 0.00 39.33 41.25 2vjr h ASP 54 CO -0.19 0.77 0.30 0.00 -2.88 0.00 0.00 179.24 177.24 2vjr h ALA 55 N 1.34 0.64 0.67 -0.78 0.00 -1.03 -2.79 119.26 117.31 2vjr h ALA 55 Ca 0.19 -0.06 -0.03 0.00 0.00 0.00 0.00 54.91 55.00 2vjr h ALA 55 Cb 0.27 -0.20 0.01 0.00 0.00 0.00 0.00 17.79 17.86 2vjr h ALA 55 CO -0.01 0.13 -0.32 0.00 0.00 0.00 0.00 179.25 179.05 2vjr h ALA 56 N 1.15 -1.14 -0.81 0.00 0.00 0.19 0.13 119.26 118.78 2vjr h ALA 56 Ca 0.18 -0.20 0.13 0.00 0.00 0.00 0.00 54.91 55.02 2vjr h ALA 56 Cb -0.01 0.35 -0.13 0.00 0.00 0.00 0.00 17.79 17.99 2vjr h ALA 56 CO -0.03 -1.07 -0.30 0.72 0.00 0.00 0.00 179.25 178.56 2vjr n HIS 57 N -4.62 0.05 -0.08 0.00 -0.00 -0.09 -0.65 115.22 109.83 2vjr n HIS 57 Ca -0.11 1.00 -0.06 0.00 -0.00 0.00 0.00 57.72 58.55 2vjr n HIS 57 Cb 0.35 -0.82 0.13 0.00 -0.00 0.00 0.00 29.99 29.64 2vjr n HIS 57 CO 0.00 0.00 0.00 0.87 -0.00 0.00 0.00 176.34 177.21 2vjr h LYS 58 N 0.00 0.75 -0.74 -0.41 1.57 -1.25 -0.89 116.57 115.59 2vjr h LYS 58 Ca 0.30 -0.26 -0.01 0.00 -1.87 0.00 0.00 60.65 58.80 2vjr h LYS 58 Cb 0.50 -0.05 -0.04 0.00 0.08 0.00 0.00 32.23 32.72 2vjr h LYS 58 CO -0.81 0.86 0.43 1.25 -0.57 0.00 0.00 179.45 180.60 2vjr h LEU 59 N 0.67 0.91 0.00 2.94 5.85 0.16 -2.24 115.31 123.60 2vjr h LEU 59 Ca 0.11 -0.08 -0.12 0.00 0.84 0.00 0.00 57.88 58.63 2vjr h LEU 59 Cb 0.63 -0.23 -0.02 0.00 0.37 0.00 0.00 40.66 41.41 2vjr h LEU 59 CO 0.04 0.72 -0.87 -0.26 -0.34 0.00 0.00 178.44 177.74 2vjr h PHE 60 N 1.02 0.00 -0.54 1.25 0.04 -1.25 -1.60 116.94 115.86 2vjr h PHE 60 Ca 0.26 0.00 0.08 0.00 2.80 0.00 0.00 57.97 61.12 2vjr h PHE 60 Cb -0.00 0.00 -0.07 0.00 2.20 0.00 0.00 35.95 38.08 2vjr h PHE 60 CO -0.01 0.49 0.17 0.00 -0.60 0.00 0.00 178.31 178.36 2vjr h ALA 61 N 1.51 0.66 -0.01 2.45 0.00 -1.04 -3.17 119.26 119.67 2vjr h ALA 61 Ca -0.06 0.09 -0.23 0.00 0.00 0.00 0.00 54.91 54.70 2vjr h ALA 61 Cb 1.43 0.08 0.01 0.00 0.00 0.00 0.00 17.79 19.31 2vjr h ALA 61 CO 0.05 -0.24 -0.95 0.93 0.00 0.00 0.00 179.25 179.04 2vjr h GLU 62 N 0.33 0.49 -2.54 0.00 5.08 -1.23 -3.40 114.58 113.30 2vjr h GLU 62 Ca 0.27 -0.51 -0.60 0.00 -1.00 0.00 0.00 59.36 57.51 2vjr h GLU 62 Cb 0.34 0.14 -0.41 0.00 0.50 0.00 0.00 28.75 29.32 2vjr h GLU 62 CO -0.30 1.15 -0.69 1.04 -1.00 0.00 0.00 179.01 179.22 2vjr n GLN 63 N -3.78 1.77 0.00 2.33 6.02 -0.62 -4.91 117.38 118.20 2vjr n GLN 63 Ca -0.08 -4.26 0.10 0.00 -0.01 0.00 0.00 57.00 52.75 2vjr n GLN 63 Cb 0.84 -2.08 0.54 0.00 1.02 0.00 0.00 30.24 30.55 2vjr n GLN 63 CO 0.00 0.00 0.00 0.25 -1.01 0.00 0.00 177.06 176.30 2vjr n THR 64 N 1.58 0.22 0.13 5.09 -2.24 -1.21 -2.45 114.28 115.41 2vjr n THR 64 Ca 0.25 0.06 0.00 0.00 -2.27 0.00 0.00 64.05 62.09 2vjr n THR 64 Cb 0.41 -0.74 0.07 0.00 -2.10 0.00 0.00 70.33 67.97 2vjr n THR 64 CO 0.00 0.00 0.00 -2.24 -0.57 0.00 0.00 175.07 172.26 2vjr h ASP 65 N 0.00 0.00 0.55 3.42 2.03 -1.91 -3.23 116.42 117.29 2vjr h ASP 65 Ca 0.00 0.00 -0.04 0.00 -0.73 0.00 0.00 57.03 56.26 2vjr h ASP 65 Cb 0.10 0.00 -0.01 0.00 -0.83 0.00 0.00 39.33 38.59 2vjr h ASP 65 CO 0.00 0.63 -0.19 -0.07 -1.03 0.00 0.00 179.24 178.58 2vjr h LEU 66 N 0.00 0.00 -2.70 0.15 3.38 -1.84 -2.77 115.31 111.52 2vjr h LEU 66 Ca -0.01 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.96 2vjr h LEU 66 Cb 1.35 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.10 2vjr h LEU 66 CO 0.08 0.19 0.00 2.30 0.09 0.00 0.00 178.44 181.10 2vjr n ILE 67 N -3.61 0.90 -3.09 1.22 -5.35 -1.22 -1.48 119.36 106.73 2vjr n ILE 67 Ca -0.01 -0.95 -0.27 0.00 -0.27 0.00 0.00 62.75 61.25 2vjr n ILE 67 Cb 0.33 0.59 -0.02 0.00 -1.74 0.00 0.00 39.64 38.80 2vjr n ILE 67 CO 0.00 0.00 0.00 -0.13 -1.76 0.00 0.00 176.55 174.66 2vjr s ARG 68 N -1.04 3.59 0.28 6.28 0.52 -1.05 -4.88 118.95 122.64 2vjr s ARG 68 Ca 0.34 0.03 -0.30 0.00 -0.52 0.00 0.00 55.73 55.27 2vjr s ARG 68 Cb 0.18 -2.54 -0.12 0.00 0.52 0.00 0.00 34.95 32.99 2vjr s ARG 68 CO 0.24 0.05 1.60 -2.30 0.02 0.00 0.00 175.30 174.91 2vjr n PRO 69 N -1.56 2.66 0.00 3.54 -0.02 -1.26 -0.47 135.00 137.88 2vjr n PRO 69 Ca -0.01 0.95 0.00 0.00 -2.02 0.00 0.00 63.50 62.41 2vjr n PRO 69 Cb 0.55 -2.73 0.00 0.00 -0.02 0.00 0.00 33.50 31.30 2vjr n PRO 69 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2vjr n GLY 70 N 2.42 2.22 3.91 -1.23 0.00 -1.26 -5.08 105.19 106.17 2vjr n GLY 70 Ca 0.10 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.83 2vjr n GLY 70 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2vjr s GLY 71 N -2.57 1.98 0.00 -0.02 0.00 0.38 -5.00 107.32 102.08 2vjr s GLY 71 Ca 0.00 -0.60 0.29 0.00 0.00 0.00 0.00 44.72 44.42 2vjr s GLY 71 CO 0.00 -0.51 1.98 -2.01 0.00 0.00 0.00 173.10 172.56 2vjr n ASN 72 N -0.52 0.00 -1.53 1.64 2.85 -1.22 -2.22 115.26 114.25 2vjr n ASN 72 Ca -0.02 0.23 -0.12 0.00 -0.11 0.00 0.00 54.58 54.56 2vjr n ASN 72 Cb 0.53 -0.41 0.18 0.00 1.24 0.00 0.00 39.78 41.33 2vjr n ASN 72 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 2vjr n ALA 73 N -1.41 4.79 -2.60 5.20 0.00 -0.55 -4.67 120.51 121.27 2vjr n ALA 73 Ca 0.10 -3.13 -0.21 0.00 0.00 0.00 0.00 53.44 50.20 2vjr n ALA 73 Cb 0.30 -0.96 -0.15 0.00 0.00 0.00 0.00 19.45 18.64 2vjr n ALA 73 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 177.50 177.03 2vjr s TYR 74 N -3.30 1.17 0.00 0.00 5.04 -0.94 -3.77 117.35 115.54 2vjr s TYR 74 Ca 0.49 -0.24 0.00 0.00 -2.44 0.00 0.00 57.07 54.88 2vjr s TYR 74 Cb 0.43 -0.74 0.00 0.00 0.35 0.00 0.00 41.96 42.00 2vjr s TYR 74 CO 0.03 -0.01 0.00 -0.35 -1.34 0.00 0.00 175.55 173.88 2vjr n PRO 75 N 2.60 3.16 -0.28 4.97 -0.04 -1.26 -4.62 135.00 139.53 2vjr n PRO 75 Ca -0.15 0.00 -0.05 0.00 -0.04 0.00 0.00 63.50 63.27 2vjr n PRO 75 Cb 0.55 0.00 0.07 0.00 -0.04 0.00 0.00 33.50 34.08 2vjr n PRO 75 CO 0.00 0.00 0.00 -0.91 -0.04 0.00 0.00 175.50 174.55 2vjr h ASN 76 N 0.00 0.88 -0.72 3.54 2.35 -2.00 -2.06 115.58 117.58 2vjr h ASN 76 Ca 0.00 -0.03 0.14 0.00 -0.55 0.00 0.00 56.30 55.86 2vjr h ASN 76 Cb 0.00 -0.22 -0.10 0.00 0.05 0.00 0.00 38.32 38.05 2vjr h ASN 76 CO 0.00 0.65 0.23 -0.09 -1.65 0.00 0.00 177.43 176.57 2vjr h ARG 77 N 1.04 0.33 -0.08 0.81 2.43 -1.96 -0.29 114.38 116.67 2vjr h ARG 77 Ca 0.28 -0.02 -0.23 0.00 -0.81 0.00 0.00 59.98 59.20 2vjr h ARG 77 Cb -0.11 -0.08 0.01 0.00 -0.42 0.00 0.00 29.97 29.38 2vjr h ARG 77 CO -0.06 0.22 -0.88 0.00 -1.51 0.00 0.00 179.97 177.75 2vjr h ARG 78 N 0.34 0.67 -0.90 0.20 3.08 -1.65 -2.43 114.38 113.69 2vjr h ARG 78 Ca 0.40 -0.62 0.01 0.00 0.07 0.00 0.00 59.98 59.84 2vjr h ARG 78 Cb 0.64 0.15 -0.04 0.00 0.08 0.00 0.00 29.97 30.79 2vjr h ARG 78 CO -0.44 1.22 0.58 1.98 -1.07 0.00 0.00 179.97 182.24 2vjr h MET 79 N 0.42 1.19 -0.20 0.04 4.05 -1.01 -0.08 114.93 119.35 2vjr h MET 79 Ca -0.08 -0.08 -0.07 0.00 -0.28 0.00 0.00 59.70 59.19 2vjr h MET 79 Cb 1.51 -0.26 -0.01 0.00 -0.80 0.00 0.00 31.60 32.03 2vjr h MET 79 CO 0.17 0.80 -0.18 0.00 0.23 0.00 0.00 176.91 177.93 2vjr h ALA 80 N 1.32 1.34 -0.17 0.39 0.00 -0.92 0.14 119.26 121.36 2vjr h ALA 80 Ca 0.33 -0.27 -0.06 0.00 0.00 0.00 0.00 54.91 54.91 2vjr h ALA 80 Cb -0.12 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 17.56 2vjr h ALA 80 CO -0.07 0.45 -0.13 0.00 0.00 0.00 0.00 179.25 179.50 2vjr h ALA 81 N 1.51 0.24 -0.38 0.00 0.00 -0.92 -0.42 119.26 119.29 2vjr h ALA 81 Ca 0.06 -0.31 -0.01 0.00 0.00 0.00 0.00 54.91 54.64 2vjr h ALA 81 Cb 0.50 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.22 2vjr h ALA 81 CO 0.03 0.11 0.20 0.00 0.00 0.00 0.00 179.25 179.59 2vjr h LEU 83 N 0.48 0.89 -0.51 0.00 3.38 -0.72 -2.04 115.31 116.79 2vjr h LEU 83 Ca 0.13 -0.05 -0.05 0.00 0.09 0.00 0.00 57.88 58.00 2vjr h LEU 83 Cb 0.07 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 40.58 2vjr h LEU 83 CO -0.02 0.70 0.14 -0.09 0.09 0.00 0.00 178.44 179.25 2vjr h ARG 84 N 1.03 0.81 -0.41 1.13 2.43 -0.43 -2.58 114.38 116.35 2vjr h ARG 84 Ca 0.27 -0.19 -0.06 0.00 -0.81 0.00 0.00 59.98 59.19 2vjr h ARG 84 Cb -0.02 -0.11 -0.02 0.00 -0.42 0.00 0.00 29.97 29.40 2vjr h ARG 84 CO -0.05 0.77 0.00 -0.44 -1.51 0.00 0.00 179.97 178.74 2vjr h ASP 85 N 0.70 0.62 -0.89 -3.80 5.19 -0.72 -0.45 116.42 117.07 2vjr h ASP 85 Ca 0.16 -0.13 -0.01 0.00 -0.62 0.00 0.00 57.03 56.43 2vjr h ASP 85 Cb 0.31 -0.16 -0.04 0.00 0.18 0.00 0.00 39.33 39.62 2vjr h ASP 85 CO -0.00 0.69 0.53 0.24 -3.12 0.00 0.00 179.24 177.58 2vjr h MET 86 N 0.62 1.22 -0.18 3.56 2.86 -1.17 -1.76 114.93 120.08 2vjr h MET 86 Ca 0.13 -0.12 -0.06 0.00 -2.06 0.00 0.00 59.70 57.59 2vjr h MET 86 Cb 0.39 -0.25 -0.00 0.00 0.06 0.00 0.00 31.60 31.79 2vjr h MET 86 CO 0.01 0.86 -0.14 1.49 1.06 0.00 0.00 176.91 180.19 2vjr h GLU 87 N 1.23 0.41 -0.57 1.72 4.81 -0.96 -2.14 114.58 119.09 2vjr h GLU 87 Ca 0.32 -0.20 0.08 0.00 -0.13 0.00 0.00 59.36 59.43 2vjr h GLU 87 Cb -0.04 0.00 -0.07 0.00 0.63 0.00 0.00 28.75 29.27 2vjr h GLU 87 CO -0.06 0.75 0.20 0.82 -0.73 0.00 0.00 179.01 180.00 2vjr h ILE 88 N 0.08 0.79 -0.33 2.32 2.04 -0.93 0.39 117.51 121.86 2vjr h ILE 88 Ca 0.03 -0.13 -0.13 0.00 1.00 0.00 0.00 64.86 65.63 2vjr h ILE 88 Cb 0.66 0.37 -0.01 0.00 -0.74 0.00 0.00 36.82 37.11 2vjr h ILE 88 CO 0.04 0.07 -0.30 0.40 0.00 0.00 0.00 178.15 178.35 2vjr h ILE 89 N 0.38 1.29 -0.24 -0.67 2.04 -1.28 -2.18 117.51 116.86 2vjr h ILE 89 Ca 0.28 -1.47 -0.01 0.00 1.00 0.00 0.00 64.86 64.66 2vjr h ILE 89 Cb 0.33 1.49 -0.01 0.00 -0.74 0.00 0.00 36.82 37.89 2vjr h ILE 89 CO -0.28 0.48 0.09 0.25 0.00 0.00 0.00 178.15 178.69 2vjr h LEU 90 N 0.56 0.29 0.02 1.44 5.85 -1.04 -1.66 115.31 120.78 2vjr h LEU 90 Ca 0.06 -0.02 -0.00 0.00 0.84 0.00 0.00 57.88 58.75 2vjr h LEU 90 Cb 0.88 -0.07 0.00 0.00 0.37 0.00 0.00 40.66 41.84 2vjr h LEU 90 CO 0.08 0.27 -0.01 -0.09 -0.34 0.00 0.00 178.44 178.34 2vjr h ARG 91 N 0.33 -0.03 0.00 1.25 2.43 -0.42 -2.20 114.38 115.74 2vjr h ARG 91 Ca 0.08 0.00 -0.03 0.00 -0.81 0.00 0.00 59.98 59.22 2vjr h ARG 91 Cb 0.07 0.01 -0.00 0.00 -0.42 0.00 0.00 29.97 29.62 2vjr h ARG 91 CO -0.01 0.37 -0.17 1.88 -1.51 0.00 0.00 179.97 180.54 2vjr h TYR 92 N -0.44 0.00 -0.27 2.20 0.05 -1.26 -1.15 116.97 116.10 2vjr h TYR 92 Ca -0.00 0.00 -0.18 0.00 0.05 0.00 0.00 58.73 58.60 2vjr h TYR 92 Cb 0.42 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.16 2vjr h TYR 92 CO 0.06 0.17 -0.51 0.28 -1.05 0.00 0.00 178.16 177.11 2vjr h VAL 93 N 0.00 1.28 -0.64 -2.88 2.07 -1.22 -1.85 116.25 113.02 2vjr h VAL 93 Ca -0.00 -1.70 -0.08 0.00 0.82 0.00 0.00 66.70 65.74 2vjr h VAL 93 Cb 0.46 1.68 -0.02 0.00 -1.52 0.00 0.00 31.29 31.88 2vjr h VAL 93 CO 0.02 0.55 0.09 0.77 0.02 0.00 0.00 177.57 179.03 2vjr h SER 94 N 0.60 1.02 -0.49 0.57 4.64 -0.84 -1.43 113.55 117.61 2vjr h SER 94 Ca 0.01 -0.27 0.03 0.00 -0.47 0.00 0.00 61.79 61.10 2vjr h SER 94 Cb 1.12 -0.27 -0.04 0.00 -0.31 0.00 0.00 62.40 62.90 2vjr h SER 94 CO 0.12 1.03 0.27 1.88 -0.87 0.00 0.00 176.83 179.26 2vjr h TYR 95 N 0.97 0.51 -0.67 4.77 0.05 -1.18 -1.38 116.97 120.03 2vjr h TYR 95 Ca 0.19 0.02 -0.00 0.00 0.05 0.00 0.00 58.73 58.99 2vjr h TYR 95 Cb 0.45 -0.16 -0.03 0.00 1.01 0.00 0.00 36.73 38.00 2vjr h TYR 95 CO 0.03 0.27 0.40 0.00 -1.05 0.00 0.00 178.16 177.82 2vjr h ALA 96 N 1.24 1.44 -0.09 3.88 0.00 -1.11 -1.72 119.26 122.90 2vjr h ALA 96 Ca 0.21 -0.08 -0.12 0.00 0.00 0.00 0.00 54.91 54.92 2vjr h ALA 96 Cb 0.07 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.57 2vjr h ALA 96 CO -0.12 0.48 -0.47 1.25 0.00 0.00 0.00 179.25 180.40 2vjr h LEU 97 N 0.93 0.23 -0.53 0.00 5.85 -0.58 0.10 115.31 121.31 2vjr h LEU 97 Ca 0.24 -0.11 -0.16 0.00 0.84 0.00 0.00 57.88 58.69 2vjr h LEU 97 Cb -0.03 -0.06 -0.01 0.00 0.37 0.00 0.00 40.66 40.92 2vjr h LEU 97 CO -0.05 0.67 -0.68 0.25 -0.34 0.00 0.00 178.44 178.29 2vjr h LEU 98 N 0.18 0.31 0.00 2.25 5.85 -0.82 -3.31 115.31 119.77 2vjr h LEU 98 Ca 0.01 -0.20 -0.18 0.00 0.84 0.00 0.00 57.88 58.36 2vjr h LEU 98 Cb 0.89 -0.09 -0.03 0.00 0.37 0.00 0.00 40.66 41.80 2vjr h LEU 98 CO 0.07 0.90 -0.89 0.00 -0.34 0.00 0.00 178.44 178.18 2vjr h ALA 99 N 1.10 0.50 -0.50 1.25 0.00 -0.81 -3.48 119.26 117.32 2vjr h ALA 99 Ca -0.02 -0.78 -0.16 0.00 0.00 0.00 0.00 54.91 53.95 2vjr h ALA 99 Cb 1.22 -0.07 -0.05 0.00 0.00 0.00 0.00 17.79 18.89 2vjr h ALA 99 CO 0.11 1.04 -0.15 0.41 0.00 0.00 0.00 179.25 180.66 2vjr n GLY 100 N 1.32 0.80 3.44 0.00 0.00 0.31 -1.61 105.19 109.44 2vjr n GLY 100 Ca -0.01 -0.67 -0.14 0.00 0.00 0.00 0.00 46.02 45.20 2vjr n GLY 100 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2vjr s ASP 101 N -2.87 -0.55 0.00 1.61 2.15 -1.13 -4.20 116.67 111.69 2vjr s ASP 101 Ca 0.00 1.00 0.30 0.00 0.43 0.00 0.00 52.55 54.28 2vjr s ASP 101 Cb 0.00 1.01 1.65 0.00 -0.30 0.00 0.00 42.92 45.28 2vjr s ASP 101 CO 0.00 -0.24 2.08 0.00 -0.17 0.00 0.00 175.17 176.84 2vjr n ALA 102 N 2.53 2.54 -0.04 3.66 0.00 -1.26 -4.42 120.51 123.52 2vjr n ALA 102 Ca -0.15 -0.16 -0.11 0.00 0.00 0.00 0.00 53.44 53.02 2vjr n ALA 102 Cb 0.56 -1.49 -0.06 0.00 0.00 0.00 0.00 19.45 18.47 2vjr n ALA 102 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 2vjr h SER 103 N 0.00 0.22 -0.90 0.00 4.64 -1.96 -0.91 113.55 114.64 2vjr h SER 103 Ca 0.00 -0.24 0.19 0.00 -0.47 0.00 0.00 61.79 61.26 2vjr h SER 103 Cb 0.14 -0.06 -0.07 0.00 -0.31 0.00 0.00 62.40 62.10 2vjr h SER 103 CO 0.00 0.41 0.59 1.62 -0.87 0.00 0.00 176.83 178.58 2vjr h VAL 104 N 0.02 0.72 -0.17 0.95 3.04 -1.83 0.30 116.25 119.28 2vjr h VAL 104 Ca 0.04 -0.17 -0.05 0.00 -1.01 0.00 0.00 66.70 65.51 2vjr h VAL 104 Cb 0.28 0.17 -0.00 0.00 -2.01 0.00 0.00 31.29 29.72 2vjr h VAL 104 CO 0.00 0.09 -0.10 0.25 -1.01 0.00 0.00 177.57 176.81 2vjr h LEU 105 N 0.51 0.38 -0.33 3.16 5.85 -1.43 -1.56 115.31 121.88 2vjr h LEU 105 Ca 0.47 -0.43 -0.16 0.00 0.84 0.00 0.00 57.88 58.61 2vjr h LEU 105 Cb 1.03 -0.10 -0.00 0.00 0.37 0.00 0.00 40.66 41.95 2vjr h LEU 105 CO -0.20 0.72 -0.40 -0.33 -0.34 0.00 0.00 178.44 177.88 2vjr h GLU 106 N 0.03 0.86 0.20 1.25 5.08 -0.06 -0.54 114.58 121.40 2vjr h GLU 106 Ca 0.04 -0.48 -0.33 0.00 -1.00 0.00 0.00 59.36 57.59 2vjr h GLU 106 Cb 0.58 0.03 0.02 0.00 0.50 0.00 0.00 28.75 29.88 2vjr h GLU 106 CO 0.03 1.12 -1.51 -0.44 -1.00 0.00 0.00 179.01 177.21 2vjr h ASP 107 N 0.65 0.65 0.02 1.42 3.32 -0.50 -0.51 116.42 121.47 2vjr h ASP 107 Ca 0.04 -0.78 0.00 0.00 0.02 0.00 0.00 57.03 56.32 2vjr h ASP 107 Cb 1.00 -0.21 0.00 0.00 0.22 0.00 0.00 39.33 40.34 2vjr h ASP 107 CO 0.10 1.62 -1.29 0.54 -1.72 0.00 0.00 179.24 178.49 2vjr n ARG 108 N -3.61 0.20 0.05 3.56 1.74 -0.59 -4.54 116.66 113.47 2vjr n ARG 108 Ca -0.17 -0.06 0.00 0.00 -0.77 0.00 0.00 57.85 56.85 2vjr n ARG 108 Cb 1.08 -1.51 0.00 0.00 -1.02 0.00 0.00 32.46 31.01 2vjr n ARG 108 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2vjr h LEU 110 N 0.00 0.00 -8.91 0.00 3.38 -1.11 -3.39 115.31 105.29 2vjr h LEU 110 Ca 0.00 0.00 -0.57 0.00 0.09 0.00 0.00 57.88 57.40 2vjr h LEU 110 Cb 0.30 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 41.00 2vjr h LEU 110 CO 0.00 0.23 1.06 0.21 0.09 0.00 0.00 178.44 180.04 2vjr s ASN 111 N -6.28 6.43 0.00 -0.43 2.47 -0.20 -2.21 114.94 114.72 2vjr s ASN 111 Ca 0.05 1.16 0.00 0.00 0.42 0.00 0.00 52.86 54.49 2vjr s ASN 111 Cb 0.07 -2.54 0.00 0.00 -1.45 0.00 0.00 41.25 37.33 2vjr s ASN 111 CO 0.69 -1.29 0.00 0.61 -3.72 0.00 0.00 177.10 173.38 2vjr n GLY 112 N 4.75 1.80 0.20 1.21 0.00 -1.26 -4.96 105.19 106.93 2vjr n GLY 112 Ca 0.17 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 46.13 2vjr n GLY 112 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 2vjr h LEU 113 N 0.00 0.41 -1.04 0.99 5.85 -1.64 -1.61 115.31 118.27 2vjr h LEU 113 Ca 0.00 0.01 0.07 0.00 0.84 0.00 0.00 57.88 58.81 2vjr h LEU 113 Cb 0.00 -0.07 -0.07 0.00 0.37 0.00 0.00 40.66 40.89 2vjr h LEU 113 CO 0.00 0.29 0.64 0.50 -0.34 0.00 0.00 178.44 179.53 2vjr h LYS 114 N 0.53 1.09 0.02 1.25 3.64 -1.80 -1.62 116.57 119.68 2vjr h LYS 114 Ca 0.20 -0.07 -0.22 0.00 -1.27 0.00 0.00 60.65 59.30 2vjr h LYS 114 Cb 0.07 -0.25 -0.00 0.00 -0.41 0.00 0.00 32.23 31.64 2vjr h LYS 114 CO -0.12 0.72 -0.95 0.93 -2.27 0.00 0.00 179.45 177.76 2vjr h GLU 115 N 1.13 0.28 0.25 1.90 3.07 -1.74 -1.31 114.58 118.17 2vjr h GLU 115 Ca 0.44 -0.33 0.01 0.00 -0.50 0.00 0.00 59.36 58.97 2vjr h GLU 115 Cb 0.22 0.10 -0.04 0.00 -0.84 0.00 0.00 28.75 28.19 2vjr h GLU 115 CO -0.18 1.05 -0.47 1.15 -1.40 0.00 0.00 179.01 179.15 2vjr h THR 116 N 0.15 0.08 -0.85 1.13 2.02 -0.87 -0.77 112.91 113.81 2vjr h THR 116 Ca -0.07 0.00 0.06 0.00 0.77 0.00 0.00 66.41 67.17 2vjr h THR 116 Cb 1.60 0.08 -0.06 0.00 -1.74 0.00 0.00 68.15 68.03 2vjr h THR 116 CO 0.15 0.00 0.52 1.88 0.37 0.00 0.00 175.52 178.45 2vjr h TYR 117 N -0.79 0.97 -0.00 3.16 0.05 -1.09 -0.28 116.97 118.97 2vjr h TYR 117 Ca -0.01 0.03 -0.00 0.00 0.05 0.00 0.00 58.73 58.79 2vjr h TYR 117 Cb 0.76 -0.31 -0.00 0.00 1.01 0.00 0.00 36.73 38.19 2vjr h TYR 117 CO -0.35 0.49 0.00 0.28 -1.05 0.00 0.00 178.16 177.53 2vjr h VAL 118 N 0.95 1.16 -0.82 -2.88 2.07 -1.18 0.51 116.25 116.06 2vjr h VAL 118 Ca 0.37 -0.47 0.19 0.00 0.82 0.00 0.00 66.70 67.61 2vjr h VAL 118 Cb 0.17 1.47 -0.12 0.00 -1.52 0.00 0.00 31.29 31.29 2vjr h VAL 118 CO -0.17 0.12 0.29 0.00 0.02 0.00 0.00 177.57 177.83 2vjr h ALA 119 N 0.80 1.20 0.00 1.67 0.00 -0.54 -1.64 119.26 120.75 2vjr h ALA 119 Ca 0.00 0.17 0.00 0.00 0.00 0.00 0.00 54.91 55.08 2vjr h ALA 119 Cb 0.20 0.19 0.00 0.00 0.00 0.00 0.00 17.79 18.18 2vjr h ALA 119 CO -0.00 -0.34 0.00 -0.07 0.00 0.00 0.00 179.25 178.84 2vjr h LEU 120 N 0.34 0.00 0.00 0.00 3.38 -0.42 -3.47 115.31 115.15 2vjr h LEU 120 Ca 0.49 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.46 2vjr h LEU 120 Cb 0.89 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.64 2vjr h LEU 120 CO -0.52 0.00 0.00 0.61 0.09 0.00 0.00 178.44 178.62 2vjr n GLY 121 N 0.55 0.52 3.69 0.83 0.00 -0.07 -5.03 105.19 105.69 2vjr n GLY 121 Ca 0.03 -0.33 -0.42 0.00 0.00 0.00 0.00 46.02 45.29 2vjr n GLY 121 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2vjr s THR 122 N -2.00 4.50 -0.36 2.61 2.01 -0.03 -4.95 115.64 117.42 2vjr s THR 122 Ca 0.00 1.79 -0.29 0.00 0.31 0.00 0.00 61.69 63.51 2vjr s THR 122 Cb 0.00 -4.15 -0.00 0.00 0.01 0.00 0.00 72.50 68.36 2vjr s THR 122 CO 0.00 0.02 1.49 -2.16 -0.69 0.00 0.00 174.62 173.27 2vjr s PRO 123 N 2.01 3.61 0.38 4.92 0.04 -1.26 -4.41 135.00 140.28 2vjr s PRO 123 Ca 0.53 1.15 0.10 0.00 0.04 0.00 0.00 61.00 62.82 2vjr s PRO 123 Cb -0.22 -4.04 0.75 0.00 0.04 0.00 0.00 34.50 31.04 2vjr s PRO 123 CO 0.21 -1.52 1.88 1.79 0.04 0.00 0.00 177.00 179.40 2vjr h THR 124 N 6.42 1.20 -0.26 1.26 1.35 -1.92 -2.04 112.91 118.91 2vjr h THR 124 Ca -0.29 -0.92 -0.09 0.00 -0.55 0.00 0.00 66.41 64.56 2vjr h THR 124 Cb 1.12 1.34 -0.01 0.00 -1.73 0.00 0.00 68.15 68.86 2vjr h THR 124 CO 1.06 0.28 -0.20 0.03 -0.25 0.00 0.00 175.52 176.44 2vjr h ARG 125 N 0.18 0.47 -0.42 4.72 3.08 -1.89 0.16 114.38 120.68 2vjr h ARG 125 Ca 0.03 -0.16 -0.13 0.00 0.07 0.00 0.00 59.98 59.79 2vjr h ARG 125 Cb 0.46 -0.04 -0.01 0.00 0.08 0.00 0.00 29.97 30.46 2vjr h ARG 125 CO 0.03 0.66 -0.26 0.77 -1.07 0.00 0.00 179.97 180.10 2vjr h SER 126 N 0.43 0.95 -0.73 7.04 0.02 -1.79 -2.02 113.55 117.45 2vjr h SER 126 Ca 0.07 -0.42 -0.04 0.00 -0.84 0.00 0.00 61.79 60.56 2vjr h SER 126 Cb 0.59 -0.26 -0.03 0.00 0.14 0.00 0.00 62.40 62.84 2vjr h SER 126 CO 0.04 1.17 0.29 0.58 -1.14 0.00 0.00 176.83 177.77 2vjr h VAL 127 N 0.74 1.25 -0.57 2.27 2.07 -0.97 -1.32 116.25 119.72 2vjr h VAL 127 Ca 0.09 -0.78 0.04 0.00 0.82 0.00 0.00 66.70 66.86 2vjr h VAL 127 Cb 0.84 0.40 -0.04 0.00 -1.52 0.00 0.00 31.29 30.97 2vjr h VAL 127 CO 0.07 0.32 0.31 0.00 0.02 0.00 0.00 177.57 178.29 2vjr h ALA 128 N 1.14 0.74 -0.48 1.67 0.00 -0.57 -2.20 119.26 119.55 2vjr h ALA 128 Ca 0.24 0.01 -0.01 0.00 0.00 0.00 0.00 54.91 55.15 2vjr h ALA 128 Cb 0.21 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.86 2vjr h ALA 128 CO -0.02 -0.00 0.27 -0.09 0.00 0.00 0.00 179.25 179.40 2vjr h ARG 129 N 0.61 0.66 -0.92 0.00 9.65 -0.87 -0.87 114.38 122.63 2vjr h ARG 129 Ca 0.24 -0.07 0.10 0.00 -1.10 0.00 0.00 59.98 59.15 2vjr h ARG 129 Cb 0.11 -0.13 -0.07 0.00 -1.39 0.00 0.00 29.97 28.49 2vjr h ARG 129 CO -0.14 0.51 0.59 0.00 2.80 0.00 0.00 179.97 183.73 2vjr h ALA 130 N 1.11 1.59 -0.44 2.80 0.00 -0.96 -0.35 119.26 123.01 2vjr h ALA 130 Ca 0.17 -0.00 -0.05 0.00 0.00 0.00 0.00 54.91 55.03 2vjr h ALA 130 Cb 0.04 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.59 2vjr h ALA 130 CO -0.03 0.22 0.09 0.28 0.00 0.00 0.00 179.25 179.82 2vjr h VAL 131 N 0.94 1.24 -0.97 0.00 2.07 -0.78 -1.75 116.25 116.99 2vjr h VAL 131 Ca 0.43 -0.84 0.03 0.00 0.82 0.00 0.00 66.70 67.14 2vjr h VAL 131 Cb 0.39 0.95 -0.06 0.00 -1.52 0.00 0.00 31.29 31.05 2vjr h VAL 131 CO -0.19 0.29 0.64 1.56 0.02 0.00 0.00 177.57 179.89 2vjr h GLN 132 N 0.58 1.20 -0.28 1.57 4.20 -0.00 -1.36 115.11 121.00 2vjr h GLN 132 Ca 0.14 -0.07 -0.10 0.00 0.06 0.00 0.00 58.65 58.68 2vjr h GLN 132 Cb 0.34 -0.27 -0.01 0.00 0.30 0.00 0.00 27.48 27.85 2vjr h GLN 132 CO 0.00 0.79 -0.20 -0.07 -0.67 0.00 0.00 178.83 178.69 2vjr h LEU 133 N 1.23 0.66 -0.60 1.46 3.38 -0.98 -2.44 115.31 118.03 2vjr h LEU 133 Ca 0.38 -0.44 0.09 0.00 0.09 0.00 0.00 57.88 58.00 2vjr h LEU 133 Cb -0.01 -0.19 -0.07 0.00 0.09 0.00 0.00 40.66 40.49 2vjr h LEU 133 CO -0.12 0.96 0.23 0.24 0.09 0.00 0.00 178.44 179.85 2vjr h MET 134 N 0.37 0.41 -0.33 1.13 2.86 -1.03 -2.15 114.93 116.19 2vjr h MET 134 Ca 0.06 -0.02 0.07 0.00 -2.06 0.00 0.00 59.70 57.74 2vjr h MET 134 Cb 0.74 -0.09 -0.07 0.00 0.06 0.00 0.00 31.60 32.24 2vjr h MET 134 CO 0.05 0.27 -0.12 -0.22 1.06 0.00 0.00 176.91 177.95 2vjr h LYS 135 N 0.42 -0.05 -0.10 1.72 3.64 -1.11 0.20 116.57 121.29 2vjr h LYS 135 Ca 0.30 0.00 0.04 0.00 -1.27 0.00 0.00 60.65 59.72 2vjr h LYS 135 Cb 0.35 0.01 -0.05 0.00 -0.41 0.00 0.00 32.23 32.13 2vjr h LYS 135 CO -0.29 -0.03 -0.17 0.93 -2.27 0.00 0.00 179.45 177.62 2vjr h GLU 136 N -0.05 -0.22 -0.28 1.90 5.08 -0.91 -1.67 114.58 118.44 2vjr h GLU 136 Ca 0.17 0.01 -0.17 0.00 -1.00 0.00 0.00 59.36 58.37 2vjr h GLU 136 Cb 0.30 0.05 0.00 0.00 0.50 0.00 0.00 28.75 29.60 2vjr h GLU 136 CO -0.37 -0.15 -0.50 1.15 -1.00 0.00 0.00 179.01 178.14 2vjr h THR 137 N -0.23 1.28 0.26 1.13 2.02 -1.24 -1.50 112.91 114.64 2vjr h THR 137 Ca 0.09 -1.69 -0.01 0.00 0.77 0.00 0.00 66.41 65.57 2vjr h THR 137 Cb 0.35 1.66 -0.00 0.00 -1.74 0.00 0.00 68.15 68.42 2vjr h THR 137 CO -0.24 0.55 -0.15 0.00 0.37 0.00 0.00 175.52 176.05 2vjr h ALA 138 N 0.67 -0.38 -0.89 6.16 0.00 -0.50 -1.43 119.26 122.90 2vjr h ALA 138 Ca 0.02 -0.08 0.03 0.00 0.00 0.00 0.00 54.91 54.88 2vjr h ALA 138 Cb 1.11 0.18 -0.05 0.00 0.00 0.00 0.00 17.79 19.03 2vjr h ALA 138 CO 0.11 -0.72 0.58 0.82 0.00 0.00 0.00 179.25 180.05 2vjr h ILE 139 N -0.39 1.18 -0.58 0.00 2.04 -1.35 -0.30 117.51 118.12 2vjr h ILE 139 Ca -0.03 -0.39 0.11 0.00 1.00 0.00 0.00 64.86 65.55 2vjr h ILE 139 Cb 0.32 -0.06 -0.11 0.00 -0.74 0.00 0.00 36.82 36.22 2vjr h ILE 139 CO 0.04 0.21 -0.23 1.23 0.00 0.00 0.00 178.15 179.39 2vjr h GLY 140 N 1.14 0.19 1.37 5.37 0.00 -0.83 -1.01 103.07 109.30 2vjr h GLY 140 Ca 0.34 0.30 -0.12 0.00 0.00 0.00 0.00 47.33 47.85 2vjr h GLY 140 CO -0.09 -0.23 -0.29 -0.97 0.00 0.00 0.00 176.54 174.96 2vjr h TYR 141 N -0.09 0.82 -0.36 5.60 0.05 -0.06 -2.09 116.97 120.84 2vjr h TYR 141 Ca 0.26 -0.20 0.00 0.00 0.05 0.00 0.00 58.73 58.84 2vjr h TYR 141 Cb 0.50 -0.19 -0.02 0.00 1.01 0.00 0.00 36.73 38.03 2vjr h TYR 141 CO -0.55 0.92 0.22 0.28 -1.05 0.00 0.00 178.16 177.98 2vjr h VAL 142 N 0.61 1.10 0.00 -2.88 2.07 -0.51 -3.07 116.25 113.57 2vjr h VAL 142 Ca 0.07 -0.21 -0.02 0.00 0.82 0.00 0.00 66.70 67.36 2vjr h VAL 142 Cb 0.80 0.59 -0.00 0.00 -1.52 0.00 0.00 31.29 31.15 2vjr h VAL 142 CO 0.07 0.10 -0.90 0.78 0.02 0.00 0.00 177.57 177.64 2vjr h ASN 143 N 0.49 0.00 -2.18 0.57 2.35 -0.78 -3.43 115.58 112.60 2vjr h ASN 143 Ca 0.13 0.00 -0.56 0.00 -0.55 0.00 0.00 56.30 55.31 2vjr h ASN 143 Cb -0.03 0.00 -0.38 0.00 0.05 0.00 0.00 38.32 37.96 2vjr h ASN 143 CO -0.03 0.09 -1.01 -1.20 -1.65 0.00 0.00 177.43 173.64 2vjr n SER 144 N -2.78 -0.38 -4.00 5.81 7.64 -0.82 -5.10 113.62 113.98 2vjr n SER 144 Ca -0.01 -2.50 -0.18 0.00 1.01 0.00 0.00 58.87 57.19 2vjr n SER 144 Cb 0.59 -0.49 0.00 0.00 -1.01 0.00 0.00 64.21 63.30 2vjr n SER 144 CO 0.00 0.00 0.00 -0.81 -3.01 0.00 0.00 175.04 171.22 2vjr n PRO 145 N 2.35 0.91 -2.66 1.43 -0.04 -1.25 -4.82 135.00 130.92 2vjr n PRO 145 Ca 0.26 -2.42 -0.42 0.00 -0.04 0.00 0.00 63.50 60.88 2vjr n PRO 145 Cb 0.50 0.25 -0.03 0.00 -0.04 0.00 0.00 33.50 34.18 2vjr n PRO 145 CO 0.00 0.00 0.00 -1.12 -0.04 0.00 0.00 175.50 174.34 2vjr s SER 146 N -3.28 6.29 -1.33 3.54 0.01 -1.26 -4.38 113.70 113.29 2vjr s SER 146 Ca 0.22 -0.33 -0.08 0.00 1.31 0.00 0.00 55.95 57.07 2vjr s SER 146 Cb -0.02 -2.51 0.05 0.00 0.21 0.00 0.00 66.02 63.75 2vjr s SER 146 CO 0.14 -1.55 0.49 0.61 0.41 0.00 0.00 173.24 173.34 2vjr n GLY 147 N 5.22 -0.49 3.78 3.44 0.00 -1.26 -4.96 105.19 110.92 2vjr n GLY 147 Ca 0.04 0.09 -0.36 0.00 0.00 0.00 0.00 46.02 45.78 2vjr n GLY 147 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2vjr s VAL 148 N -2.97 4.12 0.25 1.61 1.01 -1.26 -5.01 120.40 118.15 2vjr s VAL 148 Ca 0.36 1.69 -0.31 0.00 0.00 0.00 0.00 61.98 63.71 2vjr s VAL 148 Cb -0.18 -3.90 -0.13 0.00 0.00 0.00 0.00 36.38 32.16 2vjr s VAL 148 CO 0.44 0.07 1.41 0.41 0.00 0.00 0.00 175.10 177.43 2vjr n THR 149 N 0.32 0.99 -2.27 3.92 -1.04 -1.26 -4.91 114.28 110.04 2vjr n THR 149 Ca 0.03 -0.25 -0.42 0.00 -2.04 0.00 0.00 64.05 61.37 2vjr n THR 149 Cb 0.50 -1.51 -0.03 0.00 -1.82 0.00 0.00 70.33 67.47 2vjr n THR 149 CO 0.00 0.00 0.00 -0.13 -0.64 0.00 0.00 175.07 174.30 2vjr s ARG 150 N -0.47 4.39 0.00 -2.82 1.81 -1.26 -4.96 118.95 115.64 2vjr s ARG 150 Ca 0.67 1.98 0.00 0.00 -1.72 0.00 0.00 55.73 56.66 2vjr s ARG 150 Cb -0.64 -3.25 0.00 0.00 -0.45 0.00 0.00 34.95 30.61 2vjr s ARG 150 CO 0.50 -0.29 0.00 0.41 -0.68 0.00 0.00 175.30 175.24 2vjr n GLY 151 N 2.88 1.21 3.36 -3.53 0.00 -1.26 -5.14 105.19 102.71 2vjr n GLY 151 Ca 0.08 -0.72 -0.37 0.00 0.00 0.00 0.00 46.02 45.01 2vjr n GLY 151 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2vjr s ASP 152 N 0.94 5.10 0.00 1.61 -1.08 -1.26 -4.95 116.67 117.02 2vjr s ASP 152 Ca 0.00 -0.61 0.08 0.00 -0.52 0.00 0.00 52.55 51.51 2vjr s ASP 152 Cb 0.00 -1.88 0.24 0.00 -1.46 0.00 0.00 42.92 39.81 2vjr s ASP 152 CO 0.00 -0.16 1.19 0.00 0.52 0.00 0.00 175.17 176.72 2vjr h SER 154 N 1.61 0.92 -0.26 0.00 4.64 -1.98 0.11 113.55 118.59 2vjr h SER 154 Ca 0.00 0.03 0.04 0.00 -0.47 0.00 0.00 61.79 61.39 2vjr h SER 154 Cb 0.68 -0.16 -0.04 0.00 -0.31 0.00 0.00 62.40 62.57 2vjr h SER 154 CO 0.00 0.53 0.01 0.00 -0.87 0.00 0.00 176.83 176.50 2vjr h ALA 155 N 1.52 0.23 -0.25 5.18 0.00 -2.00 0.16 119.26 124.10 2vjr h ALA 155 Ca 0.46 0.07 -0.10 0.00 0.00 0.00 0.00 54.91 55.34 2vjr h ALA 155 Cb 0.38 0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.27 2vjr h ALA 155 CO -0.21 -0.41 -0.25 -0.07 0.00 0.00 0.00 179.25 178.30 2vjr h LEU 156 N 0.09 0.48 -0.76 0.00 3.38 -1.60 -2.13 115.31 114.78 2vjr h LEU 156 Ca 0.12 -0.16 -0.10 0.00 0.09 0.00 0.00 57.88 57.83 2vjr h LEU 156 Cb 0.15 -0.13 -0.02 0.00 0.09 0.00 0.00 40.66 40.75 2vjr h LEU 156 CO -0.20 0.73 -0.12 0.58 0.09 0.00 0.00 178.44 179.53 2vjr h VAL 157 N 0.43 1.26 -0.18 1.22 2.07 -0.33 -0.77 116.25 119.95 2vjr h VAL 157 Ca 0.06 -1.20 -0.00 0.00 0.82 0.00 0.00 66.70 66.38 2vjr h VAL 157 Cb 0.67 1.04 -0.01 0.00 -1.52 0.00 0.00 31.29 31.47 2vjr h VAL 157 CO 0.05 0.41 0.10 0.78 0.02 0.00 0.00 177.57 178.93 2vjr h ASN 158 N 0.74 0.22 -0.35 0.57 2.35 -0.66 -1.77 115.58 116.68 2vjr h ASN 158 Ca 0.12 -0.07 -0.03 0.00 -0.55 0.00 0.00 56.30 55.77 2vjr h ASN 158 Cb 0.62 -0.06 -0.01 0.00 0.05 0.00 0.00 38.32 38.92 2vjr h ASN 158 CO 0.04 0.23 0.10 -0.08 -1.65 0.00 0.00 177.43 176.07 2vjr h GLU 159 N 0.20 0.55 -0.76 0.81 4.81 -1.11 -0.39 114.58 118.70 2vjr h GLU 159 Ca 0.06 -0.12 0.10 0.00 -0.13 0.00 0.00 59.36 59.27 2vjr h GLU 159 Cb 0.05 -0.08 -0.07 0.00 0.63 0.00 0.00 28.75 29.28 2vjr h GLU 159 CO -0.01 0.58 0.39 0.00 -0.73 0.00 0.00 179.01 179.25 2vjr h ALA 160 N 0.94 1.07 -0.82 2.92 0.00 -1.15 -2.02 119.26 120.20 2vjr h ALA 160 Ca 0.11 0.05 0.01 0.00 0.00 0.00 0.00 54.91 55.09 2vjr h ALA 160 Cb 0.27 -0.07 -0.04 0.00 0.00 0.00 0.00 17.79 17.95 2vjr h ALA 160 CO -0.00 -0.01 0.54 0.00 0.00 0.00 0.00 179.25 179.78 2vjr h ALA 161 N 1.45 1.06 0.00 0.00 0.00 -0.29 -1.71 119.26 119.77 2vjr h ALA 161 Ca 0.38 -0.05 -0.05 0.00 0.00 0.00 0.00 54.91 55.18 2vjr h ALA 161 Cb 0.40 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 17.86 2vjr h ALA 161 CO -0.27 0.43 -0.24 1.79 0.00 0.00 0.00 179.25 180.95 2vjr h THR 162 N 1.09 1.00 -0.15 0.00 1.35 -0.40 0.78 112.91 116.59 2vjr h THR 162 Ca 0.31 -0.88 -0.17 0.00 -0.55 0.00 0.00 66.41 65.13 2vjr h THR 162 Cb -0.09 1.50 0.01 0.00 -1.73 0.00 0.00 68.15 67.83 2vjr h THR 162 CO -0.08 0.24 -0.55 1.88 -0.25 0.00 0.00 175.52 176.75 2vjr h TYR 163 N 0.00 0.85 -0.62 4.73 0.05 -0.94 0.23 116.97 121.27 2vjr h TYR 163 Ca -0.00 -0.35 -0.01 0.00 0.05 0.00 0.00 58.73 58.42 2vjr h TYR 163 Cb 0.48 -0.14 -0.03 0.00 1.01 0.00 0.00 36.73 38.05 2vjr h TYR 163 CO 0.00 1.15 0.36 0.74 -1.05 0.00 0.00 178.16 179.36 2vjr h PHE 164 N 0.30 0.83 -0.27 4.88 0.04 -0.51 -2.55 116.94 119.66 2vjr h PHE 164 Ca -0.03 -0.01 -0.11 0.00 2.80 0.00 0.00 57.97 60.63 2vjr h PHE 164 Cb 1.18 -0.27 -0.01 0.00 2.20 0.00 0.00 35.95 39.05 2vjr h PHE 164 CO 0.10 0.58 -0.29 -0.44 -0.60 0.00 0.00 178.31 177.66 2vjr h ASP 165 N 0.84 0.56 0.12 2.17 3.32 0.70 -1.55 116.42 122.58 2vjr h ASP 165 Ca 0.22 -0.21 0.02 0.00 0.02 0.00 0.00 57.03 57.08 2vjr h ASP 165 Cb 0.00 -0.15 -0.03 0.00 0.22 0.00 0.00 39.33 39.37 2vjr h ASP 165 CO -0.04 0.82 -0.23 0.11 -1.72 0.00 0.00 179.24 178.18 2vjr h LYS 166 N 0.47 -0.42 -0.21 3.56 1.57 -0.43 -0.02 116.57 121.11 2vjr h LYS 166 Ca 0.06 0.03 0.04 0.00 -1.87 0.00 0.00 60.65 58.91 2vjr h LYS 166 Cb 0.74 0.09 -0.04 0.00 0.08 0.00 0.00 32.23 33.11 2vjr h LYS 166 CO 0.06 -0.28 -0.03 0.00 -0.57 0.00 0.00 179.45 178.63 2vjr h ALA 167 N 0.34 0.15 -0.27 3.86 0.00 -1.29 0.15 119.26 122.19 2vjr h ALA 167 Ca 0.03 0.07 0.04 0.00 0.00 0.00 0.00 54.91 55.05 2vjr h ALA 167 Cb 0.46 0.14 -0.04 0.00 0.00 0.00 0.00 17.79 18.35 2vjr h ALA 167 CO -0.13 -0.46 0.04 0.00 0.00 0.00 0.00 179.25 178.70 2vjr h ALA 168 N 1.20 0.27 0.03 0.00 0.00 -1.19 -2.29 119.26 117.28 2vjr h ALA 168 Ca 0.10 0.06 -0.00 0.00 0.00 0.00 0.00 54.91 55.06 2vjr h ALA 168 Cb 0.14 0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.01 2vjr h ALA 168 CO -0.20 -0.37 -0.01 0.00 0.00 0.00 0.00 179.25 178.67 2vjr h ALA 169 N 1.21 -0.04 -0.81 0.00 0.00 -0.54 -1.97 119.26 117.11 2vjr h ALA 169 Ca 0.13 -0.10 0.20 0.00 0.00 0.00 0.00 54.91 55.13 2vjr h ALA 169 Cb 0.14 0.02 -0.05 0.00 0.00 0.00 0.00 17.79 17.89 2vjr h ALA 169 CO -0.18 -0.43 0.55 1.03 0.00 0.00 0.00 179.25 180.23 2vjr h SER 170 N -0.23 0.24 0.10 0.00 0.87 -0.55 -3.18 113.55 110.80 2vjr h SER 170 Ca -0.00 0.02 -0.37 0.00 -1.23 0.00 0.00 61.79 60.21 2vjr h SER 170 Cb 0.21 -0.02 -0.03 0.00 -0.44 0.00 0.00 62.40 62.12 2vjr h SER 170 CO 0.01 0.10 -2.12 -0.38 -0.53 0.00 0.00 176.83 173.91 2vjr n ILE 171 N -4.42 1.70 0.00 2.23 5.41 -0.88 -4.55 119.36 118.84 2vjr n ILE 171 Ca 0.17 -0.64 0.00 0.00 1.00 0.00 0.00 62.75 63.27 2vjr n ILE 171 Cb 0.71 -1.61 0.00 0.00 -0.71 0.00 0.00 39.64 38.03 2vjr n ILE 171 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55