#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2x52 n GLY 4 N -1.40 2.19 0.26 0.00 0.00 0.61 -2.74 105.19 104.11 2x52 n GLY 4 Ca -0.07 -0.47 0.17 0.00 0.00 0.00 0.00 46.02 45.65 2x52 n GLY 4 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 173.32 174.37 2x52 h GLU 5 N 0.00 0.00 0.00 1.61 4.11 -1.93 0.17 114.58 118.53 2x52 h GLU 5 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.43 2x52 h GLU 5 Cb 0.00 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.25 2x52 h GLU 5 CO 0.00 0.00 -0.19 1.04 0.07 0.00 0.00 179.01 179.93 2x52 n GLN 6 N -2.98 0.04 -2.74 1.06 3.00 -1.16 -4.32 117.38 110.28 2x52 n GLN 6 Ca 0.01 0.02 -0.11 0.00 -0.01 0.00 0.00 57.00 56.90 2x52 n GLN 6 Cb 0.28 -1.53 0.02 0.00 0.00 0.00 0.00 30.24 29.01 2x52 n GLN 6 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 2x52 n GLY 7 N 1.48 2.08 3.97 1.08 0.00 -0.38 -4.66 105.19 108.75 2x52 n GLY 7 Ca 0.06 -1.43 -0.29 0.00 0.00 0.00 0.00 46.02 44.36 2x52 n GLY 7 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2x52 n SER 8 N -0.03 -2.73 -1.00 1.61 7.64 -1.15 -0.70 113.62 117.25 2x52 n SER 8 Ca 0.13 -0.90 -0.13 0.00 1.01 0.00 0.00 58.87 58.98 2x52 n SER 8 Cb 0.78 -3.42 -0.06 0.00 -1.01 0.00 0.00 64.21 60.50 2x52 n SER 8 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2x52 n GLY 9 N -1.67 1.38 3.74 0.23 0.00 0.45 -4.96 105.19 104.35 2x52 n GLY 9 Ca -0.09 -0.37 -0.37 0.00 0.00 0.00 0.00 46.02 45.19 2x52 n GLY 9 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 2x52 s MET 10 N -3.08 2.84 0.09 1.61 0.00 0.12 -4.57 119.30 116.31 2x52 s MET 10 Ca 0.00 2.01 0.10 0.00 0.00 0.00 0.00 55.69 57.80 2x52 s MET 10 Cb 0.00 -1.97 -0.04 0.00 0.00 0.00 0.00 34.83 32.83 2x52 s MET 10 CO 0.00 -1.36 -0.25 -1.21 0.00 0.00 0.00 175.02 172.19 2x52 s GLU 11 N -3.25 1.63 0.51 4.11 2.02 -1.26 -0.28 118.70 122.17 2x52 s GLU 11 Ca 0.78 -1.22 -0.18 0.00 0.02 0.00 0.00 54.97 54.38 2x52 s GLU 11 Cb -0.35 -1.97 -0.08 0.00 0.10 0.00 0.00 34.13 31.83 2x52 s GLU 11 CO 0.39 0.48 0.99 0.00 0.02 0.00 0.00 175.26 177.14 2x52 s PRO 13 N -3.83 3.00 -1.59 0.00 0.04 -1.26 -4.19 135.00 127.17 2x52 s PRO 13 Ca 0.61 1.12 -0.13 0.00 0.04 0.00 0.00 61.00 62.64 2x52 s PRO 13 Cb -0.11 -1.99 0.10 0.00 0.04 0.00 0.00 34.50 32.54 2x52 s PRO 13 CO 0.27 -1.06 0.75 0.09 0.04 0.00 0.00 177.00 177.10 2x52 n ASN 14 N -2.68 -2.96 -0.37 6.66 3.02 -1.26 -1.69 115.26 115.99 2x52 n ASN 14 Ca 0.08 -0.95 -0.05 0.00 -0.03 0.00 0.00 54.58 53.64 2x52 n ASN 14 Cb 0.53 -3.14 -0.02 0.00 -0.61 0.00 0.00 39.78 36.54 2x52 n ASN 14 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 2x52 n ASN 15 N -2.78 -5.86 -4.62 6.41 3.02 -1.26 -4.95 115.26 105.22 2x52 n ASN 15 Ca -0.03 0.12 -0.40 0.00 -0.03 0.00 0.00 54.58 54.24 2x52 n ASN 15 Cb 0.55 -3.78 0.03 0.00 -0.61 0.00 0.00 39.78 35.96 2x52 n ASN 15 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 2x52 n LEU 16 N -0.55 3.11 -4.77 3.41 4.32 -0.68 -1.41 117.00 120.43 2x52 n LEU 16 Ca -0.05 0.97 -0.39 0.00 -0.02 0.00 0.00 56.01 56.51 2x52 n LEU 16 Cb 0.54 -1.38 -0.06 0.00 -1.62 0.00 0.00 43.42 40.90 2x52 n LEU 16 CO 0.07 -1.52 0.42 0.00 -1.22 0.00 0.00 177.39 175.14 2x52 s SER 19 N 1.86 2.28 0.66 0.00 1.04 -0.15 0.14 113.70 119.53 2x52 s SER 19 Ca 0.26 1.48 0.34 0.00 0.48 0.00 0.00 55.95 58.51 2x52 s SER 19 Cb -0.14 -2.17 1.85 0.00 0.10 0.00 0.00 66.02 65.66 2x52 s SER 19 CO 0.16 -3.39 2.06 0.06 0.98 0.00 0.00 173.24 173.12 2x52 h GLN 20 N -2.06 0.00 -0.29 4.02 3.07 -1.77 -0.35 115.11 117.73 2x52 h GLN 20 Ca -0.55 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.19 2x52 h GLN 20 Cb 1.31 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.87 2x52 h GLN 20 CO 0.53 0.00 0.00 0.66 0.09 0.00 0.00 178.83 180.11 2x52 n TYR 21 N -3.06 0.36 -2.58 0.06 4.01 -1.26 -4.98 117.16 109.72 2x52 n TYR 21 Ca -0.02 -0.18 -0.05 0.00 -0.16 0.00 0.00 57.90 57.49 2x52 n TYR 21 Cb 0.30 0.00 0.02 0.00 -0.31 0.00 0.00 39.34 39.35 2x52 n TYR 21 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2x52 n GLY 22 N 1.42 0.41 3.19 2.72 0.00 -0.14 -4.95 105.19 107.83 2x52 n GLY 22 Ca 0.18 -0.39 -0.15 0.00 0.00 0.00 0.00 46.02 45.66 2x52 n GLY 22 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2x52 s TYR 23 N -3.09 1.14 -0.13 1.61 2.02 -1.26 -2.11 117.35 115.53 2x52 s TYR 23 Ca 0.08 -0.61 -0.16 0.00 -0.37 0.00 0.00 57.07 56.01 2x52 s TYR 23 Cb -0.03 -0.62 -0.04 0.00 -0.40 0.00 0.00 41.96 40.86 2x52 s TYR 23 CO 0.19 0.03 0.38 0.00 -1.57 0.00 0.00 175.55 174.58 2x52 n GLY 25 N 3.22 1.91 3.04 0.00 0.00 -0.34 -4.96 105.19 108.05 2x52 n GLY 25 Ca -0.10 -0.72 -0.08 0.00 0.00 0.00 0.00 46.02 45.12 2x52 n GLY 25 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 2x52 s MET 26 N 0.60 0.48 0.00 1.61 1.75 -1.26 -0.41 119.30 122.07 2x52 s MET 26 Ca 0.00 -0.89 0.00 0.00 -1.25 0.00 0.00 55.69 53.55 2x52 s MET 26 Cb 0.00 0.17 0.00 0.00 2.84 0.00 0.00 34.83 37.84 2x52 s MET 26 CO 0.00 -0.09 0.00 0.41 -0.65 0.00 0.00 175.02 174.69 2x52 n GLY 27 N 0.85 0.13 0.29 2.11 0.00 -1.26 -4.62 105.19 102.68 2x52 n GLY 27 Ca -0.19 -1.91 0.06 0.00 0.00 0.00 0.00 46.02 43.98 2x52 n GLY 27 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 2x52 h GLY 28 N 0.00 1.25 2.00 -0.02 0.00 -1.98 0.38 103.07 104.70 2x52 h GLY 28 Ca 0.00 -0.19 0.00 0.00 0.00 0.00 0.00 47.33 47.14 2x52 h GLY 28 CO 0.00 -0.08 0.00 -0.55 0.00 0.00 0.00 176.54 175.91 2x52 h ASP 29 N 0.51 0.00 0.00 0.19 3.32 -1.94 -0.11 116.42 118.39 2x52 h ASP 29 Ca 0.44 0.00 -0.07 0.00 0.02 0.00 0.00 57.03 57.42 2x52 h ASP 29 Cb 0.66 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.20 2x52 h ASP 29 CO -0.39 0.00 -1.15 -1.22 -1.72 0.00 0.00 179.24 174.75 2x52 n TYR 30 N -2.74 0.00 0.51 4.55 4.02 -0.34 -4.56 117.16 118.60 2x52 n TYR 30 Ca -0.02 0.00 0.12 0.00 -0.01 0.00 0.00 57.90 58.00 2x52 n TYR 30 Cb 0.10 -0.17 0.26 0.00 -0.02 0.00 0.00 39.34 39.51 2x52 n TYR 30 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 2x52 n GLY 32 N 1.28 1.00 3.61 0.00 0.00 -0.05 -0.60 105.19 110.43 2x52 n GLY 32 Ca 0.04 -1.46 -0.49 0.00 0.00 0.00 0.00 46.02 44.12 2x52 n GLY 32 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 2x52 n LYS 33 N 0.00 1.49 0.00 1.61 4.81 -1.26 -1.82 118.16 122.99 2x52 n LYS 33 Ca 0.00 0.53 0.00 0.00 -0.87 0.00 0.00 58.31 57.97 2x52 n LYS 33 Cb 0.00 -2.16 0.00 0.00 0.02 0.00 0.00 35.03 32.89 2x52 n LYS 33 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2x52 n GLY 34 N 2.46 1.69 3.55 3.14 0.00 -1.26 -4.62 105.19 110.15 2x52 n GLY 34 Ca 0.16 0.00 -0.56 0.00 0.00 0.00 0.00 46.02 45.62 2x52 n GLY 34 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2x52 n GLN 36 N 2.12 0.69 -2.96 0.00 6.02 0.12 -4.90 117.38 118.47 2x52 n GLN 36 Ca 0.19 0.17 -0.05 0.00 -0.01 0.00 0.00 57.00 57.31 2x52 n GLN 36 Cb 0.13 -1.61 0.02 0.00 1.02 0.00 0.00 30.24 29.80 2x52 n GLN 36 CO 0.00 0.00 0.00 0.27 -1.01 0.00 0.00 177.06 176.32 2x52 n ASN 37 N -3.21 -1.51 0.00 1.08 0.23 -1.25 -4.99 115.26 105.60 2x52 n ASN 37 Ca -0.36 -2.00 0.00 0.00 -0.53 0.00 0.00 54.58 51.69 2x52 n ASN 37 Cb 1.04 2.51 0.00 0.00 -2.08 0.00 0.00 39.78 41.25 2x52 n ASN 37 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 2x52 n GLY 38 N -0.40 -0.51 2.34 4.83 0.00 -1.26 -1.55 105.19 108.64 2x52 n GLY 38 Ca -0.05 -1.31 -0.31 0.00 0.00 0.00 0.00 46.02 44.35 2x52 n GLY 38 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2x52 n ALA 39 N 3.53 6.88 -1.68 4.61 0.00 -0.50 -4.95 120.51 128.41 2x52 n ALA 39 Ca 0.00 -3.26 -0.45 0.00 0.00 0.00 0.00 53.44 49.74 2x52 n ALA 39 Cb 0.00 -2.73 -0.03 0.00 0.00 0.00 0.00 19.45 16.70 2x52 n ALA 39 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2x52 h TRP 41 N 4.43 0.70 -3.22 0.00 6.55 -1.15 -3.29 115.95 119.97 2x52 h TRP 41 Ca -0.45 0.02 -0.74 0.00 0.95 0.00 0.00 58.89 58.66 2x52 h TRP 41 Cb 1.27 -0.24 -0.23 0.00 -0.86 0.00 0.00 29.16 29.11 2x52 h TRP 41 CO 0.57 0.42 -0.25 0.99 -1.05 0.00 0.00 178.44 179.12 2x52 s THR 42 N -5.64 5.19 0.35 1.49 2.01 -1.26 -5.05 115.64 112.72 2x52 s THR 42 Ca -0.09 -1.16 -0.28 0.00 0.31 0.00 0.00 61.69 60.46 2x52 s THR 42 Cb 0.18 -4.22 -0.12 0.00 0.01 0.00 0.00 72.50 68.35 2x52 s THR 42 CO 0.76 -0.71 1.42 -1.20 -0.69 0.00 0.00 174.62 174.20 2x52 n SER 43 N 5.32 3.37 -4.68 3.53 7.64 -1.24 -4.96 113.62 122.60 2x52 n SER 43 Ca -0.12 1.21 -0.31 0.00 1.01 0.00 0.00 58.87 60.66 2x52 n SER 43 Cb 0.43 -1.56 0.15 0.00 -1.01 0.00 0.00 64.21 62.22 2x52 n SER 43 CO 0.00 0.00 0.00 -0.54 -3.01 0.00 0.00 175.04 171.49 2x52 s LYS 44 N -1.81 1.14 0.11 1.43 -0.14 -1.26 -4.74 119.74 114.47 2x52 s LYS 44 Ca 0.56 1.33 -0.00 0.00 -1.36 0.00 0.00 55.97 56.49 2x52 s LYS 44 Cb -0.52 -1.76 -0.04 0.00 -1.68 0.00 0.00 37.83 33.83 2x52 s LYS 44 CO 0.61 -2.47 0.28 1.03 -0.76 0.00 0.00 175.35 174.04 2x52 s ARG 45 N -4.72 3.47 0.34 1.68 1.81 -1.26 -1.79 118.95 118.49 2x52 s ARG 45 Ca 0.65 -0.42 -0.06 0.00 -1.72 0.00 0.00 55.73 54.18 2x52 s ARG 45 Cb -0.21 -2.97 0.02 0.00 -0.45 0.00 0.00 34.95 31.34 2x52 s ARG 45 CO 0.58 0.54 0.56 0.00 -0.68 0.00 0.00 175.30 176.30 2x52 n GLY 47 N -0.53 0.81 0.37 0.00 0.00 -0.12 -3.04 105.19 102.69 2x52 n GLY 47 Ca -0.03 -0.82 0.13 0.00 0.00 0.00 0.00 46.02 45.30 2x52 n GLY 47 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 2x52 h SER 48 N 1.83 0.69 0.21 1.61 4.64 -1.92 0.22 113.55 120.83 2x52 h SER 48 Ca 0.00 0.06 0.00 0.00 -0.47 0.00 0.00 61.79 61.38 2x52 h SER 48 Cb 0.00 -0.08 0.00 0.00 -0.31 0.00 0.00 62.40 62.01 2x52 h SER 48 CO 0.00 0.32 0.00 1.56 -0.87 0.00 0.00 176.83 177.84 2x52 h GLN 49 N 0.72 0.00 -0.69 4.77 7.50 -1.89 -3.21 115.11 122.30 2x52 h GLN 49 Ca 0.49 0.00 -0.33 0.00 0.50 0.00 0.00 58.65 59.32 2x52 h GLN 49 Cb 0.80 0.00 -0.40 0.00 0.05 0.00 0.00 27.48 27.92 2x52 h GLN 49 CO -0.25 0.00 -1.09 0.00 -1.50 0.00 0.00 178.83 175.99 2x52 n ALA 50 N -1.98 3.22 -1.34 3.87 0.00 0.14 -4.92 120.51 119.49 2x52 n ALA 50 Ca -0.02 -3.06 -0.12 0.00 0.00 0.00 0.00 53.44 50.25 2x52 n ALA 50 Cb 0.11 -0.82 -0.05 0.00 0.00 0.00 0.00 19.45 18.69 2x52 n ALA 50 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2x52 n GLY 51 N -0.44 1.27 1.50 0.00 0.00 -1.11 -2.50 105.19 103.91 2x52 n GLY 51 Ca 0.13 -0.33 0.00 0.00 0.00 0.00 0.00 46.02 45.82 2x52 n GLY 51 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2x52 n GLY 52 N -1.18 0.60 3.77 -0.02 0.00 0.53 -4.98 105.19 103.92 2x52 n GLY 52 Ca -0.12 -0.20 -0.41 0.00 0.00 0.00 0.00 46.02 45.29 2x52 n GLY 52 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2x52 s LYS 53 N -0.56 4.22 0.19 1.61 2.20 -1.04 -4.59 119.74 121.76 2x52 s LYS 53 Ca 0.00 2.41 -0.03 0.00 -0.36 0.00 0.00 55.97 57.99 2x52 s LYS 53 Cb 0.00 -3.01 -0.05 0.00 -1.51 0.00 0.00 37.83 33.26 2x52 s LYS 53 CO 0.00 -0.38 0.40 0.95 -0.36 0.00 0.00 175.35 175.96 2x52 s THR 54 N -1.11 5.16 0.19 3.43 -4.23 -1.26 -0.94 115.64 116.88 2x52 s THR 54 Ca 0.51 -0.13 -0.30 0.00 -1.18 0.00 0.00 61.69 60.59 2x52 s THR 54 Cb -0.44 -3.68 -0.08 0.00 1.34 0.00 0.00 72.50 69.64 2x52 s THR 54 CO 0.58 -0.10 1.19 0.00 -0.54 0.00 0.00 174.62 175.76 2x52 s PRO 56 N -0.35 1.30 -0.90 0.00 0.04 -1.26 -4.00 135.00 129.84 2x52 s PRO 56 Ca 0.52 0.62 0.00 0.00 0.04 0.00 0.00 61.00 62.18 2x52 s PRO 56 Cb -0.33 -1.83 0.00 0.00 0.04 0.00 0.00 34.50 32.38 2x52 s PRO 56 CO 0.37 -2.16 0.00 0.09 0.04 0.00 0.00 177.00 175.34 2x52 n ASN 57 N -3.80 -4.97 -3.09 6.66 4.13 -1.26 -2.65 115.26 110.27 2x52 n ASN 57 Ca 0.07 0.21 -0.22 0.00 1.68 0.00 0.00 54.58 56.31 2x52 n ASN 57 Cb 0.57 -3.22 0.03 0.00 -1.54 0.00 0.00 39.78 35.61 2x52 n ASN 57 CO 0.00 0.00 0.00 0.59 0.28 0.00 0.00 177.26 178.13 2x52 n ASN 58 N -0.57 -5.54 -4.82 6.41 3.02 -1.26 -4.99 115.26 107.51 2x52 n ASN 58 Ca -0.08 -0.30 -0.31 0.00 -0.03 0.00 0.00 54.58 53.85 2x52 n ASN 58 Cb 0.44 -4.50 0.04 0.00 -0.61 0.00 0.00 39.78 35.15 2x52 n ASN 58 CO 0.00 0.00 0.00 -1.00 -2.62 0.00 0.00 177.26 173.64 2x52 s HIS 59 N -3.12 3.17 0.13 3.10 3.76 -1.09 -4.29 115.29 116.96 2x52 s HIS 59 Ca 0.32 1.41 -0.27 0.00 -0.15 0.00 0.00 55.06 56.37 2x52 s HIS 59 Cb -0.15 -2.87 -0.07 0.00 1.11 0.00 0.00 32.58 30.60 2x52 s HIS 59 CO 0.40 -1.15 0.86 0.00 -0.85 0.00 0.00 174.74 173.99 2x52 s SER 62 N 2.45 1.56 0.63 0.00 1.04 -0.80 0.11 113.70 118.69 2x52 s SER 62 Ca 0.23 1.58 0.36 0.00 0.48 0.00 0.00 55.95 58.60 2x52 s SER 62 Cb -0.15 -2.29 2.03 0.00 0.10 0.00 0.00 66.02 65.72 2x52 s SER 62 CO 0.17 -3.85 2.24 0.06 0.98 0.00 0.00 173.24 172.84 2x52 h GLN 63 N -2.38 0.00 -0.02 4.02 3.07 -1.76 -1.15 115.11 116.88 2x52 h GLN 63 Ca -0.57 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.17 2x52 h GLN 63 Cb 1.32 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.88 2x52 h GLN 63 CO 0.50 0.00 -0.14 0.66 0.09 0.00 0.00 178.83 179.94 2x52 n TYR 64 N -3.39 0.00 -2.07 0.06 4.01 -1.26 -4.97 117.16 109.53 2x52 n TYR 64 Ca -0.02 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.72 2x52 n TYR 64 Cb 0.16 -0.02 0.00 0.00 -0.31 0.00 0.00 39.34 39.18 2x52 n TYR 64 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2x52 n GLY 65 N 1.32 0.73 3.35 2.72 0.00 -0.43 -4.87 105.19 108.01 2x52 n GLY 65 Ca 0.14 -0.73 -0.30 0.00 0.00 0.00 0.00 46.02 45.13 2x52 n GLY 65 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2x52 s HIS 66 N -2.45 2.35 -0.01 1.61 3.76 -1.26 -0.94 115.29 118.34 2x52 s HIS 66 Ca 0.00 -0.40 -0.22 0.00 -0.15 0.00 0.00 55.06 54.29 2x52 s HIS 66 Cb 0.00 -1.42 -0.05 0.00 1.11 0.00 0.00 32.58 32.23 2x52 s HIS 66 CO 0.00 0.12 0.65 0.00 -0.85 0.00 0.00 174.74 174.66 2x52 n GLY 68 N 2.64 -0.70 3.19 0.00 0.00 -0.55 -4.62 105.19 105.15 2x52 n GLY 68 Ca -0.05 -0.65 -0.11 0.00 0.00 0.00 0.00 46.02 45.21 2x52 n GLY 68 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2x52 s PHE 69 N -3.00 1.00 0.00 1.61 0.08 -1.26 -0.61 117.98 115.80 2x52 s PHE 69 Ca 0.00 -1.02 0.00 0.00 0.12 0.00 0.00 56.93 56.03 2x52 s PHE 69 Cb 0.00 -0.58 0.00 0.00 -0.57 0.00 0.00 43.02 41.87 2x52 s PHE 69 CO 0.00 -0.25 0.00 0.41 -0.10 0.00 0.00 175.22 175.28 2x52 n GLY 70 N -0.13 1.78 0.36 4.36 0.00 -1.26 -4.57 105.19 105.74 2x52 n GLY 70 Ca -0.09 -2.06 0.10 0.00 0.00 0.00 0.00 46.02 43.98 2x52 n GLY 70 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2x52 h ALA 71 N 0.00 1.66 0.00 4.61 0.00 -2.00 0.12 119.26 123.65 2x52 h ALA 71 Ca 0.00 0.04 -0.01 0.00 0.00 0.00 0.00 54.91 54.94 2x52 h ALA 71 Cb 0.00 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 17.64 2x52 h ALA 71 CO 0.00 0.05 -0.03 0.93 0.00 0.00 0.00 179.25 180.21 2x52 h GLU 72 N 0.84 0.00 0.00 0.00 3.07 -1.96 -0.03 114.58 116.50 2x52 h GLU 72 Ca 0.51 0.00 -0.33 0.00 -0.50 0.00 0.00 59.36 59.04 2x52 h GLU 72 Cb 0.69 0.00 -0.05 0.00 -0.84 0.00 0.00 28.75 28.55 2x52 h GLU 72 CO -0.29 0.03 -2.17 0.66 -1.40 0.00 0.00 179.01 175.84 2x52 n TYR 73 N -4.09 0.00 0.33 4.33 4.01 -0.48 -4.57 117.16 116.68 2x52 n TYR 73 Ca -0.03 0.00 0.12 0.00 -0.16 0.00 0.00 57.90 57.83 2x52 n TYR 73 Cb 0.11 -0.77 0.04 0.00 -0.31 0.00 0.00 39.34 38.42 2x52 n TYR 73 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 2x52 n GLY 75 N 1.27 0.32 3.65 0.00 0.00 -0.02 -0.57 105.19 109.83 2x52 n GLY 75 Ca 0.01 -1.17 -0.50 0.00 0.00 0.00 0.00 46.02 44.37 2x52 n GLY 75 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2x52 n ALA 76 N -3.00 0.32 -0.59 4.61 0.00 -1.26 -1.71 120.51 118.88 2x52 n ALA 76 Ca 0.00 0.44 0.00 0.00 0.00 0.00 0.00 53.44 53.88 2x52 n ALA 76 Cb 0.00 -2.26 0.00 0.00 0.00 0.00 0.00 19.45 17.19 2x52 n ALA 76 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2x52 n GLY 77 N 3.33 1.22 3.62 0.00 0.00 -1.26 -4.47 105.19 107.63 2x52 n GLY 77 Ca 0.19 0.00 -0.51 0.00 0.00 0.00 0.00 46.02 45.70 2x52 n GLY 77 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2x52 n GLN 79 N 3.16 0.51 -3.63 0.00 6.02 0.31 -4.91 117.38 118.84 2x52 n GLN 79 Ca 0.19 -0.04 0.01 0.00 -0.01 0.00 0.00 57.00 57.16 2x52 n GLN 79 Cb 0.21 -1.44 -0.01 0.00 1.02 0.00 0.00 30.24 30.02 2x52 n GLN 79 CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 177.06 176.25 2x52 s GLY 80 N -3.16 -0.41 0.00 1.08 0.00 -1.23 -4.92 107.32 98.69 2x52 s GLY 80 Ca 0.04 0.68 0.00 0.00 0.00 0.00 0.00 44.72 45.44 2x52 s GLY 80 CO 0.82 0.12 0.00 0.61 0.00 0.00 0.00 173.10 174.65 2x52 n GLY 81 N -0.48 -1.17 2.82 0.20 0.00 -1.26 -0.73 105.19 104.57 2x52 n GLY 81 Ca -0.08 -1.24 -0.36 0.00 0.00 0.00 0.00 46.02 44.34 2x52 n GLY 81 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2x52 n PRO 82 N -0.09 2.05 -1.77 1.61 -0.04 -1.26 -4.93 135.00 130.57 2x52 n PRO 82 Ca 0.00 -1.84 -0.38 0.00 -0.04 0.00 0.00 63.50 61.24 2x52 n PRO 82 Cb 0.00 -2.80 0.05 0.00 -0.04 0.00 0.00 33.50 30.71 2x52 n PRO 82 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2x52 h ARG 84 N 1.21 0.08 -6.87 0.00 3.08 -1.12 -3.44 114.38 107.32 2x52 h ARG 84 Ca -0.51 -0.03 -0.49 0.00 0.07 0.00 0.00 59.98 59.01 2x52 h ARG 84 Cb 1.31 -0.00 0.01 0.00 0.08 0.00 0.00 29.97 31.37 2x52 h ARG 84 CO 0.56 0.46 0.44 0.00 -1.07 0.00 0.00 179.97 180.36 2x52 s ALA 85 N -4.17 3.26 0.53 0.04 0.00 -1.26 -5.01 121.76 115.15 2x52 s ALA 85 Ca -0.03 0.79 -0.22 0.00 0.00 0.00 0.00 51.96 52.49 2x52 s ALA 85 Cb 0.14 -3.29 -0.05 0.00 0.00 0.00 0.00 23.12 19.91 2x52 s ALA 85 CO 0.74 -0.15 1.38 -0.25 0.00 0.00 0.00 175.76 177.48 2x52 n ASP 86 N 0.65 2.84 -4.19 0.00 8.00 -1.26 -5.00 116.55 117.59 2x52 n ASP 86 Ca 0.02 1.00 -0.34 0.00 0.71 0.00 0.00 54.79 56.18 2x52 n ASP 86 Cb 0.47 -1.59 -0.15 0.00 -0.02 0.00 0.00 41.12 39.83 2x52 n ASP 86 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 2x52 s ILE 87 N -1.27 2.70 0.40 0.53 1.09 -1.26 -5.05 121.20 118.34 2x52 s ILE 87 Ca 0.70 -0.99 -0.17 0.00 -1.10 0.00 0.00 60.65 59.09 2x52 s ILE 87 Cb -0.42 -2.32 -0.09 0.00 -1.06 0.00 0.00 42.46 38.57 2x52 s ILE 87 CO 0.50 0.29 0.86 -0.54 -0.10 0.00 0.00 174.94 175.95 2x52 s LYS 88 N 1.32 4.07 0.25 2.79 1.02 -1.26 -0.49 119.74 127.44 2x52 s LYS 88 Ca 0.01 0.88 -0.21 0.00 0.02 0.00 0.00 55.97 56.67 2x52 s LYS 88 Cb -0.16 -2.28 0.05 0.00 -0.52 0.00 0.00 37.83 34.92 2x52 s LYS 88 CO -0.06 0.00 0.87 0.00 -0.92 0.00 0.00 175.35 175.23 2x52 n GLY 90 N -0.53 -0.38 0.29 0.00 0.00 0.64 -3.60 105.19 101.62 2x52 n GLY 90 Ca -0.06 -1.08 0.06 0.00 0.00 0.00 0.00 46.02 44.95 2x52 n GLY 90 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 2x52 h SER 91 N 1.11 0.24 0.34 1.61 4.64 -1.90 0.58 113.55 120.17 2x52 h SER 91 Ca 0.00 -0.01 -0.01 0.00 -0.47 0.00 0.00 61.79 61.30 2x52 h SER 91 Cb 0.00 -0.06 -0.00 0.00 -0.31 0.00 0.00 62.40 62.03 2x52 h SER 91 CO 0.00 0.17 -0.07 1.56 -0.87 0.00 0.00 176.83 177.62 2x52 h GLN 92 N 0.28 0.00 -1.33 4.77 7.50 -1.91 -3.24 115.11 121.18 2x52 h GLN 92 Ca 0.08 0.00 -0.46 0.00 0.50 0.00 0.00 58.65 58.77 2x52 h GLN 92 Cb -0.00 0.00 -0.41 0.00 0.05 0.00 0.00 27.48 27.12 2x52 h GLN 92 CO -0.02 0.07 -1.00 0.00 -1.50 0.00 0.00 178.83 176.38 2x52 n ALA 93 N -2.22 3.99 -2.13 3.87 0.00 0.00 -4.97 120.51 119.06 2x52 n ALA 93 Ca -0.02 -3.67 -0.17 0.00 0.00 0.00 0.00 53.44 49.58 2x52 n ALA 93 Cb 0.20 -0.78 -0.02 0.00 0.00 0.00 0.00 19.45 18.84 2x52 n ALA 93 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2x52 n GLY 94 N -0.20 0.15 2.19 0.00 0.00 -1.11 -2.70 105.19 103.52 2x52 n GLY 94 Ca 0.22 -0.18 -0.07 0.00 0.00 0.00 0.00 46.02 46.00 2x52 n GLY 94 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2x52 n GLY 95 N -0.98 0.81 3.75 -0.02 0.00 0.18 -4.96 105.19 103.97 2x52 n GLY 95 Ca -0.20 -0.73 -0.41 0.00 0.00 0.00 0.00 46.02 44.68 2x52 n GLY 95 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2x52 s LYS 96 N -2.77 4.22 0.58 1.61 2.20 -1.10 -4.59 119.74 119.89 2x52 s LYS 96 Ca 0.00 2.40 -0.09 0.00 -0.36 0.00 0.00 55.97 57.92 2x52 s LYS 96 Cb 0.00 -3.07 -0.03 0.00 -1.51 0.00 0.00 37.83 33.22 2x52 s LYS 96 CO 0.00 -0.47 0.95 -0.51 -0.36 0.00 0.00 175.35 174.95 2x52 s LEU 97 N -0.68 3.34 0.21 5.43 1.02 -1.26 -0.26 118.68 126.48 2x52 s LEU 97 Ca 0.59 1.19 -0.13 0.00 0.02 0.00 0.00 54.13 55.80 2x52 s LEU 97 Cb -0.44 -4.18 -0.07 0.00 0.02 0.00 0.00 46.19 41.52 2x52 s LEU 97 CO 0.47 -0.82 0.60 0.00 0.02 0.00 0.00 176.35 176.62 2x52 s PRO 99 N -2.45 1.31 -1.28 0.00 0.02 -1.26 -4.32 135.00 127.02 2x52 s PRO 99 Ca 0.45 0.19 -0.12 0.00 0.02 0.00 0.00 61.00 61.54 2x52 s PRO 99 Cb -0.13 -1.87 0.10 0.00 0.02 0.00 0.00 34.50 32.62 2x52 s PRO 99 CO 0.20 -2.06 0.49 0.09 -0.33 0.00 0.00 177.00 175.38 2x52 n ASN 100 N -3.65 -3.11 -0.71 2.53 4.13 -1.26 -1.31 115.26 111.89 2x52 n ASN 100 Ca 0.08 -0.49 -0.09 0.00 1.68 0.00 0.00 54.58 55.76 2x52 n ASN 100 Cb 0.60 -2.60 -0.04 0.00 -1.54 0.00 0.00 39.78 36.20 2x52 n ASN 100 CO 0.00 0.00 0.00 0.59 0.28 0.00 0.00 177.26 178.13 2x52 n ASN 101 N -2.27 -5.46 -4.75 6.41 3.02 -1.26 -4.97 115.26 105.99 2x52 n ASN 101 Ca 0.02 0.23 -0.37 0.00 -0.03 0.00 0.00 54.58 54.42 2x52 n ASN 101 Cb 0.52 -3.77 0.04 0.00 -0.61 0.00 0.00 39.78 35.97 2x52 n ASN 101 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 2x52 s LEU 102 N -2.09 3.72 0.19 3.41 1.43 -0.42 -1.17 118.68 123.75 2x52 s LEU 102 Ca 0.00 2.59 -0.27 0.00 -1.03 0.00 0.00 54.13 55.42 2x52 s LEU 102 Cb 0.00 -4.47 -0.08 0.00 0.03 0.00 0.00 46.19 41.67 2x52 s LEU 102 CO 0.00 -1.68 0.85 0.00 0.23 0.00 0.00 176.35 175.75 2x52 s SER 105 N 1.79 2.47 0.55 0.00 1.04 -0.46 0.42 113.70 119.52 2x52 s SER 105 Ca 0.12 1.39 0.30 0.00 0.48 0.00 0.00 55.95 58.23 2x52 s SER 105 Cb -0.17 -2.07 1.46 0.00 0.10 0.00 0.00 66.02 65.34 2x52 s SER 105 CO 0.13 -3.25 1.90 0.06 0.98 0.00 0.00 173.24 173.06 2x52 h GLN 106 N -1.97 0.00 -0.00 4.02 3.07 -1.78 0.23 115.11 118.67 2x52 h GLN 106 Ca -0.54 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.20 2x52 h GLN 106 Cb 1.32 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.88 2x52 h GLN 106 CO 0.54 0.00 -0.32 0.91 0.09 0.00 0.00 178.83 180.05 2x52 n TRP 107 N -4.13 0.00 -2.03 0.06 7.02 -1.26 -4.97 117.44 112.13 2x52 n TRP 107 Ca 0.14 0.00 0.00 0.00 -1.02 0.00 0.00 57.50 56.62 2x52 n TRP 107 Cb 0.83 -0.17 0.00 0.00 -2.42 0.00 0.00 31.31 29.55 2x52 n TRP 107 CO 0.00 0.00 0.00 0.41 -2.02 0.00 0.00 177.69 176.08 2x52 n GLY 108 N 1.39 0.64 3.08 6.99 0.00 0.07 -4.91 105.19 112.45 2x52 n GLY 108 Ca 0.10 -0.51 -0.18 0.00 0.00 0.00 0.00 46.02 45.43 2x52 n GLY 108 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2x52 s TYR 109 N -2.88 0.94 0.13 1.61 2.02 -1.26 -1.34 117.35 116.57 2x52 s TYR 109 Ca 0.00 -0.31 -0.24 0.00 -0.37 0.00 0.00 57.07 56.15 2x52 s TYR 109 Cb 0.00 -0.57 -0.07 0.00 -0.40 0.00 0.00 41.96 40.91 2x52 s TYR 109 CO 0.00 -0.00 0.72 0.00 -1.57 0.00 0.00 175.55 174.69 2x52 n GLY 111 N 1.68 -1.24 3.01 0.00 0.00 -0.81 -4.69 105.19 103.14 2x52 n GLY 111 Ca -0.07 -0.90 -0.13 0.00 0.00 0.00 0.00 46.02 44.92 2x52 n GLY 111 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2x52 s LEU 112 N 0.00 2.17 0.00 0.99 1.02 -1.26 -1.25 118.68 120.35 2x52 s LEU 112 Ca 0.00 -0.38 0.00 0.00 0.02 0.00 0.00 54.13 53.77 2x52 s LEU 112 Cb 0.00 -0.16 0.00 0.00 0.02 0.00 0.00 46.19 46.05 2x52 s LEU 112 CO 0.00 -0.12 0.00 0.61 0.02 0.00 0.00 176.35 176.86 2x52 n GLY 113 N 2.01 2.85 0.37 -3.19 0.00 -1.26 -4.76 105.19 101.21 2x52 n GLY 113 Ca -0.19 -2.07 0.12 0.00 0.00 0.00 0.00 46.02 43.88 2x52 n GLY 113 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 2x52 h SER 114 N 0.00 0.59 -0.35 1.61 4.64 -1.99 0.28 113.55 118.33 2x52 h SER 114 Ca 0.00 0.03 0.03 0.00 -0.47 0.00 0.00 61.79 61.38 2x52 h SER 114 Cb 0.00 -0.08 -0.02 0.00 -0.31 0.00 0.00 62.40 61.99 2x52 h SER 114 CO 0.00 0.31 0.23 -0.33 -0.87 0.00 0.00 176.83 176.17 2x52 h GLU 115 N 0.63 0.36 0.02 4.77 3.07 -1.96 0.29 114.58 121.76 2x52 h GLU 115 Ca 0.42 -0.02 -0.39 0.00 -0.50 0.00 0.00 59.36 58.87 2x52 h GLU 115 Cb 0.72 -0.08 -0.06 0.00 -0.84 0.00 0.00 28.75 28.49 2x52 h GLU 115 CO -0.18 0.24 -2.35 1.19 -1.40 0.00 0.00 179.01 176.52 2x52 n PHE 116 N -4.49 0.28 0.93 4.33 3.72 -0.09 -4.56 117.46 117.58 2x52 n PHE 116 Ca 0.03 0.07 0.12 0.00 -0.05 0.00 0.00 57.45 57.62 2x52 n PHE 116 Cb 0.15 -1.03 0.16 0.00 -0.94 0.00 0.00 39.48 37.81 2x52 n PHE 116 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 2x52 n GLY 118 N 1.48 1.17 3.63 0.00 0.00 0.09 -0.13 105.19 111.44 2x52 n GLY 118 Ca 0.05 -1.56 -0.50 0.00 0.00 0.00 0.00 46.02 44.02 2x52 n GLY 118 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2x52 n GLU 119 N 0.00 1.62 -0.56 1.61 -0.58 -1.26 -1.22 120.64 120.25 2x52 n GLU 119 Ca 0.00 0.58 0.00 0.00 -0.42 0.00 0.00 57.16 57.32 2x52 n GLU 119 Cb 0.00 -2.29 0.00 0.00 -0.57 0.00 0.00 31.44 28.58 2x52 n GLU 119 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2x52 n GLY 120 N 3.05 0.82 3.69 0.62 0.00 -1.26 -4.51 105.19 107.60 2x52 n GLY 120 Ca 0.18 0.00 -0.45 0.00 0.00 0.00 0.00 46.02 45.76 2x52 n GLY 120 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2x52 n GLN 122 N 3.24 0.68 -3.86 0.00 6.02 0.17 -4.95 117.38 118.69 2x52 n GLN 122 Ca 0.15 0.04 -0.05 0.00 -0.01 0.00 0.00 57.00 57.14 2x52 n GLN 122 Cb 0.31 -1.56 0.02 0.00 1.02 0.00 0.00 30.24 30.03 2x52 n GLN 122 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.06 176.59 2x52 s ASN 123 N -5.62 -0.01 0.12 1.08 2.20 -1.25 -4.95 114.94 106.51 2x52 s ASN 123 Ca -0.10 -0.78 0.00 0.00 -0.94 0.00 0.00 52.86 51.04 2x52 s ASN 123 Cb 0.06 0.59 0.00 0.00 -2.00 0.00 0.00 41.25 39.91 2x52 s ASN 123 CO 0.82 -1.17 0.00 0.61 -2.94 0.00 0.00 177.10 174.42 2x52 n GLY 124 N -0.64 -1.01 2.09 0.45 0.00 -1.25 -1.28 105.19 103.55 2x52 n GLY 124 Ca -0.04 -1.21 -0.09 0.00 0.00 0.00 0.00 46.02 44.67 2x52 n GLY 124 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2x52 n ALA 125 N 2.61 5.07 -1.71 4.61 0.00 -0.32 -4.87 120.51 125.90 2x52 n ALA 125 Ca 0.00 -1.35 -0.43 0.00 0.00 0.00 0.00 53.44 51.66 2x52 n ALA 125 Cb 0.00 -2.26 -0.01 0.00 0.00 0.00 0.00 19.45 17.18 2x52 n ALA 125 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2x52 n SER 127 N 1.23 0.59 0.27 0.00 3.41 0.82 -4.09 113.62 115.84 2x52 n SER 127 Ca 0.06 -0.36 0.12 0.00 -0.26 0.00 0.00 58.87 58.43 2x52 n SER 127 Cb 0.36 0.18 0.76 0.00 -0.26 0.00 0.00 64.21 65.25 2x52 n SER 127 CO 0.00 0.00 0.00 0.71 -0.16 0.00 0.00 175.04 175.59 2x52 h THR 128 N 0.28 0.65 -6.21 6.66 1.35 -1.84 -3.47 112.91 110.33 2x52 h THR 128 Ca 0.00 -0.33 -0.45 0.00 -0.55 0.00 0.00 66.41 65.08 2x52 h THR 128 Cb 0.50 1.21 0.01 0.00 -1.73 0.00 0.00 68.15 68.13 2x52 h THR 128 CO 0.00 0.08 -0.79 -0.67 -0.25 0.00 0.00 175.52 173.89 2x52 n ASP 129 N -3.84 -3.07 -4.77 5.36 2.03 -1.26 -4.91 116.55 106.10 2x52 n ASP 129 Ca -0.02 -0.80 -0.40 0.00 0.52 0.00 0.00 54.79 54.09 2x52 n ASP 129 Cb 0.18 -3.95 0.00 0.00 -0.72 0.00 0.00 41.12 36.63 2x52 n ASP 129 CO 0.00 0.00 0.00 -0.54 -1.92 0.00 0.00 177.20 174.74 2x52 s LYS 130 N -6.33 3.89 0.81 -0.67 1.02 -1.26 -4.94 119.74 112.26 2x52 s LYS 130 Ca 0.35 2.33 -0.11 0.00 0.02 0.00 0.00 55.97 58.57 2x52 s LYS 130 Cb -0.17 -2.76 0.08 0.00 -0.52 0.00 0.00 37.83 34.46 2x52 s LYS 130 CO 0.82 -0.62 1.10 -1.25 -0.92 0.00 0.00 175.35 174.48 2x52 s PRO 131 N -2.29 1.93 0.13 -1.68 0.04 -1.26 -4.55 135.00 127.33 2x52 s PRO 131 Ca 0.58 1.20 -0.04 0.00 0.04 0.00 0.00 61.00 62.78 2x52 s PRO 131 Cb -0.42 -1.86 -0.03 0.00 0.04 0.00 0.00 34.50 32.24 2x52 s PRO 131 CO 0.54 -1.88 0.13 0.00 0.04 0.00 0.00 177.00 175.83 2x52 n GLY 133 N -0.10 -0.96 0.38 0.00 0.00 -0.27 -4.19 105.19 100.05 2x52 n GLY 133 Ca -0.08 -1.47 0.18 0.00 0.00 0.00 0.00 46.02 44.65 2x52 n GLY 133 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 2x52 h LYS 134 N 0.00 0.15 -0.03 1.61 2.10 -1.92 0.23 116.57 118.72 2x52 h LYS 134 Ca 0.00 -0.01 0.00 0.00 -2.00 0.00 0.00 60.65 58.64 2x52 h LYS 134 Cb 0.00 -0.03 0.00 0.00 -0.90 0.00 0.00 32.23 31.30 2x52 h LYS 134 CO 0.00 0.10 -0.01 -0.25 -2.00 0.00 0.00 179.45 177.30 2x52 n ASP 135 N -4.41 2.74 -1.05 7.07 8.00 -1.26 -3.95 116.55 123.68 2x52 n ASP 135 Ca 0.11 -1.91 -0.02 0.00 0.71 0.00 0.00 54.79 53.68 2x52 n ASP 135 Cb 0.58 0.01 0.20 0.00 -0.02 0.00 0.00 41.12 41.88 2x52 n ASP 135 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2x52 n ALA 136 N 1.14 4.15 -2.34 2.24 0.00 -0.14 -4.93 120.51 120.63 2x52 n ALA 136 Ca 0.15 -3.14 -0.16 0.00 0.00 0.00 0.00 53.44 50.28 2x52 n ALA 136 Cb 0.56 -0.67 -0.01 0.00 0.00 0.00 0.00 19.45 19.33 2x52 n ALA 136 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2x52 n GLY 137 N -1.11 -0.29 2.20 0.00 0.00 -1.18 -2.83 105.19 101.97 2x52 n GLY 137 Ca 0.30 -0.20 -0.03 0.00 0.00 0.00 0.00 46.02 46.09 2x52 n GLY 137 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2x52 n GLY 138 N -1.04 0.61 3.76 -0.02 0.00 0.62 -5.00 105.19 104.11 2x52 n GLY 138 Ca -0.18 -0.46 -0.38 0.00 0.00 0.00 0.00 46.02 45.00 2x52 n GLY 138 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2x52 s ARG 139 N -1.59 3.41 0.16 1.61 0.52 -1.13 -4.66 118.95 117.28 2x52 s ARG 139 Ca 0.00 2.04 0.07 0.00 -0.52 0.00 0.00 55.73 57.31 2x52 s ARG 139 Cb 0.00 -2.33 -0.04 0.00 0.52 0.00 0.00 34.95 33.10 2x52 s ARG 139 CO 0.00 -0.91 0.02 0.14 0.02 0.00 0.00 175.30 174.57 2x52 s VAL 140 N -1.41 3.87 0.67 3.52 -7.23 -1.26 -1.11 120.40 117.46 2x52 s VAL 140 Ca 0.68 -1.32 -0.14 0.00 -1.81 0.00 0.00 61.98 59.39 2x52 s VAL 140 Cb -0.35 -2.94 0.01 0.00 0.56 0.00 0.00 36.38 33.65 2x52 s VAL 140 CO 0.42 -0.08 1.10 0.00 -0.31 0.00 0.00 175.10 176.23 2x52 s THR 142 N -2.47 1.97 -1.42 0.00 -4.23 -1.26 -4.17 115.64 104.06 2x52 s THR 142 Ca 0.65 0.00 0.00 0.00 -1.18 0.00 0.00 61.69 61.16 2x52 s THR 142 Cb -0.19 -2.84 0.00 0.00 1.34 0.00 0.00 72.50 70.80 2x52 s THR 142 CO 0.44 0.00 0.00 0.59 -0.54 0.00 0.00 174.62 175.11 2x52 n ASN 143 N -3.70 -3.70 -2.48 3.99 4.13 -1.26 -1.39 115.26 110.84 2x52 n ASN 143 Ca 0.09 0.31 -0.14 0.00 1.68 0.00 0.00 54.58 56.52 2x52 n ASN 143 Cb 0.60 -3.39 -0.01 0.00 -1.54 0.00 0.00 39.78 35.44 2x52 n ASN 143 CO 0.00 0.00 0.00 -3.20 0.28 0.00 0.00 177.26 174.34 2x52 n ASN 144 N -0.74 -4.23 -4.74 6.41 5.15 -1.26 -4.95 115.26 110.89 2x52 n ASN 144 Ca -0.14 0.13 -0.36 0.00 -0.60 0.00 0.00 54.58 53.62 2x52 n ASN 144 Cb 0.48 -3.58 0.05 0.00 -0.53 0.00 0.00 39.78 36.20 2x52 n ASN 144 CO 0.00 0.00 0.00 -0.31 1.40 0.00 0.00 177.26 178.35 2x52 s TYR 145 N -2.70 2.29 0.22 1.20 2.02 -0.49 -1.65 117.35 118.25 2x52 s TYR 145 Ca 0.02 1.53 -0.30 0.00 -0.37 0.00 0.00 57.07 57.95 2x52 s TYR 145 Cb -0.01 -3.49 -0.08 0.00 -0.40 0.00 0.00 41.96 37.97 2x52 s TYR 145 CO 0.02 -2.37 1.05 0.00 -1.57 0.00 0.00 175.55 172.69 2x52 s SER 148 N 1.72 3.48 0.66 0.00 1.04 -0.19 -0.40 113.70 120.00 2x52 s SER 148 Ca 0.07 1.70 0.39 0.00 0.48 0.00 0.00 55.95 58.59 2x52 s SER 148 Cb -0.18 -2.35 2.11 0.00 0.10 0.00 0.00 66.02 65.70 2x52 s SER 148 CO 0.11 -2.67 2.20 0.07 0.98 0.00 0.00 173.24 173.93 2x52 h LYS 149 N -1.57 0.00 0.00 4.02 2.10 -1.77 -0.13 116.57 119.22 2x52 h LYS 149 Ca -0.48 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.17 2x52 h LYS 149 Cb 1.27 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.60 2x52 h LYS 149 CO 0.51 0.00 -0.34 0.91 -2.00 0.00 0.00 179.45 178.53 2x52 n TRP 150 N -3.07 0.21 -1.05 0.07 7.02 -1.26 -4.96 117.44 114.40 2x52 n TRP 150 Ca -0.02 0.06 0.00 0.00 -1.02 0.00 0.00 57.50 56.52 2x52 n TRP 150 Cb 0.19 -0.47 0.00 0.00 -2.42 0.00 0.00 31.31 28.61 2x52 n TRP 150 CO 0.00 0.00 0.00 0.41 -2.02 0.00 0.00 177.69 176.08 2x52 n GLY 151 N 1.45 1.14 3.34 6.99 0.00 -0.06 -5.00 105.19 113.04 2x52 n GLY 151 Ca 0.05 -0.47 -0.27 0.00 0.00 0.00 0.00 46.02 45.34 2x52 n GLY 151 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2x52 s SER 152 N -2.53 2.98 0.07 1.61 0.01 -1.26 -1.72 113.70 112.87 2x52 s SER 152 Ca 0.00 -0.72 -0.19 0.00 1.31 0.00 0.00 55.95 56.35 2x52 s SER 152 Cb 0.00 -0.19 -0.07 0.00 0.21 0.00 0.00 66.02 65.98 2x52 s SER 152 CO 0.00 0.13 0.56 0.00 0.41 0.00 0.00 173.24 174.34 2x52 n GLY 154 N 1.71 -1.25 2.90 0.00 0.00 0.04 -4.98 105.19 103.61 2x52 n GLY 154 Ca -0.10 -0.91 -0.21 0.00 0.00 0.00 0.00 46.02 44.80 2x52 n GLY 154 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2x52 s ILE 155 N -3.00 0.62 0.00 -0.61 1.01 -1.26 -1.12 121.20 116.83 2x52 s ILE 155 Ca 0.00 -0.15 0.00 0.00 0.00 0.00 0.00 60.65 60.50 2x52 s ILE 155 Cb 0.00 -0.64 0.00 0.00 0.01 0.00 0.00 42.46 41.83 2x52 s ILE 155 CO 0.00 0.25 0.00 0.61 0.00 0.00 0.00 174.94 175.80 2x52 n GLY 156 N 4.14 2.36 0.23 6.18 0.00 -1.26 -4.91 105.19 111.93 2x52 n GLY 156 Ca -0.23 -1.45 0.07 0.00 0.00 0.00 0.00 46.02 44.42 2x52 n GLY 156 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2x52 h PRO 157 N 0.00 0.00 0.00 1.61 0.13 -1.99 0.80 132.00 132.55 2x52 h PRO 157 Ca 0.00 0.00 -0.04 0.00 -0.87 0.00 0.00 66.00 65.09 2x52 h PRO 157 Cb 0.00 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.12 2x52 h PRO 157 CO 0.00 0.21 -0.17 0.78 -0.23 0.00 0.00 178.00 178.59 2x52 h GLY 158 N 0.87 0.00 0.00 1.56 0.00 -1.95 -0.91 103.07 102.65 2x52 h GLY 158 Ca -0.00 0.00 -0.43 0.00 0.00 0.00 0.00 47.33 46.90 2x52 h GLY 158 CO 0.03 0.00 -2.47 -1.72 0.00 0.00 0.00 176.54 172.37 2x52 n TYR 159 N -3.43 0.00 0.29 5.60 4.01 -0.79 -4.60 117.16 118.24 2x52 n TYR 159 Ca -0.01 0.00 0.11 0.00 -0.16 0.00 0.00 57.90 57.85 2x52 n TYR 159 Cb 0.35 -0.96 0.01 0.00 -0.31 0.00 0.00 39.34 38.44 2x52 n TYR 159 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 2x52 n GLY 161 N 1.27 -0.50 3.72 0.00 0.00 -0.34 -0.80 105.19 108.54 2x52 n GLY 161 Ca 0.01 -1.24 -0.43 0.00 0.00 0.00 0.00 46.02 44.36 2x52 n GLY 161 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2x52 n ALA 162 N -3.00 1.89 -0.24 4.61 0.00 -1.26 -2.34 120.51 120.17 2x52 n ALA 162 Ca 0.00 0.37 0.00 0.00 0.00 0.00 0.00 53.44 53.81 2x52 n ALA 162 Cb 0.00 -2.36 0.00 0.00 0.00 0.00 0.00 19.45 17.09 2x52 n ALA 162 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2x52 n GLY 163 N 1.59 1.36 3.66 0.00 0.00 -1.26 -4.64 105.19 105.89 2x52 n GLY 163 Ca 0.07 0.00 -0.49 0.00 0.00 0.00 0.00 46.02 45.60 2x52 n GLY 163 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2x52 n GLN 165 N 4.14 0.66 -3.84 0.00 6.02 0.46 -4.93 117.38 119.89 2x52 n GLN 165 Ca 0.20 0.14 -0.05 0.00 -0.01 0.00 0.00 57.00 57.28 2x52 n GLN 165 Cb 0.25 -1.66 0.01 0.00 1.02 0.00 0.00 30.24 29.86 2x52 n GLN 165 CO 0.00 0.00 0.00 -1.54 -1.01 0.00 0.00 177.06 174.51 2x52 s SER 166 N -5.78 -0.04 0.00 1.08 1.04 -1.25 -4.99 113.70 103.76 2x52 s SER 166 Ca -0.07 -0.75 0.00 0.00 0.48 0.00 0.00 55.95 55.60 2x52 s SER 166 Cb 0.07 0.60 0.00 0.00 0.10 0.00 0.00 66.02 66.79 2x52 s SER 166 CO 0.83 -1.18 0.00 0.61 0.98 0.00 0.00 173.24 174.48 2x52 n GLY 167 N -0.61 -0.99 2.30 7.32 0.00 -1.25 -1.37 105.19 110.59 2x52 n GLY 167 Ca -0.05 -1.54 -0.27 0.00 0.00 0.00 0.00 46.02 44.15 2x52 n GLY 167 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2x52 n GLY 168 N 0.00 4.07 3.61 -0.02 0.00 -0.66 -4.91 105.19 107.29 2x52 n GLY 168 Ca 0.00 -1.62 -0.35 0.00 0.00 0.00 0.00 46.02 44.05 2x52 n GLY 168 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2x52 s ASP 170 N -1.86 1.48 0.00 0.00 1.01 0.02 -5.05 116.67 112.28 2x52 s ASP 170 Ca 0.71 1.25 0.00 0.00 0.71 0.00 0.00 52.55 55.22 2x52 s ASP 170 Cb -0.31 -1.94 0.00 0.00 1.01 0.00 0.00 42.92 41.68 2x52 s ASP 170 CO 0.53 -3.85 0.00 0.61 0.21 0.00 0.00 175.17 172.67