#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3b4r s SER 4 N 0.00 4.38 -0.11 7.72 0.01 -1.26 -3.09 113.70 121.35 3b4r s SER 4 Ca 0.00 -1.05 0.01 0.00 1.31 0.00 0.00 55.95 56.21 3b4r s SER 4 Cb 0.00 -0.51 0.02 0.00 0.21 0.00 0.00 66.02 65.74 3b4r s SER 4 CO 0.00 -0.47 -0.12 -0.51 0.41 0.00 0.00 173.24 172.55 3b4r s ILE 5 N -2.58 1.29 0.43 1.44 2.07 -0.98 -4.91 121.20 117.97 3b4r s ILE 5 Ca 0.40 -0.48 -0.24 0.00 -1.41 0.00 0.00 60.65 58.91 3b4r s ILE 5 Cb 0.03 -1.23 -0.10 0.00 0.13 0.00 0.00 42.46 41.29 3b4r s ILE 5 CO 0.22 0.41 1.01 0.54 -1.91 0.00 0.00 174.94 175.20 3b4r n ARG 6 N 4.57 1.32 0.06 3.50 5.12 -1.26 -2.48 116.66 127.49 3b4r n ARG 6 Ca -0.17 0.48 0.00 0.00 -1.93 0.00 0.00 57.85 56.23 3b4r n ARG 6 Cb 0.51 -2.05 0.00 0.00 -1.16 0.00 0.00 32.46 29.75 3b4r n ARG 6 CO 0.00 0.00 0.00 -0.11 -1.93 0.00 0.00 177.63 175.59 3b4r n LEU 7 N 0.43 0.69 0.00 0.55 7.94 -1.08 -4.91 117.00 120.61 3b4r n LEU 7 Ca 0.10 0.19 0.00 0.00 -1.11 0.00 0.00 56.01 55.18 3b4r n LEU 7 Cb 0.40 -0.14 0.00 0.00 0.53 0.00 0.00 43.42 44.21 3b4r n LEU 7 CO 0.56 -0.66 0.00 2.22 -1.11 0.00 0.00 177.39 178.41 3b4r n PHE 8 N -3.40 0.00 -4.25 1.96 1.16 -1.24 -5.08 117.46 106.61 3b4r n PHE 8 Ca 0.00 0.00 -0.35 0.00 -1.87 0.00 0.00 57.45 55.23 3b4r n PHE 8 Cb 0.07 0.00 -0.10 0.00 -1.61 0.00 0.00 39.48 37.84 3b4r n PHE 8 CO 0.00 0.00 0.00 0.21 -1.87 0.00 0.00 176.76 175.10 3b4r s LYS 9 N -2.00 3.39 0.06 3.97 2.20 -1.26 -2.74 119.74 123.36 3b4r s LYS 9 Ca 0.00 -0.39 0.08 0.00 -0.36 0.00 0.00 55.97 55.30 3b4r s LYS 9 Cb 0.00 -2.95 -0.03 0.00 -1.51 0.00 0.00 37.83 33.34 3b4r s LYS 9 CO 0.00 0.52 -0.24 0.42 -0.36 0.00 0.00 175.35 175.70 3b4r s ILE 10 N -0.36 1.91 -0.32 5.43 1.01 -1.02 -4.73 121.20 123.12 3b4r s ILE 10 Ca 0.08 -1.35 0.00 0.00 0.00 0.00 0.00 60.65 59.38 3b4r s ILE 10 Cb -0.12 -1.66 0.00 0.00 0.01 0.00 0.00 42.46 40.69 3b4r s ILE 10 CO 0.02 0.24 0.00 0.80 0.00 0.00 0.00 174.94 176.00 3b4r n MET 11 N 1.68 -2.73 -1.73 2.79 0.00 -1.26 -0.20 117.12 115.67 3b4r n MET 11 Ca -0.17 0.18 -0.02 0.00 0.00 0.00 0.00 57.70 57.69 3b4r n MET 11 Cb 0.53 -4.70 -0.00 0.00 0.00 0.00 0.00 33.22 29.04 3b4r n MET 11 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 3b4r n GLY 12 N -0.58 0.37 2.87 -5.12 0.00 -1.26 -5.05 105.19 96.41 3b4r n GLY 12 Ca -0.04 -0.87 -0.21 0.00 0.00 0.00 0.00 46.02 44.90 3b4r n GLY 12 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3b4r s ILE 13 N -2.09 0.56 0.05 -0.61 1.01 0.73 -5.08 121.20 115.76 3b4r s ILE 13 Ca 0.00 -0.09 -0.30 0.00 0.00 0.00 0.00 60.65 60.25 3b4r s ILE 13 Cb 0.00 -0.60 -0.08 0.00 0.01 0.00 0.00 42.46 41.79 3b4r s ILE 13 CO 0.00 0.25 1.68 -2.84 0.00 0.00 0.00 174.94 174.03 3b4r s PRO 14 N 1.18 4.19 -0.31 2.79 0.02 -1.25 -2.42 135.00 139.20 3b4r s PRO 14 Ca -0.07 2.34 -0.07 0.00 0.02 0.00 0.00 61.00 63.22 3b4r s PRO 14 Cb -0.14 -3.71 0.02 0.00 0.02 0.00 0.00 34.50 30.68 3b4r s PRO 14 CO -0.01 -0.77 0.09 0.42 -0.33 0.00 0.00 177.00 176.39 3b4r s ILE 15 N 3.04 3.93 0.38 2.83 1.01 -1.11 0.10 121.20 131.38 3b4r s ILE 15 Ca 0.75 -0.79 0.08 0.00 0.00 0.00 0.00 60.65 60.69 3b4r s ILE 15 Cb -0.39 -3.07 -0.05 0.00 0.01 0.00 0.00 42.46 38.96 3b4r s ILE 15 CO 0.33 0.02 0.16 -1.61 0.00 0.00 0.00 174.94 173.84 3b4r s GLU 16 N 1.48 2.29 -0.23 2.79 0.41 0.32 -2.62 118.70 123.13 3b4r s GLU 16 Ca 0.02 -1.69 0.01 0.00 -0.41 0.00 0.00 54.97 52.89 3b4r s GLU 16 Cb -0.18 -2.08 0.06 0.00 -1.78 0.00 0.00 34.13 30.15 3b4r s GLU 16 CO 0.03 -0.01 -0.06 -0.51 -0.49 0.00 0.00 175.26 174.22 3b4r s LEU 17 N -3.88 2.57 0.63 1.80 1.02 -1.04 -1.79 118.68 117.99 3b4r s LEU 17 Ca 0.40 -1.17 -0.18 0.00 0.02 0.00 0.00 54.13 53.20 3b4r s LEU 17 Cb 0.00 -1.18 -0.02 0.00 0.02 0.00 0.00 46.19 45.01 3b4r s LEU 17 CO 0.23 -0.23 1.20 -2.28 0.02 0.00 0.00 176.35 175.28 3b4r s HIS 18 N 1.39 2.35 0.18 0.29 2.46 -1.23 -2.31 115.29 118.43 3b4r s HIS 18 Ca -0.06 1.53 -0.13 0.00 0.47 0.00 0.00 55.06 56.88 3b4r s HIS 18 Cb -0.19 -3.45 0.17 0.00 -0.13 0.00 0.00 32.58 28.99 3b4r s HIS 18 CO -0.06 -2.24 1.72 0.82 -2.47 0.00 0.00 174.74 172.51 3b4r h ILE 19 N 0.57 0.75 -0.92 0.89 2.04 -1.90 0.14 117.51 119.08 3b4r h ILE 19 Ca -0.50 -0.09 0.16 0.00 1.00 0.00 0.00 64.86 65.44 3b4r h ILE 19 Cb 1.29 0.48 -0.10 0.00 -0.74 0.00 0.00 36.82 37.75 3b4r h ILE 19 CO 0.54 0.05 0.52 0.74 0.00 0.00 0.00 178.15 179.99 3b4r h THR 20 N 0.25 0.72 -0.32 -0.27 2.02 -1.91 0.39 112.91 113.79 3b4r h THR 20 Ca 0.24 -0.24 -0.15 0.00 0.77 0.00 0.00 66.41 67.03 3b4r h THR 20 Cb 0.30 -0.03 -0.01 0.00 -1.74 0.00 0.00 68.15 66.67 3b4r h THR 20 CO -0.30 0.13 -0.40 0.15 0.37 0.00 0.00 175.52 175.46 3b4r h PHE 21 N 0.70 0.93 0.08 3.16 3.57 -1.06 -1.22 116.94 123.11 3b4r h PHE 21 Ca 0.51 -0.28 -0.00 0.00 3.53 0.00 0.00 57.97 61.73 3b4r h PHE 21 Cb 0.75 -0.20 0.00 0.00 2.79 0.00 0.00 35.95 39.29 3b4r h PHE 21 CO -0.05 1.05 -0.04 0.82 -2.23 0.00 0.00 178.31 177.86 3b4r h ILE 22 N 0.64 1.17 -0.64 1.41 2.04 0.96 0.45 117.51 123.53 3b4r h ILE 22 Ca 0.05 -1.05 0.08 0.00 1.00 0.00 0.00 64.86 64.95 3b4r h ILE 22 Cb 0.96 1.83 -0.07 0.00 -0.74 0.00 0.00 36.82 38.80 3b4r h ILE 22 CO 0.09 0.25 0.29 0.25 0.00 0.00 0.00 178.15 179.03 3b4r h LEU 23 N -0.61 0.35 -0.64 1.44 6.46 -0.38 0.69 115.31 122.64 3b4r h LEU 23 Ca -0.01 0.06 -0.00 0.00 -0.12 0.00 0.00 57.88 57.81 3b4r h LEU 23 Cb 0.50 0.01 -0.03 0.00 -0.73 0.00 0.00 40.66 40.40 3b4r h LEU 23 CO 0.02 0.21 0.39 0.15 -0.62 0.00 0.00 178.44 178.60 3b4r h PHE 24 N 0.51 0.83 -0.28 1.25 3.57 -1.11 -0.98 116.94 120.74 3b4r h PHE 24 Ca 0.31 0.00 -0.03 0.00 3.53 0.00 0.00 57.97 61.78 3b4r h PHE 24 Cb 0.33 -0.27 -0.01 0.00 2.79 0.00 0.00 35.95 38.78 3b4r h PHE 24 CO -0.13 0.56 0.05 1.25 -2.23 0.00 0.00 178.31 177.81 3b4r h LEU 25 N 0.86 0.43 -0.45 0.59 5.85 0.19 -2.24 115.31 120.54 3b4r h LEU 25 Ca 0.23 -0.25 0.08 0.00 0.84 0.00 0.00 57.88 58.77 3b4r h LEU 25 Cb -0.04 -0.12 -0.06 0.00 0.37 0.00 0.00 40.66 40.81 3b4r h LEU 25 CO -0.04 0.58 0.07 0.58 -0.34 0.00 0.00 178.44 179.28 3b4r h VAL 26 N 0.28 0.73 -0.94 1.05 2.07 0.66 0.43 116.25 120.53 3b4r h VAL 26 Ca 0.08 -0.07 0.04 0.00 0.82 0.00 0.00 66.70 67.57 3b4r h VAL 26 Cb 0.32 0.52 -0.05 0.00 -1.52 0.00 0.00 31.29 30.56 3b4r h VAL 26 CO 0.00 0.04 0.61 0.58 0.02 0.00 0.00 177.57 178.82 3b4r h VAL 27 N 0.20 1.15 0.09 2.57 2.07 -1.06 0.72 116.25 121.99 3b4r h VAL 27 Ca 0.22 -0.40 -0.00 0.00 0.82 0.00 0.00 66.70 67.34 3b4r h VAL 27 Cb 0.29 -0.12 0.00 0.00 -1.52 0.00 0.00 31.29 29.95 3b4r h VAL 27 CO -0.31 0.21 -0.04 0.40 0.02 0.00 0.00 177.57 177.85 3b4r h ILE 28 N 1.17 1.10 -1.00 4.57 2.04 -0.34 0.48 117.51 125.52 3b4r h ILE 28 Ca 0.37 -0.76 0.09 0.00 1.00 0.00 0.00 64.86 65.57 3b4r h ILE 28 Cb 0.03 1.59 -0.08 0.00 -0.74 0.00 0.00 36.82 37.62 3b4r h ILE 28 CO -0.12 0.18 0.64 0.40 0.00 0.00 0.00 178.15 179.26 3b4r h ILE 29 N -0.47 1.01 -0.47 -0.67 2.04 0.08 0.18 117.51 119.21 3b4r h ILE 29 Ca -0.01 -0.37 -0.13 0.00 1.00 0.00 0.00 64.86 65.35 3b4r h ILE 29 Cb 0.40 -0.18 -0.01 0.00 -0.74 0.00 0.00 36.82 36.29 3b4r h ILE 29 CO 0.02 0.20 -0.21 1.23 0.00 0.00 0.00 178.15 179.39 3b4r h GLY 30 N 1.09 1.04 1.85 5.37 0.00 -0.72 -2.40 103.07 109.30 3b4r h GLY 30 Ca 0.46 -0.91 0.00 0.00 0.00 0.00 0.00 47.33 46.89 3b4r h GLY 30 CO -0.22 0.83 0.00 1.04 0.00 0.00 0.00 176.54 178.19 3b4r n LEU 31 N -4.11 0.00 -0.79 3.11 4.77 0.15 -1.53 117.00 118.59 3b4r n LEU 31 Ca 0.00 0.42 0.09 0.00 -0.03 0.00 0.00 56.01 56.49 3b4r n LEU 31 Cb 0.45 -0.42 0.25 0.00 -2.33 0.00 0.00 43.42 41.37 3b4r n LEU 31 CO 0.46 -0.12 0.70 -0.24 -1.33 0.00 0.00 177.39 176.87 3b4r n SER 32 N -1.42 2.33 0.00 -1.43 2.88 -0.07 -3.86 113.62 112.04 3b4r n SER 32 Ca 0.07 -1.91 0.00 0.00 -1.33 0.00 0.00 58.87 55.70 3b4r n SER 32 Cb 0.22 -0.24 0.00 0.00 -0.75 0.00 0.00 64.21 63.44 3b4r n SER 32 CO 0.00 0.00 0.00 -0.38 -1.23 0.00 0.00 175.04 173.43 3b4r n ILE 33 N 0.76 0.00 0.24 2.46 5.41 -0.73 -4.47 119.36 123.03 3b4r n ILE 33 Ca 0.16 0.00 0.11 0.00 1.00 0.00 0.00 62.75 64.02 3b4r n ILE 33 Cb 0.39 -0.38 0.59 0.00 -0.71 0.00 0.00 39.64 39.53 3b4r n ILE 33 CO 0.00 0.00 0.00 -0.03 0.00 0.00 0.00 176.55 176.52 3b4r h MET 34 N 0.00 0.00 -4.54 0.38 4.05 -1.41 -3.44 114.93 109.98 3b4r h MET 34 Ca 0.00 0.00 -0.28 0.00 -0.28 0.00 0.00 59.70 59.14 3b4r h MET 34 Cb 0.42 0.00 -0.14 0.00 -0.80 0.00 0.00 31.60 31.08 3b4r h MET 34 CO 0.00 0.18 -0.51 -0.80 0.23 0.00 0.00 176.91 176.01 3b4r s ASN 35 N -6.17 0.53 -0.91 1.39 -0.87 -1.25 -5.05 114.94 102.60 3b4r s ASN 35 Ca -0.01 -1.44 -0.04 0.00 -1.57 0.00 0.00 52.86 49.80 3b4r s ASN 35 Cb 0.12 0.46 0.15 0.00 -0.02 0.00 0.00 41.25 41.95 3b4r s ASN 35 CO 0.61 -0.95 2.42 0.59 -2.57 0.00 0.00 177.10 177.20 3b4r n ASN 36 N -0.65 7.33 -2.91 -1.22 3.02 -1.26 -4.58 115.26 114.99 3b4r n ASN 36 Ca 0.03 -3.31 -0.32 0.00 -0.03 0.00 0.00 54.58 50.95 3b4r n ASN 36 Cb 0.64 -1.26 -0.04 0.00 -0.61 0.00 0.00 39.78 38.52 3b4r n ASN 36 CO 0.00 0.00 0.00 -1.20 -2.62 0.00 0.00 177.26 173.44 3b4r n SER 37 N 0.94 7.15 0.00 6.41 7.64 -1.26 -4.81 113.62 129.69 3b4r n SER 37 Ca 0.55 -3.13 0.00 0.00 1.01 0.00 0.00 58.87 57.30 3b4r n SER 37 Cb 0.36 -1.31 0.00 0.00 -1.01 0.00 0.00 64.21 62.25 3b4r n SER 37 CO 0.00 0.00 0.00 -0.38 -3.01 0.00 0.00 175.04 171.65 3b4r n ILE 38 N 1.38 0.00 0.15 0.44 5.41 -1.26 -2.08 119.36 123.40 3b4r n ILE 38 Ca 0.55 1.41 0.16 0.00 1.00 0.00 0.00 62.75 65.87 3b4r n ILE 38 Cb 0.43 -1.98 0.75 0.00 -0.71 0.00 0.00 39.64 38.13 3b4r n ILE 38 CO 0.00 0.00 0.00 2.19 0.00 0.00 0.00 176.55 178.74 3b4r h PHE 39 N 0.00 0.00 -0.89 1.39 -0.00 -1.96 -1.95 116.94 113.54 3b4r h PHE 39 Ca 0.00 0.00 0.09 0.00 -0.00 0.00 0.00 57.97 58.06 3b4r h PHE 39 Cb 0.00 0.00 -0.06 0.00 -0.00 0.00 0.00 35.95 35.89 3b4r h PHE 39 CO -0.62 0.00 0.58 -1.49 -0.00 0.00 0.00 178.31 176.78 3b4r h TRP 40 N 0.00 0.96 -0.04 6.09 4.06 -1.81 0.54 115.95 125.75 3b4r h TRP 40 Ca 0.12 0.03 -0.08 0.00 2.06 0.00 0.00 58.89 61.02 3b4r h TRP 40 Cb 0.57 -0.31 0.00 0.00 -1.00 0.00 0.00 29.16 28.43 3b4r h TRP 40 CO 0.00 0.45 -0.27 0.00 -3.56 0.00 0.00 178.44 175.05 3b4r h ALA 41 N 1.55 0.09 -0.95 1.49 0.00 -1.35 -2.79 119.26 117.30 3b4r h ALA 41 Ca 0.41 -0.44 0.02 0.00 0.00 0.00 0.00 54.91 54.90 3b4r h ALA 41 Cb 0.39 -0.00 -0.05 0.00 0.00 0.00 0.00 17.79 18.13 3b4r h ALA 41 CO -0.17 0.12 0.63 0.28 0.00 0.00 0.00 179.25 180.11 3b4r h VAL 42 N -0.29 1.22 0.42 0.00 2.07 -1.34 -2.39 116.25 115.93 3b4r h VAL 42 Ca -0.02 -0.43 -0.01 0.00 0.82 0.00 0.00 66.70 67.05 3b4r h VAL 42 Cb 0.95 -0.15 -0.01 0.00 -1.52 0.00 0.00 31.29 30.56 3b4r h VAL 42 CO 0.06 0.23 -0.27 0.25 0.02 0.00 0.00 177.57 177.85 3b4r h LEU 43 N 1.26 -0.69 -1.18 2.57 5.85 0.05 0.55 115.31 123.71 3b4r h LEU 43 Ca 0.36 0.05 0.28 0.00 0.84 0.00 0.00 57.88 59.40 3b4r h LEU 43 Cb -0.09 0.21 -0.12 0.00 0.37 0.00 0.00 40.66 41.03 3b4r h LEU 43 CO -0.09 -0.43 0.64 0.15 -0.34 0.00 0.00 178.44 178.37 3b4r h PHE 44 N -0.67 0.82 0.03 1.25 3.57 -1.17 0.41 116.94 121.18 3b4r h PHE 44 Ca -0.04 0.03 -0.00 0.00 3.53 0.00 0.00 57.97 61.49 3b4r h PHE 44 Cb 0.56 -0.23 0.00 0.00 2.79 0.00 0.00 35.95 39.07 3b4r h PHE 44 CO -0.11 0.01 -0.01 0.82 -2.23 0.00 0.00 178.31 176.79 3b4r h ILE 45 N 0.44 1.28 -0.32 1.41 2.04 -0.77 -2.35 117.51 119.23 3b4r h ILE 45 Ca 0.65 -0.97 0.04 0.00 1.00 0.00 0.00 64.86 65.57 3b4r h ILE 45 Cb 1.50 1.93 -0.03 0.00 -0.74 0.00 0.00 36.82 39.47 3b4r h ILE 45 CO -0.41 0.25 0.11 -0.07 0.00 0.00 0.00 178.15 178.03 3b4r h LEU 46 N -0.46 0.13 -0.03 1.44 3.38 0.13 0.15 115.31 120.04 3b4r h LEU 46 Ca -0.00 0.03 0.01 0.00 0.09 0.00 0.00 57.88 58.01 3b4r h LEU 46 Cb 0.43 0.02 -0.02 0.00 0.09 0.00 0.00 40.66 41.19 3b4r h LEU 46 CO 0.01 0.11 -0.13 0.25 0.09 0.00 0.00 178.44 178.76 3b4r h LEU 47 N 0.25 -0.43 -2.19 1.67 5.85 -0.30 0.12 115.31 120.29 3b4r h LEU 47 Ca 0.14 0.05 -0.00 0.00 0.84 0.00 0.00 57.88 58.91 3b4r h LEU 47 Cb 0.11 0.17 -0.00 0.00 0.37 0.00 0.00 40.66 41.31 3b4r h LEU 47 CO -0.15 -0.12 -0.01 -0.26 -0.34 0.00 0.00 178.44 177.56 3b4r h PHE 48 N -0.15 0.00 -0.17 1.25 -1.00 -1.26 0.14 116.94 115.76 3b4r h PHE 48 Ca 0.01 0.00 -0.01 0.00 2.81 0.00 0.00 57.97 60.78 3b4r h PHE 48 Cb 0.17 0.00 -0.01 0.00 3.61 0.00 0.00 35.95 39.72 3b4r h PHE 48 CO -0.47 0.01 0.07 0.28 -1.61 0.00 0.00 178.31 176.59 3b4r h VAL 49 N 0.00 1.16 -0.90 -0.55 2.07 -0.22 -0.34 116.25 117.47 3b4r h VAL 49 Ca -0.00 -0.48 0.04 0.00 0.82 0.00 0.00 66.70 67.08 3b4r h VAL 49 Cb 0.03 1.16 -0.06 0.00 -1.52 0.00 0.00 31.29 30.90 3b4r h VAL 49 CO 0.00 0.15 0.58 -1.28 0.02 0.00 0.00 177.57 177.04 3b4r h SER 50 N 0.12 0.95 -0.61 0.57 0.87 0.14 -1.53 113.55 114.06 3b4r h SER 50 Ca 0.06 -0.00 0.04 0.00 -1.23 0.00 0.00 61.79 60.66 3b4r h SER 50 Cb 0.18 -0.21 -0.05 0.00 -0.44 0.00 0.00 62.40 61.88 3b4r h SER 50 CO -0.00 0.64 0.35 0.58 -0.53 0.00 0.00 176.83 177.86 3b4r h VAL 51 N 1.10 1.00 -0.05 2.23 2.07 -0.40 -1.31 116.25 120.89 3b4r h VAL 51 Ca 0.37 -0.23 0.03 0.00 0.82 0.00 0.00 66.70 67.69 3b4r h VAL 51 Cb 0.05 0.28 -0.06 0.00 -1.52 0.00 0.00 31.29 30.04 3b4r h VAL 51 CO -0.13 0.12 -0.52 0.58 0.02 0.00 0.00 177.57 177.64 3b4r h VAL 52 N 0.67 0.03 -0.69 2.57 2.07 -0.02 0.32 116.25 121.19 3b4r h VAL 52 Ca 0.26 0.00 0.07 0.00 0.82 0.00 0.00 66.70 67.86 3b4r h VAL 52 Cb 0.12 0.03 -0.06 0.00 -1.52 0.00 0.00 31.29 29.85 3b4r h VAL 52 CO -0.15 0.00 0.37 -0.07 0.02 0.00 0.00 177.57 177.74 3b4r h LEU 53 N -0.63 0.52 -0.13 2.57 3.38 -1.19 -1.11 115.31 118.72 3b4r h LEU 53 Ca 0.03 0.04 0.01 0.00 0.09 0.00 0.00 57.88 58.05 3b4r h LEU 53 Cb 0.70 -0.06 -0.01 0.00 0.09 0.00 0.00 40.66 41.38 3b4r h LEU 53 CO -0.38 0.32 0.06 -0.74 0.09 0.00 0.00 178.44 177.79 3b4r h HIS 54 N 0.66 0.11 0.00 1.13 2.76 -0.60 0.41 115.15 119.61 3b4r h HIS 54 Ca 0.32 0.01 0.00 0.00 -2.20 0.00 0.00 60.37 58.50 3b4r h HIS 54 Cb 0.26 -0.03 0.00 0.00 1.55 0.00 0.00 27.41 29.19 3b4r h HIS 54 CO -0.09 0.06 0.00 0.39 -1.30 0.00 0.00 177.93 176.99 3b4r n GLU 55 N -5.04 0.78 -0.13 5.26 -0.58 0.04 -2.33 120.64 118.64 3b4r n GLU 55 Ca -0.04 0.00 -0.25 0.00 -0.42 0.00 0.00 57.16 56.45 3b4r n GLU 55 Cb 0.05 -1.11 -0.11 0.00 -0.57 0.00 0.00 31.44 29.70 3b4r n GLU 55 CO 0.00 0.00 0.00 1.28 -0.48 0.00 0.00 177.13 177.93 3b4r n LEU 56 N -0.61 2.37 -0.06 -4.62 4.77 0.01 -3.46 117.00 115.40 3b4r n LEU 56 Ca 0.04 0.16 -0.09 0.00 -0.03 0.00 0.00 56.01 56.09 3b4r n LEU 56 Cb 0.02 -0.87 -0.02 0.00 -2.33 0.00 0.00 43.42 40.22 3b4r n LEU 56 CO 0.03 0.71 0.95 1.23 -1.33 0.00 0.00 177.39 178.99 3b4r h GLY 57 N 0.21 0.33 -0.37 -0.72 0.00 -1.02 0.11 103.07 101.61 3b4r h GLY 57 Ca -0.64 -0.10 0.14 0.00 0.00 0.00 0.00 47.33 46.73 3b4r h GLY 57 CO -0.27 0.09 -0.18 0.45 0.00 0.00 0.00 176.54 176.63 3b4r h HIS 58 N 0.28 -0.38 0.46 5.60 3.86 -1.65 -2.47 115.15 120.85 3b4r h HIS 58 Ca 0.09 0.06 -0.02 0.00 -1.16 0.00 0.00 60.37 59.35 3b4r h HIS 58 Cb 0.00 0.27 -0.01 0.00 1.06 0.00 0.00 27.41 28.74 3b4r h HIS 58 CO -0.08 -0.30 -0.34 0.77 0.86 0.00 0.00 177.93 178.84 3b4r h SER 59 N -0.01 -0.90 -0.00 2.45 0.02 -1.04 -3.08 113.55 111.00 3b4r h SER 59 Ca 0.32 0.06 0.00 0.00 -0.84 0.00 0.00 61.79 61.33 3b4r h SER 59 Cb 0.50 0.28 -0.00 0.00 0.14 0.00 0.00 62.40 63.32 3b4r h SER 59 CO -0.70 -0.49 -0.00 0.00 -1.14 0.00 0.00 176.83 174.49 3b4r n TYR 60 N -4.49 -0.00 0.12 3.45 9.36 0.19 0.79 117.16 126.58 3b4r n TYR 60 Ca -0.09 0.00 0.18 0.00 3.32 0.00 0.00 57.90 61.30 3b4r n TYR 60 Cb 0.33 -0.48 0.57 0.00 -0.63 0.00 0.00 39.34 39.13 3b4r n TYR 60 CO 0.00 0.00 0.00 0.28 0.22 0.00 0.00 176.86 177.36 3b4r h VAL 61 N 0.00 0.12 0.06 2.97 2.07 -1.61 0.28 116.25 120.15 3b4r h VAL 61 Ca 0.00 0.00 -0.10 0.00 0.82 0.00 0.00 66.70 67.42 3b4r h VAL 61 Cb 0.00 0.40 0.01 0.00 -1.52 0.00 0.00 31.29 30.18 3b4r h VAL 61 CO -0.00 0.00 -0.44 0.00 0.02 0.00 0.00 177.57 177.15 3b4r h ALA 62 N 0.98 -0.03 -0.88 1.67 0.00 0.48 -3.29 119.26 118.19 3b4r h ALA 62 Ca 0.18 -0.58 0.21 0.00 0.00 0.00 0.00 54.91 54.72 3b4r h ALA 62 Cb 1.56 0.05 -0.12 0.00 0.00 0.00 0.00 17.79 19.27 3b4r h ALA 62 CO -0.00 0.20 0.37 0.87 0.00 0.00 0.00 179.25 180.69 3b4r h LYS 63 N -0.57 0.38 -1.66 0.00 1.57 0.15 0.15 116.57 116.59 3b4r h LYS 63 Ca -0.07 -0.02 0.00 0.00 -1.87 0.00 0.00 60.65 58.68 3b4r h LYS 63 Cb 1.30 -0.09 0.00 0.00 0.08 0.00 0.00 32.23 33.52 3b4r h LYS 63 CO 0.08 0.25 0.00 1.63 -0.57 0.00 0.00 179.45 180.85 3b4r n LYS 64 N -5.05 0.57 0.00 3.15 5.02 -1.06 -1.59 118.16 119.19 3b4r n LYS 64 Ca 0.21 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.50 3b4r n LYS 64 Cb 0.63 -1.21 0.00 0.00 -0.02 0.00 0.00 35.03 34.42 3b4r n LYS 64 CO 0.00 0.00 0.00 0.66 -0.52 0.00 0.00 177.40 177.54 3b4r n TYR 65 N 1.11 0.00 0.00 2.13 4.02 0.47 -5.07 117.16 119.82 3b4r n TYR 65 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.89 3b4r n TYR 65 Cb 0.29 0.00 0.00 0.00 -0.02 0.00 0.00 39.34 39.61 3b4r n TYR 65 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 3b4r n GLY 66 N -0.08 0.39 2.49 2.72 0.00 -0.62 -4.96 105.19 105.12 3b4r n GLY 66 Ca 0.00 0.40 0.00 0.00 0.00 0.00 0.00 46.02 46.42 3b4r n GLY 66 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 3b4r n VAL 67 N 0.00 0.00 0.71 1.61 0.31 -1.23 -4.49 118.33 115.25 3b4r n VAL 67 Ca 0.00 0.00 0.02 0.00 -0.01 0.00 0.00 64.34 64.35 3b4r n VAL 67 Cb 0.00 -1.34 0.09 0.00 -0.91 0.00 0.00 33.84 31.69 3b4r n VAL 67 CO 0.00 0.00 0.00 0.29 -1.32 0.00 0.00 176.83 175.80 3b4r n LYS 68 N 2.82 0.36 -2.53 5.55 4.76 -1.26 -4.62 118.16 123.24 3b4r n LYS 68 Ca 0.00 0.00 -0.42 0.00 -2.87 0.00 0.00 58.31 55.02 3b4r n LYS 68 Cb 0.00 -1.13 -0.03 0.00 -1.84 0.00 0.00 35.03 32.03 3b4r n LYS 68 CO 0.00 0.00 0.00 0.42 -1.37 0.00 0.00 177.40 176.45 3b4r s ILE 69 N -2.00 3.87 -0.14 -0.18 1.01 -1.26 -2.88 121.20 119.61 3b4r s ILE 69 Ca 0.05 0.69 -0.12 0.00 0.00 0.00 0.00 60.65 61.27 3b4r s ILE 69 Cb 0.02 -4.73 -0.04 0.00 0.01 0.00 0.00 42.46 37.72 3b4r s ILE 69 CO 0.04 -1.48 -0.23 -0.62 0.00 0.00 0.00 174.94 172.65 3b4r n GLU 70 N 8.81 0.45 -3.32 2.79 1.02 -0.68 -4.94 120.64 124.76 3b4r n GLU 70 Ca 0.08 0.38 -0.15 0.00 -0.02 0.00 0.00 57.16 57.44 3b4r n GLU 70 Cb 0.49 -1.51 -0.04 0.00 -0.02 0.00 0.00 31.44 30.36 3b4r n GLU 70 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 3b4r n LYS 71 N -4.38 0.96 -3.19 3.49 5.02 -1.25 -3.90 118.16 114.91 3b4r n LYS 71 Ca -0.09 -1.87 0.01 0.00 -2.02 0.00 0.00 58.31 54.34 3b4r n LYS 71 Cb 0.34 0.83 -0.02 0.00 -0.02 0.00 0.00 35.03 36.16 3b4r n LYS 71 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 3b4r s ILE 72 N -2.22 -0.91 -0.05 -0.18 1.01 0.11 -1.99 121.20 116.99 3b4r s ILE 72 Ca 0.07 -0.07 0.00 0.00 0.00 0.00 0.00 60.65 60.66 3b4r s ILE 72 Cb 0.00 -1.00 -0.03 0.00 0.01 0.00 0.00 42.46 41.44 3b4r s ILE 72 CO 0.05 -0.07 -0.02 -1.48 0.00 0.00 0.00 174.94 173.42 3b4r s LEU 73 N 2.76 3.44 -0.43 2.97 2.34 -0.91 0.12 118.68 128.97 3b4r s LEU 73 Ca 0.11 0.03 -0.18 0.00 0.06 0.00 0.00 54.13 54.15 3b4r s LEU 73 Cb -0.11 -1.86 0.03 0.00 -0.56 0.00 0.00 46.19 43.68 3b4r s LEU 73 CO -0.27 0.33 0.49 -0.76 -1.06 0.00 0.00 176.35 175.09 3b4r s LEU 74 N -1.15 4.81 0.13 1.48 1.43 -0.74 -1.85 118.68 122.79 3b4r s LEU 74 Ca 0.16 -0.64 -0.19 0.00 -1.03 0.00 0.00 54.13 52.43 3b4r s LEU 74 Cb -0.11 -2.45 -0.07 0.00 0.03 0.00 0.00 46.19 43.58 3b4r s LEU 74 CO 0.05 -0.64 0.63 -0.76 0.23 0.00 0.00 176.35 175.86 3b4r s LEU 75 N 2.29 4.47 0.59 1.79 1.43 -1.11 -3.51 118.68 124.63 3b4r s LEU 75 Ca 0.14 1.32 0.32 0.00 -1.03 0.00 0.00 54.13 54.88 3b4r s LEU 75 Cb -0.17 -3.16 1.19 0.00 0.03 0.00 0.00 46.19 44.08 3b4r s LEU 75 CO 0.14 0.19 1.47 1.55 0.23 0.00 0.00 176.35 179.93 3b4r h PRO 76 N 4.10 0.00 -2.71 1.29 0.13 -1.90 -1.85 132.00 131.07 3b4r h PRO 76 Ca -0.49 0.00 -0.77 0.00 -0.87 0.00 0.00 66.00 63.87 3b4r h PRO 76 Cb 1.20 0.00 -0.19 0.00 0.13 0.00 0.00 31.00 32.15 3b4r h PRO 76 CO 0.65 0.00 1.76 -0.89 -0.23 0.00 0.00 178.00 179.29 3b4r n ILE 77 N -3.49 5.35 -2.24 -3.56 -0.00 -1.26 -4.96 119.36 109.20 3b4r n ILE 77 Ca 0.25 -5.01 0.00 0.00 -0.00 0.00 0.00 62.75 57.99 3b4r n ILE 77 Cb 1.48 -1.98 0.00 0.00 -0.00 0.00 0.00 39.64 39.14 3b4r n ILE 77 CO 0.00 0.00 0.00 0.61 -0.00 0.00 0.00 176.55 177.16 3b4r n GLY 78 N 1.36 0.60 3.33 7.39 0.00 -0.69 -4.93 105.19 112.25 3b4r n GLY 78 Ca 0.50 -1.15 -0.13 0.00 0.00 0.00 0.00 46.02 45.23 3b4r n GLY 78 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3b4r s GLY 79 N 0.00 -0.32 -0.11 -0.02 0.00 -1.26 -2.76 107.32 102.86 3b4r s GLY 79 Ca 0.00 1.12 0.03 0.00 0.00 0.00 0.00 44.72 45.87 3b4r s GLY 79 CO 0.00 0.94 -0.20 0.14 0.00 0.00 0.00 173.10 173.98 3b4r s VAL 80 N -0.03 2.40 -0.58 1.40 1.01 -0.77 -4.93 120.40 118.89 3b4r s VAL 80 Ca -0.02 -0.90 -0.19 0.00 0.00 0.00 0.00 61.98 60.87 3b4r s VAL 80 Cb -0.03 -1.95 0.10 0.00 0.00 0.00 0.00 36.38 34.50 3b4r s VAL 80 CO 0.02 0.55 0.69 0.00 0.00 0.00 0.00 175.10 176.36 3b4r s ALA 81 N 0.31 3.41 -0.29 5.51 0.00 -1.26 -2.13 121.76 127.31 3b4r s ALA 81 Ca -0.15 -2.18 -0.33 0.00 0.00 0.00 0.00 51.96 49.30 3b4r s ALA 81 Cb -0.17 -3.51 -0.09 0.00 0.00 0.00 0.00 23.12 19.35 3b4r s ALA 81 CO 0.08 -2.31 2.19 -1.33 0.00 0.00 0.00 175.76 174.38 3b4r n MET 82 N 6.30 1.45 -4.18 0.00 2.81 -0.84 -4.92 117.12 117.74 3b4r n MET 82 Ca -0.09 0.40 -0.23 0.00 -1.81 0.00 0.00 57.70 55.97 3b4r n MET 82 Cb 0.43 -2.75 -0.06 0.00 -0.71 0.00 0.00 33.22 30.12 3b4r n MET 82 CO 0.00 0.00 0.00 -1.33 1.51 0.00 0.00 175.97 176.15 3b4r n MET 83 N 8.33 0.64 0.00 0.03 2.81 -1.25 -1.68 117.12 126.01 3b4r n MET 83 Ca 0.36 -3.12 0.00 0.00 -1.81 0.00 0.00 57.70 53.14 3b4r n MET 83 Cb 0.31 1.61 0.00 0.00 -0.71 0.00 0.00 33.22 34.43 3b4r n MET 83 CO 0.00 0.00 0.00 -0.25 1.51 0.00 0.00 175.97 177.23 3b4r n ASP 84 N -1.55 0.00 -4.71 7.83 8.00 -1.14 -4.94 116.55 120.05 3b4r n ASP 84 Ca -0.06 0.00 -0.43 0.00 0.71 0.00 0.00 54.79 55.01 3b4r n ASP 84 Cb 0.55 0.00 -0.01 0.00 -0.02 0.00 0.00 41.12 41.64 3b4r n ASP 84 CO 0.00 0.00 0.00 1.17 -0.39 0.00 0.00 177.20 177.98 3b4r n LYS 85 N 0.00 2.23 -3.98 -1.24 4.81 -1.26 -4.98 118.16 113.74 3b4r n LYS 85 Ca 0.00 0.78 -0.28 0.00 -0.87 0.00 0.00 58.31 57.94 3b4r n LYS 85 Cb 0.00 -2.41 -0.17 0.00 0.02 0.00 0.00 35.03 32.47 3b4r n LYS 85 CO 0.00 0.00 0.00 0.96 1.17 0.00 0.00 177.40 179.53 3b4r s ILE 86 N -0.83 1.28 0.96 3.15 -4.36 -1.26 -4.85 121.20 115.29 3b4r s ILE 86 Ca 0.58 -0.45 -0.13 0.00 -0.26 0.00 0.00 60.65 60.39 3b4r s ILE 86 Cb -0.56 -1.24 0.02 0.00 1.25 0.00 0.00 42.46 41.92 3b4r s ILE 86 CO 0.59 0.41 0.28 -2.65 0.24 0.00 0.00 174.94 173.81 3b4r n PRO 87 N 4.84 -0.29 0.00 0.37 -0.02 -1.26 -4.92 135.00 133.72 3b4r n PRO 87 Ca -0.15 -0.05 0.11 0.00 -2.02 0.00 0.00 63.50 61.40 3b4r n PRO 87 Cb 0.50 -1.77 0.10 0.00 -0.02 0.00 0.00 33.50 32.31 3b4r n PRO 87 CO 0.00 0.00 0.00 1.63 1.98 0.00 0.00 175.50 179.11 3b4r n LYS 88 N -1.29 0.93 -0.29 -0.52 5.02 -1.26 -3.81 118.16 116.93 3b4r n LYS 88 Ca 0.06 -0.71 0.07 0.00 -2.02 0.00 0.00 58.31 55.71 3b4r n LYS 88 Cb 0.54 -1.49 0.20 0.00 -0.02 0.00 0.00 35.03 34.26 3b4r n LYS 88 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 3b4r n GLU 89 N -0.41 2.72 0.00 1.97 1.02 -1.26 -4.43 120.64 120.25 3b4r n GLU 89 Ca 0.09 -2.50 0.00 0.00 -0.02 0.00 0.00 57.16 54.74 3b4r n GLU 89 Cb 0.42 -1.58 0.00 0.00 -0.02 0.00 0.00 31.44 30.25 3b4r n GLU 89 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3b4r n GLY 90 N -0.33 0.52 0.00 0.62 0.00 -1.26 -4.86 105.19 99.88 3b4r n GLY 90 Ca 0.16 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.18 3b4r n GLY 90 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3b4r n GLU 91 N -0.89 0.00 -0.16 1.61 1.02 -1.25 -1.56 120.64 119.42 3b4r n GLU 91 Ca 0.00 0.61 0.15 0.00 -0.02 0.00 0.00 57.16 57.90 3b4r n GLU 91 Cb 0.00 -1.34 0.28 0.00 -0.02 0.00 0.00 31.44 30.35 3b4r n GLU 91 CO 0.00 0.00 0.00 -0.11 1.18 0.00 0.00 177.13 178.20 3b4r n LEU 92 N -1.97 0.15 0.05 -4.62 7.94 -1.26 -0.03 117.00 117.26 3b4r n LEU 92 Ca 0.00 0.81 -0.04 0.00 -1.11 0.00 0.00 56.01 55.68 3b4r n LEU 92 Cb 0.00 -0.39 -0.02 0.00 0.53 0.00 0.00 43.42 43.55 3b4r n LEU 92 CO 0.00 -0.90 0.09 0.03 -1.11 0.00 0.00 177.39 175.50 3b4r h ARG 93 N 0.00 -0.22 -0.93 1.96 3.08 -1.78 -2.99 114.38 113.50 3b4r h ARG 93 Ca 0.40 0.02 0.26 0.00 0.07 0.00 0.00 59.98 60.73 3b4r h ARG 93 Cb 1.06 0.05 -0.04 0.00 0.08 0.00 0.00 29.97 31.11 3b4r h ARG 93 CO -0.38 -0.15 0.66 0.82 -1.07 0.00 0.00 179.97 179.85 3b4r h ILE 94 N -1.01 0.55 0.28 2.04 2.04 0.59 0.31 117.51 122.31 3b4r h ILE 94 Ca -0.02 -0.01 -0.01 0.00 1.00 0.00 0.00 64.86 65.81 3b4r h ILE 94 Cb 0.18 0.50 0.00 0.00 -0.74 0.00 0.00 36.82 36.76 3b4r h ILE 94 CO 0.04 0.01 -0.13 1.23 0.00 0.00 0.00 178.15 179.29 3b4r h GLY 95 N 0.04 -0.39 2.00 5.37 0.00 -0.84 -3.25 103.07 106.01 3b4r h GLY 95 Ca 0.45 0.14 -0.05 0.00 0.00 0.00 0.00 47.33 47.87 3b4r h GLY 95 CO -0.03 -0.14 -0.26 -2.22 0.00 0.00 0.00 176.54 173.89 3b4r h ILE 96 N -0.91 1.01 -0.89 2.60 2.04 -1.20 -3.22 117.51 116.94 3b4r h ILE 96 Ca -0.04 -0.95 0.16 0.00 1.00 0.00 0.00 64.86 65.04 3b4r h ILE 96 Cb 0.51 1.54 -0.16 0.00 -0.74 0.00 0.00 36.82 37.96 3b4r h ILE 96 CO 0.06 0.25 -0.29 0.00 0.00 0.00 0.00 178.15 178.18 3b4r h ALA 97 N 1.74 0.37 -0.04 1.87 0.00 -0.44 -0.62 119.26 122.15 3b4r h ALA 97 Ca -0.00 0.30 -0.01 0.00 0.00 0.00 0.00 54.91 55.20 3b4r h ALA 97 Cb 0.52 0.80 -0.00 0.00 0.00 0.00 0.00 17.79 19.11 3b4r h ALA 97 CO 0.03 -0.50 -0.01 0.78 0.00 0.00 0.00 179.25 179.55 3b4r h GLY 98 N -0.02 0.08 1.95 0.00 0.00 -1.67 -2.84 103.07 100.56 3b4r h GLY 98 Ca 0.38 -0.06 0.01 0.00 0.00 0.00 0.00 47.33 47.65 3b4r h GLY 98 CO -0.91 0.06 0.02 -2.55 0.00 0.00 0.00 176.54 173.15 3b4r h PRO 99 N -0.26 0.00 0.57 4.80 0.11 -1.34 -2.41 132.00 133.47 3b4r h PRO 99 Ca 0.01 0.00 -0.03 0.00 0.11 0.00 0.00 66.00 66.09 3b4r h PRO 99 Cb 0.38 0.00 0.01 0.00 0.11 0.00 0.00 31.00 31.49 3b4r h PRO 99 CO 0.00 0.00 -0.27 -0.07 -0.21 0.00 0.00 178.00 177.45 3b4r h LEU 100 N 0.00 -0.65 -0.41 2.35 3.38 -1.05 -1.16 115.31 117.77 3b4r h LEU 100 Ca 0.01 -0.04 0.05 0.00 0.09 0.00 0.00 57.88 57.99 3b4r h LEU 100 Cb 0.05 0.17 -0.07 0.00 0.09 0.00 0.00 40.66 40.90 3b4r h LEU 100 CO -0.00 -0.30 -0.46 0.58 0.09 0.00 0.00 178.44 178.34 3b4r h VAL 101 N -1.03 0.00 0.00 1.22 2.07 -1.26 0.70 116.25 117.94 3b4r h VAL 101 Ca -0.08 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.44 3b4r h VAL 101 Cb 0.65 0.00 0.00 0.00 -1.52 0.00 0.00 31.29 30.42 3b4r h VAL 101 CO 0.13 0.00 0.00 0.77 0.02 0.00 0.00 177.57 178.49 3b4r h SER 102 N -0.28 0.00 0.00 0.57 4.64 -1.49 0.30 113.55 117.29 3b4r h SER 102 Ca 0.07 0.00 -0.04 0.00 -0.47 0.00 0.00 61.79 61.35 3b4r h SER 102 Cb 0.47 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.55 3b4r h SER 102 CO -0.53 0.00 -0.26 0.15 -0.87 0.00 0.00 176.83 175.32 3b4r h PHE 103 N 0.00 0.00 0.45 4.77 3.57 0.46 -2.76 116.94 123.44 3b4r h PHE 103 Ca 0.00 0.00 -0.01 0.00 3.53 0.00 0.00 57.97 61.49 3b4r h PHE 103 Cb 0.18 0.00 -0.02 0.00 2.79 0.00 0.00 35.95 38.90 3b4r h PHE 103 CO 0.00 0.94 -0.44 0.82 -2.23 0.00 0.00 178.31 177.40 3b4r h ILE 104 N -1.00 0.00 -0.96 1.41 2.04 0.51 0.22 117.51 119.74 3b4r h ILE 104 Ca -0.07 0.00 0.30 0.00 1.00 0.00 0.00 64.86 66.09 3b4r h ILE 104 Cb 0.92 0.00 -0.15 0.00 -0.74 0.00 0.00 36.82 36.85 3b4r h ILE 104 CO -0.04 0.00 0.38 0.40 0.00 0.00 0.00 178.15 178.89 3b4r h ILE 105 N -0.89 0.23 -0.27 -0.67 2.04 -1.10 0.22 117.51 117.07 3b4r h ILE 105 Ca -0.06 -0.07 -0.16 0.00 1.00 0.00 0.00 64.86 65.57 3b4r h ILE 105 Cb 0.76 0.01 -0.01 0.00 -0.74 0.00 0.00 36.82 36.85 3b4r h ILE 105 CO -0.04 0.04 -0.48 1.23 0.00 0.00 0.00 178.15 178.89 3b4r h GLY 106 N 0.20 0.81 1.68 5.37 0.00 -0.96 -2.17 103.07 108.00 3b4r h GLY 106 Ca 0.67 -0.88 -0.14 0.00 0.00 0.00 0.00 47.33 46.98 3b4r h GLY 106 CO -0.68 0.80 -0.52 -2.22 0.00 0.00 0.00 176.54 173.91 3b4r h ILE 107 N 0.59 1.34 0.00 2.60 2.04 0.25 -2.40 117.51 121.93 3b4r h ILE 107 Ca 0.03 -1.78 0.00 0.00 1.00 0.00 0.00 64.86 64.11 3b4r h ILE 107 Cb 1.04 1.82 0.00 0.00 -0.74 0.00 0.00 36.82 38.95 3b4r h ILE 107 CO 0.10 0.54 0.00 0.52 0.00 0.00 0.00 178.15 179.31 3b4r n VAL 108 N -3.95 0.00 0.29 1.67 0.31 0.02 -2.54 118.33 114.14 3b4r n VAL 108 Ca -0.02 0.97 0.07 0.00 -0.01 0.00 0.00 64.34 65.35 3b4r n VAL 108 Cb 0.57 -1.96 0.32 0.00 -0.91 0.00 0.00 33.84 31.85 3b4r n VAL 108 CO 0.00 0.00 0.00 -0.07 -1.32 0.00 0.00 176.83 175.44 3b4r h LEU 109 N 0.00 0.00 0.02 7.52 3.38 -1.50 0.54 115.31 125.28 3b4r h LEU 109 Ca 0.00 0.00 -0.12 0.00 0.09 0.00 0.00 57.88 57.85 3b4r h LEU 109 Cb 0.00 0.00 0.01 0.00 0.09 0.00 0.00 40.66 40.76 3b4r h LEU 109 CO 0.00 0.00 -0.47 0.25 0.09 0.00 0.00 178.44 178.31 3b4r h LEU 110 N 0.00 0.37 0.37 1.67 5.85 -1.39 -1.78 115.31 120.40 3b4r h LEU 110 Ca 0.04 -0.81 -0.02 0.00 0.84 0.00 0.00 57.88 57.92 3b4r h LEU 110 Cb 1.59 -0.11 0.00 0.00 0.37 0.00 0.00 40.66 42.51 3b4r h LEU 110 CO -0.00 1.14 -0.18 0.40 -0.34 0.00 0.00 178.44 179.46 3b4r h ILE 111 N -0.36 0.62 -0.90 4.05 2.04 0.35 -3.10 117.51 120.21 3b4r h ILE 111 Ca -0.06 -0.43 0.13 0.00 1.00 0.00 0.00 64.86 65.50 3b4r h ILE 111 Cb 1.23 0.83 -0.07 0.00 -0.74 0.00 0.00 36.82 38.07 3b4r h ILE 111 CO 0.09 0.08 0.58 0.58 0.00 0.00 0.00 178.15 179.48 3b4r h VAL 112 N -0.75 0.87 0.00 1.67 2.07 -1.45 -2.31 116.25 116.36 3b4r h VAL 112 Ca -0.05 -0.26 -0.04 0.00 0.82 0.00 0.00 66.70 67.16 3b4r h VAL 112 Cb 0.51 0.04 -0.02 0.00 -1.52 0.00 0.00 31.29 30.30 3b4r h VAL 112 CO 0.08 0.14 -0.07 -1.54 0.02 0.00 0.00 177.57 176.21 3b4r n SER 113 N -4.56 4.38 0.00 0.57 3.41 -0.67 -1.08 113.62 115.67 3b4r n SER 113 Ca 0.17 -2.20 0.00 0.00 -0.26 0.00 0.00 58.87 56.58 3b4r n SER 113 Cb 0.42 -1.00 0.00 0.00 -0.26 0.00 0.00 64.21 63.37 3b4r n SER 113 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3b4r n GLN 114 N 1.87 0.00 0.00 4.33 6.02 -0.87 -4.75 117.38 123.99 3b4r n GLN 114 Ca 0.10 -0.02 0.00 0.00 -0.01 0.00 0.00 57.00 57.07 3b4r n GLN 114 Cb 0.51 -0.24 0.00 0.00 1.02 0.00 0.00 30.24 31.53 3b4r n GLN 114 CO 0.00 0.00 0.00 1.19 -1.01 0.00 0.00 177.06 177.24 3b4r n PHE 115 N 0.00 0.00 -3.65 1.08 3.01 -0.24 -5.09 117.46 112.58 3b4r n PHE 115 Ca 0.00 0.00 -0.02 0.00 1.01 0.00 0.00 57.45 58.44 3b4r n PHE 115 Cb 0.27 0.00 -0.05 0.00 -0.01 0.00 0.00 39.48 39.69 3b4r n PHE 115 CO 0.00 0.00 0.00 0.12 1.01 0.00 0.00 176.76 177.89 3b4r s PHE 116 N -0.72 -0.01 0.11 1.38 5.36 -0.44 -5.13 117.98 118.54 3b4r s PHE 116 Ca 0.00 0.03 -0.20 0.00 -0.96 0.00 0.00 56.93 55.80 3b4r s PHE 116 Cb 0.00 0.50 0.07 0.00 -0.34 0.00 0.00 43.02 43.25 3b4r s PHE 116 CO 0.00 -0.01 0.94 -0.40 -1.46 0.00 0.00 175.22 174.29 3b4r n ASP 117 N 0.94 -1.38 -4.20 6.13 5.68 -1.26 -3.76 116.55 118.71 3b4r n ASP 117 Ca -0.04 -1.64 -0.33 0.00 -0.50 0.00 0.00 54.79 52.28 3b4r n ASP 117 Cb 0.58 2.22 -0.16 0.00 -1.14 0.00 0.00 41.12 42.62 3b4r n ASP 117 CO 0.00 0.00 0.00 -0.63 -1.33 0.00 0.00 177.20 175.24 3b4r s ILE 118 N -2.11 2.17 -0.36 2.12 1.01 -1.26 -5.03 121.20 117.74 3b4r s ILE 118 Ca 0.21 -0.95 -0.17 0.00 0.00 0.00 0.00 60.65 59.75 3b4r s ILE 118 Cb -0.02 -1.87 -0.00 0.00 0.01 0.00 0.00 42.46 40.58 3b4r s ILE 118 CO 0.03 0.55 0.43 0.20 0.00 0.00 0.00 174.94 176.15 3b4r s ASN 119 N 0.72 6.23 -0.39 3.58 -0.87 -1.26 -1.97 114.94 120.97 3b4r s ASN 119 Ca -0.09 -0.22 -0.02 0.00 -1.57 0.00 0.00 52.86 50.95 3b4r s ASN 119 Cb -0.16 -2.23 0.10 0.00 -0.02 0.00 0.00 41.25 38.95 3b4r s ASN 119 CO 0.00 -0.43 0.17 -0.63 -2.57 0.00 0.00 177.10 173.65 3b4r s ILE 120 N 2.17 3.17 -1.14 0.60 -1.09 -0.75 -4.45 121.20 119.71 3b4r s ILE 120 Ca 0.14 -2.01 0.00 0.00 -2.23 0.00 0.00 60.65 56.56 3b4r s ILE 120 Cb -0.16 -3.15 0.00 0.00 -1.58 0.00 0.00 42.46 37.57 3b4r s ILE 120 CO 0.13 -0.62 0.00 0.59 -1.23 0.00 0.00 174.94 173.81 3b4r n ASN 121 N 4.57 -5.32 0.00 3.58 5.03 -1.26 -2.31 115.26 119.55 3b4r n ASN 121 Ca -0.03 0.26 0.00 0.00 0.87 0.00 0.00 54.58 55.69 3b4r n ASN 121 Cb 0.42 -3.76 0.00 0.00 -1.02 0.00 0.00 39.78 35.41 3b4r n ASN 121 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 3b4r n GLY 122 N -0.30 3.25 3.65 7.41 0.00 -1.26 -5.06 105.19 112.88 3b4r n GLY 122 Ca -0.11 -0.91 -0.48 0.00 0.00 0.00 0.00 46.02 44.53 3b4r n GLY 122 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 3b4r n TYR 123 N 0.00 2.23 -2.58 1.61 4.02 -0.98 -4.74 117.16 116.73 3b4r n TYR 123 Ca 0.00 -0.01 -0.41 0.00 -0.01 0.00 0.00 57.90 57.46 3b4r n TYR 123 Cb 0.00 -2.67 -0.03 0.00 -0.02 0.00 0.00 39.34 36.62 3b4r n TYR 123 CO 0.00 0.00 0.00 -1.25 -1.01 0.00 0.00 176.86 174.60 3b4r s PRO 124 N 4.56 3.49 0.16 -0.72 0.04 -1.26 -1.81 135.00 139.46 3b4r s PRO 124 Ca 0.95 -0.95 -0.17 0.00 0.04 0.00 0.00 61.00 60.87 3b4r s PRO 124 Cb -0.66 -5.05 0.10 0.00 0.04 0.00 0.00 34.50 28.93 3b4r s PRO 124 CO 0.49 -2.17 1.20 1.28 0.04 0.00 0.00 177.00 177.84 3b4r n LEU 125 N 8.87 -0.61 0.09 -3.56 4.77 -0.83 -0.63 117.00 125.09 3b4r n LEU 125 Ca 0.25 1.36 -0.14 0.00 -0.03 0.00 0.00 56.01 57.45 3b4r n LEU 125 Cb 0.50 -0.26 -0.08 0.00 -2.33 0.00 0.00 43.42 41.25 3b4r n LEU 125 CO 0.66 -1.18 0.51 -0.07 -1.33 0.00 0.00 177.39 175.99 3b4r h LEU 126 N 0.00 -1.33 -0.17 2.23 3.38 -1.91 -0.82 115.31 116.68 3b4r h LEU 126 Ca 0.22 0.14 0.03 0.00 0.09 0.00 0.00 57.88 58.36 3b4r h LEU 126 Cb 0.41 0.49 -0.06 0.00 0.09 0.00 0.00 40.66 41.60 3b4r h LEU 126 CO -0.75 -0.46 -0.45 0.22 0.09 0.00 0.00 178.44 177.09 3b4r h TYR 127 N -0.62 -1.35 -0.81 1.13 3.20 -1.16 -1.99 116.97 115.37 3b4r h TYR 127 Ca -0.00 0.05 0.07 0.00 3.14 0.00 0.00 58.73 61.99 3b4r h TYR 127 Cb 0.63 0.61 -0.10 0.00 1.54 0.00 0.00 36.73 39.41 3b4r h TYR 127 CO -0.44 -0.44 -0.48 2.41 -1.64 0.00 0.00 178.16 177.58 3b4r n THR 128 N -4.91 -0.55 -0.03 1.81 -1.04 0.20 -1.89 114.28 107.87 3b4r n THR 128 Ca -0.04 2.13 -0.11 0.00 -2.04 0.00 0.00 64.05 63.99 3b4r n THR 128 Cb 0.30 -2.65 -0.07 0.00 -1.82 0.00 0.00 70.33 66.09 3b4r n THR 128 CO 0.00 0.00 0.00 -0.07 -0.64 0.00 0.00 175.07 174.36 3b4r h LEU 129 N 0.00 -1.29 -0.88 -4.42 3.38 -0.47 -1.61 115.31 110.03 3b4r h LEU 129 Ca 0.13 0.16 0.14 0.00 0.09 0.00 0.00 57.88 58.40 3b4r h LEU 129 Cb 0.33 0.51 -0.14 0.00 0.09 0.00 0.00 40.66 41.45 3b4r h LEU 129 CO -0.76 -0.34 -0.33 -1.54 0.09 0.00 0.00 178.44 175.56 3b4r n SER 130 N -4.65 -0.54 -0.17 -0.43 3.41 -0.79 0.79 113.62 111.23 3b4r n SER 130 Ca -0.04 1.53 -0.04 0.00 -0.26 0.00 0.00 58.87 60.06 3b4r n SER 130 Cb 0.27 -0.36 0.03 0.00 -0.26 0.00 0.00 64.21 63.88 3b4r n SER 130 CO 0.00 0.00 0.00 0.25 -0.16 0.00 0.00 175.04 175.13 3b4r h LEU 131 N 0.00 -0.78 0.02 1.04 5.85 -0.94 0.24 115.31 120.73 3b4r h LEU 131 Ca 0.32 0.19 -0.00 0.00 0.84 0.00 0.00 57.88 59.22 3b4r h LEU 131 Cb 0.54 0.43 0.00 0.00 0.37 0.00 0.00 40.66 42.00 3b4r h LEU 131 CO -0.87 -0.25 -0.01 -0.07 -0.34 0.00 0.00 178.44 176.90 3b4r h LEU 132 N -0.10 -0.02 -0.94 2.25 4.07 0.84 -1.31 115.31 120.11 3b4r h LEU 132 Ca 0.24 -0.04 0.11 0.00 0.08 0.00 0.00 57.88 58.28 3b4r h LEU 132 Cb 0.48 0.01 -0.08 0.00 1.08 0.00 0.00 40.66 42.14 3b4r h LEU 132 CO -0.59 0.02 0.57 0.78 -1.08 0.00 0.00 178.44 178.14 3b4r h ASN 133 N -0.06 0.82 -0.36 -0.43 2.35 -0.21 0.66 115.58 118.36 3b4r h ASN 133 Ca -0.00 0.05 -0.00 0.00 -0.55 0.00 0.00 56.30 55.80 3b4r h ASN 133 Cb 0.05 -0.11 -0.02 0.00 0.05 0.00 0.00 38.32 38.30 3b4r h ASN 133 CO 0.00 0.44 0.21 -0.07 -1.65 0.00 0.00 177.43 176.37 3b4r h LEU 134 N 0.91 0.43 0.40 1.61 3.38 -0.06 1.28 115.31 123.26 3b4r h LEU 134 Ca 0.46 -0.06 -0.02 0.00 0.09 0.00 0.00 57.88 58.36 3b4r h LEU 134 Cb 0.46 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 41.10 3b4r h LEU 134 CO -0.27 0.36 -0.19 0.24 0.09 0.00 0.00 178.44 178.67 3b4r h MET 135 N 0.46 -0.52 -0.82 1.13 2.86 -0.16 0.37 114.93 118.25 3b4r h MET 135 Ca 0.13 0.04 0.19 0.00 -2.06 0.00 0.00 59.70 57.99 3b4r h MET 135 Cb 0.01 0.12 -0.05 0.00 0.06 0.00 0.00 31.60 31.74 3b4r h MET 135 CO -0.02 -0.22 0.56 1.25 1.06 0.00 0.00 176.91 179.53 3b4r h LEU 136 N -0.81 0.31 0.04 1.22 5.85 0.55 1.02 115.31 123.50 3b4r h LEU 136 Ca -0.06 0.03 -0.00 0.00 0.84 0.00 0.00 57.88 58.69 3b4r h LEU 136 Cb 0.54 -0.03 0.00 0.00 0.37 0.00 0.00 40.66 41.54 3b4r h LEU 136 CO 0.09 0.14 -0.02 1.23 -0.34 0.00 0.00 178.44 179.54 3b4r h GLY 137 N 0.32 -0.05 0.34 3.75 0.00 0.21 -3.21 103.07 104.42 3b4r h GLY 137 Ca 0.41 0.02 0.13 0.00 0.00 0.00 0.00 47.33 47.90 3b4r h GLY 137 CO -0.12 -0.02 0.52 -1.33 0.00 0.00 0.00 176.54 175.59 3b4r h GLY 138 N -0.09 1.49 1.53 4.60 0.00 0.43 -2.36 103.07 108.66 3b4r h GLY 138 Ca -0.01 -0.33 -0.06 0.00 0.00 0.00 0.00 47.33 46.93 3b4r h GLY 138 CO 0.01 0.05 -0.05 0.74 0.00 0.00 0.00 176.54 177.29 3b4r h PHE 139 N 0.78 0.61 0.00 5.60 0.04 0.91 -2.41 116.94 122.47 3b4r h PHE 139 Ca 0.47 -0.08 0.00 0.00 2.80 0.00 0.00 57.97 61.17 3b4r h PHE 139 Cb 0.58 -0.17 0.00 0.00 2.20 0.00 0.00 35.95 38.56 3b4r h PHE 139 CO -0.05 0.62 0.00 0.09 -0.60 0.00 0.00 178.31 178.37 3b4r n ASN 140 N -4.23 1.57 0.00 2.17 5.03 -0.89 -2.38 115.26 116.53 3b4r n ASN 140 Ca 0.01 -1.63 0.00 0.00 0.87 0.00 0.00 54.58 53.84 3b4r n ASN 140 Cb 0.29 -0.41 0.00 0.00 -1.02 0.00 0.00 39.78 38.64 3b4r n ASN 140 CO 0.00 0.00 0.00 0.18 -1.83 0.00 0.00 177.26 175.61 3b4r n LEU 141 N 0.33 0.40 -4.68 3.41 4.77 -0.91 -1.39 117.00 118.93 3b4r n LEU 141 Ca 0.00 -0.61 -0.42 0.00 -0.03 0.00 0.00 56.01 54.95 3b4r n LEU 141 Cb 0.30 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.36 3b4r n LEU 141 CO 0.00 0.10 1.52 -0.63 -1.33 0.00 0.00 177.39 177.05 3b4r s ILE 142 N -0.42 2.75 -0.72 -0.08 1.01 -1.00 -4.59 121.20 118.14 3b4r s ILE 142 Ca 0.00 0.06 -0.26 0.00 0.00 0.00 0.00 60.65 60.45 3b4r s ILE 142 Cb 0.00 -3.04 -0.23 0.00 0.01 0.00 0.00 42.46 39.20 3b4r s ILE 142 CO 0.00 -0.00 1.88 -0.81 0.00 0.00 0.00 174.94 176.01 3b4r n PRO 143 N 6.40 0.70 -3.94 2.79 -0.04 -1.26 -4.18 135.00 135.48 3b4r n PRO 143 Ca 0.18 -1.70 -0.10 0.00 -0.04 0.00 0.00 63.50 61.85 3b4r n PRO 143 Cb 0.39 -3.25 -0.02 0.00 -0.04 0.00 0.00 33.50 30.58 3b4r n PRO 143 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3b4r s ALA 144 N 10.32 -0.27 0.09 0.55 0.00 -1.24 -4.83 121.76 126.38 3b4r s ALA 144 Ca 0.70 -0.94 0.02 0.00 0.00 0.00 0.00 51.96 51.75 3b4r s ALA 144 Cb 0.06 0.92 -0.04 0.00 0.00 0.00 0.00 23.12 24.06 3b4r s ALA 144 CO 0.21 -0.91 0.13 -0.06 0.00 0.00 0.00 175.76 175.13 3b4r s PHE 145 N -3.10 3.30 -2.33 0.00 0.08 -1.26 -1.41 117.98 113.25 3b4r s PHE 145 Ca 0.21 0.12 0.26 0.00 0.12 0.00 0.00 56.93 57.63 3b4r s PHE 145 Cb -0.03 -1.65 1.10 0.00 -0.57 0.00 0.00 43.02 41.87 3b4r s PHE 145 CO 0.13 0.54 1.76 -0.35 -0.10 0.00 0.00 175.22 177.20 3b4r n PRO 146 N 0.26 1.54 -1.73 0.24 -0.04 -1.26 -4.34 135.00 129.67 3b4r n PRO 146 Ca -0.07 -0.79 -0.42 0.00 -0.04 0.00 0.00 63.50 62.18 3b4r n PRO 146 Cb 0.52 -1.45 0.00 0.00 -0.04 0.00 0.00 33.50 32.53 3b4r n PRO 146 CO 0.00 0.00 0.00 -1.33 -0.04 0.00 0.00 175.50 174.13 3b4r n MET 147 N -0.02 2.25 -0.32 0.54 0.00 -1.22 -4.83 117.12 113.52 3b4r n MET 147 Ca 0.19 0.79 0.29 0.00 0.00 0.00 0.00 57.70 58.97 3b4r n MET 147 Cb 0.29 -2.46 0.54 0.00 0.00 0.00 0.00 33.22 31.59 3b4r n MET 147 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 175.97 175.53 3b4r h ASP 148 N 2.54 0.32 0.00 7.83 3.32 -1.82 1.13 116.42 129.75 3b4r h ASP 148 Ca -0.48 0.24 0.00 0.00 0.02 0.00 0.00 57.03 56.81 3b4r h ASP 148 Cb 1.27 0.25 0.00 0.00 0.22 0.00 0.00 39.33 41.07 3b4r h ASP 148 CO 0.62 -0.35 0.01 0.61 -1.72 0.00 0.00 179.24 178.41 3b4r n GLY 149 N -1.28 -0.16 0.13 2.75 0.00 -0.49 -0.83 105.19 105.31 3b4r n GLY 149 Ca 0.35 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 46.17 3b4r n GLY 149 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3b4r n GLY 150 N -1.13 -0.57 0.16 -0.02 0.00 0.39 -1.97 105.19 102.04 3b4r n GLY 150 Ca 0.00 -0.26 -0.08 0.00 0.00 0.00 0.00 46.02 45.68 3b4r n GLY 150 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 3b4r h ARG 151 N 0.06 0.29 -0.06 1.61 -0.00 -1.09 -1.97 114.38 113.23 3b4r h ARG 151 Ca -0.43 -0.25 -0.01 0.00 -0.50 0.00 0.00 59.98 58.78 3b4r h ARG 151 Cb 2.02 0.06 -0.00 0.00 0.00 0.00 0.00 29.97 32.05 3b4r h ARG 151 CO 0.07 0.91 -0.01 0.82 0.00 0.00 0.00 179.97 181.76 3b4r h ILE 152 N 0.20 1.28 -0.72 2.04 2.04 -1.29 -0.42 117.51 120.64 3b4r h ILE 152 Ca -0.03 -0.88 -0.04 0.00 1.00 0.00 0.00 64.86 64.91 3b4r h ILE 152 Cb 1.32 1.76 -0.03 0.00 -0.74 0.00 0.00 36.82 39.12 3b4r h ILE 152 CO 0.12 0.24 0.28 0.25 0.00 0.00 0.00 178.15 179.04 3b4r h LEU 153 N -0.22 0.98 -0.21 1.44 5.85 -1.41 -1.95 115.31 119.79 3b4r h LEU 153 Ca 0.01 -0.15 0.00 0.00 0.84 0.00 0.00 57.88 58.59 3b4r h LEU 153 Cb 0.39 -0.25 -0.01 0.00 0.37 0.00 0.00 40.66 41.15 3b4r h LEU 153 CO 0.00 0.88 0.14 -0.09 -0.34 0.00 0.00 178.44 179.03 3b4r h ARG 154 N 1.04 0.28 0.10 1.25 2.43 -1.25 -2.15 114.38 116.07 3b4r h ARG 154 Ca 0.24 -0.02 0.01 0.00 -0.81 0.00 0.00 59.98 59.41 3b4r h ARG 154 Cb 0.21 -0.06 -0.04 0.00 -0.42 0.00 0.00 29.97 29.65 3b4r h ARG 154 CO -0.02 0.18 -0.48 0.00 -1.51 0.00 0.00 179.97 178.14 3b4r h ALA 155 N 1.08 -0.95 -0.84 2.80 0.00 -0.36 2.01 119.26 123.00 3b4r h ALA 155 Ca 0.08 -0.10 0.20 0.00 0.00 0.00 0.00 54.91 55.09 3b4r h ALA 155 Cb -0.03 0.86 -0.12 0.00 0.00 0.00 0.00 17.79 18.50 3b4r h ALA 155 CO -0.02 -1.07 0.31 0.82 0.00 0.00 0.00 179.25 179.29 3b4r h ILE 156 N -0.67 0.49 0.07 0.00 2.04 -1.34 -2.92 117.51 115.17 3b4r h ILE 156 Ca -0.00 -0.12 -0.00 0.00 1.00 0.00 0.00 64.86 65.73 3b4r h ILE 156 Cb 0.68 0.10 0.00 0.00 -0.74 0.00 0.00 36.82 36.86 3b4r h ILE 156 CO -0.27 0.06 -0.03 -0.07 0.00 0.00 0.00 178.15 177.85 3b4r h LEU 157 N 0.36 -0.08 0.00 1.44 3.38 -0.59 -3.42 115.31 116.39 3b4r h LEU 157 Ca 0.51 -0.48 0.00 0.00 0.09 0.00 0.00 57.88 58.00 3b4r h LEU 157 Cb 0.92 0.02 0.00 0.00 0.09 0.00 0.00 40.66 41.69 3b4r h LEU 157 CO -0.52 0.60 0.00 -1.20 0.09 0.00 0.00 178.44 177.41 3b4r n SER 158 N -4.79 0.00 0.00 -0.43 7.64 0.67 0.57 113.62 117.29 3b4r n SER 158 Ca -0.07 0.00 0.02 0.00 1.01 0.00 0.00 58.87 59.83 3b4r n SER 158 Cb 0.27 0.00 0.10 0.00 -1.01 0.00 0.00 64.21 63.57 3b4r n SER 158 CO 0.00 0.00 0.00 0.29 -3.01 0.00 0.00 175.04 172.32 3b4r n LYS 159 N -1.15 0.21 0.00 1.43 5.02 -1.26 -0.21 118.16 122.19 3b4r n LYS 159 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.29 3b4r n LYS 159 Cb 0.00 -1.24 0.00 0.00 -0.02 0.00 0.00 35.03 33.77 3b4r n LYS 159 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 3b4r n LYS 160 N -0.74 3.41 -0.07 1.97 5.02 0.19 -4.74 118.16 123.20 3b4r n LYS 160 Ca 0.02 0.00 0.03 0.00 -2.02 0.00 0.00 58.31 56.34 3b4r n LYS 160 Cb 0.01 -0.94 0.06 0.00 -0.02 0.00 0.00 35.03 34.15 3b4r n LYS 160 CO 0.00 0.00 0.00 0.66 -0.52 0.00 0.00 177.40 177.54 3b4r n TYR 161 N -1.84 0.17 -0.20 2.13 4.02 -1.04 -5.09 117.16 115.32 3b4r n TYR 161 Ca 0.00 -0.34 0.00 0.00 -0.01 0.00 0.00 57.90 57.55 3b4r n TYR 161 Cb 0.44 -0.03 0.00 0.00 -0.02 0.00 0.00 39.34 39.73 3b4r n TYR 161 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 3b4r n GLY 162 N 0.14 -3.41 0.33 2.72 0.00 0.70 -4.03 105.19 101.65 3b4r n GLY 162 Ca 0.05 -0.98 0.23 0.00 0.00 0.00 0.00 46.02 45.33 3b4r n GLY 162 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 3b4r h TYR 163 N 0.29 0.50 -0.05 1.61 3.20 -1.93 -1.83 116.97 118.75 3b4r h TYR 163 Ca 0.00 0.05 -0.12 0.00 3.14 0.00 0.00 58.73 61.80 3b4r h TYR 163 Cb 0.00 -0.06 0.01 0.00 1.54 0.00 0.00 36.73 38.22 3b4r h TYR 163 CO 0.00 -0.38 -0.44 1.25 -1.64 0.00 0.00 178.16 176.95 3b4r h LEU 164 N 0.08 0.48 -0.53 2.82 5.85 -1.93 -2.07 115.31 120.00 3b4r h LEU 164 Ca 0.71 -0.69 -0.05 0.00 0.84 0.00 0.00 57.88 58.70 3b4r h LEU 164 Cb 1.69 -0.14 -0.02 0.00 0.37 0.00 0.00 40.66 42.55 3b4r h LEU 164 CO -0.78 1.09 0.15 0.11 -0.34 0.00 0.00 178.44 178.67 3b4r h LYS 165 N -0.10 0.84 0.00 1.25 1.79 -1.57 0.43 116.57 119.21 3b4r h LYS 165 Ca -0.04 -0.19 -0.03 0.00 -2.18 0.00 0.00 60.65 58.21 3b4r h LYS 165 Cb 1.12 -0.11 -0.00 0.00 -1.58 0.00 0.00 32.23 31.65 3b4r h LYS 165 CO 0.09 0.79 -0.15 0.66 -1.08 0.00 0.00 179.45 179.75 3b4r h SER 166 N 0.74 0.00 0.31 0.86 4.64 -1.44 -1.10 113.55 117.56 3b4r h SER 166 Ca 0.17 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.47 3b4r h SER 166 Cb 0.31 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.40 3b4r h SER 166 CO -0.00 0.15 -0.15 0.74 -0.87 0.00 0.00 176.83 176.70 3b4r h THR 167 N 0.00 0.03 -0.98 2.95 2.02 -0.86 -3.25 112.91 112.81 3b4r h THR 167 Ca -0.00 -0.71 0.31 0.00 0.77 0.00 0.00 66.41 66.78 3b4r h THR 167 Cb 0.45 0.05 -0.15 0.00 -1.74 0.00 0.00 68.15 66.76 3b4r h THR 167 CO 0.02 0.01 0.49 0.11 0.37 0.00 0.00 175.52 176.51 3b4r h LYS 168 N -1.11 0.27 0.91 6.66 6.56 -0.56 0.19 116.57 129.50 3b4r h LYS 168 Ca -0.04 -0.02 -0.04 0.00 -1.06 0.00 0.00 60.65 59.49 3b4r h LYS 168 Cb 0.33 -0.06 0.01 0.00 -0.57 0.00 0.00 32.23 31.94 3b4r h LYS 168 CO 0.07 0.18 -0.44 0.82 -2.06 0.00 0.00 179.45 178.02 3b4r h ILE 169 N 0.28 0.09 0.02 1.86 2.04 -1.30 1.29 117.51 121.78 3b4r h ILE 169 Ca 0.70 -0.03 0.00 0.00 1.00 0.00 0.00 64.86 66.54 3b4r h ILE 169 Cb 1.58 0.09 -0.01 0.00 -0.74 0.00 0.00 36.82 37.74 3b4r h ILE 169 CO -0.63 0.00 -0.10 0.00 0.00 0.00 0.00 178.15 177.42 3b4r h ALA 170 N -1.15 -0.62 -0.99 1.87 0.00 -1.25 -1.68 119.26 115.43 3b4r h ALA 170 Ca -0.12 -0.02 0.37 0.00 0.00 0.00 0.00 54.91 55.13 3b4r h ALA 170 Cb 0.94 0.55 -0.18 0.00 0.00 0.00 0.00 17.79 19.10 3b4r h ALA 170 CO 0.20 -0.65 0.40 0.00 0.00 0.00 0.00 179.25 179.20 3b4r h ALA 171 N -1.34 1.86 -0.02 0.00 0.00 -0.93 0.17 119.26 119.00 3b4r h ALA 171 Ca -0.00 0.28 -0.00 0.00 0.00 0.00 0.00 54.91 55.19 3b4r h ALA 171 Cb 0.14 0.39 -0.00 0.00 0.00 0.00 0.00 17.79 18.32 3b4r h ALA 171 CO -0.06 -0.81 0.01 -0.91 0.00 0.00 0.00 179.25 177.49 3b4r h ASN 172 N 0.04 0.03 -0.71 0.00 2.35 0.24 -2.32 115.58 115.20 3b4r h ASN 172 Ca 0.76 -0.06 0.06 0.00 -0.55 0.00 0.00 56.30 56.51 3b4r h ASN 172 Cb 1.89 -0.01 -0.04 0.00 0.05 0.00 0.00 38.32 40.21 3b4r h ASN 172 CO -0.79 0.08 0.47 0.40 -1.65 0.00 0.00 177.43 175.94 3b4r h ILE 173 N -0.03 1.04 0.75 2.81 2.04 0.20 0.28 117.51 124.59 3b4r h ILE 173 Ca 0.01 -0.26 -0.03 0.00 1.00 0.00 0.00 64.86 65.57 3b4r h ILE 173 Cb 0.06 0.20 0.00 0.00 -0.74 0.00 0.00 36.82 36.35 3b4r h ILE 173 CO -0.00 0.14 -0.40 1.23 0.00 0.00 0.00 178.15 179.12 3b4r h GLY 174 N 0.77 -1.16 -0.62 5.37 0.00 -1.16 0.38 103.07 106.65 3b4r h GLY 174 Ca 0.30 0.45 0.32 0.00 0.00 0.00 0.00 47.33 48.40 3b4r h GLY 174 CO -0.10 -0.41 0.46 0.50 0.00 0.00 0.00 176.54 176.99 3b4r h LYS 175 N -1.06 0.22 0.58 4.80 1.57 -0.82 0.44 116.57 122.30 3b4r h LYS 175 Ca -0.10 -0.01 -0.03 0.00 -1.87 0.00 0.00 60.65 58.64 3b4r h LYS 175 Cb 0.83 -0.05 0.01 0.00 0.08 0.00 0.00 32.23 33.09 3b4r h LYS 175 CO 0.14 0.14 -0.28 0.77 -0.57 0.00 0.00 179.45 179.65 3b4r h SER 176 N 0.22 -0.66 -0.11 0.86 0.02 0.42 -0.83 113.55 113.47 3b4r h SER 176 Ca 0.71 0.02 -0.00 0.00 -0.84 0.00 0.00 61.79 61.67 3b4r h SER 176 Cb 1.62 0.17 -0.01 0.00 0.14 0.00 0.00 62.40 64.33 3b4r h SER 176 CO -0.67 -0.47 0.07 -0.07 -1.14 0.00 0.00 176.83 174.56 3b4r h LEU 177 N -0.80 0.13 0.08 5.07 3.38 0.35 -2.85 115.31 120.68 3b4r h LEU 177 Ca -0.08 -0.04 0.02 0.00 0.09 0.00 0.00 57.88 57.87 3b4r h LEU 177 Cb 0.61 -0.03 -0.04 0.00 0.09 0.00 0.00 40.66 41.28 3b4r h LEU 177 CO 0.13 0.13 -0.31 0.00 0.09 0.00 0.00 178.44 178.49 3b4r h ALA 178 N 1.00 -0.50 -0.27 1.53 0.00 -0.29 0.41 119.26 121.14 3b4r h ALA 178 Ca 0.04 -0.04 0.06 0.00 0.00 0.00 0.00 54.91 54.97 3b4r h ALA 178 Cb 0.03 0.52 -0.08 0.00 0.00 0.00 0.00 17.79 18.25 3b4r h ALA 178 CO -0.01 -0.84 -0.37 -0.07 0.00 0.00 0.00 179.25 177.96 3b4r h LEU 179 N -0.51 -1.19 -0.66 0.00 3.38 -1.12 0.33 115.31 115.54 3b4r h LEU 179 Ca 0.04 0.18 0.08 0.00 0.09 0.00 0.00 57.88 58.28 3b4r h LEU 179 Cb 0.56 0.52 -0.07 0.00 0.09 0.00 0.00 40.66 41.76 3b4r h LEU 179 CO -0.20 -0.37 0.32 0.40 0.09 0.00 0.00 178.44 178.68 3b4r h ILE 180 N -0.36 0.85 -0.39 1.22 1.08 -1.25 0.32 117.51 118.98 3b4r h ILE 180 Ca 0.12 -0.19 0.06 0.00 -0.39 0.00 0.00 64.86 64.46 3b4r h ILE 180 Cb 0.57 0.25 -0.05 0.00 -3.07 0.00 0.00 36.82 34.52 3b4r h ILE 180 CO -0.47 0.10 0.07 -0.03 -0.69 0.00 0.00 178.15 177.13 3b4r h MET 181 N 0.56 0.19 0.24 2.37 4.05 0.49 -2.19 114.93 120.63 3b4r h MET 181 Ca 0.32 -0.01 0.00 0.00 -0.28 0.00 0.00 59.70 59.73 3b4r h MET 181 Cb 0.33 -0.04 -0.02 0.00 -0.80 0.00 0.00 31.60 31.07 3b4r h MET 181 CO -0.26 0.12 -0.22 1.25 0.23 0.00 0.00 176.91 178.04 3b4r h LEU 182 N 0.19 -0.58 -1.30 3.39 5.85 0.19 -0.07 115.31 122.98 3b4r h LEU 182 Ca 0.19 0.05 0.35 0.00 0.84 0.00 0.00 57.88 59.31 3b4r h LEU 182 Cb 0.23 0.20 -0.12 0.00 0.37 0.00 0.00 40.66 41.34 3b4r h LEU 182 CO -0.26 -0.33 0.72 0.25 -0.34 0.00 0.00 178.44 178.49 3b4r h LEU 183 N -0.49 0.38 0.00 2.25 5.85 0.12 0.40 115.31 123.82 3b4r h LEU 183 Ca -0.01 0.13 -0.01 0.00 0.84 0.00 0.00 57.88 58.83 3b4r h LEU 183 Cb 0.45 0.09 -0.00 0.00 0.37 0.00 0.00 40.66 41.56 3b4r h LEU 183 CO -0.04 -0.08 -1.35 0.49 -0.34 0.00 0.00 178.44 177.12 3b4r n PHE 184 N -4.76 0.66 0.06 1.25 3.01 -0.86 -1.58 117.46 115.24 3b4r n PHE 184 Ca 0.32 0.19 -0.12 0.00 1.01 0.00 0.00 57.45 58.86 3b4r n PHE 184 Cb 1.14 -0.83 -0.01 0.00 -0.01 0.00 0.00 39.48 39.76 3b4r n PHE 184 CO 0.00 0.00 0.00 0.78 1.01 0.00 0.00 176.76 178.55 3b4r h GLY 185 N 3.98 0.44 2.00 1.37 0.00 0.11 -1.42 103.07 109.56 3b4r h GLY 185 Ca -0.02 -0.71 -0.06 0.00 0.00 0.00 0.00 47.33 46.54 3b4r h GLY 185 CO 0.00 0.63 -0.28 -2.00 0.00 0.00 0.00 176.54 174.89 3b4r h LEU 186 N 0.25 0.00 0.00 3.11 5.85 -0.43 0.38 115.31 124.47 3b4r h LEU 186 Ca -0.06 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.66 3b4r h LEU 186 Cb 1.46 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.49 3b4r h LEU 186 CO 0.15 0.28 -0.80 0.25 -0.34 0.00 0.00 178.44 177.97 3b4r h LEU 187 N 0.00 0.00 -2.20 2.25 6.46 -1.11 -3.30 115.31 117.41 3b4r h LEU 187 Ca -0.00 -0.01 0.00 0.00 -0.12 0.00 0.00 57.88 57.74 3b4r h LEU 187 Cb 1.16 0.00 0.00 0.00 -0.73 0.00 0.00 40.66 41.09 3b4r h LEU 187 CO 0.04 0.01 0.00 -1.54 -0.62 0.00 0.00 178.44 176.32 3b4r n SER 188 N -2.72 1.93 -3.95 1.25 3.41 -0.55 -5.02 113.62 107.98 3b4r n SER 188 Ca 0.01 -1.65 -0.38 0.00 -0.26 0.00 0.00 58.87 56.59 3b4r n SER 188 Cb 0.54 -0.05 0.01 0.00 -0.26 0.00 0.00 64.21 64.45 3b4r n SER 188 CO 0.00 0.00 0.00 0.23 -0.16 0.00 0.00 175.04 175.11 3b4r n MET 189 N 0.03 -0.77 -3.90 4.33 2.81 -0.06 -4.93 117.12 114.63 3b4r n MET 189 Ca 0.04 0.36 -0.30 0.00 -1.81 0.00 0.00 57.70 55.98 3b4r n MET 189 Cb 0.23 -2.53 -0.12 0.00 -0.71 0.00 0.00 33.22 30.08 3b4r n MET 189 CO 0.00 0.00 0.00 1.21 1.51 0.00 0.00 175.97 178.69 3b4r s ASN 190 N -3.32 4.68 0.09 7.83 2.47 -0.14 -5.02 114.94 121.54 3b4r s ASN 190 Ca 0.31 -3.41 -0.16 0.00 0.42 0.00 0.00 52.86 50.02 3b4r s ASN 190 Cb -0.17 -1.67 -0.02 0.00 -1.45 0.00 0.00 41.25 37.95 3b4r s ASN 190 CO 0.94 -0.17 0.84 2.30 -3.72 0.00 0.00 177.10 177.28 3b4r n ILE 191 N 2.60 -0.36 -0.24 -5.21 -5.35 -1.26 -0.61 119.36 108.93 3b4r n ILE 191 Ca 0.12 1.31 0.04 0.00 -0.27 0.00 0.00 62.75 63.96 3b4r n ILE 191 Cb 0.34 -1.63 0.16 0.00 -1.74 0.00 0.00 39.64 36.76 3b4r n ILE 191 CO 0.00 0.00 0.00 0.40 -1.76 0.00 0.00 176.55 175.19 3b4r h ILE 192 N 0.00 0.52 0.24 7.28 2.04 -1.96 0.76 117.51 126.38 3b4r h ILE 192 Ca 0.10 -0.08 0.01 0.00 1.00 0.00 0.00 64.86 65.89 3b4r h ILE 192 Cb 0.24 0.26 -0.04 0.00 -0.74 0.00 0.00 36.82 36.54 3b4r h ILE 192 CO -0.52 0.04 -0.42 0.25 0.00 0.00 0.00 178.15 177.51 3b4r h LEU 193 N 0.23 -1.20 -0.11 1.44 5.85 -1.24 0.21 115.31 120.49 3b4r h LEU 193 Ca 0.39 0.12 0.04 0.00 0.84 0.00 0.00 57.88 59.27 3b4r h LEU 193 Cb 0.65 0.43 -0.06 0.00 0.37 0.00 0.00 40.66 42.05 3b4r h LEU 193 CO -0.51 -0.52 -0.44 0.40 -0.34 0.00 0.00 178.44 177.03 3b4r h ILE 194 N -0.74 0.12 -0.88 4.05 2.04 -0.63 0.19 117.51 121.67 3b4r h ILE 194 Ca -0.00 0.00 0.18 0.00 1.00 0.00 0.00 64.86 66.03 3b4r h ILE 194 Cb 0.71 0.12 -0.11 0.00 -0.74 0.00 0.00 36.82 36.81 3b4r h ILE 194 CO -0.17 0.00 0.43 0.25 0.00 0.00 0.00 178.15 178.66 3b4r h LEU 195 N -0.52 0.47 -0.22 1.44 6.46 0.79 -0.44 115.31 123.28 3b4r h LEU 195 Ca 0.07 0.12 -0.21 0.00 -0.12 0.00 0.00 57.88 57.73 3b4r h LEU 195 Cb 0.64 0.05 0.01 0.00 -0.73 0.00 0.00 40.66 40.63 3b4r h LEU 195 CO -0.39 0.14 -0.69 1.62 -0.62 0.00 0.00 178.44 178.49 3b4r h VAL 196 N 0.54 1.28 -0.59 1.05 3.04 -0.41 -2.95 116.25 118.21 3b4r h VAL 196 Ca 0.51 -1.88 0.05 0.00 -1.01 0.00 0.00 66.70 64.37 3b4r h VAL 196 Cb 0.83 1.84 -0.03 0.00 -2.01 0.00 0.00 31.29 31.92 3b4r h VAL 196 CO -0.43 0.60 0.39 0.77 -1.01 0.00 0.00 177.57 177.90 3b4r h SER 197 N 0.59 0.53 -0.26 3.17 4.64 0.61 -1.17 113.55 121.65 3b4r h SER 197 Ca -0.03 -0.00 -0.15 0.00 -0.47 0.00 0.00 61.79 61.14 3b4r h SER 197 Cb 1.31 -0.12 -0.00 0.00 -0.31 0.00 0.00 62.40 63.28 3b4r h SER 197 CO 0.15 0.35 -0.43 -0.07 -0.87 0.00 0.00 176.83 175.96 3b4r h LEU 198 N 0.61 0.83 0.28 5.97 3.38 -1.17 -2.12 115.31 123.09 3b4r h LEU 198 Ca 0.25 -0.52 -0.01 0.00 0.09 0.00 0.00 57.88 57.69 3b4r h LEU 198 Cb 0.21 -0.24 -0.00 0.00 0.09 0.00 0.00 40.66 40.72 3b4r h LEU 198 CO -0.07 1.19 -0.17 -0.26 0.09 0.00 0.00 178.44 179.22 3b4r h PHE 199 N 0.50 -0.45 0.10 1.13 0.04 -1.09 0.66 116.94 117.83 3b4r h PHE 199 Ca 0.02 -0.00 -0.00 0.00 2.80 0.00 0.00 57.97 60.79 3b4r h PHE 199 Cb 1.02 0.16 -0.01 0.00 2.20 0.00 0.00 35.95 39.32 3b4r h PHE 199 CO 0.08 -0.27 -0.17 0.28 -0.60 0.00 0.00 178.31 177.63 3b4r h VAL 200 N -0.43 0.00 -0.34 -0.55 2.07 -1.32 0.51 116.25 116.18 3b4r h VAL 200 Ca -0.03 0.00 0.04 0.00 0.82 0.00 0.00 66.70 67.54 3b4r h VAL 200 Cb 0.36 0.00 -0.08 0.00 -1.52 0.00 0.00 31.29 30.05 3b4r h VAL 200 CO 0.03 0.00 -0.53 0.22 0.02 0.00 0.00 177.57 177.30 3b4r h TYR 201 N -0.28 -1.62 0.00 1.57 5.03 -1.32 0.73 116.97 121.07 3b4r h TYR 201 Ca -0.01 0.08 0.00 0.00 2.58 0.00 0.00 58.73 61.37 3b4r h TYR 201 Cb 0.26 0.75 0.00 0.00 1.55 0.00 0.00 36.73 39.30 3b4r h TYR 201 CO -0.24 -0.48 0.00 1.19 -1.32 0.00 0.00 178.16 177.31 3b4r n PHE 202 N -5.26 0.32 0.08 -3.82 3.72 0.22 -0.69 117.46 112.02 3b4r n PHE 202 Ca -0.04 0.15 -0.06 0.00 -0.05 0.00 0.00 57.45 57.45 3b4r n PHE 202 Cb 0.33 -0.73 -0.04 0.00 -0.94 0.00 0.00 39.48 38.10 3b4r n PHE 202 CO 0.00 0.00 0.00 0.78 -0.05 0.00 0.00 176.76 177.49 3b4r h GLY 203 N 1.06 0.01 0.68 1.37 0.00 0.27 -2.25 103.07 104.22 3b4r h GLY 203 Ca 0.00 -0.03 -0.21 0.00 0.00 0.00 0.00 47.33 47.09 3b4r h GLY 203 CO 0.00 0.03 -0.95 0.00 0.00 0.00 0.00 176.54 175.62 3b4r h ALA 204 N 1.09 -0.05 -0.77 3.60 0.00 0.97 -3.35 119.26 120.75 3b4r h ALA 204 Ca -0.01 -0.77 -0.04 0.00 0.00 0.00 0.00 54.91 54.08 3b4r h ALA 204 Cb 1.58 0.17 -0.03 0.00 0.00 0.00 0.00 17.79 19.51 3b4r h ALA 204 CO 0.12 0.47 0.33 1.49 0.00 0.00 0.00 179.25 181.66 3b4r h GLU 205 N -0.35 1.14 0.00 0.00 4.22 -1.32 -1.71 114.58 116.56 3b4r h GLU 205 Ca -0.18 -0.19 0.00 0.00 0.08 0.00 0.00 59.36 59.07 3b4r h GLU 205 Cb 1.68 -0.19 0.00 0.00 0.50 0.00 0.00 28.75 30.74 3b4r h GLU 205 CO 0.14 0.91 0.10 0.37 -2.18 0.00 0.00 179.01 178.35 3b4r h GLN 206 N 1.11 0.00 0.05 1.92 4.15 -1.53 -1.69 115.11 119.12 3b4r h GLN 206 Ca 0.26 0.00 -0.22 0.00 0.77 0.00 0.00 58.65 59.46 3b4r h GLN 206 Cb 0.18 0.00 -0.02 0.00 0.21 0.00 0.00 27.48 27.85 3b4r h GLN 206 CO -0.03 0.00 -1.17 1.49 -1.93 0.00 0.00 178.83 177.20 3b4r h GLU 207 N 0.00 0.10 0.03 1.69 4.57 -1.46 -3.28 114.58 116.24 3b4r h GLU 207 Ca 0.00 -0.17 0.01 0.00 -1.18 0.00 0.00 59.36 58.02 3b4r h GLU 207 Cb 0.21 0.06 -0.02 0.00 -0.16 0.00 0.00 28.75 28.84 3b4r h GLU 207 CO 0.00 1.08 -0.11 0.77 -1.18 0.00 0.00 179.01 179.58 3b4r h SER 208 N -0.69 -0.30 0.00 1.04 0.02 -1.28 -1.68 113.55 110.66 3b4r h SER 208 Ca -0.28 0.04 0.00 0.00 -0.84 0.00 0.00 61.79 60.71 3b4r h SER 208 Cb 1.46 0.12 0.00 0.00 0.14 0.00 0.00 62.40 64.13 3b4r h SER 208 CO -0.07 -0.16 0.00 -1.14 -1.14 0.00 0.00 176.83 174.33 3b4r n ARG 209 N -5.23 0.00 0.02 3.45 0.63 -0.71 -0.07 116.66 114.75 3b4r n ARG 209 Ca -0.06 0.67 -0.14 0.00 -0.92 0.00 0.00 57.85 57.40 3b4r n ARG 209 Cb 0.15 -1.28 -0.07 0.00 0.45 0.00 0.00 32.46 31.71 3b4r n ARG 209 CO 0.00 0.00 0.00 0.28 -2.51 0.00 0.00 177.63 175.40 3b4r h VAL 210 N 0.00 0.10 -0.01 5.15 2.07 -1.61 1.00 116.25 122.94 3b4r h VAL 210 Ca 0.00 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.52 3b4r h VAL 210 Cb 0.00 0.10 -0.00 0.00 -1.52 0.00 0.00 31.29 29.87 3b4r h VAL 210 CO 0.00 0.00 -0.03 0.58 0.02 0.00 0.00 177.57 178.14 3b4r h VAL 211 N -0.56 0.00 -0.43 2.57 2.07 -1.27 0.11 116.25 118.75 3b4r h VAL 211 Ca 0.05 0.00 0.04 0.00 0.82 0.00 0.00 66.70 67.61 3b4r h VAL 211 Cb 0.66 0.00 -0.06 0.00 -1.52 0.00 0.00 31.29 30.37 3b4r h VAL 211 CO -0.38 0.00 -0.33 -0.08 0.02 0.00 0.00 177.57 176.80 3b4r h GLU 212 N -0.03 -0.10 -0.89 1.57 4.81 -0.22 0.22 114.58 119.94 3b4r h GLU 212 Ca 0.00 0.01 0.08 0.00 -0.13 0.00 0.00 59.36 59.32 3b4r h GLU 212 Cb 0.04 0.02 -0.11 0.00 0.63 0.00 0.00 28.75 29.33 3b4r h GLU 212 CO -0.03 -0.06 -0.53 0.28 -0.73 0.00 0.00 179.01 177.94 3b4r n VAL 213 N -4.27 -0.61 -0.24 0.32 0.31 0.34 -1.28 118.33 112.91 3b4r n VAL 213 Ca -0.00 2.28 -0.10 0.00 -0.01 0.00 0.00 64.34 66.51 3b4r n VAL 213 Cb 0.17 -2.83 -0.08 0.00 -0.91 0.00 0.00 33.84 30.19 3b4r n VAL 213 CO 0.00 0.00 0.00 -0.33 -1.32 0.00 0.00 176.83 175.18 3b4r h GLU 214 N 0.00 -0.14 -0.68 5.55 5.08 0.20 -1.47 114.58 123.13 3b4r h GLU 214 Ca 0.14 0.01 0.06 0.00 -1.00 0.00 0.00 59.36 58.57 3b4r h GLU 214 Cb 0.37 0.03 -0.09 0.00 0.50 0.00 0.00 28.75 29.56 3b4r h GLU 214 CO -0.84 -0.09 -0.44 1.15 -1.00 0.00 0.00 179.01 177.79 3b4r h THR 215 N -0.14 0.00 -1.00 1.13 2.02 0.55 0.54 112.91 116.01 3b4r h THR 215 Ca 0.10 0.00 0.36 0.00 0.77 0.00 0.00 66.41 67.63 3b4r h THR 215 Cb 0.40 0.00 -0.16 0.00 -1.74 0.00 0.00 68.15 66.65 3b4r h THR 215 CO -0.64 0.00 0.55 0.40 0.37 0.00 0.00 175.52 176.20 3b4r h ILE 216 N -0.04 0.19 -0.16 3.11 2.04 -0.76 0.85 117.51 122.73 3b4r h ILE 216 Ca 0.11 -0.07 -0.14 0.00 1.00 0.00 0.00 64.86 65.76 3b4r h ILE 216 Cb 0.33 -0.03 -0.01 0.00 -0.74 0.00 0.00 36.82 36.36 3b4r h ILE 216 CO -0.66 0.04 -0.49 0.15 0.00 0.00 0.00 178.15 177.18 3b4r h PHE 217 N 0.20 0.54 -0.06 1.37 3.57 0.46 -3.06 116.94 119.96 3b4r h PHE 217 Ca 0.77 -0.18 -0.22 0.00 3.53 0.00 0.00 57.97 61.87 3b4r h PHE 217 Cb 1.87 -0.11 0.01 0.00 2.79 0.00 0.00 35.95 40.51 3b4r h PHE 217 CO -0.02 0.85 -0.87 0.87 -2.23 0.00 0.00 178.31 176.91 3b4r h LYS 218 N 0.35 0.55 -0.79 1.11 1.57 0.27 -2.77 116.57 116.87 3b4r h LYS 218 Ca 0.02 -0.52 0.00 0.00 -1.87 0.00 0.00 60.65 58.28 3b4r h LYS 218 Cb 0.99 0.13 0.00 0.00 0.08 0.00 0.00 32.23 33.43 3b4r h LYS 218 CO 0.09 1.15 0.00 0.09 -0.57 0.00 0.00 179.45 180.20 3b4r n ASN 219 N -3.83 0.79 0.00 0.86 5.03 0.45 -5.10 115.26 113.45 3b4r n ASN 219 Ca -0.07 -1.59 0.00 0.00 0.87 0.00 0.00 54.58 53.79 3b4r n ASN 219 Cb 0.79 -0.39 0.00 0.00 -1.02 0.00 0.00 39.78 39.16 3b4r n ASN 219 CO 0.00 0.00 0.00 -0.38 -1.83 0.00 0.00 177.26 175.05