#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 -0.97 1.59 0.33 0.00 0.00 0.13 -3.02 105.19 103.26 2x52 n GLY 4 Ca -0.09 -0.48 0.17 0.00 0.00 0.00 0.00 46.02 45.63 2x52 n GLY 4 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 2x52 h GLU 5 N 0.00 0.45 0.00 1.61 4.81 -1.92 0.14 114.58 119.67 2x52 h GLU 5 Ca 0.00 -0.03 0.00 0.00 -0.13 0.00 0.00 59.36 59.20 2x52 h GLU 5 Cb 0.00 -0.10 0.00 0.00 0.63 0.00 0.00 28.75 29.28 2x52 h GLU 5 CO 0.00 0.30 0.00 1.04 -0.73 0.00 0.00 179.01 179.62 2x52 n GLN 6 N -4.98 0.95 -2.71 1.92 3.00 -1.17 -3.93 117.38 110.47 2x52 n GLN 6 Ca 0.26 0.00 -0.08 0.00 -0.01 0.00 0.00 57.00 57.18 2x52 n GLN 6 Cb 0.76 -1.21 0.10 0.00 0.00 0.00 0.00 30.24 29.90 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 0.64 1.31 4.19 1.08 0.00 0.28 -4.71 105.19 107.98 2x52 n GLY 7 Ca 0.10 -0.28 -0.35 0.00 0.00 0.00 0.00 46.02 45.49 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 -0.40 -3.02 -0.65 1.61 7.64 -1.15 -0.57 113.62 117.08 2x52 n SER 8 Ca 0.00 -1.01 -0.08 0.00 1.01 0.00 0.00 58.87 58.79 2x52 n SER 8 Cb 0.82 -2.81 -0.04 0.00 -1.01 0.00 0.00 64.21 61.18 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 -1.48 1.00 3.56 0.23 0.00 0.04 -4.96 105.19 103.58 2x52 n GLY 9 Ca 0.03 -0.40 -0.41 0.00 0.00 0.00 0.00 46.02 45.25 2x52 n GLY 9 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 2x52 n MET 10 N -2.26 1.01 -4.37 1.61 2.81 0.27 -4.42 117.12 111.77 2x52 n MET 10 Ca -0.08 0.37 -0.29 0.00 -1.81 0.00 0.00 57.70 55.89 2x52 n MET 10 Cb 0.34 -1.89 -0.12 0.00 -0.71 0.00 0.00 33.22 30.83 2x52 n MET 10 CO 0.00 0.00 0.00 -1.21 1.51 0.00 0.00 175.97 176.27 2x52 s GLU 11 N -2.01 1.52 0.44 0.03 2.02 -1.26 0.22 118.70 119.65 2x52 s GLU 11 Ca 0.65 -1.31 -0.21 0.00 0.02 0.00 0.00 54.97 54.12 2x52 s GLU 11 Cb -0.54 -1.96 -0.11 0.00 0.10 0.00 0.00 34.13 31.63 2x52 s GLU 11 CO 0.56 0.45 0.96 0.00 0.02 0.00 0.00 175.26 177.25 2x52 s PRO 13 N -3.24 4.06 -1.28 0.00 0.04 -1.26 -4.11 135.00 129.20 2x52 s PRO 13 Ca 0.62 1.51 -0.07 0.00 0.04 0.00 0.00 61.00 63.09 2x52 s PRO 13 Cb -0.10 -2.44 0.01 0.00 0.04 0.00 0.00 34.50 32.01 2x52 s PRO 13 CO 0.15 -0.23 1.12 0.09 0.04 0.00 0.00 177.00 178.16 2x52 n ASN 14 N -0.28 -5.66 -0.92 6.66 5.03 -1.26 -2.57 115.26 116.27 2x52 n ASN 14 Ca 0.06 -0.53 -0.12 0.00 0.87 0.00 0.00 54.58 54.86 2x52 n ASN 14 Cb 0.50 -4.87 -0.05 0.00 -1.02 0.00 0.00 39.78 34.34 2x52 n ASN 14 CO 0.00 0.00 0.00 0.59 -1.83 0.00 0.00 177.26 176.02 2x52 n ASN 15 N -2.87 -5.67 -4.68 6.41 3.02 -1.26 -4.97 115.26 105.25 2x52 n ASN 15 Ca -0.03 0.30 -0.38 0.00 -0.03 0.00 0.00 54.58 54.44 2x52 n ASN 15 Cb 0.57 -4.22 0.06 0.00 -0.61 0.00 0.00 39.78 35.58 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 -1.36 4.88 -4.81 3.41 4.32 -1.06 -1.57 117.00 120.80 2x52 n LEU 16 Ca -0.12 0.85 -0.38 0.00 -0.02 0.00 0.00 56.01 56.33 2x52 n LEU 16 Cb 0.60 -1.48 -0.06 0.00 -1.62 0.00 0.00 43.42 40.85 2x52 n LEU 16 CO 0.18 -1.31 0.23 0.00 -1.22 0.00 0.00 177.39 175.27 2x52 s SER 19 N 2.15 0.03 0.58 0.00 1.04 -0.65 -0.04 113.70 116.80 2x52 s SER 19 Ca 0.23 1.33 0.38 0.00 0.48 0.00 0.00 55.95 58.38 2x52 s SER 19 Cb -0.14 -2.03 2.00 0.00 0.10 0.00 0.00 66.02 65.95 2x52 s SER 19 CO 0.19 -4.76 2.17 0.06 0.98 0.00 0.00 173.24 171.88 2x52 h GLN 20 N -3.01 0.00 -0.17 4.02 3.07 -1.79 -2.05 115.11 115.18 2x52 h GLN 20 Ca -0.58 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.16 2x52 h GLN 20 Cb 1.34 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.90 2x52 h GLN 20 CO 0.44 0.00 0.00 0.66 0.09 0.00 0.00 178.83 180.02 2x52 n TYR 21 N -2.92 0.20 -2.55 0.06 4.01 -1.26 -4.97 117.16 109.72 2x52 n TYR 21 Ca -0.02 -0.10 -0.07 0.00 -0.16 0.00 0.00 57.90 57.56 2x52 n TYR 21 Cb 0.11 0.00 0.04 0.00 -0.31 0.00 0.00 39.34 39.18 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 1.36 0.12 3.12 2.72 0.00 -0.77 -4.91 105.19 106.83 2x52 n GLY 22 Ca 0.17 -0.23 -0.20 0.00 0.00 0.00 0.00 46.02 45.75 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 -3.14 1.17 -0.05 1.61 2.02 -1.26 -2.40 117.35 115.30 2x52 s TYR 23 Ca 0.01 -0.30 -0.24 0.00 -0.37 0.00 0.00 57.07 56.17 2x52 s TYR 23 Cb -0.00 -0.72 -0.04 0.00 -0.40 0.00 0.00 41.96 40.80 2x52 s TYR 23 CO 0.29 0.01 0.72 0.00 -1.57 0.00 0.00 175.55 175.00 2x52 n GLY 25 N 3.01 1.90 2.99 0.00 0.00 -0.56 -4.97 105.19 107.56 2x52 n GLY 25 Ca -0.01 -0.72 -0.09 0.00 0.00 0.00 0.00 46.02 45.20 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 0.55 0.34 0.00 1.61 1.75 -1.26 -0.61 119.30 121.67 2x52 s MET 26 Ca 0.00 -0.63 0.00 0.00 -1.25 0.00 0.00 55.69 53.81 2x52 s MET 26 Cb 0.00 0.12 0.00 0.00 2.84 0.00 0.00 34.83 37.79 2x52 s MET 26 CO 0.00 -0.06 0.00 0.41 -0.65 0.00 0.00 175.02 174.72 2x52 n GLY 27 N 1.50 0.80 0.34 2.11 0.00 -1.26 -4.68 105.19 104.01 2x52 n GLY 27 Ca -0.23 -2.08 0.15 0.00 0.00 0.00 0.00 46.02 43.86 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 1.81 2.00 -0.02 0.00 -1.98 0.16 103.07 105.04 2x52 h GLY 28 Ca 0.00 -0.32 0.00 0.00 0.00 0.00 0.00 47.33 47.01 2x52 h GLY 28 CO 0.00 -0.17 0.00 1.22 0.00 0.00 0.00 176.54 177.59 2x52 n ASP 29 N -4.85 0.68 -0.02 0.19 8.00 -1.26 -0.86 116.55 118.43 2x52 n ASP 29 Ca 0.25 0.70 -0.06 0.00 0.71 0.00 0.00 54.79 56.39 2x52 n ASP 29 Cb 0.66 -0.83 -0.02 0.00 -0.02 0.00 0.00 41.12 40.91 2x52 n ASP 29 CO 0.00 0.00 0.00 -1.22 -0.39 0.00 0.00 177.20 175.59 2x52 n TYR 30 N -2.29 0.00 0.18 1.24 4.02 -0.50 -4.62 117.16 115.19 2x52 n TYR 30 Ca 0.01 0.00 0.11 0.00 -0.01 0.00 0.00 57.90 58.01 2x52 n TYR 30 Cb 0.19 -0.22 0.11 0.00 -0.02 0.00 0.00 39.34 39.40 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 1.13 0.37 3.61 0.00 0.00 -0.04 -0.73 105.19 109.53 2x52 n GLY 32 Ca 0.03 -1.37 -0.48 0.00 0.00 0.00 0.00 46.02 44.19 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 1.42 0.00 1.61 4.81 -1.26 -2.03 118.16 122.71 2x52 n LYS 33 Ca 0.00 0.51 0.00 0.00 -0.87 0.00 0.00 58.31 57.95 2x52 n LYS 33 Cb 0.00 -2.09 0.00 0.00 0.02 0.00 0.00 35.03 32.96 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 2.26 1.42 3.65 3.14 0.00 -1.26 -4.68 105.19 109.72 2x52 n GLY 34 Ca 0.15 0.00 -0.50 0.00 0.00 0.00 0.00 46.02 45.67 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 4.04 0.70 -3.82 0.00 6.02 0.94 -4.95 117.38 120.31 2x52 n GLN 36 Ca 0.20 0.23 -0.09 0.00 -0.01 0.00 0.00 57.00 57.33 2x52 n GLN 36 Cb 0.23 -1.63 0.02 0.00 1.02 0.00 0.00 30.24 29.89 2x52 n GLN 36 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.06 176.59 2x52 s ASN 37 N -6.84 0.07 0.00 1.08 2.20 -1.25 -4.99 114.94 105.21 2x52 s ASN 37 Ca -0.28 -1.18 0.00 0.00 -0.94 0.00 0.00 52.86 50.45 2x52 s ASN 37 Cb 0.08 0.85 0.00 0.00 -2.00 0.00 0.00 41.25 40.17 2x52 s ASN 37 CO 0.69 -1.68 0.00 0.61 -2.94 0.00 0.00 177.10 173.78 2x52 n GLY 38 N -0.54 -0.48 2.35 0.45 0.00 -1.26 -1.31 105.19 104.40 2x52 n GLY 38 Ca -0.08 -1.46 -0.36 0.00 0.00 0.00 0.00 46.02 44.12 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 2.52 7.12 -1.79 4.61 0.00 -0.61 -4.95 120.51 127.42 2x52 n ALA 39 Ca 0.00 -3.51 -0.41 0.00 0.00 0.00 0.00 53.44 49.51 2x52 n ALA 39 Cb 0.00 -2.98 -0.02 0.00 0.00 0.00 0.00 19.45 16.46 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 4.98 1.19 -3.19 0.00 6.55 -1.22 -3.28 115.95 120.98 2x52 h TRP 41 Ca -0.47 0.03 -0.71 0.00 0.95 0.00 0.00 58.89 58.70 2x52 h TRP 41 Cb 1.22 -0.40 -0.20 0.00 -0.86 0.00 0.00 29.16 28.92 2x52 h TRP 41 CO 0.59 0.71 -0.05 0.99 -1.05 0.00 0.00 178.44 179.63 2x52 s THR 42 N -6.04 4.97 0.40 1.49 2.01 -1.26 -5.06 115.64 112.15 2x52 s THR 42 Ca -0.12 -0.78 -0.26 0.00 0.31 0.00 0.00 61.69 60.83 2x52 s THR 42 Cb 0.19 -4.29 -0.11 0.00 0.01 0.00 0.00 72.50 68.30 2x52 s THR 42 CO 0.81 -0.81 1.20 -1.20 -0.69 0.00 0.00 174.62 173.93 2x52 n SER 43 N 5.91 2.22 -4.79 3.53 7.64 -1.24 -4.98 113.62 121.92 2x52 n SER 43 Ca -0.09 1.11 -0.34 0.00 1.01 0.00 0.00 58.87 60.57 2x52 n SER 43 Cb 0.44 -1.45 -0.01 0.00 -1.01 0.00 0.00 64.21 62.18 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 -2.06 3.48 0.32 1.43 3.01 -1.26 -4.80 119.74 119.86 2x52 s LYS 44 Ca 0.60 1.41 -0.13 0.00 -1.01 0.00 0.00 55.97 56.85 2x52 s LYS 44 Cb -0.54 -2.04 -0.08 0.00 -1.01 0.00 0.00 37.83 34.16 2x52 s LYS 44 CO 0.59 -0.71 0.70 1.03 0.51 0.00 0.00 175.35 177.47 2x52 s ARG 45 N -3.48 3.91 0.29 1.68 1.81 -1.26 -1.56 118.95 120.33 2x52 s ARG 45 Ca 0.68 0.53 -0.14 0.00 -1.72 0.00 0.00 55.73 55.09 2x52 s ARG 45 Cb -0.19 -2.47 0.01 0.00 -0.45 0.00 0.00 34.95 31.85 2x52 s ARG 45 CO 0.27 0.15 0.58 0.00 -0.68 0.00 0.00 175.30 175.62 2x52 n GLY 47 N -0.45 0.16 0.37 0.00 0.00 -0.00 -3.36 105.19 101.92 2x52 n GLY 47 Ca -0.03 -0.91 0.08 0.00 0.00 0.00 0.00 46.02 45.16 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 6.74 0.77 0.62 1.61 4.64 -1.91 0.67 113.55 126.69 2x52 h SER 48 Ca 0.00 0.03 0.00 0.00 -0.47 0.00 0.00 61.79 61.35 2x52 h SER 48 Cb 0.00 -0.13 0.00 0.00 -0.31 0.00 0.00 62.40 61.96 2x52 h SER 48 CO 0.00 0.44 0.00 0.00 -0.87 0.00 0.00 176.83 176.40 2x52 n GLN 49 N -4.54 0.02 -1.26 4.77 3.00 -1.24 -3.16 117.38 114.97 2x52 n GLN 49 Ca 0.16 0.17 0.03 0.00 -0.01 0.00 0.00 57.00 57.34 2x52 n GLN 49 Cb 0.34 -1.50 0.10 0.00 0.00 0.00 0.00 30.24 29.18 2x52 n GLN 49 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 2x52 n ALA 50 N -1.48 3.11 -1.51 -1.58 0.00 -0.15 -4.88 120.51 114.03 2x52 n ALA 50 Ca 0.05 -2.88 -0.12 0.00 0.00 0.00 0.00 53.44 50.49 2x52 n ALA 50 Cb 0.21 -0.56 -0.04 0.00 0.00 0.00 0.00 19.45 19.06 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 -0.34 1.06 1.58 0.00 0.00 -1.01 -2.43 105.19 104.05 2x52 n GLY 51 Ca 0.14 -0.45 0.00 0.00 0.00 0.00 0.00 46.02 45.71 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 -1.42 0.75 3.74 -0.02 0.00 0.22 -4.98 105.19 103.49 2x52 n GLY 52 Ca -0.12 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.48 2x52 n GLY 52 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 2x52 n LYS 53 N -2.29 2.44 -3.45 1.61 4.81 -1.02 -4.51 118.16 115.75 2x52 n LYS 53 Ca 0.00 0.85 -0.29 0.00 -0.87 0.00 0.00 58.31 58.01 2x52 n LYS 53 Cb 0.00 -2.53 -0.03 0.00 0.02 0.00 0.00 35.03 32.49 2x52 n LYS 53 CO 0.00 0.00 0.00 0.99 1.17 0.00 0.00 177.40 179.56 2x52 s THR 54 N -1.11 5.07 0.18 3.15 2.01 -1.26 -0.82 115.64 122.85 2x52 s THR 54 Ca 0.54 0.00 -0.30 0.00 0.31 0.00 0.00 61.69 62.25 2x52 s THR 54 Cb -0.51 -3.71 -0.07 0.00 0.01 0.00 0.00 72.50 68.21 2x52 s THR 54 CO 0.63 -0.24 1.03 0.00 -0.69 0.00 0.00 174.62 175.36 2x52 s PRO 56 N -0.48 0.01 -1.81 0.00 0.02 -1.26 -4.16 135.00 127.32 2x52 s PRO 56 Ca 0.47 0.47 0.00 0.00 0.02 0.00 0.00 61.00 61.96 2x52 s PRO 56 Cb -0.27 -1.69 0.00 0.00 0.02 0.00 0.00 34.50 32.55 2x52 s PRO 56 CO 0.33 -3.00 0.00 0.09 -0.33 0.00 0.00 177.00 174.09 2x52 n ASN 57 N -4.36 -4.91 -2.26 2.53 4.13 -1.26 -1.87 115.26 107.26 2x52 n ASN 57 Ca 0.05 0.33 -0.16 0.00 1.68 0.00 0.00 54.58 56.49 2x52 n ASN 57 Cb 0.57 -4.31 -0.02 0.00 -1.54 0.00 0.00 39.78 34.48 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 -1.32 -4.56 -4.77 6.41 3.02 -1.26 -4.97 115.26 107.80 2x52 n ASN 58 Ca -0.19 0.16 -0.32 0.00 -0.03 0.00 0.00 54.58 54.20 2x52 n ASN 58 Cb 0.61 -3.89 0.06 0.00 -0.61 0.00 0.00 39.78 35.95 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 -2.70 2.66 0.24 3.10 3.76 -0.78 -4.19 115.29 117.37 2x52 s HIS 59 Ca 0.00 1.54 -0.24 0.00 -0.15 0.00 0.00 55.06 56.21 2x52 s HIS 59 Cb 0.00 -3.11 -0.09 0.00 1.11 0.00 0.00 32.58 30.50 2x52 s HIS 59 CO 0.00 -1.65 0.83 0.00 -0.85 0.00 0.00 174.74 173.06 2x52 s SER 62 N 1.78 2.44 0.41 0.00 1.04 -0.39 0.88 113.70 119.86 2x52 s SER 62 Ca 0.15 1.42 0.27 0.00 0.48 0.00 0.00 55.95 58.27 2x52 s SER 62 Cb -0.16 -2.11 1.47 0.00 0.10 0.00 0.00 66.02 65.32 2x52 s SER 62 CO 0.13 -3.28 1.82 0.06 0.98 0.00 0.00 173.24 172.96 2x52 h GLN 63 N -1.99 0.00 -0.23 4.02 3.07 -1.77 -1.34 115.11 116.87 2x52 h GLN 63 Ca -0.54 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.20 2x52 h GLN 63 Cb 1.31 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.87 2x52 h GLN 63 CO 0.54 0.00 0.00 0.66 0.09 0.00 0.00 178.83 180.12 2x52 n TYR 64 N -2.46 0.28 -2.51 0.06 4.01 -1.26 -4.97 117.16 110.30 2x52 n TYR 64 Ca -0.02 -0.15 -0.06 0.00 -0.16 0.00 0.00 57.90 57.52 2x52 n TYR 64 Cb 0.06 -0.00 0.01 0.00 -0.31 0.00 0.00 39.34 39.10 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 1.36 0.42 3.38 2.72 0.00 -0.50 -4.91 105.19 107.66 2x52 n GLY 65 Ca 0.16 -0.53 -0.30 0.00 0.00 0.00 0.00 46.02 45.36 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 -2.77 2.33 -0.06 1.61 3.76 -1.26 -1.16 115.29 117.74 2x52 s HIS 66 Ca 0.09 -0.38 -0.16 0.00 -0.15 0.00 0.00 55.06 54.45 2x52 s HIS 66 Cb -0.04 -1.32 -0.05 0.00 1.11 0.00 0.00 32.58 32.28 2x52 s HIS 66 CO 0.11 0.26 0.44 0.00 -0.85 0.00 0.00 174.74 174.70 2x52 n GLY 68 N 2.61 0.74 3.17 0.00 0.00 -0.53 -4.63 105.19 106.55 2x52 n GLY 68 Ca -0.10 -0.67 -0.10 0.00 0.00 0.00 0.00 46.02 45.14 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 -2.20 0.88 0.00 1.61 0.08 -1.26 -1.01 117.98 116.07 2x52 s PHE 69 Ca 0.00 -0.98 0.00 0.00 0.12 0.00 0.00 56.93 56.07 2x52 s PHE 69 Cb 0.00 -0.52 0.00 0.00 -0.57 0.00 0.00 43.02 41.93 2x52 s PHE 69 CO 0.00 -0.22 0.00 0.41 -0.10 0.00 0.00 175.22 175.31 2x52 n GLY 70 N -0.05 1.07 0.37 4.36 0.00 -1.26 -4.62 105.19 105.06 2x52 n GLY 70 Ca -0.11 -2.06 0.07 0.00 0.00 0.00 0.00 46.02 43.92 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 1.56 0.00 4.61 0.00 -1.99 -0.67 119.26 122.77 2x52 h ALA 71 Ca 0.00 0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.92 2x52 h ALA 71 Cb 0.00 -0.21 -0.00 0.00 0.00 0.00 0.00 17.79 17.58 2x52 h ALA 71 CO 0.00 0.21 -0.05 0.93 0.00 0.00 0.00 179.25 180.34 2x52 h GLU 72 N 0.97 0.00 0.00 0.00 3.07 -1.96 0.15 114.58 116.80 2x52 h GLU 72 Ca 0.48 0.00 -0.31 0.00 -0.50 0.00 0.00 59.36 59.03 2x52 h GLU 72 Cb 0.48 0.00 -0.05 0.00 -0.84 0.00 0.00 28.75 28.34 2x52 h GLU 72 CO -0.24 0.05 -2.09 0.66 -1.40 0.00 0.00 179.01 175.99 2x52 n TYR 73 N -3.74 0.00 0.56 4.33 4.01 -0.79 -4.59 117.16 116.95 2x52 n TYR 73 Ca -0.03 0.00 0.11 0.00 -0.16 0.00 0.00 57.90 57.83 2x52 n TYR 73 Cb 0.14 -0.71 0.06 0.00 -0.31 0.00 0.00 39.34 38.52 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 1.36 0.71 3.70 0.00 0.00 0.52 -0.40 105.19 111.09 2x52 n GLY 75 Ca 0.02 -1.30 -0.44 0.00 0.00 0.00 0.00 46.02 44.30 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 2.16 -0.83 4.61 0.00 -1.26 -2.08 120.51 120.11 2x52 n ALA 76 Ca 0.00 0.41 0.00 0.00 0.00 0.00 0.00 53.44 53.85 2x52 n ALA 76 Cb 0.00 -2.44 0.00 0.00 0.00 0.00 0.00 19.45 17.01 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 3.36 0.86 3.65 0.00 0.00 -1.26 -4.63 105.19 107.17 2x52 n GLY 77 Ca 0.15 0.00 -0.48 0.00 0.00 0.00 0.00 46.02 45.69 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 3.18 0.65 -3.81 0.00 6.02 0.25 -4.92 117.38 118.75 2x52 n GLN 79 Ca 0.17 -0.15 -0.01 0.00 -0.01 0.00 0.00 57.00 57.01 2x52 n GLN 79 Cb 0.26 -1.57 0.01 0.00 1.02 0.00 0.00 30.24 29.95 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 -4.51 -0.14 0.00 1.08 0.00 -1.24 -4.94 107.32 97.58 2x52 s GLY 80 Ca -0.07 0.10 0.00 0.00 0.00 0.00 0.00 44.72 44.75 2x52 s GLY 80 CO 0.89 2.07 0.00 0.61 0.00 0.00 0.00 173.10 176.67 2x52 n GLY 81 N -0.65 -1.21 2.81 0.20 0.00 -1.26 -1.18 105.19 103.90 2x52 n GLY 81 Ca -0.04 -1.21 -0.40 0.00 0.00 0.00 0.00 46.02 44.38 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 -0.42 2.32 -1.73 1.61 -0.04 -1.26 -4.92 135.00 130.56 2x52 n PRO 82 Ca 0.00 -2.11 -0.39 0.00 -0.04 0.00 0.00 63.50 60.96 2x52 n PRO 82 Cb 0.00 -2.98 0.04 0.00 -0.04 0.00 0.00 33.50 30.52 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 1.41 0.00 -6.90 0.00 3.08 -1.00 -3.43 114.38 107.54 2x52 h ARG 84 Ca -0.50 0.00 -0.47 0.00 0.07 0.00 0.00 59.98 59.07 2x52 h ARG 84 Cb 1.31 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 31.34 2x52 h ARG 84 CO 0.57 0.17 0.36 0.00 -1.07 0.00 0.00 179.97 180.00 2x52 s ALA 85 N -4.20 3.20 0.38 0.04 0.00 -1.26 -5.02 121.76 114.89 2x52 s ALA 85 Ca -0.03 0.55 -0.28 0.00 0.00 0.00 0.00 51.96 52.21 2x52 s ALA 85 Cb 0.13 -3.20 -0.11 0.00 0.00 0.00 0.00 23.12 19.95 2x52 s ALA 85 CO 0.62 0.12 1.47 -0.51 0.00 0.00 0.00 175.76 177.46 2x52 s ASP 86 N -1.60 6.37 -0.22 0.00 1.01 -1.26 -4.99 116.67 115.97 2x52 s ASP 86 Ca 0.51 3.01 -0.04 0.00 0.71 0.00 0.00 52.55 56.74 2x52 s ASP 86 Cb -0.19 -2.67 -0.01 0.00 1.01 0.00 0.00 42.92 41.06 2x52 s ASP 86 CO 0.24 -0.85 -0.03 -0.63 0.21 0.00 0.00 175.17 174.11 2x52 s ILE 87 N -1.13 3.53 0.26 0.77 1.01 -1.26 -5.05 121.20 119.33 2x52 s ILE 87 Ca 0.53 -0.44 -0.14 0.00 0.00 0.00 0.00 60.65 60.59 2x52 s ILE 87 Cb -0.46 -2.61 -0.08 0.00 0.01 0.00 0.00 42.46 39.32 2x52 s ILE 87 CO 0.62 0.42 0.66 -0.54 0.00 0.00 0.00 174.94 176.10 2x52 s LYS 88 N 1.42 3.98 0.34 2.79 1.02 -1.26 -0.93 119.74 127.10 2x52 s LYS 88 Ca 0.05 0.57 -0.16 0.00 0.02 0.00 0.00 55.97 56.45 2x52 s LYS 88 Cb -0.14 -2.62 0.04 0.00 -0.52 0.00 0.00 37.83 34.58 2x52 s LYS 88 CO -0.02 0.28 0.72 0.00 -0.92 0.00 0.00 175.35 175.41 2x52 n GLY 90 N -0.50 -1.73 0.28 0.00 0.00 0.45 -3.99 105.19 99.70 2x52 n GLY 90 Ca -0.06 -1.54 0.17 0.00 0.00 0.00 0.00 46.02 44.59 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 0.00 0.00 0.77 1.61 4.64 -1.89 0.38 113.55 119.06 2x52 h SER 91 Ca 0.00 0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 61.29 2x52 h SER 91 Cb 0.00 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.09 2x52 h SER 91 CO 0.00 0.02 -0.15 1.56 -0.87 0.00 0.00 176.83 177.39 2x52 h GLN 92 N 0.00 0.00 -1.21 4.77 7.50 -1.95 -3.26 115.11 120.96 2x52 h GLN 92 Ca -0.00 0.00 -0.51 0.00 0.50 0.00 0.00 58.65 58.64 2x52 h GLN 92 Cb 0.48 0.00 -0.42 0.00 0.05 0.00 0.00 27.48 27.60 2x52 h GLN 92 CO 0.00 0.15 -0.87 0.00 -1.50 0.00 0.00 178.83 176.61 2x52 n ALA 93 N -2.21 4.55 -2.11 3.87 0.00 -0.56 -4.95 120.51 119.10 2x52 n ALA 93 Ca -0.00 -3.88 -0.18 0.00 0.00 0.00 0.00 53.44 49.38 2x52 n ALA 93 Cb 0.35 -0.61 -0.03 0.00 0.00 0.00 0.00 19.45 19.16 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 -0.44 0.22 1.98 0.00 0.00 -1.18 -2.18 105.19 103.60 2x52 n GLY 94 Ca 0.31 -0.15 0.00 0.00 0.00 0.00 0.00 46.02 46.19 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 -0.96 0.45 3.73 -0.02 0.00 0.12 -4.96 105.19 103.55 2x52 n GLY 95 Ca -0.20 -0.51 -0.42 0.00 0.00 0.00 0.00 46.02 44.88 2x52 n GLY 95 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 2x52 n LYS 96 N -2.99 2.61 -2.74 1.61 4.81 -0.93 -4.61 118.16 115.92 2x52 n LYS 96 Ca 0.00 0.93 -0.29 0.00 -0.87 0.00 0.00 58.31 58.08 2x52 n LYS 96 Cb 0.00 -2.71 -0.02 0.00 0.02 0.00 0.00 35.03 32.32 2x52 n LYS 96 CO 0.00 0.00 0.00 -0.51 1.17 0.00 0.00 177.40 178.06 2x52 s LEU 97 N -0.01 3.74 0.22 3.14 1.43 -1.26 -0.41 118.68 125.53 2x52 s LEU 97 Ca 0.67 1.08 -0.24 0.00 -1.03 0.00 0.00 54.13 54.61 2x52 s LEU 97 Cb -0.53 -3.99 -0.09 0.00 0.03 0.00 0.00 46.19 41.62 2x52 s LEU 97 CO 0.45 -0.48 0.80 0.00 0.23 0.00 0.00 176.35 177.35 2x52 s PRO 99 N -1.60 2.44 -1.30 0.00 0.04 -1.26 -4.02 135.00 129.29 2x52 s PRO 99 Ca 0.41 0.97 -0.05 0.00 0.04 0.00 0.00 61.00 62.37 2x52 s PRO 99 Cb -0.20 -1.93 0.03 0.00 0.04 0.00 0.00 34.50 32.44 2x52 s PRO 99 CO 0.24 -1.46 0.36 0.09 0.04 0.00 0.00 177.00 176.27 2x52 n ASN 100 N -3.37 -4.41 -0.47 6.66 4.13 -1.26 -1.97 115.26 114.57 2x52 n ASN 100 Ca 0.08 -0.18 -0.06 0.00 1.68 0.00 0.00 54.58 56.09 2x52 n ASN 100 Cb 0.54 -3.65 -0.03 0.00 -1.54 0.00 0.00 39.78 35.10 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 -2.19 -5.15 -4.66 6.41 3.02 -1.26 -4.98 115.26 106.46 2x52 n ASN 101 Ca -0.09 0.15 -0.36 0.00 -0.03 0.00 0.00 54.58 54.26 2x52 n ASN 101 Cb 0.59 -3.20 0.09 0.00 -0.61 0.00 0.00 39.78 36.65 2x52 n ASN 101 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 2x52 n LEU 102 N -0.70 4.31 -4.77 3.41 4.77 -0.83 -1.83 117.00 121.36 2x52 n LEU 102 Ca -0.06 0.70 -0.39 0.00 -0.03 0.00 0.00 56.01 56.23 2x52 n LEU 102 Cb 0.44 -1.46 -0.06 0.00 -2.33 0.00 0.00 43.42 40.01 2x52 n LEU 102 CO 0.09 -1.71 0.57 0.00 -1.33 0.00 0.00 177.39 175.01 2x52 s SER 105 N 1.71 3.50 0.61 0.00 1.04 -0.32 0.23 113.70 120.47 2x52 s SER 105 Ca 0.12 1.02 0.31 0.00 0.48 0.00 0.00 55.95 57.87 2x52 s SER 105 Cb -0.16 -1.62 1.71 0.00 0.10 0.00 0.00 66.02 66.05 2x52 s SER 105 CO 0.11 -2.56 2.07 0.06 0.98 0.00 0.00 173.24 173.90 2x52 h GLN 106 N -1.50 0.00 -0.00 4.02 3.07 -1.79 -0.79 115.11 118.11 2x52 h GLN 106 Ca -0.51 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.23 2x52 h GLN 106 Cb 1.33 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.89 2x52 h GLN 106 CO 0.61 0.00 -0.49 0.91 0.09 0.00 0.00 178.83 179.96 2x52 n TRP 107 N -3.56 0.00 -1.50 0.06 5.03 -1.26 -4.96 117.44 111.25 2x52 n TRP 107 Ca 0.01 0.00 0.00 0.00 3.03 0.00 0.00 57.50 60.54 2x52 n TRP 107 Cb 0.35 -0.22 0.00 0.00 -1.03 0.00 0.00 31.31 30.41 2x52 n TRP 107 CO 0.00 0.00 0.00 0.41 -0.03 0.00 0.00 177.69 178.07 2x52 n GLY 108 N 1.48 0.94 3.31 6.99 0.00 -0.30 -4.98 105.19 112.62 2x52 n GLY 108 Ca 0.06 -0.52 -0.29 0.00 0.00 0.00 0.00 46.02 45.27 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 -2.34 2.16 0.13 1.61 2.02 -1.26 -1.00 117.35 118.68 2x52 s TYR 109 Ca 0.00 -0.40 -0.24 0.00 -0.37 0.00 0.00 57.07 56.06 2x52 s TYR 109 Cb 0.00 -1.30 -0.07 0.00 -0.40 0.00 0.00 41.96 40.18 2x52 s TYR 109 CO 0.00 0.10 0.73 0.00 -1.57 0.00 0.00 175.55 174.81 2x52 n GLY 111 N 1.70 -1.25 3.04 0.00 0.00 -0.61 -4.72 105.19 103.35 2x52 n GLY 111 Ca -0.06 -0.86 -0.11 0.00 0.00 0.00 0.00 46.02 44.99 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 2.29 0.00 0.99 1.43 -1.26 -0.20 118.68 121.93 2x52 s LEU 112 Ca 0.00 -0.61 0.00 0.00 -1.03 0.00 0.00 54.13 52.49 2x52 s LEU 112 Cb 0.00 -0.03 0.00 0.00 0.03 0.00 0.00 46.19 46.19 2x52 s LEU 112 CO 0.00 -0.30 0.00 0.61 0.23 0.00 0.00 176.35 176.89 2x52 n GLY 113 N 1.26 2.80 0.39 -3.19 0.00 -1.26 -4.76 105.19 100.42 2x52 n GLY 113 Ca -0.22 -1.98 0.16 0.00 0.00 0.00 0.00 46.02 43.99 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 0.49 0.24 1.61 4.64 -2.00 0.26 113.55 118.79 2x52 h SER 114 Ca 0.00 0.04 -0.02 0.00 -0.47 0.00 0.00 61.79 61.34 2x52 h SER 114 Cb 0.00 -0.05 -0.00 0.00 -0.31 0.00 0.00 62.40 62.03 2x52 h SER 114 CO 0.00 0.22 -0.11 -0.33 -0.87 0.00 0.00 176.83 175.74 2x52 h GLU 115 N 0.50 0.00 0.00 4.77 3.07 -1.95 0.50 114.58 121.47 2x52 h GLU 115 Ca 0.45 0.00 -0.43 0.00 -0.50 0.00 0.00 59.36 58.88 2x52 h GLU 115 Cb 0.97 0.00 -0.07 0.00 -0.84 0.00 0.00 28.75 28.81 2x52 h GLU 115 CO -0.18 0.11 -2.48 1.19 -1.40 0.00 0.00 179.01 176.25 2x52 n PHE 116 N -3.89 0.06 0.44 4.33 3.01 0.62 -4.65 117.46 117.37 2x52 n PHE 116 Ca -0.02 0.02 0.12 0.00 1.01 0.00 0.00 57.45 58.57 2x52 n PHE 116 Cb 0.21 -1.01 0.10 0.00 -0.01 0.00 0.00 39.48 38.78 2x52 n PHE 116 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 2x52 n GLY 118 N 1.30 0.98 3.69 0.00 0.00 0.16 -0.88 105.19 110.43 2x52 n GLY 118 Ca 0.02 -1.50 -0.58 0.00 0.00 0.00 0.00 46.02 43.97 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 1.00 -0.06 1.61 4.71 -1.26 -1.11 120.64 125.53 2x52 n GLU 119 Ca 0.00 0.37 0.00 0.00 -0.01 0.00 0.00 57.16 57.52 2x52 n GLU 119 Cb 0.00 -2.02 0.00 0.00 -1.01 0.00 0.00 31.44 28.41 2x52 n GLU 119 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 2x52 n GLY 120 N 3.77 0.58 3.63 0.62 0.00 -1.26 -4.61 105.19 107.91 2x52 n GLY 120 Ca 0.25 0.00 -0.52 0.00 0.00 0.00 0.00 46.02 45.75 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 3.47 0.68 -3.86 0.00 6.02 0.14 -4.94 117.38 118.87 2x52 n GLN 122 Ca 0.20 -0.01 -0.05 0.00 -0.01 0.00 0.00 57.00 57.14 2x52 n GLN 122 Cb 0.19 -1.56 0.02 0.00 1.02 0.00 0.00 30.24 29.92 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 -5.38 -0.01 0.14 1.08 2.20 -1.25 -4.96 114.94 106.76 2x52 s ASN 123 Ca -0.09 -0.79 0.00 0.00 -0.94 0.00 0.00 52.86 51.04 2x52 s ASN 123 Cb 0.08 0.59 0.00 0.00 -2.00 0.00 0.00 41.25 39.92 2x52 s ASN 123 CO 0.84 -1.18 0.00 0.61 -2.94 0.00 0.00 177.10 174.43 2x52 n GLY 124 N -0.64 -1.00 2.24 0.45 0.00 -1.26 -1.52 105.19 103.47 2x52 n GLY 124 Ca -0.04 -1.21 -0.10 0.00 0.00 0.00 0.00 46.02 44.66 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 2.51 4.54 -1.69 4.61 0.00 -0.76 -4.90 120.51 124.81 2x52 n ALA 125 Ca 0.00 -1.34 -0.40 0.00 0.00 0.00 0.00 53.44 51.71 2x52 n ALA 125 Cb 0.00 -2.42 0.03 0.00 0.00 0.00 0.00 19.45 17.06 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 -0.30 1.02 0.27 0.00 3.41 -0.06 -4.33 113.62 113.63 2x52 n SER 127 Ca 0.09 -0.86 0.14 0.00 -0.26 0.00 0.00 58.87 57.98 2x52 n SER 127 Cb 0.42 0.62 0.77 0.00 -0.26 0.00 0.00 64.21 65.77 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 0.50 0.49 -6.42 6.66 1.35 -1.86 -3.47 112.91 110.16 2x52 h THR 128 Ca 0.00 -0.46 -0.48 0.00 -0.55 0.00 0.00 66.41 64.92 2x52 h THR 128 Cb 0.54 1.31 -0.02 0.00 -1.73 0.00 0.00 68.15 68.26 2x52 h THR 128 CO 0.00 0.09 -0.90 -0.67 -0.25 0.00 0.00 175.52 173.80 2x52 n ASP 129 N -3.58 -1.43 -4.77 5.36 2.03 -1.26 -4.92 116.55 107.99 2x52 n ASP 129 Ca -0.02 -1.00 -0.40 0.00 0.52 0.00 0.00 54.79 53.89 2x52 n ASP 129 Cb 0.22 -3.17 -0.02 0.00 -0.72 0.00 0.00 41.12 37.42 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 -6.41 4.33 0.58 -0.67 1.02 -1.26 -4.97 119.74 112.36 2x52 s LYS 130 Ca 0.10 2.03 -0.18 0.00 0.02 0.00 0.00 55.97 57.94 2x52 s LYS 130 Cb -0.04 -2.99 -0.04 0.00 -0.52 0.00 0.00 37.83 34.24 2x52 s LYS 130 CO 0.88 -0.14 1.15 -1.25 -0.92 0.00 0.00 175.35 175.07 2x52 s PRO 131 N -1.85 3.12 0.31 -1.68 0.04 -1.26 -4.49 135.00 129.19 2x52 s PRO 131 Ca 0.50 1.64 0.03 0.00 0.04 0.00 0.00 61.00 63.21 2x52 s PRO 131 Cb -0.36 -1.97 -0.05 0.00 0.04 0.00 0.00 34.50 32.16 2x52 s PRO 131 CO 0.47 -1.04 0.09 0.00 0.04 0.00 0.00 177.00 176.55 2x52 n GLY 133 N -0.63 -1.88 0.37 0.00 0.00 -0.39 -4.29 105.19 98.38 2x52 n GLY 133 Ca -0.02 -1.60 0.16 0.00 0.00 0.00 0.00 46.02 44.57 2x52 n GLY 133 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 2x52 h LYS 134 N 0.00 0.59 -0.42 1.61 3.64 -1.91 0.36 116.57 120.44 2x52 h LYS 134 Ca 0.00 -0.04 0.00 0.00 -1.27 0.00 0.00 60.65 59.34 2x52 h LYS 134 Cb 0.00 -0.13 0.00 0.00 -0.41 0.00 0.00 32.23 31.69 2x52 h LYS 134 CO 0.00 0.39 0.00 -0.25 -2.27 0.00 0.00 179.45 177.32 2x52 n ASP 135 N -4.67 1.63 -2.18 4.20 8.00 -1.26 -3.71 116.55 118.55 2x52 n ASP 135 Ca 0.23 -2.09 -0.03 0.00 0.71 0.00 0.00 54.79 53.61 2x52 n ASP 135 Cb 0.65 -0.28 0.05 0.00 -0.02 0.00 0.00 41.12 41.53 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 0.19 3.03 -0.86 2.24 0.00 0.11 -4.94 120.51 120.29 2x52 n ALA 136 Ca 0.08 -2.87 0.00 0.00 0.00 0.00 0.00 53.44 50.65 2x52 n ALA 136 Cb 0.30 -0.70 0.00 0.00 0.00 0.00 0.00 19.45 19.05 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 -0.39 0.40 1.48 0.00 0.00 -1.23 -2.36 105.19 103.09 2x52 n GLY 137 Ca 0.14 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.16 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 -1.58 0.59 3.69 -0.02 0.00 -0.26 -4.99 105.19 102.61 2x52 n GLY 138 Ca 0.00 -0.78 -0.45 0.00 0.00 0.00 0.00 46.02 44.79 2x52 n GLY 138 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 2x52 n ARG 139 N -2.40 2.45 -3.36 1.61 0.63 -0.99 -4.60 116.66 110.00 2x52 n ARG 139 Ca 0.00 0.89 -0.32 0.00 -0.92 0.00 0.00 57.85 57.50 2x52 n ARG 139 Cb 0.07 -2.72 -0.05 0.00 0.45 0.00 0.00 32.46 30.21 2x52 n ARG 139 CO 0.00 0.00 0.00 0.14 -2.51 0.00 0.00 177.63 175.26 2x52 s VAL 140 N 1.87 4.89 0.61 5.15 -7.23 -1.26 -1.26 120.40 123.18 2x52 s VAL 140 Ca 0.81 0.54 -0.16 0.00 -1.81 0.00 0.00 61.98 61.37 2x52 s VAL 140 Cb -0.59 -3.62 -0.03 0.00 0.56 0.00 0.00 36.38 32.70 2x52 s VAL 140 CO 0.38 -0.10 1.08 0.00 -0.31 0.00 0.00 175.10 176.15 2x52 s THR 142 N -2.39 1.95 -1.52 0.00 -4.23 -1.26 -4.03 115.64 104.16 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 -0.18 -2.64 0.00 0.00 1.34 0.00 0.00 72.50 71.03 2x52 s THR 142 CO 0.38 0.00 0.00 0.59 -0.54 0.00 0.00 174.62 175.05 2x52 n ASN 143 N -4.06 -3.78 -1.60 3.99 4.13 -1.26 -1.34 115.26 111.34 2x52 n ASN 143 Ca 0.07 0.35 -0.18 0.00 1.68 0.00 0.00 54.58 56.50 2x52 n ASN 143 Cb 0.59 -3.49 -0.07 0.00 -1.54 0.00 0.00 39.78 35.26 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 -0.65 -4.87 -4.66 6.41 5.15 -1.26 -4.95 115.26 110.44 2x52 n ASN 144 Ca -0.14 0.42 -0.38 0.00 -0.60 0.00 0.00 54.58 53.88 2x52 n ASN 144 Cb 0.47 -4.34 0.05 0.00 -0.53 0.00 0.00 39.78 35.44 2x52 n ASN 144 CO 0.00 0.00 0.00 -1.22 1.40 0.00 0.00 177.26 177.44 2x52 n TYR 145 N -2.34 1.34 -2.76 1.20 4.01 -0.45 -1.06 117.16 117.10 2x52 n TYR 145 Ca -0.19 0.44 -0.40 0.00 -0.16 0.00 0.00 57.90 57.59 2x52 n TYR 145 Cb 0.61 -2.21 -0.06 0.00 -0.31 0.00 0.00 39.34 37.37 2x52 n TYR 145 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 2x52 s SER 148 N 1.72 2.60 0.14 0.00 1.04 -0.22 0.39 113.70 119.37 2x52 s SER 148 Ca 0.13 1.01 0.16 0.00 0.48 0.00 0.00 55.95 57.73 2x52 s SER 148 Cb -0.16 -1.59 0.71 0.00 0.10 0.00 0.00 66.02 65.08 2x52 s SER 148 CO 0.11 -3.12 1.48 2.29 0.98 0.00 0.00 173.24 174.98 2x52 n LYS 149 N -4.15 0.09 0.00 4.02 2.85 -0.97 -1.68 118.16 118.32 2x52 n LYS 149 Ca 0.07 0.43 0.11 0.00 -1.05 0.00 0.00 58.31 57.87 2x52 n LYS 149 Cb 0.58 -1.70 0.07 0.00 -0.65 0.00 0.00 35.03 33.33 2x52 n LYS 149 CO 0.00 0.00 0.00 0.91 -0.05 0.00 0.00 177.40 178.26 2x52 n TRP 150 N -1.87 0.00 -2.18 5.58 5.03 -1.26 -4.98 117.44 117.76 2x52 n TRP 150 Ca 0.01 0.00 0.00 0.00 3.03 0.00 0.00 57.50 60.54 2x52 n TRP 150 Cb 0.13 -0.06 0.00 0.00 -1.03 0.00 0.00 31.31 30.35 2x52 n TRP 150 CO 0.00 0.00 0.00 0.41 -0.03 0.00 0.00 177.69 178.07 2x52 n GLY 151 N 1.44 0.87 3.27 6.99 0.00 -0.68 -4.96 105.19 112.11 2x52 n GLY 151 Ca 0.08 -0.66 -0.23 0.00 0.00 0.00 0.00 46.02 45.21 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 -2.91 2.39 0.15 1.61 0.01 -1.26 -1.41 113.70 112.28 2x52 s SER 152 Ca 0.00 -0.67 -0.17 0.00 1.31 0.00 0.00 55.95 56.42 2x52 s SER 152 Cb 0.00 -0.12 -0.07 0.00 0.21 0.00 0.00 66.02 66.04 2x52 s SER 152 CO 0.00 0.03 0.60 0.00 0.41 0.00 0.00 173.24 174.28 2x52 n GLY 154 N 0.99 -0.92 2.95 0.00 0.00 -0.43 -4.98 105.19 102.79 2x52 n GLY 154 Ca -0.06 -0.93 -0.17 0.00 0.00 0.00 0.00 46.02 44.86 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 0.47 0.00 -0.61 1.01 -1.26 -1.07 121.20 116.73 2x52 s ILE 155 Ca 0.00 -0.21 0.00 0.00 0.00 0.00 0.00 60.65 60.44 2x52 s ILE 155 Cb 0.00 -0.43 0.00 0.00 0.01 0.00 0.00 42.46 42.04 2x52 s ILE 155 CO 0.00 0.15 0.00 0.61 0.00 0.00 0.00 174.94 175.70 2x52 n GLY 156 N 3.24 3.35 0.35 6.18 0.00 -1.26 -4.86 105.19 112.18 2x52 n GLY 156 Ca -0.17 -1.62 0.09 0.00 0.00 0.00 0.00 46.02 44.32 2x52 n GLY 156 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 2x52 h PRO 157 N 0.00 0.54 0.00 1.61 0.11 -2.00 0.18 132.00 132.44 2x52 h PRO 157 Ca 0.00 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 66.08 2x52 h PRO 157 Cb 0.00 -0.12 0.00 0.00 0.11 0.00 0.00 31.00 30.99 2x52 h PRO 157 CO 0.00 0.36 0.00 0.41 -0.21 0.00 0.00 178.00 178.56 2x52 n GLY 158 N -1.48 -1.49 0.26 -0.55 0.00 -1.26 -1.61 105.19 99.06 2x52 n GLY 158 Ca 0.09 0.04 -0.19 0.00 0.00 0.00 0.00 46.02 45.96 2x52 n GLY 158 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 2x52 n TYR 159 N -2.29 0.00 0.77 1.61 4.01 -0.44 -4.55 117.16 116.28 2x52 n TYR 159 Ca 0.04 0.00 0.11 0.00 -0.16 0.00 0.00 57.90 57.88 2x52 n TYR 159 Cb 0.33 -0.75 -0.02 0.00 -0.31 0.00 0.00 39.34 38.58 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 1.44 0.94 3.73 0.00 0.00 -0.63 -0.75 105.19 109.92 2x52 n GLY 161 Ca 0.03 -0.63 -0.42 0.00 0.00 0.00 0.00 46.02 44.99 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 2.15 -1.00 4.61 0.00 -1.26 -2.09 120.51 119.92 2x52 n ALA 162 Ca 0.00 0.38 0.00 0.00 0.00 0.00 0.00 53.44 53.82 2x52 n ALA 162 Cb 0.00 -2.41 0.00 0.00 0.00 0.00 0.00 19.45 17.04 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 2.09 0.79 3.69 0.00 0.00 -1.26 -4.64 105.19 105.86 2x52 n GLY 163 Ca 0.09 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.68 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 5.38 0.68 -3.52 0.00 6.02 0.16 -4.96 117.38 121.14 2x52 n GLN 165 Ca 0.18 0.21 -0.08 0.00 -0.01 0.00 0.00 57.00 57.29 2x52 n GLN 165 Cb 0.35 -1.68 -0.02 0.00 1.02 0.00 0.00 30.24 29.91 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 -6.26 -0.38 0.00 1.08 1.04 -1.25 -4.97 113.70 102.96 2x52 s SER 166 Ca -0.14 -0.06 0.00 0.00 0.48 0.00 0.00 55.95 56.23 2x52 s SER 166 Cb 0.07 0.44 0.00 0.00 0.10 0.00 0.00 66.02 66.64 2x52 s SER 166 CO 0.78 -0.73 0.00 0.61 0.98 0.00 0.00 173.24 174.88 2x52 n GLY 167 N -0.30 0.18 1.69 7.32 0.00 -1.26 -0.42 105.19 112.40 2x52 n GLY 167 Ca -0.10 -1.87 -0.03 0.00 0.00 0.00 0.00 46.02 44.02 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 2.41 3.60 -0.02 0.00 -0.22 -4.92 105.19 106.04 2x52 n GLY 168 Ca 0.00 -0.28 -0.41 0.00 0.00 0.00 0.00 46.02 45.33 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 -0.85 5.61 0.00 0.00 1.01 0.08 -5.05 116.67 117.47 2x52 s ASP 170 Ca 0.65 2.39 0.00 0.00 0.71 0.00 0.00 52.55 56.30 2x52 s ASP 170 Cb -0.53 -2.60 0.00 0.00 1.01 0.00 0.00 42.92 40.80 2x52 s ASP 170 CO 0.55 -1.31 0.00 0.61 0.21 0.00 0.00 175.17 175.24