#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 -0.36 0.13 1.62 0.01 -1.26 -4.97 114.94 110.11 3kcm s ASN 30 Ca 0.00 -0.04 -0.31 0.00 -0.71 0.00 0.00 52.86 51.80 3kcm s ASN 30 Cb 0.00 0.49 -0.10 0.00 0.41 0.00 0.00 41.25 42.04 3kcm s ASN 30 CO 0.00 -0.78 1.81 -2.84 -1.51 0.00 0.00 177.10 173.78 3kcm s PRO 31 N -3.05 4.14 0.15 -0.60 0.02 -1.26 -2.34 135.00 132.05 3kcm s PRO 31 Ca -0.02 2.59 -0.34 0.00 0.02 0.00 0.00 61.00 63.25 3kcm s PRO 31 Cb 0.00 -3.53 -0.15 0.00 0.02 0.00 0.00 34.50 30.84 3kcm s PRO 31 CO -0.07 -0.83 1.39 0.00 -0.33 0.00 0.00 177.00 177.17 3kcm n ALA 32 N 5.47 0.10 -1.77 -1.55 0.00 -0.72 -4.88 120.51 117.17 3kcm n ALA 32 Ca 0.17 0.47 -0.40 0.00 0.00 0.00 0.00 53.44 53.69 3kcm n ALA 32 Cb 0.38 -2.18 0.00 0.00 0.00 0.00 0.00 19.45 17.65 3kcm n ALA 32 CO 0.00 0.00 0.00 -2.14 0.00 0.00 0.00 177.50 175.36 3kcm s PRO 33 N 0.32 3.94 0.23 0.00 0.02 -1.26 -4.97 135.00 133.28 3kcm s PRO 33 Ca 0.78 2.28 -0.21 0.00 0.02 0.00 0.00 61.00 63.87 3kcm s PRO 33 Cb -0.80 -2.78 -0.08 0.00 0.02 0.00 0.00 34.50 30.85 3kcm s PRO 33 CO 0.45 -0.56 0.75 0.34 -0.33 0.00 0.00 177.00 177.66 3kcm s ASP 34 N -0.59 7.10 0.18 2.53 2.15 -1.26 -5.01 116.67 121.77 3kcm s ASP 34 Ca 0.57 1.47 -0.07 0.00 0.43 0.00 0.00 52.55 54.95 3kcm s ASP 34 Cb -0.41 -2.44 -0.02 0.00 -0.30 0.00 0.00 42.92 39.76 3kcm s ASP 34 CO 0.53 0.03 0.25 0.72 -0.17 0.00 0.00 175.17 176.53 3kcm s PHE 35 N -1.52 0.61 -0.25 -5.34 -0.12 -1.26 -5.01 117.98 105.09 3kcm s PHE 35 Ca 0.43 -0.95 -0.04 0.00 -0.05 0.00 0.00 56.93 56.32 3kcm s PHE 35 Cb -0.17 -0.18 0.09 0.00 -0.63 0.00 0.00 43.02 42.12 3kcm s PHE 35 CO 0.21 -0.72 0.12 0.99 -0.05 0.00 0.00 175.22 175.78 3kcm s THR 36 N -4.03 -0.05 0.11 -4.49 2.01 -1.26 -1.92 115.64 106.01 3kcm s THR 36 Ca 0.23 -0.59 0.08 0.00 0.31 0.00 0.00 61.69 61.71 3kcm s THR 36 Cb 0.04 -0.87 -0.03 0.00 0.01 0.00 0.00 72.50 71.64 3kcm s THR 36 CO 0.04 -0.59 -0.19 -0.76 -0.69 0.00 0.00 174.62 172.43 3kcm s LEU 37 N 2.10 2.32 0.79 4.42 1.43 -0.96 -4.91 118.68 123.86 3kcm s LEU 37 Ca 0.07 -0.70 -0.12 0.00 -1.03 0.00 0.00 54.13 52.35 3kcm s LEU 37 Cb -0.16 -0.80 0.07 0.00 0.03 0.00 0.00 46.19 45.33 3kcm s LEU 37 CO -0.28 0.02 1.12 0.20 0.23 0.00 0.00 176.35 177.63 3kcm s ASN 38 N -2.00 4.16 0.44 2.29 -0.87 -1.26 -1.84 114.94 115.87 3kcm s ASN 38 Ca 0.06 2.00 0.07 0.00 -1.57 0.00 0.00 52.86 53.42 3kcm s ASN 38 Cb -0.09 -2.54 -0.02 0.00 -0.02 0.00 0.00 41.25 38.58 3kcm s ASN 38 CO 0.04 -2.27 0.35 0.28 -2.57 0.00 0.00 177.10 172.94 3kcm s THR 39 N -2.66 2.42 0.08 1.60 -1.32 -0.54 -2.21 115.64 113.01 3kcm s THR 39 Ca 0.65 -1.42 0.33 0.00 -1.21 0.00 0.00 61.69 60.04 3kcm s THR 39 Cb -0.20 -2.85 0.37 0.00 -1.51 0.00 0.00 72.50 68.32 3kcm s THR 39 CO 0.53 0.00 1.99 -0.07 -2.21 0.00 0.00 174.62 174.86 3kcm h LEU 40 N 1.04 0.00 -3.83 9.08 3.38 -1.90 -3.29 115.31 119.79 3kcm h LEU 40 Ca -0.41 0.00 -0.53 0.00 0.09 0.00 0.00 57.88 57.03 3kcm h LEU 40 Cb 1.27 0.00 -0.42 0.00 0.09 0.00 0.00 40.66 41.60 3kcm h LEU 40 CO 0.59 0.00 -0.83 -0.46 0.09 0.00 0.00 178.44 177.83 3kcm n ASN 41 N -2.94 4.73 0.00 -0.43 0.23 -1.26 -4.98 115.26 110.61 3kcm n ASN 41 Ca 0.00 -3.67 0.00 0.00 -0.53 0.00 0.00 54.58 50.39 3kcm n ASN 41 Cb 0.26 -0.35 0.00 0.00 -2.08 0.00 0.00 39.78 37.61 3kcm n ASN 41 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 3kcm n GLY 42 N -0.71 0.49 3.95 4.83 0.00 -1.24 -5.06 105.19 107.45 3kcm n GLY 42 Ca 0.42 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 46.16 3kcm n GLY 42 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3kcm s GLU 43 N -0.94 0.97 0.09 1.61 2.02 -1.26 -4.87 118.70 116.32 3kcm s GLU 43 Ca 0.00 -0.58 0.04 0.00 0.02 0.00 0.00 54.97 54.45 3kcm s GLU 43 Cb 0.00 -1.98 -0.03 0.00 0.10 0.00 0.00 34.13 32.21 3kcm s GLU 43 CO 0.00 -2.12 -0.12 0.08 0.02 0.00 0.00 175.26 173.12 3kcm s VAL 44 N -3.68 1.02 -0.07 2.63 1.01 -1.26 -1.47 120.40 118.59 3kcm s VAL 44 Ca 0.71 -1.48 -0.03 0.00 0.00 0.00 0.00 61.98 61.19 3kcm s VAL 44 Cb -0.04 -1.21 0.04 0.00 0.00 0.00 0.00 36.38 35.17 3kcm s VAL 44 CO 0.50 -0.40 0.08 -0.69 0.00 0.00 0.00 175.10 174.59 3kcm s VAL 45 N -1.87 -0.13 -0.11 2.92 1.01 -0.76 -4.96 120.40 116.49 3kcm s VAL 45 Ca 0.02 0.30 -0.09 0.00 0.00 0.00 0.00 61.98 62.21 3kcm s VAL 45 Cb -0.06 -0.25 -0.04 0.00 0.00 0.00 0.00 36.38 36.02 3kcm s VAL 45 CO 0.01 0.09 0.20 -0.75 0.00 0.00 0.00 175.10 174.64 3kcm s LYS 46 N 2.18 3.67 0.13 2.72 2.20 -1.26 -2.27 119.74 127.11 3kcm s LYS 46 Ca 0.04 -0.03 -0.13 0.00 -0.36 0.00 0.00 55.97 55.49 3kcm s LYS 46 Cb -0.13 -3.24 -0.04 0.00 -1.51 0.00 0.00 37.83 32.92 3kcm s LYS 46 CO -0.05 0.67 1.50 1.25 -0.36 0.00 0.00 175.35 178.36 3kcm h LEU 47 N 5.25 0.87 -1.44 5.43 5.85 -1.78 -3.20 115.31 126.30 3kcm h LEU 47 Ca -0.52 -0.42 0.16 0.00 0.84 0.00 0.00 57.88 57.94 3kcm h LEU 47 Cb 1.21 -0.24 -0.06 0.00 0.37 0.00 0.00 40.66 41.94 3kcm h LEU 47 CO 0.62 1.10 0.55 0.28 -0.34 0.00 0.00 178.44 180.65 3kcm h SER 48 N 0.65 0.50 0.00 1.25 0.02 -1.97 0.55 113.55 114.55 3kcm h SER 48 Ca 0.08 0.03 0.00 0.00 -0.84 0.00 0.00 61.79 61.07 3kcm h SER 48 Cb 0.79 -0.06 0.00 0.00 0.14 0.00 0.00 62.40 63.27 3kcm h SER 48 CO 0.06 0.24 0.00 0.47 -1.14 0.00 0.00 176.83 176.47 3kcm n ASP 49 N -4.52 0.00 -0.82 3.07 9.92 -1.21 -2.91 116.55 120.08 3kcm n ASP 49 Ca 0.17 -0.60 0.09 0.00 -0.53 0.00 0.00 54.79 53.92 3kcm n ASP 49 Cb 0.55 0.00 0.12 0.00 -0.64 0.00 0.00 41.12 41.15 3kcm n ASP 49 CO 0.00 0.00 0.00 0.18 0.13 0.00 0.00 177.20 177.51 3kcm n LEU 50 N -0.98 2.80 -4.63 0.64 4.32 0.19 -5.01 117.00 114.33 3kcm n LEU 50 Ca 0.13 -1.27 -0.36 0.00 -0.02 0.00 0.00 56.01 54.50 3kcm n LEU 50 Cb 0.06 -0.10 0.09 0.00 -1.62 0.00 0.00 43.42 41.84 3kcm n LEU 50 CO 0.10 0.56 0.58 0.29 -1.22 0.00 0.00 177.39 177.70 3kcm n LYS 51 N 1.07 0.56 0.00 3.23 5.02 -1.15 -1.41 118.16 125.49 3kcm n LYS 51 Ca 0.13 0.25 0.00 0.00 -2.02 0.00 0.00 58.31 56.67 3kcm n LYS 51 Cb 0.48 -2.26 0.00 0.00 -0.02 0.00 0.00 35.03 33.23 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 1.06 2.97 3.63 0.72 0.00 0.25 -5.02 105.19 108.80 3kcm n GLY 52 Ca 0.13 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.89 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 -0.39 2.29 0.07 1.61 -0.21 -0.50 -4.82 119.66 117.72 3kcm s GLN 53 Ca 0.00 -1.19 -0.19 0.00 0.02 0.00 0.00 55.36 54.00 3kcm s GLN 53 Cb 0.00 -2.28 -0.07 0.00 1.00 0.00 0.00 33.01 31.66 3kcm s GLN 53 CO 0.00 0.44 0.57 0.54 -2.12 0.00 0.00 175.29 174.72 3kcm s VAL 54 N -1.79 4.73 -0.03 1.09 0.11 -1.22 -3.03 120.40 120.26 3kcm s VAL 54 Ca 0.27 1.23 0.03 0.00 -2.93 0.00 0.00 61.98 60.58 3kcm s VAL 54 Cb -0.09 -3.91 0.00 0.00 -1.53 0.00 0.00 36.38 30.86 3kcm s VAL 54 CO 0.18 0.55 -0.11 -0.69 -3.33 0.00 0.00 175.10 171.70 3kcm s VAL 55 N -1.09 0.93 -0.22 2.04 1.01 -0.80 -1.41 120.40 120.86 3kcm s VAL 55 Ca 0.29 -0.43 -0.11 0.00 0.00 0.00 0.00 61.98 61.73 3kcm s VAL 55 Cb -0.20 -0.83 -0.05 0.00 0.00 0.00 0.00 36.38 35.31 3kcm s VAL 55 CO 0.19 0.29 0.19 -0.63 0.00 0.00 0.00 175.10 175.14 3kcm s ILE 56 N 0.23 5.35 -0.22 2.22 -1.09 -0.26 -1.28 121.20 126.15 3kcm s ILE 56 Ca -0.05 0.28 -0.03 0.00 -2.23 0.00 0.00 60.65 58.63 3kcm s ILE 56 Cb -0.10 -3.53 0.00 0.00 -1.58 0.00 0.00 42.46 37.25 3kcm s ILE 56 CO 0.01 0.37 -0.07 -0.69 -1.23 0.00 0.00 174.94 173.33 3kcm s VAL 57 N 0.82 3.10 -0.17 2.92 1.01 -0.40 -0.12 120.40 127.56 3kcm s VAL 57 Ca 0.10 -0.66 0.01 0.00 0.00 0.00 0.00 61.98 61.43 3kcm s VAL 57 Cb -0.13 -2.43 0.03 0.00 0.00 0.00 0.00 36.38 33.85 3kcm s VAL 57 CO 0.03 0.39 -0.13 0.21 0.00 0.00 0.00 175.10 175.60 3kcm s ASN 58 N 1.42 2.98 -0.14 3.32 2.47 -0.57 0.11 114.94 124.53 3kcm s ASN 58 Ca 0.05 -0.64 -0.17 0.00 0.42 0.00 0.00 52.86 52.51 3kcm s ASN 58 Cb -0.14 -1.22 -0.04 0.00 -1.45 0.00 0.00 41.25 38.39 3kcm s ASN 58 CO -0.05 -0.08 0.43 -0.36 -3.72 0.00 0.00 177.10 173.31 3kcm s PHE 59 N 1.44 3.49 0.25 0.43 0.40 0.14 0.13 117.98 124.25 3kcm s PHE 59 Ca 0.03 0.79 -0.04 0.00 -0.60 0.00 0.00 56.93 57.11 3kcm s PHE 59 Cb -0.14 -2.50 -0.02 0.00 0.51 0.00 0.00 43.02 40.87 3kcm s PHE 59 CO -0.10 0.17 0.31 1.67 0.70 0.00 0.00 175.22 177.97 3kcm s TRP 60 N 0.65 0.94 0.06 0.36 1.48 -0.47 -2.41 118.94 119.55 3kcm s TRP 60 Ca 0.23 -1.18 -0.07 0.00 -1.06 0.00 0.00 56.10 54.02 3kcm s TRP 60 Cb -0.14 -0.26 -0.01 0.00 -1.16 0.00 0.00 33.47 31.90 3kcm s TRP 60 CO 0.08 -0.85 0.14 0.00 -4.06 0.00 0.00 176.95 172.26 3kcm s ALA 61 N -3.88 -0.10 0.28 2.67 0.00 -1.26 -1.82 121.76 117.65 3kcm s ALA 61 Ca 0.33 -0.63 -0.03 0.00 0.00 0.00 0.00 51.96 51.63 3kcm s ALA 61 Cb 0.03 0.37 0.38 0.00 0.00 0.00 0.00 23.12 23.89 3kcm s ALA 61 CO 0.14 -0.42 1.88 1.15 0.00 0.00 0.00 175.76 178.51 3kcm h THR 62 N 3.13 1.23 -0.01 0.00 2.02 -1.99 -2.54 112.91 114.75 3kcm h THR 62 Ca -0.33 -0.63 0.00 0.00 0.77 0.00 0.00 66.41 66.22 3kcm h THR 62 Cb 1.19 0.32 0.00 0.00 -1.74 0.00 0.00 68.15 67.91 3kcm h THR 62 CO 0.55 0.27 -0.10 -2.67 0.37 0.00 0.00 175.52 173.93 3kcm n TRP 63 N -4.33 0.00 -2.91 3.16 4.27 -1.26 -4.81 117.44 111.56 3kcm n TRP 63 Ca 0.07 0.00 -0.43 0.00 -3.89 0.00 0.00 57.50 53.25 3kcm n TRP 63 Cb 0.13 -0.06 -0.05 0.00 -1.36 0.00 0.00 31.31 29.97 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 8.93 1.10 0.00 0.00 0.11 -1.87 -1.95 132.00 138.31 3kcm h PRO 65 Ca -0.24 -0.07 -0.08 0.00 0.11 0.00 0.00 66.00 65.72 3kcm h PRO 65 Cb 1.08 -0.25 -0.01 0.00 0.11 0.00 0.00 31.00 31.93 3kcm h PRO 65 CO 0.98 0.73 -0.36 -1.35 -0.21 0.00 0.00 178.00 177.78 3kcm h PRO 66 N 1.13 0.00 0.49 1.05 0.11 -1.93 -2.56 132.00 130.28 3kcm h PRO 66 Ca 0.37 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 66.46 3kcm h PRO 66 Cb 0.05 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.15 3kcm h PRO 66 CO -0.12 0.36 -0.42 0.00 -0.21 0.00 0.00 178.00 177.61 3kcm h ARG 68 N -0.89 0.11 0.04 0.00 3.08 -1.31 -2.41 114.38 113.01 3kcm h ARG 68 Ca -0.06 -0.01 -0.22 0.00 0.07 0.00 0.00 59.98 59.76 3kcm h ARG 68 Cb 0.75 -0.03 -0.01 0.00 0.08 0.00 0.00 29.97 30.76 3kcm h ARG 68 CO -0.02 0.08 -1.01 1.49 -1.07 0.00 0.00 179.97 179.44 3kcm h GLU 69 N 0.12 0.17 -0.00 0.04 4.22 -1.02 -3.19 114.58 114.91 3kcm h GLU 69 Ca 0.48 -0.24 0.00 0.00 0.08 0.00 0.00 59.36 59.68 3kcm h GLU 69 Cb 1.71 0.08 0.00 0.00 0.50 0.00 0.00 28.75 31.04 3kcm h GLU 69 CO -0.07 1.04 -0.24 -0.85 -2.18 0.00 0.00 179.01 176.71 3kcm n GLU 70 N -3.55 0.40 -0.22 1.92 0.28 -0.91 -4.38 120.64 114.18 3kcm n GLU 70 Ca -0.04 -0.18 -0.08 0.00 -0.16 0.00 0.00 57.16 56.70 3kcm n GLU 70 Cb 0.90 -1.50 0.05 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 0.43 1.26 -0.64 3.84 2.04 -1.53 -2.95 117.51 119.97 3kcm h ILE 71 Ca 0.00 -1.08 0.06 0.00 1.00 0.00 0.00 64.86 64.84 3kcm h ILE 71 Cb 0.45 0.69 -0.05 0.00 -0.74 0.00 0.00 36.82 37.17 3kcm h ILE 71 CO 0.00 0.40 0.35 -0.65 0.00 0.00 0.00 178.15 178.25 3kcm h PRO 72 N 1.01 0.64 -5.26 2.37 0.11 -1.80 -3.43 132.00 125.64 3kcm h PRO 72 Ca 0.19 -0.04 -0.13 0.00 0.11 0.00 0.00 66.00 66.13 3kcm h PRO 72 Cb 0.48 -0.14 -0.02 0.00 0.11 0.00 0.00 31.00 31.43 3kcm h PRO 72 CO 0.02 0.42 0.42 -1.54 -0.21 0.00 0.00 178.00 177.11 3kcm s SER 73 N -5.58 4.02 0.00 -2.05 1.04 -1.11 -4.75 113.70 105.26 3kcm s SER 73 Ca -0.13 -1.16 0.00 0.00 0.48 0.00 0.00 55.95 55.14 3kcm s SER 73 Cb 0.16 -2.59 0.00 0.00 0.10 0.00 0.00 66.02 63.68 3kcm s SER 73 CO 0.76 -4.12 0.00 0.54 0.98 0.00 0.00 173.24 171.39 3kcm n ARG 76 N 8.25 0.00 -0.31 4.02 1.74 -1.26 -3.82 116.66 125.28 3kcm n ARG 76 Ca 0.43 0.00 -0.04 0.00 -0.77 0.00 0.00 57.85 57.47 3kcm n ARG 76 Cb 0.47 -0.34 0.09 0.00 -1.02 0.00 0.00 32.46 31.66 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 1.10 -0.18 0.55 5.85 -1.85 -1.50 115.31 119.28 3kcm h LEU 77 Ca 0.00 -0.12 -0.00 0.00 0.84 0.00 0.00 57.88 58.59 3kcm h LEU 77 Cb 0.00 -0.28 -0.01 0.00 0.37 0.00 0.00 40.66 40.74 3kcm h LEU 77 CO 0.00 0.91 0.10 -1.13 -0.34 0.00 0.00 178.44 177.98 3kcm h ASN 78 N 1.21 0.23 -0.60 1.25 -1.24 -1.95 -2.77 115.58 111.70 3kcm h ASN 78 Ca 0.29 -0.09 0.08 0.00 0.71 0.00 0.00 56.30 57.29 3kcm h ASN 78 Cb 0.09 -0.06 -0.06 0.00 0.73 0.00 0.00 38.32 39.02 3kcm h ASN 78 CO -0.04 0.26 0.26 0.00 -1.29 0.00 0.00 177.43 176.61 3kcm h ALA 79 N 0.98 0.78 0.00 1.57 0.00 -1.93 -3.28 119.26 117.38 3kcm h ALA 79 Ca 0.06 0.06 0.00 0.00 0.00 0.00 0.00 54.91 55.04 3kcm h ALA 79 Cb 0.08 0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.88 3kcm h ALA 79 CO -0.01 -0.14 0.00 0.00 0.00 0.00 0.00 179.25 179.10 3kcm n ALA 80 N -2.42 2.10 0.00 0.00 0.00 -0.58 -4.96 120.51 114.65 3kcm n ALA 80 Ca 0.08 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.52 3kcm n ALA 80 Cb 0.24 -1.65 0.00 0.00 0.00 0.00 0.00 19.45 18.04 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 1.74 -0.99 0.00 0.00 0.00 -1.24 -5.00 120.51 115.02 3kcm n ALA 82 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 3kcm n ALA 82 Cb 0.13 -0.19 0.00 0.00 0.00 0.00 0.00 19.45 19.39 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 1.48 2.74 3.81 0.00 0.00 -1.26 -5.03 105.19 106.93 3kcm n GLY 83 Ca 0.00 -0.04 -0.32 0.00 0.00 0.00 0.00 46.02 45.65 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 0.00 3.30 -0.80 1.61 1.02 -1.26 -4.96 119.74 118.66 3kcm s LYS 84 Ca 0.00 1.15 -0.26 0.00 0.02 0.00 0.00 55.97 56.88 3kcm s LYS 84 Cb 0.00 -2.03 0.02 0.00 -0.52 0.00 0.00 37.83 35.30 3kcm s LYS 84 CO 0.00 -0.82 1.48 -1.25 -0.92 0.00 0.00 175.35 173.84 3kcm s PRO 85 N -4.22 3.13 -0.28 -1.68 0.05 -1.26 -4.88 135.00 125.86 3kcm s PRO 85 Ca 0.62 -0.30 -0.23 0.00 0.05 0.00 0.00 61.00 61.15 3kcm s PRO 85 Cb -0.15 -4.57 0.10 0.00 0.05 0.00 0.00 34.50 29.93 3kcm s PRO 85 CO 0.39 -2.37 0.90 0.12 0.05 0.00 0.00 177.00 176.09 3kcm s PHE 86 N 6.53 -0.64 0.01 0.56 5.36 -1.26 -3.41 117.98 125.13 3kcm s PHE 86 Ca 0.46 1.49 0.00 0.00 -0.96 0.00 0.00 56.93 57.92 3kcm s PHE 86 Cb -0.07 0.36 -0.00 0.00 -0.34 0.00 0.00 43.02 42.97 3kcm s PHE 86 CO 0.09 -0.31 0.01 0.54 -1.46 0.00 0.00 175.22 174.08 3kcm n ARG 87 N 2.73 0.37 0.00 10.12 5.12 -0.50 -4.97 116.66 129.53 3kcm n ARG 87 Ca -0.14 -0.08 0.00 0.00 -1.93 0.00 0.00 57.85 55.70 3kcm n ARG 87 Cb 0.56 0.06 0.00 0.00 -1.16 0.00 0.00 32.46 31.92 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 -4.36 0.55 4.77 0.83 -1.10 117.00 117.69 3kcm n LEU 89 Ca 0.00 0.00 -0.45 0.00 -0.03 0.00 0.00 56.01 55.53 3kcm n LEU 89 Cb 0.01 0.00 -0.06 0.00 -2.33 0.00 0.00 43.42 41.05 3kcm n LEU 89 CO 0.01 0.00 0.16 0.00 -1.33 0.00 0.00 177.39 176.23 3kcm s VAL 91 N 1.86 4.89 -0.03 0.00 1.01 0.12 -1.62 120.40 126.63 3kcm s VAL 91 Ca 0.06 1.02 -0.23 0.00 0.00 0.00 0.00 61.98 62.83 3kcm s VAL 91 Cb -0.26 -4.04 -0.04 0.00 0.00 0.00 0.00 36.38 32.03 3kcm s VAL 91 CO 0.05 -0.15 0.70 -0.55 0.00 0.00 0.00 175.10 175.15 3kcm s SER 92 N 1.60 7.03 0.00 3.32 0.15 0.31 -1.37 113.70 124.75 3kcm s SER 92 Ca 0.28 1.24 0.24 0.00 0.70 0.00 0.00 55.95 58.41 3kcm s SER 92 Cb -0.15 -2.42 0.20 0.00 -1.71 0.00 0.00 66.02 61.94 3kcm s SER 92 CO 0.11 -0.05 1.22 2.30 1.20 0.00 0.00 173.24 178.03 3kcm n ILE 93 N 3.38 0.00 -1.66 6.45 -5.35 -0.76 -0.28 119.36 121.14 3kcm n ILE 93 Ca -0.02 -0.28 -0.64 0.00 -0.27 0.00 0.00 62.75 61.54 3kcm n ILE 93 Cb 0.51 1.12 -0.09 0.00 -1.74 0.00 0.00 39.64 39.44 3kcm n ILE 93 CO 0.00 0.00 0.00 0.47 -1.76 0.00 0.00 176.55 175.26 3kcm n ASP 94 N 0.11 0.91 -0.34 7.28 8.00 -1.26 -4.46 116.55 126.79 3kcm n ASP 94 Ca 0.11 1.17 0.17 0.00 0.71 0.00 0.00 54.79 56.95 3kcm n ASP 94 Cb 0.47 -0.92 0.38 0.00 -0.02 0.00 0.00 41.12 41.02 3kcm n ASP 94 CO 0.00 0.00 0.00 -0.08 -0.39 0.00 0.00 177.20 176.73 3kcm h GLU 95 N 4.49 0.50 0.00 -1.24 4.57 -1.93 -2.21 114.58 118.77 3kcm h GLU 95 Ca -0.47 -0.03 0.00 0.00 -1.18 0.00 0.00 59.36 57.68 3kcm h GLU 95 Cb 1.38 -0.11 0.00 0.00 -0.16 0.00 0.00 28.75 29.86 3kcm h GLU 95 CO 0.87 0.33 0.00 0.41 -1.18 0.00 0.00 179.01 179.44 3kcm n GLY 96 N -1.31 -1.00 7.00 1.92 0.00 -1.26 -4.94 105.19 105.60 3kcm n GLY 96 Ca 0.26 -0.06 0.00 0.00 0.00 0.00 0.00 46.02 46.23 3kcm n GLY 96 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3kcm n GLY 97 N 0.63 2.97 0.31 -0.02 0.00 -0.83 -2.04 105.19 106.22 3kcm n GLY 97 Ca 0.07 -0.16 -0.05 0.00 0.00 0.00 0.00 46.02 45.87 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 1.06 -0.43 1.61 3.64 -1.93 -2.83 116.57 117.69 3kcm h LYS 98 Ca 0.00 -0.11 -0.11 0.00 -1.27 0.00 0.00 60.65 59.16 3kcm h LYS 98 Cb 0.00 -0.22 -0.01 0.00 -0.41 0.00 0.00 32.23 31.59 3kcm h LYS 98 CO 0.00 0.77 -0.17 0.28 -2.27 0.00 0.00 179.45 178.06 3kcm h VAL 99 N 1.07 1.28 -1.00 2.00 2.07 -1.97 -1.20 116.25 118.49 3kcm h VAL 99 Ca 0.28 -1.31 0.02 0.00 0.82 0.00 0.00 66.70 66.51 3kcm h VAL 99 Cb -0.01 1.21 -0.05 0.00 -1.52 0.00 0.00 31.29 30.92 3kcm h VAL 99 CO -0.05 0.44 0.66 0.00 0.02 0.00 0.00 177.57 178.65 3kcm h ALA 100 N 0.84 1.29 -0.10 1.67 0.00 -1.26 -1.79 119.26 119.91 3kcm h ALA 100 Ca 0.10 -0.06 -0.12 0.00 0.00 0.00 0.00 54.91 54.83 3kcm h ALA 100 Cb 0.73 -0.39 0.00 0.00 0.00 0.00 0.00 17.79 18.13 3kcm h ALA 100 CO 0.06 0.62 -0.40 0.28 0.00 0.00 0.00 179.25 179.81 3kcm h VAL 101 N 1.33 1.39 -0.56 0.00 2.07 -1.38 -2.73 116.25 116.37 3kcm h VAL 101 Ca 0.38 -1.75 0.02 0.00 0.82 0.00 0.00 66.70 66.17 3kcm h VAL 101 Cb -0.10 2.22 -0.03 0.00 -1.52 0.00 0.00 31.29 31.86 3kcm h VAL 101 CO -0.10 0.52 0.37 -0.33 0.02 0.00 0.00 177.57 178.05 3kcm h GLU 102 N 0.00 0.69 -0.20 1.57 5.08 -1.08 0.05 114.58 120.70 3kcm h GLU 102 Ca -0.02 -0.04 -0.15 0.00 -1.00 0.00 0.00 59.36 58.15 3kcm h GLU 102 Cb 1.04 -0.16 -0.01 0.00 0.50 0.00 0.00 28.75 30.13 3kcm h GLU 102 CO 0.08 0.46 -0.49 0.93 -1.00 0.00 0.00 179.01 178.99 3kcm h GLU 103 N 0.71 0.53 -0.13 2.33 5.08 -1.31 -2.12 114.58 119.67 3kcm h GLU 103 Ca 0.22 -0.31 -0.11 0.00 -1.00 0.00 0.00 59.36 58.16 3kcm h GLU 103 Cb -0.01 0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.27 3kcm h GLU 103 CO -0.05 0.90 -0.36 0.35 -1.00 0.00 0.00 179.01 178.85 3kcm h PHE 104 N 0.42 0.61 -0.41 4.33 3.57 -1.04 -2.66 116.94 121.76 3kcm h PHE 104 Ca 0.02 -0.24 -0.02 0.00 3.53 0.00 0.00 57.97 61.26 3kcm h PHE 104 Cb 1.01 -0.11 -0.02 0.00 2.79 0.00 0.00 35.95 39.62 3kcm h PHE 104 CO 0.04 0.98 0.19 0.74 -2.23 0.00 0.00 178.31 178.03 3kcm h PHE 105 N 0.07 0.59 -0.38 0.41 0.04 -1.02 -1.85 116.94 114.80 3kcm h PHE 105 Ca -0.01 -0.03 0.05 0.00 2.80 0.00 0.00 57.97 60.78 3kcm h PHE 105 Cb 0.98 -0.18 -0.04 0.00 2.20 0.00 0.00 35.95 38.91 3kcm h PHE 105 CO 0.11 0.49 0.12 0.00 -0.60 0.00 0.00 178.31 178.43 3kcm h ARG 106 N 0.52 0.26 0.00 1.51 3.08 -1.34 0.52 114.38 118.93 3kcm h ARG 106 Ca 0.14 -0.02 -0.11 0.00 0.07 0.00 0.00 59.98 60.06 3kcm h ARG 106 Cb 0.12 -0.06 -0.02 0.00 0.08 0.00 0.00 29.97 30.10 3kcm h ARG 106 CO -0.02 0.17 -0.55 0.87 -1.07 0.00 0.00 179.97 179.38 3kcm h LYS 107 N 0.27 0.00 0.00 0.04 1.57 -1.39 -3.23 116.57 113.83 3kcm h LYS 107 Ca 0.17 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.95 3kcm h LYS 107 Cb 0.16 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.47 3kcm h LYS 107 CO -0.19 0.55 -1.28 0.25 -0.57 0.00 0.00 179.45 178.21 3kcm n THR 108 N -3.71 0.31 -1.95 -0.16 -2.24 -0.70 -4.96 114.28 100.86 3kcm n THR 108 Ca -0.01 -0.44 -0.14 0.00 -2.27 0.00 0.00 64.05 61.19 3kcm n THR 108 Cb 0.59 -0.08 -0.03 0.00 -2.10 0.00 0.00 70.33 68.71 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 1.26 0.40 3.93 3.38 0.00 0.14 -5.05 105.19 109.25 3kcm n GLY 109 Ca -0.00 -0.33 -0.25 0.00 0.00 0.00 0.00 46.02 45.43 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 -2.63 3.50 -0.14 1.61 2.99 -1.16 -5.05 117.98 117.10 3kcm s PHE 110 Ca 0.00 0.52 -0.07 0.00 0.00 0.00 0.00 56.93 57.38 3kcm s PHE 110 Cb 0.00 -2.09 0.06 0.00 0.00 0.00 0.00 43.02 40.98 3kcm s PHE 110 CO 0.00 -0.08 0.33 -0.08 -0.00 0.00 0.00 175.22 175.39 3kcm s THR 111 N -2.51 -0.13 0.05 0.64 -1.32 -1.26 -4.71 115.64 106.40 3kcm s THR 111 Ca 0.44 0.14 -0.01 0.00 -1.21 0.00 0.00 61.69 61.05 3kcm s THR 111 Cb -0.10 -0.51 -0.04 0.00 -1.51 0.00 0.00 72.50 70.34 3kcm s THR 111 CO 0.40 0.06 -0.02 -0.76 -2.21 0.00 0.00 174.62 172.08 3kcm s LEU 112 N 1.58 2.45 -0.73 9.08 1.43 -1.26 -5.08 118.68 126.15 3kcm s LEU 112 Ca -0.08 -0.98 -0.27 0.00 -1.03 0.00 0.00 54.13 51.78 3kcm s LEU 112 Cb -0.10 0.23 0.02 0.00 0.03 0.00 0.00 46.19 46.37 3kcm s LEU 112 CO -0.11 -0.60 1.43 -2.84 0.23 0.00 0.00 176.35 174.46 3kcm s PRO 113 N -3.87 3.08 0.18 1.29 0.02 -1.26 -4.97 135.00 129.47 3kcm s PRO 113 Ca 0.06 -0.10 -0.04 0.00 0.02 0.00 0.00 61.00 60.94 3kcm s PRO 113 Cb 0.08 -4.30 -0.05 0.00 0.02 0.00 0.00 34.50 30.24 3kcm s PRO 113 CO -0.10 -2.30 0.41 0.08 -0.33 0.00 0.00 177.00 174.76 3kcm s VAL 114 N 6.50 5.14 0.04 3.83 1.01 -1.26 -1.97 120.40 133.69 3kcm s VAL 114 Ca 0.43 -0.02 0.05 0.00 0.00 0.00 0.00 61.98 62.44 3kcm s VAL 114 Cb -0.09 -3.66 -0.02 0.00 0.00 0.00 0.00 36.38 32.61 3kcm s VAL 114 CO 0.15 -0.06 -0.13 -0.76 0.00 0.00 0.00 175.10 174.30 3kcm s LEU 115 N -2.91 2.18 -0.21 3.92 1.43 -0.64 -3.64 118.68 118.81 3kcm s LEU 115 Ca 0.41 -0.46 -0.08 0.00 -1.03 0.00 0.00 54.13 52.97 3kcm s LEU 115 Cb -0.12 -0.56 -0.04 0.00 0.03 0.00 0.00 46.19 45.50 3kcm s LEU 115 CO 0.26 0.01 0.09 -0.76 0.23 0.00 0.00 176.35 176.18 3kcm s LEU 116 N -1.16 3.82 -0.46 1.79 2.01 -0.94 -0.53 118.68 123.21 3kcm s LEU 116 Ca 0.01 0.04 0.08 0.00 0.01 0.00 0.00 54.13 54.27 3kcm s LEU 116 Cb -0.08 -1.99 0.30 0.00 0.01 0.00 0.00 46.19 44.43 3kcm s LEU 116 CO 0.01 0.11 0.70 -0.67 1.01 0.00 0.00 176.35 177.52 3kcm n ASP 117 N 3.95 1.75 -0.20 2.29 2.03 0.62 -4.50 116.55 122.49 3kcm n ASP 117 Ca -0.16 -3.10 -0.08 0.00 0.52 0.00 0.00 54.79 51.97 3kcm n ASP 117 Cb 0.52 -0.62 0.02 0.00 -0.72 0.00 0.00 41.12 40.32 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 3.52 0.73 -0.26 -1.67 0.00 -1.77 -2.54 119.26 117.28 3kcm h ALA 118 Ca 0.11 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.85 3kcm h ALA 118 Cb 0.81 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 18.38 3kcm h ALA 118 CO 0.60 0.36 0.00 -0.40 0.00 0.00 0.00 179.25 179.81 3kcm n ASP 119 N -4.48 1.48 0.00 0.00 3.85 -1.26 -4.49 116.55 111.65 3kcm n ASP 119 Ca 0.03 -2.02 0.00 0.00 -0.71 0.00 0.00 54.79 52.09 3kcm n ASP 119 Cb 0.18 -0.20 0.00 0.00 -1.35 0.00 0.00 41.12 39.75 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 0.27 -0.57 -0.18 0.11 4.76 -0.95 -4.87 118.16 116.72 3kcm n LYS 120 Ca 0.09 0.14 -0.01 0.00 -2.87 0.00 0.00 58.31 55.66 3kcm n LYS 120 Cb 0.24 -4.33 0.06 0.00 -1.84 0.00 0.00 35.03 29.16 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 0.39 0.06 -0.21 1.97 9.65 -1.92 -0.39 114.38 123.94 3kcm h ARG 121 Ca 0.00 -0.00 -0.15 0.00 -1.10 0.00 0.00 59.98 58.73 3kcm h ARG 121 Cb 0.29 -0.01 -0.01 0.00 -1.39 0.00 0.00 29.97 28.85 3kcm h ARG 121 CO 0.00 0.04 -0.48 0.28 2.80 0.00 0.00 179.97 182.60 3kcm h VAL 122 N 0.06 1.31 -0.27 0.20 2.07 -1.92 -0.49 116.25 117.21 3kcm h VAL 122 Ca 0.27 -1.70 0.06 0.00 0.82 0.00 0.00 66.70 66.15 3kcm h VAL 122 Cb 0.42 1.67 -0.08 0.00 -1.52 0.00 0.00 31.29 31.79 3kcm h VAL 122 CO -0.51 0.53 -0.37 1.23 0.02 0.00 0.00 177.57 178.48 3kcm h GLY 123 N 1.06 -0.47 1.00 2.17 0.00 -1.76 -1.11 103.07 103.96 3kcm h GLY 123 Ca 0.02 0.46 0.01 0.00 0.00 0.00 0.00 47.33 47.82 3kcm h GLY 123 CO 0.09 -0.21 0.39 0.50 0.00 0.00 0.00 176.54 177.31 3kcm h LYS 124 N -0.36 0.77 -0.72 4.80 1.57 -0.57 -2.20 116.57 119.87 3kcm h LYS 124 Ca 0.12 -0.05 0.10 0.00 -1.87 0.00 0.00 60.65 58.96 3kcm h LYS 124 Cb 0.57 -0.17 -0.05 0.00 0.08 0.00 0.00 32.23 32.66 3kcm h LYS 124 CO -0.46 0.51 0.47 1.25 -0.57 0.00 0.00 179.45 180.65 3kcm h LEU 125 N 0.80 0.52 -0.92 2.94 5.85 -0.45 0.67 115.31 124.72 3kcm h LEU 125 Ca 0.22 0.01 0.00 0.00 0.84 0.00 0.00 57.88 58.95 3kcm h LEU 125 Cb -0.09 -0.09 0.00 0.00 0.37 0.00 0.00 40.66 40.85 3kcm h LEU 125 CO -0.05 0.30 0.00 -1.22 -0.34 0.00 0.00 178.44 177.13 3kcm n TYR 126 N -4.49 0.33 -2.77 1.25 4.02 -0.48 -4.93 117.16 110.10 3kcm n TYR 126 Ca 0.12 -0.16 -0.16 0.00 -0.01 0.00 0.00 57.90 57.69 3kcm n TYR 126 Cb 0.37 -0.01 -0.00 0.00 -0.02 0.00 0.00 39.34 39.67 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 0.83 -0.50 3.74 2.72 0.00 0.23 -4.96 105.19 107.26 3kcm n GLY 127 Ca 0.08 0.04 -0.33 0.00 0.00 0.00 0.00 46.02 45.81 3kcm n GLY 127 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3kcm s THR 128 N -2.74 2.76 -0.00 2.61 -4.23 -1.04 -4.96 115.64 108.04 3kcm s THR 128 Ca 0.14 0.32 0.00 0.00 -1.18 0.00 0.00 61.69 60.97 3kcm s THR 128 Cb -0.07 -2.76 -0.00 0.00 1.34 0.00 0.00 72.50 71.01 3kcm s THR 128 CO 0.18 -0.25 0.00 0.41 -0.54 0.00 0.00 174.62 174.42 3kcm n THR 129 N -3.05 0.00 -3.24 3.99 -1.04 -1.26 -4.89 114.28 104.79 3kcm n THR 129 Ca 0.11 -0.05 0.00 0.00 -2.04 0.00 0.00 64.05 62.08 3kcm n THR 129 Cb 0.52 0.55 0.00 0.00 -1.82 0.00 0.00 70.33 69.57 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 2.36 -1.04 3.15 3.41 0.00 -1.26 -5.19 105.19 106.62 3kcm n GLY 130 Ca -0.00 -0.84 -0.12 0.00 0.00 0.00 0.00 46.02 45.06 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 -3.00 0.06 0.48 1.61 -7.23 -1.26 -4.43 120.40 106.62 3kcm s VAL 131 Ca 0.00 -0.51 -0.08 0.00 -1.81 0.00 0.00 61.98 59.57 3kcm s VAL 131 Cb 0.00 -0.48 -0.05 0.00 0.56 0.00 0.00 36.38 36.41 3kcm s VAL 131 CO 0.00 -0.28 0.83 -2.16 -0.31 0.00 0.00 175.10 173.17 3kcm s PRO 132 N -1.13 3.66 -0.08 4.82 0.05 -1.26 -4.82 135.00 136.23 3kcm s PRO 132 Ca -0.12 0.41 -0.04 0.00 0.05 0.00 0.00 61.00 61.31 3kcm s PRO 132 Cb -0.06 -2.33 0.04 0.00 0.05 0.00 0.00 34.50 32.21 3kcm s PRO 132 CO 0.02 -0.20 0.18 -2.00 0.05 0.00 0.00 177.00 175.05 3kcm s GLU 133 N -4.45 0.12 -0.03 4.56 2.12 -1.01 -0.93 118.70 119.08 3kcm s GLU 133 Ca 0.50 0.47 0.01 0.00 0.36 0.00 0.00 54.97 56.31 3kcm s GLU 133 Cb -0.10 -0.17 0.02 0.00 0.26 0.00 0.00 34.13 34.13 3kcm s GLU 133 CO 0.41 -0.20 -0.03 0.99 -0.54 0.00 0.00 175.26 175.89 3kcm s THR 134 N 1.46 0.38 -0.07 -1.70 2.01 0.50 0.25 115.64 118.47 3kcm s THR 134 Ca -0.07 -0.09 0.05 0.00 0.31 0.00 0.00 61.69 61.90 3kcm s THR 134 Cb -0.11 -0.40 -0.01 0.00 0.01 0.00 0.00 72.50 71.99 3kcm s THR 134 CO -0.07 0.16 -0.23 -0.36 -0.69 0.00 0.00 174.62 173.43 3kcm s PHE 135 N 0.62 2.51 -0.17 4.92 0.40 0.30 0.19 117.98 126.74 3kcm s PHE 135 Ca -0.07 -0.77 -0.07 0.00 -0.60 0.00 0.00 56.93 55.41 3kcm s PHE 135 Cb -0.10 -1.65 -0.04 0.00 0.51 0.00 0.00 43.02 41.74 3kcm s PHE 135 CO -0.00 -0.25 0.07 0.08 0.70 0.00 0.00 175.22 175.82 3kcm s VAL 136 N -0.03 4.88 -0.00 -0.44 1.01 0.11 -1.28 120.40 124.65 3kcm s VAL 136 Ca -0.07 -0.01 0.07 0.00 0.00 0.00 0.00 61.98 61.97 3kcm s VAL 136 Cb -0.15 -3.19 -0.02 0.00 0.00 0.00 0.00 36.38 33.03 3kcm s VAL 136 CO 0.05 0.48 -0.21 -0.63 0.00 0.00 0.00 175.10 174.79 3kcm s ILE 137 N 0.17 1.65 0.50 2.22 1.01 -0.41 0.71 121.20 127.05 3kcm s ILE 137 Ca 0.05 -0.95 0.01 0.00 0.00 0.00 0.00 60.65 59.75 3kcm s ILE 137 Cb -0.12 -1.38 0.02 0.00 0.01 0.00 0.00 42.46 40.98 3kcm s ILE 137 CO 0.00 0.41 0.73 1.51 0.00 0.00 0.00 174.94 177.59 3kcm s ASP 138 N -0.63 5.54 0.59 3.58 1.47 0.39 -1.91 116.67 125.70 3kcm s ASP 138 Ca 0.08 0.14 0.29 0.00 1.18 0.00 0.00 52.55 54.23 3kcm s ASP 138 Cb -0.08 -1.19 1.48 0.00 -0.34 0.00 0.00 42.92 42.78 3kcm s ASP 138 CO -0.00 -0.94 1.89 0.03 0.68 0.00 0.00 175.17 176.83 3kcm h ARG 139 N 0.22 0.00 -0.01 2.11 -0.00 -1.86 0.19 114.38 115.04 3kcm h ARG 139 Ca -0.44 0.00 0.00 0.00 -0.50 0.00 0.00 59.98 59.04 3kcm h ARG 139 Cb 1.28 0.00 0.00 0.00 0.00 0.00 0.00 29.97 31.25 3kcm h ARG 139 CO 0.55 0.00 -0.11 0.72 0.00 0.00 0.00 179.97 181.13 3kcm n HIS 140 N -3.69 0.00 -0.07 3.04 8.25 -1.26 0.87 115.22 122.37 3kcm n HIS 140 Ca 0.08 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.54 3kcm n HIS 140 Cb 0.67 -0.10 0.00 0.00 1.12 0.00 0.00 29.99 31.68 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 1.24 0.96 3.58 -1.41 0.00 0.66 -4.98 105.19 105.24 3kcm n GLY 141 Ca 0.16 -0.06 -0.34 0.00 0.00 0.00 0.00 46.02 45.78 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 -2.00 3.93 -0.15 1.61 1.01 -1.24 -1.75 120.40 121.80 3kcm s VAL 142 Ca 0.00 -0.37 -0.29 0.00 0.00 0.00 0.00 61.98 61.31 3kcm s VAL 142 Cb 0.00 -2.66 -0.03 0.00 0.00 0.00 0.00 36.38 33.69 3kcm s VAL 142 CO 0.00 0.56 1.46 -0.63 0.00 0.00 0.00 175.10 176.49 3kcm s ILE 143 N -0.38 3.93 -0.20 2.22 1.01 -0.99 -0.46 121.20 126.33 3kcm s ILE 143 Ca 0.06 1.10 -0.22 0.00 0.00 0.00 0.00 60.65 61.60 3kcm s ILE 143 Cb -0.12 -3.78 -0.20 0.00 0.01 0.00 0.00 42.46 38.36 3kcm s ILE 143 CO 0.02 -0.18 0.29 -0.07 0.00 0.00 0.00 174.94 175.00 3kcm h LEU 144 N 10.39 0.02 -7.66 2.97 4.07 -0.07 -3.18 115.31 121.84 3kcm h LEU 144 Ca -0.32 -0.58 -0.22 0.00 0.08 0.00 0.00 57.88 56.84 3kcm h LEU 144 Cb 1.14 -0.01 -0.28 0.00 1.08 0.00 0.00 40.66 42.59 3kcm h LEU 144 CO 0.98 1.45 -0.66 -0.75 -1.08 0.00 0.00 178.44 178.37 3kcm s LYS 145 N -2.35 0.06 -0.10 1.13 2.47 -1.12 -4.76 119.74 115.06 3kcm s LYS 145 Ca -0.27 0.09 0.04 0.00 -1.56 0.00 0.00 55.97 54.26 3kcm s LYS 145 Cb 0.05 0.01 0.00 0.00 -1.46 0.00 0.00 37.83 36.43 3kcm s LYS 145 CO 0.61 -0.02 -0.23 0.21 0.16 0.00 0.00 175.35 176.08 3kcm s LYS 146 N 0.10 3.06 -0.10 4.03 2.20 -1.26 0.08 119.74 127.85 3kcm s LYS 146 Ca -0.01 -0.87 0.01 0.00 -0.36 0.00 0.00 55.97 54.74 3kcm s LYS 146 Cb -0.01 -2.32 0.02 0.00 -1.51 0.00 0.00 37.83 34.00 3kcm s LYS 146 CO -0.00 0.16 -0.12 0.08 -0.36 0.00 0.00 175.35 175.11 3kcm s VAL 147 N 0.38 1.27 -0.16 4.02 1.01 0.13 -4.98 120.40 122.07 3kcm s VAL 147 Ca -0.18 -0.49 -0.08 0.00 0.00 0.00 0.00 61.98 61.23 3kcm s VAL 147 Cb -0.18 -1.19 -0.04 0.00 0.00 0.00 0.00 36.38 34.97 3kcm s VAL 147 CO 0.08 0.40 0.11 0.68 0.00 0.00 0.00 175.10 176.37 3kcm s VAL 148 N 1.15 5.25 0.00 2.92 -7.23 -1.26 -0.37 120.40 120.85 3kcm s VAL 148 Ca -0.04 0.12 0.00 0.00 -1.81 0.00 0.00 61.98 60.25 3kcm s VAL 148 Cb -0.14 -3.34 0.00 0.00 0.56 0.00 0.00 36.38 33.46 3kcm s VAL 148 CO -0.03 0.52 0.00 0.61 -0.31 0.00 0.00 175.10 175.89 3kcm n GLY 149 N 2.90 -1.35 3.59 2.32 0.00 -0.10 -5.00 105.19 107.54 3kcm n GLY 149 Ca -0.18 -1.57 -0.29 0.00 0.00 0.00 0.00 46.02 43.98 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 -1.36 0.53 -0.38 4.61 0.00 -1.26 -4.83 121.76 119.07 3kcm s ALA 150 Ca 0.00 0.14 0.01 0.00 0.00 0.00 0.00 51.96 52.11 3kcm s ALA 150 Cb 0.00 -3.31 0.14 0.00 0.00 0.00 0.00 23.12 19.94 3kcm s ALA 150 CO 0.00 -3.23 0.22 -2.00 0.00 0.00 0.00 175.76 170.75 3kcm s GLU 152 N -4.60 0.77 0.00 0.00 2.56 -1.26 -5.08 118.70 111.09 3kcm s GLU 152 Ca 0.67 -1.52 0.26 0.00 0.00 0.00 0.00 54.97 54.38 3kcm s GLU 152 Cb -0.23 -1.63 1.27 0.00 2.00 0.00 0.00 34.13 35.54 3kcm s GLU 152 CO 0.61 -1.19 1.87 0.91 -0.56 0.00 0.00 175.26 176.91 3kcm n TRP 153 N 3.92 0.00 0.86 5.30 7.02 -1.26 -2.33 117.44 130.95 3kcm n TRP 153 Ca 0.10 0.00 0.12 0.00 -1.02 0.00 0.00 57.50 56.70 3kcm n TRP 153 Cb 0.36 -0.34 0.11 0.00 -2.42 0.00 0.00 31.31 29.03 3kcm n TRP 153 CO 0.00 0.00 0.00 -3.47 -2.02 0.00 0.00 177.69 172.20 3kcm n ASP 154 N -1.34 3.00 -4.77 -0.99 2.03 -1.25 -4.56 116.55 108.68 3kcm n ASP 154 Ca 0.11 -1.96 -0.39 0.00 0.52 0.00 0.00 54.79 53.06 3kcm n ASP 154 Cb 0.23 -0.04 -0.01 0.00 -0.72 0.00 0.00 41.12 40.59 3kcm n ASP 154 CO 0.00 0.00 0.00 -1.00 -1.92 0.00 0.00 177.20 174.28 3kcm s HIS 155 N -1.85 2.87 0.30 -0.67 3.76 -0.98 -4.75 115.29 113.96 3kcm s HIS 155 Ca 0.29 1.43 0.05 0.00 -0.15 0.00 0.00 55.06 56.68 3kcm s HIS 155 Cb 0.20 -3.63 0.74 0.00 1.11 0.00 0.00 32.58 31.00 3kcm s HIS 155 CO 0.29 -1.97 1.75 -1.35 -0.85 0.00 0.00 174.74 172.62 3kcm h PRO 156 N 2.73 0.64 -0.30 8.40 0.11 -1.94 0.23 132.00 141.87 3kcm h PRO 156 Ca -0.49 -0.04 -0.00 0.00 0.11 0.00 0.00 66.00 65.57 3kcm h PRO 156 Cb 1.24 -0.14 -0.02 0.00 0.11 0.00 0.00 31.00 32.19 3kcm h PRO 156 CO 0.63 0.42 0.17 0.93 -0.21 0.00 0.00 178.00 179.94 3kcm h GLU 157 N 0.66 0.40 0.53 1.05 3.07 -1.97 -0.94 114.58 117.38 3kcm h GLU 157 Ca 0.58 -0.03 -0.03 0.00 -0.50 0.00 0.00 59.36 59.38 3kcm h GLU 157 Cb 0.96 -0.09 0.01 0.00 -0.84 0.00 0.00 28.75 28.79 3kcm h GLU 157 CO -0.42 0.29 -0.25 0.28 -1.40 0.00 0.00 179.01 177.50 3kcm h VAL 158 N 0.41 0.11 -0.91 3.13 2.07 -0.87 -2.74 116.25 117.45 3kcm h VAL 158 Ca 0.11 -0.48 0.17 0.00 0.82 0.00 0.00 66.70 67.32 3kcm h VAL 158 Cb -0.00 0.16 -0.17 0.00 -1.52 0.00 0.00 31.29 29.76 3kcm h VAL 158 CO -0.02 0.02 -0.27 0.40 0.02 0.00 0.00 177.57 177.72 3kcm h ILE 159 N -1.15 0.07 -0.02 4.57 1.08 -1.28 -1.76 117.51 119.02 3kcm h ILE 159 Ca -0.07 0.00 0.01 0.00 -0.39 0.00 0.00 64.86 64.41 3kcm h ILE 159 Cb 0.58 0.07 -0.01 0.00 -3.07 0.00 0.00 36.82 34.39 3kcm h ILE 159 CO 0.12 0.00 -0.02 0.00 -0.69 0.00 0.00 178.15 177.56 3kcm h ALA 160 N 1.72 -0.00 -0.55 1.87 0.00 -1.25 -0.58 119.26 120.48 3kcm h ALA 160 Ca 0.40 0.01 0.08 0.00 0.00 0.00 0.00 54.91 55.40 3kcm h ALA 160 Cb 0.64 0.05 -0.06 0.00 0.00 0.00 0.00 17.79 18.42 3kcm h ALA 160 CO -0.93 -0.51 0.20 0.35 0.00 0.00 0.00 179.25 178.36 3kcm h PHE 161 N -0.03 0.35 -0.36 0.00 3.57 -1.02 -1.96 116.94 117.49 3kcm h PHE 161 Ca 0.02 0.03 -0.10 0.00 3.53 0.00 0.00 57.97 61.44 3kcm h PHE 161 Cb 0.06 -0.07 -0.02 0.00 2.79 0.00 0.00 35.95 38.71 3kcm h PHE 161 CO -0.11 0.10 -0.20 -0.07 -2.23 0.00 0.00 178.31 175.80 3kcm h LEU 162 N 0.38 0.70 -0.42 0.59 3.38 -1.17 -3.21 115.31 115.57 3kcm h LEU 162 Ca 0.27 -0.24 -0.03 0.00 0.09 0.00 0.00 57.88 57.97 3kcm h LEU 162 Cb 0.30 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 40.84 3kcm h LEU 162 CO -0.27 0.90 0.14 0.78 0.09 0.00 0.00 178.44 180.08 3kcm h ASN 163 N 0.61 0.61 -0.32 -0.43 2.35 -0.82 0.19 115.58 117.77 3kcm h ASN 163 Ca 0.09 -0.20 0.09 0.00 -0.55 0.00 0.00 56.30 55.74 3kcm h ASN 163 Cb 0.68 -0.16 -0.01 0.00 0.05 0.00 0.00 38.32 38.88 3kcm h ASN 163 CO 0.05 0.64 0.40 -1.13 -1.65 0.00 0.00 177.43 175.74 3kcm h ASN 164 N 0.54 0.00 0.45 5.81 -0.73 -1.36 0.29 115.58 120.58 3kcm h ASN 164 Ca 0.14 0.00 -0.30 0.00 1.87 0.00 0.00 56.30 58.01 3kcm h ASN 164 Cb 0.25 0.00 -0.04 0.00 0.27 0.00 0.00 38.32 38.80 3kcm h ASN 164 CO -0.01 0.00 -1.70 -0.33 -0.37 0.00 0.00 177.43 175.03 3kcm h GLU 165 N 0.00 0.08 0.00 6.67 4.39 -1.32 -3.52 114.58 120.88 3kcm h GLU 165 Ca 0.15 -0.13 0.00 0.00 0.34 0.00 0.00 59.36 59.72 3kcm h GLU 165 Cb 0.94 0.05 0.00 0.00 -0.10 0.00 0.00 28.75 29.64 3kcm h GLU 165 CO -0.00 0.73 0.00 1.47 -1.16 0.00 0.00 179.01 180.05