#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3kcm s ASN 30 N 0.00 4.06 0.48 -1.84 2.47 -1.26 -5.00 114.94 113.85 3kcm s ASN 30 Ca 0.00 1.66 -0.03 0.00 0.42 0.00 0.00 52.86 54.91 3kcm s ASN 30 Cb 0.00 -2.35 -0.02 0.00 -1.45 0.00 0.00 41.25 37.43 3kcm s ASN 30 CO 0.00 -2.29 0.75 -2.16 -3.72 0.00 0.00 177.10 169.68 3kcm s PRO 31 N -4.93 3.29 0.37 0.43 0.05 -1.26 -4.60 135.00 128.35 3kcm s PRO 31 Ca 0.62 -0.09 -0.26 0.00 0.05 0.00 0.00 61.00 61.32 3kcm s PRO 31 Cb -0.17 -2.44 -0.12 0.00 0.05 0.00 0.00 34.50 31.82 3kcm s PRO 31 CO 0.56 -0.27 1.13 0.00 0.05 0.00 0.00 177.00 178.48 3kcm n ALA 32 N -2.21 0.61 -1.69 8.56 0.00 0.18 -4.85 120.51 121.10 3kcm n ALA 32 Ca 0.01 0.31 -0.44 0.00 0.00 0.00 0.00 53.44 53.31 3kcm n ALA 32 Cb 0.56 -2.15 -0.03 0.00 0.00 0.00 0.00 19.45 17.83 3kcm n ALA 32 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 3kcm n PRO 33 N 0.36 2.36 -3.05 0.00 -0.02 -1.26 -4.93 135.00 128.45 3kcm n PRO 33 Ca 0.08 0.85 -0.33 0.00 -2.02 0.00 0.00 63.50 62.07 3kcm n PRO 33 Cb 0.37 -2.61 -0.06 0.00 -0.02 0.00 0.00 33.50 31.18 3kcm n PRO 33 CO 0.00 0.00 0.00 0.34 1.98 0.00 0.00 175.50 177.82 3kcm s ASP 34 N 0.74 6.89 0.21 2.55 -1.08 -1.26 -5.00 116.67 119.72 3kcm s ASP 34 Ca 0.73 1.41 -0.19 0.00 -0.52 0.00 0.00 52.55 53.98 3kcm s ASP 34 Cb -0.60 -2.42 0.03 0.00 -1.46 0.00 0.00 42.92 38.46 3kcm s ASP 34 CO 0.41 -0.19 0.57 0.72 0.52 0.00 0.00 175.17 177.21 3kcm s PHE 35 N -1.92 -0.15 -0.11 -5.34 -0.12 -1.26 -5.04 117.98 104.03 3kcm s PHE 35 Ca 0.53 -0.20 -0.04 0.00 -0.05 0.00 0.00 56.93 57.17 3kcm s PHE 35 Cb -0.12 0.47 0.05 0.00 -0.63 0.00 0.00 43.02 42.79 3kcm s PHE 35 CO 0.18 -0.99 0.08 0.99 -0.05 0.00 0.00 175.22 175.43 3kcm s THR 36 N -3.88 -0.11 0.06 -4.49 2.01 -1.26 -1.98 115.64 106.00 3kcm s THR 36 Ca 0.10 0.10 0.05 0.00 0.31 0.00 0.00 61.69 62.25 3kcm s THR 36 Cb -0.02 -0.39 -0.03 0.00 0.01 0.00 0.00 72.50 72.07 3kcm s THR 36 CO -0.01 -0.07 -0.13 -0.76 -0.69 0.00 0.00 174.62 172.96 3kcm s LEU 37 N 2.16 2.26 0.36 4.42 1.43 -0.91 -4.90 118.68 123.50 3kcm s LEU 37 Ca 0.03 -0.58 -0.28 0.00 -1.03 0.00 0.00 54.13 52.28 3kcm s LEU 37 Cb -0.14 -0.47 -0.10 0.00 0.03 0.00 0.00 46.19 45.51 3kcm s LEU 37 CO -0.06 -0.08 1.34 0.20 0.23 0.00 0.00 176.35 177.98 3kcm s ASN 38 N -1.61 6.54 0.83 2.29 -0.87 -1.26 -1.14 114.94 119.71 3kcm s ASN 38 Ca -0.03 2.75 -0.08 0.00 -1.57 0.00 0.00 52.86 53.94 3kcm s ASN 38 Cb -0.10 -2.65 0.16 0.00 -0.02 0.00 0.00 41.25 38.64 3kcm s ASN 38 CO 0.02 -0.70 1.14 0.42 -2.57 0.00 0.00 177.10 175.40 3kcm s THR 39 N -1.17 2.07 0.15 1.60 -4.23 -0.26 -0.46 115.64 113.34 3kcm s THR 39 Ca 0.52 -0.33 -0.17 0.00 -1.18 0.00 0.00 61.69 60.53 3kcm s THR 39 Cb -0.41 -2.75 0.04 0.00 1.34 0.00 0.00 72.50 70.73 3kcm s THR 39 CO 0.54 0.00 1.71 -0.07 -0.54 0.00 0.00 174.62 176.25 3kcm h LEU 40 N -1.02 -0.13 -3.55 4.79 3.38 -1.89 -3.14 115.31 113.75 3kcm h LEU 40 Ca -0.40 0.08 -0.34 0.00 0.09 0.00 0.00 57.88 57.30 3kcm h LEU 40 Cb 1.25 0.14 -0.14 0.00 0.09 0.00 0.00 40.66 41.99 3kcm h LEU 40 CO 0.40 -0.03 0.43 -0.46 0.09 0.00 0.00 178.44 178.86 3kcm n ASN 41 N -5.17 6.51 -0.38 -0.43 6.94 -1.26 -4.89 115.26 116.57 3kcm n ASN 41 Ca 0.01 -3.09 -0.05 0.00 -0.02 0.00 0.00 54.58 51.43 3kcm n ASN 41 Cb 0.17 -1.07 -0.02 0.00 -2.36 0.00 0.00 39.78 36.51 3kcm n ASN 41 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 3kcm n GLY 42 N 0.35 0.65 3.98 4.83 0.00 -1.19 -5.03 105.19 108.80 3kcm n GLY 42 Ca 0.32 -0.18 -0.20 0.00 0.00 0.00 0.00 46.02 45.96 3kcm n GLY 42 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 3kcm s GLU 43 N -1.92 2.45 0.04 1.61 -1.05 -1.26 -4.90 118.70 113.68 3kcm s GLU 43 Ca 0.00 -1.60 0.05 0.00 -0.15 0.00 0.00 54.97 53.28 3kcm s GLU 43 Cb 0.00 -2.54 -0.02 0.00 -0.44 0.00 0.00 34.13 31.13 3kcm s GLU 43 CO 0.00 -0.58 -0.15 0.14 0.95 0.00 0.00 175.26 175.62 3kcm s VAL 44 N -2.58 1.17 -0.07 1.83 -7.23 -1.26 -1.11 120.40 111.15 3kcm s VAL 44 Ca 0.54 -1.05 0.05 0.00 -1.81 0.00 0.00 61.98 59.71 3kcm s VAL 44 Cb -0.06 -1.06 -0.00 0.00 0.56 0.00 0.00 36.38 35.82 3kcm s VAL 44 CO 0.33 0.01 -0.23 -0.69 -0.31 0.00 0.00 175.10 174.21 3kcm s VAL 45 N -0.88 1.91 -0.19 1.32 1.01 -0.30 -4.94 120.40 118.34 3kcm s VAL 45 Ca 0.02 -0.96 -0.01 0.00 0.00 0.00 0.00 61.98 61.02 3kcm s VAL 45 Cb -0.08 -1.63 0.00 0.00 0.00 0.00 0.00 36.38 34.67 3kcm s VAL 45 CO 0.01 0.53 -0.12 -0.75 0.00 0.00 0.00 175.10 174.78 3kcm s LYS 46 N 0.09 3.22 0.11 2.72 2.20 -1.26 -2.14 119.74 124.68 3kcm s LYS 46 Ca -0.10 -0.72 -0.18 0.00 -0.36 0.00 0.00 55.97 54.61 3kcm s LYS 46 Cb -0.15 -2.78 -0.05 0.00 -1.51 0.00 0.00 37.83 33.34 3kcm s LYS 46 CO 0.05 -0.15 1.69 1.25 -0.36 0.00 0.00 175.35 177.83 3kcm h LEU 47 N 7.87 0.36 -2.92 5.43 5.85 -1.80 -2.45 115.31 127.65 3kcm h LEU 47 Ca -0.41 -0.13 0.00 0.00 0.84 0.00 0.00 57.88 58.18 3kcm h LEU 47 Cb 1.16 -0.09 -0.00 0.00 0.37 0.00 0.00 40.66 42.10 3kcm h LEU 47 CO 0.61 0.38 0.01 0.77 -0.34 0.00 0.00 178.44 179.88 3kcm h SER 48 N 0.31 0.00 0.21 1.25 4.64 -1.95 -0.40 113.55 117.62 3kcm h SER 48 Ca 0.09 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.41 3kcm h SER 48 Cb 0.12 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.21 3kcm h SER 48 CO -0.01 0.00 0.00 0.47 -0.87 0.00 0.00 176.83 176.42 3kcm n ASP 49 N -3.13 0.00 -1.06 4.97 8.00 -0.92 -3.19 116.55 121.22 3kcm n ASP 49 Ca -0.03 -0.37 0.08 0.00 0.71 0.00 0.00 54.79 55.18 3kcm n ASP 49 Cb 0.08 -0.14 0.25 0.00 -0.02 0.00 0.00 41.12 41.29 3kcm n ASP 49 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 3kcm n LEU 50 N -1.14 3.76 -4.71 0.64 4.77 -0.16 -4.94 117.00 115.22 3kcm n LEU 50 Ca 0.14 -2.29 -0.41 0.00 -0.03 0.00 0.00 56.01 53.42 3kcm n LEU 50 Cb 0.13 -0.42 0.01 0.00 -2.33 0.00 0.00 43.42 40.81 3kcm n LEU 50 CO 0.15 0.79 0.92 0.29 -1.33 0.00 0.00 177.39 178.21 3kcm n LYS 51 N 0.69 2.03 0.00 3.23 5.02 -1.19 -1.71 118.16 126.23 3kcm n LYS 51 Ca 0.19 0.72 0.00 0.00 -2.02 0.00 0.00 58.31 57.20 3kcm n LYS 51 Cb 0.66 -2.42 0.00 0.00 -0.02 0.00 0.00 35.03 33.25 3kcm n LYS 51 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3kcm n GLY 52 N 0.76 2.14 3.42 0.72 0.00 0.12 -5.03 105.19 107.33 3kcm n GLY 52 Ca 0.06 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.80 3kcm n GLY 52 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3kcm s GLN 53 N -0.70 1.52 0.02 1.61 -0.21 -0.69 -4.87 119.66 116.34 3kcm s GLN 53 Ca 0.00 -1.42 -0.21 0.00 0.02 0.00 0.00 55.36 53.75 3kcm s GLN 53 Cb 0.00 -1.91 -0.06 0.00 1.00 0.00 0.00 33.01 32.05 3kcm s GLN 53 CO 0.00 0.43 0.63 0.54 -2.12 0.00 0.00 175.29 174.77 3kcm s VAL 54 N -1.40 4.84 0.00 1.09 0.11 -0.94 -3.64 120.40 120.47 3kcm s VAL 54 Ca 0.18 1.34 0.06 0.00 -2.93 0.00 0.00 61.98 60.63 3kcm s VAL 54 Cb -0.09 -3.97 -0.02 0.00 -1.53 0.00 0.00 36.38 30.77 3kcm s VAL 54 CO 0.09 0.42 -0.19 -0.69 -3.33 0.00 0.00 175.10 171.40 3kcm s VAL 55 N -0.27 1.52 -0.26 2.04 1.01 -0.18 -1.54 120.40 122.72 3kcm s VAL 55 Ca 0.32 -0.93 -0.07 0.00 0.00 0.00 0.00 61.98 61.30 3kcm s VAL 55 Cb -0.19 -1.29 -0.02 0.00 0.00 0.00 0.00 36.38 34.89 3kcm s VAL 55 CO 0.19 0.34 0.07 -0.63 0.00 0.00 0.00 175.10 175.07 3kcm s ILE 56 N -0.57 4.20 -0.32 2.22 -1.09 -0.38 -0.28 121.20 124.98 3kcm s ILE 56 Ca 0.07 -0.34 -0.09 0.00 -2.23 0.00 0.00 60.65 58.06 3kcm s ILE 56 Cb -0.08 -3.02 0.01 0.00 -1.58 0.00 0.00 42.46 37.78 3kcm s ILE 56 CO 0.00 0.26 0.15 -0.69 -1.23 0.00 0.00 174.94 173.42 3kcm s VAL 57 N 1.58 4.43 -0.21 2.92 1.01 -0.07 -0.79 120.40 129.27 3kcm s VAL 57 Ca 0.05 -0.59 0.02 0.00 0.00 0.00 0.00 61.98 61.45 3kcm s VAL 57 Cb -0.16 -3.32 0.03 0.00 0.00 0.00 0.00 36.38 32.94 3kcm s VAL 57 CO 0.03 -0.00 -0.16 0.21 0.00 0.00 0.00 175.10 175.18 3kcm s ASN 58 N 1.57 3.68 -0.18 3.32 2.47 -0.19 0.27 114.94 125.87 3kcm s ASN 58 Ca 0.03 -0.93 -0.19 0.00 0.42 0.00 0.00 52.86 52.19 3kcm s ASN 58 Cb -0.18 -1.52 -0.03 0.00 -1.45 0.00 0.00 41.25 38.08 3kcm s ASN 58 CO 0.05 -0.08 0.55 -0.36 -3.72 0.00 0.00 177.10 173.55 3kcm s PHE 59 N 1.23 3.40 0.17 0.43 0.40 -0.24 -0.28 117.98 123.09 3kcm s PHE 59 Ca -0.00 0.85 -0.16 0.00 -0.60 0.00 0.00 56.93 57.02 3kcm s PHE 59 Cb -0.16 -2.69 0.02 0.00 0.51 0.00 0.00 43.02 40.71 3kcm s PHE 59 CO -0.10 -0.07 0.45 1.67 0.70 0.00 0.00 175.22 177.87 3kcm s TRP 60 N 1.51 -0.04 0.04 0.36 1.48 -0.99 -2.50 118.94 118.81 3kcm s TRP 60 Ca 0.26 -0.30 -0.05 0.00 -1.06 0.00 0.00 56.10 54.95 3kcm s TRP 60 Cb -0.16 0.28 -0.01 0.00 -1.16 0.00 0.00 33.47 32.42 3kcm s TRP 60 CO 0.10 -0.83 0.08 0.00 -4.06 0.00 0.00 176.95 172.25 3kcm s ALA 61 N -3.88 -0.00 0.32 2.67 0.00 -1.26 -2.06 121.76 117.55 3kcm s ALA 61 Ca 0.09 -0.63 0.02 0.00 0.00 0.00 0.00 51.96 51.44 3kcm s ALA 61 Cb 0.00 0.27 0.53 0.00 0.00 0.00 0.00 23.12 23.93 3kcm s ALA 61 CO -0.04 -0.33 1.86 0.00 0.00 0.00 0.00 175.76 177.24 3kcm h THR 62 N 3.56 1.21 -0.41 0.00 1.03 -1.98 -2.61 112.91 113.71 3kcm h THR 62 Ca -0.33 -0.80 0.00 0.00 -0.01 0.00 0.00 66.41 65.28 3kcm h THR 62 Cb 1.18 0.86 0.00 0.00 -1.07 0.00 0.00 68.15 69.12 3kcm h THR 62 CO 0.52 0.28 0.00 -2.67 -0.01 0.00 0.00 175.52 173.64 3kcm n TRP 63 N -4.28 0.54 -3.68 0.00 4.27 -1.26 -4.83 117.44 108.20 3kcm n TRP 63 Ca 0.02 -0.27 -0.39 0.00 -3.89 0.00 0.00 57.50 52.97 3kcm n TRP 63 Cb 0.24 0.00 -0.11 0.00 -1.36 0.00 0.00 31.31 30.08 3kcm n TRP 63 CO 0.00 0.00 0.00 0.00 -2.29 0.00 0.00 177.69 175.40 3kcm h PRO 65 N 8.30 0.31 -0.28 0.00 0.11 -1.88 -1.36 132.00 137.19 3kcm h PRO 65 Ca -0.22 -0.02 -0.03 0.00 0.11 0.00 0.00 66.00 65.84 3kcm h PRO 65 Cb 1.08 -0.07 -0.02 0.00 0.11 0.00 0.00 31.00 32.10 3kcm h PRO 65 CO 0.68 0.21 0.03 -1.35 -0.21 0.00 0.00 178.00 177.36 3kcm h PRO 66 N 0.32 0.42 -0.26 1.05 0.11 -1.95 -0.42 132.00 131.27 3kcm h PRO 66 Ca 0.31 -0.07 0.05 0.00 0.11 0.00 0.00 66.00 66.41 3kcm h PRO 66 Cb 0.44 -0.07 -0.05 0.00 0.11 0.00 0.00 31.00 31.43 3kcm h PRO 66 CO -0.36 0.42 -0.06 0.00 -0.21 0.00 0.00 178.00 177.79 3kcm h ARG 68 N 0.00 0.00 0.00 0.00 3.08 -0.51 -2.87 114.38 114.08 3kcm h ARG 68 Ca 0.12 0.00 -0.22 0.00 0.07 0.00 0.00 59.98 59.95 3kcm h ARG 68 Cb 0.19 0.00 -0.03 0.00 0.08 0.00 0.00 29.97 30.20 3kcm h ARG 68 CO -0.27 0.07 -1.20 1.49 -1.07 0.00 0.00 179.97 179.00 3kcm h GLU 69 N 0.00 0.00 -0.00 0.04 4.22 -0.11 -3.33 114.58 115.40 3kcm h GLU 69 Ca -0.00 0.00 0.00 0.00 0.08 0.00 0.00 59.36 59.44 3kcm h GLU 69 Cb 0.39 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.64 3kcm h GLU 69 CO 0.01 0.75 -0.34 -0.85 -2.18 0.00 0.00 179.01 176.40 3kcm n GLU 70 N -3.22 0.16 -0.11 1.92 0.28 -0.72 -4.47 120.64 114.48 3kcm n GLU 70 Ca -0.06 -0.08 -0.08 0.00 -0.16 0.00 0.00 57.16 56.79 3kcm n GLU 70 Cb 0.95 -1.50 0.00 0.00 1.43 0.00 0.00 31.44 32.32 3kcm n GLU 70 CO 0.00 0.00 0.00 0.82 -0.16 0.00 0.00 177.13 177.79 3kcm h ILE 71 N 0.19 1.06 0.00 3.84 2.04 -1.66 -2.75 117.51 120.23 3kcm h ILE 71 Ca 0.00 -0.16 -0.03 0.00 1.00 0.00 0.00 64.86 65.67 3kcm h ILE 71 Cb 0.49 0.56 -0.00 0.00 -0.74 0.00 0.00 36.82 37.12 3kcm h ILE 71 CO 0.00 0.08 -0.15 -0.65 0.00 0.00 0.00 178.15 177.44 3kcm h PRO 72 N 0.46 0.00 -5.23 2.37 0.11 -1.84 -3.41 132.00 124.46 3kcm h PRO 72 Ca 0.14 0.00 -0.48 0.00 0.11 0.00 0.00 66.00 65.77 3kcm h PRO 72 Cb -0.02 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 31.06 3kcm h PRO 72 CO -0.05 0.15 1.66 -1.13 -0.21 0.00 0.00 178.00 178.41 3kcm n SER 73 N -4.03 3.32 0.00 -2.05 3.41 -1.04 -4.72 113.62 108.51 3kcm n SER 73 Ca -0.02 -2.74 0.00 0.00 -0.26 0.00 0.00 58.87 55.85 3kcm n SER 73 Cb 0.23 -1.60 0.00 0.00 -0.26 0.00 0.00 64.21 62.59 3kcm n SER 73 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 3kcm n ARG 76 N 7.89 0.00 0.11 4.33 1.74 -1.26 -3.82 116.66 125.65 3kcm n ARG 76 Ca 0.47 0.00 -0.13 0.00 -0.77 0.00 0.00 57.85 57.42 3kcm n ARG 76 Cb 0.45 -0.12 -0.08 0.00 -1.02 0.00 0.00 32.46 31.69 3kcm n ARG 76 CO 0.00 0.00 0.00 1.25 -1.52 0.00 0.00 177.63 177.36 3kcm h LEU 77 N 0.00 -0.18 -0.40 0.55 5.85 -1.85 -2.20 115.31 117.08 3kcm h LEU 77 Ca 0.00 -0.06 0.08 0.00 0.84 0.00 0.00 57.88 58.74 3kcm h LEU 77 Cb 0.00 0.05 -0.08 0.00 0.37 0.00 0.00 40.66 41.00 3kcm h LEU 77 CO 0.00 -0.06 -0.10 -1.13 -0.34 0.00 0.00 178.44 176.81 3kcm h ASN 78 N -0.29 -0.37 -0.13 1.25 -1.24 -1.97 0.28 115.58 113.11 3kcm h ASN 78 Ca -0.02 0.12 -0.03 0.00 0.71 0.00 0.00 56.30 57.08 3kcm h ASN 78 Cb 0.23 0.25 -0.01 0.00 0.73 0.00 0.00 38.32 39.51 3kcm h ASN 78 CO 0.04 -0.13 0.01 0.00 -1.29 0.00 0.00 177.43 176.05 3kcm h ALA 79 N 1.40 1.59 0.00 1.57 0.00 -1.96 -2.94 119.26 118.92 3kcm h ALA 79 Ca 0.19 -0.14 -0.05 0.00 0.00 0.00 0.00 54.91 54.92 3kcm h ALA 79 Cb 0.29 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 17.96 3kcm h ALA 79 CO -0.41 0.30 -0.08 0.00 0.00 0.00 0.00 179.25 179.07 3kcm n ALA 80 N -2.49 4.23 -0.81 0.00 0.00 0.09 -4.94 120.51 116.59 3kcm n ALA 80 Ca 0.00 -0.44 0.00 0.00 0.00 0.00 0.00 53.44 53.01 3kcm n ALA 80 Cb 0.19 -1.45 0.00 0.00 0.00 0.00 0.00 19.45 18.19 3kcm n ALA 80 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3kcm n ALA 82 N 1.84 -2.10 -0.19 0.00 0.00 -1.11 -5.03 120.51 113.92 3kcm n ALA 82 Ca 0.10 0.22 0.00 0.00 0.00 0.00 0.00 53.44 53.76 3kcm n ALA 82 Cb 0.54 -0.94 0.00 0.00 0.00 0.00 0.00 19.45 19.05 3kcm n ALA 82 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3kcm n GLY 83 N -0.53 0.76 3.62 0.00 0.00 -1.26 -5.08 105.19 102.69 3kcm n GLY 83 Ca 0.00 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.79 3kcm n GLY 83 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3kcm s LYS 84 N -0.69 2.16 -0.93 1.61 1.02 -1.26 -5.03 119.74 116.62 3kcm s LYS 84 Ca 0.00 -1.53 -0.17 0.00 0.02 0.00 0.00 55.97 54.30 3kcm s LYS 84 Cb 0.00 -2.06 -0.10 0.00 -0.52 0.00 0.00 37.83 35.14 3kcm s LYS 84 CO 0.00 0.32 2.05 -0.35 -0.92 0.00 0.00 175.35 176.44 3kcm n PRO 85 N -0.87 1.91 -4.57 -1.68 -0.04 -1.26 -4.83 135.00 123.66 3kcm n PRO 85 Ca -0.06 -1.87 -0.23 0.00 -0.04 0.00 0.00 63.50 61.30 3kcm n PRO 85 Cb 0.60 -2.85 -0.16 0.00 -0.04 0.00 0.00 33.50 31.05 3kcm n PRO 85 CO 0.00 0.00 0.00 0.12 -0.04 0.00 0.00 175.50 175.58 3kcm s PHE 86 N 4.26 1.34 0.07 0.54 5.36 -1.26 -2.21 117.98 126.09 3kcm s PHE 86 Ca 0.52 -0.42 0.00 0.00 -0.96 0.00 0.00 56.93 56.07 3kcm s PHE 86 Cb 0.13 -0.96 -0.00 0.00 -0.34 0.00 0.00 43.02 41.86 3kcm s PHE 86 CO 0.05 -0.19 0.02 0.54 -1.46 0.00 0.00 175.22 174.17 3kcm n ARG 87 N 3.51 1.21 0.00 10.12 5.12 -0.59 -4.97 116.66 131.06 3kcm n ARG 87 Ca -0.21 -0.58 0.00 0.00 -1.93 0.00 0.00 57.85 55.13 3kcm n ARG 87 Cb 0.53 0.26 0.00 0.00 -1.16 0.00 0.00 32.46 32.08 3kcm n ARG 87 CO 0.00 0.00 0.00 1.28 -1.93 0.00 0.00 177.63 176.98 3kcm n LEU 89 N 0.00 0.00 -4.25 0.55 4.77 0.03 -1.25 117.00 116.85 3kcm n LEU 89 Ca -0.02 0.00 -0.43 0.00 -0.03 0.00 0.00 56.01 55.53 3kcm n LEU 89 Cb 0.10 0.00 -0.06 0.00 -2.33 0.00 0.00 43.42 41.14 3kcm n LEU 89 CO 0.05 0.00 0.20 0.00 -1.33 0.00 0.00 177.39 176.32 3kcm s VAL 91 N 0.58 4.48 -0.08 0.00 1.01 0.62 -1.15 120.40 125.85 3kcm s VAL 91 Ca 0.13 1.67 -0.13 0.00 0.00 0.00 0.00 61.98 63.64 3kcm s VAL 91 Cb -0.19 -4.43 -0.05 0.00 0.00 0.00 0.00 36.38 31.71 3kcm s VAL 91 CO -0.04 -0.54 0.33 -0.55 0.00 0.00 0.00 175.10 174.31 3kcm s SER 92 N 1.74 6.62 0.00 3.32 0.15 -0.21 -2.34 113.70 122.99 3kcm s SER 92 Ca 0.45 0.74 0.25 0.00 0.70 0.00 0.00 55.95 58.09 3kcm s SER 92 Cb -0.12 -2.20 0.48 0.00 -1.71 0.00 0.00 66.02 62.47 3kcm s SER 92 CO 0.17 0.25 1.39 -0.38 1.20 0.00 0.00 173.24 175.87 3kcm n ILE 93 N 2.50 0.00 -1.57 6.45 -0.00 -0.87 -1.82 119.36 124.04 3kcm n ILE 93 Ca -0.14 -0.10 -0.47 0.00 -0.00 0.00 0.00 62.75 62.04 3kcm n ILE 93 Cb 0.53 0.55 -0.05 0.00 -0.00 0.00 0.00 39.64 40.66 3kcm n ILE 93 CO 0.00 0.00 0.00 0.47 -0.00 0.00 0.00 176.55 177.02 3kcm n ASP 94 N -0.86 2.96 -0.39 4.38 8.00 -1.26 -4.61 116.55 124.76 3kcm n ASP 94 Ca 0.09 0.53 0.34 0.00 0.71 0.00 0.00 54.79 56.46 3kcm n ASP 94 Cb 0.36 -1.40 0.57 0.00 -0.02 0.00 0.00 41.12 40.63 3kcm n ASP 94 CO 0.00 0.00 0.00 1.21 -0.39 0.00 0.00 177.20 178.02 3kcm n GLU 95 N 7.88 -0.03 0.25 -1.24 4.07 -1.26 -0.74 120.64 129.56 3kcm n GLU 95 Ca 0.31 1.06 0.14 0.00 -0.06 0.00 0.00 57.16 58.61 3kcm n GLU 95 Cb 0.32 -2.08 0.45 0.00 -0.06 0.00 0.00 31.44 30.07 3kcm n GLU 95 CO 0.00 0.00 0.00 0.78 -0.06 0.00 0.00 177.13 177.85 3kcm h GLY 96 N 0.00 0.00 0.00 8.31 0.00 -1.93 -3.48 103.07 105.96 3kcm h GLY 96 Ca 0.74 0.00 0.00 0.00 0.00 0.00 0.00 47.33 48.07 3kcm h GLY 96 CO -0.40 0.00 0.00 0.61 0.00 0.00 0.00 176.54 176.75 3kcm n GLY 97 N 0.48 1.74 0.24 4.60 0.00 0.08 -3.42 105.19 108.91 3kcm n GLY 97 Ca 0.02 -0.62 -0.12 0.00 0.00 0.00 0.00 46.02 45.30 3kcm n GLY 97 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 3kcm h LYS 98 N 0.00 -0.36 -0.65 1.61 3.64 -1.93 -2.16 116.57 116.72 3kcm h LYS 98 Ca 0.00 0.02 0.14 0.00 -1.27 0.00 0.00 60.65 59.54 3kcm h LYS 98 Cb 0.00 0.08 -0.11 0.00 -0.41 0.00 0.00 32.23 31.79 3kcm h LYS 98 CO 0.00 -0.24 -0.04 0.28 -2.27 0.00 0.00 179.45 177.18 3kcm h VAL 99 N -0.37 0.43 -0.15 2.00 2.07 -2.00 0.88 116.25 119.11 3kcm h VAL 99 Ca 0.03 -0.03 -0.00 0.00 0.82 0.00 0.00 66.70 67.52 3kcm h VAL 99 Cb 0.41 0.34 -0.01 0.00 -1.52 0.00 0.00 31.29 30.51 3kcm h VAL 99 CO -0.13 0.02 0.08 0.00 0.02 0.00 0.00 177.57 177.56 3kcm h ALA 100 N 1.61 0.19 -0.26 1.67 0.00 -1.52 -1.61 119.26 119.34 3kcm h ALA 100 Ca 0.34 -0.05 -0.11 0.00 0.00 0.00 0.00 54.91 55.09 3kcm h ALA 100 Cb 0.55 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 18.28 3kcm h ALA 100 CO -0.59 -0.28 -0.27 0.28 0.00 0.00 0.00 179.25 178.39 3kcm h VAL 101 N 0.15 1.31 0.17 0.00 2.07 -0.71 -1.97 116.25 117.27 3kcm h VAL 101 Ca 0.05 -1.44 0.01 0.00 0.82 0.00 0.00 66.70 66.14 3kcm h VAL 101 Cb 0.06 1.65 -0.03 0.00 -1.52 0.00 0.00 31.29 31.44 3kcm h VAL 101 CO -0.01 0.46 -0.31 -0.33 0.02 0.00 0.00 177.57 177.39 3kcm h GLU 102 N 0.36 -0.55 -0.70 1.57 4.39 -0.85 0.93 114.58 119.74 3kcm h GLU 102 Ca 0.04 0.04 0.13 0.00 0.34 0.00 0.00 59.36 59.91 3kcm h GLU 102 Cb 0.84 0.12 -0.13 0.00 -0.10 0.00 0.00 28.75 29.48 3kcm h GLU 102 CO 0.07 -0.36 -0.23 0.93 -1.16 0.00 0.00 179.01 178.25 3kcm h GLU 103 N -0.57 -0.05 -0.47 2.33 5.08 -1.25 0.10 114.58 119.76 3kcm h GLU 103 Ca 0.02 0.00 -0.07 0.00 -1.00 0.00 0.00 59.36 58.31 3kcm h GLU 103 Cb 0.58 0.01 -0.02 0.00 0.50 0.00 0.00 28.75 29.81 3kcm h GLU 103 CO -0.15 -0.03 0.00 0.35 -1.00 0.00 0.00 179.01 178.18 3kcm h PHE 104 N -0.05 0.82 -0.28 4.33 3.57 -0.88 -2.88 116.94 121.58 3kcm h PHE 104 Ca 0.32 -0.11 -0.13 0.00 3.53 0.00 0.00 57.97 61.58 3kcm h PHE 104 Cb 0.54 -0.23 -0.00 0.00 2.79 0.00 0.00 35.95 39.05 3kcm h PHE 104 CO -0.61 0.76 -0.32 0.74 -2.23 0.00 0.00 178.31 176.66 3kcm h PHE 105 N 0.72 0.85 -0.76 0.41 0.04 0.62 -3.09 116.94 115.73 3kcm h PHE 105 Ca 0.14 -0.27 0.12 0.00 2.80 0.00 0.00 57.97 60.77 3kcm h PHE 105 Cb 0.44 -0.18 -0.08 0.00 2.20 0.00 0.00 35.95 38.33 3kcm h PHE 105 CO 0.02 1.02 0.36 -0.09 -0.60 0.00 0.00 178.31 179.03 3kcm h ARG 106 N 0.44 0.55 0.00 1.51 9.65 -0.75 0.65 114.38 126.44 3kcm h ARG 106 Ca 0.04 -0.03 0.00 0.00 -1.10 0.00 0.00 59.98 58.89 3kcm h ARG 106 Cb 0.89 -0.13 0.00 0.00 -1.39 0.00 0.00 29.97 29.35 3kcm h ARG 106 CO 0.08 0.37 -0.58 1.63 2.80 0.00 0.00 179.97 184.26 3kcm n LYS 107 N -4.90 0.10 -0.04 0.20 5.02 -1.10 -3.63 118.16 113.82 3kcm n LYS 107 Ca 0.13 0.02 -0.02 0.00 -2.02 0.00 0.00 58.31 56.42 3kcm n LYS 107 Cb 0.35 -1.55 -0.08 0.00 -0.02 0.00 0.00 35.03 33.73 3kcm n LYS 107 CO 0.00 0.00 0.00 0.25 -0.52 0.00 0.00 177.40 177.13 3kcm n THR 108 N -1.69 0.48 -1.00 -0.18 -2.24 -1.16 -5.01 114.28 103.47 3kcm n THR 108 Ca 0.05 -0.36 -0.00 0.00 -2.27 0.00 0.00 64.05 61.47 3kcm n THR 108 Cb 0.37 -0.48 -0.00 0.00 -2.10 0.00 0.00 70.33 68.12 3kcm n THR 108 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3kcm n GLY 109 N 2.28 0.41 3.84 3.38 0.00 0.23 -5.05 105.19 110.28 3kcm n GLY 109 Ca -0.12 -0.95 -0.32 0.00 0.00 0.00 0.00 46.02 44.63 3kcm n GLY 109 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3kcm s PHE 110 N -2.00 3.44 -0.02 1.61 2.99 -1.18 -5.03 117.98 117.78 3kcm s PHE 110 Ca 0.00 1.45 -0.05 0.00 0.00 0.00 0.00 56.93 58.33 3kcm s PHE 110 Cb 0.00 -2.77 0.01 0.00 0.00 0.00 0.00 43.02 40.26 3kcm s PHE 110 CO 0.00 -0.31 0.12 -0.08 -0.00 0.00 0.00 175.22 174.95 3kcm s THR 111 N -2.55 0.04 -0.02 0.64 -1.32 -1.26 -4.71 115.64 106.47 3kcm s THR 111 Ca 0.59 -0.36 -0.17 0.00 -1.21 0.00 0.00 61.69 60.54 3kcm s THR 111 Cb -0.10 -0.29 0.03 0.00 -1.51 0.00 0.00 72.50 70.63 3kcm s THR 111 CO 0.29 -0.20 0.35 -0.76 -2.21 0.00 0.00 174.62 172.10 3kcm s LEU 112 N -0.64 0.67 -0.52 9.08 1.43 -1.26 -5.09 118.68 122.35 3kcm s LEU 112 Ca -0.07 0.17 -0.28 0.00 -1.03 0.00 0.00 54.13 52.92 3kcm s LEU 112 Cb -0.04 1.42 0.00 0.00 0.03 0.00 0.00 46.19 47.60 3kcm s LEU 112 CO 0.01 -0.46 1.54 -2.16 0.23 0.00 0.00 176.35 175.50 3kcm s PRO 113 N -1.30 3.24 -0.02 1.29 0.04 -1.26 -4.97 135.00 132.03 3kcm s PRO 113 Ca -0.13 0.68 -0.00 0.00 0.04 0.00 0.00 61.00 61.59 3kcm s PRO 113 Cb -0.05 -4.16 -0.04 0.00 0.04 0.00 0.00 34.50 30.30 3kcm s PRO 113 CO 0.05 -2.00 0.04 0.08 0.04 0.00 0.00 177.00 175.21 3kcm s VAL 114 N 6.56 4.45 -0.04 -0.36 1.01 -1.26 -1.13 120.40 129.64 3kcm s VAL 114 Ca 0.60 -0.45 0.07 0.00 0.00 0.00 0.00 61.98 62.19 3kcm s VAL 114 Cb -0.13 -2.99 -0.01 0.00 0.00 0.00 0.00 36.38 33.24 3kcm s VAL 114 CO 0.26 0.40 -0.25 -0.76 0.00 0.00 0.00 175.10 174.76 3kcm s LEU 115 N -1.52 2.05 0.10 3.92 1.43 -0.30 -3.39 118.68 120.97 3kcm s LEU 115 Ca 0.20 -0.48 -0.26 0.00 -1.03 0.00 0.00 54.13 52.56 3kcm s LEU 115 Cb -0.12 -1.31 -0.07 0.00 0.03 0.00 0.00 46.19 44.73 3kcm s LEU 115 CO 0.10 0.27 0.80 -0.76 0.23 0.00 0.00 176.35 176.99 3kcm s LEU 116 N -0.34 4.51 -0.33 1.79 2.01 0.39 -1.04 118.68 125.68 3kcm s LEU 116 Ca 0.02 1.58 0.17 0.00 0.01 0.00 0.00 54.13 55.91 3kcm s LEU 116 Cb -0.12 -3.31 0.45 0.00 0.01 0.00 0.00 46.19 43.22 3kcm s LEU 116 CO 0.02 0.08 1.11 -0.67 1.01 0.00 0.00 176.35 177.89 3kcm n ASP 117 N 2.32 0.55 -0.28 2.29 2.03 -0.76 -4.46 116.55 118.24 3kcm n ASP 117 Ca -0.03 -2.50 0.27 0.00 0.52 0.00 0.00 54.79 53.05 3kcm n ASP 117 Cb 0.49 -0.11 0.63 0.00 -0.72 0.00 0.00 41.12 41.42 3kcm n ASP 117 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 3kcm h ALA 118 N 2.58 2.63 -0.24 -1.67 0.00 -1.77 -1.54 119.26 119.24 3kcm h ALA 118 Ca -0.17 0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.75 3kcm h ALA 118 Cb 1.23 0.05 0.00 0.00 0.00 0.00 0.00 17.79 19.07 3kcm h ALA 118 CO 0.27 -0.97 0.00 -0.40 0.00 0.00 0.00 179.25 178.15 3kcm n ASP 119 N -4.40 2.25 0.00 0.00 3.85 -1.26 -4.40 116.55 112.58 3kcm n ASP 119 Ca 0.23 -1.81 0.00 0.00 -0.71 0.00 0.00 54.79 52.50 3kcm n ASP 119 Cb 0.99 -0.15 0.00 0.00 -1.35 0.00 0.00 41.12 40.60 3kcm n ASP 119 CO 0.00 0.00 0.00 0.29 -1.01 0.00 0.00 177.20 176.48 3kcm n LYS 120 N 0.71 -0.01 0.08 0.11 4.76 -0.58 -4.90 118.16 118.32 3kcm n LYS 120 Ca 0.17 0.00 -0.12 0.00 -2.87 0.00 0.00 58.31 55.50 3kcm n LYS 120 Cb 0.42 -2.70 -0.05 0.00 -1.84 0.00 0.00 35.03 30.86 3kcm n LYS 120 CO 0.00 0.00 0.00 -0.09 -1.37 0.00 0.00 177.40 175.94 3kcm h ARG 121 N 2.63 -0.35 -0.28 1.97 2.43 -1.92 0.62 114.38 119.49 3kcm h ARG 121 Ca 0.00 0.02 -0.12 0.00 -0.81 0.00 0.00 59.98 59.07 3kcm h ARG 121 Cb 0.01 0.08 -0.01 0.00 -0.42 0.00 0.00 29.97 29.62 3kcm h ARG 121 CO 0.00 -0.23 -0.34 0.28 -1.51 0.00 0.00 179.97 178.17 3kcm h VAL 122 N -0.36 1.29 -0.51 0.20 2.07 -1.91 0.12 116.25 117.14 3kcm h VAL 122 Ca 0.05 -1.47 0.10 0.00 0.82 0.00 0.00 66.70 66.20 3kcm h VAL 122 Cb 0.41 1.44 -0.10 0.00 -1.52 0.00 0.00 31.29 31.52 3kcm h VAL 122 CO -0.16 0.47 -0.23 1.23 0.02 0.00 0.00 177.57 178.90 3kcm h GLY 123 N 1.02 0.14 1.73 2.17 0.00 -1.73 -0.49 103.07 105.90 3kcm h GLY 123 Ca 0.06 0.29 -0.07 0.00 0.00 0.00 0.00 47.33 47.61 3kcm h GLY 123 CO 0.07 -0.22 -0.19 0.50 0.00 0.00 0.00 176.54 176.70 3kcm h LYS 124 N -0.11 0.32 0.00 4.80 1.57 0.14 -2.81 116.57 120.48 3kcm h LYS 124 Ca 0.24 -0.10 -0.10 0.00 -1.87 0.00 0.00 60.65 58.82 3kcm h LYS 124 Cb 0.48 -0.03 -0.01 0.00 0.08 0.00 0.00 32.23 32.74 3kcm h LYS 124 CO -0.58 0.51 -0.47 1.25 -0.57 0.00 0.00 179.45 179.59 3kcm h LEU 125 N 0.30 0.00 -1.03 2.94 5.85 0.19 -3.07 115.31 120.50 3kcm h LEU 125 Ca 0.05 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.77 3kcm h LEU 125 Cb 0.51 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.54 3kcm h LEU 125 CO 0.03 0.47 0.00 -1.22 -0.34 0.00 0.00 178.44 177.38 3kcm n TYR 126 N -3.72 0.02 -1.78 1.25 4.02 -0.29 -4.94 117.16 111.73 3kcm n TYR 126 Ca -0.01 -0.01 -0.13 0.00 -0.01 0.00 0.00 57.90 57.74 3kcm n TYR 126 Cb 0.53 0.00 -0.03 0.00 -0.02 0.00 0.00 39.34 39.82 3kcm n TYR 126 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 3kcm n GLY 127 N 1.18 0.66 3.72 2.72 0.00 -1.11 -5.00 105.19 107.36 3kcm n GLY 127 Ca 0.19 -0.39 -0.38 0.00 0.00 0.00 0.00 46.02 45.44 3kcm n GLY 127 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3kcm n THR 128 N -3.27 4.13 0.23 2.61 -2.24 -1.09 -4.94 114.28 109.71 3kcm n THR 128 Ca -0.14 -0.50 0.03 0.00 -2.27 0.00 0.00 64.05 61.17 3kcm n THR 128 Cb 0.51 -1.53 -0.04 0.00 -2.10 0.00 0.00 70.33 67.18 3kcm n THR 128 CO 0.00 0.00 0.00 0.41 -0.57 0.00 0.00 175.07 174.91 3kcm n THR 129 N -1.38 0.00 0.00 4.28 -1.04 -1.26 -4.92 114.28 109.96 3kcm n THR 129 Ca 0.13 -0.32 0.00 0.00 -2.04 0.00 0.00 64.05 61.82 3kcm n THR 129 Cb 0.46 0.88 0.00 0.00 -1.82 0.00 0.00 70.33 69.84 3kcm n THR 129 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 3kcm n GLY 130 N 1.34 -0.97 3.26 3.41 0.00 -1.26 -5.18 105.19 105.79 3kcm n GLY 130 Ca 0.01 -1.10 -0.26 0.00 0.00 0.00 0.00 46.02 44.67 3kcm n GLY 130 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3kcm s VAL 131 N -2.00 1.71 0.46 1.61 -7.23 -1.26 -4.18 120.40 109.52 3kcm s VAL 131 Ca 0.00 -1.27 -0.13 0.00 -1.81 0.00 0.00 61.98 58.77 3kcm s VAL 131 Cb 0.00 -1.49 -0.07 0.00 0.56 0.00 0.00 36.38 35.38 3kcm s VAL 131 CO 0.00 0.18 0.88 -2.16 -0.31 0.00 0.00 175.10 173.69 3kcm s PRO 132 N -1.29 3.86 -0.05 4.82 0.04 -1.26 -4.82 135.00 136.29 3kcm s PRO 132 Ca 0.08 0.71 -0.02 0.00 0.04 0.00 0.00 61.00 61.81 3kcm s PRO 132 Cb -0.09 -2.26 0.03 0.00 0.04 0.00 0.00 34.50 32.23 3kcm s PRO 132 CO 0.02 -0.16 0.08 -2.00 0.04 0.00 0.00 177.00 174.98 3kcm s GLU 133 N -3.99 -0.03 -0.05 4.56 2.12 -1.04 -1.57 118.70 118.70 3kcm s GLU 133 Ca 0.55 0.38 0.06 0.00 0.36 0.00 0.00 54.97 56.32 3kcm s GLU 133 Cb -0.10 -0.37 -0.02 0.00 0.26 0.00 0.00 34.13 33.91 3kcm s GLU 133 CO 0.32 -0.27 -0.23 0.99 -0.54 0.00 0.00 175.26 175.52 3kcm s THR 134 N 1.85 2.24 -0.16 -1.70 2.01 0.19 -1.08 115.64 118.99 3kcm s THR 134 Ca 0.00 -1.02 -0.01 0.00 0.31 0.00 0.00 61.69 60.97 3kcm s THR 134 Cb -0.12 -1.81 -0.01 0.00 0.01 0.00 0.00 72.50 70.56 3kcm s THR 134 CO -0.04 0.57 -0.10 -0.36 -0.69 0.00 0.00 174.62 174.00 3kcm s PHE 135 N -0.38 2.87 -0.18 4.92 0.40 0.14 0.38 117.98 126.13 3kcm s PHE 135 Ca 0.03 -0.72 -0.07 0.00 -0.60 0.00 0.00 56.93 55.57 3kcm s PHE 135 Cb -0.12 -1.92 -0.04 0.00 0.51 0.00 0.00 43.02 41.45 3kcm s PHE 135 CO 0.02 -0.30 0.06 0.08 0.70 0.00 0.00 175.22 175.78 3kcm s VAL 136 N 0.67 4.78 -0.09 -0.44 1.01 -0.35 -0.89 120.40 125.09 3kcm s VAL 136 Ca -0.05 -0.04 0.04 0.00 0.00 0.00 0.00 61.98 61.93 3kcm s VAL 136 Cb -0.15 -3.15 0.00 0.00 0.00 0.00 0.00 36.38 33.07 3kcm s VAL 136 CO 0.02 0.46 -0.23 -0.63 0.00 0.00 0.00 175.10 174.72 3kcm s ILE 137 N 0.38 1.97 0.86 2.22 1.01 0.62 0.70 121.20 128.95 3kcm s ILE 137 Ca 0.03 -0.97 -0.12 0.00 0.00 0.00 0.00 60.65 59.59 3kcm s ILE 137 Cb -0.12 -1.70 0.13 0.00 0.01 0.00 0.00 42.46 40.78 3kcm s ILE 137 CO 0.00 0.54 1.21 1.51 0.00 0.00 0.00 174.94 178.20 3kcm s ASP 138 N 0.33 3.93 0.62 3.58 1.47 -0.34 -1.01 116.67 125.25 3kcm s ASP 138 Ca -0.17 0.45 0.27 0.00 1.18 0.00 0.00 52.55 54.27 3kcm s ASP 138 Cb -0.17 -0.76 1.36 0.00 -0.34 0.00 0.00 42.92 43.01 3kcm s ASP 138 CO 0.08 -2.23 1.78 0.03 0.68 0.00 0.00 175.17 175.51 3kcm h ARG 139 N -1.22 0.00 -0.10 2.11 3.08 -1.86 -0.90 114.38 115.48 3kcm h ARG 139 Ca -0.45 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.60 3kcm h ARG 139 Cb 1.28 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.33 3kcm h ARG 139 CO 0.52 0.00 0.00 0.72 -1.07 0.00 0.00 179.97 180.14 3kcm n HIS 140 N -3.32 0.11 -0.75 3.04 8.25 -1.26 0.14 115.22 121.43 3kcm n HIS 140 Ca 0.06 -0.06 0.00 0.00 -0.26 0.00 0.00 57.72 57.46 3kcm n HIS 140 Cb 0.69 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.80 3kcm n HIS 140 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3kcm n GLY 141 N 1.20 0.63 3.85 -1.41 0.00 -0.34 -4.96 105.19 104.15 3kcm n GLY 141 Ca 0.17 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.84 3kcm n GLY 141 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3kcm s VAL 142 N -2.04 4.93 0.13 1.61 1.01 -1.26 0.48 120.40 125.26 3kcm s VAL 142 Ca 0.00 0.74 -0.31 0.00 0.00 0.00 0.00 61.98 62.41 3kcm s VAL 142 Cb 0.00 -3.72 -0.09 0.00 0.00 0.00 0.00 36.38 32.57 3kcm s VAL 142 CO 0.00 0.30 1.60 -0.63 0.00 0.00 0.00 175.10 176.37 3kcm s ILE 143 N -1.40 2.78 -0.16 2.22 1.01 -1.26 -1.20 121.20 123.19 3kcm s ILE 143 Ca 0.35 0.46 -0.07 0.00 0.00 0.00 0.00 60.65 61.39 3kcm s ILE 143 Cb -0.15 -3.30 -0.23 0.00 0.01 0.00 0.00 42.46 38.79 3kcm s ILE 143 CO 0.18 0.02 0.23 -0.11 0.00 0.00 0.00 174.94 175.27 3kcm n LEU 144 N 4.55 2.58 -3.64 2.97 7.94 0.22 -4.90 117.00 126.72 3kcm n LEU 144 Ca 0.15 0.19 -0.08 0.00 -1.11 0.00 0.00 56.01 55.15 3kcm n LEU 144 Cb 0.39 -1.06 -0.07 0.00 0.53 0.00 0.00 43.42 43.21 3kcm n LEU 144 CO 0.62 0.79 0.45 -0.75 -1.11 0.00 0.00 177.39 177.39 3kcm s LYS 145 N -2.53 0.67 -0.19 1.96 2.20 -1.16 -5.00 119.74 115.70 3kcm s LYS 145 Ca -0.26 1.03 -0.03 0.00 -0.36 0.00 0.00 55.97 56.35 3kcm s LYS 145 Cb 0.07 0.20 -0.02 0.00 -1.51 0.00 0.00 37.83 36.57 3kcm s LYS 145 CO 0.71 -0.12 -0.05 0.21 -0.36 0.00 0.00 175.35 175.74 3kcm s LYS 146 N 1.19 3.49 -0.21 4.03 2.20 -1.26 -1.21 119.74 127.96 3kcm s LYS 146 Ca -0.06 -0.59 -0.02 0.00 -0.36 0.00 0.00 55.97 54.93 3kcm s LYS 146 Cb -0.05 -2.93 0.00 0.00 -1.51 0.00 0.00 37.83 33.34 3kcm s LYS 146 CO -0.13 0.01 -0.09 0.08 -0.36 0.00 0.00 175.35 174.86 3kcm s VAL 147 N 0.95 2.98 -0.07 4.02 1.01 0.16 -4.99 120.40 124.46 3kcm s VAL 147 Ca -0.00 -0.64 -0.11 0.00 0.00 0.00 0.00 61.98 61.23 3kcm s VAL 147 Cb -0.15 -2.34 -0.05 0.00 0.00 0.00 0.00 36.38 33.85 3kcm s VAL 147 CO 0.01 0.45 0.26 -0.69 0.00 0.00 0.00 175.10 175.13 3kcm s VAL 148 N 1.42 5.29 0.00 2.92 1.01 -1.26 0.53 120.40 130.31 3kcm s VAL 148 Ca 0.05 0.50 0.00 0.00 0.00 0.00 0.00 61.98 62.54 3kcm s VAL 148 Cb -0.14 -3.55 0.00 0.00 0.00 0.00 0.00 36.38 32.69 3kcm s VAL 148 CO -0.06 0.59 0.00 0.61 0.00 0.00 0.00 175.10 176.24 3kcm n GLY 149 N 1.96 -1.77 3.74 4.51 0.00 -0.61 -4.99 105.19 108.03 3kcm n GLY 149 Ca -0.17 -1.53 -0.29 0.00 0.00 0.00 0.00 46.02 44.03 3kcm n GLY 149 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3kcm s ALA 150 N -2.12 1.40 -0.43 4.61 0.00 -1.26 -4.78 121.76 119.19 3kcm s ALA 150 Ca 0.00 -0.46 -0.11 0.00 0.00 0.00 0.00 51.96 51.39 3kcm s ALA 150 Cb 0.00 -3.07 0.08 0.00 0.00 0.00 0.00 23.12 20.13 3kcm s ALA 150 CO 0.00 -2.54 0.29 -1.21 0.00 0.00 0.00 175.76 172.30 3kcm s GLU 152 N -5.15 2.69 0.13 0.00 0.41 -1.26 -5.07 118.70 110.46 3kcm s GLU 152 Ca 0.64 -1.42 0.25 0.00 -0.41 0.00 0.00 54.97 54.03 3kcm s GLU 152 Cb -0.16 -3.85 0.94 0.00 -1.78 0.00 0.00 34.13 29.27 3kcm s GLU 152 CO 0.55 -0.96 1.77 0.91 -0.49 0.00 0.00 175.26 177.04 3kcm n TRP 153 N 4.98 0.54 1.26 1.61 7.02 -1.26 -3.29 117.44 128.30 3kcm n TRP 153 Ca -0.11 0.17 0.13 0.00 -1.02 0.00 0.00 57.50 56.68 3kcm n TRP 153 Cb 0.43 -0.78 0.41 0.00 -2.42 0.00 0.00 31.31 28.95 3kcm n TRP 153 CO 0.00 0.00 0.00 -0.40 -2.02 0.00 0.00 177.69 175.27 3kcm n ASP 154 N -1.95 0.95 -4.77 -0.99 3.85 -1.25 -4.62 116.55 107.77 3kcm n ASP 154 Ca 0.05 -0.84 -0.40 0.00 -0.71 0.00 0.00 54.79 52.88 3kcm n ASP 154 Cb 0.34 0.11 -0.02 0.00 -1.35 0.00 0.00 41.12 40.20 3kcm n ASP 154 CO 0.00 0.00 0.00 -1.00 -1.01 0.00 0.00 177.20 175.19 3kcm s HIS 155 N -2.50 3.01 0.34 2.11 3.76 -1.21 -4.82 115.29 115.98 3kcm s HIS 155 Ca 0.25 1.42 0.13 0.00 -0.15 0.00 0.00 55.06 56.71 3kcm s HIS 155 Cb 0.19 -3.67 1.05 0.00 1.11 0.00 0.00 32.58 31.27 3kcm s HIS 155 CO 0.51 -1.87 1.64 -1.35 -0.85 0.00 0.00 174.74 172.82 3kcm h PRO 156 N 3.25 0.22 -0.78 8.40 0.11 -1.94 0.31 132.00 141.56 3kcm h PRO 156 Ca -0.49 -0.01 0.11 0.00 0.11 0.00 0.00 66.00 65.71 3kcm h PRO 156 Cb 1.23 -0.05 -0.08 0.00 0.11 0.00 0.00 31.00 32.21 3kcm h PRO 156 CO 0.65 0.14 0.41 0.93 -0.21 0.00 0.00 178.00 179.92 3kcm h GLU 157 N 0.22 0.65 0.17 1.05 3.07 -1.98 -1.45 114.58 116.31 3kcm h GLU 157 Ca 0.72 -0.04 -0.01 0.00 -0.50 0.00 0.00 59.36 59.53 3kcm h GLU 157 Cb 1.66 -0.15 0.00 0.00 -0.84 0.00 0.00 28.75 29.43 3kcm h GLU 157 CO -0.67 0.43 -0.08 0.28 -1.40 0.00 0.00 179.01 177.57 3kcm h VAL 158 N 0.67 0.93 -0.79 3.13 2.07 -1.25 -2.13 116.25 118.87 3kcm h VAL 158 Ca 0.39 -0.43 0.19 0.00 0.82 0.00 0.00 66.70 67.66 3kcm h VAL 158 Cb 0.43 1.19 -0.14 0.00 -1.52 0.00 0.00 31.29 31.26 3kcm h VAL 158 CO -0.29 0.10 0.01 0.40 0.02 0.00 0.00 177.57 177.82 3kcm h ILE 159 N -0.43 0.30 -0.48 4.57 1.08 -1.36 -1.56 117.51 119.63 3kcm h ILE 159 Ca -0.02 -0.03 -0.10 0.00 -0.39 0.00 0.00 64.86 64.31 3kcm h ILE 159 Cb 0.34 0.19 -0.01 0.00 -3.07 0.00 0.00 36.82 34.26 3kcm h ILE 159 CO 0.04 0.02 -0.11 0.00 -0.69 0.00 0.00 178.15 177.41 3kcm h ALA 160 N 1.75 0.65 -0.29 1.87 0.00 -1.16 -1.25 119.26 120.84 3kcm h ALA 160 Ca 0.44 -0.34 0.02 0.00 0.00 0.00 0.00 54.91 55.03 3kcm h ALA 160 Cb 0.79 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 18.39 3kcm h ALA 160 CO -0.70 0.55 0.15 0.35 0.00 0.00 0.00 179.25 179.60 3kcm h PHE 161 N 0.76 0.29 0.05 0.00 3.57 -0.62 -1.28 116.94 119.70 3kcm h PHE 161 Ca 0.12 0.01 -0.00 0.00 3.53 0.00 0.00 57.97 61.63 3kcm h PHE 161 Cb 0.65 -0.09 0.00 0.00 2.79 0.00 0.00 35.95 39.31 3kcm h PHE 161 CO 0.05 0.16 -0.02 -0.07 -2.23 0.00 0.00 178.31 176.20 3kcm h LEU 162 N 0.32 -0.05 -1.05 0.59 3.38 -1.36 -1.64 115.31 115.49 3kcm h LEU 162 Ca 0.12 -0.17 0.11 0.00 0.09 0.00 0.00 57.88 58.03 3kcm h LEU 162 Cb 0.02 0.01 -0.08 0.00 0.09 0.00 0.00 40.66 40.71 3kcm h LEU 162 CO -0.07 0.14 0.63 0.78 0.09 0.00 0.00 178.44 180.00 3kcm h ASN 163 N -0.24 0.92 -0.46 -0.43 2.35 -0.99 -1.20 115.58 115.52 3kcm h ASN 163 Ca -0.01 0.04 0.04 0.00 -0.55 0.00 0.00 56.30 55.82 3kcm h ASN 163 Cb 0.22 -0.15 -0.04 0.00 0.05 0.00 0.00 38.32 38.40 3kcm h ASN 163 CO 0.01 0.52 0.21 -1.13 -1.65 0.00 0.00 177.43 175.39 3kcm h ASN 164 N 1.00 0.29 0.37 5.81 -0.73 -1.10 -2.27 115.58 118.96 3kcm h ASN 164 Ca 0.47 0.03 -0.02 0.00 1.87 0.00 0.00 56.30 58.65 3kcm h ASN 164 Cb 0.43 -0.02 -0.00 0.00 0.27 0.00 0.00 38.32 39.00 3kcm h ASN 164 CO -0.23 0.21 -0.10 -0.33 -0.37 0.00 0.00 177.43 176.60 3kcm h GLU 165 N 0.43 0.00 -0.18 6.67 4.39 -0.46 -2.35 114.58 123.08 3kcm h GLU 165 Ca 0.20 0.00 -0.14 0.00 0.34 0.00 0.00 59.36 59.76 3kcm h GLU 165 Cb 0.14 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 28.78 3kcm h GLU 165 CO -0.16 0.10 -0.48 -0.07 -1.16 0.00 0.00 179.01 177.24 3kcm h LEU 166 N 0.00 0.51 -1.83 1.33 -0.00 -0.69 -3.32 115.31 111.31 3kcm h LEU 166 Ca -0.00 -0.25 -0.02 0.00 -0.00 0.00 0.00 57.88 57.61 3kcm h LEU 166 Cb 0.32 -0.14 -0.00 0.00 -0.00 0.00 0.00 40.66 40.83 3kcm h LEU 166 CO 0.01 0.91 -0.11 0.77 -0.00 0.00 0.00 178.44 180.02 3kcm h SER 167 N 0.37 0.00 -1.03 -0.43 4.64 -1.00 -3.43 113.55 112.68 3kcm h SER 167 Ca 0.02 0.00 -0.56 0.00 -0.47 0.00 0.00 61.79 60.78 3kcm h SER 167 Cb 0.98 0.00 -0.09 0.00 -0.31 0.00 0.00 62.40 62.98 3kcm h SER 167 CO 0.09 0.11 1.46 -0.54 -0.87 0.00 0.00 176.83 177.08 3kcm s LYS 168 N -4.05 3.48 0.00 4.77 1.02 -1.25 -5.15 119.74 118.56 3kcm s LYS 168 Ca -0.02 -1.09 0.00 0.00 0.02 0.00 0.00 55.97 54.88 3kcm s LYS 168 Cb 0.12 -5.34 0.00 0.00 -0.52 0.00 0.00 37.83 32.10 3kcm s LYS 168 CO 0.57 -2.39 0.00 0.00 -0.92 0.00 0.00 175.35 172.61