#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1s3s n ASN 24 N 0.00 0.00 -4.56 2.55 6.94 -1.26 -4.80 115.26 114.13 1s3s n ASN 24 Ca 0.00 -0.70 -0.39 0.00 -0.02 0.00 0.00 54.58 53.47 1s3s n ASN 24 Cb 0.00 0.00 -0.10 0.00 -2.36 0.00 0.00 39.78 37.32 1s3s n ASN 24 CO 0.00 0.00 0.00 -0.13 -1.03 0.00 0.00 177.26 176.10 1s3s s ARG 25 N 0.00 3.73 0.20 -3.83 3.00 -1.24 0.51 118.95 121.31 1s3s s ARG 25 Ca 0.00 -0.40 0.08 0.00 0.00 0.00 0.00 55.73 55.41 1s3s s ARG 25 Cb 0.00 -3.74 -0.05 0.00 0.00 0.00 0.00 34.95 31.17 1s3s s ARG 25 CO 0.00 -0.35 -0.15 -0.51 0.00 0.00 0.00 175.30 174.28 1s3s s LEU 26 N 1.84 2.53 -0.01 2.53 1.43 0.41 -4.88 118.68 122.54 1s3s s LEU 26 Ca 0.09 -0.99 -0.22 0.00 -1.03 0.00 0.00 54.13 51.98 1s3s s LEU 26 Cb -0.17 -0.73 -0.05 0.00 0.03 0.00 0.00 46.19 45.28 1s3s s LEU 26 CO 0.11 -0.13 0.66 -0.63 0.23 0.00 0.00 176.35 176.59 1s3s s ILE 27 N -2.76 4.91 -0.09 -0.59 -1.09 0.22 -1.04 121.20 120.76 1s3s s ILE 27 Ca 0.21 1.39 -0.27 0.00 -2.23 0.00 0.00 60.65 59.76 1s3s s ILE 27 Cb -0.02 -4.01 -0.02 0.00 -1.58 0.00 0.00 42.46 36.83 1s3s s ILE 27 CO 0.07 0.36 0.87 0.54 -1.23 0.00 0.00 174.94 175.55 1s3s s VAL 28 N 0.13 4.90 0.21 2.92 0.11 -0.09 -0.49 120.40 128.10 1s3s s VAL 28 Ca 0.35 1.77 0.09 0.00 -2.93 0.00 0.00 61.98 61.26 1s3s s VAL 28 Cb -0.19 -4.19 -0.05 0.00 -1.53 0.00 0.00 36.38 30.42 1s3s s VAL 28 CO 0.19 0.12 -0.16 -0.62 -3.33 0.00 0.00 175.10 171.29 1s3s s ASP 29 N 1.01 2.79 0.57 3.54 2.15 -0.55 -0.61 116.67 125.57 1s3s s ASP 29 Ca 0.44 -1.00 -0.18 0.00 0.43 0.00 0.00 52.55 52.23 1s3s s ASP 29 Cb -0.18 -0.17 -0.08 0.00 -0.30 0.00 0.00 42.92 42.18 1s3s s ASP 29 CO 0.19 -0.11 0.58 -0.62 -0.17 0.00 0.00 175.17 175.04 1s3s n GLU 30 N -0.33 0.57 -2.64 4.34 1.02 -1.26 -2.36 120.64 119.98 1s3s n GLU 30 Ca -0.08 0.22 -0.40 0.00 -0.02 0.00 0.00 57.16 56.88 1s3s n GLU 30 Cb 0.60 -1.75 -0.05 0.00 -0.02 0.00 0.00 31.44 30.21 1s3s n GLU 30 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1s3s s ALA 31 N -1.68 3.34 -0.98 0.62 0.00 -0.30 -4.02 121.76 118.73 1s3s s ALA 31 Ca 0.69 0.72 0.17 0.00 0.00 0.00 0.00 51.96 53.54 1s3s s ALA 31 Cb -0.45 -3.26 -0.14 0.00 0.00 0.00 0.00 23.12 19.28 1s3s s ALA 31 CO 0.54 0.04 0.75 1.51 0.00 0.00 0.00 175.76 178.60 1s3s n ILE 32 N 1.22 0.00 -3.89 0.00 3.06 -1.26 -4.85 119.36 113.64 1s3s n ILE 32 Ca -0.01 -0.16 -0.28 0.00 -2.50 0.00 0.00 62.75 59.79 1s3s n ILE 32 Cb 0.47 1.05 -0.16 0.00 0.54 0.00 0.00 39.64 41.53 1s3s n ILE 32 CO 0.00 0.00 0.00 0.21 -2.50 0.00 0.00 176.55 174.26 1s3s s ASN 33 N -2.42 2.93 -0.44 9.51 3.04 -1.26 -5.07 114.94 121.22 1s3s s ASN 33 Ca 0.08 -0.71 -0.27 0.00 0.04 0.00 0.00 52.86 52.00 1s3s s ASN 33 Cb 0.13 -0.94 -0.03 0.00 -1.54 0.00 0.00 41.25 38.87 1s3s s ASN 33 CO 0.62 -0.19 1.93 -1.83 -3.04 0.00 0.00 177.10 174.59 1s3s s GLU 34 N 1.61 2.91 -0.30 0.43 -1.05 -1.26 -4.84 118.70 116.20 1s3s s GLU 34 Ca 0.00 1.18 -0.18 0.00 -0.15 0.00 0.00 54.97 55.82 1s3s s GLU 34 Cb -0.16 -4.33 0.19 0.00 -0.44 0.00 0.00 34.13 29.39 1s3s s GLU 34 CO -0.08 -2.37 1.22 0.34 0.95 0.00 0.00 175.26 175.32 1s3s s ASP 35 N 7.76 -0.17 0.62 0.83 -1.08 -1.26 -5.04 116.67 118.32 1s3s s ASP 35 Ca 0.79 0.19 0.37 0.00 -0.52 0.00 0.00 52.55 53.38 1s3s s ASP 35 Cb -0.19 1.18 2.05 0.00 -1.46 0.00 0.00 42.92 44.50 1s3s s ASP 35 CO 0.28 -0.03 2.28 0.78 0.52 0.00 0.00 175.17 179.00 1s3s h ASN 36 N 7.36 0.00 -0.46 -0.34 -0.26 -1.94 -2.63 115.58 117.31 1s3s h ASN 36 Ca -0.13 0.00 -0.08 0.00 -0.56 0.00 0.00 56.30 55.53 1s3s h ASN 36 Cb 1.14 0.00 -0.05 0.00 -1.06 0.00 0.00 38.32 38.35 1s3s h ASN 36 CO -0.00 0.01 0.06 -1.20 -1.06 0.00 0.00 177.43 175.24 1s3s n SER 37 N -3.45 4.37 -4.32 5.81 7.64 -1.26 -4.63 113.62 117.78 1s3s n SER 37 Ca -0.03 -3.14 -0.21 0.00 1.01 0.00 0.00 58.87 56.50 1s3s n SER 37 Cb 0.10 -0.64 -0.11 0.00 -1.01 0.00 0.00 64.21 62.55 1s3s n SER 37 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 1s3s s VAL 38 N -2.91 1.76 -0.10 0.44 0.11 -0.99 -1.24 120.40 117.47 1s3s s VAL 38 Ca 0.48 -1.89 -0.19 0.00 -2.93 0.00 0.00 61.98 57.45 1s3s s VAL 38 Cb 0.39 -1.81 0.04 0.00 -1.53 0.00 0.00 36.38 33.48 1s3s s VAL 38 CO 0.11 -0.33 0.47 0.68 -3.33 0.00 0.00 175.10 172.70 1s3s s VAL 39 N -2.06 0.02 0.19 2.04 -7.23 -0.71 -4.62 120.40 108.04 1s3s s VAL 39 Ca 0.15 -0.16 0.09 0.00 -1.81 0.00 0.00 61.98 60.24 1s3s s VAL 39 Cb -0.06 -0.73 -0.04 0.00 0.56 0.00 0.00 36.38 36.11 1s3s s VAL 39 CO 0.06 -0.09 -0.17 -0.44 -0.31 0.00 0.00 175.10 174.16 1s3s s SER 40 N -0.58 2.72 0.17 4.85 0.01 0.17 -1.49 113.70 119.55 1s3s s SER 40 Ca -0.07 -0.95 -0.08 0.00 1.31 0.00 0.00 55.95 56.16 1s3s s SER 40 Cb -0.03 -0.16 -0.01 0.00 0.21 0.00 0.00 66.02 66.02 1s3s s SER 40 CO 0.04 -0.09 0.27 -0.76 0.41 0.00 0.00 173.24 173.12 1s3s s LEU 41 N -3.04 0.97 0.17 2.44 1.43 -1.19 0.02 118.68 119.48 1s3s s LEU 41 Ca 0.20 -0.94 -0.27 0.00 -1.03 0.00 0.00 54.13 52.09 1s3s s LEU 41 Cb -0.03 1.12 -0.08 0.00 0.03 0.00 0.00 46.19 47.23 1s3s s LEU 41 CO 0.08 -0.90 0.83 -0.94 0.23 0.00 0.00 176.35 175.64 1s3s s SER 42 N -2.99 7.44 0.29 2.29 1.04 -1.24 -0.30 113.70 120.23 1s3s s SER 42 Ca 0.20 1.71 0.04 0.00 0.48 0.00 0.00 55.95 58.38 1s3s s SER 42 Cb 0.03 -2.53 0.74 0.00 0.10 0.00 0.00 66.02 64.37 1s3s s SER 42 CO 0.02 0.15 1.68 1.56 0.98 0.00 0.00 173.24 177.64 1s3s h GLN 43 N 4.54 0.34 0.00 4.02 4.20 -1.92 0.32 115.11 126.61 1s3s h GLN 43 Ca -0.46 -0.02 0.00 0.00 0.06 0.00 0.00 58.65 58.23 1s3s h GLN 43 Cb 1.20 -0.08 0.00 0.00 0.30 0.00 0.00 27.48 28.91 1s3s h GLN 43 CO 0.68 0.23 0.23 -1.35 -0.67 0.00 0.00 178.83 177.95 1s3s h PRO 44 N 0.35 0.00 0.00 1.46 0.11 -1.95 0.47 132.00 132.45 1s3s h PRO 44 Ca 0.57 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.68 1s3s h PRO 44 Cb 1.10 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.21 1s3s h PRO 44 CO -0.56 0.00 -1.50 1.17 -0.21 0.00 0.00 178.00 176.90 1s3s n LYS 45 N -2.62 0.58 0.02 1.05 3.00 0.11 -3.78 118.16 116.51 1s3s n LYS 45 Ca -0.02 -0.11 -0.19 0.00 -0.00 0.00 0.00 58.31 58.00 1s3s n LYS 45 Cb 0.27 -1.46 -0.11 0.00 0.00 0.00 0.00 35.03 33.74 1s3s n LYS 45 CO 0.00 0.00 0.00 0.52 0.00 0.00 0.00 177.40 177.92 1s3s h MET 46 N 0.00 0.54 0.80 1.64 2.86 0.21 -2.31 114.93 118.67 1s3s h MET 46 Ca 0.00 -0.57 -0.04 0.00 -2.06 0.00 0.00 59.70 57.03 1s3s h MET 46 Cb 0.73 0.16 0.01 0.00 0.06 0.00 0.00 31.60 32.56 1s3s h MET 46 CO 0.00 1.20 -0.39 -0.44 1.06 0.00 0.00 176.91 178.34 1s3s h ASP 47 N 0.12 -0.92 -0.88 1.22 3.32 -1.37 -1.63 116.42 116.27 1s3s h ASP 47 Ca -0.10 0.03 0.20 0.00 0.02 0.00 0.00 57.03 57.19 1s3s h ASP 47 Cb 1.46 0.24 -0.06 0.00 0.22 0.00 0.00 39.33 41.19 1s3s h ASP 47 CO 0.15 -0.66 0.59 -0.33 -1.72 0.00 0.00 179.24 177.28 1s3s h GLU 48 N -1.08 0.36 -0.55 3.56 3.07 -1.65 -1.83 114.58 116.45 1s3s h GLU 48 Ca -0.11 -0.02 0.00 0.00 -0.50 0.00 0.00 59.36 58.73 1s3s h GLU 48 Cb 0.83 -0.08 0.00 0.00 -0.84 0.00 0.00 28.75 28.66 1s3s h GLU 48 CO 0.18 0.24 0.00 1.28 -1.40 0.00 0.00 179.01 179.31 1s3s n LEU 49 N -4.49 2.96 -3.21 1.33 7.99 -0.87 -4.97 117.00 115.74 1s3s n LEU 49 Ca 0.19 -1.49 -0.22 0.00 -0.01 0.00 0.00 56.01 54.48 1s3s n LEU 49 Cb 0.70 -0.40 0.06 0.00 -0.11 0.00 0.00 43.42 43.67 1s3s n LEU 49 CO 0.31 0.59 0.18 0.00 -1.51 0.00 0.00 177.39 176.96 1s3s n GLN 50 N 0.74 -6.73 -3.93 3.23 1.13 -0.69 -4.82 117.38 106.31 1s3s n GLN 50 Ca 0.16 0.77 -0.10 0.00 -1.94 0.00 0.00 57.00 55.90 1s3s n GLN 50 Cb 0.53 -5.58 -0.10 0.00 0.11 0.00 0.00 30.24 25.20 1s3s n GLN 50 CO 0.00 0.00 0.00 -0.51 -1.44 0.00 0.00 177.06 175.11 1s3s s LEU 51 N -6.64 1.82 0.25 1.08 1.43 -0.73 -5.00 118.68 110.89 1s3s s LEU 51 Ca 0.48 -0.46 0.10 0.00 -1.03 0.00 0.00 54.13 53.22 1s3s s LEU 51 Cb -0.21 0.54 -0.04 0.00 0.03 0.00 0.00 46.19 46.50 1s3s s LEU 51 CO 0.60 -0.45 -0.03 -0.36 0.23 0.00 0.00 176.35 176.34 1s3s s PHE 52 N -2.17 2.66 -0.79 0.29 0.40 -1.26 -4.57 117.98 112.55 1s3s s PHE 52 Ca -0.09 -0.23 -0.23 0.00 -0.60 0.00 0.00 56.93 55.78 1s3s s PHE 52 Cb -0.04 -1.20 -0.17 0.00 0.51 0.00 0.00 43.02 42.13 1s3s s PHE 52 CO -0.03 0.61 2.39 -2.13 0.70 0.00 0.00 175.22 176.76 1s3s n ARG 53 N -0.72 0.51 0.00 0.44 0.63 -1.26 -1.06 116.66 115.20 1s3s n ARG 53 Ca -0.07 -0.50 0.00 0.00 -0.92 0.00 0.00 57.85 56.36 1s3s n ARG 53 Cb 0.58 -3.04 0.00 0.00 0.45 0.00 0.00 32.46 30.45 1s3s n ARG 53 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 1s3s n GLY 54 N 6.41 1.07 3.71 5.14 0.00 -1.11 -4.98 105.19 115.43 1s3s n GLY 54 Ca 0.50 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 46.10 1s3s n GLY 54 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1s3s s ASP 55 N -0.75 7.27 0.23 1.61 1.11 -0.23 -4.65 116.67 121.25 1s3s s ASP 55 Ca 0.00 1.76 -0.31 0.00 0.18 0.00 0.00 52.55 54.17 1s3s s ASP 55 Cb 0.00 -2.57 -0.11 0.00 1.07 0.00 0.00 42.92 41.31 1s3s s ASP 55 CO 0.00 -0.34 1.63 0.42 1.18 0.00 0.00 175.17 178.05 1s3s s THR 56 N 1.14 2.22 0.45 -1.27 -4.23 -1.26 -3.22 115.64 109.47 1s3s s THR 56 Ca 0.54 0.17 0.04 0.00 -1.18 0.00 0.00 61.69 61.25 1s3s s THR 56 Cb -0.23 -3.11 0.04 0.00 1.34 0.00 0.00 72.50 70.54 1s3s s THR 56 CO 0.27 0.02 0.31 1.33 -0.54 0.00 0.00 174.62 176.01 1s3s n VAL 57 N 3.31 0.00 -3.72 2.29 0.24 -0.19 -2.76 118.33 117.50 1s3s n VAL 57 Ca 0.12 -1.81 -0.17 0.00 -2.04 0.00 0.00 64.34 60.44 1s3s n VAL 57 Cb 0.37 -0.06 -0.17 0.00 -1.47 0.00 0.00 33.84 32.51 1s3s n VAL 57 CO 0.00 0.00 0.00 -0.22 -2.14 0.00 0.00 176.83 174.47 1s3s s LEU 58 N 0.00 0.63 0.06 1.34 2.96 0.20 -3.16 118.68 120.70 1s3s s LEU 58 Ca 0.23 0.06 0.05 0.00 -0.22 0.00 0.00 54.13 54.25 1s3s s LEU 58 Cb -0.02 -0.11 -0.04 0.00 0.50 0.00 0.00 46.19 46.53 1s3s s LEU 58 CO 0.15 -0.19 -0.07 -0.76 -1.32 0.00 0.00 176.35 174.16 1s3s s LEU 59 N 1.60 3.17 -0.05 -0.68 1.43 -0.25 -1.75 118.68 122.15 1s3s s LEU 59 Ca -0.02 -0.24 0.04 0.00 -1.03 0.00 0.00 54.13 52.87 1s3s s LEU 59 Cb -0.13 -1.89 0.00 0.00 0.03 0.00 0.00 46.19 44.20 1s3s s LEU 59 CO -0.03 0.22 -0.16 -0.54 0.23 0.00 0.00 176.35 176.08 1s3s s LYS 60 N -1.87 1.79 0.00 1.70 1.02 -0.80 -2.31 119.74 119.27 1s3s s LYS 60 Ca 0.20 -0.56 0.00 0.00 0.02 0.00 0.00 55.97 55.64 1s3s s LYS 60 Cb -0.11 -1.52 0.00 0.00 -0.52 0.00 0.00 37.83 35.68 1s3s s LYS 60 CO 0.12 0.18 0.00 0.41 -0.92 0.00 0.00 175.35 175.13 1s3s n GLY 61 N 3.34 5.25 3.92 -3.33 0.00 0.42 -2.29 105.19 112.50 1s3s n GLY 61 Ca -0.19 -1.50 -0.26 0.00 0.00 0.00 0.00 46.02 44.07 1s3s n GLY 61 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1s3s s LYS 62 N 2.66 2.17 -1.39 1.61 1.02 -1.21 -3.78 119.74 120.81 1s3s s LYS 62 Ca 0.00 -0.17 0.00 0.00 0.02 0.00 0.00 55.97 55.82 1s3s s LYS 62 Cb 0.00 -2.13 0.00 0.00 -0.52 0.00 0.00 37.83 35.18 1s3s s LYS 62 CO 0.00 -1.30 0.00 1.63 -0.92 0.00 0.00 175.35 174.76 1s3s n LYS 63 N -3.00 -1.51 -3.12 1.68 5.02 -1.26 -1.69 118.16 114.29 1s3s n LYS 63 Ca 0.08 0.86 -0.21 0.00 -2.02 0.00 0.00 58.31 57.02 1s3s n LYS 63 Cb 0.60 -5.12 0.04 0.00 -0.02 0.00 0.00 35.03 30.54 1s3s n LYS 63 CO 0.00 0.00 0.00 -2.13 -0.52 0.00 0.00 177.40 174.75 1s3s n ARG 64 N -1.47 -5.36 -3.45 1.97 3.00 -1.25 -5.00 116.66 105.10 1s3s n ARG 64 Ca -0.13 0.83 -0.26 0.00 -0.00 0.00 0.00 57.85 58.29 1s3s n ARG 64 Cb 0.52 -5.61 -0.02 0.00 0.00 0.00 0.00 32.46 27.35 1s3s n ARG 64 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.63 178.66 1s3s s ARG 65 N -5.78 3.53 0.31 -0.14 0.52 -0.68 -4.90 118.95 111.81 1s3s s ARG 65 Ca 0.35 -0.25 0.02 0.00 -0.52 0.00 0.00 55.73 55.34 1s3s s ARG 65 Cb -0.16 -2.70 -0.02 0.00 0.52 0.00 0.00 34.95 32.59 1s3s s ARG 65 CO 0.44 0.23 0.33 -1.21 0.02 0.00 0.00 175.30 175.11 1s3s s GLU 66 N -3.86 1.71 0.00 3.54 2.02 -1.26 -0.44 118.70 120.42 1s3s s GLU 66 Ca 0.41 -1.85 0.00 0.00 0.02 0.00 0.00 54.97 53.55 1s3s s GLU 66 Cb -0.10 0.36 0.00 0.00 0.10 0.00 0.00 34.13 34.49 1s3s s GLU 66 CO 0.33 -0.66 0.00 0.00 0.02 0.00 0.00 175.26 174.95 1s3s n ALA 67 N -0.54 0.00 -2.79 5.21 0.00 -0.98 -4.73 120.51 116.68 1s3s n ALA 67 Ca 0.04 0.00 -0.29 0.00 0.00 0.00 0.00 53.44 53.19 1s3s n ALA 67 Cb 0.63 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 20.02 1s3s n ALA 67 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 1s3s s VAL 68 N -2.00 4.57 -0.08 0.00 1.01 -1.26 -1.09 120.40 121.55 1s3s s VAL 68 Ca 0.00 -0.83 -0.30 0.00 0.00 0.00 0.00 61.98 60.85 1s3s s VAL 68 Cb 0.00 -3.24 0.09 0.00 0.00 0.00 0.00 36.38 33.23 1s3s s VAL 68 CO 0.00 0.06 0.79 0.00 0.00 0.00 0.00 175.10 175.96 1s3s s ILE 70 N -1.34 3.31 -0.35 0.00 -1.09 -0.37 -1.02 121.20 120.34 1s3s s ILE 70 Ca -0.07 1.05 0.04 0.00 -2.23 0.00 0.00 60.65 59.44 1s3s s ILE 70 Cb -0.00 -3.57 0.10 0.00 -1.58 0.00 0.00 42.46 37.41 1s3s s ILE 70 CO 0.05 0.05 0.07 0.54 -1.23 0.00 0.00 174.94 174.43 1s3s s VAL 71 N -1.50 2.36 0.43 2.92 0.11 -1.20 -1.73 120.40 121.79 1s3s s VAL 71 Ca 0.58 -2.36 -0.03 0.00 -2.93 0.00 0.00 61.98 57.24 1s3s s VAL 71 Cb -0.28 -2.73 0.09 0.00 -1.53 0.00 0.00 36.38 31.93 1s3s s VAL 71 CO 0.35 -0.61 0.59 0.18 -3.33 0.00 0.00 175.10 172.28 1s3s n LEU 72 N 4.24 0.00 -4.50 2.54 4.77 -0.55 -2.76 117.00 120.73 1s3s n LEU 72 Ca 0.04 -1.01 -0.32 0.00 -0.03 0.00 0.00 56.01 54.69 1s3s n LEU 72 Cb 0.42 -0.41 -0.12 0.00 -2.33 0.00 0.00 43.42 40.97 1s3s n LEU 72 CO 0.23 -0.84 -0.45 -0.94 -1.33 0.00 0.00 177.39 174.06 1s3s s SER 73 N -3.31 4.10 -0.03 -1.43 1.04 -1.26 -3.16 113.70 109.65 1s3s s SER 73 Ca 0.37 -0.27 -0.00 0.00 0.48 0.00 0.00 55.95 56.53 1s3s s SER 73 Cb -0.02 -0.82 0.03 0.00 0.10 0.00 0.00 66.02 65.31 1s3s s SER 73 CO 0.25 0.29 0.02 -0.62 0.98 0.00 0.00 173.24 174.16 1s3s s ASP 74 N -1.20 0.46 0.32 7.02 -1.08 0.59 -4.85 116.67 117.92 1s3s s ASP 74 Ca 0.14 0.00 0.17 0.00 -0.52 0.00 0.00 52.55 52.35 1s3s s ASP 74 Cb -0.11 -0.18 0.14 0.00 -1.46 0.00 0.00 42.92 41.31 1s3s s ASP 74 CO 0.04 -0.13 1.47 -2.24 0.52 0.00 0.00 175.17 174.83 1s3s h ASP 75 N 7.46 0.00 1.79 -0.34 2.03 -1.99 -3.15 116.42 122.22 1s3s h ASP 75 Ca -0.39 0.00 -0.01 0.00 -0.73 0.00 0.00 57.03 55.91 1s3s h ASP 75 Cb 1.13 0.00 -0.00 0.00 -0.83 0.00 0.00 39.33 39.63 1s3s h ASP 75 CO 0.43 0.35 -0.21 0.74 -1.03 0.00 0.00 179.24 179.52 1s3s h THR 76 N 0.00 0.04 -3.14 1.15 2.02 -1.95 -3.45 112.91 107.59 1s3s h THR 76 Ca -0.01 -1.07 -0.53 0.00 0.77 0.00 0.00 66.41 65.58 1s3s h THR 76 Cb 1.27 1.93 0.02 0.00 -1.74 0.00 0.00 68.15 69.63 1s3s h THR 76 CO 0.04 0.03 0.64 0.00 0.37 0.00 0.00 175.52 176.60 1s3s s SER 78 N 0.96 6.33 0.02 0.00 0.01 -1.26 -4.19 113.70 115.57 1s3s s SER 78 Ca 0.61 1.65 -0.04 0.00 1.31 0.00 0.00 55.95 59.47 1s3s s SER 78 Cb -0.33 -2.52 -0.01 0.00 0.21 0.00 0.00 66.02 63.37 1s3s s SER 78 CO 0.31 -0.79 1.07 0.44 0.41 0.00 0.00 173.24 174.68 1s3s h ASP 79 N 0.72 -0.28 0.00 2.44 5.19 -1.95 -0.78 116.42 121.76 1s3s h ASP 79 Ca -0.47 0.04 0.00 0.00 -0.62 0.00 0.00 57.03 55.98 1s3s h ASP 79 Cb 1.20 0.12 0.00 0.00 0.18 0.00 0.00 39.33 40.83 1s3s h ASP 79 CO 0.60 -0.04 0.00 1.21 -3.12 0.00 0.00 179.24 177.89 1s3s n GLU 80 N -3.22 0.65 -4.05 3.56 4.07 -1.26 -4.68 120.64 115.71 1s3s n GLU 80 Ca 0.00 0.00 -0.36 0.00 -0.06 0.00 0.00 57.16 56.74 1s3s n GLU 80 Cb 0.04 -1.31 -0.07 0.00 -0.06 0.00 0.00 31.44 30.04 1s3s n GLU 80 CO 0.00 0.00 0.00 0.15 -0.06 0.00 0.00 177.13 177.22 1s3s s LYS 81 N -2.00 3.27 -0.17 5.31 1.02 -0.30 0.71 119.74 127.59 1s3s s LYS 81 Ca 0.20 -0.25 0.01 0.00 0.02 0.00 0.00 55.97 55.94 1s3s s LYS 81 Cb 0.09 -3.04 0.02 0.00 -0.52 0.00 0.00 37.83 34.38 1s3s s LYS 81 CO 0.15 0.74 -0.17 -1.50 -0.92 0.00 0.00 175.35 173.65 1s3s s ILE 82 N -1.02 1.83 0.02 2.17 2.07 0.36 -4.52 121.20 122.10 1s3s s ILE 82 Ca 0.16 -0.84 -0.29 0.00 -1.41 0.00 0.00 60.65 58.27 1s3s s ILE 82 Cb -0.12 -1.70 -0.04 0.00 0.13 0.00 0.00 42.46 40.73 1s3s s ILE 82 CO 0.05 0.47 0.95 -0.13 -1.91 0.00 0.00 174.94 174.37 1s3s s ARG 83 N 1.37 4.58 0.08 3.50 0.52 0.10 -1.49 118.95 127.61 1s3s s ARG 83 Ca 0.04 1.37 -0.26 0.00 -0.52 0.00 0.00 55.73 56.37 1s3s s ARG 83 Cb -0.13 -3.44 0.08 0.00 0.52 0.00 0.00 34.95 31.98 1s3s s ARG 83 CO -0.12 0.02 0.70 0.00 0.02 0.00 0.00 175.30 175.93 1s3s s MET 84 N 0.76 1.10 0.34 3.54 0.23 -0.99 -0.66 119.30 123.62 1s3s s MET 84 Ca 0.49 -0.30 0.08 0.00 -1.03 0.00 0.00 55.69 54.93 1s3s s MET 84 Cb -0.21 0.51 -0.03 0.00 -1.53 0.00 0.00 34.83 33.57 1s3s s MET 84 CO 0.27 -0.46 0.27 0.54 -2.03 0.00 0.00 175.02 173.61 1s3s s ASN 85 N -2.40 5.15 0.48 -1.18 2.20 -1.26 -1.15 114.94 116.79 1s3s s ASN 85 Ca 0.00 -0.56 0.38 0.00 -0.94 0.00 0.00 52.86 51.74 1s3s s ASN 85 Cb -0.01 -0.91 1.57 0.00 -2.00 0.00 0.00 41.25 39.91 1s3s s ASN 85 CO -0.08 -0.36 1.59 0.03 -2.94 0.00 0.00 177.10 175.35 1s3s h ARG 86 N 1.30 0.02 0.83 3.55 3.08 -1.98 -1.93 114.38 119.24 1s3s h ARG 86 Ca -0.44 -0.00 -0.04 0.00 0.07 0.00 0.00 59.98 59.57 1s3s h ARG 86 Cb 1.25 -0.00 0.01 0.00 0.08 0.00 0.00 29.97 31.31 1s3s h ARG 86 CO 0.59 0.01 -0.41 -0.24 -1.07 0.00 0.00 179.97 178.85 1s3s h VAL 87 N 0.02 0.00 0.33 2.04 3.04 -1.94 0.17 116.25 119.92 1s3s h VAL 87 Ca 0.88 0.00 -0.01 0.00 -1.01 0.00 0.00 66.70 66.56 1s3s h VAL 87 Cb 3.09 0.00 -0.00 0.00 -2.01 0.00 0.00 31.29 32.37 1s3s h VAL 87 CO -0.29 0.00 -0.21 0.58 -1.01 0.00 0.00 177.57 176.64 1s3s h VAL 88 N -1.13 0.00 -1.59 1.51 2.07 -1.65 -1.42 116.25 114.04 1s3s h VAL 88 Ca -0.11 0.00 0.46 0.00 0.82 0.00 0.00 66.70 67.87 1s3s h VAL 88 Cb 0.87 0.00 -0.06 0.00 -1.52 0.00 0.00 31.29 30.58 1s3s h VAL 88 CO 0.17 0.00 1.20 0.54 0.02 0.00 0.00 177.57 179.50 1s3s n ARG 89 N -3.56 0.00 0.06 1.57 1.74 -0.79 0.30 116.66 115.98 1s3s n ARG 89 Ca -0.06 0.92 -0.17 0.00 -0.77 0.00 0.00 57.85 57.76 1s3s n ARG 89 Cb 0.21 -2.14 -0.14 0.00 -1.02 0.00 0.00 32.46 29.37 1s3s n ARG 89 CO 0.00 0.00 0.00 -0.91 -1.52 0.00 0.00 177.63 175.20 1s3s h ASN 90 N 0.00 0.40 -0.83 0.55 -0.26 -0.19 0.15 115.58 115.40 1s3s h ASN 90 Ca 0.75 -0.56 -0.02 0.00 -0.56 0.00 0.00 56.30 55.92 1s3s h ASN 90 Cb 3.14 -0.13 -0.04 0.00 -1.06 0.00 0.00 38.32 40.23 1s3s h ASN 90 CO -0.01 1.46 0.45 0.78 -1.06 0.00 0.00 177.43 179.05 1s3s h ASN 91 N 0.07 1.04 0.48 5.81 2.35 0.55 -0.92 115.58 124.95 1s3s h ASN 91 Ca -0.25 -0.10 0.00 0.00 -0.55 0.00 0.00 56.30 55.40 1s3s h ASN 91 Cb 2.02 -0.26 0.00 0.00 0.05 0.00 0.00 38.32 40.13 1s3s h ASN 91 CO 0.16 0.84 0.00 0.18 -1.65 0.00 0.00 177.43 176.97 1s3s n LEU 92 N -4.39 0.00 -3.64 1.61 4.77 -0.16 -4.60 117.00 110.59 1s3s n LEU 92 Ca 0.08 0.26 -0.21 0.00 -0.03 0.00 0.00 56.01 56.11 1s3s n LEU 92 Cb 0.10 -0.26 0.04 0.00 -2.33 0.00 0.00 43.42 40.97 1s3s n LEU 92 CO 0.38 -0.02 -0.04 0.54 -1.33 0.00 0.00 177.39 176.92 1s3s n ARG 93 N -1.26 -4.60 -4.18 3.23 5.12 -0.35 -3.35 116.66 111.27 1s3s n ARG 93 Ca 0.14 0.65 -0.13 0.00 -1.93 0.00 0.00 57.85 56.58 1s3s n ARG 93 Cb 0.21 -5.21 -0.11 0.00 -1.16 0.00 0.00 32.46 26.20 1s3s n ARG 93 CO 0.00 0.00 0.00 0.14 -1.93 0.00 0.00 177.63 175.84 1s3s s VAL 94 N -3.60 0.87 0.55 1.55 -7.23 0.01 -4.56 120.40 107.98 1s3s s VAL 94 Ca 0.07 -1.73 0.06 0.00 -1.81 0.00 0.00 61.98 58.56 1s3s s VAL 94 Cb -0.02 -1.46 0.05 0.00 0.56 0.00 0.00 36.38 35.51 1s3s s VAL 94 CO 0.80 -0.66 0.45 -0.13 -0.31 0.00 0.00 175.10 175.26 1s3s s ARG 95 N -3.11 2.26 0.09 4.82 1.81 -1.26 -4.49 118.95 119.06 1s3s s ARG 95 Ca 0.08 -1.99 -0.30 0.00 -1.72 0.00 0.00 55.73 51.80 1s3s s ARG 95 Cb -0.00 -2.16 -0.06 0.00 -0.45 0.00 0.00 34.95 32.28 1s3s s ARG 95 CO -0.01 -0.66 1.15 -0.51 -0.68 0.00 0.00 175.30 174.59 1s3s s LEU 96 N -4.33 4.40 0.00 2.53 1.43 -1.26 -3.27 118.68 118.18 1s3s s LEU 96 Ca 0.37 2.00 0.00 0.00 -1.03 0.00 0.00 54.13 55.47 1s3s s LEU 96 Cb -0.03 -3.59 0.00 0.00 0.03 0.00 0.00 46.19 42.61 1s3s s LEU 96 CO 0.23 -0.38 0.00 0.61 0.23 0.00 0.00 176.35 177.04 1s3s n GLY 97 N 2.83 2.43 3.81 -3.19 0.00 0.23 -4.99 105.19 106.31 1s3s n GLY 97 Ca 0.07 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.80 1s3s n GLY 97 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1s3s s ASP 98 N -1.60 3.64 -0.03 1.61 1.01 -1.20 -4.58 116.67 115.51 1s3s s ASP 98 Ca 0.00 0.90 -0.01 0.00 0.71 0.00 0.00 52.55 54.16 1s3s s ASP 98 Cb 0.00 -1.44 -0.04 0.00 1.01 0.00 0.00 42.92 42.45 1s3s s ASP 98 CO 0.00 -2.46 0.05 -0.69 0.21 0.00 0.00 175.17 172.27 1s3s s VAL 99 N -3.35 4.55 0.09 -1.27 1.01 -1.26 -0.92 120.40 119.26 1s3s s VAL 99 Ca 0.64 -0.36 0.03 0.00 0.00 0.00 0.00 61.98 62.29 1s3s s VAL 99 Cb -0.14 -3.02 -0.04 0.00 0.00 0.00 0.00 36.38 33.19 1s3s s VAL 99 CO 0.53 0.44 -0.09 0.27 0.00 0.00 0.00 175.10 176.24 1s3s s ILE 100 N -1.08 0.89 -0.33 2.22 -5.25 -0.21 -4.83 121.20 112.61 1s3s s ILE 100 Ca 0.19 -1.65 -0.07 0.00 -0.99 0.00 0.00 60.65 58.13 1s3s s ILE 100 Cb -0.12 -1.36 0.03 0.00 2.95 0.00 0.00 42.46 43.96 1s3s s ILE 100 CO 0.09 -0.59 0.11 -0.44 -1.79 0.00 0.00 174.94 172.32 1s3s s SER 101 N -2.48 5.31 -0.09 4.36 0.01 -0.97 -0.44 113.70 119.39 1s3s s SER 101 Ca 0.06 -1.02 -0.10 0.00 1.31 0.00 0.00 55.95 56.19 1s3s s SER 101 Cb -0.02 -1.89 -0.05 0.00 0.21 0.00 0.00 66.02 64.27 1s3s s SER 101 CO -0.01 -0.30 0.25 -0.51 0.41 0.00 0.00 173.24 173.08 1s3s s ILE 102 N 1.44 5.32 -0.12 1.44 2.07 0.18 -1.90 121.20 129.64 1s3s s ILE 102 Ca -0.00 0.46 -0.11 0.00 -1.41 0.00 0.00 60.65 59.59 1s3s s ILE 102 Cb -0.19 -3.53 0.03 0.00 0.13 0.00 0.00 42.46 38.90 1s3s s ILE 102 CO 0.03 0.58 0.31 -1.10 -1.91 0.00 0.00 174.94 172.85 1s3s s GLN 103 N -0.84 0.36 0.92 3.50 -0.21 -0.72 -4.65 119.66 118.02 1s3s s GLN 103 Ca 0.18 0.45 -0.10 0.00 0.02 0.00 0.00 55.36 55.90 1s3s s GLN 103 Cb -0.14 0.17 0.15 0.00 1.00 0.00 0.00 33.01 34.19 1s3s s GLN 103 CO 0.07 -0.05 1.13 -2.14 -2.12 0.00 0.00 175.29 172.18 1s3s s PRO 104 N 0.22 1.00 -0.50 2.91 0.02 -1.26 -0.63 135.00 136.76 1s3s s PRO 104 Ca -0.00 1.41 0.07 0.00 0.02 0.00 0.00 61.00 62.49 1s3s s PRO 104 Cb -0.03 -1.74 0.20 0.00 0.02 0.00 0.00 34.50 32.96 1s3s s PRO 104 CO -0.00 -2.60 0.72 0.00 -0.33 0.00 0.00 177.00 174.79 1s3s n PRO 106 N 2.63 0.62 0.00 0.00 -0.02 -1.26 -3.54 135.00 133.43 1s3s n PRO 106 Ca 0.17 0.00 0.06 0.00 -2.02 0.00 0.00 63.50 61.71 1s3s n PRO 106 Cb 0.57 -1.12 0.30 0.00 -0.02 0.00 0.00 33.50 33.23 1s3s n PRO 106 CO 0.00 0.00 0.00 -3.47 1.98 0.00 0.00 175.50 174.01 1s3s n ASP 107 N -0.24 0.00 -0.13 2.55 -0.08 -1.26 -4.87 116.55 112.52 1s3s n ASP 107 Ca 0.00 -0.03 -0.01 0.00 -1.51 0.00 0.00 54.79 53.24 1s3s n ASP 107 Cb 0.06 -0.20 -0.00 0.00 2.34 0.00 0.00 41.12 43.32 1s3s n ASP 107 CO 0.00 0.00 0.00 0.55 0.12 0.00 0.00 177.20 177.87 1s3s n VAL 108 N -1.20 0.00 -3.51 5.18 3.14 -1.23 -4.87 118.33 115.85 1s3s n VAL 108 Ca 0.06 0.00 -0.42 0.00 -2.96 0.00 0.00 64.34 61.02 1s3s n VAL 108 Cb 0.07 -0.01 -0.08 0.00 -1.06 0.00 0.00 33.84 32.76 1s3s n VAL 108 CO 0.00 0.00 0.00 -0.54 -6.46 0.00 0.00 176.83 169.83 1s3s s LYS 109 N 0.25 2.66 -0.94 1.45 1.02 -1.26 -4.98 119.74 117.94 1s3s s LYS 109 Ca 0.04 -1.62 -0.25 0.00 0.02 0.00 0.00 55.97 54.16 1s3s s LYS 109 Cb -0.04 -3.97 -0.11 0.00 -0.52 0.00 0.00 37.83 33.19 1s3s s LYS 109 CO 0.01 -1.13 2.12 0.71 -0.92 0.00 0.00 175.35 176.14 1s3s s TYR 110 N 1.45 1.53 1.11 3.18 1.51 -1.26 -0.75 117.35 124.12 1s3s s TYR 110 Ca 0.04 1.28 -0.19 0.00 -1.01 0.00 0.00 57.07 57.20 1s3s s TYR 110 Cb -0.26 -3.74 0.10 0.00 -0.11 0.00 0.00 41.96 37.96 1s3s s TYR 110 CO 0.02 -1.45 -0.04 0.41 -1.11 0.00 0.00 175.55 173.38 1s3s n GLY 111 N 6.58 -2.56 0.76 0.71 0.00 -1.19 -4.87 105.19 104.62 1s3s n GLY 111 Ca 0.43 -0.77 -0.03 0.00 0.00 0.00 0.00 46.02 45.64 1s3s n GLY 111 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1s3s n LYS 112 N -1.89 0.07 -4.00 1.61 5.02 -1.26 -4.55 118.16 113.16 1s3s n LYS 112 Ca 0.01 0.03 -0.23 0.00 -2.02 0.00 0.00 58.31 56.10 1s3s n LYS 112 Cb 0.60 -0.69 -0.06 0.00 -0.02 0.00 0.00 35.03 34.87 1s3s n LYS 112 CO 0.00 0.00 0.00 -0.98 -0.52 0.00 0.00 177.40 175.90 1s3s s ARG 113 N -2.06 2.39 -0.28 1.97 1.04 -1.26 0.18 118.95 120.94 1s3s s ARG 113 Ca -0.05 -1.59 -0.22 0.00 -1.04 0.00 0.00 55.73 52.84 1s3s s ARG 113 Cb 0.02 -2.19 0.08 0.00 -2.04 0.00 0.00 34.95 30.82 1s3s s ARG 113 CO 0.06 0.01 0.75 0.42 -0.04 0.00 0.00 175.30 176.50 1s3s s ILE 114 N -2.46 0.00 -0.29 4.99 1.01 -0.06 -2.65 121.20 121.74 1s3s s ILE 114 Ca 0.40 0.00 0.01 0.00 0.00 0.00 0.00 60.65 61.06 1s3s s ILE 114 Cb -0.01 -1.00 0.08 0.00 0.01 0.00 0.00 42.46 41.54 1s3s s ILE 114 CO 0.24 0.00 0.03 -2.28 0.00 0.00 0.00 174.94 172.93 1s3s s HIS 115 N 0.84 2.48 -0.06 3.97 5.65 -1.20 0.14 115.29 127.11 1s3s s HIS 115 Ca -0.04 -2.05 0.03 0.00 0.25 0.00 0.00 55.06 53.25 1s3s s HIS 115 Cb -0.05 -1.97 -0.02 0.00 -1.18 0.00 0.00 32.58 29.36 1s3s s HIS 115 CO -0.08 -0.85 -0.14 0.14 -0.65 0.00 0.00 174.74 173.16 1s3s s VAL 116 N 1.35 3.04 -0.18 0.89 -7.23 -0.97 -0.92 120.40 116.39 1s3s s VAL 116 Ca 0.04 -0.72 -0.00 0.00 -1.81 0.00 0.00 61.98 59.49 1s3s s VAL 116 Cb -0.18 -2.20 0.04 0.00 0.56 0.00 0.00 36.38 34.60 1s3s s VAL 116 CO -0.13 0.58 -0.07 -0.76 -0.31 0.00 0.00 175.10 174.41 1s3s s LEU 117 N -0.57 1.84 0.87 1.32 1.43 -1.17 -3.94 118.68 118.45 1s3s s LEU 117 Ca 0.08 -0.74 -0.11 0.00 -1.03 0.00 0.00 54.13 52.33 1s3s s LEU 117 Cb -0.11 -1.02 0.12 0.00 0.03 0.00 0.00 46.19 45.20 1s3s s LEU 117 CO 0.01 -0.17 1.16 -2.16 0.23 0.00 0.00 176.35 175.42 1s3s s PRO 118 N 1.55 1.28 -0.44 1.29 0.04 -1.26 -3.06 135.00 134.40 1s3s s PRO 118 Ca 0.00 1.58 -0.16 0.00 0.04 0.00 0.00 61.00 62.46 1s3s s PRO 118 Cb -0.16 -1.75 0.03 0.00 0.04 0.00 0.00 34.50 32.67 1s3s s PRO 118 CO -0.08 -2.45 0.41 0.42 0.04 0.00 0.00 177.00 175.34 1s3s s ILE 119 N -2.52 5.14 0.00 0.56 1.01 -0.34 0.80 121.20 125.85 1s3s s ILE 119 Ca 0.68 -0.58 0.00 0.00 0.00 0.00 0.00 60.65 60.75 1s3s s ILE 119 Cb -0.24 -4.05 0.00 0.00 0.01 0.00 0.00 42.46 38.18 1s3s s ILE 119 CO 0.56 -0.46 0.00 -0.90 0.00 0.00 0.00 174.94 174.14 1s3s n ASP 120 N 5.45 0.00 0.27 3.58 5.68 -1.03 0.15 116.55 130.65 1s3s n ASP 120 Ca -0.09 0.00 0.15 0.00 -0.50 0.00 0.00 54.79 54.34 1s3s n ASP 120 Cb 0.46 0.00 0.73 0.00 -1.14 0.00 0.00 41.12 41.18 1s3s n ASP 120 CO 0.00 0.00 0.00 -2.24 -1.33 0.00 0.00 177.20 173.63 1s3s h ASP 121 N 0.00 0.00 0.03 -1.12 2.03 -1.94 -2.00 116.42 113.42 1s3s h ASP 121 Ca 0.00 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.30 1s3s h ASP 121 Cb 0.00 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 38.50 1s3s h ASP 121 CO 0.00 0.10 -0.04 0.35 -1.03 0.00 0.00 179.24 178.62 1s3s n THR 122 N -3.38 0.00 -0.80 1.15 -2.24 0.39 -3.84 114.28 105.56 1s3s n THR 122 Ca -0.01 -0.22 0.03 0.00 -2.27 0.00 0.00 64.05 61.58 1s3s n THR 122 Cb 0.27 0.44 0.05 0.00 -2.10 0.00 0.00 70.33 68.98 1s3s n THR 122 CO 0.00 0.00 0.00 1.33 -0.57 0.00 0.00 175.07 175.83 1s3s n VAL 123 N 0.00 0.99 -1.70 2.28 0.24 -0.79 -4.47 118.33 114.89 1s3s n VAL 123 Ca 0.18 -1.12 -0.43 0.00 -2.04 0.00 0.00 64.34 60.93 1s3s n VAL 123 Cb 0.34 0.34 -0.03 0.00 -1.47 0.00 0.00 33.84 33.01 1s3s n VAL 123 CO 0.00 0.00 0.00 -0.62 -2.14 0.00 0.00 176.83 174.07 1s3s n GLU 124 N -0.66 2.61 0.00 7.34 1.02 -0.99 -2.69 120.64 127.27 1s3s n GLU 124 Ca 0.05 0.94 0.00 0.00 -0.02 0.00 0.00 57.16 58.14 1s3s n GLU 124 Cb 0.48 -2.78 0.00 0.00 -0.02 0.00 0.00 31.44 29.12 1s3s n GLU 124 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1s3s n GLY 125 N 3.93 2.35 3.76 0.62 0.00 -1.26 -4.98 105.19 109.61 1s3s n GLY 125 Ca 0.17 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.80 1s3s n GLY 125 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1s3s s ILE 126 N -0.77 4.88 0.46 -0.61 -4.36 -1.10 -4.15 121.20 115.56 1s3s s ILE 126 Ca 0.00 1.30 0.03 0.00 -0.26 0.00 0.00 60.65 61.72 1s3s s ILE 126 Cb 0.00 -3.96 -0.01 0.00 1.25 0.00 0.00 42.46 39.74 1s3s s ILE 126 CO 0.00 0.41 0.10 -0.89 0.24 0.00 0.00 174.94 174.80 1s3s s THR 127 N -0.16 0.67 0.00 8.37 2.01 -1.16 -4.89 115.64 120.49 1s3s s THR 127 Ca 0.32 -2.00 0.00 0.00 0.31 0.00 0.00 61.69 60.32 1s3s s THR 127 Cb -0.19 -2.19 0.00 0.00 0.01 0.00 0.00 72.50 70.13 1s3s s THR 127 CO 0.18 0.00 0.00 0.61 -0.69 0.00 0.00 174.62 174.72 1s3s n GLY 128 N -1.08 -1.05 3.58 4.40 0.00 -1.26 0.53 105.19 110.32 1s3s n GLY 128 Ca -0.11 -1.42 -0.52 0.00 0.00 0.00 0.00 46.02 43.96 1s3s n GLY 128 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1s3s n ASN 129 N -0.89 1.55 0.02 1.61 5.03 -1.26 -4.69 115.26 116.63 1s3s n ASN 129 Ca 0.00 1.12 -0.06 0.00 0.87 0.00 0.00 54.58 56.51 1s3s n ASN 129 Cb 0.00 -1.18 -0.11 0.00 -1.02 0.00 0.00 39.78 37.47 1s3s n ASN 129 CO 0.00 0.00 0.00 -0.07 -1.83 0.00 0.00 177.26 175.36 1s3s h LEU 130 N 4.43 0.00 -0.73 3.41 3.38 -1.99 -3.33 115.31 120.48 1s3s h LEU 130 Ca -0.48 0.00 0.10 0.00 0.09 0.00 0.00 57.88 57.59 1s3s h LEU 130 Cb 1.34 0.00 -0.12 0.00 0.09 0.00 0.00 40.66 41.97 1s3s h LEU 130 CO 0.77 0.90 -0.47 0.15 0.09 0.00 0.00 178.44 179.87 1s3s h PHE 131 N 0.00 -1.42 -0.48 1.13 -0.00 -1.95 0.97 116.94 115.19 1s3s h PHE 131 Ca -0.17 0.10 -0.06 0.00 -0.00 0.00 0.00 57.97 57.83 1s3s h PHE 131 Cb 1.83 0.72 -0.02 0.00 -0.00 0.00 0.00 35.95 38.48 1s3s h PHE 131 CO 0.00 -0.41 0.04 1.49 -0.00 0.00 0.00 178.31 179.42 1s3s h GLU 132 N -0.15 0.77 0.10 1.11 4.57 -1.97 0.17 114.58 119.18 1s3s h GLU 132 Ca 0.20 -0.19 -0.13 0.00 -1.18 0.00 0.00 59.36 58.06 1s3s h GLU 132 Cb 0.54 -0.10 0.02 0.00 -0.16 0.00 0.00 28.75 29.05 1s3s h GLU 132 CO -0.79 0.75 -0.57 0.28 -1.18 0.00 0.00 179.01 177.50 1s3s h VAL 133 N 0.73 1.60 0.00 0.32 2.07 -1.06 -3.41 116.25 116.49 1s3s h VAL 133 Ca 0.15 -2.48 0.00 0.00 0.82 0.00 0.00 66.70 65.19 1s3s h VAL 133 Cb 0.39 3.26 0.00 0.00 -1.52 0.00 0.00 31.29 33.43 1s3s h VAL 133 CO 0.01 0.69 -0.09 -1.22 0.02 0.00 0.00 177.57 176.98 1s3s n TYR 134 N -4.27 0.00 -0.19 1.57 4.01 0.31 -4.55 117.16 114.05 1s3s n TYR 134 Ca -0.13 0.00 -0.06 0.00 -0.16 0.00 0.00 57.90 57.55 1s3s n TYR 134 Cb 0.72 -0.05 -0.05 0.00 -0.31 0.00 0.00 39.34 39.66 1s3s n TYR 134 CO 0.00 0.00 0.00 -0.07 -0.46 0.00 0.00 176.86 176.33 1s3s h LEU 135 N -0.09 -1.08 -0.50 7.72 -0.00 -1.46 -1.18 115.31 118.72 1s3s h LEU 135 Ca 0.00 0.16 0.06 0.00 -0.00 0.00 0.00 57.88 58.10 1s3s h LEU 135 Cb 0.09 0.47 -0.09 0.00 -0.00 0.00 0.00 40.66 41.13 1s3s h LEU 135 CO 0.00 -0.13 -0.56 0.11 -0.00 0.00 0.00 178.44 177.86 1s3s h LYS 136 N -0.03 -0.32 -0.57 1.13 1.57 -0.91 -1.47 116.57 115.96 1s3s h LYS 136 Ca 0.07 0.02 0.11 0.00 -1.87 0.00 0.00 60.65 58.99 1s3s h LYS 136 Cb 0.22 0.07 -0.09 0.00 0.08 0.00 0.00 32.23 32.52 1s3s h LYS 136 CO -0.45 -0.22 0.07 -1.35 -0.57 0.00 0.00 179.45 176.94 1s3s h PRO 137 N -0.34 0.19 0.11 3.15 0.11 -1.69 -1.72 132.00 131.80 1s3s h PRO 137 Ca 0.09 -0.01 -0.00 0.00 0.11 0.00 0.00 66.00 66.18 1s3s h PRO 137 Cb 0.56 -0.04 -0.01 0.00 0.11 0.00 0.00 31.00 31.63 1s3s h PRO 137 CO -0.65 0.12 -0.12 -0.92 -0.21 0.00 0.00 178.00 176.22 1s3s h TYR 138 N 0.19 -0.35 0.00 0.65 3.20 -0.18 -3.24 116.97 117.24 1s3s h TYR 138 Ca 0.30 0.00 -0.09 0.00 3.14 0.00 0.00 58.73 62.08 1s3s h TYR 138 Cb 0.45 0.14 -0.01 0.00 1.54 0.00 0.00 36.73 38.84 1s3s h TYR 138 CO -0.29 -0.16 -0.42 0.74 -1.64 0.00 0.00 178.16 176.39 1s3s h PHE 139 N -0.23 0.00 0.00 -3.82 0.04 -1.48 -3.45 116.94 108.00 1s3s h PHE 139 Ca -0.01 0.00 -0.68 0.00 2.80 0.00 0.00 57.97 60.07 1s3s h PHE 139 Cb 0.21 0.00 -0.04 0.00 2.20 0.00 0.00 35.95 38.32 1s3s h PHE 139 CO -0.15 0.42 1.23 -0.11 -0.60 0.00 0.00 178.31 179.10 1s3s n LEU 140 N -3.99 0.65 -3.63 1.54 7.94 -0.65 -1.29 117.00 117.58 1s3s n LEU 140 Ca -0.02 0.59 -0.20 0.00 -1.11 0.00 0.00 56.01 55.27 1s3s n LEU 140 Cb 0.46 -0.82 0.05 0.00 0.53 0.00 0.00 43.42 43.63 1s3s n LEU 140 CO 0.39 -0.70 -0.03 -0.62 -1.11 0.00 0.00 177.39 175.33 1s3s n GLU 141 N 6.90 -5.14 0.00 1.96 1.02 -1.26 -4.89 120.64 119.22 1s3s n GLU 141 Ca 0.51 0.67 0.00 0.00 -0.02 0.00 0.00 57.16 58.32 1s3s n GLU 141 Cb -0.03 -5.33 0.00 0.00 -0.02 0.00 0.00 31.44 26.06 1s3s n GLU 141 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1s3s n ALA 142 N -4.21 0.97 -2.90 0.62 0.00 -0.41 -5.01 120.51 109.57 1s3s n ALA 142 Ca -0.29 0.00 -0.21 0.00 0.00 0.00 0.00 53.44 52.94 1s3s n ALA 142 Cb 0.67 0.04 0.01 0.00 0.00 0.00 0.00 19.45 20.18 1s3s n ALA 142 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1s3s n TYR 143 N -0.69 -1.68 -1.53 0.00 4.02 -1.20 -4.81 117.16 111.27 1s3s n TYR 143 Ca 0.00 0.34 -0.47 0.00 -0.01 0.00 0.00 57.90 57.76 1s3s n TYR 143 Cb 0.08 -3.81 -0.05 0.00 -0.02 0.00 0.00 39.34 35.54 1s3s n TYR 143 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 176.86 176.39 1s3s n ARG 144 N -3.60 1.58 -2.05 -0.72 1.74 -1.26 -4.44 116.66 107.91 1s3s n ARG 144 Ca -0.12 0.44 -0.41 0.00 -0.77 0.00 0.00 57.85 56.99 1s3s n ARG 144 Cb 0.61 -2.86 -0.02 0.00 -1.02 0.00 0.00 32.46 29.18 1s3s n ARG 144 CO 0.00 0.00 0.00 -1.25 -1.52 0.00 0.00 177.63 174.86 1s3s s PRO 145 N 6.18 4.30 0.05 5.56 0.04 -1.26 -3.26 135.00 146.61 1s3s s PRO 145 Ca 1.04 2.28 0.02 0.00 0.04 0.00 0.00 61.00 64.39 1s3s s PRO 145 Cb -0.59 -3.08 -0.03 0.00 0.04 0.00 0.00 34.50 30.84 1s3s s PRO 145 CO 0.42 -0.32 -0.08 0.96 0.04 0.00 0.00 177.00 178.02 1s3s s ILE 146 N -0.60 0.61 0.14 0.56 -4.36 -0.78 -4.80 121.20 111.96 1s3s s ILE 146 Ca 0.54 -1.25 0.11 0.00 -0.26 0.00 0.00 60.65 59.79 1s3s s ILE 146 Cb -0.41 -0.83 -0.04 0.00 1.25 0.00 0.00 42.46 42.43 1s3s s ILE 146 CO 0.49 -0.46 -0.26 -0.60 0.24 0.00 0.00 174.94 174.36 1s3s s ARG 147 N -1.99 1.38 0.60 0.37 3.00 -1.26 -2.41 118.95 118.64 1s3s s ARG 147 Ca -0.06 -1.36 -0.20 0.00 -1.00 0.00 0.00 55.73 53.12 1s3s s ARG 147 Cb -0.07 -1.82 -0.03 0.00 0.00 0.00 0.00 34.95 33.03 1s3s s ARG 147 CO -0.00 0.42 1.33 -1.59 0.00 0.00 0.00 175.30 175.46 1s3s s LYS 148 N -2.15 2.84 0.00 5.12 -2.85 -1.23 -2.69 119.74 118.77 1s3s s LYS 148 Ca 0.14 2.16 0.00 0.00 -1.00 0.00 0.00 55.97 57.28 1s3s s LYS 148 Cb -0.10 -2.05 0.00 0.00 -2.06 0.00 0.00 37.83 33.62 1s3s s LYS 148 CO 0.06 -1.41 0.00 0.41 0.10 0.00 0.00 175.35 174.52 1s3s n GLY 149 N 0.82 2.83 3.71 0.59 0.00 -0.18 -5.01 105.19 107.95 1s3s n GLY 149 Ca 0.13 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.84 1s3s n GLY 149 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1s3s s ASP 150 N -2.39 3.53 -0.21 1.61 1.01 -1.10 -4.69 116.67 114.44 1s3s s ASP 150 Ca 0.00 1.92 -0.01 0.00 0.71 0.00 0.00 52.55 55.17 1s3s s ASP 150 Cb 0.00 -2.49 0.06 0.00 1.01 0.00 0.00 42.92 41.50 1s3s s ASP 150 CO 0.00 -2.67 -0.01 -0.63 0.21 0.00 0.00 175.17 172.07 1s3s s ILE 151 N -2.78 1.00 0.41 0.77 1.01 -1.26 -0.75 121.20 119.59 1s3s s ILE 151 Ca 0.64 -0.83 0.08 0.00 0.00 0.00 0.00 60.65 60.54 1s3s s ILE 151 Cb -0.20 -1.37 -0.02 0.00 0.01 0.00 0.00 42.46 40.88 1s3s s ILE 151 CO 0.57 -0.12 0.40 0.72 0.00 0.00 0.00 174.94 176.51 1s3s s PHE 152 N 1.64 2.75 -0.05 3.97 -0.71 0.51 -4.87 117.98 121.23 1s3s s PHE 152 Ca -0.03 -0.45 0.03 0.00 -1.04 0.00 0.00 56.93 55.44 1s3s s PHE 152 Cb -0.18 -2.16 0.01 0.00 -1.21 0.00 0.00 43.02 39.48 1s3s s PHE 152 CO -0.07 -0.13 -0.12 -1.17 -1.34 0.00 0.00 175.22 172.39 1s3s s LEU 153 N -4.15 1.73 -0.13 -1.99 2.96 -1.26 -1.04 118.68 114.80 1s3s s LEU 153 Ca 0.48 -0.26 0.02 0.00 -0.22 0.00 0.00 54.13 54.15 1s3s s LEU 153 Cb -0.05 -0.75 -0.00 0.00 0.50 0.00 0.00 46.19 45.89 1s3s s LEU 153 CO 0.29 0.07 -0.19 -0.69 -1.32 0.00 0.00 176.35 174.50 1s3s s VAL 154 N 0.38 2.45 -0.06 1.68 1.01 -0.53 -4.95 120.40 120.37 1s3s s VAL 154 Ca -0.08 -0.87 -0.02 0.00 0.00 0.00 0.00 61.98 61.01 1s3s s VAL 154 Cb -0.12 -1.99 -0.04 0.00 0.00 0.00 0.00 36.38 34.23 1s3s s VAL 154 CO 0.02 0.54 0.07 -0.13 0.00 0.00 0.00 175.10 175.59 1s3s s ARG 155 N 0.52 3.11 0.00 2.72 0.52 -1.26 -0.65 118.95 123.90 1s3s s ARG 155 Ca -0.12 -0.39 0.00 0.00 -0.52 0.00 0.00 55.73 54.70 1s3s s ARG 155 Cb -0.17 -2.90 0.00 0.00 0.52 0.00 0.00 34.95 32.40 1s3s s ARG 155 CO 0.05 0.69 0.00 0.41 0.02 0.00 0.00 175.30 176.47 1s3s n GLY 156 N 1.67 -0.02 2.34 -3.53 0.00 -0.35 -4.97 105.19 100.33 1s3s n GLY 156 Ca -0.16 -1.59 -0.13 0.00 0.00 0.00 0.00 46.02 44.13 1s3s n GLY 156 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1s3s n GLY 157 N -1.43 -0.06 3.69 -0.02 0.00 -1.23 -1.39 105.19 104.75 1s3s n GLY 157 Ca 0.00 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.79 1s3s n GLY 157 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 1s3s n MET 158 N -2.60 -5.62 -3.90 1.61 0.00 0.32 -4.82 117.12 102.11 1s3s n MET 158 Ca -0.15 0.67 0.05 0.00 0.00 0.00 0.00 57.70 58.26 1s3s n MET 158 Cb 0.58 -5.42 0.01 0.00 0.00 0.00 0.00 33.22 28.38 1s3s n MET 158 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 175.97 174.99 1s3s s ARG 159 N -6.05 0.03 -0.06 0.03 1.70 -0.49 -4.91 118.95 109.21 1s3s s ARG 159 Ca 0.20 -0.02 0.02 0.00 -0.47 0.00 0.00 55.73 55.46 1s3s s ARG 159 Cb -0.10 0.01 0.01 0.00 -0.57 0.00 0.00 34.95 34.31 1s3s s ARG 159 CO 0.79 -0.01 -0.10 0.00 -1.08 0.00 0.00 175.30 174.90 1s3s s ALA 160 N -2.01 1.07 -0.11 7.88 0.00 -1.26 -1.21 121.76 126.12 1s3s s ALA 160 Ca 0.28 -0.30 -0.04 0.00 0.00 0.00 0.00 51.96 51.90 1s3s s ALA 160 Cb 0.02 -0.51 -0.04 0.00 0.00 0.00 0.00 23.12 22.60 1s3s s ALA 160 CO -0.04 0.08 0.04 0.08 0.00 0.00 0.00 175.76 175.93 1s3s s VAL 161 N 0.70 4.67 -0.14 0.00 1.01 0.17 -4.88 120.40 121.93 1s3s s VAL 161 Ca -0.13 -0.11 -0.15 0.00 0.00 0.00 0.00 61.98 61.60 1s3s s VAL 161 Cb -0.15 -3.00 -0.05 0.00 0.00 0.00 0.00 36.38 33.18 1s3s s VAL 161 CO 0.03 0.59 0.34 -1.61 0.00 0.00 0.00 175.10 174.45 1s3s s GLU 162 N -0.78 4.23 -0.06 2.72 2.02 -1.26 -1.45 118.70 124.12 1s3s s GLU 162 Ca 0.12 0.20 0.03 0.00 0.02 0.00 0.00 54.97 55.34 1s3s s GLU 162 Cb -0.12 -3.41 0.01 0.00 0.10 0.00 0.00 34.13 30.71 1s3s s GLU 162 CO 0.03 0.27 -0.13 -0.06 0.02 0.00 0.00 175.26 175.38 1s3s s PHE 163 N 0.35 1.50 -0.22 1.61 0.08 -0.21 -1.20 117.98 119.88 1s3s s PHE 163 Ca 0.19 -0.51 -0.05 0.00 0.12 0.00 0.00 56.93 56.68 1s3s s PHE 163 Cb -0.14 -1.07 -0.02 0.00 -0.57 0.00 0.00 43.02 41.22 1s3s s PHE 163 CO 0.06 -0.23 0.01 0.21 -0.10 0.00 0.00 175.22 175.17 1s3s s LYS 164 N 0.44 3.57 -0.07 0.44 2.20 -1.17 -0.36 119.74 124.79 1s3s s LYS 164 Ca -0.11 -0.53 -0.30 0.00 -0.36 0.00 0.00 55.97 54.67 1s3s s LYS 164 Cb -0.14 -3.13 -0.05 0.00 -1.51 0.00 0.00 37.83 33.00 1s3s s LYS 164 CO 0.03 -0.09 1.65 0.08 -0.36 0.00 0.00 175.35 176.66 1s3s s VAL 165 N 1.29 3.59 -0.45 4.02 1.01 0.07 -3.06 120.40 126.87 1s3s s VAL 165 Ca 0.04 0.71 0.03 0.00 0.00 0.00 0.00 61.98 62.76 1s3s s VAL 165 Cb -0.15 -3.47 0.12 0.00 0.00 0.00 0.00 36.38 32.88 1s3s s VAL 165 CO 0.01 -0.08 0.18 -0.69 0.00 0.00 0.00 175.10 174.53 1s3s s VAL 166 N 4.15 2.55 0.03 2.92 1.01 -0.10 -1.02 120.40 129.94 1s3s s VAL 166 Ca 0.73 -2.86 0.00 0.00 0.00 0.00 0.00 61.98 59.85 1s3s s VAL 166 Cb -0.33 -2.81 0.00 0.00 0.00 0.00 0.00 36.38 33.25 1s3s s VAL 166 CO 0.29 -0.72 0.00 1.21 0.00 0.00 0.00 175.10 175.89 1s3s n GLU 167 N 3.65 -2.20 -3.38 2.72 4.07 -1.26 -3.86 120.64 120.38 1s3s n GLU 167 Ca 0.04 1.88 -0.31 0.00 -0.06 0.00 0.00 57.16 58.72 1s3s n GLU 167 Cb 0.37 -2.13 -0.05 0.00 -0.06 0.00 0.00 31.44 29.57 1s3s n GLU 167 CO 0.00 0.00 0.00 0.99 -0.06 0.00 0.00 177.13 178.06 1s3s s THR 168 N -0.24 4.97 0.00 6.31 2.01 -1.26 -3.26 115.64 124.17 1s3s s THR 168 Ca 0.00 0.32 0.00 0.00 0.31 0.00 0.00 61.69 62.32 1s3s s THR 168 Cb 0.00 -3.66 0.00 0.00 0.01 0.00 0.00 72.50 68.85 1s3s s THR 168 CO 0.00 -0.17 0.81 -0.67 -0.69 0.00 0.00 174.62 173.90 1s3s n ASP 169 N -0.44 0.00 -4.56 3.53 -0.08 -1.08 -3.79 116.55 110.12 1s3s n ASP 169 Ca -0.00 0.83 -0.34 0.00 -1.51 0.00 0.00 54.79 53.77 1s3s n ASP 169 Cb 0.53 -0.35 -0.04 0.00 2.34 0.00 0.00 41.12 43.60 1s3s n ASP 169 CO 0.00 0.00 0.00 -2.84 0.12 0.00 0.00 177.20 174.48 1s3s s PRO 170 N -2.32 2.84 0.47 -0.67 0.02 -1.26 -4.95 135.00 129.13 1s3s s PRO 170 Ca 0.00 -0.25 -0.17 0.00 0.02 0.00 0.00 61.00 60.60 1s3s s PRO 170 Cb 0.00 -4.89 -0.08 0.00 0.02 0.00 0.00 34.50 29.55 1s3s s PRO 170 CO 0.00 -2.88 0.94 0.45 -0.33 0.00 0.00 177.00 175.18 1s3s s SER 171 N 7.02 6.69 0.00 2.53 0.15 -1.25 -0.53 113.70 128.31 1s3s s SER 171 Ca 0.61 1.52 0.11 0.00 0.70 0.00 0.00 55.95 58.89 1s3s s SER 171 Cb -0.07 -2.48 0.65 0.00 -1.71 0.00 0.00 66.02 62.41 1s3s s SER 171 CO 0.04 -0.49 1.12 -0.81 1.20 0.00 0.00 173.24 174.30 1s3s n PRO 172 N -1.27 0.32 0.00 5.44 -0.04 -1.26 -5.01 135.00 133.18 1s3s n PRO 172 Ca 0.06 0.03 0.00 0.00 -0.04 0.00 0.00 63.50 63.55 1s3s n PRO 172 Cb 0.54 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 32.50 1s3s n PRO 172 CO 0.00 0.00 0.00 2.48 -0.04 0.00 0.00 175.50 177.94 1s3s n TYR 173 N -1.04 0.00 -3.78 0.54 0.18 0.31 -3.53 117.16 109.84 1s3s n TYR 173 Ca 0.08 0.00 -0.09 0.00 1.88 0.00 0.00 57.90 59.77 1s3s n TYR 173 Cb 0.04 0.00 -0.06 0.00 -0.38 0.00 0.00 39.34 38.94 1s3s n TYR 173 CO 0.00 0.00 0.00 0.00 -2.08 0.00 0.00 176.86 174.78 1s3s s ILE 175 N -3.84 5.25 -0.39 0.00 1.01 0.07 -1.87 121.20 121.42 1s3s s ILE 175 Ca 0.05 0.20 -0.27 0.00 0.00 0.00 0.00 60.65 60.63 1s3s s ILE 175 Cb 0.04 -3.64 -0.06 0.00 0.01 0.00 0.00 42.46 38.81 1s3s s ILE 175 CO -0.11 0.14 2.28 -0.69 0.00 0.00 0.00 174.94 176.56 1s3s s VAL 176 N 1.87 3.05 0.25 2.92 1.01 -1.20 -3.15 120.40 125.15 1s3s s VAL 176 Ca 0.10 0.04 0.03 0.00 0.00 0.00 0.00 61.98 62.15 1s3s s VAL 176 Cb -0.16 -3.10 -0.03 0.00 0.00 0.00 0.00 36.38 33.09 1s3s s VAL 176 CO 0.11 -0.08 0.40 0.00 0.00 0.00 0.00 175.10 175.53 1s3s s ALA 177 N 10.34 3.87 -1.45 5.51 0.00 -1.26 -3.27 121.76 135.49 1s3s s ALA 177 Ca 0.96 -1.09 0.00 0.00 0.00 0.00 0.00 51.96 51.83 1s3s s ALA 177 Cb -0.23 -1.85 0.00 0.00 0.00 0.00 0.00 23.12 21.04 1s3s s ALA 177 CO 0.29 0.22 0.57 -0.35 0.00 0.00 0.00 175.76 176.50 1s3s n PRO 178 N -1.35 0.00 -0.28 0.00 -0.04 -1.26 0.21 135.00 132.28 1s3s n PRO 178 Ca -0.07 0.12 0.08 0.00 -0.04 0.00 0.00 63.50 63.59 1s3s n PRO 178 Cb 0.56 -1.52 0.19 0.00 -0.04 0.00 0.00 33.50 32.69 1s3s n PRO 178 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 1s3s n ASP 179 N -1.07 2.74 -4.55 3.54 9.92 -1.26 -4.99 116.55 120.88 1s3s n ASP 179 Ca 0.00 -3.20 -0.37 0.00 -0.53 0.00 0.00 54.79 50.69 1s3s n ASP 179 Cb 0.02 -0.49 -0.11 0.00 -0.64 0.00 0.00 41.12 39.90 1s3s n ASP 179 CO 0.00 0.00 0.00 -0.89 0.13 0.00 0.00 177.20 176.44 1s3s s THR 180 N -2.93 5.01 0.23 -3.53 2.01 0.13 -4.81 115.64 111.76 1s3s s THR 180 Ca 0.36 0.07 -0.30 0.00 0.31 0.00 0.00 61.69 62.14 1s3s s THR 180 Cb 0.32 -3.37 -0.09 0.00 0.01 0.00 0.00 72.50 69.37 1s3s s THR 180 CO 0.03 0.28 1.12 0.54 -0.69 0.00 0.00 174.62 175.91 1s3s s VAL 181 N 1.67 3.61 -0.33 3.82 0.11 0.48 -4.89 120.40 124.87 1s3s s VAL 181 Ca 0.07 1.49 0.03 0.00 -2.93 0.00 0.00 61.98 60.64 1s3s s VAL 181 Cb -0.16 -3.95 0.10 0.00 -1.53 0.00 0.00 36.38 30.84 1s3s s VAL 181 CO 0.08 0.30 0.06 -0.63 -3.33 0.00 0.00 175.10 171.58 1s3s s ILE 182 N -0.67 2.07 -0.18 7.04 1.01 -1.26 -0.88 121.20 128.33 1s3s s ILE 182 Ca 0.48 -2.20 -0.22 0.00 0.00 0.00 0.00 60.65 58.70 1s3s s ILE 182 Cb -0.31 -2.53 -0.02 0.00 0.01 0.00 0.00 42.46 39.60 1s3s s ILE 182 CO 0.38 -0.61 0.70 -1.00 0.00 0.00 0.00 174.94 174.41 1s3s s HIS 183 N 1.01 3.40 -0.09 3.97 3.76 0.38 -4.96 115.29 122.76 1s3s s HIS 183 Ca 0.11 1.05 -0.12 0.00 -0.15 0.00 0.00 55.06 55.94 1s3s s HIS 183 Cb -0.19 -2.87 -0.05 0.00 1.11 0.00 0.00 32.58 30.59 1s3s s HIS 183 CO -0.11 -0.18 0.29 0.00 -0.85 0.00 0.00 174.74 173.90 1s3s n GLU 185 N 2.52 3.62 -3.88 0.00 4.71 -1.25 -5.00 120.64 121.37 1s3s n GLU 185 Ca -0.15 0.00 -0.25 0.00 -0.01 0.00 0.00 57.16 56.75 1s3s n GLU 185 Cb 0.53 0.00 -0.17 0.00 -1.01 0.00 0.00 31.44 30.79 1s3s n GLU 185 CO 0.00 0.00 0.00 0.20 0.09 0.00 0.00 177.13 177.42 1s3s s GLY 186 N 0.00 0.69 0.00 0.62 0.00 -1.26 -5.05 107.32 102.31 1s3s s GLY 186 Ca 0.00 -0.37 0.00 0.00 0.00 0.00 0.00 44.72 44.35 1s3s s GLY 186 CO 0.00 0.91 0.00 1.18 0.00 0.00 0.00 173.10 175.19 1s3s n GLU 187 N 4.97 0.00 -2.71 2.90 -0.58 -1.26 -5.10 120.64 118.86 1s3s n GLU 187 Ca -0.11 0.00 -0.38 0.00 -0.42 0.00 0.00 57.16 56.25 1s3s n GLU 187 Cb 0.50 0.00 -0.06 0.00 -0.57 0.00 0.00 31.44 31.31 1s3s n GLU 187 CO 0.00 0.00 0.00 -2.14 -0.48 0.00 0.00 177.13 174.51 1s3s s PRO 188 N -5.04 4.60 0.12 3.49 0.02 -1.25 -4.34 135.00 132.61 1s3s s PRO 188 Ca 0.00 1.44 -0.15 0.00 0.02 0.00 0.00 61.00 62.32 1s3s s PRO 188 Cb 0.00 -2.93 -0.07 0.00 0.02 0.00 0.00 34.50 31.52 1s3s s PRO 188 CO 0.00 0.28 0.53 0.42 -0.33 0.00 0.00 177.00 177.90 1s3s s ILE 189 N -1.46 4.87 0.91 2.83 1.01 0.24 -4.61 121.20 124.98 1s3s s ILE 189 Ca 0.48 0.84 -0.11 0.00 0.00 0.00 0.00 60.65 61.86 1s3s s ILE 189 Cb -0.22 -3.75 0.20 0.00 0.01 0.00 0.00 42.46 38.70 1s3s s ILE 189 CO 0.28 0.31 1.24 -1.59 0.00 0.00 0.00 174.94 175.18 1s3s s LYS 190 N -1.80 0.79 -0.21 2.79 -2.85 -1.26 -2.46 119.74 114.74 1s3s s LYS 190 Ca 0.35 -0.74 -0.29 0.00 -1.00 0.00 0.00 55.97 54.29 1s3s s LYS 190 Cb -0.16 -1.99 0.00 0.00 -2.06 0.00 0.00 37.83 33.63 1s3s s LYS 190 CO 0.19 -2.22 1.07 0.50 0.10 0.00 0.00 175.35 174.98 1s3s s ARG 191 N -5.69 4.28 -0.58 1.78 6.06 -1.26 -4.94 118.95 118.59 1s3s s ARG 191 Ca 0.73 1.40 -0.24 0.00 -2.50 0.00 0.00 55.73 55.13 1s3s s ARG 191 Cb -0.03 -3.64 0.05 0.00 0.06 0.00 0.00 34.95 31.38 1s3s s ARG 191 CO 0.51 -0.60 0.95 -1.83 -2.50 0.00 0.00 175.30 171.82 1s3s s GLU 192 N 3.10 3.26 0.11 5.12 -1.05 -1.26 -4.87 118.70 123.11 1s3s s GLU 192 Ca 0.46 -0.44 0.07 0.00 -0.15 0.00 0.00 54.97 54.91 1s3s s GLU 192 Cb -0.16 -4.11 0.24 0.00 -0.44 0.00 0.00 34.13 29.66 1s3s s GLU 192 CO 0.08 -1.59 0.27 -0.25 0.95 0.00 0.00 175.26 174.72 1s3s n ASP 193 N 7.55 0.00 -2.19 0.83 9.92 -1.26 0.18 116.55 131.58 1s3s n ASP 193 Ca -0.00 0.16 -0.25 0.00 -0.53 0.00 0.00 54.79 54.18 1s3s n ASP 193 Cb 0.47 -0.07 0.17 0.00 -0.64 0.00 0.00 41.12 41.05 1s3s n ASP 193 CO 0.00 0.00 0.00 -0.62 0.13 0.00 0.00 177.20 176.71 1s3s n GLU 194 N -1.98 2.29 -3.75 -1.24 1.02 -1.26 -4.77 120.64 110.95 1s3s n GLU 194 Ca 0.06 -3.06 -0.30 0.00 -0.02 0.00 0.00 57.16 53.84 1s3s n GLU 194 Cb 0.33 -2.18 -0.15 0.00 -0.02 0.00 0.00 31.44 29.43 1s3s n GLU 194 CO 0.00 0.00 0.00 -1.21 1.18 0.00 0.00 177.13 177.10 1s3s s GLU 195 N -3.37 0.90 0.36 3.49 2.02 0.49 -5.11 118.70 117.48 1s3s s GLU 195 Ca 0.57 -1.35 -0.28 0.00 0.02 0.00 0.00 54.97 53.93 1s3s s GLU 195 Cb 0.48 -2.16 -0.12 0.00 0.10 0.00 0.00 34.13 32.43 1s3s s GLU 195 CO 0.09 -1.02 1.40 0.39 0.02 0.00 0.00 175.26 176.13 1s3s n GLU 196 N 4.50 2.41 -2.46 1.61 4.71 -1.26 -4.76 120.64 125.40 1s3s n GLU 196 Ca 0.01 0.85 -0.39 0.00 -0.01 0.00 0.00 57.16 57.61 1s3s n GLU 196 Cb 0.40 -2.51 -0.04 0.00 -1.01 0.00 0.00 31.44 28.28 1s3s n GLU 196 CO 0.00 0.00 0.00 0.45 0.09 0.00 0.00 177.13 177.67 1s3s s SER 197 N -0.18 7.09 0.00 1.62 0.15 -1.26 -4.91 113.70 116.20 1s3s s SER 197 Ca 0.55 2.25 0.20 0.00 0.70 0.00 0.00 55.95 59.64 1s3s s SER 197 Cb -0.52 -2.62 1.17 0.00 -1.71 0.00 0.00 66.02 62.34 1s3s s SER 197 CO 0.62 -0.27 1.72 0.18 1.20 0.00 0.00 173.24 176.70 1s3s n LEU 198 N 0.84 0.00 -0.02 3.45 4.77 -1.26 -2.15 117.00 122.63 1s3s n LEU 198 Ca 0.01 0.00 0.12 0.00 -0.03 0.00 0.00 56.01 56.10 1s3s n LEU 198 Cb 0.46 0.00 0.21 0.00 -2.33 0.00 0.00 43.42 41.75 1s3s n LEU 198 CO 0.52 0.00 0.40 -0.46 -1.33 0.00 0.00 177.39 176.52 1s3s n ASN 199 N -0.82 0.62 -4.79 -1.43 0.23 -1.26 -4.89 115.26 102.92 1s3s n ASN 199 Ca 0.15 -0.41 -0.36 0.00 -0.53 0.00 0.00 54.58 53.43 1s3s n ASN 199 Cb 0.07 0.35 -0.05 0.00 -2.08 0.00 0.00 39.78 38.06 1s3s n ASN 199 CO 0.00 0.00 0.00 -1.61 -0.93 0.00 0.00 177.26 174.72 1s3s s GLU 200 N -2.96 4.34 0.32 -3.83 2.02 -0.91 -4.98 118.70 112.70 1s3s s GLU 200 Ca 0.12 1.39 -0.28 0.00 0.02 0.00 0.00 54.97 56.21 1s3s s GLU 200 Cb 0.17 -2.60 -0.13 0.00 0.10 0.00 0.00 34.13 31.68 1s3s s GLU 200 CO 0.71 0.04 1.21 0.28 0.02 0.00 0.00 175.26 177.53 1s3s n VAL 201 N 0.11 1.96 -3.85 2.63 0.31 -1.26 -5.01 118.33 113.21 1s3s n VAL 201 Ca 0.04 -0.49 -0.10 0.00 -0.01 0.00 0.00 64.34 63.79 1s3s n VAL 201 Cb 0.50 -1.40 -0.06 0.00 -0.91 0.00 0.00 33.84 31.97 1s3s n VAL 201 CO 0.00 0.00 0.00 -0.83 -1.32 0.00 0.00 176.83 174.68 1s3s s GLY 202 N -0.36 0.18 0.60 2.92 0.00 -1.26 -4.62 107.32 104.78 1s3s s GLY 202 Ca 0.57 -0.58 0.29 0.00 0.00 0.00 0.00 44.72 45.00 1s3s s GLY 202 CO 0.61 -0.63 1.97 -0.97 0.00 0.00 0.00 173.10 174.09 1s3s h TYR 203 N 2.47 0.00 0.00 1.90 0.05 -1.95 0.18 116.97 119.62 1s3s h TYR 203 Ca -0.32 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.46 1s3s h TYR 203 Cb 1.23 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.97 1s3s h TYR 203 CO 0.38 0.00 0.00 -0.40 -1.05 0.00 0.00 178.16 177.09 1s3s n ASP 204 N -3.61 0.00 -0.38 3.88 5.75 -1.26 -1.90 116.55 119.04 1s3s n ASP 204 Ca 0.04 -1.05 0.08 0.00 -0.01 0.00 0.00 54.79 53.85 1s3s n ASP 204 Cb 0.51 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.60 1s3s n ASP 204 CO 0.00 0.00 0.00 0.47 -0.11 0.00 0.00 177.20 177.56 1s3s n ASP 205 N -0.85 1.65 -4.50 -1.12 8.00 0.63 -4.92 116.55 115.44 1s3s n ASP 205 Ca 0.13 -1.32 -0.34 0.00 0.71 0.00 0.00 54.79 53.97 1s3s n ASP 205 Cb 0.06 0.43 -0.12 0.00 -0.02 0.00 0.00 41.12 41.47 1s3s n ASP 205 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 1s3s s VAL 206 N -1.80 4.10 0.23 2.53 1.01 -0.80 -5.00 120.40 120.67 1s3s s VAL 206 Ca 0.13 -0.27 0.09 0.00 0.00 0.00 0.00 61.98 61.93 1s3s s VAL 206 Cb 0.13 -2.84 -0.05 0.00 0.00 0.00 0.00 36.38 33.62 1s3s s VAL 206 CO 0.37 0.45 -0.15 -0.83 0.00 0.00 0.00 175.10 174.94 1s3s s GLY 207 N 0.69 1.58 0.00 4.51 0.00 -1.26 -4.73 107.32 108.11 1s3s s GLY 207 Ca -0.00 -1.73 0.00 0.00 0.00 0.00 0.00 44.72 42.99 1s3s s GLY 207 CO 0.02 -1.82 0.00 0.61 0.00 0.00 0.00 173.10 171.91 1s3s n GLY 208 N -0.46 2.74 3.18 0.20 0.00 -1.26 -4.83 105.19 104.76 1s3s n GLY 208 Ca -0.07 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.59 1s3s n GLY 208 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1s3s n ARG 210 N 4.66 0.09 0.14 0.00 0.00 -1.26 -4.23 116.66 116.06 1s3s n ARG 210 Ca -0.08 0.04 0.06 0.00 -0.00 0.00 0.00 57.85 57.86 1s3s n ARG 210 Cb 0.43 -0.66 0.52 0.00 -0.00 0.00 0.00 32.46 32.75 1s3s n ARG 210 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.63 178.50 1s3s h LYS 211 N -0.17 0.24 0.28 2.89 1.79 -1.99 0.22 116.57 119.82 1s3s h LYS 211 Ca -0.03 -0.02 -0.01 0.00 -2.18 0.00 0.00 60.65 58.41 1s3s h LYS 211 Cb 0.37 -0.05 0.00 0.00 -1.58 0.00 0.00 32.23 30.97 1s3s h LYS 211 CO -0.02 0.19 -0.14 1.96 -1.08 0.00 0.00 179.45 180.37 1s3s h GLN 212 N 0.24 -0.37 -0.24 3.15 1.08 -1.89 -3.11 115.11 113.98 1s3s h GLN 212 Ca 0.06 0.02 0.02 0.00 -1.45 0.00 0.00 58.65 57.31 1s3s h GLN 212 Cb 0.03 0.08 -0.01 0.00 -0.05 0.00 0.00 27.48 27.53 1s3s h GLN 212 CO -0.01 -0.02 0.16 -0.07 -0.95 0.00 0.00 178.83 177.94 1s3s h LEU 213 N -0.90 0.20 0.29 1.46 3.38 -1.62 -2.78 115.31 115.34 1s3s h LEU 213 Ca -0.04 -0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.92 1s3s h LEU 213 Cb 0.51 -0.05 -0.01 0.00 0.09 0.00 0.00 40.66 41.20 1s3s h LEU 213 CO 0.06 0.14 -0.21 0.00 0.09 0.00 0.00 178.44 178.52 1s3s h ALA 214 N 1.86 -0.49 0.42 1.53 0.00 -0.58 -1.01 119.26 121.00 1s3s h ALA 214 Ca 0.10 -0.09 -0.02 0.00 0.00 0.00 0.00 54.91 54.90 1s3s h ALA 214 Cb 0.10 0.28 -0.00 0.00 0.00 0.00 0.00 17.79 18.17 1s3s h ALA 214 CO -0.02 -0.79 -0.27 1.96 0.00 0.00 0.00 179.25 180.13 1s3s h GLN 215 N -0.50 -0.62 -0.92 0.00 4.20 -1.43 -2.62 115.11 113.21 1s3s h GLN 215 Ca -0.02 0.04 0.27 0.00 0.06 0.00 0.00 58.65 59.00 1s3s h GLN 215 Cb 0.44 0.14 -0.15 0.00 0.30 0.00 0.00 27.48 28.21 1s3s h GLN 215 CO 0.00 -0.42 0.26 0.82 -0.67 0.00 0.00 178.83 178.83 1s3s h ILE 216 N -0.65 0.23 0.21 2.54 2.04 -1.58 0.12 117.51 120.42 1s3s h ILE 216 Ca -0.06 -0.06 0.01 0.00 1.00 0.00 0.00 64.86 65.76 1s3s h ILE 216 Cb 0.52 0.05 -0.03 0.00 -0.74 0.00 0.00 36.82 36.62 1s3s h ILE 216 CO 0.05 0.03 -0.30 0.11 0.00 0.00 0.00 178.15 178.04 1s3s h LYS 217 N 0.16 -0.56 -0.11 2.37 1.57 -0.98 -1.97 116.57 117.05 1s3s h LYS 217 Ca 0.61 0.04 -0.11 0.00 -1.87 0.00 0.00 60.65 59.31 1s3s h LYS 217 Cb 1.31 0.13 -0.01 0.00 0.08 0.00 0.00 32.23 33.73 1s3s h LYS 217 CO -0.71 -0.37 -0.44 1.05 -0.57 0.00 0.00 179.45 178.41 1s3s h GLU 218 N -0.58 0.26 -0.26 3.15 4.11 -0.80 0.20 114.58 120.67 1s3s h GLU 218 Ca 0.01 -0.13 0.06 0.00 0.07 0.00 0.00 59.36 59.36 1s3s h GLU 218 Cb 0.57 0.00 -0.06 0.00 0.50 0.00 0.00 28.75 29.76 1s3s h GLU 218 CO -0.12 0.66 -0.10 0.52 0.07 0.00 0.00 179.01 180.03 1s3s h MET 219 N 0.22 -0.05 -0.00 1.06 2.86 -0.50 -2.24 114.93 116.28 1s3s h MET 219 Ca 0.02 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.66 1s3s h MET 219 Cb 0.86 0.01 0.00 0.00 0.06 0.00 0.00 31.60 32.53 1s3s h MET 219 CO 0.07 -0.04 -0.35 1.33 1.06 0.00 0.00 176.91 178.99 1s3s n VAL 220 N -5.27 0.00 -0.04 -2.22 0.24 -0.77 -4.40 118.33 105.87 1s3s n VAL 220 Ca -0.01 -0.04 -0.13 0.00 -2.04 0.00 0.00 64.34 62.12 1s3s n VAL 220 Cb 0.19 0.20 -0.07 0.00 -1.47 0.00 0.00 33.84 32.68 1s3s n VAL 220 CO 0.00 0.00 0.00 -0.08 -2.14 0.00 0.00 176.83 174.61 1s3s h GLU 221 N 0.41 -0.46 0.25 7.34 4.57 -0.31 -0.69 114.58 125.69 1s3s h GLU 221 Ca 0.00 0.03 -0.01 0.00 -1.18 0.00 0.00 59.36 58.20 1s3s h GLU 221 Cb 0.49 0.10 0.00 0.00 -0.16 0.00 0.00 28.75 29.18 1s3s h GLU 221 CO 0.00 -0.31 -0.12 -0.07 -1.18 0.00 0.00 179.01 177.33 1s3s h LEU 222 N -0.48 -0.28 -1.69 1.64 3.38 -1.77 -2.07 115.31 114.04 1s3s h LEU 222 Ca 0.08 -0.24 -0.04 0.00 0.09 0.00 0.00 57.88 57.77 1s3s h LEU 222 Cb 0.63 0.07 -0.01 0.00 0.09 0.00 0.00 40.66 41.45 1s3s h LEU 222 CO -0.47 0.20 -0.18 1.55 0.09 0.00 0.00 178.44 179.63 1s3s h PRO 223 N -0.90 0.00 0.00 1.13 0.13 -1.81 0.26 132.00 130.81 1s3s h PRO 223 Ca -0.03 0.00 -0.21 0.00 -0.87 0.00 0.00 66.00 64.88 1s3s h PRO 223 Cb 0.50 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 31.60 1s3s h PRO 223 CO 0.06 0.18 -1.67 -0.11 -0.23 0.00 0.00 178.00 176.23 1s3s n LEU 224 N -3.83 0.67 -0.09 1.56 7.94 -0.27 -4.02 117.00 118.97 1s3s n LEU 224 Ca -0.02 0.30 0.01 0.00 -1.11 0.00 0.00 56.01 55.20 1s3s n LEU 224 Cb 0.28 0.16 0.01 0.00 0.53 0.00 0.00 43.42 44.40 1s3s n LEU 224 CO 0.33 0.24 0.29 0.54 -1.11 0.00 0.00 177.39 177.68 1s3s n ARG 225 N -2.86 -0.65 -2.77 1.96 1.74 -0.78 -4.70 116.66 108.60 1s3s n ARG 225 Ca -0.14 -0.64 -0.10 0.00 -0.77 0.00 0.00 57.85 56.19 1s3s n ARG 225 Cb 0.92 -1.04 0.04 0.00 -1.02 0.00 0.00 32.46 31.35 1s3s n ARG 225 CO 0.00 0.00 0.00 0.72 -1.52 0.00 0.00 177.63 176.83 1s3s n HIS 226 N 0.11 0.09 -0.24 -1.55 8.25 0.90 -4.97 115.22 117.81 1s3s n HIS 226 Ca 0.01 -2.80 0.04 0.00 -0.26 0.00 0.00 57.72 54.72 1s3s n HIS 226 Cb 0.06 0.08 0.17 0.00 1.12 0.00 0.00 29.99 31.41 1s3s n HIS 226 CO 0.00 0.00 0.00 -1.35 0.64 0.00 0.00 176.34 175.63 1s3s h PRO 227 N 2.83 0.35 -0.94 -0.41 0.11 -1.69 -2.15 132.00 130.09 1s3s h PRO 227 Ca -0.09 -0.02 0.09 0.00 0.11 0.00 0.00 66.00 66.09 1s3s h PRO 227 Cb 1.16 -0.08 -0.12 0.00 0.11 0.00 0.00 31.00 32.07 1s3s h PRO 227 CO 0.38 0.23 -0.56 0.00 -0.21 0.00 0.00 178.00 177.84 1s3s h ALA 228 N 1.55 -0.48 -0.87 -0.75 0.00 -1.92 0.23 119.26 117.02 1s3s h ALA 228 Ca 0.39 0.13 0.32 0.00 0.00 0.00 0.00 54.91 55.75 1s3s h ALA 228 Cb 0.62 1.30 -0.16 0.00 0.00 0.00 0.00 17.79 19.55 1s3s h ALA 228 CO -0.43 -0.93 0.31 -0.11 0.00 0.00 0.00 179.25 178.09 1s3s n LEU 229 N -5.29 0.16 -0.68 0.00 7.94 -0.81 0.39 117.00 118.71 1s3s n LEU 229 Ca 0.03 1.45 0.01 0.00 -1.11 0.00 0.00 56.01 56.39 1s3s n LEU 229 Cb 0.29 -0.64 0.05 0.00 0.53 0.00 0.00 43.42 43.65 1s3s n LEU 229 CO -0.14 -1.57 0.33 0.49 -1.11 0.00 0.00 177.39 175.39 1s3s n PHE 230 N -5.07 0.27 0.00 1.96 3.72 0.81 -2.46 117.46 116.70 1s3s n PHE 230 Ca 0.29 -0.09 0.01 0.00 -0.05 0.00 0.00 57.45 57.60 1s3s n PHE 230 Cb 0.96 -0.15 -0.01 0.00 -0.94 0.00 0.00 39.48 39.33 1s3s n PHE 230 CO 0.00 0.00 0.00 1.63 -0.05 0.00 0.00 176.76 178.34 1s3s n LYS 231 N 0.08 0.14 0.00 -1.08 5.02 0.16 -4.61 118.16 117.88 1s3s n LYS 231 Ca 0.04 -0.02 0.07 0.00 -2.02 0.00 0.00 58.31 56.38 1s3s n LYS 231 Cb 0.37 -1.04 0.05 0.00 -0.02 0.00 0.00 35.03 34.40 1s3s n LYS 231 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1s3s n ALA 232 N -1.56 2.53 -2.52 7.82 0.00 -1.09 -5.00 120.51 120.69 1s3s n ALA 232 Ca -0.00 -0.60 -0.24 0.00 0.00 0.00 0.00 53.44 52.59 1s3s n ALA 232 Cb 0.05 -0.47 -0.11 0.00 0.00 0.00 0.00 19.45 18.92 1s3s n ALA 232 CO 0.00 0.00 0.00 0.96 0.00 0.00 0.00 177.50 178.46 1s3s s ILE 233 N -1.20 1.68 -0.21 0.00 -4.36 -1.03 -5.05 121.20 111.03 1s3s s ILE 233 Ca 0.16 -2.04 0.11 0.00 -0.26 0.00 0.00 60.65 58.62 1s3s s ILE 233 Cb 0.11 -2.81 0.42 0.00 1.25 0.00 0.00 42.46 41.43 1s3s s ILE 233 CO 0.19 -0.06 1.22 0.61 0.24 0.00 0.00 174.94 177.13 1s3s n GLY 234 N -0.79 5.09 3.81 6.27 0.00 -1.26 -4.88 105.19 113.42 1s3s n GLY 234 Ca -0.04 -1.31 -0.37 0.00 0.00 0.00 0.00 46.02 44.30 1s3s n GLY 234 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1s3s s VAL 235 N -3.20 5.31 -0.38 1.61 1.01 -1.26 -5.06 120.40 118.44 1s3s s VAL 235 Ca 0.38 0.47 -0.24 0.00 0.00 0.00 0.00 61.98 62.59 1s3s s VAL 235 Cb 0.37 -3.56 0.01 0.00 0.00 0.00 0.00 36.38 33.21 1s3s s VAL 235 CO -0.07 0.52 0.85 -0.54 0.00 0.00 0.00 175.10 175.86 1s3s s LYS 236 N -0.46 3.76 0.57 2.72 1.02 -1.26 -5.01 119.74 121.07 1s3s s LYS 236 Ca 0.17 0.39 -0.09 0.00 0.02 0.00 0.00 55.97 56.47 1s3s s LYS 236 Cb -0.13 -3.82 -0.04 0.00 -0.52 0.00 0.00 37.83 33.32 1s3s s LYS 236 CO 0.06 -0.92 0.93 -1.25 -0.92 0.00 0.00 175.35 173.25 1s3s s PRO 237 N 3.30 3.56 0.35 -1.68 0.04 -1.26 -5.00 135.00 134.31 1s3s s PRO 237 Ca 0.34 0.52 -0.28 0.00 0.04 0.00 0.00 61.00 61.63 1s3s s PRO 237 Cb -0.12 -2.20 -0.12 0.00 0.04 0.00 0.00 34.50 32.10 1s3s s PRO 237 CO 0.18 -0.43 1.31 -2.30 0.04 0.00 0.00 177.00 175.80 1s3s n PRO 238 N -2.56 2.18 0.00 0.56 -0.02 -1.26 -4.95 135.00 128.95 1s3s n PRO 238 Ca 0.04 0.76 0.00 0.00 -2.02 0.00 0.00 63.50 62.28 1s3s n PRO 238 Cb 0.55 -2.37 0.00 0.00 -0.02 0.00 0.00 33.50 31.66 1s3s n PRO 238 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 1s3s n ARG 239 N 0.51 0.00 -4.11 -0.52 1.74 -1.26 -4.82 116.66 108.20 1s3s n ARG 239 Ca 0.04 0.00 -0.35 0.00 -0.77 0.00 0.00 57.85 56.77 1s3s n ARG 239 Cb 0.37 -0.32 -0.09 0.00 -1.02 0.00 0.00 32.46 31.40 1s3s n ARG 239 CO 0.00 0.00 0.00 0.20 -1.52 0.00 0.00 177.63 176.31 1s3s s GLY 240 N -2.56 1.94 -0.13 -0.13 0.00 -1.12 -0.81 107.32 104.51 1s3s s GLY 240 Ca 0.00 -0.74 0.02 0.00 0.00 0.00 0.00 44.72 44.00 1s3s s GLY 240 CO 0.00 -0.25 -0.20 -0.42 0.00 0.00 0.00 173.10 172.23 1s3s s ILE 241 N -0.36 1.92 -0.27 0.90 1.01 -0.60 -3.05 121.20 120.75 1s3s s ILE 241 Ca 0.09 -0.90 -0.09 0.00 0.00 0.00 0.00 60.65 59.75 1s3s s ILE 241 Cb -0.12 -1.71 -0.03 0.00 0.01 0.00 0.00 42.46 40.61 1s3s s ILE 241 CO 0.02 0.52 0.13 -0.22 0.00 0.00 0.00 174.94 175.39 1s3s s LEU 242 N 0.86 3.78 -0.18 2.97 2.96 0.14 -1.43 118.68 127.77 1s3s s LEU 242 Ca -0.07 -0.19 -0.13 0.00 -0.22 0.00 0.00 54.13 53.52 1s3s s LEU 242 Cb -0.15 -2.01 -0.05 0.00 0.50 0.00 0.00 46.19 44.48 1s3s s LEU 242 CO -0.02 -0.07 0.26 -0.76 -1.32 0.00 0.00 176.35 174.44 1s3s s LEU 243 N 1.67 4.21 0.29 -0.68 1.02 0.62 -0.71 118.68 125.09 1s3s s LEU 243 Ca 0.06 0.41 0.09 0.00 0.02 0.00 0.00 54.13 54.72 1s3s s LEU 243 Cb -0.16 -2.31 -0.04 0.00 0.02 0.00 0.00 46.19 43.70 1s3s s LEU 243 CO 0.07 0.09 0.02 -0.31 0.02 0.00 0.00 176.35 176.23 1s3s s TYR 244 N 0.62 2.67 0.00 0.29 4.12 -0.70 -1.24 117.35 123.11 1s3s s TYR 244 Ca 0.14 -0.28 0.00 0.00 0.02 0.00 0.00 57.07 56.95 1s3s s TYR 244 Cb -0.13 -1.30 0.00 0.00 -1.52 0.00 0.00 41.96 39.01 1s3s s TYR 244 CO 0.03 0.56 0.00 0.41 0.02 0.00 0.00 175.55 176.57 1s3s n GLY 245 N -0.94 4.06 3.63 0.71 0.00 -1.04 -1.67 105.19 109.93 1s3s n GLY 245 Ca -0.06 -1.62 -0.29 0.00 0.00 0.00 0.00 46.02 44.05 1s3s n GLY 245 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1s3s s PRO 246 N -3.16 0.41 0.77 1.61 0.04 -1.26 -4.00 135.00 129.41 1s3s s PRO 246 Ca 0.00 1.00 -0.15 0.00 0.04 0.00 0.00 61.00 61.89 1s3s s PRO 246 Cb 0.00 -1.70 0.03 0.00 0.04 0.00 0.00 34.50 32.87 1s3s s PRO 246 CO 0.00 -2.88 0.96 -2.30 0.04 0.00 0.00 177.00 172.82 1s3s n PRO 247 N -4.34 0.31 -2.36 0.56 -0.02 -1.26 -3.56 135.00 124.32 1s3s n PRO 247 Ca 0.07 0.17 -0.18 0.00 -2.02 0.00 0.00 63.50 61.53 1s3s n PRO 247 Cb 0.54 -2.23 -0.01 0.00 -0.02 0.00 0.00 33.50 31.79 1s3s n PRO 247 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1s3s n GLY 248 N 1.00 -0.38 0.03 -1.23 0.00 -1.26 -4.85 105.19 98.49 1s3s n GLY 248 Ca 0.12 -0.12 0.12 0.00 0.00 0.00 0.00 46.02 46.14 1s3s n GLY 248 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1s3s n THR 249 N -4.03 0.14 -0.23 2.61 -1.04 -1.23 -1.02 114.28 109.48 1s3s n THR 249 Ca -0.21 -0.12 0.00 0.00 -2.04 0.00 0.00 64.05 61.68 1s3s n THR 249 Cb 0.66 0.12 0.00 0.00 -1.82 0.00 0.00 70.33 69.30 1s3s n THR 249 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1s3s n GLY 250 N 1.43 0.86 0.21 3.41 0.00 -1.26 -4.80 105.19 105.04 1s3s n GLY 250 Ca 0.04 -0.24 -0.09 0.00 0.00 0.00 0.00 46.02 45.73 1s3s n GLY 250 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1s3s h LYS 251 N 0.09 0.67 -0.78 1.61 1.57 -1.95 0.50 116.57 118.29 1s3s h LYS 251 Ca 0.00 -0.12 -0.05 0.00 -1.87 0.00 0.00 60.65 58.61 1s3s h LYS 251 Cb 0.00 -0.11 -0.03 0.00 0.08 0.00 0.00 32.23 32.17 1s3s h LYS 251 CO 0.00 0.61 0.29 1.15 -0.57 0.00 0.00 179.45 180.93 1s3s h THR 252 N 0.58 1.26 0.52 -0.16 2.02 -1.99 -0.61 112.91 114.54 1s3s h THR 252 Ca 0.15 -0.84 -0.03 0.00 0.77 0.00 0.00 66.41 66.46 1s3s h THR 252 Cb 0.19 0.35 0.01 0.00 -1.74 0.00 0.00 68.15 66.95 1s3s h THR 252 CO -0.01 0.34 -0.25 0.25 0.37 0.00 0.00 175.52 176.22 1s3s h LEU 253 N 1.14 -0.59 -0.24 2.58 6.46 -1.82 -0.46 115.31 122.38 1s3s h LEU 253 Ca 0.26 -0.04 0.06 0.00 -0.12 0.00 0.00 57.88 58.04 1s3s h LEU 253 Cb 0.24 0.15 -0.08 0.00 -0.73 0.00 0.00 40.66 40.25 1s3s h LEU 253 CO -0.02 -0.32 -0.35 0.40 -0.62 0.00 0.00 178.44 177.53 1s3s h ILE 254 N -0.84 0.23 -0.40 4.05 2.04 0.13 1.31 117.51 124.03 1s3s h ILE 254 Ca -0.07 0.00 0.07 0.00 1.00 0.00 0.00 64.86 65.86 1s3s h ILE 254 Cb 0.59 0.23 -0.07 0.00 -0.74 0.00 0.00 36.82 36.83 1s3s h ILE 254 CO 0.12 0.00 -0.02 0.00 0.00 0.00 0.00 178.15 178.25 1s3s h ALA 255 N 0.48 0.34 -0.47 1.87 0.00 -1.05 -0.32 119.26 120.11 1s3s h ALA 255 Ca 0.12 0.12 -0.14 0.00 0.00 0.00 0.00 54.91 55.02 1s3s h ALA 255 Cb 0.56 0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.56 1s3s h ALA 255 CO -0.44 -0.41 -0.24 -0.09 0.00 0.00 0.00 179.25 178.07 1s3s h ARG 256 N 0.08 0.99 0.14 0.00 2.43 -0.25 -2.57 114.38 115.21 1s3s h ARG 256 Ca 0.19 -0.44 0.00 0.00 -0.81 0.00 0.00 59.98 58.93 1s3s h ARG 256 Cb 0.28 -0.03 -0.02 0.00 -0.42 0.00 0.00 29.97 29.79 1s3s h ARG 256 CO -0.34 1.11 -0.25 0.00 -1.51 0.00 0.00 179.97 178.98 1s3s h ALA 257 N 0.86 -0.85 -0.85 2.80 0.00 0.28 -1.96 119.26 119.55 1s3s h ALA 257 Ca 0.10 -0.07 0.22 0.00 0.00 0.00 0.00 54.91 55.16 1s3s h ALA 257 Cb 0.82 0.58 -0.14 0.00 0.00 0.00 0.00 17.79 19.06 1s3s h ALA 257 CO 0.07 -0.89 0.20 0.28 0.00 0.00 0.00 179.25 178.92 1s3s h VAL 258 N -0.41 0.34 -0.01 0.00 2.07 -1.12 0.17 116.25 117.29 1s3s h VAL 258 Ca -0.02 -0.07 0.03 0.00 0.82 0.00 0.00 66.70 67.46 1s3s h VAL 258 Cb 0.38 0.12 -0.04 0.00 -1.52 0.00 0.00 31.29 30.23 1s3s h VAL 258 CO -0.09 0.04 -0.22 0.00 0.02 0.00 0.00 177.57 177.32 1s3s h ALA 259 N 1.75 -0.28 -0.31 1.67 0.00 -0.99 -0.15 119.26 120.95 1s3s h ALA 259 Ca 0.52 0.01 -0.03 0.00 0.00 0.00 0.00 54.91 55.41 1s3s h ALA 259 Cb 1.01 0.39 -0.01 0.00 0.00 0.00 0.00 17.79 19.18 1s3s h ALA 259 CO -0.64 -0.71 0.08 -0.91 0.00 0.00 0.00 179.25 177.07 1s3s h ASN 260 N -0.34 0.46 -0.19 0.00 2.35 -0.47 0.34 115.58 117.73 1s3s h ASN 260 Ca 0.06 -0.22 0.05 0.00 -0.55 0.00 0.00 56.30 55.64 1s3s h ASN 260 Cb 0.43 -0.12 -0.01 0.00 0.05 0.00 0.00 38.32 38.67 1s3s h ASN 260 CO -0.21 0.56 0.21 -0.08 -1.65 0.00 0.00 177.43 176.26 1s3s h GLU 261 N 0.33 0.00 -0.37 0.81 4.57 -0.22 -0.33 114.58 119.37 1s3s h GLU 261 Ca 0.10 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.28 1s3s h GLU 261 Cb 0.28 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.87 1s3s h GLU 261 CO 0.00 0.00 0.00 0.25 -1.18 0.00 0.00 179.01 178.08 1s3s n THR 262 N -3.80 1.28 -2.11 0.32 -2.24 -0.11 -4.37 114.28 103.25 1s3s n THR 262 Ca 0.02 -1.17 -0.19 0.00 -2.27 0.00 0.00 64.05 60.43 1s3s n THR 262 Cb 0.33 0.34 -0.03 0.00 -2.10 0.00 0.00 70.33 68.87 1s3s n THR 262 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1s3s n GLY 263 N 0.42 0.32 3.84 3.38 0.00 -0.13 -4.89 105.19 108.11 1s3s n GLY 263 Ca 0.15 -0.07 -0.35 0.00 0.00 0.00 0.00 46.02 45.74 1s3s n GLY 263 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1s3s s ALA 264 N -2.89 3.52 0.29 4.61 0.00 0.12 -4.96 121.76 122.44 1s3s s ALA 264 Ca 0.00 -0.04 -0.29 0.00 0.00 0.00 0.00 51.96 51.62 1s3s s ALA 264 Cb 0.00 -2.62 -0.10 0.00 0.00 0.00 0.00 23.12 20.41 1s3s s ALA 264 CO 0.00 0.42 1.21 0.12 0.00 0.00 0.00 175.76 177.51 1s3s s PHE 265 N -1.52 3.31 -0.11 0.00 5.36 -0.66 -4.40 117.98 119.96 1s3s s PHE 265 Ca 0.40 1.52 0.03 0.00 -0.96 0.00 0.00 56.93 57.92 1s3s s PHE 265 Cb -0.15 -3.49 0.01 0.00 -0.34 0.00 0.00 43.02 39.04 1s3s s PHE 265 CO 0.20 -1.27 -0.21 0.12 -1.46 0.00 0.00 175.22 172.60 1s3s s PHE 266 N -0.99 2.41 -0.10 10.12 5.36 -1.26 -0.13 117.98 133.38 1s3s s PHE 266 Ca 0.48 -1.09 -0.00 0.00 -0.96 0.00 0.00 56.93 55.36 1s3s s PHE 266 Cb -0.36 -1.64 0.02 0.00 -0.34 0.00 0.00 43.02 40.70 1s3s s PHE 266 CO 0.46 -0.49 -0.08 0.12 -1.46 0.00 0.00 175.22 173.77 1s3s s PHE 267 N 0.64 1.43 -0.17 10.12 2.19 -0.96 -4.99 117.98 126.25 1s3s s PHE 267 Ca -0.12 -0.68 -0.19 0.00 0.33 0.00 0.00 56.93 56.26 1s3s s PHE 267 Cb -0.16 -1.18 -0.03 0.00 -1.31 0.00 0.00 43.02 40.33 1s3s s PHE 267 CO 0.03 -0.47 0.55 -1.17 1.83 0.00 0.00 175.22 175.99 1s3s s LEU 268 N 1.55 4.19 -0.27 6.12 2.96 -1.26 -1.85 118.68 130.12 1s3s s LEU 268 Ca 0.02 0.78 0.02 0.00 -0.22 0.00 0.00 54.13 54.73 1s3s s LEU 268 Cb -0.13 -2.77 0.06 0.00 0.50 0.00 0.00 46.19 43.85 1s3s s LEU 268 CO -0.06 -0.16 -0.09 -0.63 -1.32 0.00 0.00 176.35 174.09 1s3s s ILE 269 N 1.41 2.35 -0.09 6.68 1.01 -0.15 -4.98 121.20 127.43 1s3s s ILE 269 Ca 0.26 -1.59 -0.15 0.00 0.00 0.00 0.00 60.65 59.18 1s3s s ILE 269 Cb -0.16 -2.37 -0.05 0.00 0.01 0.00 0.00 42.46 39.89 1s3s s ILE 269 CO 0.10 -0.05 0.36 0.21 0.00 0.00 0.00 174.94 175.57 1s3s s ASN 270 N 1.13 6.63 0.02 3.58 3.84 -1.26 -0.18 114.94 128.70 1s3s s ASN 270 Ca -0.08 0.74 -0.07 0.00 0.21 0.00 0.00 52.86 53.66 1s3s s ASN 270 Cb -0.20 -2.22 -0.03 0.00 -0.55 0.00 0.00 41.25 38.25 1s3s s ASN 270 CO -0.04 0.19 1.10 1.23 -2.79 0.00 0.00 177.10 176.79 1s3s h GLY 271 N 5.80 -1.04 -0.32 1.21 0.00 -0.38 -1.59 103.07 106.75 1s3s h GLY 271 Ca -0.46 0.47 0.18 0.00 0.00 0.00 0.00 47.33 47.52 1s3s h GLY 271 CO 0.69 -0.37 0.10 -2.55 0.00 0.00 0.00 176.54 174.41 1s3s h PRO 272 N -0.16 0.16 -0.69 4.80 0.11 -1.84 0.17 132.00 134.54 1s3s h PRO 272 Ca -0.01 -0.01 0.15 0.00 0.11 0.00 0.00 66.00 66.24 1s3s h PRO 272 Cb 0.15 -0.04 -0.12 0.00 0.11 0.00 0.00 31.00 31.10 1s3s h PRO 272 CO -0.04 0.10 -0.04 1.49 -0.21 0.00 0.00 178.00 179.31 1s3s h GLU 273 N 0.16 0.08 0.09 1.05 4.57 -1.89 0.22 114.58 118.86 1s3s h GLU 273 Ca 0.45 -0.00 -0.00 0.00 -1.18 0.00 0.00 59.36 58.62 1s3s h GLU 273 Cb 0.82 -0.02 0.00 0.00 -0.16 0.00 0.00 28.75 29.39 1s3s h GLU 273 CO -0.63 0.05 -0.04 0.82 -1.18 0.00 0.00 179.01 178.03 1s3s h ILE 274 N 0.08 1.15 0.00 2.32 1.08 0.25 -3.07 117.51 119.32 1s3s h ILE 274 Ca 0.36 -0.98 0.00 0.00 -0.39 0.00 0.00 64.86 63.86 1s3s h ILE 274 Cb 0.61 1.76 0.00 0.00 -3.07 0.00 0.00 36.82 36.12 1s3s h ILE 274 CO -0.63 0.23 0.00 0.23 -0.69 0.00 0.00 178.15 177.29 1s3s n MET 275 N -4.93 0.08 0.08 2.37 2.81 -0.22 -1.70 117.12 115.61 1s3s n MET 275 Ca -0.09 0.20 0.04 0.00 -1.81 0.00 0.00 57.70 56.04 1s3s n MET 275 Cb 0.25 -1.50 -0.03 0.00 -0.71 0.00 0.00 33.22 31.22 1s3s n MET 275 CO 0.00 0.00 0.00 0.66 1.51 0.00 0.00 175.97 178.14 1s3s h SER 276 N 0.00 0.00 -3.71 7.83 4.64 -0.87 -3.47 113.55 117.97 1s3s h SER 276 Ca 0.00 0.00 -0.45 0.00 -0.47 0.00 0.00 61.79 60.87 1s3s h SER 276 Cb 0.04 0.00 0.18 0.00 -0.31 0.00 0.00 62.40 62.30 1s3s h SER 276 CO 0.00 0.40 0.14 -0.54 -0.87 0.00 0.00 176.83 175.96 1s3s s LYS 277 N -3.05 0.06 0.42 4.77 -0.14 -0.69 -5.01 119.74 116.10 1s3s s LYS 277 Ca -0.01 0.65 -0.22 0.00 -1.36 0.00 0.00 55.97 55.04 1s3s s LYS 277 Cb 0.08 -1.68 -0.11 0.00 -1.68 0.00 0.00 37.83 34.45 1s3s s LYS 277 CO 0.79 -3.02 0.96 -1.17 -0.76 0.00 0.00 175.35 172.15 1s3s s LEU 278 N -6.69 3.99 0.13 3.17 2.96 -1.26 -4.78 118.68 116.21 1s3s s LEU 278 Ca 0.66 1.74 -0.34 0.00 -0.22 0.00 0.00 54.13 55.97 1s3s s LEU 278 Cb -0.21 -4.46 -0.17 0.00 0.50 0.00 0.00 46.19 41.85 1s3s s LEU 278 CO 0.60 -0.35 1.00 0.00 -1.32 0.00 0.00 176.35 176.27 1s3s n ALA 279 N -0.49 -1.99 0.00 5.97 0.00 -1.26 -0.11 120.51 122.63 1s3s n ALA 279 Ca 0.06 0.49 0.00 0.00 0.00 0.00 0.00 53.44 54.00 1s3s n ALA 279 Cb 0.53 -1.87 0.00 0.00 0.00 0.00 0.00 19.45 18.12 1s3s n ALA 279 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1s3s n GLY 280 N 1.87 1.88 0.25 0.00 0.00 -1.26 -4.63 105.19 103.30 1s3s n GLY 280 Ca 0.17 -0.29 0.17 0.00 0.00 0.00 0.00 46.02 46.07 1s3s n GLY 280 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1s3s h GLU 281 N 0.00 0.00 0.03 1.61 4.81 -0.88 0.10 114.58 120.26 1s3s h GLU 281 Ca 0.00 0.00 -0.00 0.00 -0.13 0.00 0.00 59.36 59.23 1s3s h GLU 281 Cb 0.00 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.38 1s3s h GLU 281 CO 0.00 0.00 -0.01 0.77 -0.73 0.00 0.00 179.01 179.04 1s3s h SER 282 N 0.00 -0.03 -0.76 1.04 0.02 -1.72 -2.80 113.55 109.28 1s3s h SER 282 Ca 0.00 -0.56 0.00 0.00 -0.84 0.00 0.00 61.79 60.39 1s3s h SER 282 Cb 0.35 0.01 -0.04 0.00 0.14 0.00 0.00 62.40 62.86 1s3s h SER 282 CO 0.00 0.72 0.48 -0.33 -1.14 0.00 0.00 176.83 176.57 1s3s h GLU 283 N -0.97 1.03 -0.60 3.45 5.08 -1.81 -1.14 114.58 119.62 1s3s h GLU 283 Ca -0.00 -0.08 0.07 0.00 -1.00 0.00 0.00 59.36 58.35 1s3s h GLU 283 Cb 0.59 -0.22 -0.06 0.00 0.50 0.00 0.00 28.75 29.56 1s3s h GLU 283 CO 0.01 0.70 0.29 1.03 -1.00 0.00 0.00 179.01 180.04 1s3s h SER 284 N 1.05 0.40 0.10 1.42 0.87 -0.89 -1.39 113.55 115.12 1s3s h SER 284 Ca 0.28 0.04 -0.12 0.00 -1.23 0.00 0.00 61.79 60.77 1s3s h SER 284 Cb -0.08 -0.02 -0.01 0.00 -0.44 0.00 0.00 62.40 61.84 1s3s h SER 284 CO -0.06 0.25 -0.40 0.78 -0.53 0.00 0.00 176.83 176.88 1s3s h ASN 285 N 0.54 0.41 0.03 6.23 -0.26 -0.96 -2.17 115.58 119.41 1s3s h ASN 285 Ca 0.28 -0.17 -0.00 0.00 -0.56 0.00 0.00 56.30 55.85 1s3s h ASN 285 Cb 0.24 -0.11 0.00 0.00 -1.06 0.00 0.00 38.32 37.38 1s3s h ASN 285 CO -0.21 0.77 -0.02 -0.07 -1.06 0.00 0.00 177.43 176.84 1s3s h LEU 286 N 0.33 -0.04 -0.27 1.61 3.38 -0.68 -0.16 115.31 119.47 1s3s h LEU 286 Ca 0.03 -0.08 0.06 0.00 0.09 0.00 0.00 57.88 57.98 1s3s h LEU 286 Cb 0.85 0.01 -0.06 0.00 0.09 0.00 0.00 40.66 41.55 1s3s h LEU 286 CO 0.07 0.06 -0.12 -0.09 0.09 0.00 0.00 178.44 178.45 1s3s h ARG 287 N -0.13 -0.07 -0.64 1.13 2.43 -1.14 -0.85 114.38 115.11 1s3s h ARG 287 Ca -0.00 0.00 -0.01 0.00 -0.81 0.00 0.00 59.98 59.16 1s3s h ARG 287 Cb 0.12 0.02 -0.03 0.00 -0.42 0.00 0.00 29.97 29.65 1s3s h ARG 287 CO 0.01 -0.05 0.37 0.87 -1.51 0.00 0.00 179.97 179.66 1s3s h LYS 288 N -0.07 0.87 0.40 0.20 1.57 -1.22 -1.33 116.57 116.98 1s3s h LYS 288 Ca 0.14 -0.08 -0.01 0.00 -1.87 0.00 0.00 60.65 58.83 1s3s h LYS 288 Cb 0.29 -0.18 -0.02 0.00 0.08 0.00 0.00 32.23 32.39 1s3s h LYS 288 CO -0.32 0.62 -0.46 0.00 -0.57 0.00 0.00 179.45 178.71 1s3s h ALA 289 N 1.53 -1.09 -0.71 3.86 0.00 0.40 0.51 119.26 123.75 1s3s h ALA 289 Ca 0.23 -0.16 -0.01 0.00 0.00 0.00 0.00 54.91 54.97 1s3s h ALA 289 Cb -0.01 0.72 -0.03 0.00 0.00 0.00 0.00 17.79 18.47 1s3s h ALA 289 CO -0.04 -1.14 0.42 0.74 0.00 0.00 0.00 179.25 179.23 1s3s h PHE 290 N -0.88 0.94 0.09 0.00 -1.00 -1.33 -2.51 116.94 112.25 1s3s h PHE 290 Ca -0.05 -0.00 0.01 0.00 2.81 0.00 0.00 57.97 60.74 1s3s h PHE 290 Cb 0.78 -0.31 -0.01 0.00 3.61 0.00 0.00 35.95 40.01 1s3s h PHE 290 CO -0.27 0.63 -0.11 1.49 -1.61 0.00 0.00 178.31 178.43 1s3s h GLU 291 N 0.98 -0.23 0.08 1.51 4.81 -0.58 -0.25 114.58 120.91 1s3s h GLU 291 Ca 0.26 0.02 0.02 0.00 -0.13 0.00 0.00 59.36 59.53 1s3s h GLU 291 Cb -0.03 0.05 -0.04 0.00 0.63 0.00 0.00 28.75 29.36 1s3s h GLU 291 CO -0.05 -0.15 -0.31 1.49 -0.73 0.00 0.00 179.01 179.26 1s3s h GLU 292 N -0.24 -0.49 -0.87 1.92 4.57 0.33 -2.31 114.58 117.48 1s3s h GLU 292 Ca 0.01 0.03 0.09 0.00 -1.18 0.00 0.00 59.36 58.31 1s3s h GLU 292 Cb 0.24 0.11 -0.07 0.00 -0.16 0.00 0.00 28.75 28.88 1s3s h GLU 292 CO -0.05 -0.33 0.52 0.00 -1.18 0.00 0.00 179.01 177.97 1s3s h ALA 293 N 0.17 1.24 -0.72 2.92 0.00 -1.28 -0.95 119.26 120.64 1s3s h ALA 293 Ca 0.04 0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.97 1s3s h ALA 293 Cb 0.56 -0.19 -0.04 0.00 0.00 0.00 0.00 17.79 18.13 1s3s h ALA 293 CO -0.21 0.19 0.45 1.05 0.00 0.00 0.00 179.25 180.74 1s3s h GLU 294 N 0.90 0.96 -0.66 0.00 -0.00 -0.73 -1.68 114.58 113.37 1s3s h GLU 294 Ca 0.41 -0.07 -0.01 0.00 -0.00 0.00 0.00 59.36 59.68 1s3s h GLU 294 Cb 0.31 -0.21 -0.03 0.00 -0.00 0.00 0.00 28.75 28.82 1s3s h GLU 294 CO -0.22 0.66 0.35 -0.22 -0.00 0.00 0.00 179.01 179.58 1s3s h LYS 295 N 0.98 0.93 -0.70 1.06 3.64 -0.63 -2.67 116.57 119.18 1s3s h LYS 295 Ca 0.26 -0.11 -0.00 0.00 -1.27 0.00 0.00 60.65 59.53 1s3s h LYS 295 Cb -0.07 -0.18 -0.00 0.00 -0.41 0.00 0.00 32.23 31.57 1s3s h LYS 295 CO -0.05 0.70 0.00 0.09 -2.27 0.00 0.00 179.45 177.92 1s3s n ASN 296 N -4.52 4.46 -4.51 4.20 3.02 -0.84 -4.99 115.26 112.08 1s3s n ASN 296 Ca 0.05 -2.68 -0.41 0.00 -0.03 0.00 0.00 54.58 51.52 1s3s n ASN 296 Cb 0.10 -0.64 0.02 0.00 -0.61 0.00 0.00 39.78 38.65 1s3s n ASN 296 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1s3s n ALA 297 N 0.45 -0.81 -1.77 5.41 0.00 -0.69 -4.34 120.51 118.76 1s3s n ALA 297 Ca 0.20 0.13 -0.37 0.00 0.00 0.00 0.00 53.44 53.40 1s3s n ALA 297 Cb 0.94 -1.90 -0.03 0.00 0.00 0.00 0.00 19.45 18.46 1s3s n ALA 297 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 1s3s s PRO 298 N -1.90 4.15 0.23 0.00 0.04 -1.26 -5.00 135.00 131.25 1s3s s PRO 298 Ca 0.65 1.65 0.00 0.00 0.04 0.00 0.00 61.00 63.35 1s3s s PRO 298 Cb -0.54 -2.63 -0.04 0.00 0.04 0.00 0.00 34.50 31.32 1s3s s PRO 298 CO 0.56 -0.19 0.13 0.00 0.04 0.00 0.00 177.00 177.53 1s3s s ALA 299 N -1.53 1.41 -0.19 8.56 0.00 -0.98 -1.65 121.76 127.38 1s3s s ALA 299 Ca 0.57 -1.77 -0.04 0.00 0.00 0.00 0.00 51.96 50.72 1s3s s ALA 299 Cb -0.26 1.27 0.06 0.00 0.00 0.00 0.00 23.12 24.19 1s3s s ALA 299 CO 0.33 -0.55 0.06 -1.50 0.00 0.00 0.00 175.76 174.10 1s3s s ILE 300 N -3.98 0.28 -0.42 0.00 1.10 0.82 -1.08 121.20 117.93 1s3s s ILE 300 Ca 0.39 -0.42 -0.22 0.00 -0.51 0.00 0.00 60.65 59.89 1s3s s ILE 300 Cb 0.07 -0.86 0.02 0.00 0.15 0.00 0.00 42.46 41.83 1s3s s ILE 300 CO 0.13 -0.25 0.70 -0.63 -2.11 0.00 0.00 174.94 172.78 1s3s s ILE 301 N 1.97 4.78 -0.32 2.00 1.01 -0.47 -2.26 121.20 127.90 1s3s s ILE 301 Ca 0.00 0.38 -0.12 0.00 0.00 0.00 0.00 60.65 60.91 1s3s s ILE 301 Cb -0.17 -4.21 -0.03 0.00 0.01 0.00 0.00 42.46 38.06 1s3s s ILE 301 CO -0.09 -0.56 0.23 0.12 0.00 0.00 0.00 174.94 174.64 1s3s s PHE 302 N 2.96 3.23 -0.50 3.97 5.36 -0.77 -0.89 117.98 131.34 1s3s s PHE 302 Ca 0.26 -0.09 -0.17 0.00 -0.96 0.00 0.00 56.93 55.97 1s3s s PHE 302 Cb -0.13 -2.45 0.08 0.00 -0.34 0.00 0.00 43.02 40.18 1s3s s PHE 302 CO 0.19 -0.29 0.48 0.42 -1.46 0.00 0.00 175.22 174.56 1s3s s ILE 303 N 1.74 5.12 0.08 3.12 1.01 0.25 -0.98 121.20 131.53 1s3s s ILE 303 Ca 0.06 -0.97 -0.30 0.00 0.00 0.00 0.00 60.65 59.44 1s3s s ILE 303 Cb -0.17 -4.22 -0.05 0.00 0.01 0.00 0.00 42.46 38.03 1s3s s ILE 303 CO 0.11 -0.71 1.00 -0.62 0.00 0.00 0.00 174.94 174.72 1s3s s ASP 304 N 2.81 7.41 -1.18 3.58 -1.08 0.75 -1.83 116.67 127.13 1s3s s ASP 304 Ca 0.07 1.80 -0.01 0.00 -0.52 0.00 0.00 52.55 53.89 1s3s s ASP 304 Cb -0.24 -2.58 -0.01 0.00 -1.46 0.00 0.00 42.92 38.62 1s3s s ASP 304 CO 0.07 -0.17 0.96 -0.62 0.52 0.00 0.00 175.17 175.94 1s3s n GLU 305 N 3.15 -5.56 -0.30 4.34 1.02 -1.22 0.25 120.64 122.31 1s3s n GLU 305 Ca 0.04 0.83 0.20 0.00 -0.02 0.00 0.00 57.16 58.21 1s3s n GLU 305 Cb 0.49 -5.79 0.49 0.00 -0.02 0.00 0.00 31.44 26.61 1s3s n GLU 305 CO 0.00 0.00 0.00 1.25 1.18 0.00 0.00 177.13 179.56 1s3s h LEU 306 N -1.73 0.47 -1.43 -4.62 5.85 -1.50 0.13 115.31 112.48 1s3s h LEU 306 Ca -0.60 0.07 0.00 0.00 0.84 0.00 0.00 57.88 58.19 1s3s h LEU 306 Cb 1.34 -0.01 0.00 0.00 0.37 0.00 0.00 40.66 42.35 1s3s h LEU 306 CO 0.49 0.14 0.00 -2.24 -0.34 0.00 0.00 178.44 176.49 1s3s h ASP 307 N 0.44 0.00 0.65 1.25 3.04 -1.83 0.19 116.42 120.17 1s3s h ASP 307 Ca 0.55 0.00 -0.10 0.00 -3.24 0.00 0.00 57.03 54.24 1s3s h ASP 307 Cb 1.32 0.00 -0.01 0.00 -1.04 0.00 0.00 39.33 39.59 1s3s h ASP 307 CO -0.26 0.00 -0.46 0.00 -2.04 0.00 0.00 179.24 176.48 1s3s h ALA 308 N 2.09 1.07 0.00 4.15 0.00 -1.08 -3.33 119.26 122.15 1s3s h ALA 308 Ca 0.00 -0.42 -0.40 0.00 0.00 0.00 0.00 54.91 54.09 1s3s h ALA 308 Cb 0.20 -0.07 -0.06 0.00 0.00 0.00 0.00 17.79 17.85 1s3s h ALA 308 CO 0.00 0.57 -2.39 -0.89 0.00 0.00 0.00 179.25 176.54 1s3s n ILE 309 N -3.74 1.38 -3.73 0.00 5.41 -0.12 -4.83 119.36 113.72 1s3s n ILE 309 Ca -0.01 -0.41 -0.31 0.00 1.00 0.00 0.00 62.75 63.01 1s3s n ILE 309 Cb 0.52 -1.66 -0.09 0.00 -0.71 0.00 0.00 39.64 37.70 1s3s n ILE 309 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1s3s n ALA 310 N -3.79 3.68 -2.02 -1.39 0.00 -0.16 -4.24 120.51 112.59 1s3s n ALA 310 Ca -0.47 -4.59 -0.34 0.00 0.00 0.00 0.00 53.44 48.04 1s3s n ALA 310 Cb 0.89 -1.32 -0.06 0.00 0.00 0.00 0.00 19.45 18.96 1s3s n ALA 310 CO 0.00 0.00 0.00 -2.14 0.00 0.00 0.00 177.50 175.36 1s3s s PRO 311 N -1.57 4.20 -0.08 0.00 0.02 -1.25 -2.36 135.00 133.96 1s3s s PRO 311 Ca 0.28 0.91 -0.38 0.00 0.02 0.00 0.00 61.00 61.82 1s3s s PRO 311 Cb -0.03 -2.56 -0.16 0.00 0.02 0.00 0.00 34.50 31.76 1s3s s PRO 311 CO -0.13 0.20 1.52 0.36 -0.33 0.00 0.00 177.00 178.62 1s3s n LYS 312 N 0.02 1.15 -0.53 5.54 0.00 -1.21 -4.36 118.16 118.76 1s3s n LYS 312 Ca 0.02 0.42 0.40 0.00 -0.00 0.00 0.00 58.31 59.15 1s3s n LYS 312 Cb 0.52 -2.08 0.62 0.00 -0.00 0.00 0.00 35.03 34.09 1s3s n LYS 312 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.40 177.94 1s3s n ARG 313 N 3.80 -0.00 0.26 -1.58 1.74 -1.26 0.17 116.66 119.80 1s3s n ARG 313 Ca 0.22 0.82 0.15 0.00 -0.77 0.00 0.00 57.85 58.27 1s3s n ARG 313 Cb 0.16 -1.89 0.65 0.00 -1.02 0.00 0.00 32.46 30.37 1s3s n ARG 313 CO 0.00 0.00 0.00 1.49 -1.52 0.00 0.00 177.63 177.60 1s3s h GLU 314 N 0.00 0.00 0.00 5.56 4.81 -2.00 -3.32 114.58 119.63 1s3s h GLU 314 Ca 0.71 0.00 -0.27 0.00 -0.13 0.00 0.00 59.36 59.67 1s3s h GLU 314 Cb 2.84 0.00 -0.05 0.00 0.63 0.00 0.00 28.75 32.17 1s3s h GLU 314 CO -0.02 0.07 -2.06 1.63 -0.73 0.00 0.00 179.01 177.91 1s3s n LYS 315 N -3.22 1.36 -2.21 1.92 5.02 0.46 -5.01 118.16 116.48 1s3s n LYS 315 Ca 0.00 -0.02 -0.37 0.00 -2.02 0.00 0.00 58.31 55.91 1s3s n LYS 315 Cb 0.33 -1.40 -0.00 0.00 -0.02 0.00 0.00 35.03 33.93 1s3s n LYS 315 CO 0.00 0.00 0.00 0.99 -0.52 0.00 0.00 177.40 177.87 1s3s s THR 316 N -2.44 3.02 -0.26 -0.18 2.01 -1.17 -5.03 115.64 111.59 1s3s s THR 316 Ca -0.08 0.74 -0.01 0.00 0.31 0.00 0.00 61.69 62.65 1s3s s THR 316 Cb 0.05 -3.36 0.14 0.00 0.01 0.00 0.00 72.50 69.34 1s3s s THR 316 CO 0.65 -0.04 0.38 -1.38 -0.69 0.00 0.00 174.62 173.54 1s3s s HIS 317 N -1.56 -0.85 0.00 4.92 -3.43 -1.26 -4.99 115.29 108.11 1s3s s HIS 317 Ca 0.66 0.61 0.00 0.00 -0.80 0.00 0.00 55.06 55.53 1s3s s HIS 317 Cb -0.29 -0.07 0.00 0.00 -1.43 0.00 0.00 32.58 30.79 1s3s s HIS 317 CO 0.34 -0.81 0.00 0.41 -2.00 0.00 0.00 174.74 172.68 1s3s n GLY 318 N 5.36 4.59 0.00 -1.38 0.00 -1.26 -4.72 105.19 107.78 1s3s n GLY 318 Ca -0.02 -0.67 0.04 0.00 0.00 0.00 0.00 46.02 45.37 1s3s n GLY 318 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 1s3s n GLU 319 N -1.55 0.36 0.00 1.61 0.28 -1.26 -1.54 120.64 118.54 1s3s n GLU 319 Ca 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 57.00 1s3s n GLU 319 Cb 0.00 -1.32 0.00 0.00 1.43 0.00 0.00 31.44 31.55 1s3s n GLU 319 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 177.13 177.25 1s3s n VAL 320 N -0.82 0.00 0.07 3.84 0.31 -1.26 -4.26 118.33 116.21 1s3s n VAL 320 Ca 0.05 0.00 -0.13 0.00 -0.01 0.00 0.00 64.34 64.26 1s3s n VAL 320 Cb 0.03 -0.31 -0.09 0.00 -0.91 0.00 0.00 33.84 32.56 1s3s n VAL 320 CO 0.00 0.00 0.00 -0.33 -1.32 0.00 0.00 176.83 175.18 1s3s h GLU 321 N 0.00 -0.18 -0.02 5.55 4.39 -1.58 -2.87 114.58 119.87 1s3s h GLU 321 Ca 0.00 0.01 -0.12 0.00 0.34 0.00 0.00 59.36 59.59 1s3s h GLU 321 Cb 0.44 0.04 -0.02 0.00 -0.10 0.00 0.00 28.75 29.11 1s3s h GLU 321 CO 0.00 0.19 -0.54 0.00 -1.16 0.00 0.00 179.01 177.50 1s3s h ARG 322 N -0.58 0.05 0.00 2.33 2.47 -1.57 -2.63 114.38 114.45 1s3s h ARG 322 Ca -0.02 -0.03 -0.01 0.00 -1.26 0.00 0.00 59.98 58.66 1s3s h ARG 322 Cb 0.45 0.00 -0.00 0.00 -1.65 0.00 0.00 29.97 28.77 1s3s h ARG 322 CO 0.03 0.58 -0.05 -0.09 0.56 0.00 0.00 179.97 181.00 1s3s h ARG 323 N 0.04 0.00 0.11 0.04 2.43 -1.73 -1.88 114.38 113.39 1s3s h ARG 323 Ca -0.00 0.00 -0.26 0.00 -0.81 0.00 0.00 59.98 58.91 1s3s h ARG 323 Cb 0.96 0.00 -0.00 0.00 -0.42 0.00 0.00 29.97 30.51 1s3s h ARG 323 CO 0.07 0.05 -1.30 0.82 -1.51 0.00 0.00 179.97 178.10 1s3s h ILE 324 N 0.00 1.10 -0.76 1.20 2.04 -1.24 -2.66 117.51 117.20 1s3s h ILE 324 Ca -0.00 -2.41 0.08 0.00 1.00 0.00 0.00 64.86 63.54 1s3s h ILE 324 Cb 0.30 2.77 -0.07 0.00 -0.74 0.00 0.00 36.82 39.08 1s3s h ILE 324 CO 0.01 0.69 0.42 0.58 0.00 0.00 0.00 178.15 179.84 1s3s h VAL 325 N -0.36 0.92 -0.10 1.67 2.07 -1.34 -1.80 116.25 117.31 1s3s h VAL 325 Ca -0.28 -0.25 -0.01 0.00 0.82 0.00 0.00 66.70 66.99 1s3s h VAL 325 Cb 1.71 0.12 -0.00 0.00 -1.52 0.00 0.00 31.29 31.60 1s3s h VAL 325 CO 0.06 0.13 0.05 0.28 0.02 0.00 0.00 177.57 178.11 1s3s h SER 326 N 0.73 0.14 -0.80 0.57 0.02 -1.45 -2.34 113.55 110.43 1s3s h SER 326 Ca 0.36 -0.14 0.15 0.00 -0.84 0.00 0.00 61.79 61.31 1s3s h SER 326 Cb 0.30 -0.04 -0.10 0.00 0.14 0.00 0.00 62.40 62.71 1s3s h SER 326 CO -0.23 0.25 0.35 -0.61 -1.14 0.00 0.00 176.83 175.45 1s3s h GLN 327 N 0.02 0.49 -0.46 3.45 5.75 -1.05 -0.48 115.11 122.83 1s3s h GLN 327 Ca 0.04 -0.03 -0.00 0.00 -0.15 0.00 0.00 58.65 58.51 1s3s h GLN 327 Cb 0.15 -0.11 -0.02 0.00 1.07 0.00 0.00 27.48 28.56 1s3s h GLN 327 CO -0.00 0.32 0.29 1.25 -2.65 0.00 0.00 178.83 178.03 1s3s h LEU 328 N 0.50 0.55 0.70 -2.39 5.85 -1.02 0.60 115.31 120.09 1s3s h LEU 328 Ca 0.44 -0.04 -0.03 0.00 0.84 0.00 0.00 57.88 59.09 1s3s h LEU 328 Cb 0.67 -0.14 0.00 0.00 0.37 0.00 0.00 40.66 41.57 1s3s h LEU 328 CO -0.40 0.43 -0.39 -0.07 -0.34 0.00 0.00 178.44 177.67 1s3s h LEU 329 N 0.62 -0.96 -0.59 2.25 3.38 -0.73 -1.77 115.31 117.51 1s3s h LEU 329 Ca 0.17 0.05 0.11 0.00 0.09 0.00 0.00 57.88 58.29 1s3s h LEU 329 Cb -0.02 0.27 -0.11 0.00 0.09 0.00 0.00 40.66 40.88 1s3s h LEU 329 CO -0.03 -0.63 -0.27 0.74 0.09 0.00 0.00 178.44 178.34 1s3s h THR 330 N -1.01 0.24 -0.97 0.22 2.02 -0.88 0.19 112.91 112.72 1s3s h THR 330 Ca -0.09 0.00 0.15 0.00 0.77 0.00 0.00 66.41 67.23 1s3s h THR 330 Cb 0.80 0.24 -0.09 0.00 -1.74 0.00 0.00 68.15 67.37 1s3s h THR 330 CO 0.12 0.00 0.61 -0.07 0.37 0.00 0.00 175.52 176.55 1s3s h LEU 331 N -0.11 0.81 0.19 2.58 3.38 -0.69 0.64 115.31 122.10 1s3s h LEU 331 Ca 0.26 0.06 -0.01 0.00 0.09 0.00 0.00 57.88 58.27 1s3s h LEU 331 Cb 0.52 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 41.18 1s3s h LEU 331 CO -0.66 0.39 -0.09 0.24 0.09 0.00 0.00 178.44 178.41 1s3s h MET 332 N 0.85 -0.25 0.00 1.13 2.86 0.21 -2.09 114.93 117.65 1s3s h MET 332 Ca 0.50 0.02 -0.01 0.00 -2.06 0.00 0.00 59.70 58.16 1s3s h MET 332 Cb 0.67 0.06 -0.00 0.00 0.06 0.00 0.00 31.60 32.38 1s3s h MET 332 CO -0.28 0.08 -0.03 -0.44 1.06 0.00 0.00 176.91 177.30 1s3s h ASP 333 N -0.60 0.00 -0.33 1.22 3.32 -0.50 -2.01 116.42 117.51 1s3s h ASP 333 Ca -0.03 0.00 -0.09 0.00 0.02 0.00 0.00 57.03 56.94 1s3s h ASP 333 Cb 0.44 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 39.97 1s3s h ASP 333 CO 0.04 0.03 -0.09 1.23 -1.72 0.00 0.00 179.24 178.73 1s3s h GLY 334 N 0.30 0.81 -4.19 2.75 0.00 0.93 -3.44 103.07 100.24 1s3s h GLY 334 Ca -0.00 -0.60 -0.56 0.00 0.00 0.00 0.00 47.33 46.17 1s3s h GLY 334 CO 0.00 0.55 0.61 1.04 0.00 0.00 0.00 176.54 178.75 1s3s n LEU 335 N -4.18 3.86 -4.41 3.11 4.77 -0.76 -5.01 117.00 114.39 1s3s n LEU 335 Ca 0.01 1.20 -0.28 0.00 -0.03 0.00 0.00 56.01 56.91 1s3s n LEU 335 Cb 0.35 -1.52 -0.12 0.00 -2.33 0.00 0.00 43.42 39.80 1s3s n LEU 335 CO 0.42 -0.28 -0.55 -0.54 -1.33 0.00 0.00 177.39 175.12 1s3s s LYS 336 N -1.64 1.48 0.48 3.23 -0.14 -1.26 -5.02 119.74 116.86 1s3s s LYS 336 Ca 0.57 -1.40 0.18 0.00 -1.36 0.00 0.00 55.97 53.96 1s3s s LYS 336 Cb -0.55 -1.90 1.20 0.00 -1.68 0.00 0.00 37.83 34.90 1s3s s LYS 336 CO 0.60 0.43 2.01 1.96 -0.76 0.00 0.00 175.35 179.59 1s3s h GLN 337 N 3.60 0.20 -0.99 1.68 4.20 -1.95 -2.93 115.11 118.92 1s3s h GLN 337 Ca -0.49 -0.01 0.35 0.00 0.06 0.00 0.00 58.65 58.55 1s3s h GLN 337 Cb 1.18 -0.04 -0.17 0.00 0.30 0.00 0.00 27.48 28.75 1s3s h GLN 337 CO 0.43 0.13 0.36 -0.09 -0.67 0.00 0.00 178.83 178.99 1s3s h ARG 338 N 0.20 0.06 0.00 1.46 9.65 -1.95 1.12 114.38 124.92 1s3s h ARG 338 Ca 0.23 -0.00 0.00 0.00 -1.10 0.00 0.00 59.98 59.11 1s3s h ARG 338 Cb 0.66 -0.01 0.00 0.00 -1.39 0.00 0.00 29.97 29.22 1s3s h ARG 338 CO -0.04 0.04 0.00 0.00 2.80 0.00 0.00 179.97 182.77 1s3s n ALA 339 N -2.57 1.64 -3.69 2.80 0.00 -1.10 -4.91 120.51 112.67 1s3s n ALA 339 Ca 0.31 0.08 -0.23 0.00 0.00 0.00 0.00 53.44 53.60 1s3s n ALA 339 Cb 1.04 -1.37 0.00 0.00 0.00 0.00 0.00 19.45 19.13 1s3s n ALA 339 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 1s3s n HIS 340 N -2.16 -2.13 -4.30 0.00 8.25 0.39 -4.51 115.22 110.75 1s3s n HIS 340 Ca 0.02 0.79 -0.20 0.00 -0.26 0.00 0.00 57.72 58.07 1s3s n HIS 340 Cb 0.22 -3.05 -0.16 0.00 1.12 0.00 0.00 29.99 28.12 1s3s n HIS 340 CO 0.00 0.00 0.00 0.08 0.64 0.00 0.00 176.34 177.06 1s3s s VAL 341 N -3.07 0.68 -0.14 1.59 1.01 -1.26 -2.32 120.40 116.90 1s3s s VAL 341 Ca 0.08 -0.26 -0.01 0.00 0.00 0.00 0.00 61.98 61.78 1s3s s VAL 341 Cb -0.04 -0.64 -0.02 0.00 0.00 0.00 0.00 36.38 35.68 1s3s s VAL 341 CO 0.88 0.24 -0.11 -0.63 0.00 0.00 0.00 175.10 175.48 1s3s s ILE 342 N 0.49 3.28 -0.41 2.22 1.01 -0.24 -4.83 121.20 122.74 1s3s s ILE 342 Ca -0.07 -0.58 -0.10 0.00 0.00 0.00 0.00 60.65 59.89 1s3s s ILE 342 Cb -0.11 -2.40 0.06 0.00 0.01 0.00 0.00 42.46 40.02 1s3s s ILE 342 CO 0.01 0.52 0.25 -0.69 0.00 0.00 0.00 174.94 175.02 1s3s s VAL 343 N 0.33 4.45 -0.02 2.92 1.01 0.01 -1.36 120.40 127.74 1s3s s VAL 343 Ca -0.09 -1.16 -0.13 0.00 0.00 0.00 0.00 61.98 60.61 1s3s s VAL 343 Cb -0.15 -3.62 -0.05 0.00 0.00 0.00 0.00 36.38 32.55 1s3s s VAL 343 CO 0.05 -0.41 0.35 -0.04 0.00 0.00 0.00 175.10 175.06 1s3s s MET 344 N 1.49 3.81 0.07 2.72 -1.94 -0.07 -1.56 119.30 123.82 1s3s s MET 344 Ca 0.02 0.28 0.03 0.00 -1.71 0.00 0.00 55.69 54.32 1s3s s MET 344 Cb -0.22 -3.20 -0.03 0.00 2.01 0.00 0.00 34.83 33.40 1s3s s MET 344 CO 0.04 0.70 -0.09 0.00 -0.01 0.00 0.00 175.02 175.66 1s3s s ALA 345 N -1.09 0.84 0.05 3.03 0.00 -0.52 -0.59 121.76 123.50 1s3s s ALA 345 Ca 0.23 -0.96 0.06 0.00 0.00 0.00 0.00 51.96 51.28 1s3s s ALA 345 Cb -0.16 0.03 -0.03 0.00 0.00 0.00 0.00 23.12 22.97 1s3s s ALA 345 CO 0.12 -0.01 -0.18 0.00 0.00 0.00 0.00 175.76 175.69 1s3s s ALA 346 N -1.84 1.49 0.24 0.00 0.00 -0.76 -0.28 121.76 120.61 1s3s s ALA 346 Ca -0.03 -1.00 -0.19 0.00 0.00 0.00 0.00 51.96 50.74 1s3s s ALA 346 Cb -0.07 -0.24 0.02 0.00 0.00 0.00 0.00 23.12 22.83 1s3s s ALA 346 CO 0.00 0.30 0.62 -0.08 0.00 0.00 0.00 175.76 176.60 1s3s s THR 347 N -0.92 0.01 0.07 0.00 -1.32 -0.37 -1.93 115.64 111.17 1s3s s THR 347 Ca 0.04 -0.90 -0.15 0.00 -1.21 0.00 0.00 61.69 59.48 1s3s s THR 347 Cb -0.09 -1.82 -0.20 0.00 -1.51 0.00 0.00 72.50 68.89 1s3s s THR 347 CO 0.02 -0.03 1.22 0.78 -2.21 0.00 0.00 174.62 174.41 1s3s h ASN 348 N 2.09 0.85 -5.21 8.08 -0.26 -1.86 -2.94 115.58 116.32 1s3s h ASN 348 Ca -0.24 -0.69 -0.09 0.00 -0.56 0.00 0.00 56.30 54.72 1s3s h ASN 348 Cb 1.26 -0.25 -0.05 0.00 -1.06 0.00 0.00 38.32 38.21 1s3s h ASN 348 CO 0.30 1.41 0.03 0.00 -1.06 0.00 0.00 177.43 178.11 1s3s s ARG 349 N -3.51 1.90 0.08 0.81 1.70 -1.26 -2.50 118.95 116.16 1s3s s ARG 349 Ca -0.11 -1.41 -0.18 0.00 -0.47 0.00 0.00 55.73 53.56 1s3s s ARG 349 Cb 0.07 0.53 -0.10 0.00 -0.57 0.00 0.00 34.95 34.88 1s3s s ARG 349 CO 0.89 -0.83 1.44 -1.00 -1.08 0.00 0.00 175.30 174.72 1s3s h PRO 350 N 2.10 0.50 -0.01 3.89 0.13 -1.95 -2.81 132.00 133.86 1s3s h PRO 350 Ca -0.27 -0.22 0.00 0.00 -0.87 0.00 0.00 66.00 64.64 1s3s h PRO 350 Cb 1.25 -0.01 -0.00 0.00 0.13 0.00 0.00 31.00 32.36 1s3s h PRO 350 CO 0.36 0.77 0.10 -0.91 -0.23 0.00 0.00 178.00 178.09 1s3s h ASN 351 N 0.22 0.00 -0.56 1.44 -0.26 -2.03 -1.55 115.58 112.85 1s3s h ASN 351 Ca 0.05 0.00 -0.11 0.00 -0.56 0.00 0.00 56.30 55.68 1s3s h ASN 351 Cb 0.61 0.00 -0.02 0.00 -1.06 0.00 0.00 38.32 37.86 1s3s h ASN 351 CO 0.03 0.00 -0.09 0.28 -1.06 0.00 0.00 177.43 176.59 1s3s h SER 352 N 0.00 1.05 -3.40 5.81 0.02 -1.90 -3.42 113.55 111.69 1s3s h SER 352 Ca 0.00 -0.34 -0.48 0.00 -0.84 0.00 0.00 61.79 60.13 1s3s h SER 352 Cb 0.21 -0.28 0.03 0.00 0.14 0.00 0.00 62.40 62.50 1s3s h SER 352 CO -0.00 1.14 0.06 -0.63 -1.14 0.00 0.00 176.83 176.27 1s3s s ILE 353 N -4.88 4.59 -0.16 3.27 -1.09 -0.58 -3.36 121.20 118.99 1s3s s ILE 353 Ca -0.12 0.01 -0.21 0.00 -2.23 0.00 0.00 60.65 58.10 1s3s s ILE 353 Cb 0.13 -3.74 -0.03 0.00 -1.58 0.00 0.00 42.46 37.24 1s3s s ILE 353 CO 0.86 -0.69 0.63 -0.62 -1.23 0.00 0.00 174.94 173.90 1s3s s ASP 354 N -4.15 6.75 0.57 3.58 2.15 -1.00 -3.97 116.67 120.60 1s3s s ASP 354 Ca 0.48 0.90 0.43 0.00 0.43 0.00 0.00 52.55 54.79 1s3s s ASP 354 Cb -0.10 -2.35 1.53 0.00 -0.30 0.00 0.00 42.92 41.70 1s3s s ASP 354 CO 0.43 -0.21 1.56 -0.65 -0.17 0.00 0.00 175.17 176.13 1s3s h PRO 355 N 7.25 0.00 -0.00 4.34 0.11 -1.94 0.12 132.00 141.87 1s3s h PRO 355 Ca -0.34 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.77 1s3s h PRO 355 Cb 1.16 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.27 1s3s h PRO 355 CO 0.77 0.00 0.11 0.00 -0.21 0.00 0.00 178.00 178.67 1s3s h ALA 356 N 0.97 1.13 0.00 -0.75 0.00 -1.99 0.09 119.26 118.71 1s3s h ALA 356 Ca 0.77 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.68 1s3s h ALA 356 Cb 3.31 0.00 0.00 0.00 0.00 0.00 0.00 17.79 21.10 1s3s h ALA 356 CO -0.01 -0.11 -0.23 1.28 0.00 0.00 0.00 179.25 180.19 1s3s n LEU 357 N -3.04 0.79 0.08 0.00 4.77 0.40 -3.69 117.00 116.31 1s3s n LEU 357 Ca -0.03 0.45 -0.13 0.00 -0.03 0.00 0.00 56.01 56.28 1s3s n LEU 357 Cb 0.17 -0.27 -0.13 0.00 -2.33 0.00 0.00 43.42 40.86 1s3s n LEU 357 CO 0.18 -0.14 -0.01 0.03 -1.33 0.00 0.00 177.39 176.12 1s3s h ARG 358 N 0.00 0.17 -5.93 3.23 2.47 -1.16 0.11 114.38 113.27 1s3s h ARG 358 Ca 0.00 -0.29 -0.81 0.00 -1.26 0.00 0.00 59.98 57.62 1s3s h ARG 358 Cb 0.74 0.11 -0.02 0.00 -1.65 0.00 0.00 29.97 29.16 1s3s h ARG 358 CO 0.00 1.12 1.01 -2.13 0.56 0.00 0.00 179.97 180.53 1s3s n ARG 359 N -3.45 0.00 0.00 0.04 0.63 -1.23 -3.96 116.66 108.70 1s3s n ARG 359 Ca -0.06 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.87 1s3s n ARG 359 Cb 1.00 -1.48 0.00 0.00 0.45 0.00 0.00 32.46 32.42 1s3s n ARG 359 CO 0.00 0.00 0.00 1.19 -2.51 0.00 0.00 177.63 176.31 1s3s n PHE 360 N 5.76 0.00 0.26 -0.14 3.01 -1.26 0.25 117.46 125.33 1s3s n PHE 360 Ca 0.43 0.00 0.07 0.00 1.01 0.00 0.00 57.45 58.96 1s3s n PHE 360 Cb -0.05 -0.24 0.33 0.00 -0.01 0.00 0.00 39.48 39.51 1s3s n PHE 360 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1s3s n GLY 361 N -0.49 -0.89 0.00 1.37 0.00 -1.26 -4.28 105.19 99.64 1s3s n GLY 361 Ca 0.00 0.05 0.00 0.00 0.00 0.00 0.00 46.02 46.07 1s3s n GLY 361 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1s3s n ARG 362 N -1.85 0.00 -2.90 1.61 1.74 0.14 -4.73 116.66 110.67 1s3s n ARG 362 Ca 0.01 0.00 -0.44 0.00 -0.77 0.00 0.00 57.85 56.65 1s3s n ARG 362 Cb 0.10 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 31.54 1s3s n ARG 362 CO 0.00 0.00 0.00 1.19 -1.52 0.00 0.00 177.63 177.30 1s3s n PHE 363 N 0.00 4.69 0.38 -1.55 3.72 0.39 -2.77 117.46 122.32 1s3s n PHE 363 Ca 0.00 -3.32 0.11 0.00 -0.05 0.00 0.00 57.45 54.20 1s3s n PHE 363 Cb 0.00 -2.11 0.03 0.00 -0.94 0.00 0.00 39.48 36.47 1s3s n PHE 363 CO 0.00 0.00 0.00 -0.40 -0.05 0.00 0.00 176.76 176.31 1s3s n ASP 364 N 5.11 0.66 -4.36 4.37 3.85 -1.23 -4.31 116.55 120.64 1s3s n ASP 364 Ca 0.36 0.05 -0.35 0.00 -0.71 0.00 0.00 54.79 54.14 1s3s n ASP 364 Cb 0.41 0.63 -0.13 0.00 -1.35 0.00 0.00 41.12 40.68 1s3s n ASP 364 CO 0.00 0.00 0.00 -0.13 -1.01 0.00 0.00 177.20 176.06 1s3s s ARG 365 N -3.27 3.48 0.06 0.11 1.81 -1.17 -5.04 118.95 114.93 1s3s s ARG 365 Ca 0.02 -0.57 0.08 0.00 -1.72 0.00 0.00 55.73 53.54 1s3s s ARG 365 Cb 0.13 -3.11 -0.03 0.00 -0.45 0.00 0.00 34.95 31.49 1s3s s ARG 365 CO 0.79 -0.18 -0.22 -1.21 -0.68 0.00 0.00 175.30 173.80 1s3s s GLU 366 N 1.48 1.38 -0.06 3.54 2.02 -1.26 0.23 118.70 126.03 1s3s s GLU 366 Ca 0.06 -1.03 0.02 0.00 0.02 0.00 0.00 54.97 54.04 1s3s s GLU 366 Cb -0.15 -1.55 0.01 0.00 0.10 0.00 0.00 34.13 32.54 1s3s s GLU 366 CO -0.01 0.39 -0.11 0.08 0.02 0.00 0.00 175.26 175.63 1s3s s VAL 367 N -0.89 1.06 0.06 2.63 1.01 0.11 -4.92 120.40 119.46 1s3s s VAL 367 Ca 0.08 -0.45 -0.22 0.00 0.00 0.00 0.00 61.98 61.39 1s3s s VAL 367 Cb -0.09 -0.96 -0.06 0.00 0.00 0.00 0.00 36.38 35.26 1s3s s VAL 367 CO 0.03 0.33 0.64 -0.62 0.00 0.00 0.00 175.10 175.48 1s3s s ASP 368 N 0.56 7.11 -0.42 3.32 2.15 -1.26 -1.72 116.67 126.41 1s3s s ASP 368 Ca -0.12 1.32 0.02 0.00 0.43 0.00 0.00 52.55 54.20 1s3s s ASP 368 Cb -0.14 -2.40 0.15 0.00 -0.30 0.00 0.00 42.92 40.23 1s3s s ASP 368 CO 0.03 0.17 0.28 -0.63 -0.17 0.00 0.00 175.17 174.84 1s3s s ILE 369 N -0.65 0.79 0.00 4.11 1.01 -0.67 -4.86 121.20 120.92 1s3s s ILE 369 Ca 0.32 -2.43 0.00 0.00 0.00 0.00 0.00 60.65 58.55 1s3s s ILE 369 Cb -0.20 -1.55 0.00 0.00 0.01 0.00 0.00 42.46 40.72 1s3s s ILE 369 CO 0.20 -1.03 0.00 0.61 0.00 0.00 0.00 174.94 174.72 1s3s n GLY 370 N 3.40 -0.08 3.75 6.18 0.00 -1.26 -4.38 105.19 112.79 1s3s n GLY 370 Ca 0.17 -1.75 -0.41 0.00 0.00 0.00 0.00 46.02 44.03 1s3s n GLY 370 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1s3s s ILE 371 N 0.40 3.51 0.63 -0.61 1.01 -1.26 -4.98 121.20 119.91 1s3s s ILE 371 Ca 0.00 1.35 -0.17 0.00 0.00 0.00 0.00 60.65 61.83 1s3s s ILE 371 Cb 0.00 -3.86 -0.01 0.00 0.01 0.00 0.00 42.46 38.59 1s3s s ILE 371 CO 0.00 0.25 1.17 -2.84 0.00 0.00 0.00 174.94 173.53 1s3s s PRO 372 N -0.69 2.80 0.62 2.79 0.02 -1.26 -5.05 135.00 134.23 1s3s s PRO 372 Ca 0.50 1.68 0.06 0.00 0.02 0.00 0.00 61.00 63.26 1s3s s PRO 372 Cb -0.33 -1.92 0.10 0.00 0.02 0.00 0.00 34.50 32.37 1s3s s PRO 372 CO 0.39 -1.31 0.85 0.16 -0.33 0.00 0.00 177.00 176.76 1s3s s ASP 373 N -1.95 4.87 0.30 2.53 -4.77 -1.26 -4.70 116.67 111.69 1s3s s ASP 373 Ca 0.74 -0.69 0.01 0.00 -3.30 0.00 0.00 52.55 49.31 1s3s s ASP 373 Cb -0.27 0.18 0.72 0.00 -1.09 0.00 0.00 42.92 42.46 1s3s s ASP 373 CO 0.37 -1.50 1.52 0.00 0.70 0.00 0.00 175.17 176.26 1s3s n ALA 374 N -2.42 0.48 0.11 2.11 0.00 -1.26 -0.40 120.51 119.12 1s3s n ALA 374 Ca 0.15 1.04 -0.13 0.00 0.00 0.00 0.00 53.44 54.50 1s3s n ALA 374 Cb 0.61 -0.75 -0.08 0.00 0.00 0.00 0.00 19.45 19.23 1s3s n ALA 374 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.50 178.65 1s3s h THR 375 N 0.00 0.88 -0.24 0.00 2.02 -1.93 -2.83 112.91 110.82 1s3s h THR 375 Ca 0.58 -0.44 0.04 0.00 0.77 0.00 0.00 66.41 67.36 1s3s h THR 375 Cb 1.18 1.15 -0.04 0.00 -1.74 0.00 0.00 68.15 68.70 1s3s h THR 375 CO -0.92 0.10 0.01 1.23 0.37 0.00 0.00 175.52 176.31 1s3s h GLY 376 N -0.48 0.24 0.29 2.16 0.00 -1.06 -1.93 103.07 102.28 1s3s h GLY 376 Ca -0.03 0.02 0.18 0.00 0.00 0.00 0.00 47.33 47.50 1s3s h GLY 376 CO 0.04 -0.04 0.61 3.21 0.00 0.00 0.00 176.54 180.36 1s3s h ARG 377 N 0.09 0.67 0.42 4.80 3.08 -0.79 -1.17 114.38 121.48 1s3s h ARG 377 Ca 0.11 -0.04 -0.02 0.00 0.07 0.00 0.00 59.98 60.10 1s3s h ARG 377 Cb 0.14 -0.15 0.00 0.00 0.08 0.00 0.00 29.97 30.04 1s3s h ARG 377 CO -0.18 0.45 -0.22 1.25 -1.07 0.00 0.00 179.97 180.19 1s3s h LEU 378 N 0.70 -0.54 -0.67 3.04 5.85 -1.09 -1.12 115.31 121.47 1s3s h LEU 378 Ca 0.52 0.03 0.11 0.00 0.84 0.00 0.00 57.88 59.37 1s3s h LEU 378 Cb 0.88 0.15 -0.08 0.00 0.37 0.00 0.00 40.66 41.98 1s3s h LEU 378 CO -0.28 -0.37 0.26 -0.08 -0.34 0.00 0.00 178.44 177.63 1s3s h GLU 379 N -0.60 0.42 0.54 1.25 4.81 -1.03 -1.06 114.58 118.91 1s3s h GLU 379 Ca -0.05 -0.03 -0.02 0.00 -0.13 0.00 0.00 59.36 59.13 1s3s h GLU 379 Cb 0.47 -0.09 -0.00 0.00 0.63 0.00 0.00 28.75 29.76 1s3s h GLU 379 CO 0.08 0.28 -0.31 0.82 -0.73 0.00 0.00 179.01 179.14 1s3s h ILE 380 N 0.43 0.36 -0.92 2.32 2.04 -1.04 -1.39 117.51 119.31 1s3s h ILE 380 Ca 0.35 0.00 0.20 0.00 1.00 0.00 0.00 64.86 66.40 1s3s h ILE 380 Cb 0.46 0.36 -0.11 0.00 -0.74 0.00 0.00 36.82 36.79 1s3s h ILE 380 CO -0.34 0.00 0.49 -0.07 0.00 0.00 0.00 178.15 178.23 1s3s h LEU 381 N -0.80 0.55 -0.85 1.44 3.38 -0.49 0.81 115.31 119.36 1s3s h LEU 381 Ca -0.07 0.12 -0.03 0.00 0.09 0.00 0.00 57.88 57.99 1s3s h LEU 381 Cb 0.64 0.04 -0.04 0.00 0.09 0.00 0.00 40.66 41.39 1s3s h LEU 381 CO 0.08 0.14 0.41 1.56 0.09 0.00 0.00 178.44 180.71 1s3s h GLN 382 N 0.57 1.22 -0.64 1.13 4.20 -0.69 -2.32 115.11 118.58 1s3s h GLN 382 Ca 0.55 -0.18 -0.03 0.00 0.06 0.00 0.00 58.65 59.05 1s3s h GLN 382 Cb 0.94 -0.22 -0.03 0.00 0.30 0.00 0.00 27.48 28.47 1s3s h GLN 382 CO -0.44 0.94 0.26 0.82 -0.67 0.00 0.00 178.83 179.74 1s3s h ILE 383 N 1.21 1.22 -0.48 2.54 2.04 0.23 -2.97 117.51 121.30 1s3s h ILE 383 Ca 0.29 -0.69 -0.08 0.00 1.00 0.00 0.00 64.86 65.39 1s3s h ILE 383 Cb 0.12 0.45 -0.05 0.00 -0.74 0.00 0.00 36.82 36.61 1s3s h ILE 383 CO -0.04 0.28 0.10 1.41 0.00 0.00 0.00 178.15 179.90 1s3s n HIS 384 N -4.31 1.68 -0.81 1.37 8.25 -0.77 -3.77 115.22 116.86 1s3s n HIS 384 Ca 0.06 -0.72 0.00 0.00 -0.26 0.00 0.00 57.72 56.79 1s3s n HIS 384 Cb 0.17 -0.48 0.00 0.00 1.12 0.00 0.00 29.99 30.80 1s3s n HIS 384 CO 0.00 0.00 0.00 0.25 0.64 0.00 0.00 176.34 177.23 1s3s n THR 385 N 0.23 0.08 0.42 1.59 -2.24 -1.09 -4.81 114.28 108.46 1s3s n THR 385 Ca 0.25 -0.14 0.09 0.00 -2.27 0.00 0.00 64.05 61.99 1s3s n THR 385 Cb 1.03 1.41 0.39 0.00 -2.10 0.00 0.00 70.33 71.06 1s3s n THR 385 CO 0.00 0.00 0.00 2.29 -0.57 0.00 0.00 175.07 176.79 1s3s n LYS 386 N -0.04 0.09 -0.00 -0.78 2.85 -1.15 -2.41 118.16 116.72 1s3s n LYS 386 Ca 0.00 0.35 0.07 0.00 -1.05 0.00 0.00 58.31 57.69 1s3s n LYS 386 Cb 0.31 -1.69 -0.10 0.00 -0.65 0.00 0.00 35.03 32.91 1s3s n LYS 386 CO 0.00 0.00 0.00 0.09 -0.05 0.00 0.00 177.40 177.44 1s3s n ASN 387 N -1.87 1.16 -4.69 -5.58 5.03 -1.26 -4.47 115.26 103.58 1s3s n ASN 387 Ca 0.03 -0.40 -0.32 0.00 0.87 0.00 0.00 54.58 54.76 1s3s n ASN 387 Cb 0.19 1.36 -0.08 0.00 -1.02 0.00 0.00 39.78 40.22 1s3s n ASN 387 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 1s3s s MET 388 N -2.72 2.72 -0.65 3.52 0.23 -1.01 -0.52 119.30 120.86 1s3s s MET 388 Ca -0.00 -0.68 -0.28 0.00 -1.03 0.00 0.00 55.69 53.70 1s3s s MET 388 Cb 0.10 -2.63 0.03 0.00 -1.53 0.00 0.00 34.83 30.80 1s3s s MET 388 CO 0.61 0.60 1.29 0.21 -2.03 0.00 0.00 175.02 175.69 1s3s s LYS 389 N -1.81 3.31 0.05 3.16 2.20 -1.26 -4.93 119.74 120.46 1s3s s LYS 389 Ca 0.22 0.07 -0.29 0.00 -0.36 0.00 0.00 55.97 55.60 1s3s s LYS 389 Cb -0.12 -4.12 -0.05 0.00 -1.51 0.00 0.00 37.83 32.04 1s3s s LYS 389 CO 0.13 -1.97 0.94 -0.51 -0.36 0.00 0.00 175.35 173.58 1s3s s LEU 390 N 5.61 4.43 0.36 5.43 1.43 -1.26 -1.91 118.68 132.77 1s3s s LEU 390 Ca 0.41 1.67 -0.27 0.00 -1.03 0.00 0.00 54.13 54.92 1s3s s LEU 390 Cb -0.08 -3.52 -0.09 0.00 0.03 0.00 0.00 46.19 42.53 1s3s s LEU 390 CO 0.20 -0.14 1.15 0.00 0.23 0.00 0.00 176.35 177.80 1s3s s ALA 391 N 0.44 3.25 0.47 4.21 0.00 -0.43 -4.89 121.76 124.81 1s3s s ALA 391 Ca 0.48 0.95 0.35 0.00 0.00 0.00 0.00 51.96 53.74 1s3s s ALA 391 Cb -0.22 -3.37 1.51 0.00 0.00 0.00 0.00 23.12 21.04 1s3s s ALA 391 CO 0.28 -0.41 1.62 -0.44 0.00 0.00 0.00 175.76 176.81 1s3s h ASP 392 N 3.02 0.17 0.75 0.00 3.32 -1.95 1.44 116.42 123.17 1s3s h ASP 392 Ca -0.48 0.10 0.00 0.00 0.02 0.00 0.00 57.03 56.67 1s3s h ASP 392 Cb 1.23 0.09 0.00 0.00 0.22 0.00 0.00 39.33 40.87 1s3s h ASP 392 CO 0.64 -0.14 0.00 -0.90 -1.72 0.00 0.00 179.24 177.12 1s3s n ASP 393 N -4.50 0.06 -4.72 6.45 5.75 -1.26 -4.75 116.55 113.58 1s3s n ASP 393 Ca 0.38 0.51 -0.42 0.00 -0.01 0.00 0.00 54.79 55.25 1s3s n ASP 393 Cb 1.56 -0.52 -0.03 0.00 -1.03 0.00 0.00 41.12 41.09 1s3s n ASP 393 CO 0.00 0.00 0.00 -0.69 -0.11 0.00 0.00 177.20 176.40 1s3s s VAL 394 N -3.02 3.17 -0.54 2.12 1.01 0.49 -4.42 120.40 119.21 1s3s s VAL 394 Ca 0.10 0.86 0.04 0.00 0.00 0.00 0.00 61.98 62.98 1s3s s VAL 394 Cb 0.14 -3.55 0.16 0.00 0.00 0.00 0.00 36.38 33.13 1s3s s VAL 394 CO 0.39 0.08 0.39 -0.62 0.00 0.00 0.00 175.10 175.34 1s3s s ASP 395 N 0.99 3.24 0.37 3.32 -1.08 -1.26 -4.96 116.67 117.28 1s3s s ASP 395 Ca 0.64 -3.33 0.13 0.00 -0.52 0.00 0.00 52.55 49.46 1s3s s ASP 395 Cb -0.38 -1.04 0.93 0.00 -1.46 0.00 0.00 42.92 40.97 1s3s s ASP 395 CO 0.32 -0.15 1.81 -0.07 0.52 0.00 0.00 175.17 177.60 1s3s h LEU 396 N 5.71 0.58 -1.39 -1.34 3.38 -1.99 0.18 115.31 120.46 1s3s h LEU 396 Ca 0.17 0.07 -0.02 0.00 0.09 0.00 0.00 57.88 58.19 1s3s h LEU 396 Cb 0.85 -0.04 -0.02 0.00 0.09 0.00 0.00 40.66 41.54 1s3s h LEU 396 CO 0.54 0.21 0.20 -0.08 0.09 0.00 0.00 178.44 179.40 1s3s h GLU 397 N 0.57 0.62 0.79 1.13 4.81 -1.94 0.13 114.58 120.68 1s3s h GLU 397 Ca 0.53 -0.07 -0.04 0.00 -0.13 0.00 0.00 59.36 59.65 1s3s h GLU 397 Cb 1.08 -0.12 0.01 0.00 0.63 0.00 0.00 28.75 30.35 1s3s h GLU 397 CO -0.28 0.49 -0.38 0.37 -0.73 0.00 0.00 179.01 178.49 1s3s h GLN 398 N 0.62 -1.02 -0.72 1.92 5.75 -1.08 -1.79 115.11 118.79 1s3s h GLN 398 Ca 0.16 0.07 0.14 0.00 -0.15 0.00 0.00 58.65 58.87 1s3s h GLN 398 Cb 0.08 0.23 -0.14 0.00 1.07 0.00 0.00 27.48 28.73 1s3s h GLN 398 CO -0.02 -0.68 -0.19 0.28 -2.65 0.00 0.00 178.83 175.57 1s3s h VAL 399 N -1.21 0.26 -0.54 2.39 2.07 -1.00 0.35 116.25 118.58 1s3s h VAL 399 Ca -0.11 0.00 0.10 0.00 0.82 0.00 0.00 66.70 67.51 1s3s h VAL 399 Cb 0.81 0.26 -0.03 0.00 -1.52 0.00 0.00 31.29 30.81 1s3s h VAL 399 CO 0.18 0.00 0.37 0.00 0.02 0.00 0.00 177.57 178.13 1s3s h ALA 400 N 1.67 2.12 0.00 1.67 0.00 -0.62 -2.03 119.26 122.07 1s3s h ALA 400 Ca 0.34 -0.01 -0.12 0.00 0.00 0.00 0.00 54.91 55.12 1s3s h ALA 400 Cb 0.53 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.26 1s3s h ALA 400 CO -0.75 -0.24 -0.57 -0.91 0.00 0.00 0.00 179.25 176.78 1s3s h ASN 401 N 0.29 0.00 -1.43 0.00 2.35 0.59 -3.24 115.58 114.15 1s3s h ASN 401 Ca 0.25 0.00 -0.69 0.00 -0.55 0.00 0.00 56.30 55.31 1s3s h ASN 401 Cb 0.60 0.00 -0.31 0.00 0.05 0.00 0.00 38.32 38.66 1s3s h ASN 401 CO -0.06 0.57 0.61 -0.62 -1.65 0.00 0.00 177.43 176.28 1s3s n GLU 402 N -3.41 2.89 0.00 0.81 1.02 -0.77 -4.33 120.64 116.85 1s3s n GLU 402 Ca 0.01 -3.60 0.00 0.00 -0.02 0.00 0.00 57.16 53.54 1s3s n GLU 402 Cb 0.69 -2.28 0.00 0.00 -0.02 0.00 0.00 31.44 29.83 1s3s n GLU 402 CO 0.00 0.00 0.00 2.41 1.18 0.00 0.00 177.13 180.72 1s3s n THR 403 N -0.70 0.00 0.00 2.62 -1.04 -1.21 -5.00 114.28 108.95 1s3s n THR 403 Ca 0.55 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.56 1s3s n THR 403 Cb 0.52 0.15 0.00 0.00 -1.82 0.00 0.00 70.33 69.18 1s3s n THR 403 CO 0.00 0.00 0.00 1.41 -0.64 0.00 0.00 175.07 175.84 1s3s n HIS 404 N -0.69 0.00 0.38 -1.42 8.25 -1.26 -0.18 115.22 120.30 1s3s n HIS 404 Ca 0.00 0.00 0.05 0.00 -0.26 0.00 0.00 57.72 57.51 1s3s n HIS 404 Cb 0.02 0.00 0.22 0.00 1.12 0.00 0.00 29.99 31.35 1s3s n HIS 404 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1s3s n GLY 405 N 0.00 -0.76 3.74 -1.41 0.00 -1.26 -4.84 105.19 100.66 1s3s n GLY 405 Ca 0.00 -0.04 -0.36 0.00 0.00 0.00 0.00 46.02 45.62 1s3s n GLY 405 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1s3s s HIS 406 N -2.86 2.22 0.45 1.61 4.02 0.75 -4.97 115.29 116.51 1s3s s HIS 406 Ca 0.06 1.52 0.07 0.00 1.02 0.00 0.00 55.06 57.73 1s3s s HIS 406 Cb 0.06 -3.56 -0.02 0.00 -1.02 0.00 0.00 32.58 28.05 1s3s s HIS 406 CO 0.17 -2.55 0.30 0.14 1.02 0.00 0.00 174.74 173.82 1s3s s VAL 407 N -1.58 2.21 0.40 -0.90 -7.23 -1.26 -4.46 120.40 107.58 1s3s s VAL 407 Ca 0.79 -1.53 0.14 0.00 -1.81 0.00 0.00 61.98 59.57 1s3s s VAL 407 Cb -0.33 -2.75 0.35 0.00 0.56 0.00 0.00 36.38 34.22 1s3s s VAL 407 CO 0.38 0.00 1.89 1.23 -0.31 0.00 0.00 175.10 178.28 1s3s h GLY 408 N 1.11 0.90 0.73 2.32 0.00 -1.86 -0.89 103.07 105.38 1s3s h GLY 408 Ca -0.41 -0.22 0.04 0.00 0.00 0.00 0.00 47.33 46.75 1s3s h GLY 408 CO 0.63 0.05 0.25 0.00 0.00 0.00 0.00 176.54 177.47 1s3s h ALA 409 N 1.62 0.63 0.52 3.60 0.00 -1.41 0.49 119.26 124.71 1s3s h ALA 409 Ca 0.42 0.02 -0.03 0.00 0.00 0.00 0.00 54.91 55.33 1s3s h ALA 409 Cb 0.90 -0.07 0.01 0.00 0.00 0.00 0.00 17.79 18.62 1s3s h ALA 409 CO -0.16 -0.10 -0.25 -0.44 0.00 0.00 0.00 179.25 178.30 1s3s h ASP 410 N 0.49 -0.59 -0.76 0.00 3.32 -1.46 -1.29 116.42 116.12 1s3s h ASP 410 Ca 0.22 -0.03 0.05 0.00 0.02 0.00 0.00 57.03 57.29 1s3s h ASP 410 Cb 0.13 0.15 -0.05 0.00 0.22 0.00 0.00 39.33 39.78 1s3s h ASP 410 CO -0.15 -0.34 0.47 -0.07 -1.72 0.00 0.00 179.24 177.42 1s3s h LEU 411 N -0.81 0.74 -1.52 1.55 3.38 -1.24 0.76 115.31 118.18 1s3s h LEU 411 Ca -0.07 0.01 0.07 0.00 0.09 0.00 0.00 57.88 57.98 1s3s h LEU 411 Cb 0.58 -0.14 -0.04 0.00 0.09 0.00 0.00 40.66 41.15 1s3s h LEU 411 CO 0.12 0.49 0.42 0.00 0.09 0.00 0.00 178.44 179.56 1s3s h ALA 412 N 1.35 1.84 0.16 1.53 0.00 0.17 -1.86 119.26 122.47 1s3s h ALA 412 Ca 0.32 -0.02 -0.25 0.00 0.00 0.00 0.00 54.91 54.96 1s3s h ALA 412 Cb 0.11 -0.14 0.02 0.00 0.00 0.00 0.00 17.79 17.78 1s3s h ALA 412 CO -0.15 0.04 -1.18 0.00 0.00 0.00 0.00 179.25 177.96 1s3s h ALA 413 N 1.67 -0.02 -0.97 0.00 0.00 0.19 -3.27 119.26 116.86 1s3s h ALA 413 Ca 0.28 -0.86 0.16 0.00 0.00 0.00 0.00 54.91 54.49 1s3s h ALA 413 Cb 0.35 0.24 -0.10 0.00 0.00 0.00 0.00 17.79 18.28 1s3s h ALA 413 CO -0.09 0.61 0.57 1.25 0.00 0.00 0.00 179.25 181.59 1s3s h LEU 414 N -0.21 0.76 -0.23 0.00 5.85 0.90 0.16 115.31 122.54 1s3s h LEU 414 Ca -0.22 0.08 -0.02 0.00 0.84 0.00 0.00 57.88 58.56 1s3s h LEU 414 Cb 1.82 -0.05 -0.01 0.00 0.37 0.00 0.00 40.66 42.79 1s3s h LEU 414 CO 0.16 0.31 0.07 0.00 -0.34 0.00 0.00 178.44 178.64 1s3s h SER 416 N 0.19 0.00 0.42 0.00 0.02 -1.05 0.14 113.55 113.27 1s3s h SER 416 Ca 0.07 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.02 1s3s h SER 416 Cb 0.24 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.78 1s3s h SER 416 CO -0.00 0.13 -0.08 -0.62 -1.14 0.00 0.00 176.83 175.12 1s3s n GLU 417 N -4.34 0.61 -0.07 3.45 -0.58 0.36 -1.54 120.64 118.53 1s3s n GLU 417 Ca -0.03 -0.15 -0.08 0.00 -0.42 0.00 0.00 57.16 56.49 1s3s n GLU 417 Cb 0.20 -1.50 -0.11 0.00 -0.57 0.00 0.00 31.44 29.46 1s3s n GLU 417 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1s3s n ALA 418 N -1.07 1.64 0.09 0.62 0.00 -0.62 -3.86 120.51 117.32 1s3s n ALA 418 Ca 0.15 -0.94 -0.02 0.00 0.00 0.00 0.00 53.44 52.63 1s3s n ALA 418 Cb 0.26 -0.05 0.24 0.00 0.00 0.00 0.00 19.45 19.91 1s3s n ALA 418 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1s3s h ALA 419 N 0.65 1.15 0.13 0.00 0.00 -0.69 -2.37 119.26 118.14 1s3s h ALA 419 Ca -0.40 -0.39 -0.28 0.00 0.00 0.00 0.00 54.91 53.85 1s3s h ALA 419 Cb 1.87 -0.09 0.01 0.00 0.00 0.00 0.00 17.79 19.58 1s3s h ALA 419 CO 0.01 0.56 -1.24 -0.07 0.00 0.00 0.00 179.25 178.52 1s3s h LEU 420 N 0.21 0.48 -0.91 0.00 3.38 -1.47 -2.87 115.31 114.13 1s3s h LEU 420 Ca 0.02 -0.50 -0.01 0.00 0.09 0.00 0.00 57.88 57.48 1s3s h LEU 420 Cb 0.76 -0.16 -0.04 0.00 0.09 0.00 0.00 40.66 41.31 1s3s h LEU 420 CO 0.06 1.38 0.53 -0.61 0.09 0.00 0.00 178.44 179.89 1s3s h GLN 421 N 0.10 1.25 -0.42 1.13 5.75 -1.62 0.24 115.11 121.54 1s3s h GLN 421 Ca -0.14 -0.13 -0.12 0.00 -0.15 0.00 0.00 58.65 58.11 1s3s h GLN 421 Cb 1.96 -0.26 -0.01 0.00 1.07 0.00 0.00 27.48 30.24 1s3s h GLN 421 CO 0.21 0.89 -0.22 0.00 -2.65 0.00 0.00 178.83 177.06 1s3s h ALA 422 N 1.29 0.81 -0.33 3.38 0.00 -1.48 -0.61 119.26 122.32 1s3s h ALA 422 Ca 0.32 -0.38 -0.07 0.00 0.00 0.00 0.00 54.91 54.78 1s3s h ALA 422 Cb -0.02 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.60 1s3s h ALA 422 CO -0.06 0.65 -0.08 0.82 0.00 0.00 0.00 179.25 180.58 1s3s h ILE 423 N 0.74 1.28 -0.37 0.00 1.08 -1.08 -0.11 117.51 119.04 1s3s h ILE 423 Ca 0.10 -1.14 -0.03 0.00 -0.39 0.00 0.00 64.86 63.40 1s3s h ILE 423 Cb 0.76 1.33 -0.02 0.00 -3.07 0.00 0.00 36.82 35.82 1s3s h ILE 423 CO 0.06 0.37 0.10 0.03 -0.69 0.00 0.00 178.15 178.02 1s3s h ARG 424 N 0.43 0.58 0.35 2.37 3.08 -0.47 -3.06 114.38 117.65 1s3s h ARG 424 Ca 0.08 -0.13 -0.02 0.00 0.07 0.00 0.00 59.98 59.98 1s3s h ARG 424 Cb 0.58 -0.08 0.00 0.00 0.08 0.00 0.00 29.97 30.56 1s3s h ARG 424 CO 0.03 0.61 -0.17 0.87 -1.07 0.00 0.00 179.97 180.24 1s3s h LYS 425 N 0.44 -0.45 0.00 0.04 1.57 -1.03 -3.29 116.57 113.85 1s3s h LYS 425 Ca 0.12 0.03 0.00 0.00 -1.87 0.00 0.00 60.65 58.93 1s3s h LYS 425 Cb 0.28 0.10 0.00 0.00 0.08 0.00 0.00 32.23 32.69 1s3s h LYS 425 CO -0.00 -0.26 0.00 1.17 -0.57 0.00 0.00 179.45 179.79 1s3s n LYS 426 N -5.26 0.74 -0.09 3.15 3.00 -0.06 -4.11 118.16 115.52 1s3s n LYS 426 Ca -0.10 0.00 0.07 0.00 -0.00 0.00 0.00 58.31 58.28 1s3s n LYS 426 Cb 0.22 0.00 0.11 0.00 0.00 0.00 0.00 35.03 35.36 1s3s n LYS 426 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 177.40 177.28 1s3s n MET 427 N 0.00 0.00 0.26 1.64 1.56 -1.24 -0.73 117.12 118.62 1s3s n MET 427 Ca 0.00 0.17 0.11 0.00 -0.27 0.00 0.00 57.70 57.71 1s3s n MET 427 Cb 0.00 -0.41 0.71 0.00 2.15 0.00 0.00 33.22 35.67 1s3s n MET 427 CO 0.00 0.00 0.00 -0.44 -0.73 0.00 0.00 175.97 174.80 1s3s h ASP 428 N 0.00 0.00 0.17 6.12 5.19 -1.60 0.45 116.42 126.75 1s3s h ASP 428 Ca 0.13 0.00 -0.35 0.00 -0.62 0.00 0.00 57.03 56.19 1s3s h ASP 428 Cb 0.57 0.00 -0.06 0.00 0.18 0.00 0.00 39.33 40.02 1s3s h ASP 428 CO -0.00 0.07 -2.15 0.18 -3.12 0.00 0.00 179.24 174.22 1s3s n LEU 429 N -4.06 0.76 0.00 1.55 4.77 0.09 -3.97 117.00 116.15 1s3s n LEU 429 Ca -0.03 0.13 0.13 0.00 -0.03 0.00 0.00 56.01 56.22 1s3s n LEU 429 Cb 0.16 0.14 0.73 0.00 -2.33 0.00 0.00 43.42 42.12 1s3s n LEU 429 CO 0.32 0.53 0.95 -0.38 -1.33 0.00 0.00 177.39 177.48 1s3s n ILE 430 N -2.95 0.07 -0.03 -0.08 5.41 -0.89 -5.00 119.36 115.90 1s3s n ILE 430 Ca -0.29 0.02 0.00 0.00 1.00 0.00 0.00 62.75 63.48 1s3s n ILE 430 Cb 1.10 -0.60 -0.00 0.00 -0.71 0.00 0.00 39.64 39.43 1s3s n ILE 430 CO 0.00 0.00 0.00 0.47 0.00 0.00 0.00 176.55 177.02 1s3s n ASP 431 N -1.11 -0.20 -4.17 4.38 9.92 0.15 -4.77 116.55 120.75 1s3s n ASP 431 Ca 0.17 0.02 -0.39 0.00 -0.53 0.00 0.00 54.79 54.06 1s3s n ASP 431 Cb 0.13 -0.10 -0.10 0.00 -0.64 0.00 0.00 41.12 40.41 1s3s n ASP 431 CO 0.00 0.00 0.00 -0.76 0.13 0.00 0.00 177.20 176.57 1s3s s LEU 432 N -3.84 5.53 0.33 0.64 1.43 -1.26 -4.52 118.68 116.98 1s3s s LEU 432 Ca 0.00 -2.05 0.11 0.00 -1.03 0.00 0.00 54.13 51.16 1s3s s LEU 432 Cb 0.00 -1.94 0.98 0.00 0.03 0.00 0.00 46.19 45.26 1s3s s LEU 432 CO 0.00 -0.61 1.65 -0.08 0.23 0.00 0.00 176.35 177.54 1s3s h GLU 433 N 8.18 0.24 -3.77 1.70 4.81 -1.92 -3.44 114.58 120.39 1s3s h GLU 433 Ca -0.16 -0.01 -0.08 0.00 -0.13 0.00 0.00 59.36 58.97 1s3s h GLU 433 Cb 1.05 -0.05 -0.13 0.00 0.63 0.00 0.00 28.75 30.24 1s3s h GLU 433 CO 0.79 0.16 -0.31 -0.51 -0.73 0.00 0.00 179.01 178.41 1s3s s ASP 434 N -4.93 0.05 0.28 1.04 1.01 -1.26 -5.09 116.67 107.77 1s3s s ASP 434 Ca -0.11 -0.66 0.02 0.00 0.71 0.00 0.00 52.55 52.51 1s3s s ASP 434 Cb 0.29 0.38 0.64 0.00 1.01 0.00 0.00 42.92 45.24 1s3s s ASP 434 CO 0.78 -0.79 1.74 -0.33 0.21 0.00 0.00 175.17 176.78 1s3s h GLU 435 N 2.64 0.54 -4.36 8.23 5.08 -2.03 -3.37 114.58 121.31 1s3s h GLU 435 Ca -0.33 -0.03 -0.57 0.00 -1.00 0.00 0.00 59.36 57.43 1s3s h GLU 435 Cb 1.21 -0.12 -0.37 0.00 0.50 0.00 0.00 28.75 29.97 1s3s h GLU 435 CO 0.53 0.36 -0.81 0.99 -1.00 0.00 0.00 179.01 179.08 1s3s s THR 436 N -5.92 1.27 0.17 1.13 2.01 -1.26 -5.10 115.64 107.93 1s3s s THR 436 Ca -0.12 -0.57 -0.33 0.00 0.31 0.00 0.00 61.69 60.99 1s3s s THR 436 Cb 0.23 -1.31 -0.16 0.00 0.01 0.00 0.00 72.50 71.27 1s3s s THR 436 CO 0.78 0.30 1.09 -0.38 -0.69 0.00 0.00 174.62 175.71 1s3s n ILE 437 N 4.85 0.99 -2.23 1.82 -0.00 -1.26 -4.69 119.36 118.84 1s3s n ILE 437 Ca -0.14 -0.25 -0.29 0.00 -0.00 0.00 0.00 62.75 62.08 1s3s n ILE 437 Cb 0.49 -0.70 0.01 0.00 -0.00 0.00 0.00 39.64 39.44 1s3s n ILE 437 CO 0.00 0.00 0.00 -1.81 -0.00 0.00 0.00 176.55 174.74 1s3s s ASP 438 N -0.13 6.10 -0.01 4.38 1.01 -1.26 -2.96 116.67 123.80 1s3s s ASP 438 Ca 0.73 1.12 -0.23 0.00 0.71 0.00 0.00 52.55 54.88 1s3s s ASP 438 Cb -0.89 -2.25 -0.14 0.00 1.01 0.00 0.00 42.92 40.65 1s3s s ASP 438 CO 0.53 -0.82 1.03 0.00 0.21 0.00 0.00 175.17 176.12 1s3s h ALA 439 N -0.12 -0.61 -0.81 5.23 0.00 -0.19 -3.34 119.26 119.42 1s3s h ALA 439 Ca -0.45 -0.18 0.07 0.00 0.00 0.00 0.00 54.91 54.35 1s3s h ALA 439 Cb 1.21 0.23 -0.10 0.00 0.00 0.00 0.00 17.79 19.14 1s3s h ALA 439 CO 0.62 -0.63 -0.48 0.39 0.00 0.00 0.00 179.25 179.15 1s3s n GLU 440 N -5.21 -0.36 -0.16 0.00 4.71 -1.26 -1.92 120.64 116.44 1s3s n GLU 440 Ca -0.10 1.26 -0.10 0.00 -0.01 0.00 0.00 57.16 58.21 1s3s n GLU 440 Cb 0.29 -1.85 -0.08 0.00 -1.01 0.00 0.00 31.44 28.80 1s3s n GLU 440 CO 0.00 0.00 0.00 -0.39 0.09 0.00 0.00 177.13 176.83 1s3s h VAL 441 N 0.00 0.00 -0.44 2.62 -1.51 -1.96 -2.11 116.25 112.85 1s3s h VAL 441 Ca 0.13 0.00 0.09 0.00 -1.23 0.00 0.00 66.70 65.69 1s3s h VAL 441 Cb 0.33 0.00 -0.08 0.00 -2.13 0.00 0.00 31.29 29.41 1s3s h VAL 441 CO -0.76 0.00 -0.10 0.24 -1.23 0.00 0.00 177.57 175.72 1s3s h MET 442 N -0.22 0.01 -0.54 5.19 2.86 -1.50 -2.11 114.93 118.61 1s3s h MET 442 Ca 0.07 -0.00 0.08 0.00 -2.06 0.00 0.00 59.70 57.79 1s3s h MET 442 Cb 0.42 -0.00 -0.06 0.00 0.06 0.00 0.00 31.60 32.01 1s3s h MET 442 CO -0.53 0.00 0.18 -0.97 1.06 0.00 0.00 176.91 176.66 1s3s h ASN 443 N 0.01 0.16 -0.50 1.22 -0.73 -1.01 -1.59 115.58 113.14 1s3s h ASN 443 Ca 0.21 0.07 -0.00 0.00 1.87 0.00 0.00 56.30 58.45 1s3s h ASN 443 Cb 0.32 0.06 -0.03 0.00 0.27 0.00 0.00 38.32 38.95 1s3s h ASN 443 CO -0.44 0.11 0.30 0.28 -0.37 0.00 0.00 177.43 177.31 1s3s h SER 444 N 0.35 0.62 -2.73 1.15 0.02 -0.74 -3.42 113.55 108.80 1s3s h SER 444 Ca 0.27 -0.03 -0.56 0.00 -0.84 0.00 0.00 61.79 60.62 1s3s h SER 444 Cb 0.31 -0.16 -0.02 0.00 0.14 0.00 0.00 62.40 62.68 1s3s h SER 444 CO -0.28 0.49 1.11 -0.22 -1.14 0.00 0.00 176.83 176.78 1s3s s LEU 445 N -9.55 4.00 -0.07 5.07 2.96 -0.60 -5.01 118.68 115.49 1s3s s LEU 445 Ca -0.09 1.76 0.04 0.00 -0.22 0.00 0.00 54.13 55.62 1s3s s LEU 445 Cb 0.17 -3.53 -0.02 0.00 0.50 0.00 0.00 46.19 43.31 1s3s s LEU 445 CO 0.76 -1.16 -0.18 0.00 -1.32 0.00 0.00 176.35 174.45 1s3s s ALA 446 N 4.86 2.48 -0.20 5.97 0.00 -1.26 -4.54 121.76 129.08 1s3s s ALA 446 Ca 0.71 -0.98 -0.29 0.00 0.00 0.00 0.00 51.96 51.40 1s3s s ALA 446 Cb -0.27 -0.92 0.00 0.00 0.00 0.00 0.00 23.12 21.93 1s3s s ALA 446 CO 0.28 0.44 1.05 0.08 0.00 0.00 0.00 175.76 177.60 1s3s s VAL 447 N -0.28 4.68 0.35 0.00 1.01 -0.80 -4.79 120.40 120.56 1s3s s VAL 447 Ca 0.01 2.00 -0.08 0.00 0.00 0.00 0.00 61.98 63.91 1s3s s VAL 447 Cb -0.13 -4.29 -0.06 0.00 0.00 0.00 0.00 36.38 31.90 1s3s s VAL 447 CO 0.03 -0.13 0.67 0.42 0.00 0.00 0.00 175.10 176.09 1s3s s THR 448 N 2.93 4.88 0.10 3.92 -4.23 -1.26 -1.32 115.64 120.66 1s3s s THR 448 Ca 0.46 0.39 0.17 0.00 -1.18 0.00 0.00 61.69 61.53 1s3s s THR 448 Cb -0.16 -3.73 0.17 0.00 1.34 0.00 0.00 72.50 70.12 1s3s s THR 448 CO 0.09 -0.42 1.44 -0.03 -0.54 0.00 0.00 174.62 175.17 1s3s h MET 449 N 1.50 0.00 -0.34 3.99 1.85 -1.83 0.30 114.93 120.39 1s3s h MET 449 Ca -0.47 0.00 -0.15 0.00 -0.61 0.00 0.00 59.70 58.46 1s3s h MET 449 Cb 1.19 0.00 -0.01 0.00 0.43 0.00 0.00 31.60 33.21 1s3s h MET 449 CO 0.65 0.00 -0.40 -0.44 -0.40 0.00 0.00 176.91 176.32 1s3s h ASP 450 N 0.00 0.88 0.22 1.39 3.32 -1.91 -2.80 116.42 117.52 1s3s h ASP 450 Ca 0.00 -0.41 -0.09 0.00 0.02 0.00 0.00 57.03 56.55 1s3s h ASP 450 Cb 0.55 -0.25 -0.01 0.00 0.22 0.00 0.00 39.33 39.84 1s3s h ASP 450 CO 0.00 1.17 -0.35 0.44 -1.72 0.00 0.00 179.24 178.78 1s3s h ASP 451 N 0.67 0.20 -0.15 6.45 3.32 -0.73 -2.64 116.42 123.54 1s3s h ASP 451 Ca 0.05 -0.07 -0.12 0.00 0.02 0.00 0.00 57.03 56.91 1s3s h ASP 451 Cb 0.97 -0.05 0.00 0.00 0.22 0.00 0.00 39.33 40.47 1s3s h ASP 451 CO 0.09 0.54 -0.36 -0.26 -1.72 0.00 0.00 179.24 177.53 1s3s h PHE 452 N 0.17 0.65 -0.71 4.55 -1.00 -1.56 -1.84 116.94 117.20 1s3s h PHE 452 Ca 0.02 -0.25 0.07 0.00 2.81 0.00 0.00 57.97 60.62 1s3s h PHE 452 Cb 0.70 -0.12 -0.04 0.00 3.61 0.00 0.00 35.95 40.10 1s3s h PHE 452 CO 0.01 0.98 0.47 -0.09 -1.61 0.00 0.00 178.31 178.07 1s3s h ARG 453 N 0.13 0.69 0.59 1.51 9.65 -1.45 0.84 114.38 126.34 1s3s h ARG 453 Ca -0.00 -0.04 -0.03 0.00 -1.10 0.00 0.00 59.98 58.81 1s3s h ARG 453 Cb 0.97 -0.16 0.01 0.00 -1.39 0.00 0.00 29.97 29.40 1s3s h ARG 453 CO 0.08 0.46 -0.28 2.35 2.80 0.00 0.00 179.97 185.37 1s3s h TRP 454 N 0.71 -0.73 -0.39 2.20 7.01 -1.24 -2.24 115.95 121.28 1s3s h TRP 454 Ca 0.31 -0.02 0.11 0.00 2.11 0.00 0.00 58.89 61.41 1s3s h TRP 454 Cb 0.30 0.24 -0.02 0.00 -2.10 0.00 0.00 29.16 27.58 1s3s h TRP 454 CO -0.00 -0.45 0.35 0.00 -2.79 0.00 0.00 178.44 175.54 1s3s h ALA 455 N -1.46 2.19 -0.00 2.65 0.00 -1.10 0.24 119.26 121.77 1s3s h ALA 455 Ca -0.08 -0.01 -0.11 0.00 0.00 0.00 0.00 54.91 54.70 1s3s h ALA 455 Cb 0.60 0.03 -0.02 0.00 0.00 0.00 0.00 17.79 18.41 1s3s h ALA 455 CO 0.13 -0.55 -0.54 -0.07 0.00 0.00 0.00 179.25 178.22 1s3s h LEU 456 N 0.00 0.01 -1.78 0.00 3.38 -0.68 -2.47 115.31 113.77 1s3s h LEU 456 Ca 0.19 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.15 1s3s h LEU 456 Cb 0.88 -0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.62 1s3s h LEU 456 CO -0.00 0.55 0.00 -1.20 0.09 0.00 0.00 178.44 177.88 1s3s n SER 457 N -3.90 2.59 -0.85 -0.43 7.64 0.82 -5.08 113.62 114.42 1s3s n SER 457 Ca -0.01 -2.26 0.11 0.00 1.01 0.00 0.00 58.87 57.71 1s3s n SER 457 Cb 0.55 -0.45 0.09 0.00 -1.01 0.00 0.00 64.21 63.39 1s3s n SER 457 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03