#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2c8p s VAL 2 N 0.00 5.23 0.43 3.15 1.01 -1.26 -0.66 120.40 128.29 2c8p s VAL 2 Ca 0.00 -0.34 -0.22 0.00 0.00 0.00 0.00 61.98 61.42 2c8p s VAL 2 Cb 0.00 -3.85 -0.10 0.00 0.00 0.00 0.00 36.38 32.43 2c8p s VAL 2 CO 0.00 -0.19 0.99 -0.36 0.00 0.00 0.00 175.10 175.54 2c8p s PHE 3 N 1.82 3.27 0.72 5.22 0.08 0.00 -4.99 117.98 124.11 2c8p s PHE 3 Ca 0.08 1.63 -0.11 0.00 0.12 0.00 0.00 56.93 58.65 2c8p s PHE 3 Cb -0.18 -2.96 0.02 0.00 -0.57 0.00 0.00 43.02 39.34 2c8p s PHE 3 CO 0.11 -0.33 1.07 0.20 -0.10 0.00 0.00 175.22 176.17 2c8p s GLY 4 N -1.96 1.71 0.11 4.36 0.00 -1.26 -4.83 107.32 105.45 2c8p s GLY 4 Ca 0.61 0.19 -0.31 0.00 0.00 0.00 0.00 44.72 45.21 2c8p s GLY 4 CO 0.18 0.51 1.59 -0.09 0.00 0.00 0.00 173.10 175.30 2c8p h ARG 5 N -0.79 -0.67 -0.08 2.90 2.43 -1.97 -0.30 114.38 115.90 2c8p h ARG 5 Ca -0.44 0.05 -0.13 0.00 -0.81 0.00 0.00 59.98 58.65 2c8p h ARG 5 Cb 1.22 0.15 -0.01 0.00 -0.42 0.00 0.00 29.97 30.91 2c8p h ARG 5 CO 0.55 -0.45 -0.52 0.00 -1.51 0.00 0.00 179.97 178.04 2c8p h GLU 7 N 0.17 0.65 -0.47 0.00 4.81 -1.90 -0.69 114.58 117.15 2c8p h GLU 7 Ca 0.00 -0.05 -0.12 0.00 -0.13 0.00 0.00 59.36 59.06 2c8p h GLU 7 Cb 0.97 -0.14 -0.01 0.00 0.63 0.00 0.00 28.75 30.19 2c8p h GLU 7 CO 0.08 0.45 -0.18 1.25 -0.73 0.00 0.00 179.01 179.88 2c8p h LEU 8 N 0.66 0.97 -0.48 1.64 5.85 -0.87 -1.77 115.31 121.31 2c8p h LEU 8 Ca 0.18 -0.39 0.06 0.00 0.84 0.00 0.00 57.88 58.57 2c8p h LEU 8 Cb -0.05 -0.27 -0.05 0.00 0.37 0.00 0.00 40.66 40.67 2c8p h LEU 8 CO -0.04 1.14 0.20 0.00 -0.34 0.00 0.00 178.44 179.40 2c8p h ALA 9 N 0.86 0.59 -0.44 1.25 0.00 -1.09 0.11 119.26 120.55 2c8p h ALA 9 Ca 0.11 0.05 -0.02 0.00 0.00 0.00 0.00 54.91 55.05 2c8p h ALA 9 Cb 0.76 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.53 2c8p h ALA 9 CO 0.06 -0.18 0.19 0.00 0.00 0.00 0.00 179.25 179.32 2c8p h ALA 10 N 1.30 0.57 -0.65 0.00 0.00 -1.02 -1.04 119.26 118.41 2c8p h ALA 10 Ca 0.22 -0.13 -0.02 0.00 0.00 0.00 0.00 54.91 54.98 2c8p h ALA 10 Cb 0.20 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 17.79 2c8p h ALA 10 CO -0.20 0.15 0.32 0.00 0.00 0.00 0.00 179.25 179.52 2c8p h ALA 11 N 1.03 0.84 -0.72 0.00 0.00 -0.90 0.11 119.26 119.62 2c8p h ALA 11 Ca 0.15 -0.14 -0.06 0.00 0.00 0.00 0.00 54.91 54.86 2c8p h ALA 11 Cb 0.16 -0.26 -0.03 0.00 0.00 0.00 0.00 17.79 17.66 2c8p h ALA 11 CO -0.01 0.40 0.23 0.52 0.00 0.00 0.00 179.25 180.39 2c8p h MET 12 N 0.90 1.11 -0.32 0.00 2.86 -0.64 -1.52 114.93 117.32 2c8p h MET 12 Ca 0.22 -0.23 -0.04 0.00 -2.06 0.00 0.00 59.70 57.59 2c8p h MET 12 Cb 0.12 -0.17 -0.01 0.00 0.06 0.00 0.00 31.60 31.60 2c8p h MET 12 CO -0.03 0.94 0.04 -0.22 1.06 0.00 0.00 176.91 178.70 2c8p h LYS 13 N 1.07 0.54 -0.90 1.72 3.64 -0.89 -1.06 116.57 120.69 2c8p h LYS 13 Ca 0.23 -0.15 0.15 0.00 -1.27 0.00 0.00 60.65 59.62 2c8p h LYS 13 Cb 0.29 -0.06 -0.10 0.00 -0.41 0.00 0.00 32.23 31.95 2c8p h LYS 13 CO -0.01 0.65 0.50 -0.09 -2.27 0.00 0.00 179.45 178.23 2c8p h ARG 14 N 0.36 0.67 -0.25 1.90 2.43 -0.77 -1.47 114.38 117.25 2c8p h ARG 14 Ca 0.09 -0.04 0.00 0.00 -0.81 0.00 0.00 59.98 59.22 2c8p h ARG 14 Cb 0.38 -0.15 0.00 0.00 -0.42 0.00 0.00 29.97 29.78 2c8p h ARG 14 CO 0.01 0.45 0.00 0.72 -1.51 0.00 0.00 179.97 179.64 2c8p n HIS 15 N -4.82 0.33 -1.00 2.20 8.25 -0.59 -4.93 115.22 114.66 2c8p n HIS 15 Ca 0.19 -0.17 0.00 0.00 -0.26 0.00 0.00 57.72 57.48 2c8p n HIS 15 Cb 0.46 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.57 2c8p n HIS 15 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2c8p n GLY 16 N 1.03 0.56 0.18 -1.41 0.00 -0.55 -4.95 105.19 100.05 2c8p n GLY 16 Ca 0.12 -0.83 0.12 0.00 0.00 0.00 0.00 46.02 45.44 2c8p n GLY 16 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2c8p h LEU 17 N 0.00 0.00 -9.18 0.99 3.38 -1.40 -3.40 115.31 105.70 2c8p h LEU 17 Ca 0.00 -0.00 -0.55 0.00 0.09 0.00 0.00 57.88 57.41 2c8p h LEU 17 Cb 0.21 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.96 2c8p h LEU 17 CO 0.00 0.00 1.23 -0.62 0.09 0.00 0.00 178.44 179.14 2c8p s ASP 18 N -5.88 6.27 -1.27 -0.43 2.15 -1.26 -1.19 116.67 115.06 2c8p s ASP 18 Ca 0.05 2.16 0.00 0.00 0.43 0.00 0.00 52.55 55.19 2c8p s ASP 18 Cb 0.07 -2.53 0.00 0.00 -0.30 0.00 0.00 42.92 40.16 2c8p s ASP 18 CO 0.70 -1.27 0.00 -3.20 -0.17 0.00 0.00 175.17 171.23 2c8p n ASN 19 N 8.55 -5.02 -4.70 -0.34 4.05 -0.17 -4.89 115.26 112.73 2c8p n ASN 19 Ca 0.21 0.29 -0.42 0.00 0.45 0.00 0.00 54.58 55.12 2c8p n ASN 19 Cb 0.43 -3.57 -0.03 0.00 1.23 0.00 0.00 39.78 37.84 2c8p n ASN 19 CO 0.00 0.00 0.00 -0.47 -3.05 0.00 0.00 177.26 173.74 2c8p s TYR 20 N -2.25 2.52 -1.32 1.20 5.04 -0.33 -1.18 117.35 121.03 2c8p s TYR 20 Ca 0.00 0.29 0.00 0.00 -2.44 0.00 0.00 57.07 54.92 2c8p s TYR 20 Cb 0.00 -4.03 0.00 0.00 0.35 0.00 0.00 41.96 38.28 2c8p s TYR 20 CO 0.00 -4.08 0.00 0.54 -1.34 0.00 0.00 175.55 170.67 2c8p n ARG 21 N 5.14 -1.91 -0.91 4.97 5.12 -1.26 -1.41 116.66 126.39 2c8p n ARG 21 Ca 0.16 0.74 0.00 0.00 -1.93 0.00 0.00 57.85 56.82 2c8p n ARG 21 Cb 0.39 -5.29 0.00 0.00 -1.16 0.00 0.00 32.46 26.40 2c8p n ARG 21 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 2c8p n GLY 22 N -0.73 0.66 3.52 -0.13 0.00 -0.33 -5.02 105.19 103.17 2c8p n GLY 22 Ca -0.17 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.43 2c8p n GLY 22 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2c8p s TYR 23 N -2.50 3.18 0.77 1.61 2.02 -0.50 -4.88 117.35 117.05 2c8p s TYR 23 Ca 0.00 -0.12 -0.14 0.00 -0.37 0.00 0.00 57.07 56.44 2c8p s TYR 23 Cb 0.00 -2.82 0.06 0.00 -0.40 0.00 0.00 41.96 38.80 2c8p s TYR 23 CO 0.00 -0.57 1.22 -1.54 -1.57 0.00 0.00 175.55 173.09 2c8p s SER 24 N 1.78 3.85 0.31 2.29 1.04 -1.26 -1.00 113.70 120.70 2c8p s SER 24 Ca 0.13 2.39 0.08 0.00 0.48 0.00 0.00 55.95 59.04 2c8p s SER 24 Cb -0.16 -2.59 0.85 0.00 0.10 0.00 0.00 66.02 64.22 2c8p s SER 24 CO 0.13 -2.50 1.72 0.25 0.98 0.00 0.00 173.24 173.82 2c8p h LEU 25 N -0.60 0.58 -1.49 2.42 5.85 -1.90 -0.44 115.31 119.73 2c8p h LEU 25 Ca -0.47 0.14 0.10 0.00 0.84 0.00 0.00 57.88 58.49 2c8p h LEU 25 Cb 1.30 0.06 -0.05 0.00 0.37 0.00 0.00 40.66 42.35 2c8p h LEU 25 CO 0.48 0.07 0.47 1.23 -0.34 0.00 0.00 178.44 180.34 2c8p h GLY 26 N 0.53 0.82 0.98 3.75 0.00 -1.91 -1.43 103.07 105.80 2c8p h GLY 26 Ca 0.63 -0.24 -0.01 0.00 0.00 0.00 0.00 47.33 47.71 2c8p h GLY 26 CO -0.49 0.13 0.26 3.43 0.00 0.00 0.00 176.54 179.87 2c8p h ASN 27 N 0.57 0.65 -0.52 0.19 2.35 -1.30 -0.22 115.58 117.29 2c8p h ASN 27 Ca 0.33 -0.11 -0.12 0.00 -0.55 0.00 0.00 56.30 55.85 2c8p h ASN 27 Cb 0.52 -0.17 -0.02 0.00 0.05 0.00 0.00 38.32 38.71 2c8p h ASN 27 CO -0.11 0.57 -0.15 -0.50 -1.65 0.00 0.00 177.43 175.59 2c8p h TRP 28 N 0.67 1.15 -0.27 1.19 4.06 -1.37 -1.21 115.95 120.17 2c8p h TRP 28 Ca 0.18 -0.26 -0.07 0.00 2.06 0.00 0.00 58.89 60.80 2c8p h TRP 28 Cb 0.09 -0.28 -0.01 0.00 -1.00 0.00 0.00 29.16 27.96 2c8p h TRP 28 CO -0.01 1.08 -0.11 0.28 -3.56 0.00 0.00 178.44 176.12 2c8p h VAL 29 N 0.89 1.29 -0.57 1.49 2.07 -1.18 -1.59 116.25 118.64 2c8p h VAL 29 Ca 0.13 -1.17 0.03 0.00 0.82 0.00 0.00 66.70 66.51 2c8p h VAL 29 Cb 0.73 1.48 -0.04 0.00 -1.52 0.00 0.00 31.29 31.94 2c8p h VAL 29 CO 0.06 0.37 0.34 0.00 0.02 0.00 0.00 177.57 178.36 2c8p h ALA 31 N 1.26 0.54 -0.56 0.00 0.00 -1.12 -2.49 119.26 116.90 2c8p h ALA 31 Ca 0.23 -0.07 -0.06 0.00 0.00 0.00 0.00 54.91 55.01 2c8p h ALA 31 Cb 0.04 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 17.63 2c8p h ALA 31 CO -0.11 0.05 0.09 0.00 0.00 0.00 0.00 179.25 179.28 2c8p h ALA 32 N 1.11 1.10 -0.20 0.00 0.00 -0.94 0.56 119.26 120.88 2c8p h ALA 32 Ca 0.15 -0.24 0.04 0.00 0.00 0.00 0.00 54.91 54.86 2c8p h ALA 32 Cb 0.02 -0.22 -0.04 0.00 0.00 0.00 0.00 17.79 17.55 2c8p h ALA 32 CO -0.03 0.59 -0.06 -0.22 0.00 0.00 0.00 179.25 179.53 2c8p h LYS 33 N 0.85 -0.02 0.00 0.00 1.63 -0.59 -0.96 116.57 117.48 2c8p h LYS 33 Ca 0.18 0.00 -0.11 0.00 -0.85 0.00 0.00 60.65 59.87 2c8p h LYS 33 Cb 0.38 0.00 -0.02 0.00 -0.60 0.00 0.00 32.23 31.99 2c8p h LYS 33 CO 0.01 -0.01 -0.86 0.74 -3.45 0.00 0.00 179.45 175.88 2c8p h PHE 34 N -0.02 0.00 -0.13 1.91 0.04 -1.24 0.13 116.94 117.63 2c8p h PHE 34 Ca 0.10 0.00 -0.10 0.00 2.80 0.00 0.00 57.97 60.78 2c8p h PHE 34 Cb 0.17 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.32 2c8p h PHE 34 CO -0.23 0.43 -0.29 0.93 -0.60 0.00 0.00 178.31 178.55 2c8p h GLU 35 N 0.00 0.43 0.00 1.51 4.39 -0.81 -3.42 114.58 116.67 2c8p h GLU 35 Ca -0.06 -0.28 0.00 0.00 0.34 0.00 0.00 59.36 59.35 2c8p h GLU 35 Cb 1.38 0.04 0.00 0.00 -0.10 0.00 0.00 28.75 30.07 2c8p h GLU 35 CO 0.05 0.89 0.00 -1.13 -1.16 0.00 0.00 179.01 177.66 2c8p n SER 36 N -4.41 0.17 -2.89 1.42 3.41 -0.39 -4.83 113.62 106.10 2c8p n SER 36 Ca -0.07 -0.72 -0.19 0.00 -0.26 0.00 0.00 58.87 57.63 2c8p n SER 36 Cb 0.47 0.08 0.00 0.00 -0.26 0.00 0.00 64.21 64.50 2c8p n SER 36 CO 0.00 0.00 0.00 -3.20 -0.16 0.00 0.00 175.04 171.68 2c8p n ASN 37 N -0.08 -4.48 -0.40 4.04 5.15 0.45 -1.90 115.26 118.05 2c8p n ASN 37 Ca 0.00 -0.13 -0.05 0.00 -0.60 0.00 0.00 54.58 53.79 2c8p n ASN 37 Cb 0.13 -3.71 -0.02 0.00 -0.53 0.00 0.00 39.78 35.64 2c8p n ASN 37 CO 0.00 0.00 0.00 0.49 1.40 0.00 0.00 177.26 179.15 2c8p n PHE 38 N -3.88 0.00 -3.42 1.20 3.72 -1.21 -4.83 117.46 109.04 2c8p n PHE 38 Ca -0.10 0.00 -0.41 0.00 -0.05 0.00 0.00 57.45 56.89 2c8p n PHE 38 Cb 0.59 -1.30 -0.10 0.00 -0.94 0.00 0.00 39.48 37.74 2c8p n PHE 38 CO 0.00 0.00 0.00 1.21 -0.05 0.00 0.00 176.76 177.92 2c8p s ASN 39 N -2.66 6.15 0.58 4.37 3.84 -0.80 -0.82 114.94 125.61 2c8p s ASN 39 Ca 0.00 -0.37 0.34 0.00 0.21 0.00 0.00 52.86 53.04 2c8p s ASN 39 Cb 0.00 -2.18 1.76 0.00 -0.55 0.00 0.00 41.25 40.27 2c8p s ASN 39 CO 0.00 -0.35 2.16 0.71 -2.79 0.00 0.00 177.10 176.82 2c8p h THR 40 N 5.56 0.27 -0.17 -5.21 1.35 -1.19 -2.62 112.91 110.89 2c8p h THR 40 Ca -0.29 -0.33 0.00 0.00 -0.55 0.00 0.00 66.41 65.23 2c8p h THR 40 Cb 1.14 1.26 0.00 0.00 -1.73 0.00 0.00 68.15 68.82 2c8p h THR 40 CO 0.70 0.05 0.00 0.00 -0.25 0.00 0.00 175.52 176.01 2c8p n GLN 41 N -3.36 1.81 -1.71 4.72 6.02 -1.26 -3.88 117.38 119.71 2c8p n GLN 41 Ca -0.02 -1.21 -0.43 0.00 -0.01 0.00 0.00 57.00 55.33 2c8p n GLN 41 Cb 0.19 -1.41 -0.02 0.00 1.02 0.00 0.00 30.24 30.02 2c8p n GLN 41 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2c8p n ALA 42 N 0.44 2.09 -2.65 -1.58 0.00 -0.99 -4.81 120.51 113.01 2c8p n ALA 42 Ca 0.17 0.39 -0.12 0.00 0.00 0.00 0.00 53.44 53.88 2c8p n ALA 42 Cb 0.36 -2.41 -0.11 0.00 0.00 0.00 0.00 19.45 17.29 2c8p n ALA 42 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 2c8p s THR 43 N 0.24 0.60 -0.13 0.00 -4.23 -1.26 -0.78 115.64 110.08 2c8p s THR 43 Ca 0.68 -1.35 -0.07 0.00 -1.18 0.00 0.00 61.69 59.78 2c8p s THR 43 Cb -0.56 -0.95 0.05 0.00 1.34 0.00 0.00 72.50 72.39 2c8p s THR 43 CO 0.45 -0.53 0.31 0.21 -0.54 0.00 0.00 174.62 174.52 2c8p s ASN 44 N -2.03 -0.33 -0.08 3.99 2.47 -0.71 -4.97 114.94 113.27 2c8p s ASN 44 Ca -0.03 0.67 -0.22 0.00 0.42 0.00 0.00 52.86 53.70 2c8p s ASN 44 Cb -0.05 0.57 -0.04 0.00 -1.45 0.00 0.00 41.25 40.27 2c8p s ASN 44 CO -0.01 -0.18 0.64 -0.60 -3.72 0.00 0.00 177.10 173.23 2c8p s ARG 45 N 1.38 4.41 0.38 0.43 6.06 -1.26 -0.51 118.95 129.84 2c8p s ARG 45 Ca -0.09 0.77 -0.05 0.00 -2.50 0.00 0.00 55.73 53.86 2c8p s ARG 45 Cb -0.10 -3.44 -0.04 0.00 0.06 0.00 0.00 34.95 31.43 2c8p s ARG 45 CO -0.10 0.09 0.66 -0.80 -2.50 0.00 0.00 175.30 172.65 2c8p s ASN 46 N 0.74 6.37 0.40 -2.12 0.02 0.58 -4.98 114.94 115.94 2c8p s ASN 46 Ca 0.34 0.78 0.13 0.00 -1.02 0.00 0.00 52.86 53.09 2c8p s ASN 46 Cb -0.17 -2.18 0.96 0.00 0.02 0.00 0.00 41.25 39.88 2c8p s ASN 46 CO 0.16 -0.37 1.92 0.71 0.02 0.00 0.00 177.10 179.55 2c8p h THR 47 N 0.83 0.85 0.00 1.60 1.35 -1.98 -1.36 112.91 114.20 2c8p h THR 47 Ca -0.48 -0.18 0.00 0.00 -0.55 0.00 0.00 66.41 65.20 2c8p h THR 47 Cb 1.20 0.29 0.00 0.00 -1.73 0.00 0.00 68.15 67.91 2c8p h THR 47 CO 0.63 0.09 0.00 -0.90 -0.25 0.00 0.00 175.52 175.10 2c8p n ASP 48 N -4.49 0.00 0.00 5.36 5.75 -1.26 -4.89 116.55 117.01 2c8p n ASP 48 Ca 0.14 -0.53 0.00 0.00 -0.01 0.00 0.00 54.79 54.39 2c8p n ASP 48 Cb 0.45 -0.14 0.00 0.00 -1.03 0.00 0.00 41.12 40.40 2c8p n ASP 48 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2c8p n GLY 49 N 0.98 0.82 3.78 6.12 0.00 -0.51 -4.98 105.19 111.40 2c8p n GLY 49 Ca 0.18 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.90 2c8p n GLY 49 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2c8p s SER 50 N -2.00 3.95 0.01 1.61 1.04 -1.26 -4.72 113.70 112.33 2c8p s SER 50 Ca 0.00 1.22 0.03 0.00 0.48 0.00 0.00 55.95 57.68 2c8p s SER 50 Cb 0.00 -1.90 -0.01 0.00 0.10 0.00 0.00 66.02 64.21 2c8p s SER 50 CO 0.00 -2.30 -0.08 -0.89 0.98 0.00 0.00 173.24 170.94 2c8p s THR 51 N -3.15 0.64 -0.11 2.02 2.01 -1.26 -0.31 115.64 115.48 2c8p s THR 51 Ca 0.62 -0.50 -0.08 0.00 0.31 0.00 0.00 61.69 62.04 2c8p s THR 51 Cb -0.15 -0.57 -0.04 0.00 0.01 0.00 0.00 72.50 71.75 2c8p s THR 51 CO 0.55 0.07 0.18 -1.81 -0.69 0.00 0.00 174.62 172.91 2c8p s ASP 52 N -0.48 6.43 -0.03 3.53 1.01 0.34 -0.91 116.67 126.56 2c8p s ASP 52 Ca 0.01 0.52 0.03 0.00 0.71 0.00 0.00 52.55 53.81 2c8p s ASP 52 Cb -0.04 -2.10 0.00 0.00 1.01 0.00 0.00 42.92 41.79 2c8p s ASP 52 CO -0.00 0.38 -0.11 -0.31 0.21 0.00 0.00 175.17 175.34 2c8p s TYR 53 N -0.91 1.10 0.00 4.23 2.02 -0.07 -1.74 117.35 121.98 2c8p s TYR 53 Ca 0.16 -0.28 0.00 0.00 -0.37 0.00 0.00 57.07 56.58 2c8p s TYR 53 Cb -0.13 -0.76 0.00 0.00 -0.40 0.00 0.00 41.96 40.67 2c8p s TYR 53 CO 0.05 -0.10 0.00 0.41 -1.57 0.00 0.00 175.55 174.34 2c8p n GLY 54 N 3.20 -1.94 0.25 0.71 0.00 0.04 -1.49 105.19 105.97 2c8p n GLY 54 Ca -0.18 -1.60 0.09 0.00 0.00 0.00 0.00 46.02 44.33 2c8p n GLY 54 CO 0.00 0.00 0.00 0.16 0.00 0.00 0.00 173.32 173.48 2c8p h ILE 55 N 0.00 0.90 -0.23 -0.61 3.07 -1.73 -1.58 117.51 117.33 2c8p h ILE 55 Ca 0.00 -0.31 0.00 0.00 1.55 0.00 0.00 64.86 66.10 2c8p h ILE 55 Cb 0.00 1.17 0.00 0.00 -0.27 0.00 0.00 36.82 37.72 2c8p h ILE 55 CO 0.00 0.08 0.00 0.18 -1.05 0.00 0.00 178.15 177.36 2c8p n LEU 56 N -4.21 2.97 -3.83 0.16 4.77 -1.26 -3.95 117.00 111.65 2c8p n LEU 56 Ca -0.03 -2.37 -0.28 0.00 -0.03 0.00 0.00 56.01 53.31 2c8p n LEU 56 Cb 0.17 -0.29 0.01 0.00 -2.33 0.00 0.00 43.42 40.98 2c8p n LEU 56 CO 0.33 0.67 -0.16 0.00 -1.33 0.00 0.00 177.39 176.91 2c8p n GLN 57 N -0.11 -2.56 -2.63 3.23 1.13 -0.60 -4.89 117.38 110.95 2c8p n GLN 57 Ca 0.13 0.43 -0.41 0.00 -1.94 0.00 0.00 57.00 55.21 2c8p n GLN 57 Cb 0.54 -4.37 -0.04 0.00 0.11 0.00 0.00 30.24 26.47 2c8p n GLN 57 CO 0.00 0.00 0.00 0.42 -1.44 0.00 0.00 177.06 176.04 2c8p s ILE 58 N -3.73 4.31 0.00 5.09 1.01 -0.55 -4.34 121.20 122.99 2c8p s ILE 58 Ca 0.20 1.86 -0.17 0.00 0.00 0.00 0.00 60.65 62.54 2c8p s ILE 58 Cb -0.07 -4.19 -0.06 0.00 0.01 0.00 0.00 42.46 38.15 2c8p s ILE 58 CO 0.87 0.26 0.47 0.21 0.00 0.00 0.00 174.94 176.75 2c8p s ASN 59 N 0.23 6.87 0.00 3.58 3.84 -1.26 -0.89 114.94 127.31 2c8p s ASN 59 Ca 0.50 1.03 0.19 0.00 0.21 0.00 0.00 52.86 54.79 2c8p s ASN 59 Cb -0.25 -2.29 0.81 0.00 -0.55 0.00 0.00 41.25 38.96 2c8p s ASN 59 CO 0.31 0.26 1.61 -1.54 -2.79 0.00 0.00 177.10 174.94 2c8p n SER 60 N 2.10 0.00 -0.12 -4.21 3.41 -0.09 -2.01 113.62 112.71 2c8p n SER 60 Ca -0.12 0.50 -0.02 0.00 -0.26 0.00 0.00 58.87 58.97 2c8p n SER 60 Cb 0.52 -0.50 0.22 0.00 -0.26 0.00 0.00 64.21 64.19 2c8p n SER 60 CO 0.00 0.00 0.00 -0.09 -0.16 0.00 0.00 175.04 174.79 2c8p h ARG 61 N 0.00 0.80 0.00 4.33 9.65 -1.84 -3.38 114.38 123.94 2c8p h ARG 61 Ca 0.00 -0.14 0.00 0.00 -1.10 0.00 0.00 59.98 58.74 2c8p h ARG 61 Cb 0.33 -0.13 0.00 0.00 -1.39 0.00 0.00 29.97 28.78 2c8p h ARG 61 CO 0.00 0.70 -0.91 0.91 2.80 0.00 0.00 179.97 183.46 2c8p n TRP 62 N -4.30 0.00 -0.03 2.20 7.02 -1.20 -1.27 117.44 119.86 2c8p n TRP 62 Ca 0.04 0.00 -0.01 0.00 -1.02 0.00 0.00 57.50 56.51 2c8p n TRP 62 Cb 0.20 0.00 -0.09 0.00 -2.42 0.00 0.00 31.31 29.00 2c8p n TRP 62 CO 0.00 0.00 0.00 0.91 -2.02 0.00 0.00 177.69 176.58 2c8p n TRP 63 N -2.04 0.00 -3.98 -5.99 7.02 -0.85 -0.86 117.44 110.73 2c8p n TRP 63 Ca 0.00 0.00 -0.08 0.00 -1.02 0.00 0.00 57.50 56.40 2c8p n TRP 63 Cb 0.46 -0.44 -0.09 0.00 -2.42 0.00 0.00 31.31 28.82 2c8p n TRP 63 CO 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 177.69 175.67 2c8p s ASN 65 N -2.85 6.26 0.00 0.00 2.47 -0.32 -4.58 114.94 115.91 2c8p s ASN 65 Ca 0.05 0.29 0.00 0.00 0.42 0.00 0.00 52.86 53.62 2c8p s ASN 65 Cb 0.06 -2.16 0.00 0.00 -1.45 0.00 0.00 41.25 37.70 2c8p s ASN 65 CO -0.10 -0.01 0.55 -0.90 -3.72 0.00 0.00 177.10 172.92 2c8p n ASP 66 N 4.44 1.09 0.00 -4.21 5.68 -1.26 -0.84 116.55 121.44 2c8p n ASP 66 Ca -0.12 -1.15 0.00 0.00 -0.50 0.00 0.00 54.79 53.02 2c8p n ASP 66 Cb 0.52 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 40.50 2c8p n ASP 66 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2c8p n GLY 67 N -0.08 0.54 1.17 6.12 0.00 -1.26 -4.81 105.19 106.87 2c8p n GLY 67 Ca 0.00 0.00 0.04 0.00 0.00 0.00 0.00 46.02 46.06 2c8p n GLY 67 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 2c8p n ARG 68 N -1.86 0.21 -3.77 1.61 1.85 -1.26 -4.95 116.66 108.50 2c8p n ARG 68 Ca 0.00 -1.97 -0.29 0.00 -1.00 0.00 0.00 57.85 54.59 2c8p n ARG 68 Cb 0.05 -0.31 -0.13 0.00 -1.05 0.00 0.00 32.46 31.02 2c8p n ARG 68 CO 0.00 0.00 0.00 0.99 -0.01 0.00 0.00 177.63 178.61 2c8p s THR 69 N -0.44 1.90 0.18 8.89 2.01 -1.26 -4.82 115.64 122.10 2c8p s THR 69 Ca 0.28 -3.21 -0.33 0.00 0.31 0.00 0.00 61.69 58.74 2c8p s THR 69 Cb 0.31 -2.30 -0.14 0.00 0.01 0.00 0.00 72.50 70.38 2c8p s THR 69 CO -0.12 -0.96 1.41 -2.65 -0.69 0.00 0.00 174.62 171.62 2c8p n PRO 70 N 2.92 1.79 -0.90 4.92 -0.02 -1.26 -1.96 135.00 140.49 2c8p n PRO 70 Ca 0.14 0.64 0.00 0.00 -2.02 0.00 0.00 63.50 62.26 2c8p n PRO 70 Cb 0.36 -2.31 0.00 0.00 -0.02 0.00 0.00 33.50 31.53 2c8p n PRO 70 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2c8p n GLY 71 N 2.60 0.85 3.89 -1.23 0.00 -1.26 -5.02 105.19 105.02 2c8p n GLY 71 Ca 0.15 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.88 2c8p n GLY 71 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2c8p s SER 72 N -2.75 4.17 0.48 1.61 1.04 -0.83 -5.07 113.70 112.35 2c8p s SER 72 Ca 0.00 0.71 0.05 0.00 0.48 0.00 0.00 55.95 57.19 2c8p s SER 72 Cb 0.00 -1.12 -0.02 0.00 0.10 0.00 0.00 66.02 64.98 2c8p s SER 72 CO 0.00 -2.11 0.19 -0.13 0.98 0.00 0.00 173.24 172.17 2c8p s ARG 73 N -5.61 2.21 -0.41 4.02 1.81 -0.40 -5.00 118.95 115.57 2c8p s ARG 73 Ca 0.64 -2.05 0.09 0.00 -1.72 0.00 0.00 55.73 52.69 2c8p s ARG 73 Cb -0.10 -1.88 0.29 0.00 -0.45 0.00 0.00 34.95 32.81 2c8p s ARG 73 CO 0.50 -0.32 0.63 -1.71 -0.68 0.00 0.00 175.30 173.72 2c8p n ASN 74 N -1.38 0.85 0.25 0.23 5.15 -1.18 -3.74 115.26 115.44 2c8p n ASN 74 Ca -0.06 -2.90 0.13 0.00 -0.60 0.00 0.00 54.58 51.15 2c8p n ASN 74 Cb 0.65 -0.63 0.58 0.00 -0.53 0.00 0.00 39.78 39.85 2c8p n ASN 74 CO 0.00 0.00 0.00 -0.07 1.40 0.00 0.00 177.26 178.59 2c8p h LEU 75 N 3.60 0.00 -0.39 1.20 3.38 -1.01 -0.75 115.31 121.34 2c8p h LEU 75 Ca 0.09 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.06 2c8p h LEU 75 Cb 0.88 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.63 2c8p h LEU 75 CO 0.52 0.12 -0.16 0.00 0.09 0.00 0.00 178.44 179.01 2c8p n ASN 77 N -0.74 -1.64 -3.90 0.00 4.13 -0.29 -4.98 115.26 107.85 2c8p n ASN 77 Ca 0.14 -0.77 -0.10 0.00 1.68 0.00 0.00 54.58 55.53 2c8p n ASN 77 Cb 0.31 -4.34 -0.09 0.00 -1.54 0.00 0.00 39.78 34.12 2c8p n ASN 77 CO 0.00 0.00 0.00 0.27 0.28 0.00 0.00 177.26 177.81 2c8p s ILE 78 N -3.58 0.11 0.34 2.41 -4.36 -1.26 -5.06 121.20 109.80 2c8p s ILE 78 Ca 0.03 -0.93 -0.27 0.00 -0.26 0.00 0.00 60.65 59.21 2c8p s ILE 78 Cb -0.01 -0.73 -0.09 0.00 1.25 0.00 0.00 42.46 42.89 2c8p s ILE 78 CO 0.79 -0.51 1.17 -2.16 0.24 0.00 0.00 174.94 174.47 2c8p s PRO 79 N -2.17 4.32 0.54 0.37 0.04 -1.26 -1.18 135.00 135.67 2c8p s PRO 79 Ca -0.09 1.90 0.21 0.00 0.04 0.00 0.00 61.00 63.07 2c8p s PRO 79 Cb -0.04 -2.93 1.43 0.00 0.04 0.00 0.00 34.50 33.01 2c8p s PRO 79 CO -0.02 -0.11 2.14 0.00 0.04 0.00 0.00 177.00 179.05 2c8p h SER 81 N 0.00 0.00 0.03 0.00 4.64 -1.91 -0.53 113.55 115.79 2c8p h SER 81 Ca 0.05 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.37 2c8p h SER 81 Cb 0.23 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.32 2c8p h SER 81 CO -0.00 0.00 -0.01 0.00 -0.87 0.00 0.00 176.83 175.95 2c8p h ALA 82 N 1.86 1.56 0.00 5.18 0.00 -1.57 -0.86 119.26 125.42 2c8p h ALA 82 Ca 0.13 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.03 2c8p h ALA 82 Cb 0.54 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.33 2c8p h ALA 82 CO -0.00 0.02 0.00 1.28 0.00 0.00 0.00 179.25 180.54 2c8p n LEU 83 N -3.91 0.00 -0.45 0.00 4.77 -0.20 -3.01 117.00 114.19 2c8p n LEU 83 Ca -0.03 0.21 0.10 0.00 -0.03 0.00 0.00 56.01 56.26 2c8p n LEU 83 Cb 0.10 -0.21 -0.00 0.00 -2.33 0.00 0.00 43.42 40.97 2c8p n LEU 83 CO 0.28 -0.04 0.29 0.18 -1.33 0.00 0.00 177.39 176.77 2c8p n LEU 84 N -1.21 1.88 -4.70 2.23 4.77 -0.33 -3.79 117.00 115.85 2c8p n LEU 84 Ca 0.13 -0.76 -0.37 0.00 -0.03 0.00 0.00 56.01 54.98 2c8p n LEU 84 Cb 0.16 0.00 0.06 0.00 -2.33 0.00 0.00 43.42 41.32 2c8p n LEU 84 CO 0.17 0.35 0.83 -0.24 -1.33 0.00 0.00 177.39 177.18 2c8p n SER 85 N -0.06 1.84 0.29 -1.43 2.88 -1.16 -4.13 113.62 111.85 2c8p n SER 85 Ca 0.08 0.84 0.15 0.00 -1.33 0.00 0.00 58.87 58.61 2c8p n SER 85 Cb 0.42 -1.52 0.89 0.00 -0.75 0.00 0.00 64.21 63.25 2c8p n SER 85 CO 0.00 0.00 0.00 0.77 -1.23 0.00 0.00 175.04 174.58 2c8p h SER 86 N 0.59 0.00 -3.49 -3.46 4.64 -1.94 -3.40 113.55 106.49 2c8p h SER 86 Ca -0.50 0.00 -0.61 0.00 -0.47 0.00 0.00 61.79 60.21 2c8p h SER 86 Cb 1.34 0.00 -0.11 0.00 -0.31 0.00 0.00 62.40 63.32 2c8p h SER 86 CO 0.53 0.04 0.32 -0.62 -0.87 0.00 0.00 176.83 176.23 2c8p s ASP 87 N -6.00 6.58 0.00 4.97 -1.08 -1.26 -4.96 116.67 114.92 2c8p s ASP 87 Ca -0.04 0.50 0.19 0.00 -0.52 0.00 0.00 52.55 52.69 2c8p s ASP 87 Cb 0.14 -2.38 1.02 0.00 -1.46 0.00 0.00 42.92 40.23 2c8p s ASP 87 CO 0.54 -0.61 1.67 2.30 0.52 0.00 0.00 175.17 179.59 2c8p n ILE 88 N 5.57 0.06 -0.11 4.11 -5.35 -1.26 -4.35 119.36 118.03 2c8p n ILE 88 Ca 0.02 -0.10 -0.06 0.00 -0.27 0.00 0.00 62.75 62.34 2c8p n ILE 88 Cb 0.48 -0.10 0.00 0.00 -1.74 0.00 0.00 39.64 38.29 2c8p n ILE 88 CO 0.00 0.00 0.00 0.74 -1.76 0.00 0.00 176.55 175.53 2c8p h THR 89 N 0.64 0.40 -0.51 7.28 2.02 -1.94 0.25 112.91 121.05 2c8p h THR 89 Ca 0.00 0.00 -0.03 0.00 0.77 0.00 0.00 66.41 67.15 2c8p h THR 89 Cb 0.14 0.40 -0.02 0.00 -1.74 0.00 0.00 68.15 66.93 2c8p h THR 89 CO 0.00 0.00 0.19 0.00 0.37 0.00 0.00 175.52 176.08 2c8p h ALA 90 N 1.07 0.67 -0.64 6.16 0.00 -1.84 0.35 119.26 125.04 2c8p h ALA 90 Ca 0.19 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.94 2c8p h ALA 90 Cb 0.44 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 18.00 2c8p h ALA 90 CO -0.47 0.29 0.41 0.77 0.00 0.00 0.00 179.25 180.25 2c8p h SER 91 N 0.69 0.74 -0.16 0.00 0.02 -1.66 -1.25 113.55 111.94 2c8p h SER 91 Ca 0.17 -0.04 -0.02 0.00 -0.84 0.00 0.00 61.79 61.06 2c8p h SER 91 Cb 0.22 -0.19 -0.01 0.00 0.14 0.00 0.00 62.40 62.56 2c8p h SER 91 CO -0.01 0.56 0.02 0.58 -1.14 0.00 0.00 176.83 176.83 2c8p h VAL 92 N 0.86 1.23 -0.84 2.27 2.07 -0.64 0.28 116.25 121.48 2c8p h VAL 92 Ca 0.23 -0.74 -0.02 0.00 0.82 0.00 0.00 66.70 66.98 2c8p h VAL 92 Cb -0.07 1.41 -0.04 0.00 -1.52 0.00 0.00 31.29 31.07 2c8p h VAL 92 CO -0.05 0.22 0.43 0.78 0.02 0.00 0.00 177.57 178.97 2c8p h ASN 93 N 0.05 1.07 -0.29 0.57 2.35 -0.85 -0.86 115.58 117.62 2c8p h ASN 93 Ca 0.05 -0.11 -0.15 0.00 -0.55 0.00 0.00 56.30 55.53 2c8p h ASN 93 Cb 0.32 -0.27 -0.00 0.00 0.05 0.00 0.00 38.32 38.42 2c8p h ASN 93 CO 0.00 0.88 -0.41 0.00 -1.65 0.00 0.00 177.43 176.26 2c8p h ALA 95 N 0.69 1.60 -0.87 0.00 0.00 -0.51 -0.97 119.26 119.20 2c8p h ALA 95 Ca 0.03 -0.01 0.02 0.00 0.00 0.00 0.00 54.91 54.95 2c8p h ALA 95 Cb 1.01 -0.22 -0.05 0.00 0.00 0.00 0.00 17.79 18.53 2c8p h ALA 95 CO 0.10 0.23 0.57 0.87 0.00 0.00 0.00 179.25 181.02 2c8p h LYS 96 N 0.93 1.12 -0.36 0.00 1.57 -1.07 -0.01 116.57 118.75 2c8p h LYS 96 Ca 0.41 -0.07 -0.06 0.00 -1.87 0.00 0.00 60.65 59.07 2c8p h LYS 96 Cb 0.36 -0.25 -0.01 0.00 0.08 0.00 0.00 32.23 32.41 2c8p h LYS 96 CO -0.17 0.74 -0.00 -0.22 -0.57 0.00 0.00 179.45 179.22 2c8p h LYS 97 N 1.16 0.63 -0.14 3.15 3.64 -1.21 -2.70 116.57 121.11 2c8p h LYS 97 Ca 0.33 -0.20 -0.00 0.00 -1.27 0.00 0.00 60.65 59.50 2c8p h LYS 97 Cb -0.10 -0.06 -0.01 0.00 -0.41 0.00 0.00 32.23 31.66 2c8p h LYS 97 CO -0.08 0.75 0.08 0.82 -2.27 0.00 0.00 179.45 178.75 2c8p h ILE 98 N 0.45 1.09 0.00 2.00 2.04 -0.84 -2.51 117.51 119.75 2c8p h ILE 98 Ca 0.10 -0.26 0.00 0.00 1.00 0.00 0.00 64.86 65.71 2c8p h ILE 98 Cb 0.47 1.01 0.00 0.00 -0.74 0.00 0.00 36.82 37.55 2c8p h ILE 98 CO 0.02 0.09 0.00 1.62 0.00 0.00 0.00 178.15 179.88 2c8p h VAL 99 N 0.13 0.00 -0.01 1.67 3.04 -1.02 -1.33 116.25 118.74 2c8p h VAL 99 Ca 0.05 -0.29 0.00 0.00 -1.01 0.00 0.00 66.70 65.45 2c8p h VAL 99 Cb 0.07 1.08 0.00 0.00 -2.01 0.00 0.00 31.29 30.43 2c8p h VAL 99 CO -0.01 0.00 -0.04 -1.20 -1.01 0.00 0.00 177.57 175.31 2c8p n SER 100 N -2.47 1.14 0.18 3.17 7.64 -0.96 -3.77 113.62 118.54 2c8p n SER 100 Ca 0.01 -1.27 0.14 0.00 1.01 0.00 0.00 58.87 58.76 2c8p n SER 100 Cb 0.24 0.01 0.50 0.00 -1.01 0.00 0.00 64.21 63.95 2c8p n SER 100 CO 0.00 0.00 0.00 -0.78 -3.01 0.00 0.00 175.04 171.25 2c8p h ASP 101 N 1.72 0.00 0.00 6.43 3.58 -1.08 -3.47 116.42 123.61 2c8p h ASP 101 Ca 0.00 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.45 2c8p h ASP 101 Cb 0.42 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.47 2c8p h ASP 101 CO 0.00 0.00 0.00 0.61 -2.88 0.00 0.00 179.24 176.97 2c8p n GLY 102 N 0.35 2.39 1.09 -0.78 0.00 -1.26 -4.96 105.19 102.02 2c8p n GLY 102 Ca 0.02 -0.37 0.09 0.00 0.00 0.00 0.00 46.02 45.77 2c8p n GLY 102 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2c8p n ASN 103 N 0.00 3.58 0.00 1.61 5.03 -1.26 -5.06 115.26 119.16 2c8p n ASN 103 Ca 0.00 -2.01 0.00 0.00 0.87 0.00 0.00 54.58 53.44 2c8p n ASN 103 Cb 0.00 -0.40 0.00 0.00 -1.02 0.00 0.00 39.78 38.36 2c8p n ASN 103 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 2c8p n GLY 104 N 1.22 2.68 0.00 7.41 0.00 -1.25 -1.98 105.19 113.27 2c8p n GLY 104 Ca 0.20 -0.31 0.14 0.00 0.00 0.00 0.00 46.02 46.05 2c8p n GLY 104 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 2c8p n MET 105 N 14.00 0.49 0.22 1.61 2.81 -1.26 -2.80 117.12 132.19 2c8p n MET 105 Ca 0.00 0.01 0.15 0.00 -1.81 0.00 0.00 57.70 56.05 2c8p n MET 105 Cb 0.00 -1.50 0.80 0.00 -0.71 0.00 0.00 33.22 31.81 2c8p n MET 105 CO 0.00 0.00 0.00 -0.91 1.51 0.00 0.00 175.97 176.57 2c8p h ASN 106 N 0.00 0.00 -0.43 7.83 2.35 -1.81 -1.14 115.58 122.38 2c8p h ASN 106 Ca 0.00 0.00 0.10 0.00 -0.55 0.00 0.00 56.30 55.85 2c8p h ASN 106 Cb 0.23 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 38.58 2c8p h ASN 106 CO 0.00 0.00 0.30 0.00 -1.65 0.00 0.00 177.43 176.08 2c8p h ALA 107 N 2.01 2.26 -1.93 -0.83 0.00 -1.68 -3.32 119.26 115.76 2c8p h ALA 107 Ca 0.00 -0.01 -0.67 0.00 0.00 0.00 0.00 54.91 54.22 2c8p h ALA 107 Cb 0.03 -0.00 -0.17 0.00 0.00 0.00 0.00 17.79 17.64 2c8p h ALA 107 CO 0.00 -0.37 0.20 -1.58 0.00 0.00 0.00 179.25 177.51 2c8p s TRP 108 N -5.13 2.94 0.28 0.00 0.51 -0.43 -4.93 118.94 112.18 2c8p s TRP 108 Ca -0.06 -0.62 0.01 0.00 -2.12 0.00 0.00 56.10 53.31 2c8p s TRP 108 Cb 0.19 -3.87 0.54 0.00 -0.81 0.00 0.00 33.47 29.52 2c8p s TRP 108 CO 0.72 -1.25 1.84 0.28 -0.51 0.00 0.00 176.95 178.03 2c8p h VAL 109 N 5.92 0.94 -0.38 4.03 2.07 -1.83 -0.78 116.25 126.22 2c8p h VAL 109 Ca -0.28 -0.35 -0.06 0.00 0.82 0.00 0.00 66.70 66.83 2c8p h VAL 109 Cb 1.09 -0.17 -0.02 0.00 -1.52 0.00 0.00 31.29 30.67 2c8p h VAL 109 CO 1.06 0.19 -0.00 0.00 0.02 0.00 0.00 177.57 178.83 2c8p h ALA 110 N 1.53 1.30 -0.17 1.67 0.00 -1.92 0.18 119.26 121.84 2c8p h ALA 110 Ca 0.49 -0.22 -0.01 0.00 0.00 0.00 0.00 54.91 55.18 2c8p h ALA 110 Cb 0.46 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.08 2c8p h ALA 110 CO -0.25 0.48 0.09 2.35 0.00 0.00 0.00 179.25 181.91 2c8p h TRP 111 N 0.57 0.25 -0.65 0.00 7.01 -1.46 0.56 115.95 122.22 2c8p h TRP 111 Ca 0.12 -0.01 0.02 0.00 2.11 0.00 0.00 58.89 61.12 2c8p h TRP 111 Cb 0.36 -0.08 -0.04 0.00 -2.10 0.00 0.00 29.16 27.31 2c8p h TRP 111 CO 0.01 0.27 0.42 -0.09 -2.79 0.00 0.00 178.44 176.26 2c8p h ARG 112 N 0.16 0.82 0.00 2.65 2.43 -0.73 0.23 114.38 119.94 2c8p h ARG 112 Ca 0.06 -0.05 -0.10 0.00 -0.81 0.00 0.00 59.98 59.08 2c8p h ARG 112 Cb 0.11 -0.19 -0.01 0.00 -0.42 0.00 0.00 29.97 29.46 2c8p h ARG 112 CO -0.01 0.55 -0.55 -0.91 -1.51 0.00 0.00 179.97 177.54 2c8p h ASN 113 N 0.85 0.00 0.00 -3.80 2.35 -0.87 -3.36 115.58 110.74 2c8p h ASN 113 Ca 0.25 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 56.00 2c8p h ASN 113 Cb -0.06 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.31 2c8p h ASN 113 CO -0.07 0.46 -0.46 0.54 -1.65 0.00 0.00 177.43 176.25 2c8p n ARG 114 N -3.18 2.90 -0.01 0.81 1.74 0.18 -4.89 116.66 114.20 2c8p n ARG 114 Ca 0.01 0.00 -0.02 0.00 -0.77 0.00 0.00 57.85 57.07 2c8p n ARG 114 Cb 0.72 -0.68 -0.01 0.00 -1.02 0.00 0.00 32.46 31.47 2c8p n ARG 114 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2c8p n LYS 116 N -2.81 1.47 -0.98 0.00 4.81 0.63 -1.27 118.16 120.01 2c8p n LYS 116 Ca -0.04 0.53 0.00 0.00 -0.87 0.00 0.00 58.31 57.93 2c8p n LYS 116 Cb 0.54 -2.25 0.00 0.00 0.02 0.00 0.00 35.03 33.34 2c8p n LYS 116 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2c8p n GLY 117 N 3.63 0.57 4.01 3.14 0.00 -1.26 -4.95 105.19 110.33 2c8p n GLY 117 Ca 0.22 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 46.05 2c8p n GLY 117 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2c8p s THR 118 N -2.43 2.53 -1.25 2.61 -4.23 -0.40 -4.99 115.64 107.49 2c8p s THR 118 Ca 0.00 -0.93 -0.17 0.00 -1.18 0.00 0.00 61.69 59.41 2c8p s THR 118 Cb 0.00 -2.61 -0.01 0.00 1.34 0.00 0.00 72.50 71.23 2c8p s THR 118 CO 0.00 0.00 2.03 -0.67 -0.54 0.00 0.00 174.62 175.44 2c8p n ASP 119 N -2.16 3.74 0.27 3.99 2.03 -1.26 -4.75 116.55 118.41 2c8p n ASP 119 Ca 0.12 -2.81 0.18 0.00 0.52 0.00 0.00 54.79 52.79 2c8p n ASP 119 Cb 0.60 -1.57 0.81 0.00 -0.72 0.00 0.00 41.12 40.24 2c8p n ASP 119 CO 0.00 0.00 0.00 -0.37 -1.92 0.00 0.00 177.20 174.91 2c8p h VAL 120 N 4.64 0.00 0.00 5.18 -1.51 -1.90 -2.22 116.25 120.43 2c8p h VAL 120 Ca 0.48 -0.28 -0.01 0.00 -1.23 0.00 0.00 66.70 65.66 2c8p h VAL 120 Cb 0.72 1.20 -0.00 0.00 -2.13 0.00 0.00 31.29 31.08 2c8p h VAL 120 CO 1.75 0.00 -0.05 -0.61 -1.23 0.00 0.00 177.57 177.44 2c8p h GLN 121 N 0.00 0.00 -0.29 5.19 -0.00 -1.88 -1.26 115.11 116.87 2c8p h GLN 121 Ca 0.00 0.00 0.08 0.00 -0.00 0.00 0.00 58.65 58.73 2c8p h GLN 121 Cb 0.30 0.00 -0.01 0.00 0.00 0.00 0.00 27.48 27.77 2c8p h GLN 121 CO 0.00 0.05 0.23 0.00 0.00 0.00 0.00 178.83 179.11 2c8p h ALA 122 N 1.95 2.15 0.00 3.38 0.00 -1.80 -1.43 119.26 123.51 2c8p h ALA 122 Ca -0.00 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.90 2c8p h ALA 122 Cb 0.16 0.02 -0.00 0.00 0.00 0.00 0.00 17.79 17.97 2c8p h ALA 122 CO 0.01 -0.38 -0.02 -1.49 0.00 0.00 0.00 179.25 177.37 2c8p h TRP 123 N 0.00 0.00 -0.09 0.00 4.06 -1.44 -2.83 115.95 115.65 2c8p h TRP 123 Ca 0.14 0.00 0.00 0.00 2.06 0.00 0.00 58.89 61.09 2c8p h TRP 123 Cb 0.60 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 28.76 2c8p h TRP 123 CO 0.00 0.02 0.00 0.44 -3.56 0.00 0.00 178.44 175.34 2c8p n ILE 124 N -3.12 0.38 -1.81 1.49 -5.35 -0.58 -4.79 119.36 105.58 2c8p n ILE 124 Ca 0.00 -0.69 -0.42 0.00 -0.27 0.00 0.00 62.75 61.37 2c8p n ILE 124 Cb 0.31 0.90 -0.03 0.00 -1.74 0.00 0.00 39.64 39.08 2c8p n ILE 124 CO 0.00 0.00 0.00 -0.60 -1.76 0.00 0.00 176.55 174.19 2c8p s ARG 125 N -0.73 4.16 0.00 6.28 3.52 -0.94 -1.95 118.95 129.29 2c8p s ARG 125 Ca 0.10 2.51 0.00 0.00 -0.13 0.00 0.00 55.73 58.21 2c8p s ARG 125 Cb 0.06 -3.10 0.00 0.00 -1.56 0.00 0.00 34.95 30.35 2c8p s ARG 125 CO 0.09 -0.69 0.00 0.41 -0.81 0.00 0.00 175.30 174.30 2c8p n GLY 126 N 3.83 2.60 3.75 8.12 0.00 -1.26 -5.03 105.19 117.20 2c8p n GLY 126 Ca 0.15 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.76 2c8p n GLY 126 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2c8p s ARG 128 N -1.17 3.61 0.00 0.00 3.52 -1.26 -5.12 118.95 118.53 2c8p s ARG 128 Ca 0.44 0.78 0.00 0.00 -0.13 0.00 0.00 55.73 56.82 2c8p s ARG 128 Cb -0.30 -3.99 0.00 0.00 -1.56 0.00 0.00 34.95 29.11 2c8p s ARG 128 CO 0.37 -1.52 0.24 1.28 -0.81 0.00 0.00 175.30 174.86