#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2r4r s VAL 2 N 0.00 1.79 -0.26 2.62 1.01 -1.26 -4.40 120.40 119.89 2r4r s VAL 2 Ca 0.00 -0.94 -0.27 0.00 0.00 0.00 0.00 61.98 60.77 2r4r s VAL 2 Cb 0.00 -1.51 0.17 0.00 0.00 0.00 0.00 36.38 35.03 2r4r s VAL 2 CO 0.00 0.51 1.25 0.00 0.00 0.00 0.00 175.10 176.86 2r4r s GLN 3 N -0.22 0.25 -0.30 2.72 -2.07 -1.23 -4.98 119.66 113.84 2r4r s GLN 3 Ca 0.00 0.17 -0.01 0.00 -1.82 0.00 0.00 55.36 53.70 2r4r s GLN 3 Cb -0.12 0.12 0.05 0.00 -1.09 0.00 0.00 33.01 31.98 2r4r s GLN 3 CO 0.02 -0.06 -0.01 -0.51 -1.32 0.00 0.00 175.29 173.41 2r4r s LEU 4 N -0.47 3.89 0.34 2.60 1.02 -1.26 0.57 118.68 125.38 2r4r s LEU 4 Ca 0.05 -1.34 -0.26 0.00 0.02 0.00 0.00 54.13 52.60 2r4r s LEU 4 Cb -0.03 -1.69 -0.09 0.00 0.02 0.00 0.00 46.19 44.40 2r4r s LEU 4 CO -0.08 -0.26 1.02 -1.10 0.02 0.00 0.00 176.35 175.95 2r4r s GLN 5 N 1.22 4.44 0.07 1.70 -0.21 0.20 -3.60 119.66 123.48 2r4r s GLN 5 Ca -0.05 1.51 -0.01 0.00 0.02 0.00 0.00 55.36 56.83 2r4r s GLN 5 Cb -0.20 -2.80 -0.04 0.00 1.00 0.00 0.00 33.01 30.97 2r4r s GLN 5 CO -0.02 0.10 -0.00 -0.65 -2.12 0.00 0.00 175.29 172.60 2r4r s GLN 6 N -2.06 0.70 0.33 2.91 -0.21 -1.26 -0.71 119.66 119.36 2r4r s GLN 6 Ca 0.52 -1.28 0.04 0.00 0.02 0.00 0.00 55.36 54.66 2r4r s GLN 6 Cb -0.23 0.22 0.60 0.00 1.00 0.00 0.00 33.01 34.60 2r4r s GLN 6 CO 0.29 -0.16 1.87 0.77 -2.12 0.00 0.00 175.29 175.95 2r4r h SER 7 N 3.06 0.48 0.00 5.90 0.02 -1.78 -3.46 113.55 117.78 2r4r h SER 7 Ca -0.34 -0.09 0.00 0.00 -0.84 0.00 0.00 61.79 60.51 2r4r h SER 7 Cb 1.16 -0.13 0.00 0.00 0.14 0.00 0.00 62.40 63.57 2r4r h SER 7 CO 0.64 0.57 0.00 0.61 -1.14 0.00 0.00 176.83 177.51 2r4r n GLY 8 N -0.85 1.41 2.91 -3.77 0.00 0.63 -4.86 105.19 100.66 2r4r n GLY 8 Ca 0.01 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.88 2r4r n GLY 8 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2r4r s ALA 9 N 0.00 -0.31 -0.16 4.61 0.00 -1.26 -0.25 121.76 124.39 2r4r s ALA 9 Ca 0.00 0.71 -0.04 0.00 0.00 0.00 0.00 51.96 52.63 2r4r s ALA 9 Cb 0.00 -0.84 0.06 0.00 0.00 0.00 0.00 23.12 22.33 2r4r s ALA 9 CO 0.00 -0.54 0.06 -2.00 0.00 0.00 0.00 175.76 173.28 2r4r s GLU 10 N 2.19 0.30 -0.05 0.00 2.56 -1.18 -4.75 118.70 117.77 2r4r s GLU 10 Ca 0.01 -0.15 -0.11 0.00 0.00 0.00 0.00 54.97 54.71 2r4r s GLU 10 Cb -0.12 -1.76 -0.05 0.00 2.00 0.00 0.00 34.13 34.20 2r4r s GLU 10 CO -0.07 -0.60 0.29 -1.17 -0.56 0.00 0.00 175.26 173.15 2r4r s LEU 11 N 2.03 4.43 -0.17 2.70 1.98 -1.26 0.39 118.68 128.79 2r4r s LEU 11 Ca 0.01 0.75 -0.15 0.00 -2.89 0.00 0.00 54.13 51.85 2r4r s LEU 11 Cb -0.16 -2.36 0.04 0.00 0.66 0.00 0.00 46.19 44.37 2r4r s LEU 11 CO -0.08 0.36 0.44 0.00 -1.89 0.00 0.00 176.35 175.17 2r4r s ALA 12 N -1.02 -1.08 0.42 5.97 0.00 -0.10 -4.93 121.76 121.02 2r4r s ALA 12 Ca 0.20 1.26 -0.23 0.00 0.00 0.00 0.00 51.96 53.18 2r4r s ALA 12 Cb -0.15 -0.73 -0.09 0.00 0.00 0.00 0.00 23.12 22.16 2r4r s ALA 12 CO 0.09 -0.21 1.08 1.03 0.00 0.00 0.00 175.76 177.75 2r4r s ARG 13 N 0.30 4.03 0.25 0.00 0.52 -1.24 0.89 118.95 123.69 2r4r s ARG 13 Ca -0.01 1.56 -0.31 0.00 -0.52 0.00 0.00 55.73 56.46 2r4r s ARG 13 Cb -0.03 -2.46 -0.13 0.00 0.52 0.00 0.00 34.95 32.84 2r4r s ARG 13 CO -0.00 -0.27 1.42 -0.35 0.02 0.00 0.00 175.30 176.11 2r4r n PRO 14 N -0.26 2.09 0.00 3.54 -0.04 -1.25 -1.53 135.00 137.54 2r4r n PRO 14 Ca 0.06 0.74 0.00 0.00 -0.04 0.00 0.00 63.50 64.26 2r4r n PRO 14 Cb 0.49 -2.41 0.00 0.00 -0.04 0.00 0.00 33.50 31.54 2r4r n PRO 14 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2r4r n GLY 15 N 2.13 2.41 0.00 0.55 0.00 0.11 -4.95 105.19 105.44 2r4r n GLY 15 Ca 0.11 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.13 2r4r n GLY 15 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2r4r n ALA 16 N -0.99 0.00 -3.66 4.61 0.00 -0.58 -4.04 120.51 115.85 2r4r n ALA 16 Ca 0.00 0.00 -0.06 0.00 0.00 0.00 0.00 53.44 53.38 2r4r n ALA 16 Cb 0.00 0.00 -0.07 0.00 0.00 0.00 0.00 19.45 19.38 2r4r n ALA 16 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 2r4r s SER 17 N -1.23 -0.80 0.31 0.00 0.15 -1.26 -0.82 113.70 110.04 2r4r s SER 17 Ca 0.00 1.33 0.06 0.00 0.70 0.00 0.00 55.95 58.04 2r4r s SER 17 Cb 0.00 1.57 -0.02 0.00 -1.71 0.00 0.00 66.02 65.86 2r4r s SER 17 CO 0.00 -0.22 0.39 0.68 1.20 0.00 0.00 173.24 175.28 2r4r s VAL 18 N 2.19 4.27 -0.42 4.45 -7.23 -0.93 -4.97 120.40 117.75 2r4r s VAL 18 Ca -0.07 -1.10 0.05 0.00 -1.81 0.00 0.00 61.98 59.05 2r4r s VAL 18 Cb -0.09 -3.47 0.19 0.00 0.56 0.00 0.00 36.38 33.57 2r4r s VAL 18 CO -0.17 -0.22 0.42 1.17 -0.31 0.00 0.00 175.10 175.99 2r4r n LYS 19 N -1.50 0.32 -1.75 4.82 4.81 -1.26 -1.96 118.16 121.64 2r4r n LYS 19 Ca -0.03 -3.04 -0.41 0.00 -0.87 0.00 0.00 58.31 53.96 2r4r n LYS 19 Cb 0.58 -1.57 0.01 0.00 0.02 0.00 0.00 35.03 34.07 2r4r n LYS 19 CO 0.00 0.00 0.00 1.28 1.17 0.00 0.00 177.40 179.85 2r4r n LEU 20 N 2.58 4.67 -4.66 3.14 4.32 -1.12 -4.76 117.00 121.16 2r4r n LEU 20 Ca 0.27 1.16 -0.26 0.00 -0.02 0.00 0.00 56.01 57.16 2r4r n LEU 20 Cb 0.50 -1.58 -0.09 0.00 -1.62 0.00 0.00 43.42 40.63 2r4r n LEU 20 CO 0.09 -0.18 -0.25 -0.94 -1.22 0.00 0.00 177.39 174.89 2r4r s SER 21 N -0.36 4.17 -0.33 -1.43 1.04 -1.26 -1.73 113.70 113.79 2r4r s SER 21 Ca 0.58 -1.13 0.05 0.00 0.48 0.00 0.00 55.95 55.93 2r4r s SER 21 Cb -0.48 -0.47 0.18 0.00 0.10 0.00 0.00 66.02 65.35 2r4r s SER 21 CO 0.60 -0.41 0.53 0.00 0.98 0.00 0.00 173.24 174.94 2r4r s LYS 23 N 2.32 3.49 0.37 0.00 2.20 0.11 -1.83 119.74 126.41 2r4r s LYS 23 Ca 0.12 -1.38 -0.26 0.00 -0.36 0.00 0.00 55.97 54.09 2r4r s LYS 23 Cb -0.10 -4.87 -0.09 0.00 -1.51 0.00 0.00 37.83 31.26 2r4r s LYS 23 CO -0.19 -1.90 1.10 0.00 -0.36 0.00 0.00 175.35 173.99 2r4r s ALA 24 N 3.59 3.17 -0.33 3.13 0.00 -1.10 -0.63 121.76 129.59 2r4r s ALA 24 Ca 0.34 0.82 0.01 0.00 0.00 0.00 0.00 51.96 53.13 2r4r s ALA 24 Cb -0.06 -3.32 0.19 0.00 0.00 0.00 0.00 23.12 19.93 2r4r s ALA 24 CO -0.05 -0.30 0.77 -1.54 0.00 0.00 0.00 175.76 174.64 2r4r s SER 25 N -1.29 -1.15 0.00 0.00 1.04 0.19 -4.67 113.70 107.83 2r4r s SER 25 Ca 0.55 -0.19 0.00 0.00 0.48 0.00 0.00 55.95 56.79 2r4r s SER 25 Cb -0.27 1.60 0.00 0.00 0.10 0.00 0.00 66.02 67.45 2r4r s SER 25 CO 0.34 -0.17 0.00 0.61 0.98 0.00 0.00 173.24 175.00 2r4r n GLY 26 N 4.77 0.00 1.70 7.32 0.00 -1.26 -3.52 105.19 114.20 2r4r n GLY 26 Ca 0.08 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 46.08 2r4r n GLY 26 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 173.32 174.90 2r4r n TYR 27 N 0.00 -1.15 -3.03 1.61 4.11 -1.26 -4.71 117.16 112.73 2r4r n TYR 27 Ca 0.00 -0.65 -0.44 0.00 -0.00 0.00 0.00 57.90 56.81 2r4r n TYR 27 Cb 0.00 0.32 -0.04 0.00 -0.00 0.00 0.00 39.34 39.62 2r4r n TYR 27 CO 0.00 0.00 0.00 0.42 -0.00 0.00 0.00 176.86 177.28 2r4r s ILE 28 N -2.43 4.72 0.06 -3.48 1.01 -1.26 -4.93 121.20 114.89 2r4r s ILE 28 Ca 0.09 -1.01 -0.12 0.00 0.00 0.00 0.00 60.65 59.61 2r4r s ILE 28 Cb -0.02 -4.59 -0.03 0.00 0.01 0.00 0.00 42.46 37.84 2r4r s ILE 28 CO 0.03 -1.27 0.58 0.33 0.00 0.00 0.00 174.94 174.61 2r4r n PHE 29 N 6.59 -0.16 -1.67 3.97 7.35 -1.26 -1.58 117.46 130.69 2r4r n PHE 29 Ca -0.01 0.47 -0.41 0.00 -0.76 0.00 0.00 57.45 56.74 2r4r n PHE 29 Cb 0.45 -0.53 -0.01 0.00 0.35 0.00 0.00 39.48 39.73 2r4r n PHE 29 CO 0.00 0.00 0.00 -2.37 -0.76 0.00 0.00 176.76 173.63 2r4r n THR 30 N -4.47 4.16 -1.41 -2.13 5.66 -1.26 -3.27 114.28 111.57 2r4r n THR 30 Ca 0.01 -3.18 0.00 0.00 -3.05 0.00 0.00 64.05 57.82 2r4r n THR 30 Cb 0.10 -2.51 0.00 0.00 -1.55 0.00 0.00 70.33 66.37 2r4r n THR 30 CO 0.00 0.00 0.00 0.47 -3.05 0.00 0.00 175.07 172.49 2r4r n ASP 31 N 4.20 0.00 -3.71 1.09 9.92 -0.61 -4.75 116.55 122.70 2r4r n ASP 31 Ca 0.63 -0.75 -0.12 0.00 -0.53 0.00 0.00 54.79 54.01 2r4r n ASP 31 Cb 0.30 0.00 -0.10 0.00 -0.64 0.00 0.00 41.12 40.69 2r4r n ASP 31 CO 0.00 0.00 0.00 -0.31 0.13 0.00 0.00 177.20 177.02 2r4r s TYR 32 N 0.00 -0.56 0.97 1.24 2.02 -1.20 -5.10 117.35 114.72 2r4r s TYR 32 Ca 0.00 1.30 -0.15 0.00 -0.37 0.00 0.00 57.07 57.85 2r4r s TYR 32 Cb 0.00 0.22 0.19 0.00 -0.40 0.00 0.00 41.96 41.97 2r4r s TYR 32 CO 0.00 -0.28 1.24 0.71 -1.57 0.00 0.00 175.55 175.65 2r4r s TYR 33 N 0.59 1.74 -0.06 2.71 1.51 -1.26 -4.47 117.35 118.10 2r4r s TYR 33 Ca -0.03 0.49 -0.03 0.00 -1.01 0.00 0.00 57.07 56.49 2r4r s TYR 33 Cb -0.05 -3.81 0.04 0.00 -0.11 0.00 0.00 41.96 38.03 2r4r s TYR 33 CO -0.04 -2.69 0.12 0.96 -1.11 0.00 0.00 175.55 172.79 2r4r s ILE 34 N -3.61 -0.18 0.48 2.71 -4.36 -0.54 -2.91 121.20 112.78 2r4r s ILE 34 Ca 0.70 0.37 0.02 0.00 -0.26 0.00 0.00 60.65 61.48 2r4r s ILE 34 Cb -0.07 -0.23 0.01 0.00 1.25 0.00 0.00 42.46 43.42 2r4r s ILE 34 CO 0.53 0.15 0.69 0.20 0.24 0.00 0.00 174.94 176.75 2r4r s ASN 35 N 2.12 5.61 -0.24 4.36 0.02 -1.06 -2.56 114.94 123.19 2r4r s ASN 35 Ca 0.02 0.08 0.01 0.00 -1.02 0.00 0.00 52.86 51.95 2r4r s ASN 35 Cb -0.12 -1.19 0.06 0.00 0.02 0.00 0.00 41.25 40.03 2r4r s ASN 35 CO -0.05 -0.85 -0.05 0.26 0.02 0.00 0.00 177.10 176.43 2r4r s TRP 36 N -2.59 2.42 -0.17 2.20 0.52 -0.15 -1.73 118.94 119.45 2r4r s TRP 36 Ca 0.52 -1.79 -0.03 0.00 0.02 0.00 0.00 56.10 54.82 2r4r s TRP 36 Cb -0.10 -1.62 -0.02 0.00 -1.15 0.00 0.00 33.47 30.58 2r4r s TRP 36 CO 0.37 -0.78 -0.05 0.08 0.02 0.00 0.00 176.95 176.58 2r4r s VAL 37 N 1.39 3.64 0.06 4.03 1.01 -0.11 -0.16 120.40 130.26 2r4r s VAL 37 Ca -0.05 -0.44 -0.20 0.00 0.00 0.00 0.00 61.98 61.29 2r4r s VAL 37 Cb -0.19 -2.60 -0.06 0.00 0.00 0.00 0.00 36.38 33.53 2r4r s VAL 37 CO -0.07 0.48 0.60 -0.60 0.00 0.00 0.00 175.10 175.51 2r4r s ARG 38 N 0.61 4.28 -0.34 2.72 3.52 -0.48 -0.74 118.95 128.52 2r4r s ARG 38 Ca -0.04 0.78 -0.01 0.00 -0.13 0.00 0.00 55.73 56.34 2r4r s ARG 38 Cb -0.15 -3.28 0.12 0.00 -1.56 0.00 0.00 34.95 30.08 2r4r s ARG 38 CO 0.03 0.54 0.15 -1.14 -0.81 0.00 0.00 175.30 174.07 2r4r s GLN 39 N -0.80 0.72 1.13 5.12 0.74 0.56 -0.66 119.66 126.47 2r4r s GLN 39 Ca 0.30 -1.23 -0.15 0.00 0.05 0.00 0.00 55.36 54.33 2r4r s GLN 39 Cb -0.19 -1.80 0.18 0.00 1.10 0.00 0.00 33.01 32.30 2r4r s GLN 39 CO 0.19 -1.07 0.51 -2.13 -0.55 0.00 0.00 175.29 172.24 2r4r n ARG 40 N 4.48 -1.84 -0.01 1.67 0.63 -1.25 -2.78 116.66 117.56 2r4r n ARG 40 Ca 0.02 -0.51 -0.01 0.00 -0.92 0.00 0.00 57.85 56.43 2r4r n ARG 40 Cb 0.39 -1.94 0.01 0.00 0.45 0.00 0.00 32.46 31.37 2r4r n ARG 40 CO 0.00 0.00 0.00 -2.37 -2.51 0.00 0.00 177.63 172.75 2r4r n THR 41 N -4.60 0.00 -1.37 5.15 5.66 -1.26 -4.28 114.28 113.58 2r4r n THR 41 Ca 0.03 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.03 2r4r n THR 41 Cb 0.58 -0.03 0.00 0.00 -1.55 0.00 0.00 70.33 69.33 2r4r n THR 41 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 2r4r n GLY 42 N -0.16 3.11 3.08 1.09 0.00 -1.26 -4.66 105.19 106.40 2r4r n GLY 42 Ca 0.00 -0.17 -0.09 0.00 0.00 0.00 0.00 46.02 45.77 2r4r n GLY 42 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2r4r s GLN 43 N 0.00 0.59 0.00 1.61 -0.21 -1.26 -5.13 119.66 115.26 2r4r s GLN 43 Ca 0.00 -1.08 0.00 0.00 0.02 0.00 0.00 55.36 54.30 2r4r s GLN 43 Cb 0.00 0.07 0.00 0.00 1.00 0.00 0.00 33.01 34.08 2r4r s GLN 43 CO 0.00 -0.07 0.00 0.41 -2.12 0.00 0.00 175.29 173.51 2r4r n GLY 44 N 0.49 4.55 3.25 3.09 0.00 -1.26 -4.88 105.19 110.43 2r4r n GLY 44 Ca -0.16 -1.13 -0.32 0.00 0.00 0.00 0.00 46.02 44.41 2r4r n GLY 44 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2r4r s PHE 45 N -1.02 2.55 -0.19 1.61 0.08 -1.26 -3.83 117.98 115.92 2r4r s PHE 45 Ca 0.00 -0.90 -0.03 0.00 0.12 0.00 0.00 56.93 56.12 2r4r s PHE 45 Cb 0.00 -1.69 0.06 0.00 -0.57 0.00 0.00 43.02 40.82 2r4r s PHE 45 CO 0.00 -0.33 0.05 -1.83 -0.10 0.00 0.00 175.22 173.01 2r4r s GLU 46 N 0.16 0.52 0.03 0.44 -1.05 0.17 -5.00 118.70 113.97 2r4r s GLU 46 Ca -0.13 -0.35 -0.34 0.00 -0.15 0.00 0.00 54.97 54.00 2r4r s GLU 46 Cb -0.16 -2.06 -0.13 0.00 -0.44 0.00 0.00 34.13 31.34 2r4r s GLU 46 CO 0.07 -0.65 1.74 1.87 0.95 0.00 0.00 175.26 179.24 2r4r n TRP 47 N 5.10 2.31 0.17 4.83 -0.00 -1.26 -1.38 117.44 127.20 2r4r n TRP 47 Ca -0.08 0.11 0.11 0.00 -0.00 0.00 0.00 57.50 57.64 2r4r n TRP 47 Cb 0.48 -2.61 -0.08 0.00 -0.00 0.00 0.00 31.31 29.09 2r4r n TRP 47 CO 0.00 0.00 0.00 -0.89 -0.00 0.00 0.00 177.69 176.80 2r4r n ILE 48 N 4.35 0.23 0.00 5.87 5.41 0.78 -4.75 119.36 131.25 2r4r n ILE 48 Ca 0.20 -0.45 0.00 0.00 1.00 0.00 0.00 62.75 63.50 2r4r n ILE 48 Cb 0.29 -0.03 0.00 0.00 -0.71 0.00 0.00 39.64 39.19 2r4r n ILE 48 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 2r4r n GLY 49 N 1.26 2.69 2.78 7.39 0.00 -1.18 -3.26 105.19 114.86 2r4r n GLY 49 Ca -0.01 -1.28 -0.18 0.00 0.00 0.00 0.00 46.02 44.55 2r4r n GLY 49 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2r4r s GLU 50 N -2.07 0.19 -0.09 1.61 2.12 -0.92 -0.98 118.70 118.57 2r4r s GLU 50 Ca 0.00 0.16 0.04 0.00 0.36 0.00 0.00 54.97 55.53 2r4r s GLU 50 Cb 0.00 -0.49 -0.00 0.00 0.26 0.00 0.00 34.13 33.90 2r4r s GLU 50 CO 0.00 -0.19 -0.23 -1.50 -0.54 0.00 0.00 175.26 172.80 2r4r s ILE 51 N 1.34 1.96 -0.57 -3.70 -1.16 -1.06 -1.58 121.20 116.42 2r4r s ILE 51 Ca -0.05 -0.98 -0.19 0.00 -0.51 0.00 0.00 60.65 58.92 2r4r s ILE 51 Cb -0.13 -1.69 0.09 0.00 0.61 0.00 0.00 42.46 41.34 2r4r s ILE 51 CO -0.03 0.54 0.70 -0.47 -2.81 0.00 0.00 174.94 172.87 2r4r s TYR 52 N 0.24 2.99 0.27 3.50 5.04 -0.43 -1.47 117.35 127.49 2r4r s TYR 52 Ca -0.15 -0.79 -0.01 0.00 -2.44 0.00 0.00 57.07 53.69 2r4r s TYR 52 Cb -0.17 -3.89 0.60 0.00 0.35 0.00 0.00 41.96 38.86 2r4r s TYR 52 CO 0.07 -1.24 1.68 -1.00 -1.34 0.00 0.00 175.55 173.72 2r4r h PRO 53 N 9.16 0.30 -0.38 4.97 0.13 -1.88 -2.49 132.00 141.81 2r4r h PRO 53 Ca -0.29 -0.02 0.05 0.00 -0.87 0.00 0.00 66.00 64.87 2r4r h PRO 53 Cb 1.09 -0.07 -0.04 0.00 0.13 0.00 0.00 31.00 32.11 2r4r h PRO 53 CO 1.06 0.20 0.13 0.78 -0.23 0.00 0.00 178.00 179.94 2r4r h GLY 54 N 0.31 0.48 0.00 1.56 0.00 -1.86 -3.40 103.07 100.16 2r4r h GLY 54 Ca 0.49 -0.07 0.00 0.00 0.00 0.00 0.00 47.33 47.75 2r4r h GLY 54 CO -0.55 0.02 0.00 -1.26 0.00 0.00 0.00 176.54 174.76 2r4r n SER 55 N -5.02 0.00 0.00 0.19 2.88 -1.01 -5.05 113.62 105.61 2r4r n SER 55 Ca 0.02 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.56 2r4r n SER 55 Cb 0.14 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.60 2r4r n SER 55 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2r4r n GLY 56 N 2.51 0.00 3.66 0.46 0.00 -0.97 -5.08 105.19 105.77 2r4r n GLY 56 Ca 0.00 0.00 -0.55 0.00 0.00 0.00 0.00 46.02 45.47 2r4r n GLY 56 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2r4r n ASN 57 N 0.00 2.07 -3.72 1.61 4.13 -1.26 -4.72 115.26 113.38 2r4r n ASN 57 Ca 0.00 1.09 -0.29 0.00 1.68 0.00 0.00 54.58 57.06 2r4r n ASN 57 Cb 0.00 -1.16 -0.13 0.00 -1.54 0.00 0.00 39.78 36.95 2r4r n ASN 57 CO 0.00 0.00 0.00 -0.63 0.28 0.00 0.00 177.26 176.91 2r4r s ILE 58 N 2.28 1.45 -0.57 2.41 1.01 -1.26 -1.31 121.20 125.21 2r4r s ILE 58 Ca 0.93 -2.63 -0.26 0.00 0.00 0.00 0.00 60.65 58.69 2r4r s ILE 58 Cb -1.02 -2.01 0.04 0.00 0.01 0.00 0.00 42.46 39.47 2r4r s ILE 58 CO 0.58 -0.90 1.06 -1.81 0.00 0.00 0.00 174.94 173.86 2r4r s ASP 59 N 0.28 6.38 0.62 3.58 1.01 -0.62 -4.92 116.67 123.00 2r4r s ASP 59 Ca 0.18 -0.17 -0.09 0.00 0.71 0.00 0.00 52.55 53.19 2r4r s ASP 59 Cb -0.23 -2.49 -0.01 0.00 1.01 0.00 0.00 42.92 41.20 2r4r s ASP 59 CO -0.01 -1.35 0.98 -0.31 0.21 0.00 0.00 175.17 174.68 2r4r s TYR 60 N 4.43 3.42 -0.14 4.23 1.51 -1.26 -2.17 117.35 127.37 2r4r s TYR 60 Ca 0.36 0.96 -0.19 0.00 -1.01 0.00 0.00 57.07 57.18 2r4r s TYR 60 Cb -0.10 -2.77 -0.04 0.00 -0.11 0.00 0.00 41.96 38.94 2r4r s TYR 60 CO 0.22 -0.82 0.53 1.21 -1.11 0.00 0.00 175.55 175.58 2r4r s ASN 61 N -4.26 6.70 0.02 2.29 3.84 -1.20 -4.93 114.94 117.39 2r4r s ASN 61 Ca 0.54 0.83 -0.04 0.00 0.21 0.00 0.00 52.86 54.41 2r4r s ASN 61 Cb -0.11 -2.31 -0.01 0.00 -0.55 0.00 0.00 41.25 38.28 2r4r s ASN 61 CO 0.49 -0.07 0.65 -0.62 -2.79 0.00 0.00 177.10 174.76 2r4r n GLU 62 N 4.03 -0.05 -0.19 0.43 1.02 -1.26 -0.69 120.64 123.93 2r4r n GLU 62 Ca -0.05 0.64 -0.05 0.00 -0.02 0.00 0.00 57.16 57.68 2r4r n GLU 62 Cb 0.51 -0.96 -0.05 0.00 -0.02 0.00 0.00 31.44 30.92 2r4r n GLU 62 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 2r4r n ARG 63 N -3.03 -0.20 -0.10 3.49 1.74 -1.26 0.25 116.66 117.54 2r4r n ARG 63 Ca 0.00 0.92 0.02 0.00 -0.77 0.00 0.00 57.85 58.02 2r4r n ARG 63 Cb 0.03 -1.36 0.07 0.00 -1.02 0.00 0.00 32.46 30.19 2r4r n ARG 63 CO 0.00 0.00 0.00 1.19 -1.52 0.00 0.00 177.63 177.30 2r4r n PHE 64 N -4.12 0.26 -0.09 -1.55 3.01 -0.32 -4.47 117.46 110.17 2r4r n PHE 64 Ca 0.01 -0.12 -0.03 0.00 1.01 0.00 0.00 57.45 58.33 2r4r n PHE 64 Cb 0.12 -0.04 -0.02 0.00 -0.01 0.00 0.00 39.48 39.52 2r4r n PHE 64 CO 0.00 0.00 0.00 -0.22 1.01 0.00 0.00 176.76 177.55 2r4r h LYS 65 N 0.90 -0.02 0.00 -1.08 3.64 0.55 -0.81 116.57 119.76 2r4r h LYS 65 Ca 0.00 0.00 -0.02 0.00 -1.27 0.00 0.00 60.65 59.37 2r4r h LYS 65 Cb 0.35 0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 32.17 2r4r h LYS 65 CO 0.02 -0.01 -0.36 0.38 -2.27 0.00 0.00 179.45 177.21 2r4r h ASP 66 N -0.02 0.00 -0.09 4.20 -0.00 -1.78 -3.37 116.42 115.36 2r4r h ASP 66 Ca 0.03 0.00 -0.02 0.00 -0.00 0.00 0.00 57.03 57.04 2r4r h ASP 66 Cb 0.11 0.00 -0.00 0.00 -0.00 0.00 0.00 39.33 39.43 2r4r h ASP 66 CO -0.21 0.07 -0.04 0.50 -0.00 0.00 0.00 179.24 179.56 2r4r h LYS 67 N 0.00 0.18 -6.72 4.15 1.63 -1.66 -3.46 116.57 110.69 2r4r h LYS 67 Ca -0.01 -0.08 -0.66 0.00 -0.85 0.00 0.00 60.65 59.05 2r4r h LYS 67 Cb 1.06 -0.01 -0.21 0.00 -0.60 0.00 0.00 32.23 32.47 2r4r h LYS 67 CO 0.01 0.54 -0.85 0.00 -3.45 0.00 0.00 179.45 175.70 2r4r s ALA 68 N -4.59 2.40 -0.19 5.00 0.00 -0.36 -1.77 121.76 122.25 2r4r s ALA 68 Ca -0.15 -1.53 -0.03 0.00 0.00 0.00 0.00 51.96 50.25 2r4r s ALA 68 Cb 0.04 -0.35 0.06 0.00 0.00 0.00 0.00 23.12 22.87 2r4r s ALA 68 CO 0.71 0.48 0.05 0.95 0.00 0.00 0.00 175.76 177.95 2r4r s THR 69 N -1.34 0.34 0.75 0.00 -4.23 -0.15 -4.73 115.64 106.29 2r4r s THR 69 Ca 0.16 -0.44 -0.11 0.00 -1.18 0.00 0.00 61.69 60.13 2r4r s THR 69 Cb -0.09 -0.89 0.05 0.00 1.34 0.00 0.00 72.50 72.90 2r4r s THR 69 CO 0.07 -0.23 1.09 -0.76 -0.54 0.00 0.00 174.62 174.25 2r4r s LEU 70 N 1.94 3.07 -0.24 4.79 1.43 -1.26 -1.49 118.68 126.92 2r4r s LEU 70 Ca -0.00 1.80 -0.27 0.00 -1.03 0.00 0.00 54.13 54.63 2r4r s LEU 70 Cb -0.17 -4.52 0.13 0.00 0.03 0.00 0.00 46.19 41.66 2r4r s LEU 70 CO -0.08 -1.91 1.05 0.28 0.23 0.00 0.00 176.35 175.92 2r4r s THR 71 N -2.90 0.00 0.31 5.49 -1.32 -0.91 -4.93 115.64 111.38 2r4r s THR 71 Ca 0.61 0.00 0.11 0.00 -1.21 0.00 0.00 61.69 61.20 2r4r s THR 71 Cb -0.17 -1.00 -0.06 0.00 -1.51 0.00 0.00 72.50 69.77 2r4r s THR 71 CO 0.55 0.00 -0.15 0.00 -2.21 0.00 0.00 174.62 172.81 2r4r s ALA 72 N -0.33 2.86 -0.41 11.08 0.00 -1.26 0.81 121.76 134.51 2r4r s ALA 72 Ca 0.02 -1.95 0.01 0.00 0.00 0.00 0.00 51.96 50.04 2r4r s ALA 72 Cb -0.03 -0.20 0.13 0.00 0.00 0.00 0.00 23.12 23.02 2r4r s ALA 72 CO -0.04 0.20 0.22 0.34 0.00 0.00 0.00 175.76 176.48 2r4r s ASP 73 N -3.56 3.54 0.32 0.00 2.15 0.00 -4.94 116.67 114.18 2r4r s ASP 73 Ca 0.31 -2.47 0.10 0.00 0.43 0.00 0.00 52.55 50.92 2r4r s ASP 73 Cb -0.02 -0.90 0.95 0.00 -0.30 0.00 0.00 42.92 42.65 2r4r s ASP 73 CO 0.16 -0.29 1.65 0.11 -0.17 0.00 0.00 175.17 176.64 2r4r h LYS 74 N 6.88 0.27 0.00 4.34 1.57 -1.91 0.48 116.57 128.20 2r4r h LYS 74 Ca -0.01 -0.02 0.00 0.00 -1.87 0.00 0.00 60.65 58.76 2r4r h LYS 74 Cb 0.94 -0.06 0.00 0.00 0.08 0.00 0.00 32.23 33.19 2r4r h LYS 74 CO 0.44 0.18 0.00 0.45 -0.57 0.00 0.00 179.45 179.95 2r4r n SER 75 N -5.12 0.00 0.10 0.86 2.88 -1.26 -3.65 113.62 107.42 2r4r n SER 75 Ca 0.28 0.47 0.17 0.00 -1.33 0.00 0.00 58.87 58.46 2r4r n SER 75 Cb 0.88 -0.23 0.50 0.00 -0.75 0.00 0.00 64.21 64.60 2r4r n SER 75 CO 0.00 0.00 0.00 0.28 -1.23 0.00 0.00 175.04 174.09 2r4r h SER 76 N 0.00 0.00 -5.96 -3.46 0.02 -1.96 -3.44 113.55 98.75 2r4r h SER 76 Ca 0.00 0.00 -0.40 0.00 -0.84 0.00 0.00 61.79 60.55 2r4r h SER 76 Cb 0.00 0.00 0.09 0.00 0.14 0.00 0.00 62.40 62.63 2r4r h SER 76 CO 0.00 0.00 -0.76 -0.24 -1.14 0.00 0.00 176.83 174.69 2r4r n SER 77 N -3.12 -3.51 -4.07 3.07 2.88 0.17 -4.89 113.62 104.15 2r4r n SER 77 Ca 0.09 -0.69 -0.10 0.00 -1.33 0.00 0.00 58.87 56.84 2r4r n SER 77 Cb 0.95 -4.54 -0.11 0.00 -0.75 0.00 0.00 64.21 59.76 2r4r n SER 77 CO 0.00 0.00 0.00 0.42 -1.23 0.00 0.00 175.04 174.23 2r4r s THR 78 N -3.42 0.40 0.31 2.46 -4.23 -1.17 -2.72 115.64 107.28 2r4r s THR 78 Ca 0.30 -1.37 0.07 0.00 -1.18 0.00 0.00 61.69 59.50 2r4r s THR 78 Cb -0.14 -0.94 -0.06 0.00 1.34 0.00 0.00 72.50 72.70 2r4r s THR 78 CO 0.77 -0.65 -0.05 0.00 -0.54 0.00 0.00 174.62 174.16 2r4r s ALA 79 N -2.41 2.57 0.22 3.99 0.00 -0.76 -0.82 121.76 124.55 2r4r s ALA 79 Ca -0.03 -2.01 -0.00 0.00 0.00 0.00 0.00 51.96 49.92 2r4r s ALA 79 Cb -0.03 0.19 -0.04 0.00 0.00 0.00 0.00 23.12 23.23 2r4r s ALA 79 CO -0.03 -0.07 0.11 0.71 0.00 0.00 0.00 175.76 176.48 2r4r s TYR 80 N -2.92 1.30 -0.11 0.00 1.51 0.24 -1.48 117.35 115.89 2r4r s TYR 80 Ca 0.32 -1.30 -0.04 0.00 -1.01 0.00 0.00 57.07 55.03 2r4r s TYR 80 Cb 0.05 -0.69 0.05 0.00 -0.11 0.00 0.00 41.96 41.26 2r4r s TYR 80 CO 0.14 -0.52 0.23 1.41 -1.11 0.00 0.00 175.55 175.70 2r4r s MET 81 N -4.11 0.14 -0.40 -0.62 1.75 -0.71 -2.13 119.30 113.23 2r4r s MET 81 Ca 0.38 0.63 -0.17 0.00 -1.25 0.00 0.00 55.69 55.28 2r4r s MET 81 Cb 0.07 -0.11 0.01 0.00 2.84 0.00 0.00 34.83 37.64 2r4r s MET 81 CO 0.12 -0.25 0.41 -1.14 -0.65 0.00 0.00 175.02 173.52 2r4r s GLN 82 N 1.98 3.24 -0.43 4.11 2.00 -0.56 -2.80 119.66 127.20 2r4r s GLN 82 Ca -0.02 -0.66 -0.06 0.00 -2.00 0.00 0.00 55.36 52.62 2r4r s GLN 82 Cb -0.12 -3.92 0.11 0.00 0.80 0.00 0.00 33.01 29.88 2r4r s GLN 82 CO -0.08 -0.75 0.25 -1.17 -0.50 0.00 0.00 175.29 173.04 2r4r s LEU 83 N 2.08 5.34 0.38 3.68 2.96 -0.83 -0.97 118.68 131.32 2r4r s LEU 83 Ca 0.12 -1.89 -0.04 0.00 -0.22 0.00 0.00 54.13 52.09 2r4r s LEU 83 Cb -0.17 -1.91 -0.04 0.00 0.50 0.00 0.00 46.19 44.57 2r4r s LEU 83 CO 0.13 -0.58 0.65 -0.44 -1.32 0.00 0.00 176.35 174.79 2r4r s SER 84 N 2.13 6.35 -1.23 3.68 0.01 -0.73 -2.20 113.70 121.72 2r4r s SER 84 Ca 0.06 0.75 -0.29 0.00 1.31 0.00 0.00 55.95 57.78 2r4r s SER 84 Cb -0.24 -2.16 0.03 0.00 0.21 0.00 0.00 66.02 63.86 2r4r s SER 84 CO -0.02 -0.37 0.65 -1.54 0.41 0.00 0.00 173.24 172.37 2r4r n SER 85 N -1.64 -3.90 -4.71 2.44 3.41 0.00 -4.87 113.62 104.35 2r4r n SER 85 Ca -0.01 -1.24 -0.38 0.00 -0.26 0.00 0.00 58.87 56.97 2r4r n SER 85 Cb 0.55 -2.03 0.05 0.00 -0.26 0.00 0.00 64.21 62.51 2r4r n SER 85 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 2r4r n LEU 86 N -4.85 5.12 -4.30 1.04 4.77 -0.46 -4.65 117.00 113.67 2r4r n LEU 86 Ca -0.13 0.94 -0.16 0.00 -0.03 0.00 0.00 56.01 56.63 2r4r n LEU 86 Cb 0.58 -1.53 -0.10 0.00 -2.33 0.00 0.00 43.42 40.04 2r4r n LEU 86 CO 0.74 -0.89 -0.32 0.28 -1.33 0.00 0.00 177.39 175.88 2r4r s THR 87 N -1.33 0.83 0.57 -5.08 -1.32 -1.26 0.08 115.64 108.13 2r4r s THR 87 Ca 0.73 -2.01 0.31 0.00 -1.21 0.00 0.00 61.69 59.51 2r4r s THR 87 Cb -0.42 -2.33 0.44 0.00 -1.51 0.00 0.00 72.50 68.68 2r4r s THR 87 CO 0.48 -0.31 1.82 0.28 -2.21 0.00 0.00 174.62 174.68 2r4r h SER 88 N 2.53 0.00 -0.06 8.08 0.02 -1.97 0.25 113.55 122.41 2r4r h SER 88 Ca -0.38 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.57 2r4r h SER 88 Cb 1.22 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.76 2r4r h SER 88 CO 0.63 0.00 0.00 -1.84 -1.14 0.00 0.00 176.83 174.48 2r4r n GLU 89 N -3.87 2.00 0.01 3.45 0.28 -1.26 -3.72 120.64 117.53 2r4r n GLU 89 Ca 0.15 -1.46 0.12 0.00 -0.16 0.00 0.00 57.16 55.82 2r4r n GLU 89 Cb 0.92 -1.47 0.32 0.00 1.43 0.00 0.00 31.44 32.65 2r4r n GLU 89 CO 0.00 0.00 0.00 -0.25 -0.16 0.00 0.00 177.13 176.72 2r4r n ASP 90 N 0.75 0.42 -4.75 -1.84 8.00 0.89 -4.87 116.55 115.16 2r4r n ASP 90 Ca 0.17 -0.02 -0.41 0.00 0.71 0.00 0.00 54.79 55.23 2r4r n ASP 90 Cb 0.47 0.06 -0.02 0.00 -0.02 0.00 0.00 41.12 41.60 2r4r n ASP 90 CO 0.00 0.00 0.00 -0.44 -0.39 0.00 0.00 177.20 176.37 2r4r s SER 91 N -3.18 6.80 0.00 -2.24 0.01 -1.24 -4.90 113.70 108.95 2r4r s SER 91 Ca 0.11 2.59 0.00 0.00 1.31 0.00 0.00 55.95 59.96 2r4r s SER 91 Cb 0.17 -2.63 0.00 0.00 0.21 0.00 0.00 66.02 63.77 2r4r s SER 91 CO 0.66 -0.56 0.00 0.00 0.41 0.00 0.00 173.24 173.75 2r4r n ALA 92 N 1.69 0.00 -2.69 1.44 0.00 -0.54 -4.73 120.51 115.68 2r4r n ALA 92 Ca 0.03 0.00 -0.38 0.00 0.00 0.00 0.00 53.44 53.09 2r4r n ALA 92 Cb 0.42 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 19.81 2r4r n ALA 92 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 2r4r s VAL 93 N -2.06 5.15 -0.23 0.00 1.01 -1.12 -2.32 120.40 120.82 2r4r s VAL 93 Ca 0.00 1.00 -0.06 0.00 0.00 0.00 0.00 61.98 62.92 2r4r s VAL 93 Cb 0.00 -3.83 -0.02 0.00 0.00 0.00 0.00 36.38 32.53 2r4r s VAL 93 CO 0.00 0.35 0.02 -0.31 0.00 0.00 0.00 175.10 175.15 2r4r s TYR 94 N 0.46 3.03 -0.10 5.22 1.51 -0.89 -0.32 117.35 126.24 2r4r s TYR 94 Ca 0.27 -0.64 -0.07 0.00 -1.01 0.00 0.00 57.07 55.62 2r4r s TYR 94 Cb -0.16 -2.17 -0.04 0.00 -0.11 0.00 0.00 41.96 39.48 2r4r s TYR 94 CO 0.12 -0.43 0.16 -0.06 -1.11 0.00 0.00 175.55 174.22 2r4r s PHE 95 N 1.52 3.60 -0.39 2.71 0.40 0.09 -2.65 117.98 123.27 2r4r s PHE 95 Ca 0.06 0.54 0.01 0.00 -0.60 0.00 0.00 56.93 56.94 2r4r s PHE 95 Cb -0.15 -1.95 0.11 0.00 0.51 0.00 0.00 43.02 41.54 2r4r s PHE 95 CO 0.01 0.73 0.14 0.00 0.70 0.00 0.00 175.22 176.79 2r4r s VAL 97 N 0.86 3.66 -0.89 0.00 -7.23 -0.70 -1.58 120.40 114.51 2r4r s VAL 97 Ca 0.11 -0.80 -0.00 0.00 -1.81 0.00 0.00 61.98 59.47 2r4r s VAL 97 Cb -0.21 -3.30 0.27 0.00 0.56 0.00 0.00 36.38 33.71 2r4r s VAL 97 CO -0.06 -0.16 1.09 -1.14 -0.31 0.00 0.00 175.10 174.53 2r4r n ARG 98 N -1.91 3.45 -3.49 4.82 0.63 -0.29 -2.56 116.66 117.30 2r4r n ARG 98 Ca 0.03 -4.59 -0.23 0.00 -0.92 0.00 0.00 57.85 52.14 2r4r n ARG 98 Cb 0.58 -2.40 0.07 0.00 0.45 0.00 0.00 32.46 31.16 2r4r n ARG 98 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 2r4r n GLY 99 N 1.35 -0.51 3.54 5.14 0.00 -1.15 -2.35 105.19 111.21 2r4r n GLY 99 Ca 0.27 0.22 0.00 0.00 0.00 0.00 0.00 46.02 46.50 2r4r n GLY 99 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 2r4r n PHE 100 N -4.89 0.00 0.00 1.61 3.72 -1.26 -4.86 117.46 111.77 2r4r n PHE 100 Ca -0.01 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.39 2r4r n PHE 100 Cb 0.57 -0.58 0.00 0.00 -0.94 0.00 0.00 39.48 38.53 2r4r n PHE 100 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2r4r n GLY 101 N -2.00 0.11 3.63 1.37 0.00 -0.99 -4.84 105.19 102.47 2r4r n GLY 101 Ca 0.00 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.68 2r4r n GLY 101 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 2r4r s TYR 102 N -0.72 3.24 0.47 1.61 5.04 -1.26 -4.98 117.35 120.76 2r4r s TYR 102 Ca 0.00 0.05 -0.02 0.00 -2.44 0.00 0.00 57.07 54.67 2r4r s TYR 102 Cb 0.00 -2.07 -0.01 0.00 0.35 0.00 0.00 41.96 40.23 2r4r s TYR 102 CO 0.00 0.15 0.72 -1.58 -1.34 0.00 0.00 175.55 173.49 2r4r s TRP 103 N 0.36 3.32 0.00 4.97 0.52 -1.26 -1.14 118.94 125.71 2r4r s TRP 103 Ca 0.03 0.42 0.00 0.00 0.02 0.00 0.00 56.10 56.57 2r4r s TRP 103 Cb -0.12 -2.34 0.00 0.00 -1.15 0.00 0.00 33.47 29.86 2r4r s TRP 103 CO 0.00 -0.38 0.00 0.41 0.02 0.00 0.00 176.95 177.01 2r4r n GLY 104 N -2.17 -0.47 0.01 0.98 0.00 -0.61 -4.75 105.19 98.18 2r4r n GLY 104 Ca 0.01 -1.68 -0.00 0.00 0.00 0.00 0.00 46.02 44.34 2r4r n GLY 104 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 2r4r h GLN 105 N 0.00 0.00 0.00 1.61 4.20 -1.84 -3.47 115.11 115.61 2r4r h GLN 105 Ca 0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 2r4r h GLN 105 Cb 0.00 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.78 2r4r h GLN 105 CO 0.00 0.00 0.00 0.41 -0.67 0.00 0.00 178.83 178.57 2r4r n GLY 106 N 1.80 4.40 2.58 3.46 0.00 -1.26 -5.01 105.19 111.15 2r4r n GLY 106 Ca -0.01 -1.36 -0.28 0.00 0.00 0.00 0.00 46.02 44.38 2r4r n GLY 106 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2r4r s THR 107 N -2.00 -0.04 -1.02 2.61 2.01 -1.08 -0.27 115.64 115.85 2r4r s THR 107 Ca 0.00 -0.52 -0.06 0.00 0.31 0.00 0.00 61.69 61.41 2r4r s THR 107 Cb 0.00 -0.83 -0.06 0.00 0.01 0.00 0.00 72.50 71.62 2r4r s THR 107 CO 0.00 -0.53 2.23 0.41 -0.69 0.00 0.00 174.62 176.04 2r4r n THR 108 N 5.25 2.70 -1.73 -0.82 -1.04 0.66 -2.10 114.28 117.19 2r4r n THR 108 Ca -0.06 -1.62 -0.42 0.00 -2.04 0.00 0.00 64.05 59.91 2r4r n THR 108 Cb 0.45 -2.20 -0.01 0.00 -1.82 0.00 0.00 70.33 66.74 2r4r n THR 108 CO 0.00 0.00 0.00 -0.11 -0.64 0.00 0.00 175.07 174.32 2r4r n LEU 109 N 4.16 4.15 -3.67 -4.42 7.94 -0.98 -3.08 117.00 121.10 2r4r n LEU 109 Ca 0.49 1.17 -0.17 0.00 -1.11 0.00 0.00 56.01 56.40 2r4r n LEU 109 Cb 0.15 -1.56 -0.16 0.00 0.53 0.00 0.00 43.42 42.38 2r4r n LEU 109 CO 0.73 -0.03 -0.25 0.28 -1.11 0.00 0.00 177.39 177.00 2r4r s THR 110 N -0.40 -0.22 -0.39 1.96 -1.32 0.16 -1.47 115.64 113.96 2r4r s THR 110 Ca 0.61 0.36 -0.21 0.00 -1.21 0.00 0.00 61.69 61.24 2r4r s THR 110 Cb -0.53 -0.27 0.01 0.00 -1.51 0.00 0.00 72.50 70.21 2r4r s THR 110 CO 0.54 0.15 0.66 -0.69 -2.21 0.00 0.00 174.62 173.06 2r4r s VAL 111 N 2.20 4.84 0.11 5.08 1.01 -1.26 -0.92 120.40 131.46 2r4r s VAL 111 Ca 0.03 0.42 -0.14 0.00 0.00 0.00 0.00 61.98 62.28 2r4r s VAL 111 Cb -0.12 -4.15 0.03 0.00 0.00 0.00 0.00 36.38 32.14 2r4r s VAL 111 CO -0.05 -0.45 0.35 -0.55 0.00 0.00 0.00 175.10 174.39 2r4r s SER 112 N 1.90 -0.15 0.23 3.32 0.15 0.26 -4.62 113.70 114.78 2r4r s SER 112 Ca 0.24 -0.39 0.22 0.00 0.70 0.00 0.00 55.95 56.72 2r4r s SER 112 Cb -0.14 0.44 0.04 0.00 -1.71 0.00 0.00 66.02 64.65 2r4r s SER 112 CO 0.17 -0.82 1.12 0.28 1.20 0.00 0.00 173.24 175.20 2r4r h SER 113 N 2.48 0.00 -3.64 5.45 0.02 -1.95 -3.29 113.55 112.62 2r4r h SER 113 Ca -0.34 0.00 -0.55 0.00 -0.84 0.00 0.00 61.79 60.06 2r4r h SER 113 Cb 1.24 0.00 0.19 0.00 0.14 0.00 0.00 62.40 63.97 2r4r h SER 113 CO 0.49 0.08 -0.09 0.00 -1.14 0.00 0.00 176.83 176.17 2r4r n ALA 114 N -2.19 -0.89 -2.82 3.77 0.00 -1.26 -5.02 120.51 112.10 2r4r n ALA 114 Ca -0.00 -0.29 -0.36 0.00 0.00 0.00 0.00 53.44 52.79 2r4r n ALA 114 Cb 0.58 -2.02 -0.07 0.00 0.00 0.00 0.00 19.45 17.94 2r4r n ALA 114 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 177.50 175.91 2r4r s LYS 115 N -3.35 3.42 0.44 0.00 -2.85 -1.26 -5.02 119.74 111.12 2r4r s LYS 115 Ca 0.69 -0.21 -0.24 0.00 -1.00 0.00 0.00 55.97 55.21 2r4r s LYS 115 Cb -0.32 -3.12 -0.08 0.00 -2.06 0.00 0.00 37.83 32.26 2r4r s LYS 115 CO 0.55 0.70 1.22 0.99 0.10 0.00 0.00 175.35 178.91 2r4r s THR 116 N -0.83 2.88 -0.19 3.79 2.01 -1.26 -4.92 115.64 117.13 2r4r s THR 116 Ca 0.13 0.72 -0.05 0.00 0.31 0.00 0.00 61.69 62.81 2r4r s THR 116 Cb -0.12 -3.39 0.09 0.00 0.01 0.00 0.00 72.50 69.09 2r4r s THR 116 CO 0.03 0.04 0.32 0.42 -0.69 0.00 0.00 174.62 174.74 2r4r s THR 117 N -1.41 -0.50 0.80 -0.82 -4.23 -1.14 -5.00 115.64 103.34 2r4r s THR 117 Ca 0.61 0.09 -0.12 0.00 -1.18 0.00 0.00 61.69 61.10 2r4r s THR 117 Cb -0.33 -0.63 0.08 0.00 1.34 0.00 0.00 72.50 72.96 2r4r s THR 117 CO 0.41 -0.01 1.13 -2.16 -0.54 0.00 0.00 174.62 173.45 2r4r s PRO 118 N 2.48 1.91 0.00 3.99 0.04 -1.26 -1.37 135.00 140.78 2r4r s PRO 118 Ca 0.05 1.41 0.00 0.00 0.04 0.00 0.00 61.00 62.50 2r4r s PRO 118 Cb -0.14 -1.84 0.00 0.00 0.04 0.00 0.00 34.50 32.56 2r4r s PRO 118 CO -0.12 -1.94 0.00 -0.35 0.04 0.00 0.00 177.00 174.63 2r4r n PRO 119 N -3.49 -0.03 -2.86 0.56 -0.04 -1.25 -4.44 135.00 123.45 2r4r n PRO 119 Ca 0.11 0.00 -0.08 0.00 -0.04 0.00 0.00 63.50 63.49 2r4r n PRO 119 Cb 0.52 0.00 -0.01 0.00 -0.04 0.00 0.00 33.50 33.98 2r4r n PRO 119 CO 0.00 0.00 0.00 0.43 -0.04 0.00 0.00 175.50 175.89 2r4r n SER 120 N -1.17 -2.96 -4.66 3.54 7.64 -0.57 -4.90 113.62 110.53 2r4r n SER 120 Ca 0.00 -2.86 -0.42 0.00 1.01 0.00 0.00 58.87 56.60 2r4r n SER 120 Cb 0.00 1.40 -0.03 0.00 -1.01 0.00 0.00 64.21 64.57 2r4r n SER 120 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 2r4r s VAL 121 N 0.72 3.21 0.04 0.44 1.01 -1.26 -2.90 120.40 121.67 2r4r s VAL 121 Ca 0.31 0.26 0.09 0.00 0.00 0.00 0.00 61.98 62.63 2r4r s VAL 121 Cb 0.02 -3.17 -0.03 0.00 0.00 0.00 0.00 36.38 33.20 2r4r s VAL 121 CO -0.08 -0.03 -0.25 -0.31 0.00 0.00 0.00 175.10 174.43 2r4r s TYR 122 N 4.50 2.37 -0.10 5.22 2.02 -0.38 -5.01 117.35 125.98 2r4r s TYR 122 Ca 0.84 -0.38 -0.05 0.00 -0.37 0.00 0.00 57.07 57.11 2r4r s TYR 122 Cb -0.39 -1.41 -0.04 0.00 -0.40 0.00 0.00 41.96 39.73 2r4r s TYR 122 CO 0.37 0.16 0.11 -1.25 -1.57 0.00 0.00 175.55 173.37 2r4r s PRO 123 N -1.29 3.33 -0.28 -1.71 0.04 -1.26 -1.91 135.00 131.92 2r4r s PRO 123 Ca 0.12 -0.21 -0.06 0.00 0.04 0.00 0.00 61.00 60.89 2r4r s PRO 123 Cb -0.10 -3.09 0.01 0.00 0.04 0.00 0.00 34.50 31.36 2r4r s PRO 123 CO 0.03 0.75 0.06 -0.51 0.04 0.00 0.00 177.00 177.37 2r4r s LEU 124 N -1.07 3.69 0.19 -3.56 2.01 0.21 -4.97 118.68 115.17 2r4r s LEU 124 Ca 0.16 -0.68 0.09 0.00 0.01 0.00 0.00 54.13 53.71 2r4r s LEU 124 Cb -0.12 -1.85 -0.04 0.00 0.01 0.00 0.00 46.19 44.19 2r4r s LEU 124 CO 0.05 -0.16 -0.12 0.00 1.01 0.00 0.00 176.35 177.12 2r4r s ALA 125 N 1.49 2.86 0.13 4.21 0.00 -1.26 -1.94 121.76 127.25 2r4r s ALA 125 Ca 0.03 -1.52 -0.34 0.00 0.00 0.00 0.00 51.96 50.13 2r4r s ALA 125 Cb -0.17 -0.65 -0.16 0.00 0.00 0.00 0.00 23.12 22.14 2r4r s ALA 125 CO 0.01 0.45 1.22 -0.35 0.00 0.00 0.00 175.76 177.10 2r4r n PRO 126 N 0.06 1.11 0.00 0.00 -0.04 -1.26 -4.98 135.00 129.88 2r4r n PRO 126 Ca -0.11 0.40 0.00 0.00 -0.04 0.00 0.00 63.50 63.75 2r4r n PRO 126 Cb 0.56 -1.94 0.00 0.00 -0.04 0.00 0.00 33.50 32.07 2r4r n PRO 126 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2r4r n GLY 127 N 2.19 -1.93 2.84 0.55 0.00 -1.26 -4.47 105.19 103.12 2r4r n GLY 127 Ca 0.16 0.06 -0.39 0.00 0.00 0.00 0.00 46.02 45.86 2r4r n GLY 127 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2r4r n SER 128 N -0.14 5.79 -3.06 1.61 3.41 -1.25 -4.52 113.62 115.45 2r4r n SER 128 Ca 0.00 -3.44 -0.22 0.00 -0.26 0.00 0.00 58.87 54.95 2r4r n SER 128 Cb 0.00 -1.10 -0.04 0.00 -0.26 0.00 0.00 64.21 62.81 2r4r n SER 128 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2r4r n ALA 129 N 1.11 -0.71 -2.23 7.33 0.00 -1.26 -4.74 120.51 120.00 2r4r n ALA 129 Ca 0.28 -0.11 -0.32 0.00 0.00 0.00 0.00 53.44 53.30 2r4r n ALA 129 Cb 0.35 -1.31 -0.04 0.00 0.00 0.00 0.00 19.45 18.44 2r4r n ALA 129 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2r4r s ALA 130 N -2.16 2.04 -1.31 0.00 0.00 -1.26 -4.86 121.76 114.21 2r4r s ALA 130 Ca 0.42 -1.79 -0.17 0.00 0.00 0.00 0.00 51.96 50.42 2r4r s ALA 130 Cb -0.25 -4.55 0.01 0.00 0.00 0.00 0.00 23.12 18.33 2r4r s ALA 130 CO 0.52 -4.40 2.06 0.94 0.00 0.00 0.00 175.76 174.88 2r4r n GLN 131 N 8.85 2.65 -2.32 0.00 0.00 -1.26 -4.71 117.38 120.59 2r4r n GLN 131 Ca 0.38 -2.62 -0.32 0.00 -0.00 0.00 0.00 57.00 54.44 2r4r n GLN 131 Cb 0.48 -3.30 0.01 0.00 0.00 0.00 0.00 30.24 27.43 2r4r n GLN 131 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.06 177.31 2r4r n THR 132 N 5.66 2.95 0.00 1.69 -2.24 -1.26 -5.02 114.28 116.05 2r4r n THR 132 Ca 0.51 -4.80 0.00 0.00 -2.27 0.00 0.00 64.05 57.49 2r4r n THR 132 Cb 0.41 -1.28 0.00 0.00 -2.10 0.00 0.00 70.33 67.36 2r4r n THR 132 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 2r4r n ASN 133 N -0.47 0.00 -0.06 3.42 4.05 -1.26 -4.93 115.26 116.00 2r4r n ASN 133 Ca 0.44 0.00 0.13 0.00 0.45 0.00 0.00 54.58 55.60 2r4r n ASN 133 Cb 0.49 0.00 0.44 0.00 1.23 0.00 0.00 39.78 41.93 2r4r n ASN 133 CO 0.00 0.00 0.00 -0.24 -3.05 0.00 0.00 177.26 173.97 2r4r n SER 134 N 0.00 0.45 -2.69 1.20 2.88 -1.26 -4.77 113.62 109.43 2r4r n SER 134 Ca 0.00 -0.25 -0.14 0.00 -1.33 0.00 0.00 58.87 57.15 2r4r n SER 134 Cb 0.00 -0.01 -0.05 0.00 -0.75 0.00 0.00 64.21 63.41 2r4r n SER 134 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2r4r n ALA 135 N -1.25 0.39 -3.25 -1.46 0.00 -1.26 -2.14 120.51 111.54 2r4r n ALA 135 Ca 0.09 -1.23 -0.13 0.00 0.00 0.00 0.00 53.44 52.17 2r4r n ALA 135 Cb 0.32 0.89 -0.09 0.00 0.00 0.00 0.00 19.45 20.58 2r4r n ALA 135 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 2r4r s VAL 136 N -2.62 0.05 -0.26 0.00 1.01 0.51 -4.20 120.40 114.90 2r4r s VAL 136 Ca 0.17 -0.40 -0.01 0.00 0.00 0.00 0.00 61.98 61.74 2r4r s VAL 136 Cb 0.01 -0.61 0.08 0.00 0.00 0.00 0.00 36.38 35.86 2r4r s VAL 136 CO 0.12 -0.22 0.05 0.42 0.00 0.00 0.00 175.10 175.47 2r4r s THR 137 N -1.14 0.84 0.44 3.92 -4.23 -1.24 -0.82 115.64 113.41 2r4r s THR 137 Ca -0.12 -1.06 0.07 0.00 -1.18 0.00 0.00 61.69 59.40 2r4r s THR 137 Cb -0.05 -1.45 -0.02 0.00 1.34 0.00 0.00 72.50 72.32 2r4r s THR 137 CO 0.04 -0.42 0.34 -1.48 -0.54 0.00 0.00 174.62 172.56 2r4r s LEU 138 N 1.67 3.19 0.28 4.79 2.34 0.45 -4.80 118.68 126.60 2r4r s LEU 138 Ca 0.03 -0.93 -0.21 0.00 0.06 0.00 0.00 54.13 53.09 2r4r s LEU 138 Cb -0.17 -1.72 0.03 0.00 -0.56 0.00 0.00 46.19 43.77 2r4r s LEU 138 CO -0.16 -0.72 0.76 -0.83 -1.06 0.00 0.00 176.35 174.35 2r4r s GLY 139 N -4.11 -0.02 -0.21 -3.48 0.00 -0.82 0.24 107.32 98.91 2r4r s GLY 139 Ca 0.44 -0.34 -0.04 0.00 0.00 0.00 0.00 44.72 44.77 2r4r s GLY 139 CO 0.25 -0.07 0.10 0.00 0.00 0.00 0.00 173.10 173.39 2r4r s LEU 141 N 2.09 4.25 -0.41 0.00 1.98 -0.80 -2.78 118.68 123.01 2r4r s LEU 141 Ca 0.04 1.59 -0.15 0.00 -2.89 0.00 0.00 54.13 52.72 2r4r s LEU 141 Cb -0.16 -3.56 0.02 0.00 0.66 0.00 0.00 46.19 43.15 2r4r s LEU 141 CO -0.19 -0.49 0.31 0.68 -1.89 0.00 0.00 176.35 174.78 2r4r s VAL 142 N 2.12 5.25 0.03 1.68 -7.23 0.21 -1.25 120.40 121.20 2r4r s VAL 142 Ca 0.50 -0.65 0.00 0.00 -1.81 0.00 0.00 61.98 60.03 2r4r s VAL 142 Cb -0.20 -3.94 -0.04 0.00 0.56 0.00 0.00 36.38 32.76 2r4r s VAL 142 CO 0.18 -0.33 0.13 -0.75 -0.31 0.00 0.00 175.10 174.02 2r4r s LYS 143 N 1.72 3.16 -0.08 4.82 2.20 -1.14 -0.89 119.74 129.51 2r4r s LYS 143 Ca 0.06 -0.51 -0.01 0.00 -0.36 0.00 0.00 55.97 55.15 2r4r s LYS 143 Cb -0.19 -2.90 0.00 0.00 -1.51 0.00 0.00 37.83 33.23 2r4r s LYS 143 CO 0.10 0.62 0.02 0.41 -0.36 0.00 0.00 175.35 176.14 2r4r n GLY 144 N 0.73 -1.34 3.47 5.54 0.00 0.05 -1.52 105.19 112.12 2r4r n GLY 144 Ca -0.10 0.22 -0.13 0.00 0.00 0.00 0.00 46.02 46.02 2r4r n GLY 144 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 2r4r s TYR 145 N -0.99 0.91 0.00 1.61 -0.85 0.13 -3.74 117.35 114.41 2r4r s TYR 145 Ca -0.02 -1.16 0.00 0.00 -0.52 0.00 0.00 57.07 55.37 2r4r s TYR 145 Cb 0.00 -0.10 0.00 0.00 0.38 0.00 0.00 41.96 42.24 2r4r s TYR 145 CO 0.23 -1.02 0.00 0.34 -1.52 0.00 0.00 175.55 173.59 2r4r n PHE 146 N -0.47 0.00 0.00 -3.49 -0.00 -0.47 -0.75 117.46 112.28 2r4r n PHE 146 Ca 0.01 0.00 0.00 0.00 -0.00 0.00 0.00 57.45 57.46 2r4r n PHE 146 Cb 0.62 0.00 0.00 0.00 -0.00 0.00 0.00 39.48 40.10 2r4r n PHE 146 CO 0.00 0.00 0.00 -0.35 -0.00 0.00 0.00 176.76 176.41 2r4r n PRO 147 N -0.31 1.16 -2.33 -7.13 -0.04 -1.26 -2.89 135.00 122.20 2r4r n PRO 147 Ca 0.00 0.00 -0.27 0.00 -0.04 0.00 0.00 63.50 63.19 2r4r n PRO 147 Cb 0.00 0.00 0.03 0.00 -0.04 0.00 0.00 33.50 33.49 2r4r n PRO 147 CO 0.00 0.00 0.00 -1.21 -0.04 0.00 0.00 175.50 174.25 2r4r s GLU 148 N 0.00 2.88 0.08 0.54 0.41 -1.26 -4.87 118.70 116.48 2r4r s GLU 148 Ca 0.00 0.03 0.01 0.00 -0.41 0.00 0.00 54.97 54.60 2r4r s GLU 148 Cb 0.00 -2.24 0.01 0.00 -1.78 0.00 0.00 34.13 30.12 2r4r s GLU 148 CO 0.00 -0.76 0.07 -0.35 -0.49 0.00 0.00 175.26 173.73 2r4r n PRO 149 N -2.64 1.28 -3.40 0.39 -0.04 -1.26 -4.75 135.00 124.58 2r4r n PRO 149 Ca 0.05 -0.47 -0.13 0.00 -0.04 0.00 0.00 63.50 62.91 2r4r n PRO 149 Cb 0.58 0.03 -0.10 0.00 -0.04 0.00 0.00 33.50 33.97 2r4r n PRO 149 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 2r4r s VAL 150 N -0.17 -0.50 0.25 0.52 -7.23 -1.26 -4.39 120.40 107.63 2r4r s VAL 150 Ca 0.05 -0.13 -0.30 0.00 -1.81 0.00 0.00 61.98 59.79 2r4r s VAL 150 Cb -0.00 -0.80 -0.10 0.00 0.56 0.00 0.00 36.38 36.04 2r4r s VAL 150 CO 0.03 -0.19 1.37 -0.89 -0.31 0.00 0.00 175.10 175.12 2r4r s THR 151 N 2.46 2.82 -0.33 5.32 2.01 -0.46 -4.76 115.64 122.70 2r4r s THR 151 Ca 0.10 0.71 -0.01 0.00 0.31 0.00 0.00 61.69 62.80 2r4r s THR 151 Cb -0.15 -3.45 0.12 0.00 0.01 0.00 0.00 72.50 69.02 2r4r s THR 151 CO -0.17 0.12 0.17 -0.69 -0.69 0.00 0.00 174.62 173.36 2r4r s VAL 152 N -0.23 0.27 0.34 3.82 1.01 -1.26 0.28 120.40 124.62 2r4r s VAL 152 Ca 0.56 -1.38 0.07 0.00 0.00 0.00 0.00 61.98 61.23 2r4r s VAL 152 Cb -0.40 -1.21 -0.02 0.00 0.00 0.00 0.00 36.38 34.75 2r4r s VAL 152 CO 0.44 -0.84 0.36 0.28 0.00 0.00 0.00 175.10 175.33 2r4r s THR 153 N 1.47 3.71 -0.05 3.92 -1.32 -1.12 -4.96 115.64 117.29 2r4r s THR 153 Ca 0.14 -1.24 0.05 0.00 -1.21 0.00 0.00 61.69 59.43 2r4r s THR 153 Cb -0.20 -3.26 -0.01 0.00 -1.51 0.00 0.00 72.50 67.52 2r4r s THR 153 CO -0.17 -0.17 -0.21 0.26 -2.21 0.00 0.00 174.62 172.12 2r4r s TRP 154 N -2.26 2.07 -1.36 9.09 0.52 -1.26 0.02 118.94 125.75 2r4r s TRP 154 Ca 0.42 -0.58 -0.04 0.00 0.02 0.00 0.00 56.10 55.92 2r4r s TRP 154 Cb -0.07 -1.37 0.00 0.00 -1.15 0.00 0.00 33.47 30.89 2r4r s TRP 154 CO 0.28 -0.17 0.51 0.09 0.02 0.00 0.00 176.95 177.68 2r4r n ASN 155 N 2.98 -5.54 -3.62 2.95 4.13 -0.23 -2.37 115.26 113.56 2r4r n ASN 155 Ca -0.17 -0.24 -0.20 0.00 1.68 0.00 0.00 54.58 55.64 2r4r n ASN 155 Cb 0.52 -4.38 0.05 0.00 -1.54 0.00 0.00 39.78 34.44 2r4r n ASN 155 CO 0.00 0.00 0.00 -1.20 0.28 0.00 0.00 177.26 176.34 2r4r n SER 156 N -1.93 -1.69 0.00 6.41 7.64 -1.26 -1.19 113.62 121.60 2r4r n SER 156 Ca -0.10 -0.75 0.00 0.00 1.01 0.00 0.00 58.87 59.03 2r4r n SER 156 Cb 0.61 -4.41 0.00 0.00 -1.01 0.00 0.00 64.21 59.40 2r4r n SER 156 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2r4r n GLY 157 N -1.45 2.81 0.03 0.23 0.00 -1.00 -4.89 105.19 100.91 2r4r n GLY 157 Ca -0.28 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 45.73 2r4r n GLY 157 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 2r4r h SER 158 N 0.00 -0.10 -3.72 1.61 0.02 -1.10 -3.42 113.55 106.83 2r4r h SER 158 Ca 0.00 0.01 -0.52 0.00 -0.84 0.00 0.00 61.79 60.44 2r4r h SER 158 Cb 0.00 0.04 0.05 0.00 0.14 0.00 0.00 62.40 62.63 2r4r h SER 158 CO 0.00 -0.03 0.63 -0.76 -1.14 0.00 0.00 176.83 175.53 2r4r s LEU 159 N -5.57 4.44 0.12 5.07 1.02 -1.02 -4.92 118.68 117.82 2r4r s LEU 159 Ca -0.01 2.56 0.00 0.00 0.02 0.00 0.00 54.13 56.70 2r4r s LEU 159 Cb 0.00 -3.64 0.00 0.00 0.02 0.00 0.00 46.19 42.58 2r4r s LEU 159 CO 0.03 -0.48 0.00 -1.54 0.02 0.00 0.00 176.35 174.38 2r4r n SER 160 N 1.37 -0.14 -4.57 2.29 3.41 -1.26 -4.52 113.62 110.20 2r4r n SER 160 Ca 0.02 0.20 -0.39 0.00 -0.26 0.00 0.00 58.87 58.44 2r4r n SER 160 Cb 0.42 0.23 -0.03 0.00 -0.26 0.00 0.00 64.21 64.58 2r4r n SER 160 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 2r4r s SER 161 N -4.87 4.88 0.00 4.04 0.15 -1.26 -2.58 113.70 114.07 2r4r s SER 161 Ca 0.00 1.30 0.00 0.00 0.70 0.00 0.00 55.95 57.95 2r4r s SER 161 Cb 0.00 -2.51 0.00 0.00 -1.71 0.00 0.00 66.02 61.80 2r4r s SER 161 CO 0.00 -2.50 0.00 0.61 1.20 0.00 0.00 173.24 172.55 2r4r n GLY 162 N 5.88 1.72 3.19 9.45 0.00 -1.26 -4.86 105.19 119.30 2r4r n GLY 162 Ca 0.33 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 46.02 2r4r n GLY 162 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2r4r s VAL 163 N -2.00 2.35 0.05 1.61 0.11 -1.06 -1.78 120.40 119.68 2r4r s VAL 163 Ca 0.00 -0.86 0.04 0.00 -2.93 0.00 0.00 61.98 58.23 2r4r s VAL 163 Cb 0.00 -1.99 -0.04 0.00 -1.53 0.00 0.00 36.38 32.82 2r4r s VAL 163 CO 0.00 0.52 -0.05 -1.00 -3.33 0.00 0.00 175.10 171.25 2r4r s HIS 164 N 1.07 2.90 -0.06 1.54 3.76 -0.62 -5.01 115.29 118.88 2r4r s HIS 164 Ca -0.01 -0.05 -0.01 0.00 -0.15 0.00 0.00 55.06 54.85 2r4r s HIS 164 Cb -0.14 -1.55 0.03 0.00 1.11 0.00 0.00 32.58 32.02 2r4r s HIS 164 CO -0.06 0.43 0.00 0.99 -0.85 0.00 0.00 174.74 175.25 2r4r s THR 165 N -1.15 0.31 0.12 1.30 2.01 -1.26 -1.00 115.64 115.96 2r4r s THR 165 Ca 0.21 0.12 -0.12 0.00 0.31 0.00 0.00 61.69 62.21 2r4r s THR 165 Cb -0.11 -0.45 -0.06 0.00 0.01 0.00 0.00 72.50 71.88 2r4r s THR 165 CO 0.13 0.23 0.48 -0.36 -0.69 0.00 0.00 174.62 174.40 2r4r s PHE 166 N 1.71 3.58 0.13 4.92 0.40 -0.66 -4.99 117.98 123.07 2r4r s PHE 166 Ca 0.01 0.91 -0.33 0.00 -0.60 0.00 0.00 56.93 56.91 2r4r s PHE 166 Cb -0.13 -2.26 -0.13 0.00 0.51 0.00 0.00 43.02 41.02 2r4r s PHE 166 CO -0.04 0.46 1.68 -0.35 0.70 0.00 0.00 175.22 177.68 2r4r n PRO 167 N 0.78 2.37 -1.68 0.24 -0.04 -1.26 -4.15 135.00 131.26 2r4r n PRO 167 Ca -0.06 0.86 -0.51 0.00 -0.04 0.00 0.00 63.50 63.74 2r4r n PRO 167 Cb 0.52 -2.67 -0.06 0.00 -0.04 0.00 0.00 33.50 31.25 2r4r n PRO 167 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2r4r n ALA 168 N 4.25 0.54 -2.90 0.55 0.00 -1.26 -4.89 120.51 116.80 2r4r n ALA 168 Ca 0.18 0.30 -0.31 0.00 0.00 0.00 0.00 53.44 53.61 2r4r n ALA 168 Cb 0.31 -2.42 -0.04 0.00 0.00 0.00 0.00 19.45 17.31 2r4r n ALA 168 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 2r4r s VAL 169 N 4.08 5.37 0.80 0.00 1.01 -0.47 -4.89 120.40 126.30 2r4r s VAL 169 Ca 0.95 -0.37 -0.06 0.00 0.00 0.00 0.00 61.98 62.50 2r4r s VAL 169 Cb -0.82 -3.63 0.15 0.00 0.00 0.00 0.00 36.38 32.08 2r4r s VAL 169 CO 0.56 0.13 1.11 -0.22 0.00 0.00 0.00 175.10 176.68 2r4r s LEU 170 N -2.54 2.88 0.00 3.92 2.96 -1.26 -1.97 118.68 122.67 2r4r s LEU 170 Ca 0.35 -0.13 0.00 0.00 -0.22 0.00 0.00 54.13 54.13 2r4r s LEU 170 Cb -0.13 -2.11 0.00 0.00 0.50 0.00 0.00 46.19 44.45 2r4r s LEU 170 CO 0.28 -2.16 0.00 1.67 -1.32 0.00 0.00 176.35 174.82 2r4r n GLN 171 N -3.16 0.00 -3.41 1.98 7.27 -0.95 -4.84 117.38 114.27 2r4r n GLN 171 Ca 0.15 0.00 -0.21 0.00 0.07 0.00 0.00 57.00 57.01 2r4r n GLN 171 Cb 0.60 0.00 0.06 0.00 2.41 0.00 0.00 30.24 33.31 2r4r n GLN 171 CO 0.00 0.00 0.00 0.43 0.07 0.00 0.00 177.06 177.56 2r4r n SER 172 N 0.00 -6.22 -4.22 1.69 7.64 -1.26 -2.78 113.62 108.48 2r4r n SER 172 Ca 0.00 -0.79 -0.35 0.00 1.01 0.00 0.00 58.87 58.74 2r4r n SER 172 Cb 0.00 -4.50 -0.03 0.00 -1.01 0.00 0.00 64.21 58.67 2r4r n SER 172 CO 0.00 0.00 0.00 -0.67 -3.01 0.00 0.00 175.04 171.36 2r4r n ASP 173 N -2.94 -2.47 -3.64 6.43 4.64 -1.26 -4.94 116.55 112.37 2r4r n ASP 173 Ca -0.08 -1.05 -0.09 0.00 -1.38 0.00 0.00 54.79 52.20 2r4r n ASP 173 Cb 0.60 -2.63 -0.07 0.00 -1.04 0.00 0.00 41.12 37.98 2r4r n ASP 173 CO 0.00 0.00 0.00 -0.22 -0.82 0.00 0.00 177.20 176.16 2r4r s LEU 174 N -7.23 -0.84 0.34 -2.67 1.98 -1.12 -5.04 118.68 104.11 2r4r s LEU 174 Ca 0.59 1.42 -0.25 0.00 -2.89 0.00 0.00 54.13 53.01 2r4r s LEU 174 Cb -0.33 2.35 -0.10 0.00 0.66 0.00 0.00 46.19 48.77 2r4r s LEU 174 CO 0.94 -0.23 0.95 -0.31 -1.89 0.00 0.00 176.35 175.80 2r4r s TYR 175 N 1.17 3.61 -0.05 5.38 2.02 0.08 -2.25 117.35 127.30 2r4r s TYR 175 Ca -0.06 1.75 -0.04 0.00 -0.37 0.00 0.00 57.07 58.34 2r4r s TYR 175 Cb -0.05 -2.92 0.01 0.00 -0.40 0.00 0.00 41.96 38.61 2r4r s TYR 175 CO -0.12 0.13 0.13 0.99 -1.57 0.00 0.00 175.55 175.10 2r4r s THR 176 N -1.72 -0.00 0.31 -0.71 2.01 -0.83 -0.69 115.64 114.01 2r4r s THR 176 Ca 0.52 0.01 -0.18 0.00 0.31 0.00 0.00 61.69 62.36 2r4r s THR 176 Cb -0.17 -0.19 0.03 0.00 0.01 0.00 0.00 72.50 72.18 2r4r s THR 176 CO 0.22 0.00 0.70 -1.48 -0.69 0.00 0.00 174.62 173.37 2r4r s LEU 177 N 0.11 -0.05 -0.11 4.42 0.05 -0.07 -1.37 118.68 121.66 2r4r s LEU 177 Ca -0.00 -0.85 -0.29 0.00 0.05 0.00 0.00 54.13 53.04 2r4r s LEU 177 Cb -0.01 2.58 0.07 0.00 -2.05 0.00 0.00 46.19 46.78 2r4r s LEU 177 CO -0.00 -1.42 0.69 -0.94 -0.55 0.00 0.00 176.35 174.13 2r4r s SER 178 N -2.99 -0.68 -0.11 1.48 1.04 -1.26 0.66 113.70 111.84 2r4r s SER 178 Ca 0.15 0.92 0.02 0.00 0.48 0.00 0.00 55.95 57.52 2r4r s SER 178 Cb -0.05 0.80 0.01 0.00 0.10 0.00 0.00 66.02 66.88 2r4r s SER 178 CO 0.09 -0.51 -0.17 -0.55 0.98 0.00 0.00 173.24 173.09 2r4r s SER 179 N -0.75 2.52 0.30 7.02 0.15 -1.12 -1.65 113.70 120.18 2r4r s SER 179 Ca -0.08 -0.45 0.07 0.00 0.70 0.00 0.00 55.95 56.19 2r4r s SER 179 Cb -0.01 -1.14 -0.03 0.00 -1.71 0.00 0.00 66.02 63.13 2r4r s SER 179 CO 0.07 0.04 0.27 -0.94 1.20 0.00 0.00 173.24 173.88 2r4r s SER 180 N 0.87 5.46 -0.13 5.45 1.04 -0.17 -0.01 113.70 126.20 2r4r s SER 180 Ca -0.09 -0.36 -0.16 0.00 0.48 0.00 0.00 55.95 55.82 2r4r s SER 180 Cb -0.15 -1.18 0.04 0.00 0.10 0.00 0.00 66.02 64.82 2r4r s SER 180 CO -0.00 -0.23 0.42 0.54 0.98 0.00 0.00 173.24 174.95 2r4r s VAL 181 N -2.22 0.01 -0.02 5.02 0.11 0.65 -1.59 120.40 122.35 2r4r s VAL 181 Ca 0.38 -0.09 0.03 0.00 -2.93 0.00 0.00 61.98 59.36 2r4r s VAL 181 Cb -0.07 -0.62 -0.03 0.00 -1.53 0.00 0.00 36.38 34.13 2r4r s VAL 181 CO 0.26 -0.05 -0.09 -0.89 -3.33 0.00 0.00 175.10 171.00 2r4r s THR 182 N -0.16 3.51 0.28 5.04 2.01 -0.74 -0.41 115.64 125.18 2r4r s THR 182 Ca -0.03 -0.70 -0.10 0.00 0.31 0.00 0.00 61.69 61.16 2r4r s THR 182 Cb -0.03 -2.47 -0.00 0.00 0.01 0.00 0.00 72.50 70.00 2r4r s THR 182 CO 0.02 0.49 0.49 0.68 -0.69 0.00 0.00 174.62 175.60 2r4r s VAL 183 N -0.89 0.00 0.09 3.82 -7.23 -0.00 -4.76 120.40 111.43 2r4r s VAL 183 Ca 0.15 -1.45 -0.30 0.00 -1.81 0.00 0.00 61.98 58.57 2r4r s VAL 183 Cb -0.11 -2.36 -0.06 0.00 0.56 0.00 0.00 36.38 34.41 2r4r s VAL 183 CO 0.04 0.00 1.09 -2.84 -0.31 0.00 0.00 175.10 173.08 2r4r s PRO 184 N -3.68 4.55 0.63 4.82 0.02 -1.26 -0.36 135.00 139.71 2r4r s PRO 184 Ca 0.24 1.64 0.30 0.00 0.02 0.00 0.00 61.00 63.20 2r4r s PRO 184 Cb -0.01 -3.35 1.62 0.00 0.02 0.00 0.00 34.50 32.78 2r4r s PRO 184 CO 0.12 -0.04 1.96 0.66 -0.33 0.00 0.00 177.00 179.37 2r4r h SER 185 N 6.09 0.00 0.00 2.53 4.64 -1.60 0.88 113.55 126.09 2r4r h SER 185 Ca -0.43 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.89 2r4r h SER 185 Cb 1.21 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.30 2r4r h SER 185 CO 0.76 0.00 0.00 -1.20 -0.87 0.00 0.00 176.83 175.52 2r4r n SER 186 N -3.30 0.22 0.13 4.97 7.64 -1.26 -4.20 113.62 117.82 2r4r n SER 186 Ca 0.02 -1.29 0.00 0.00 1.01 0.00 0.00 58.87 58.61 2r4r n SER 186 Cb 0.45 -0.11 0.00 0.00 -1.01 0.00 0.00 64.21 63.54 2r4r n SER 186 CO 0.00 0.00 0.00 0.35 -3.01 0.00 0.00 175.04 172.38 2r4r n THR 187 N -0.27 0.17 0.00 0.44 -2.24 0.30 -4.95 114.28 107.75 2r4r n THR 187 Ca 0.00 0.06 0.00 0.00 -2.27 0.00 0.00 64.05 61.84 2r4r n THR 187 Cb 0.06 -0.66 0.00 0.00 -2.10 0.00 0.00 70.33 67.63 2r4r n THR 187 CO 0.00 0.00 0.00 1.87 -0.57 0.00 0.00 175.07 176.37 2r4r n TRP 188 N -3.48 0.00 0.28 4.78 -0.00 -1.21 0.12 117.44 117.94 2r4r n TRP 188 Ca 0.00 0.00 0.11 0.00 -0.00 0.00 0.00 57.50 57.61 2r4r n TRP 188 Cb 0.00 0.00 0.51 0.00 -0.00 0.00 0.00 31.31 31.82 2r4r n TRP 188 CO 0.00 0.00 0.00 -1.00 -0.00 0.00 0.00 177.69 176.69 2r4r h PRO 189 N 0.00 0.00 0.12 5.87 0.13 -1.92 0.23 132.00 136.43 2r4r h PRO 189 Ca 0.00 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 65.12 2r4r h PRO 189 Cb 0.00 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.13 2r4r h PRO 189 CO 0.00 0.00 -0.06 0.77 -0.23 0.00 0.00 178.00 178.48 2r4r h SER 190 N 0.00 -0.14 -2.70 1.44 0.02 -1.41 -3.46 113.55 107.31 2r4r h SER 190 Ca 0.04 0.00 -0.66 0.00 -0.84 0.00 0.00 61.79 60.34 2r4r h SER 190 Cb 1.30 0.04 -0.07 0.00 0.14 0.00 0.00 62.40 63.80 2r4r h SER 190 CO -0.00 0.15 -0.49 -0.70 -1.14 0.00 0.00 176.83 174.65 2r4r s GLU 191 N -2.02 3.43 0.56 3.45 2.12 0.33 -5.08 118.70 121.50 2r4r s GLU 191 Ca -0.02 -0.19 -0.19 0.00 0.36 0.00 0.00 54.97 54.93 2r4r s GLU 191 Cb 0.00 -3.16 -0.07 0.00 0.26 0.00 0.00 34.13 31.17 2r4r s GLU 191 CO 0.07 0.75 0.84 -2.37 -0.54 0.00 0.00 175.26 174.01 2r4r n THR 192 N 1.71 3.06 -3.45 -1.70 5.66 -1.26 -4.39 114.28 113.91 2r4r n THR 192 Ca -0.18 -0.50 -0.16 0.00 -3.05 0.00 0.00 64.05 60.17 2r4r n THR 192 Cb 0.54 -1.00 -0.11 0.00 -1.55 0.00 0.00 70.33 68.20 2r4r n THR 192 CO 0.00 0.00 0.00 -0.69 -3.05 0.00 0.00 175.07 171.33 2r4r s VAL 193 N -1.53 -0.41 0.33 1.08 1.01 -1.26 -5.00 120.40 114.62 2r4r s VAL 193 Ca 0.72 -0.10 0.08 0.00 0.00 0.00 0.00 61.98 62.67 2r4r s VAL 193 Cb -0.45 -0.72 -0.04 0.00 0.00 0.00 0.00 36.38 35.17 2r4r s VAL 193 CO 0.51 -0.18 0.12 0.28 0.00 0.00 0.00 175.10 175.83 2r4r s THR 194 N 2.39 3.09 -0.10 3.92 -1.32 -1.26 -1.89 115.64 120.47 2r4r s THR 194 Ca 0.09 -1.72 -0.00 0.00 -1.21 0.00 0.00 61.69 58.84 2r4r s THR 194 Cb -0.16 -2.97 0.02 0.00 -1.51 0.00 0.00 72.50 67.89 2r4r s THR 194 CO -0.13 -0.21 -0.07 0.00 -2.21 0.00 0.00 174.62 172.00 2r4r s ASN 196 N 1.63 6.38 -0.11 0.00 -0.87 0.10 -1.06 114.94 121.00 2r4r s ASN 196 Ca 0.03 0.51 -0.14 0.00 -1.57 0.00 0.00 52.86 51.69 2r4r s ASN 196 Cb -0.13 -2.06 0.03 0.00 -0.02 0.00 0.00 41.25 39.08 2r4r s ASN 196 CO -0.07 -0.17 0.37 -0.69 -2.57 0.00 0.00 177.10 173.97 2r4r s VAL 197 N -2.07 0.01 -0.02 1.60 1.01 0.23 -2.81 120.40 118.34 2r4r s VAL 197 Ca 0.41 -0.11 0.01 0.00 0.00 0.00 0.00 61.98 62.29 2r4r s VAL 197 Cb -0.10 -0.56 0.01 0.00 0.00 0.00 0.00 36.38 35.73 2r4r s VAL 197 CO 0.31 -0.06 -0.03 0.00 0.00 0.00 0.00 175.10 175.32 2r4r s ALA 198 N -0.17 0.47 -0.55 5.51 0.00 0.14 0.10 121.76 127.27 2r4r s ALA 198 Ca -0.03 -0.04 0.04 0.00 0.00 0.00 0.00 51.96 51.93 2r4r s ALA 198 Cb -0.03 -0.27 0.16 0.00 0.00 0.00 0.00 23.12 22.98 2r4r s ALA 198 CO 0.02 0.02 0.39 -1.58 0.00 0.00 0.00 175.76 174.61 2r4r s HIS 199 N 0.56 2.33 0.22 0.00 2.46 0.29 -1.35 115.29 119.80 2r4r s HIS 199 Ca -0.06 -2.79 -0.13 0.00 0.47 0.00 0.00 55.06 52.55 2r4r s HIS 199 Cb -0.10 -1.86 0.27 0.00 -0.13 0.00 0.00 32.58 30.76 2r4r s HIS 199 CO -0.00 -0.70 1.62 -1.35 -2.47 0.00 0.00 174.74 171.84 2r4r h PRO 200 N 5.70 0.00 0.00 2.88 0.11 -1.80 0.69 132.00 139.58 2r4r h PRO 200 Ca 0.17 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.28 2r4r h PRO 200 Cb 0.84 -0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.95 2r4r h PRO 200 CO 0.54 0.00 0.59 0.00 -0.21 0.00 0.00 178.00 178.92 2r4r h ALA 201 N 1.68 1.51 0.00 -0.75 0.00 -1.85 1.75 119.26 121.60 2r4r h ALA 201 Ca 0.33 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.24 2r4r h ALA 201 Cb 0.50 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.29 2r4r h ALA 201 CO -0.70 -0.51 0.00 -1.13 0.00 0.00 0.00 179.25 176.91 2r4r n SER 202 N -2.31 0.73 -3.50 0.00 3.41 -0.00 -4.90 113.62 107.04 2r4r n SER 202 Ca -0.01 -1.19 -0.17 0.00 -0.26 0.00 0.00 58.87 57.24 2r4r n SER 202 Cb 0.61 0.00 0.01 0.00 -0.26 0.00 0.00 64.21 64.57 2r4r n SER 202 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 2r4r n SER 203 N -0.10 -6.04 -3.78 4.04 7.64 0.60 -4.97 113.62 111.01 2r4r n SER 203 Ca 0.00 -0.66 -0.28 0.00 1.01 0.00 0.00 58.87 58.94 2r4r n SER 203 Cb 0.20 -3.40 -0.16 0.00 -1.01 0.00 0.00 64.21 59.85 2r4r n SER 203 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 2r4r s THR 204 N -3.11 0.80 -0.00 0.44 2.01 -0.48 -4.95 115.64 110.34 2r4r s THR 204 Ca 0.11 -0.80 0.02 0.00 0.31 0.00 0.00 61.69 61.33 2r4r s THR 204 Cb -0.04 -1.28 -0.04 0.00 0.01 0.00 0.00 72.50 71.16 2r4r s THR 204 CO 0.84 -0.23 -0.02 -0.75 -0.69 0.00 0.00 174.62 173.77 2r4r s LYS 205 N 1.72 2.74 -0.09 4.92 2.20 -1.26 0.11 119.74 130.08 2r4r s LYS 205 Ca -0.01 -0.63 -0.10 0.00 -0.36 0.00 0.00 55.97 54.87 2r4r s LYS 205 Cb -0.18 -2.63 0.03 0.00 -1.51 0.00 0.00 37.83 33.54 2r4r s LYS 205 CO -0.09 0.62 0.28 0.08 -0.36 0.00 0.00 175.35 175.88 2r4r s VAL 206 N -1.05 0.01 0.10 4.02 1.01 0.28 -4.98 120.40 119.80 2r4r s VAL 206 Ca 0.19 -0.12 0.09 0.00 0.00 0.00 0.00 61.98 62.13 2r4r s VAL 206 Cb -0.11 -0.44 -0.04 0.00 0.00 0.00 0.00 36.38 35.79 2r4r s VAL 206 CO 0.09 -0.07 -0.19 -1.81 0.00 0.00 0.00 175.10 173.12 2r4r s ASP 207 N -0.18 3.78 -0.36 3.32 1.01 -1.26 0.76 116.67 123.73 2r4r s ASP 207 Ca -0.03 -0.55 0.04 0.00 0.71 0.00 0.00 52.55 52.72 2r4r s ASP 207 Cb -0.03 -0.51 0.16 0.00 1.01 0.00 0.00 42.92 43.55 2r4r s ASP 207 CO 0.01 0.20 0.43 -0.75 0.21 0.00 0.00 175.17 175.27 2r4r s LYS 208 N -1.94 0.63 0.90 8.23 2.47 -0.23 -4.95 119.74 124.84 2r4r s LYS 208 Ca 0.17 -0.56 -0.12 0.00 -1.56 0.00 0.00 55.97 53.90 2r4r s LYS 208 Cb -0.10 -0.49 0.08 0.00 -1.46 0.00 0.00 37.83 35.85 2r4r s LYS 208 CO 0.08 -1.16 0.82 1.17 0.16 0.00 0.00 175.35 176.42 2r4r n LYS 209 N 4.50 -0.23 -3.86 4.03 4.81 -1.26 -2.75 118.16 123.40 2r4r n LYS 209 Ca 0.09 -0.01 -0.33 0.00 -0.87 0.00 0.00 58.31 57.20 2r4r n LYS 209 Cb 0.48 -2.14 -0.12 0.00 0.02 0.00 0.00 35.03 33.26 2r4r n LYS 209 CO 0.00 0.00 0.00 0.42 1.17 0.00 0.00 177.40 178.99 2r4r s ILE 210 N -2.40 3.02 0.27 3.15 1.01 -0.79 -4.90 121.20 120.57 2r4r s ILE 210 Ca 0.64 -3.10 -0.29 0.00 0.00 0.00 0.00 60.65 57.89 2r4r s ILE 210 Cb -0.24 -3.05 -0.10 0.00 0.01 0.00 0.00 42.46 39.08 2r4r s ILE 210 CO 0.60 -0.82 1.30 -0.69 0.00 0.00 0.00 174.94 175.33 2r4r s VAL 211 N -0.11 2.98 0.00 2.92 1.01 -1.26 -4.82 120.40 121.12 2r4r s VAL 211 Ca 0.16 0.90 0.00 0.00 0.00 0.00 0.00 61.98 63.04 2r4r s VAL 211 Cb -0.23 -3.57 0.00 0.00 0.00 0.00 0.00 36.38 32.58 2r4r s VAL 211 CO -0.02 0.18 0.00 -0.81 0.00 0.00 0.00 175.10 174.45 2r4r n PRO 212 N 1.64 0.00 -3.82 2.72 -0.04 -1.26 -4.89 135.00 129.34 2r4r n PRO 212 Ca 0.03 0.00 -0.08 0.00 -0.04 0.00 0.00 63.50 63.41 2r4r n PRO 212 Cb 0.42 -0.39 0.02 0.00 -0.04 0.00 0.00 33.50 33.51 2r4r n PRO 212 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 2r4r s ARG 213 N 0.00 2.06 0.00 0.54 1.81 -1.26 -4.64 118.95 117.46 2r4r s ARG 213 Ca 0.00 -1.33 0.00 0.00 -1.72 0.00 0.00 55.73 52.68 2r4r s ARG 213 Cb 0.00 0.58 0.00 0.00 -0.45 0.00 0.00 34.95 35.08 2r4r s ARG 213 CO 0.00 -0.97 0.20 -0.25 -0.68 0.00 0.00 175.30 173.61 2r4r n ASP 214 N -1.39 0.06 0.00 0.23 9.92 -1.26 -4.74 116.55 119.37 2r4r n ASP 214 Ca -0.07 -0.47 0.00 0.00 -0.53 0.00 0.00 54.79 53.72 2r4r n ASP 214 Cb 0.60 -0.03 0.00 0.00 -0.64 0.00 0.00 41.12 41.05 2r4r n ASP 214 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 2r4r h GLY 216 N 0.00 0.30 1.00 0.00 0.00 -1.96 -3.50 103.07 98.91 2r4r h GLY 216 Ca 0.00 -0.76 0.00 0.00 0.00 0.00 0.00 47.33 46.57 2r4r h GLY 216 CO 0.00 0.67 0.00 0.00 0.00 0.00 0.00 176.54 177.21