#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2pzh s MET 1 N 0.00 1.72 0.05 -0.41 0.00 -0.88 -4.96 119.30 114.81 2pzh s MET 1 Ca 0.00 -1.17 0.07 0.00 0.00 0.00 0.00 55.69 54.60 2pzh s MET 1 Cb 0.00 -1.99 -0.03 0.00 0.00 0.00 0.00 34.83 32.81 2pzh s MET 1 CO 0.00 0.50 -0.18 1.03 0.00 0.00 0.00 175.02 176.37 2pzh s ARG 2 N -1.53 2.05 0.04 4.11 0.52 -1.26 -0.13 118.95 122.76 2pzh s ARG 2 Ca 0.13 -1.00 -0.07 0.00 -0.52 0.00 0.00 55.73 54.27 2pzh s ARG 2 Cb -0.10 -2.18 -0.00 0.00 0.52 0.00 0.00 34.95 33.18 2pzh s ARG 2 CO 0.04 0.54 0.14 0.00 0.02 0.00 0.00 175.30 176.04 2pzh s ARG 4 N -2.68 3.49 -0.31 0.00 6.06 -1.26 -0.57 118.95 123.68 2pzh s ARG 4 Ca -0.04 -0.11 -0.29 0.00 -2.50 0.00 0.00 55.73 52.79 2pzh s ARG 4 Cb -0.01 -3.17 0.01 0.00 0.06 0.00 0.00 34.95 31.85 2pzh s ARG 4 CO -0.05 0.74 1.13 0.08 -2.50 0.00 0.00 175.30 174.71 2pzh s VAL 5 N -1.11 4.42 0.44 7.11 1.01 0.30 -4.98 120.40 127.59 2pzh s VAL 5 Ca 0.19 1.64 0.08 0.00 0.00 0.00 0.00 61.98 63.88 2pzh s VAL 5 Cb -0.13 -4.34 -0.01 0.00 0.00 0.00 0.00 36.38 31.90 2pzh s VAL 5 CO 0.08 -0.46 0.39 -0.31 0.00 0.00 0.00 175.10 174.80 2pzh s TYR 6 N 3.79 2.55 0.29 5.22 2.02 -1.26 -0.97 117.35 128.99 2pzh s TYR 6 Ca 0.48 -0.54 0.02 0.00 -0.37 0.00 0.00 57.07 56.66 2pzh s TYR 6 Cb -0.14 -2.15 0.58 0.00 -0.40 0.00 0.00 41.96 39.86 2pzh s TYR 6 CO 0.17 -0.19 1.84 1.88 -1.57 0.00 0.00 175.55 177.67 2pzh h TYR 7 N 0.97 1.12 -0.23 2.71 -1.99 -1.96 0.03 116.97 117.62 2pzh h TYR 7 Ca -0.40 0.03 0.07 0.00 2.00 0.00 0.00 58.73 60.42 2pzh h TYR 7 Cb 1.27 -0.35 -0.01 0.00 2.00 0.00 0.00 36.73 39.64 2pzh h TYR 7 CO 0.56 0.44 0.20 1.05 -0.00 0.00 0.00 178.16 180.41 2pzh h GLU 8 N 0.97 0.00 0.00 4.88 4.11 -2.01 -2.00 114.58 120.53 2pzh h GLU 8 Ca 0.49 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.92 2pzh h GLU 8 Cb 0.51 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.76 2pzh h GLU 8 CO -0.26 0.00 -0.39 -0.44 0.07 0.00 0.00 179.01 177.99 2pzh h ASP 9 N 0.00 0.00 -3.04 3.06 3.32 -1.37 -3.48 116.42 114.91 2pzh h ASP 9 Ca 0.11 -0.07 -0.47 0.00 0.02 0.00 0.00 57.03 56.62 2pzh h ASP 9 Cb 0.51 0.00 0.03 0.00 0.22 0.00 0.00 39.33 40.08 2pzh h ASP 9 CO -0.00 0.04 -0.04 0.42 -1.72 0.00 0.00 179.24 177.94 2pzh s THR 10 N -3.19 4.35 0.30 0.35 -4.23 -0.75 -0.72 115.64 111.75 2pzh s THR 10 Ca 0.06 -0.29 0.00 0.00 -1.18 0.00 0.00 61.69 60.28 2pzh s THR 10 Cb 0.11 -3.63 -0.00 0.00 1.34 0.00 0.00 72.50 70.32 2pzh s THR 10 CO 0.69 -0.50 0.00 -0.90 -0.54 0.00 0.00 174.62 173.37 2pzh n ASP 11 N -2.12 2.77 0.19 3.99 5.68 -0.05 -4.60 116.55 122.41 2pzh n ASP 11 Ca 0.00 -2.30 0.14 0.00 -0.50 0.00 0.00 54.79 52.13 2pzh n ASP 11 Cb 0.57 0.22 0.67 0.00 -1.14 0.00 0.00 41.12 41.44 2pzh n ASP 11 CO 0.00 0.00 0.00 0.77 -1.33 0.00 0.00 177.20 176.64 2pzh h SER 12 N 0.72 0.00 0.09 -1.12 4.64 -2.00 -0.82 113.55 115.05 2pzh h SER 12 Ca -0.25 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.07 2pzh h SER 12 Cb 0.75 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.84 2pzh h SER 12 CO 0.41 0.00 -0.06 -1.84 -0.87 0.00 0.00 176.83 174.47 2pzh n GLU 13 N -2.47 1.27 -0.86 4.77 0.28 -1.26 -4.92 120.64 117.45 2pzh n GLU 13 Ca -0.00 -0.61 0.00 0.00 -0.16 0.00 0.00 57.16 56.39 2pzh n GLU 13 Cb 0.12 -1.49 0.00 0.00 1.43 0.00 0.00 31.44 31.51 2pzh n GLU 13 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 2pzh n GLY 14 N 1.19 0.52 3.54 -1.84 0.00 -0.31 -5.05 105.19 103.23 2pzh n GLY 14 Ca 0.18 -0.46 -0.25 0.00 0.00 0.00 0.00 46.02 45.49 2pzh n GLY 14 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2pzh s VAL 15 N -2.00 1.84 0.16 1.61 -7.23 -1.26 -4.32 120.40 109.21 2pzh s VAL 15 Ca 0.00 -2.07 -0.32 0.00 -1.81 0.00 0.00 61.98 57.79 2pzh s VAL 15 Cb 0.00 -2.79 -0.10 0.00 0.56 0.00 0.00 36.38 34.04 2pzh s VAL 15 CO 0.00 -0.09 1.61 -0.69 -0.31 0.00 0.00 175.10 175.62 2pzh s VAL 16 N -2.85 2.54 0.20 1.32 1.01 -0.25 -0.87 120.40 121.49 2pzh s VAL 16 Ca 0.34 0.35 -0.31 0.00 0.00 0.00 0.00 61.98 62.36 2pzh s VAL 16 Cb 0.07 -3.23 -0.11 0.00 0.00 0.00 0.00 36.38 33.12 2pzh s VAL 16 CO 0.16 0.02 1.61 -0.47 0.00 0.00 0.00 175.10 176.43 2pzh s TYR 17 N 1.33 2.98 0.31 5.22 5.04 0.10 -4.82 117.35 127.51 2pzh s TYR 17 Ca 0.72 0.58 0.07 0.00 -2.44 0.00 0.00 57.07 55.99 2pzh s TYR 17 Cb -0.45 -4.00 0.80 0.00 0.35 0.00 0.00 41.96 38.67 2pzh s TYR 17 CO 0.32 -3.68 1.73 1.12 -1.34 0.00 0.00 175.55 173.70 2pzh h HIS 18 N 6.48 0.93 0.00 4.97 2.07 -1.91 0.15 115.15 127.83 2pzh h HIS 18 Ca -0.43 0.04 0.00 0.00 -2.85 0.00 0.00 60.37 57.12 2pzh h HIS 18 Cb 1.21 -0.26 0.00 0.00 2.57 0.00 0.00 27.41 30.93 2pzh h HIS 18 CO 0.64 0.07 0.00 0.00 -3.07 0.00 0.00 177.93 175.57 2pzh h ALA 19 N 1.70 1.00 0.00 6.11 0.00 -1.98 -2.95 119.26 123.14 2pzh h ALA 19 Ca 0.60 0.00 -0.05 0.00 0.00 0.00 0.00 54.91 55.46 2pzh h ALA 19 Cb 1.10 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.88 2pzh h ALA 19 CO -0.47 0.00 -0.24 -0.91 0.00 0.00 0.00 179.25 177.64 2pzh h ASN 20 N 0.00 0.00 -0.02 0.00 -0.26 -1.32 -1.91 115.58 112.07 2pzh h ASN 20 Ca 0.00 0.00 -0.03 0.00 -0.56 0.00 0.00 56.30 55.71 2pzh h ASN 20 Cb 0.41 0.00 -0.01 0.00 -1.06 0.00 0.00 38.32 37.66 2pzh h ASN 20 CO 0.00 0.24 -0.06 1.88 -1.06 0.00 0.00 177.43 178.42 2pzh h TYR 21 N 0.00 0.21 -0.35 1.19 0.05 -1.66 -0.78 116.97 115.63 2pzh h TYR 21 Ca -0.00 -0.01 -0.11 0.00 0.05 0.00 0.00 58.73 58.66 2pzh h TYR 21 Cb 0.58 -0.06 -0.01 0.00 1.01 0.00 0.00 36.73 38.24 2pzh h TYR 21 CO 0.00 0.28 -0.22 -0.07 -1.05 0.00 0.00 178.16 177.10 2pzh h LEU 22 N 0.20 0.68 -0.20 3.88 4.07 -1.54 -2.15 115.31 120.25 2pzh h LEU 22 Ca 0.05 -0.23 -0.01 0.00 0.08 0.00 0.00 57.88 57.76 2pzh h LEU 22 Cb 0.25 -0.19 -0.01 0.00 1.08 0.00 0.00 40.66 41.80 2pzh h LEU 22 CO 0.01 0.89 0.10 0.11 -1.08 0.00 0.00 178.44 178.47 2pzh h LYS 23 N 0.60 0.29 -0.66 1.13 1.57 -1.17 -0.78 116.57 117.54 2pzh h LYS 23 Ca 0.09 -0.04 0.11 0.00 -1.87 0.00 0.00 60.65 58.94 2pzh h LYS 23 Cb 0.69 -0.05 -0.08 0.00 0.08 0.00 0.00 32.23 32.87 2pzh h LYS 23 CO 0.05 0.30 0.24 1.88 -0.57 0.00 0.00 179.45 181.35 2pzh h TYR 24 N 0.20 0.41 -0.40 -1.35 0.05 -1.05 -0.53 116.97 114.29 2pzh h TYR 24 Ca 0.07 0.03 -0.09 0.00 0.05 0.00 0.00 58.73 58.80 2pzh h TYR 24 Cb 0.11 -0.08 -0.02 0.00 1.01 0.00 0.00 36.73 37.75 2pzh h TYR 24 CO -0.03 0.07 -0.10 0.00 -1.05 0.00 0.00 178.16 177.05 2pzh h GLU 26 N 0.64 0.65 -0.77 0.00 4.22 -0.37 -2.22 114.58 116.73 2pzh h GLU 26 Ca 0.11 -0.06 0.04 0.00 0.08 0.00 0.00 59.36 59.54 2pzh h GLU 26 Cb 0.55 -0.14 -0.05 0.00 0.50 0.00 0.00 28.75 29.61 2pzh h GLU 26 CO 0.03 0.47 0.48 0.00 -2.18 0.00 0.00 179.01 177.81 2pzh h ARG 27 N 0.63 0.88 -0.57 1.92 3.08 -0.71 -0.43 114.38 119.19 2pzh h ARG 27 Ca 0.17 -0.05 -0.05 0.00 0.07 0.00 0.00 59.98 60.11 2pzh h ARG 27 Cb -0.01 -0.20 -0.03 0.00 0.08 0.00 0.00 29.97 29.82 2pzh h ARG 27 CO -0.03 0.58 0.14 0.00 -1.07 0.00 0.00 179.97 179.59 2pzh h ALA 28 N 1.35 1.17 -0.15 0.04 0.00 -1.12 -0.37 119.26 120.18 2pzh h ALA 28 Ca 0.32 -0.21 -0.05 0.00 0.00 0.00 0.00 54.91 54.98 2pzh h ALA 28 Cb 0.09 -0.23 -0.00 0.00 0.00 0.00 0.00 17.79 17.64 2pzh h ALA 28 CO -0.14 0.56 -0.08 0.00 0.00 0.00 0.00 179.25 179.59 2pzh h ARG 29 N 0.85 0.32 -0.51 0.00 3.08 -0.74 -3.11 114.38 114.27 2pzh h ARG 29 Ca 0.18 -0.14 -0.06 0.00 0.07 0.00 0.00 59.98 60.03 2pzh h ARG 29 Cb 0.31 -0.01 -0.02 0.00 0.08 0.00 0.00 29.97 30.33 2pzh h ARG 29 CO -0.00 0.65 0.08 0.77 -1.07 0.00 0.00 179.97 180.40 2pzh h SER 30 N -0.02 0.75 0.04 7.04 0.02 -0.83 -2.81 113.55 117.74 2pzh h SER 30 Ca 0.03 -0.15 -0.04 0.00 -0.84 0.00 0.00 61.79 60.79 2pzh h SER 30 Cb 0.56 -0.20 -0.01 0.00 0.14 0.00 0.00 62.40 62.90 2pzh h SER 30 CO 0.02 0.77 -0.12 -0.08 -1.14 0.00 0.00 176.83 176.29 2pzh h GLU 31 N 0.76 0.18 -0.90 3.45 4.57 -1.08 0.18 114.58 121.74 2pzh h GLU 31 Ca 0.16 -0.04 0.11 0.00 -1.18 0.00 0.00 59.36 58.41 2pzh h GLU 31 Cb 0.35 -0.03 -0.08 0.00 -0.16 0.00 0.00 28.75 28.83 2pzh h GLU 31 CO 0.01 0.31 0.54 0.35 -1.18 0.00 0.00 179.01 179.04 2pzh h PHE 32 N 0.18 0.98 0.10 0.92 3.57 -1.42 0.35 116.94 121.61 2pzh h PHE 32 Ca 0.04 0.03 -0.17 0.00 3.53 0.00 0.00 57.97 61.40 2pzh h PHE 32 Cb 0.33 -0.30 0.02 0.00 2.79 0.00 0.00 35.95 38.78 2pzh h PHE 32 CO 0.00 0.39 -0.71 0.74 -2.23 0.00 0.00 178.31 176.50 2pzh h PHE 33 N 0.87 0.52 -0.59 0.41 0.04 -1.27 -3.34 116.94 113.58 2pzh h PHE 33 Ca 0.44 -0.35 0.04 0.00 2.80 0.00 0.00 57.97 60.90 2pzh h PHE 33 Cb 0.43 -0.03 -0.04 0.00 2.20 0.00 0.00 35.95 38.50 2pzh h PHE 33 CO -0.04 1.25 0.34 0.74 -0.60 0.00 0.00 178.31 180.00 2pzh h PHE 34 N -0.35 0.63 -0.90 -0.55 0.04 -0.25 -1.04 116.94 114.52 2pzh h PHE 34 Ca -0.12 0.02 0.25 0.00 2.80 0.00 0.00 57.97 60.93 2pzh h PHE 34 Cb 1.52 -0.20 -0.15 0.00 2.20 0.00 0.00 35.95 39.32 2pzh h PHE 34 CO 0.19 0.33 0.25 0.87 -0.60 0.00 0.00 178.31 179.35 2pzh h LYS 35 N 0.66 0.18 -0.86 1.51 1.57 -0.44 0.18 116.57 119.37 2pzh h LYS 35 Ca 0.25 -0.01 -0.20 0.00 -1.87 0.00 0.00 60.65 58.82 2pzh h LYS 35 Cb 0.09 -0.04 -0.12 0.00 0.08 0.00 0.00 32.23 32.24 2pzh h LYS 35 CO -0.14 0.12 0.26 1.04 -0.57 0.00 0.00 179.45 180.16 2pzh n GLN 36 N -5.24 2.81 -2.78 3.15 6.02 -0.44 -4.90 117.38 116.00 2pzh n GLN 36 Ca 0.23 -2.24 -0.21 0.00 -0.01 0.00 0.00 57.00 54.76 2pzh n GLN 36 Cb 0.73 -1.95 0.01 0.00 1.02 0.00 0.00 30.24 30.05 2pzh n GLN 36 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 177.06 176.14 2pzh n ASN 37 N -0.17 -5.70 -4.20 1.08 5.03 0.64 -4.99 115.26 106.96 2pzh n ASN 37 Ca 0.33 -0.16 -0.12 0.00 0.87 0.00 0.00 54.58 55.50 2pzh n ASN 37 Cb 1.17 -4.68 -0.10 0.00 -1.02 0.00 0.00 39.78 35.15 2pzh n ASN 37 CO 0.00 0.00 0.00 0.54 -1.83 0.00 0.00 177.26 175.97 2pzh s VAL 38 N -3.07 0.75 0.40 2.41 0.11 -0.91 -5.02 120.40 115.07 2pzh s VAL 38 Ca 0.18 -1.96 -0.11 0.00 -2.93 0.00 0.00 61.98 57.16 2pzh s VAL 38 Cb -0.08 -1.82 -0.06 0.00 -1.53 0.00 0.00 36.38 32.89 2pzh s VAL 38 CO 0.22 -0.75 0.76 -0.76 -3.33 0.00 0.00 175.10 171.24 2pzh s LEU 39 N -3.09 3.84 0.00 2.54 1.43 -1.26 -2.70 118.68 119.44 2pzh s LEU 39 Ca 0.16 1.13 0.00 0.00 -1.03 0.00 0.00 54.13 54.39 2pzh s LEU 39 Cb 0.05 -4.01 0.00 0.00 0.03 0.00 0.00 46.19 42.26 2pzh s LEU 39 CO -0.02 -0.39 1.68 -0.81 0.23 0.00 0.00 176.35 177.04 2pzh n PRO 40 N -1.25 0.94 -3.51 1.29 -0.05 -1.26 -4.73 135.00 126.44 2pzh n PRO 40 Ca 0.02 0.00 -0.11 0.00 -0.05 0.00 0.00 63.50 63.36 2pzh n PRO 40 Cb 0.54 -1.03 -0.03 0.00 -0.05 0.00 0.00 33.50 32.93 2pzh n PRO 40 CO 0.00 0.00 0.00 -1.83 -0.05 0.00 0.00 175.50 173.62 2pzh s GLU 41 N 0.10 1.19 0.00 0.54 -1.05 -1.26 -4.33 118.70 113.89 2pzh s GLU 41 Ca 0.00 -0.56 0.00 0.00 -0.15 0.00 0.00 54.97 54.26 2pzh s GLU 41 Cb 0.00 0.54 0.00 0.00 -0.44 0.00 0.00 34.13 34.23 2pzh s GLU 41 CO 0.00 -0.50 0.00 0.27 0.95 0.00 0.00 175.26 175.98 2pzh n ASN 42 N -0.30 0.00 -0.29 0.83 0.23 -0.88 -5.03 115.26 109.82 2pzh n ASN 42 Ca -0.17 -0.83 0.13 0.00 -0.53 0.00 0.00 54.58 53.19 2pzh n ASN 42 Cb 0.64 0.00 0.39 0.00 -2.08 0.00 0.00 39.78 38.73 2pzh n ASN 42 CO 0.00 0.00 0.00 1.05 -0.93 0.00 0.00 177.26 177.38 2pzh h GLU 43 N 0.00 0.65 -0.00 -3.83 9.09 -2.03 -3.07 114.58 115.39 2pzh h GLU 43 Ca 0.00 -0.04 0.00 0.00 0.05 0.00 0.00 59.36 59.37 2pzh h GLU 43 Cb 0.00 -0.15 0.00 0.00 -1.65 0.00 0.00 28.75 26.95 2pzh h GLU 43 CO 0.00 0.43 -0.37 -1.91 0.05 0.00 0.00 179.01 177.21 2pzh n GLU 44 N -4.59 4.26 -3.83 1.06 2.13 -1.26 -5.01 120.64 113.40 2pzh n GLU 44 Ca 0.19 -0.03 -0.10 0.00 0.66 0.00 0.00 57.16 57.89 2pzh n GLU 44 Cb 0.53 -0.88 -0.05 0.00 0.27 0.00 0.00 31.44 31.30 2pzh n GLU 44 CO 0.00 0.00 0.00 0.20 -0.41 0.00 0.00 177.13 176.92 2pzh s GLY 45 N -1.73 0.13 0.05 8.31 0.00 -1.16 -2.12 107.32 110.81 2pzh s GLY 45 Ca 0.03 -0.50 0.01 0.00 0.00 0.00 0.00 44.72 44.27 2pzh s GLY 45 CO 0.32 -0.53 -0.06 0.54 0.00 0.00 0.00 173.10 173.37 2pzh s VAL 46 N -3.90 0.47 0.27 1.40 0.11 -1.01 -2.07 120.40 115.67 2pzh s VAL 46 Ca 0.12 -1.35 -0.29 0.00 -2.93 0.00 0.00 61.98 57.52 2pzh s VAL 46 Cb 0.01 -0.92 -0.09 0.00 -1.53 0.00 0.00 36.38 33.85 2pzh s VAL 46 CO -0.03 -0.60 1.01 -0.36 -3.33 0.00 0.00 175.10 171.80 2pzh s PHE 47 N -2.25 3.76 -0.07 1.54 0.08 -1.26 -0.73 117.98 119.05 2pzh s PHE 47 Ca -0.04 1.80 0.02 0.00 0.12 0.00 0.00 56.93 58.84 2pzh s PHE 47 Cb -0.04 -3.12 0.02 0.00 -0.57 0.00 0.00 43.02 39.31 2pzh s PHE 47 CO -0.02 -0.04 -0.11 0.14 -0.10 0.00 0.00 175.22 175.09 2pzh s VAL 48 N -1.22 1.05 0.10 -0.44 -7.23 0.45 -4.92 120.40 108.20 2pzh s VAL 48 Ca 0.44 -0.41 -0.31 0.00 -1.81 0.00 0.00 61.98 59.89 2pzh s VAL 48 Cb -0.28 -0.99 -0.07 0.00 0.56 0.00 0.00 36.38 35.60 2pzh s VAL 48 CO 0.35 0.34 1.36 -0.51 -0.31 0.00 0.00 175.10 176.34 2pzh s ILE 49 N 0.85 3.45 -0.26 -0.62 2.07 -1.26 -0.97 121.20 124.47 2pzh s ILE 49 Ca -0.11 1.03 -0.06 0.00 -1.41 0.00 0.00 60.65 60.10 2pzh s ILE 49 Cb -0.15 -3.66 -0.16 0.00 0.13 0.00 0.00 42.46 38.62 2pzh s ILE 49 CO 0.01 0.07 -0.22 0.54 -1.91 0.00 0.00 174.94 173.43 2pzh n ARG 50 N 4.08 0.63 -3.56 3.50 5.12 0.26 -4.92 116.66 121.76 2pzh n ARG 50 Ca 0.11 0.22 -0.16 0.00 -1.93 0.00 0.00 57.85 56.09 2pzh n ARG 50 Cb 0.43 -1.53 -0.06 0.00 -1.16 0.00 0.00 32.46 30.14 2pzh n ARG 50 CO 0.00 0.00 0.00 -1.54 -1.93 0.00 0.00 177.63 174.16 2pzh s SER 51 N -6.96 -0.53 -0.04 0.55 1.04 -1.20 -5.00 113.70 101.56 2pzh s SER 51 Ca -0.36 0.44 0.00 0.00 0.48 0.00 0.00 55.95 56.51 2pzh s SER 51 Cb 0.11 0.50 0.03 0.00 0.10 0.00 0.00 66.02 66.76 2pzh s SER 51 CO 0.57 -0.64 -0.00 -0.63 0.98 0.00 0.00 173.24 173.51 2pzh s ILE 52 N -1.72 0.25 -0.21 -1.02 1.01 -1.26 -1.98 121.20 116.27 2pzh s ILE 52 Ca -0.09 0.08 -0.03 0.00 0.00 0.00 0.00 60.65 60.61 2pzh s ILE 52 Cb -0.01 -0.36 -0.01 0.00 0.01 0.00 0.00 42.46 42.09 2pzh s ILE 52 CO 0.04 0.18 -0.05 -0.54 0.00 0.00 0.00 174.94 174.57 2pzh s LYS 53 N 1.26 3.37 0.03 2.79 1.02 -0.37 -4.99 119.74 122.85 2pzh s LYS 53 Ca -0.06 -0.63 0.04 0.00 0.02 0.00 0.00 55.97 55.33 2pzh s LYS 53 Cb -0.13 -2.96 -0.02 0.00 -0.52 0.00 0.00 37.83 34.19 2pzh s LYS 53 CO -0.02 -0.15 -0.12 0.00 -0.92 0.00 0.00 175.35 174.14 2pzh s ALA 54 N 1.35 0.98 0.02 5.17 0.00 -1.26 -0.88 121.76 127.14 2pzh s ALA 54 Ca 0.04 -0.73 0.06 0.00 0.00 0.00 0.00 51.96 51.33 2pzh s ALA 54 Cb -0.14 -0.14 -0.02 0.00 0.00 0.00 0.00 23.12 22.82 2pzh s ALA 54 CO -0.03 0.17 -0.17 -0.51 0.00 0.00 0.00 175.76 175.22 2pzh s ASP 55 N -1.04 2.01 -0.16 0.00 1.01 0.59 -5.00 116.67 114.09 2pzh s ASP 55 Ca -0.00 -0.41 -0.01 0.00 0.71 0.00 0.00 52.55 52.84 2pzh s ASP 55 Cb -0.07 -0.18 -0.01 0.00 1.01 0.00 0.00 42.92 43.67 2pzh s ASP 55 CO 0.01 0.14 -0.12 -0.36 0.21 0.00 0.00 175.17 175.05 2pzh s PHE 56 N -0.64 2.84 0.00 4.23 0.40 -1.26 -1.39 117.98 122.15 2pzh s PHE 56 Ca 0.05 -0.81 0.00 0.00 -0.60 0.00 0.00 56.93 55.58 2pzh s PHE 56 Cb -0.07 -1.91 0.00 0.00 0.51 0.00 0.00 43.02 41.54 2pzh s PHE 56 CO 0.01 -0.35 0.00 1.19 0.70 0.00 0.00 175.22 176.77 2pzh n PHE 57 N 3.92 0.00 -2.19 0.36 3.72 -0.53 -4.98 117.46 117.76 2pzh n PHE 57 Ca -0.18 0.00 -0.42 0.00 -0.05 0.00 0.00 57.45 56.80 2pzh n PHE 57 Cb 0.52 0.00 -0.03 0.00 -0.94 0.00 0.00 39.48 39.03 2pzh n PHE 57 CO 0.00 0.00 0.00 0.99 -0.05 0.00 0.00 176.76 177.70 2pzh s THR 58 N 4.19 3.42 0.44 4.37 2.01 -1.11 -4.92 115.64 124.05 2pzh s THR 58 Ca 0.00 0.99 -0.24 0.00 0.31 0.00 0.00 61.69 62.75 2pzh s THR 58 Cb 0.00 -3.64 -0.08 0.00 0.01 0.00 0.00 72.50 68.80 2pzh s THR 58 CO 0.00 0.06 1.19 -2.16 -0.69 0.00 0.00 174.62 173.02 2pzh s PRO 59 N 1.34 3.82 0.47 4.92 0.04 -1.26 -4.21 135.00 140.12 2pzh s PRO 59 Ca 0.64 1.85 -0.05 0.00 0.04 0.00 0.00 61.00 63.48 2pzh s PRO 59 Cb -0.35 -2.50 -0.04 0.00 0.04 0.00 0.00 34.50 31.65 2pzh s PRO 59 CO 0.30 -0.52 0.77 0.00 0.04 0.00 0.00 177.00 177.59 2pzh s ALA 60 N -1.47 3.41 0.30 8.56 0.00 -1.26 -4.96 121.76 126.34 2pzh s ALA 60 Ca 0.62 -0.50 0.03 0.00 0.00 0.00 0.00 51.96 52.11 2pzh s ALA 60 Cb -0.31 -2.58 -0.04 0.00 0.00 0.00 0.00 23.12 20.20 2pzh s ALA 60 CO 0.38 -0.31 0.16 -1.54 0.00 0.00 0.00 175.76 174.45 2pzh s SER 61 N -4.02 1.54 0.03 0.00 1.04 -1.26 -1.09 113.70 109.94 2pzh s SER 61 Ca 0.47 -1.55 -0.38 0.00 0.48 0.00 0.00 55.95 54.98 2pzh s SER 61 Cb -0.10 0.37 -0.17 0.00 0.10 0.00 0.00 66.02 66.22 2pzh s SER 61 CO 0.43 -0.88 1.34 -0.11 0.98 0.00 0.00 173.24 175.01 2pzh n LEU 62 N -0.58 1.48 0.00 2.42 7.94 -1.26 -2.02 117.00 124.98 2pzh n LEU 62 Ca 0.01 1.12 0.00 0.00 -1.11 0.00 0.00 56.01 56.03 2pzh n LEU 62 Cb 0.65 -1.14 0.00 0.00 0.53 0.00 0.00 43.42 43.46 2pzh n LEU 62 CO 0.35 -1.11 0.00 0.61 -1.11 0.00 0.00 177.39 176.13 2pzh n GLY 63 N 2.55 1.75 3.79 -3.96 0.00 -0.15 -4.78 105.19 104.40 2pzh n GLY 63 Ca 0.20 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.88 2pzh n GLY 63 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2pzh s GLN 64 N -0.44 3.37 -0.19 1.61 -0.21 -0.85 -2.90 119.66 120.05 2pzh s GLN 64 Ca 0.00 1.40 -0.07 0.00 0.02 0.00 0.00 55.36 56.70 2pzh s GLN 64 Cb 0.00 -2.03 -0.04 0.00 1.00 0.00 0.00 33.01 31.94 2pzh s GLN 64 CO 0.00 -0.80 0.07 0.08 -2.12 0.00 0.00 175.29 172.52 2pzh s VAL 65 N -2.10 4.78 0.05 1.09 1.01 -0.24 -0.54 120.40 124.45 2pzh s VAL 65 Ca 0.68 -0.04 0.07 0.00 0.00 0.00 0.00 61.98 62.69 2pzh s VAL 65 Cb -0.19 -3.16 -0.03 0.00 0.00 0.00 0.00 36.38 32.99 2pzh s VAL 65 CO 0.30 0.45 -0.15 -0.76 0.00 0.00 0.00 175.10 174.94 2pzh s LEU 66 N 0.46 2.75 -0.15 3.92 1.43 0.26 -1.09 118.68 126.25 2pzh s LEU 66 Ca 0.03 -0.40 0.01 0.00 -1.03 0.00 0.00 54.13 52.75 2pzh s LEU 66 Cb -0.13 -1.60 0.01 0.00 0.03 0.00 0.00 46.19 44.50 2pzh s LEU 66 CO 0.01 0.24 -0.19 -0.70 0.23 0.00 0.00 176.35 175.94 2pzh s GLU 67 N -1.60 3.09 -0.26 1.70 2.12 0.79 -0.89 118.70 123.64 2pzh s GLU 67 Ca 0.16 -0.81 -0.10 0.00 0.36 0.00 0.00 54.97 54.58 2pzh s GLU 67 Cb -0.11 -2.53 -0.05 0.00 0.26 0.00 0.00 34.13 31.71 2pzh s GLU 67 CO 0.07 -0.04 0.16 0.42 -0.54 0.00 0.00 175.26 175.33 2pzh s ILE 68 N 0.91 5.22 -0.21 -3.70 1.09 0.82 -1.16 121.20 124.17 2pzh s ILE 68 Ca -0.04 0.13 -0.05 0.00 -1.10 0.00 0.00 60.65 59.59 2pzh s ILE 68 Cb -0.15 -3.45 -0.02 0.00 -1.06 0.00 0.00 42.46 37.77 2pzh s ILE 68 CO -0.03 0.31 0.00 -0.13 -0.10 0.00 0.00 174.94 174.99 2pzh s ARG 69 N 1.38 3.60 -0.09 2.79 0.52 0.62 -2.08 118.95 125.69 2pzh s ARG 69 Ca 0.07 -0.53 0.03 0.00 -0.52 0.00 0.00 55.73 54.79 2pzh s ARG 69 Cb -0.15 -3.10 0.01 0.00 0.52 0.00 0.00 34.95 32.23 2pzh s ARG 69 CO 0.07 -0.03 -0.19 0.99 0.02 0.00 0.00 175.30 176.16 2pzh s THR 70 N 1.10 1.68 0.06 0.02 2.01 -1.26 -0.90 115.64 118.36 2pzh s THR 70 Ca 0.02 -0.79 0.04 0.00 0.31 0.00 0.00 61.69 61.27 2pzh s THR 70 Cb -0.14 -1.47 -0.03 0.00 0.01 0.00 0.00 72.50 70.86 2pzh s THR 70 CO 0.01 0.48 -0.11 0.00 -0.69 0.00 0.00 174.62 174.31 2pzh s GLN 71 N 0.49 0.68 -0.48 4.92 -2.07 0.43 -5.00 119.66 118.64 2pzh s GLN 71 Ca -0.17 -0.88 -0.28 0.00 -1.82 0.00 0.00 55.36 52.21 2pzh s GLN 71 Cb -0.17 -0.55 0.03 0.00 -1.09 0.00 0.00 33.01 31.23 2pzh s GLN 71 CO 0.07 0.11 1.11 0.42 -1.32 0.00 0.00 175.29 175.68 2pzh s ILE 72 N -1.43 4.23 0.10 3.63 -1.09 -1.26 -0.62 121.20 124.75 2pzh s ILE 72 Ca -0.05 1.15 -0.04 0.00 -2.23 0.00 0.00 60.65 59.48 2pzh s ILE 72 Cb -0.09 -4.59 -0.25 0.00 -1.58 0.00 0.00 42.46 35.95 2pzh s ILE 72 CO 0.01 -1.00 1.20 0.50 -1.23 0.00 0.00 174.94 174.42 2pzh h LYS 73 N 9.23 0.31 -1.96 2.79 3.64 -1.23 -3.47 116.57 125.87 2pzh h LYS 73 Ca -0.23 -0.44 0.01 0.00 -1.27 0.00 0.00 60.65 58.72 2pzh h LYS 73 Cb 1.06 0.15 -0.22 0.00 -0.41 0.00 0.00 32.23 32.82 2pzh h LYS 73 CO 1.12 1.17 0.09 -2.00 -2.27 0.00 0.00 179.45 177.55 2pzh s GLU 74 N -2.87 0.72 -0.22 1.90 2.12 -1.05 -4.98 118.70 114.31 2pzh s GLU 74 Ca -0.04 1.11 -0.01 0.00 0.36 0.00 0.00 54.97 56.38 2pzh s GLU 74 Cb 0.08 0.21 0.06 0.00 0.26 0.00 0.00 34.13 34.74 2pzh s GLU 74 CO 0.88 -0.13 0.01 -1.17 -0.54 0.00 0.00 175.26 174.31 2pzh s LEU 75 N 1.24 1.75 0.00 2.70 0.20 -1.26 -0.20 118.68 123.11 2pzh s LEU 75 Ca -0.07 -1.02 0.02 0.00 0.69 0.00 0.00 54.13 53.76 2pzh s LEU 75 Cb -0.05 -0.82 0.02 0.00 -0.43 0.00 0.00 46.19 44.92 2pzh s LEU 75 CO -0.14 -0.29 0.19 0.54 -0.29 0.00 0.00 176.35 176.36 2pzh n ARG 76 N 4.90 0.94 -0.21 1.98 5.12 0.21 -5.03 116.66 124.57 2pzh n ARG 76 Ca -0.09 -2.72 -0.07 0.00 -1.93 0.00 0.00 57.85 53.04 2pzh n ARG 76 Cb 0.46 0.47 0.08 0.00 -1.16 0.00 0.00 32.46 32.31 2pzh n ARG 76 CO 0.00 0.00 0.00 -0.22 -1.93 0.00 0.00 177.63 175.48 2pzh h LYS 77 N 0.00 1.05 0.00 5.56 3.64 -1.99 -3.33 116.57 121.50 2pzh h LYS 77 Ca -0.29 -0.26 0.00 0.00 -1.27 0.00 0.00 60.65 58.83 2pzh h LYS 77 Cb 0.98 -0.13 0.00 0.00 -0.41 0.00 0.00 32.23 32.67 2pzh h LYS 77 CO 0.47 0.95 -1.44 0.28 -2.27 0.00 0.00 179.45 177.43 2pzh n VAL 78 N -4.22 0.00 -4.13 2.00 0.31 -1.26 -0.58 118.33 110.44 2pzh n VAL 78 Ca 0.04 -0.29 -0.11 0.00 -0.01 0.00 0.00 64.34 63.98 2pzh n VAL 78 Cb 0.28 0.33 -0.09 0.00 -0.91 0.00 0.00 33.84 33.44 2pzh n VAL 78 CO 0.00 0.00 0.00 0.72 -1.32 0.00 0.00 176.83 176.23 2pzh s PHE 79 N -2.81 0.88 -0.01 3.52 -0.12 -1.25 -3.14 117.98 115.05 2pzh s PHE 79 Ca -0.03 -1.19 -0.03 0.00 -0.05 0.00 0.00 56.93 55.63 2pzh s PHE 79 Cb 0.09 -0.41 0.00 0.00 -0.63 0.00 0.00 43.02 42.07 2pzh s PHE 79 CO 0.55 -0.62 0.06 0.54 -0.05 0.00 0.00 175.22 175.69 2pzh s VAL 80 N -4.08 0.04 -0.19 -2.49 0.11 -0.18 -0.62 120.40 112.99 2pzh s VAL 80 Ca 0.29 -0.29 -0.00 0.00 -2.93 0.00 0.00 61.98 59.05 2pzh s VAL 80 Cb 0.06 -0.19 0.01 0.00 -1.53 0.00 0.00 36.38 34.74 2pzh s VAL 80 CO 0.06 -0.16 -0.16 -0.69 -3.33 0.00 0.00 175.10 170.82 2pzh s VAL 81 N -0.49 2.37 -0.10 2.04 1.01 0.72 -0.52 120.40 125.43 2pzh s VAL 81 Ca -0.06 -0.84 -0.02 0.00 0.00 0.00 0.00 61.98 61.07 2pzh s VAL 81 Cb -0.04 -2.02 -0.03 0.00 0.00 0.00 0.00 36.38 34.30 2pzh s VAL 81 CO 0.00 0.51 -0.02 -0.76 0.00 0.00 0.00 175.10 174.84 2pzh s LEU 82 N 1.31 3.44 -0.17 3.92 1.43 -0.02 -0.66 118.68 127.94 2pzh s LEU 82 Ca 0.05 0.05 -0.04 0.00 -1.03 0.00 0.00 54.13 53.16 2pzh s LEU 82 Cb -0.13 -1.79 -0.03 0.00 0.03 0.00 0.00 46.19 44.27 2pzh s LEU 82 CO -0.10 0.32 -0.03 0.12 0.23 0.00 0.00 176.35 176.89 2pzh s PHE 83 N -0.56 3.01 -0.03 0.29 5.36 0.21 -0.96 117.98 125.30 2pzh s PHE 83 Ca 0.09 -0.38 0.02 0.00 -0.96 0.00 0.00 56.93 55.70 2pzh s PHE 83 Cb -0.12 -1.99 0.01 0.00 -0.34 0.00 0.00 43.02 40.58 2pzh s PHE 83 CO 0.02 -0.12 -0.08 -0.65 -1.46 0.00 0.00 175.22 172.94 2pzh s GLN 84 N 0.56 0.88 0.00 10.12 -0.21 0.10 -0.43 119.66 130.69 2pzh s GLN 84 Ca -0.03 -0.26 0.06 0.00 0.02 0.00 0.00 55.36 55.15 2pzh s GLN 84 Cb -0.14 -0.83 -0.02 0.00 1.00 0.00 0.00 33.01 33.02 2pzh s GLN 84 CO 0.03 0.08 -0.17 -1.21 -2.12 0.00 0.00 175.29 171.89 2pzh s GLU 85 N 0.27 1.34 -0.16 2.91 2.02 -0.07 -0.74 118.70 124.26 2pzh s GLU 85 Ca -0.04 -0.70 -0.02 0.00 0.02 0.00 0.00 54.97 54.23 2pzh s GLU 85 Cb -0.09 -1.33 -0.02 0.00 0.10 0.00 0.00 34.13 32.80 2pzh s GLU 85 CO 0.00 0.36 -0.08 0.42 0.02 0.00 0.00 175.26 175.98 2pzh s ILE 86 N -0.53 3.43 -0.06 -1.63 1.01 0.35 -0.28 121.20 123.49 2pzh s ILE 86 Ca 0.06 -0.51 0.05 0.00 0.00 0.00 0.00 60.65 60.25 2pzh s ILE 86 Cb -0.07 -2.49 -0.01 0.00 0.01 0.00 0.00 42.46 39.89 2pzh s ILE 86 CO 0.00 0.49 -0.22 -0.31 0.00 0.00 0.00 174.94 174.90 2pzh s TYR 87 N 0.62 2.52 -0.05 3.97 1.51 -0.30 -0.34 117.35 125.27 2pzh s TYR 87 Ca -0.05 -0.62 -0.30 0.00 -1.01 0.00 0.00 57.07 55.09 2pzh s TYR 87 Cb -0.15 -1.63 -0.03 0.00 -0.11 0.00 0.00 41.96 40.04 2pzh s TYR 87 CO 0.03 -0.15 1.13 0.00 -1.11 0.00 0.00 175.55 175.44 2pzh n ILE 89 N 4.48 0.00 -3.77 0.00 -5.35 -0.25 -2.25 119.36 112.22 2pzh n ILE 89 Ca 0.10 -0.27 -0.13 0.00 -0.27 0.00 0.00 62.75 62.18 2pzh n ILE 89 Cb 0.47 0.76 -0.09 0.00 -1.74 0.00 0.00 39.64 39.05 2pzh n ILE 89 CO 0.00 0.00 0.00 -1.10 -1.76 0.00 0.00 176.55 173.69 2pzh s GLN 90 N -1.51 0.68 0.22 6.28 -0.21 -1.16 -4.82 119.66 119.14 2pzh s GLN 90 Ca 0.00 -0.26 -0.02 0.00 0.02 0.00 0.00 55.36 55.10 2pzh s GLN 90 Cb 0.00 0.30 -0.05 0.00 1.00 0.00 0.00 33.01 34.26 2pzh s GLN 90 CO 0.02 -0.19 0.43 -0.80 -2.12 0.00 0.00 175.29 172.64 2pzh s ASN 91 N -1.45 6.42 0.42 5.90 0.02 -1.26 -1.08 114.94 123.91 2pzh s ASN 91 Ca -0.12 0.51 0.13 0.00 -1.02 0.00 0.00 52.86 52.36 2pzh s ASN 91 Cb -0.05 -2.06 0.99 0.00 0.02 0.00 0.00 41.25 40.15 2pzh s ASN 91 CO 0.03 -0.07 1.95 0.00 0.02 0.00 0.00 177.10 179.03 2pzh h ALA 92 N 2.02 1.99 0.00 0.60 0.00 -1.83 -1.72 119.26 120.33 2pzh h ALA 92 Ca -0.48 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.43 2pzh h ALA 92 Cb 1.19 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.88 2pzh h ALA 92 CO 0.68 -0.15 0.00 -1.13 0.00 0.00 0.00 179.25 178.65 2pzh n SER 93 N -4.48 0.18 -0.43 0.00 3.41 -1.26 -4.89 113.62 106.15 2pzh n SER 93 Ca 0.12 0.52 -0.06 0.00 -0.26 0.00 0.00 58.87 59.20 2pzh n SER 93 Cb 0.41 -0.57 -0.02 0.00 -0.26 0.00 0.00 64.21 63.76 2pzh n SER 93 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 2pzh n LEU 94 N -1.68 -0.01 -4.69 1.04 4.32 -0.65 -4.97 117.00 110.36 2pzh n LEU 94 Ca 0.06 0.14 -0.42 0.00 -0.02 0.00 0.00 56.01 55.76 2pzh n LEU 94 Cb 0.30 -1.93 -0.03 0.00 -1.62 0.00 0.00 43.42 40.15 2pzh n LEU 94 CO 0.24 -0.69 1.35 -1.61 -1.22 0.00 0.00 177.39 175.46 2pzh s GLU 95 N -2.07 4.18 0.36 3.23 2.02 -1.26 -4.90 118.70 120.25 2pzh s GLU 95 Ca 0.00 2.40 -0.26 0.00 0.02 0.00 0.00 54.97 57.12 2pzh s GLU 95 Cb 0.00 -3.54 -0.12 0.00 0.10 0.00 0.00 34.13 30.56 2pzh s GLU 95 CO 0.00 -0.75 1.01 -2.30 0.02 0.00 0.00 175.26 173.24 2pzh n PRO 96 N 5.43 1.38 -3.67 0.39 -0.02 -1.26 -4.55 135.00 132.70 2pzh n PRO 96 Ca 0.16 0.49 -0.15 0.00 -2.02 0.00 0.00 63.50 61.98 2pzh n PRO 96 Cb 0.40 -1.95 -0.08 0.00 -0.02 0.00 0.00 33.50 31.85 2pzh n PRO 96 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2pzh s MET 97 N -1.77 0.75 0.04 -0.52 0.23 -1.26 -5.07 119.30 111.70 2pzh s MET 97 Ca 0.60 0.26 -0.30 0.00 -1.03 0.00 0.00 55.69 55.22 2pzh s MET 97 Cb -0.62 0.35 -0.05 0.00 -1.53 0.00 0.00 34.83 32.98 2pzh s MET 97 CO 0.59 -0.18 1.18 0.21 -2.03 0.00 0.00 175.02 174.78 2pzh s LYS 98 N -0.71 4.44 0.48 3.16 2.20 -1.26 -4.96 119.74 123.09 2pzh s LYS 98 Ca -0.08 1.73 -0.24 0.00 -0.36 0.00 0.00 55.97 57.01 2pzh s LYS 98 Cb -0.03 -3.38 -0.07 0.00 -1.51 0.00 0.00 37.83 32.84 2pzh s LYS 98 CO 0.05 -0.26 1.41 -2.14 -0.36 0.00 0.00 175.35 174.05 2pzh s PRO 99 N 1.18 3.52 0.03 4.03 0.02 -1.26 -4.96 135.00 137.55 2pzh s PRO 99 Ca 0.58 2.38 0.04 0.00 0.02 0.00 0.00 61.00 64.02 2pzh s PRO 99 Cb -0.28 -2.54 -0.02 0.00 0.02 0.00 0.00 34.50 31.68 2pzh s PRO 99 CO 0.28 -0.94 -0.13 -0.59 -0.33 0.00 0.00 177.00 175.30 2pzh s PHE 100 N -1.23 1.14 0.24 6.54 -0.12 -0.96 -4.96 117.98 118.64 2pzh s PHE 100 Ca 0.64 -0.32 -0.30 0.00 -0.05 0.00 0.00 56.93 56.90 2pzh s PHE 100 Cb -0.43 -0.69 -0.09 0.00 -0.63 0.00 0.00 43.02 41.18 2pzh s PHE 100 CO 0.54 0.02 1.17 0.21 -0.05 0.00 0.00 175.22 177.11 2pzh s LYS 101 N -0.95 4.53 -0.06 1.99 2.20 -1.26 -0.69 119.74 125.51 2pzh s LYS 101 Ca 0.02 1.90 0.03 0.00 -0.36 0.00 0.00 55.97 57.56 2pzh s LYS 101 Cb -0.07 -3.20 -0.06 0.00 -1.51 0.00 0.00 37.83 32.99 2pzh s LYS 101 CO 0.01 0.02 -0.00 0.28 -0.36 0.00 0.00 175.35 175.29 2pzh n VAL 102 N 1.74 0.37 -3.60 4.02 0.31 0.53 -2.76 118.33 118.95 2pzh n VAL 102 Ca 0.02 -0.20 -0.11 0.00 -0.01 0.00 0.00 64.34 64.04 2pzh n VAL 102 Cb 0.44 -0.82 -0.06 0.00 -0.91 0.00 0.00 33.84 32.49 2pzh n VAL 102 CO 0.00 0.00 0.00 0.12 -1.32 0.00 0.00 176.83 175.63 2pzh s PHE 103 N -2.13 -0.43 -0.01 3.52 5.36 -1.17 -1.46 117.98 121.66 2pzh s PHE 103 Ca -0.04 0.87 -0.05 0.00 -0.96 0.00 0.00 56.93 56.75 2pzh s PHE 103 Cb 0.02 0.41 -0.00 0.00 -0.34 0.00 0.00 43.02 43.11 2pzh s PHE 103 CO 0.20 -0.32 0.09 0.00 -1.46 0.00 0.00 175.22 173.73 2pzh s ALA 104 N -0.62 -0.21 -0.03 11.12 0.00 -0.49 -0.49 121.76 131.04 2pzh s ALA 104 Ca -0.01 -0.11 -0.07 0.00 0.00 0.00 0.00 51.96 51.78 2pzh s ALA 104 Cb -0.02 0.04 0.01 0.00 0.00 0.00 0.00 23.12 23.15 2pzh s ALA 104 CO -0.01 -0.16 0.15 -1.54 0.00 0.00 0.00 175.76 174.21 2pzh s SER 105 N -1.01 -0.06 -0.17 0.00 1.04 0.08 -0.30 113.70 113.28 2pzh s SER 105 Ca -0.11 0.03 0.01 0.00 0.48 0.00 0.00 55.95 56.36 2pzh s SER 105 Cb -0.06 0.26 0.02 0.00 0.10 0.00 0.00 66.02 66.34 2pzh s SER 105 CO 0.01 -0.23 -0.19 -0.70 0.98 0.00 0.00 173.24 173.10 2pzh s GLU 106 N -0.72 3.03 -0.04 4.02 2.12 -0.06 -0.72 118.70 126.34 2pzh s GLU 106 Ca -0.08 -0.82 0.04 0.00 0.36 0.00 0.00 54.97 54.47 2pzh s GLU 106 Cb -0.05 -2.57 -0.00 0.00 0.26 0.00 0.00 34.13 31.77 2pzh s GLU 106 CO 0.01 -0.16 -0.15 0.42 -0.54 0.00 0.00 175.26 174.84 2pzh s ILE 107 N 1.18 1.22 -0.21 -3.70 -1.09 -0.14 -1.23 121.20 117.23 2pzh s ILE 107 Ca 0.02 -0.61 -0.08 0.00 -2.23 0.00 0.00 60.65 57.75 2pzh s ILE 107 Cb -0.14 -1.06 -0.04 0.00 -1.58 0.00 0.00 42.46 39.65 2pzh s ILE 107 CO -0.10 0.36 0.09 -0.75 -1.23 0.00 0.00 174.94 173.31 2pzh s LYS 108 N 0.05 3.91 -0.09 2.79 2.20 -0.84 -0.84 119.74 126.93 2pzh s LYS 108 Ca -0.03 -0.36 0.03 0.00 -0.36 0.00 0.00 55.97 55.25 2pzh s LYS 108 Cb -0.10 -3.32 -0.01 0.00 -1.51 0.00 0.00 37.83 32.89 2pzh s LYS 108 CO 0.01 0.10 -0.20 -0.06 -0.36 0.00 0.00 175.35 174.84 2pzh s PHE 109 N 0.86 2.61 0.40 4.03 0.08 0.32 -0.58 117.98 125.71 2pzh s PHE 109 Ca 0.05 -0.78 0.08 0.00 0.12 0.00 0.00 56.93 56.39 2pzh s PHE 109 Cb -0.13 -1.72 -0.00 0.00 -0.57 0.00 0.00 43.02 40.60 2pzh s PHE 109 CO 0.03 -0.26 0.49 0.20 -0.10 0.00 0.00 175.22 175.57 2pzh s GLY 110 N 0.14 1.94 -0.13 4.36 0.00 -0.15 -1.01 107.32 112.47 2pzh s GLY 110 Ca -0.11 -1.70 0.00 0.00 0.00 0.00 0.00 44.72 42.92 2pzh s GLY 110 CO 0.06 -1.54 -0.15 -0.12 0.00 0.00 0.00 173.10 171.36 2pzh s PHE 111 N -2.36 2.77 -0.03 1.90 5.36 -1.19 -0.41 117.98 124.03 2pzh s PHE 111 Ca 0.51 -0.79 0.07 0.00 -0.96 0.00 0.00 56.93 55.76 2pzh s PHE 111 Cb -0.08 -1.84 -0.02 0.00 -0.34 0.00 0.00 43.02 40.75 2pzh s PHE 111 CO 0.31 -0.31 -0.26 0.14 -1.46 0.00 0.00 175.22 173.65 2pzh s VAL 112 N 0.47 2.04 -0.15 3.12 -7.23 0.09 -1.14 120.40 117.60 2pzh s VAL 112 Ca -0.11 -1.09 -0.29 0.00 -1.81 0.00 0.00 61.98 58.69 2pzh s VAL 112 Cb -0.16 -1.70 -0.06 0.00 0.56 0.00 0.00 36.38 35.02 2pzh s VAL 112 CO 0.05 0.57 2.12 0.21 -0.31 0.00 0.00 175.10 177.74 2pzh s ASN 113 N -0.46 5.77 0.00 4.85 3.84 0.16 -2.39 114.94 126.71 2pzh s ASN 113 Ca 0.06 2.08 0.00 0.00 0.21 0.00 0.00 52.86 55.21 2pzh s ASN 113 Cb -0.11 -2.52 0.00 0.00 -0.55 0.00 0.00 41.25 38.07 2pzh s ASN 113 CO 0.01 -1.68 0.00 0.54 -2.79 0.00 0.00 177.10 173.18 2pzh n ARG 114 N 8.37 0.00 0.00 0.43 1.74 -0.90 0.19 116.66 126.49 2pzh n ARG 114 Ca 0.26 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.34 2pzh n ARG 114 Cb 0.44 -0.19 0.00 0.00 -1.02 0.00 0.00 32.46 31.69 2pzh n ARG 114 CO 0.00 0.00 0.00 0.43 -1.52 0.00 0.00 177.63 176.54 2pzh n SER 115 N 0.00 0.00 -0.18 0.55 7.64 -1.26 0.83 113.62 121.20 2pzh n SER 115 Ca 0.00 0.57 0.13 0.00 1.01 0.00 0.00 58.87 60.58 2pzh n SER 115 Cb 0.00 -0.27 0.45 0.00 -1.01 0.00 0.00 64.21 63.38 2pzh n SER 115 CO 0.00 0.00 0.00 0.71 -3.01 0.00 0.00 175.04 172.74 2pzh h THR 116 N 0.00 0.85 -0.27 0.44 1.35 -1.98 -3.45 112.91 109.85 2pzh h THR 116 Ca 0.00 -0.18 -0.08 0.00 -0.55 0.00 0.00 66.41 65.60 2pzh h THR 116 Cb 0.00 0.28 -0.03 0.00 -1.73 0.00 0.00 68.15 66.67 2pzh h THR 116 CO 0.00 0.10 -0.08 0.00 -0.25 0.00 0.00 175.52 175.29 2pzh n TYR 117 N -4.50 -0.04 -3.01 4.73 9.36 0.24 -5.01 117.16 118.93 2pzh n TYR 117 Ca 0.14 0.00 -0.40 0.00 3.32 0.00 0.00 57.90 60.96 2pzh n TYR 117 Cb 0.44 -1.17 -0.05 0.00 -0.63 0.00 0.00 39.34 37.93 2pzh n TYR 117 CO 0.00 0.00 0.00 0.45 0.22 0.00 0.00 176.86 177.53 2pzh s SER 118 N -2.93 7.19 0.01 2.98 0.15 -1.12 -4.75 113.70 115.23 2pzh s SER 118 Ca 0.00 1.42 -0.30 0.00 0.70 0.00 0.00 55.95 57.77 2pzh s SER 118 Cb 0.00 -2.46 -0.05 0.00 -1.71 0.00 0.00 66.02 61.80 2pzh s SER 118 CO 0.00 0.04 1.32 -2.16 1.20 0.00 0.00 173.24 173.64 2pzh s PRO 119 N -0.16 4.33 0.25 5.44 0.04 -1.26 0.37 135.00 144.02 2pzh s PRO 119 Ca 0.37 1.88 0.04 0.00 0.04 0.00 0.00 61.00 63.33 2pzh s PRO 119 Cb -0.20 -3.49 -0.05 0.00 0.04 0.00 0.00 34.50 30.79 2pzh s PRO 119 CO 0.22 -0.47 0.01 0.96 0.04 0.00 0.00 177.00 177.76 2pzh s ILE 120 N 1.95 1.08 0.49 0.56 -4.36 -0.29 -4.88 121.20 115.74 2pzh s ILE 120 Ca 0.61 -2.03 -0.22 0.00 -0.26 0.00 0.00 60.65 58.74 2pzh s ILE 120 Cb -0.30 -2.46 -0.08 0.00 1.25 0.00 0.00 42.46 40.87 2pzh s ILE 120 CO 0.26 -0.24 1.08 0.00 0.24 0.00 0.00 174.94 176.28 2pzh n ALA 121 N -0.49 0.53 -1.85 2.27 0.00 -1.26 -4.28 120.51 115.44 2pzh n ALA 121 Ca -0.04 0.16 -0.42 0.00 0.00 0.00 0.00 53.44 53.14 2pzh n ALA 121 Cb 0.64 -2.15 -0.02 0.00 0.00 0.00 0.00 19.45 17.92 2pzh n ALA 121 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 2pzh s ILE 122 N -1.34 2.44 0.74 0.00 1.01 0.25 -4.94 121.20 119.38 2pzh s ILE 122 Ca 0.67 0.36 -0.14 0.00 0.00 0.00 0.00 60.65 61.54 2pzh s ILE 122 Cb -0.49 -3.23 0.05 0.00 0.01 0.00 0.00 42.46 38.80 2pzh s ILE 122 CO 0.54 0.05 1.17 -2.84 0.00 0.00 0.00 174.94 173.86 2pzh s PRO 123 N 0.02 2.11 0.21 2.79 0.02 -1.26 -4.74 135.00 134.16 2pzh s PRO 123 Ca 0.64 1.62 -0.09 0.00 0.02 0.00 0.00 61.00 63.19 2pzh s PRO 123 Cb -0.44 -1.84 0.26 0.00 0.02 0.00 0.00 34.50 32.49 2pzh s PRO 123 CO 0.41 -1.83 1.79 0.87 -0.33 0.00 0.00 177.00 177.92 2pzh h LYS 124 N -0.51 0.61 -0.13 5.54 1.57 -1.98 0.45 116.57 122.12 2pzh h LYS 124 Ca -0.47 -0.04 0.00 0.00 -1.87 0.00 0.00 60.65 58.28 2pzh h LYS 124 Cb 1.28 -0.14 -0.01 0.00 0.08 0.00 0.00 32.23 33.44 2pzh h LYS 124 CO 0.49 0.41 0.09 1.25 -0.57 0.00 0.00 179.45 181.12 2pzh h LEU 125 N 0.63 0.15 -0.36 2.94 6.46 -2.00 -0.28 115.31 122.87 2pzh h LEU 125 Ca 0.31 -0.01 -0.18 0.00 -0.12 0.00 0.00 57.88 57.88 2pzh h LEU 125 Cb 0.24 -0.04 -0.00 0.00 -0.73 0.00 0.00 40.66 40.13 2pzh h LEU 125 CO -0.21 0.11 -0.54 -0.26 -0.62 0.00 0.00 178.44 176.92 2pzh h PHE 126 N 0.18 1.01 0.08 1.25 0.04 -1.86 -2.32 116.94 115.31 2pzh h PHE 126 Ca 0.05 -0.36 0.02 0.00 2.80 0.00 0.00 57.97 60.49 2pzh h PHE 126 Cb -0.02 -0.19 -0.04 0.00 2.20 0.00 0.00 35.95 37.90 2pzh h PHE 126 CO -0.07 1.16 -0.27 -0.22 -0.60 0.00 0.00 178.31 178.31 2pzh h LYS 127 N 0.62 -0.45 -0.87 1.51 1.63 -0.79 0.66 116.57 118.88 2pzh h LYS 127 Ca 0.02 0.03 0.00 0.00 -0.85 0.00 0.00 60.65 59.85 2pzh h LYS 127 Cb 1.13 0.10 -0.04 0.00 -0.60 0.00 0.00 32.23 32.82 2pzh h LYS 127 CO 0.12 -0.30 0.56 0.93 -3.45 0.00 0.00 179.45 177.31 2pzh h GLU 128 N -0.46 1.16 0.22 1.90 5.08 -1.03 -1.21 114.58 120.24 2pzh h GLU 128 Ca 0.04 -0.08 -0.01 0.00 -1.00 0.00 0.00 59.36 58.31 2pzh h GLU 128 Cb 0.51 -0.26 0.00 0.00 0.50 0.00 0.00 28.75 29.51 2pzh h GLU 128 CO -0.19 0.78 -0.11 -0.07 -1.00 0.00 0.00 179.01 178.43 2pzh h LEU 129 N 1.19 -0.26 -2.09 1.33 3.38 -1.11 -3.14 115.31 114.61 2pzh h LEU 129 Ca 0.32 -0.14 0.03 0.00 0.09 0.00 0.00 57.88 58.18 2pzh h LEU 129 Cb -0.11 0.07 -0.00 0.00 0.09 0.00 0.00 40.66 40.70 2pzh h LEU 129 CO -0.07 -0.00 0.09 0.25 0.09 0.00 0.00 178.44 178.80 2pzh h LEU 130 N -0.51 0.00 -1.85 1.67 7.12 0.64 0.23 115.31 122.60 2pzh h LEU 130 Ca -0.03 0.00 -0.03 0.00 0.13 0.00 0.00 57.88 57.95 2pzh h LEU 130 Cb 0.38 0.00 -0.00 0.00 -0.53 0.00 0.00 40.66 40.51 2pzh h LEU 130 CO 0.05 0.00 -0.14 0.78 -0.13 0.00 0.00 178.44 179.01 2pzh h ASN 131 N 0.00 0.00 -0.03 1.25 -0.26 -1.17 -3.47 115.58 111.90 2pzh h ASN 131 Ca 0.05 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 55.79 2pzh h ASN 131 Cb 0.23 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 37.49 2pzh h ASN 131 CO -0.00 0.14 0.00 0.00 -1.06 0.00 0.00 177.43 176.51