#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3mep s ASN 13 N 0.00 6.49 0.25 1.08 0.01 -1.26 -4.68 114.94 116.84 3mep s ASN 13 Ca 0.00 2.44 -0.09 0.00 -0.71 0.00 0.00 52.86 54.50 3mep s ASN 13 Cb 0.00 -2.62 -0.01 0.00 0.41 0.00 0.00 41.25 39.03 3mep s ASN 13 CO 0.00 -0.70 0.41 0.28 -1.51 0.00 0.00 177.10 175.58 3mep s THR 14 N -1.35 0.00 0.21 1.60 -1.32 0.14 -4.96 115.64 109.96 3mep s THR 14 Ca 0.56 -1.55 0.06 0.00 -1.21 0.00 0.00 61.69 59.55 3mep s THR 14 Cb -0.33 -2.33 -0.04 0.00 -1.51 0.00 0.00 72.50 68.30 3mep s THR 14 CO 0.42 0.00 0.18 0.26 -2.21 0.00 0.00 174.62 173.27 3mep s TRP 15 N -3.91 3.16 -0.21 9.09 0.52 -1.26 -1.75 118.94 124.58 3mep s TRP 15 Ca 0.27 -0.06 0.01 0.00 0.02 0.00 0.00 56.10 56.34 3mep s TRP 15 Cb 0.01 -1.47 0.04 0.00 -1.15 0.00 0.00 33.47 30.90 3mep s TRP 15 CO 0.11 0.52 -0.12 0.42 0.02 0.00 0.00 176.95 177.90 3mep s ILE 16 N -1.95 1.82 -0.90 2.03 1.01 -0.43 -4.74 121.20 118.04 3mep s ILE 16 Ca 0.32 -1.13 -0.04 0.00 0.00 0.00 0.00 60.65 59.80 3mep s ILE 16 Cb -0.09 -1.86 -0.03 0.00 0.01 0.00 0.00 42.46 40.49 3mep s ILE 16 CO 0.25 0.19 0.78 0.59 0.00 0.00 0.00 174.94 176.75 3mep n ASN 17 N 4.62 -6.99 -4.72 3.58 5.03 -1.26 -2.12 115.26 113.40 3mep n ASN 17 Ca -0.16 -0.45 -0.42 0.00 0.87 0.00 0.00 54.58 54.42 3mep n ASN 17 Cb 0.46 -4.89 -0.03 0.00 -1.02 0.00 0.00 39.78 34.30 3mep n ASN 17 CO 0.00 0.00 0.00 -1.14 -1.83 0.00 0.00 177.26 174.29 3mep n ARG 18 N -2.58 2.68 -1.65 3.52 0.63 -1.26 -4.39 116.66 113.61 3mep n ARG 18 Ca -0.05 0.96 -0.31 0.00 -0.92 0.00 0.00 57.85 57.53 3mep n ARG 18 Cb 0.56 -2.78 0.04 0.00 0.45 0.00 0.00 32.46 30.74 3mep n ARG 18 CO 0.00 0.00 0.00 -1.25 -2.51 0.00 0.00 177.63 173.87 3mep s PRO 19 N 0.62 3.03 0.11 -0.14 0.04 -1.26 -5.00 135.00 132.41 3mep s PRO 19 Ca 0.72 0.87 -0.17 0.00 0.04 0.00 0.00 61.00 62.46 3mep s PRO 19 Cb -0.52 -2.01 -0.04 0.00 0.04 0.00 0.00 34.50 31.97 3mep s PRO 19 CO 0.38 -1.01 1.60 1.49 0.04 0.00 0.00 177.00 179.50 3mep h GLU 20 N -0.65 0.55 -6.43 4.56 4.81 -1.93 -3.43 114.58 112.06 3mep h GLU 20 Ca -0.44 -0.14 -0.69 0.00 -0.13 0.00 0.00 59.36 57.95 3mep h GLU 20 Cb 1.21 -0.07 -0.25 0.00 0.63 0.00 0.00 28.75 30.28 3mep h GLU 20 CO 0.58 0.62 -0.80 0.71 -0.73 0.00 0.00 179.01 179.40 3mep s TYR 21 N -5.22 2.59 0.04 0.92 2.02 -1.26 -5.11 117.35 111.33 3mep s TYR 21 Ca -0.13 -0.24 -0.28 0.00 -0.37 0.00 0.00 57.07 56.05 3mep s TYR 21 Cb 0.09 -1.57 0.10 0.00 -0.40 0.00 0.00 41.96 40.18 3mep s TYR 21 CO 0.76 0.15 1.21 -1.54 -1.57 0.00 0.00 175.55 174.55 3mep s SER 22 N -0.83 -0.04 -0.11 2.29 1.04 -1.26 -2.66 113.70 112.13 3mep s SER 22 Ca 0.12 -0.28 -0.07 0.00 0.48 0.00 0.00 55.95 56.19 3mep s SER 22 Cb -0.10 0.25 0.04 0.00 0.10 0.00 0.00 66.02 66.31 3mep s SER 22 CO 0.01 -0.49 0.26 -1.61 0.98 0.00 0.00 173.24 172.40 3mep s GLU 23 N -2.34 0.26 -0.25 4.02 2.02 -0.51 -4.96 118.70 116.94 3mep s GLU 23 Ca 0.20 0.47 -0.02 0.00 0.02 0.00 0.00 54.97 55.64 3mep s GLU 23 Cb 0.01 0.01 0.08 0.00 0.10 0.00 0.00 34.13 34.33 3mep s GLU 23 CO -0.01 -0.10 0.06 0.08 0.02 0.00 0.00 175.26 175.31 3mep s VAL 24 N 0.75 0.74 0.56 2.63 1.01 -1.26 -1.00 120.40 123.83 3mep s VAL 24 Ca -0.05 -0.97 0.05 0.00 0.00 0.00 0.00 61.98 61.01 3mep s VAL 24 Cb -0.06 -1.36 0.05 0.00 0.00 0.00 0.00 36.38 35.00 3mep s VAL 24 CO -0.05 -0.41 0.42 -0.44 0.00 0.00 0.00 175.10 174.62 3mep s SER 25 N 1.73 4.61 0.34 3.32 0.01 0.41 -5.02 113.70 119.10 3mep s SER 25 Ca 0.03 -1.29 0.09 0.00 1.31 0.00 0.00 55.95 56.09 3mep s SER 25 Cb -0.17 0.52 0.63 0.00 0.21 0.00 0.00 66.02 67.21 3mep s SER 25 CO -0.16 -1.16 1.81 1.05 0.41 0.00 0.00 173.24 175.18 3mep h GLU 26 N 0.70 0.19 -0.17 12.44 4.11 -2.03 -3.30 114.58 126.52 3mep h GLU 26 Ca -0.36 -0.07 -0.20 0.00 0.07 0.00 0.00 59.36 58.80 3mep h GLU 26 Cb 1.31 -0.01 -0.34 0.00 0.50 0.00 0.00 28.75 30.21 3mep h GLU 26 CO 0.56 0.48 -0.96 -0.40 0.07 0.00 0.00 179.01 178.76 3mep n ASP 27 N -4.13 1.55 -3.64 3.06 5.68 -1.26 -5.06 116.55 112.75 3mep n ASP 27 Ca -0.01 -2.42 -0.09 0.00 -0.50 0.00 0.00 54.79 51.77 3mep n ASP 27 Cb 0.39 -0.38 -0.07 0.00 -1.14 0.00 0.00 41.12 39.91 3mep n ASP 27 CO 0.00 0.00 0.00 -0.60 -1.33 0.00 0.00 177.20 175.27 3mep s ARG 28 N -1.74 0.68 -0.06 0.11 3.52 -1.25 -4.36 118.95 115.85 3mep s ARG 28 Ca 0.34 1.01 0.01 0.00 -0.13 0.00 0.00 55.73 56.96 3mep s ARG 28 Cb 0.37 0.23 0.02 0.00 -1.56 0.00 0.00 34.95 34.01 3mep s ARG 28 CO -0.11 -0.12 -0.05 0.42 -0.81 0.00 0.00 175.30 174.64 3mep s ILE 29 N 1.05 0.67 -0.16 4.11 1.01 -0.39 -0.45 121.20 127.04 3mep s ILE 29 Ca -0.05 -0.15 0.00 0.00 0.00 0.00 0.00 60.65 60.45 3mep s ILE 29 Cb -0.05 -0.71 0.00 0.00 0.01 0.00 0.00 42.46 41.72 3mep s ILE 29 CO -0.11 0.28 -0.16 -0.69 0.00 0.00 0.00 174.94 174.26 3mep s VAL 30 N 1.22 2.59 -0.16 2.92 1.01 -0.17 0.20 120.40 128.00 3mep s VAL 30 Ca -0.06 -0.79 0.00 0.00 0.00 0.00 0.00 61.98 61.13 3mep s VAL 30 Cb -0.14 -2.09 0.00 0.00 0.00 0.00 0.00 36.38 34.15 3mep s VAL 30 CO -0.02 0.52 -0.16 -0.63 0.00 0.00 0.00 175.10 174.81 3mep s ILE 31 N 0.88 2.53 -0.28 2.22 1.01 -0.18 -1.42 121.20 125.95 3mep s ILE 31 Ca -0.04 -0.81 -0.07 0.00 0.00 0.00 0.00 60.65 59.74 3mep s ILE 31 Cb -0.15 -2.07 0.00 0.00 0.01 0.00 0.00 42.46 40.26 3mep s ILE 31 CO -0.01 0.52 0.07 -0.69 0.00 0.00 0.00 174.94 174.82 3mep s VAL 32 N 0.97 3.93 0.58 2.92 1.01 -1.09 -0.76 120.40 127.97 3mep s VAL 32 Ca -0.02 -0.64 -0.19 0.00 0.00 0.00 0.00 61.98 61.12 3mep s VAL 32 Cb -0.15 -3.00 -0.04 0.00 0.00 0.00 0.00 36.38 33.20 3mep s VAL 32 CO -0.03 0.13 1.23 -0.94 0.00 0.00 0.00 175.10 175.49 3mep s SER 33 N 1.50 5.24 0.60 3.32 1.04 -0.61 -4.36 113.70 120.44 3mep s SER 33 Ca 0.03 2.45 -0.01 0.00 0.48 0.00 0.00 55.95 58.90 3mep s SER 33 Cb -0.17 -2.61 0.05 0.00 0.10 0.00 0.00 66.02 63.39 3mep s SER 33 CO 0.02 -1.57 0.84 -1.81 0.98 0.00 0.00 173.24 171.71 3mep s ASP 34 N -1.48 5.11 0.32 7.02 1.01 -1.26 -1.47 116.67 125.93 3mep s ASP 34 Ca 0.76 0.07 -0.29 0.00 0.71 0.00 0.00 52.55 53.80 3mep s ASP 34 Cb -0.32 -0.87 -0.11 0.00 1.01 0.00 0.00 42.92 42.63 3mep s ASP 34 CO 0.35 -1.29 1.46 0.00 0.21 0.00 0.00 175.17 175.90 3mep s ALA 35 N -2.90 3.61 -1.23 5.23 0.00 -1.26 -3.81 121.76 121.40 3mep s ALA 35 Ca 0.59 1.46 -0.21 0.00 0.00 0.00 0.00 51.96 53.80 3mep s ALA 35 Cb -0.10 -3.58 0.01 0.00 0.00 0.00 0.00 23.12 19.45 3mep s ALA 35 CO 0.40 -0.90 0.65 0.09 0.00 0.00 0.00 175.76 176.01 3mep n ASN 36 N 1.25 -3.77 -4.76 0.00 3.02 -0.68 -4.98 115.26 105.35 3mep n ASN 36 Ca 0.03 -1.13 -0.35 0.00 -0.03 0.00 0.00 54.58 53.11 3mep n ASN 36 Cb 0.40 -2.66 -0.08 0.00 -0.61 0.00 0.00 39.78 36.83 3mep n ASN 36 CO 0.00 0.00 0.00 0.42 -2.62 0.00 0.00 177.26 175.06 3mep s THR 37 N -3.62 4.74 0.11 3.41 -4.23 -0.08 -4.83 115.64 111.13 3mep s THR 37 Ca 0.38 -0.16 -0.26 0.00 -1.18 0.00 0.00 61.69 60.47 3mep s THR 37 Cb -0.17 -3.05 0.08 0.00 1.34 0.00 0.00 72.50 70.70 3mep s THR 37 CO 0.91 0.55 1.07 -0.62 -0.54 0.00 0.00 174.62 175.99 3mep s ASP 38 N -1.13 -0.12 -0.16 3.99 2.15 -1.26 -1.63 116.67 118.52 3mep s ASP 38 Ca 0.16 -0.36 -0.02 0.00 0.43 0.00 0.00 52.55 52.77 3mep s ASP 38 Cb -0.12 0.39 0.05 0.00 -0.30 0.00 0.00 42.92 42.94 3mep s ASP 38 CO 0.05 -0.73 -0.00 -0.36 -0.17 0.00 0.00 175.17 173.96 3mep s PHE 39 N -2.89 1.18 -0.23 -5.34 0.08 -1.26 -1.27 117.98 108.25 3mep s PHE 39 Ca 0.14 -0.78 -0.27 0.00 0.12 0.00 0.00 56.93 56.15 3mep s PHE 39 Cb 0.00 -1.08 0.10 0.00 -0.57 0.00 0.00 43.02 41.48 3mep s PHE 39 CO 0.01 -0.55 0.89 -0.46 -0.10 0.00 0.00 175.22 175.01 3mep s TRP 40 N 1.80 -0.57 -0.25 0.36 -0.11 -0.46 -4.95 118.94 114.75 3mep s TRP 40 Ca 0.01 1.30 -0.01 0.00 1.22 0.00 0.00 56.10 58.62 3mep s TRP 40 Cb -0.15 0.36 0.08 0.00 -1.50 0.00 0.00 33.47 32.25 3mep s TRP 40 CO -0.07 -0.34 0.03 -2.00 -4.62 0.00 0.00 176.95 169.95 3mep s GLU 41 N -0.12 1.02 0.00 5.86 2.56 -1.26 -0.22 118.70 126.53 3mep s GLU 41 Ca -0.00 -0.90 0.00 0.00 0.00 0.00 0.00 54.97 54.07 3mep s GLU 41 Cb -0.04 -2.28 0.00 0.00 2.00 0.00 0.00 34.13 33.81 3mep s GLU 41 CO -0.01 -0.76 0.00 0.09 -0.56 0.00 0.00 175.26 174.02 3mep n ASN 42 N 4.82 0.00 -1.57 -1.70 5.03 -0.67 -2.00 115.26 119.17 3mep n ASN 42 Ca -0.07 0.00 -0.22 0.00 0.87 0.00 0.00 54.58 55.16 3mep n ASN 42 Cb 0.44 0.00 -0.04 0.00 -1.02 0.00 0.00 39.78 39.16 3mep n ASN 42 CO 0.00 0.00 0.00 0.41 -1.83 0.00 0.00 177.26 175.84 3mep n THR 43 N 0.00 0.00 0.00 3.41 -1.04 -1.26 -0.39 114.28 115.00 3mep n THR 43 Ca 0.00 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.01 3mep n THR 43 Cb 0.00 -0.17 0.00 0.00 -1.82 0.00 0.00 70.33 68.34 3mep n THR 43 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 3mep n TYR 44 N 1.92 0.00 0.28 -1.42 9.36 -1.26 -4.24 117.16 121.80 3mep n TYR 44 Ca 0.14 0.00 0.17 0.00 3.32 0.00 0.00 57.90 61.53 3mep n TYR 44 Cb -0.02 0.00 0.80 0.00 -0.63 0.00 0.00 39.34 39.49 3mep n TYR 44 CO 0.00 0.00 0.00 1.88 0.22 0.00 0.00 176.86 178.96 3mep h TYR 45 N 0.00 0.00 -2.00 2.98 0.05 -1.96 -3.47 116.97 112.57 3mep h TYR 45 Ca 0.00 0.00 -0.32 0.00 0.05 0.00 0.00 58.73 58.46 3mep h TYR 45 Cb 0.00 0.00 -0.04 0.00 1.01 0.00 0.00 36.73 37.70 3mep h TYR 45 CO 0.00 0.05 -0.39 -0.25 -1.05 0.00 0.00 178.16 176.52 3mep n ASP 46 N -3.25 -4.81 -4.21 3.88 8.00 0.47 -5.02 116.55 111.62 3mep n ASP 46 Ca -0.01 0.06 -0.13 0.00 0.71 0.00 0.00 54.79 55.42 3mep n ASP 46 Cb 0.25 -3.89 -0.10 0.00 -0.02 0.00 0.00 41.12 37.36 3mep n ASP 46 CO 0.00 0.00 0.00 0.72 -0.39 0.00 0.00 177.20 177.53 3mep s PHE 47 N -2.76 1.13 -0.30 1.24 -0.12 -1.26 -4.93 117.98 110.98 3mep s PHE 47 Ca 0.00 -0.76 0.02 0.00 -0.05 0.00 0.00 56.93 56.13 3mep s PHE 47 Cb 0.00 -0.60 0.07 0.00 -0.63 0.00 0.00 43.02 41.86 3mep s PHE 47 CO 0.00 0.01 -0.02 0.45 -0.05 0.00 0.00 175.22 175.61 3mep s SER 48 N -2.94 4.70 -0.15 1.98 0.15 -1.26 -1.67 113.70 114.51 3mep s SER 48 Ca 0.12 -1.63 -0.05 0.00 0.70 0.00 0.00 55.95 55.09 3mep s SER 48 Cb 0.02 -1.63 -0.03 0.00 -1.71 0.00 0.00 66.02 62.66 3mep s SER 48 CO -0.01 -0.29 0.00 -1.00 1.20 0.00 0.00 173.24 173.15 3mep s HIS 49 N 1.08 3.13 -0.38 3.44 3.76 0.69 -4.97 115.29 122.04 3mep s HIS 49 Ca -0.01 -0.08 0.12 0.00 -0.15 0.00 0.00 55.06 54.93 3mep s HIS 49 Cb -0.20 -1.97 0.37 0.00 1.11 0.00 0.00 32.58 31.89 3mep s HIS 49 CO -0.05 0.12 0.93 0.98 -0.85 0.00 0.00 174.74 175.87 3mep n TYR 50 N 3.28 -0.58 -0.14 1.40 9.36 -1.20 -1.36 117.16 127.91 3mep n TYR 50 Ca -0.17 -3.04 0.00 0.00 3.32 0.00 0.00 57.90 58.01 3mep n TYR 50 Cb 0.53 0.26 0.00 0.00 -0.63 0.00 0.00 39.34 39.49 3mep n TYR 50 CO 0.00 0.00 0.00 0.25 0.22 0.00 0.00 176.86 177.33 3mep n THR 51 N 0.14 0.45 -1.32 2.97 -2.24 -0.40 -4.97 114.28 108.92 3mep n THR 51 Ca 0.15 -0.66 -0.32 0.00 -2.27 0.00 0.00 64.05 60.95 3mep n THR 51 Cb 0.72 0.84 0.09 0.00 -2.10 0.00 0.00 70.33 69.88 3mep n THR 51 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 3mep s GLY 52 N -0.45 1.86 -0.13 3.38 0.00 -0.93 -4.27 107.32 106.78 3mep s GLY 52 Ca 0.00 0.44 -0.13 0.00 0.00 0.00 0.00 44.72 45.03 3mep s GLY 52 CO 0.00 0.81 0.29 0.30 0.00 0.00 0.00 173.10 174.50 3mep s HIS 53 N -2.64 3.51 -0.01 1.90 0.09 -1.06 -4.46 115.29 112.63 3mep s HIS 53 Ca 0.65 0.64 0.00 0.00 -0.00 0.00 0.00 55.06 56.35 3mep s HIS 53 Cb -0.20 -2.29 0.02 0.00 -0.00 0.00 0.00 32.58 30.11 3mep s HIS 53 CO 0.52 0.34 0.01 0.08 -0.00 0.00 0.00 174.74 175.69 3mep s VAL 54 N 0.11 0.02 -0.14 -0.90 1.01 -0.90 -1.87 120.40 117.72 3mep s VAL 54 Ca 0.17 0.11 0.01 0.00 0.00 0.00 0.00 61.98 62.27 3mep s VAL 54 Cb -0.13 -0.10 0.02 0.00 0.00 0.00 0.00 36.38 36.16 3mep s VAL 54 CO 0.05 0.07 -0.15 -0.47 0.00 0.00 0.00 175.10 174.60 3mep s TYR 55 N 0.69 2.17 0.00 5.22 5.04 -0.47 -1.32 117.35 128.69 3mep s TYR 55 Ca -0.06 -1.18 0.00 0.00 -2.44 0.00 0.00 57.07 53.39 3mep s TYR 55 Cb -0.09 -1.58 0.00 0.00 0.35 0.00 0.00 41.96 40.64 3mep s TYR 55 CO -0.02 -0.63 0.00 0.41 -1.34 0.00 0.00 175.55 173.97 3mep n GLY 56 N 4.60 1.45 3.39 8.97 0.00 -0.72 -1.30 105.19 121.59 3mep n GLY 56 Ca -0.18 -0.08 -0.13 0.00 0.00 0.00 0.00 46.02 45.63 3mep n GLY 56 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3mep s LYS 57 N 3.91 1.09 0.24 1.61 -2.85 -0.86 0.27 119.74 123.14 3mep s LYS 57 Ca 0.00 -0.34 -0.20 0.00 -1.00 0.00 0.00 55.97 54.43 3mep s LYS 57 Cb 0.00 0.50 -0.08 0.00 -2.06 0.00 0.00 37.83 36.18 3mep s LYS 57 CO 0.00 -0.42 0.74 -1.21 0.10 0.00 0.00 175.35 174.56 3mep s GLU 58 N -2.89 4.26 -0.00 1.78 2.02 -1.26 -1.61 118.70 120.99 3mep s GLU 58 Ca -0.03 0.89 -0.10 0.00 0.02 0.00 0.00 54.97 55.75 3mep s GLU 58 Cb -0.00 -2.84 0.01 0.00 0.10 0.00 0.00 34.13 31.40 3mep s GLU 58 CO -0.05 0.37 0.19 -0.08 0.02 0.00 0.00 175.26 175.71 3mep s THR 59 N -1.56 0.08 -0.13 3.63 -1.32 -0.08 -4.92 115.64 111.34 3mep s THR 59 Ca 0.44 -0.63 0.14 0.00 -1.21 0.00 0.00 61.69 60.44 3mep s THR 59 Cb -0.16 -0.49 0.24 0.00 -1.51 0.00 0.00 72.50 70.58 3mep s THR 59 CO 0.21 -0.34 1.14 -0.62 -2.21 0.00 0.00 174.62 172.79 3mep n GLU 60 N 1.39 1.89 -4.45 7.08 1.02 -1.26 -1.19 120.64 125.12 3mep n GLU 60 Ca -0.22 -2.32 -0.22 0.00 -0.02 0.00 0.00 57.16 54.38 3mep n GLU 60 Cb 0.56 -1.40 -0.10 0.00 -0.02 0.00 0.00 31.44 30.47 3mep n GLU 60 CO 0.00 0.00 0.00 -1.54 1.18 0.00 0.00 177.13 176.77 3mep s SER 61 N -2.28 2.75 0.82 1.62 1.04 -1.26 -4.91 113.70 111.48 3mep s SER 61 Ca 0.25 -1.26 -0.12 0.00 0.48 0.00 0.00 55.95 55.30 3mep s SER 61 Cb 0.21 -0.16 0.09 0.00 0.10 0.00 0.00 66.02 66.26 3mep s SER 61 CO 0.03 -0.43 1.15 -1.81 0.98 0.00 0.00 173.24 173.17 3mep s ASP 62 N -3.48 3.69 0.12 7.02 1.01 -1.26 -5.03 116.67 118.75 3mep s ASP 62 Ca 0.32 2.17 -0.26 0.00 0.71 0.00 0.00 52.55 55.49 3mep s ASP 62 Cb 0.06 -2.57 0.07 0.00 1.01 0.00 0.00 42.92 41.49 3mep s ASP 62 CO 0.13 -2.59 0.97 0.72 0.21 0.00 0.00 175.17 174.62 3mep s PHE 63 N -2.48 -0.15 -0.08 4.23 -0.12 -0.52 -4.54 117.98 114.33 3mep s PHE 63 Ca 0.68 -0.12 -0.00 0.00 -0.05 0.00 0.00 56.93 57.44 3mep s PHE 63 Cb -0.24 0.62 0.02 0.00 -0.63 0.00 0.00 43.02 42.80 3mep s PHE 63 CO 0.53 -0.76 -0.05 0.99 -0.05 0.00 0.00 175.22 175.89 3mep s THR 64 N -3.21 0.71 -0.07 -4.49 2.01 0.32 -0.57 115.64 110.35 3mep s THR 64 Ca 0.12 -0.13 0.03 0.00 0.31 0.00 0.00 61.69 62.02 3mep s THR 64 Cb -0.01 -0.77 -0.02 0.00 0.01 0.00 0.00 72.50 71.71 3mep s THR 64 CO 0.01 0.30 -0.15 0.12 -0.69 0.00 0.00 174.62 174.20 3mep s PHE 65 N 1.55 2.69 -0.02 4.92 5.36 0.11 -0.81 117.98 131.78 3mep s PHE 65 Ca 0.00 -0.32 -0.04 0.00 -0.96 0.00 0.00 56.93 55.61 3mep s PHE 65 Cb -0.13 -1.67 0.01 0.00 -0.34 0.00 0.00 43.02 40.89 3mep s PHE 65 CO -0.04 0.06 0.09 -1.14 -1.46 0.00 0.00 175.22 172.72 3mep s GLN 66 N -0.45 0.19 -0.04 10.12 0.74 -0.64 -0.06 119.66 129.53 3mep s GLN 66 Ca 0.05 -0.03 -0.24 0.00 0.05 0.00 0.00 55.36 55.19 3mep s GLN 66 Cb -0.12 0.08 0.05 0.00 1.10 0.00 0.00 33.01 34.13 3mep s GLN 66 CO 0.02 -0.03 0.53 0.54 -0.55 0.00 0.00 175.29 175.79 3mep s VAL 67 N -0.34 0.02 -0.20 1.34 0.11 -1.26 -1.14 120.40 118.93 3mep s VAL 67 Ca -0.04 -0.19 -0.07 0.00 -2.93 0.00 0.00 61.98 58.74 3mep s VAL 67 Cb -0.03 -0.84 -0.04 0.00 -1.53 0.00 0.00 36.38 33.94 3mep s VAL 67 CO 0.00 -0.11 0.07 -0.60 -3.33 0.00 0.00 175.10 171.13 3mep s ARG 68 N -1.24 3.87 -0.13 1.54 3.52 -0.47 -4.33 118.95 121.70 3mep s ARG 68 Ca -0.12 -0.39 -0.02 0.00 -0.13 0.00 0.00 55.73 55.06 3mep s ARG 68 Cb -0.02 -3.25 -0.03 0.00 -1.56 0.00 0.00 34.95 30.09 3mep s ARG 68 CO 0.08 0.12 -0.05 0.08 -0.81 0.00 0.00 175.30 174.71 3mep s VAL 69 N 0.79 3.78 -0.36 7.11 1.01 0.12 -1.67 120.40 131.19 3mep s VAL 69 Ca 0.03 -0.41 -0.00 0.00 0.00 0.00 0.00 61.98 61.60 3mep s VAL 69 Cb -0.14 -2.63 0.12 0.00 0.00 0.00 0.00 36.38 33.74 3mep s VAL 69 CO 0.02 0.52 0.17 -0.54 0.00 0.00 0.00 175.10 175.27 3mep s LYS 70 N 0.10 0.81 0.20 2.72 1.02 -0.19 -1.92 119.74 122.49 3mep s LYS 70 Ca -0.01 -1.37 0.09 0.00 0.02 0.00 0.00 55.97 54.70 3mep s LYS 70 Cb -0.14 -1.88 -0.05 0.00 -0.52 0.00 0.00 37.83 35.25 3mep s LYS 70 CO 0.03 -1.09 -0.18 0.00 -0.92 0.00 0.00 175.35 173.19 3mep s ALA 71 N 1.15 2.22 -1.10 5.17 0.00 -1.26 -1.35 121.76 126.59 3mep s ALA 71 Ca 0.14 -1.64 -0.06 0.00 0.00 0.00 0.00 51.96 50.40 3mep s ALA 71 Cb -0.21 -0.18 0.30 0.00 0.00 0.00 0.00 23.12 23.03 3mep s ALA 71 CO -0.13 0.21 1.33 -0.25 0.00 0.00 0.00 175.76 176.92 3mep n ASP 72 N -0.10 6.05 -4.77 0.00 8.00 -1.21 -4.45 116.55 120.06 3mep n ASP 72 Ca -0.10 -3.25 -0.41 0.00 0.71 0.00 0.00 54.79 51.74 3mep n ASP 72 Cb 0.59 -1.32 -0.00 0.00 -0.02 0.00 0.00 41.12 40.36 3mep n ASP 72 CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 3mep s PHE 73 N -2.15 2.71 0.00 1.24 0.08 -1.26 -4.80 117.98 113.80 3mep s PHE 73 Ca 0.31 1.26 0.00 0.00 0.12 0.00 0.00 56.93 58.62 3mep s PHE 73 Cb -0.02 -3.90 0.00 0.00 -0.57 0.00 0.00 43.02 38.53 3mep s PHE 73 CO 0.03 -2.63 0.00 -1.13 -0.10 0.00 0.00 175.22 171.39 3mep n SER 74 N 0.46 0.00 -4.87 1.36 3.41 -1.26 -5.11 113.62 107.62 3mep n SER 74 Ca 0.01 0.00 -0.31 0.00 -0.26 0.00 0.00 58.87 58.31 3mep n SER 74 Cb 0.40 0.36 -0.03 0.00 -0.26 0.00 0.00 64.21 64.68 3mep n SER 74 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3mep s ALA 75 N -1.74 3.28 0.21 7.33 0.00 -1.26 -4.99 121.76 124.60 3mep s ALA 75 Ca 0.00 -0.09 -0.32 0.00 0.00 0.00 0.00 51.96 51.54 3mep s ALA 75 Cb 0.00 -2.80 -0.14 0.00 0.00 0.00 0.00 23.12 20.18 3mep s ALA 75 CO 0.00 -0.03 1.42 -0.11 0.00 0.00 0.00 175.76 177.04 3mep n LEU 76 N -1.28 2.88 -0.22 0.00 7.94 -1.26 -2.17 117.00 122.89 3mep n LEU 76 Ca 0.03 1.13 -0.03 0.00 -1.11 0.00 0.00 56.01 56.03 3mep n LEU 76 Cb 0.54 -1.40 -0.01 0.00 0.53 0.00 0.00 43.42 43.08 3mep n LEU 76 CO 0.47 -0.55 -0.03 -1.22 -1.11 0.00 0.00 177.39 174.95 3mep n TYR 77 N 2.23 0.00 -1.79 1.96 4.01 0.47 -3.97 117.16 120.07 3mep n TYR 77 Ca 0.13 0.00 -0.42 0.00 -0.16 0.00 0.00 57.90 57.45 3mep n TYR 77 Cb 0.30 -1.12 -0.03 0.00 -0.31 0.00 0.00 39.34 38.17 3mep n TYR 77 CO 0.00 0.00 0.00 -0.51 -0.46 0.00 0.00 176.86 175.89 3mep s ASP 78 N -2.31 6.43 0.04 7.72 1.11 -0.92 -4.29 116.67 124.46 3mep s ASP 78 Ca 0.00 2.81 0.05 0.00 0.18 0.00 0.00 52.55 55.59 3mep s ASP 78 Cb 0.00 -2.60 -0.02 0.00 1.07 0.00 0.00 42.92 41.37 3mep s ASP 78 CO 0.00 -0.93 -0.15 -1.10 1.18 0.00 0.00 175.17 174.17 3mep s GLN 79 N 1.04 1.00 -0.24 8.23 -0.21 -0.34 -1.59 119.66 127.55 3mep s GLN 79 Ca 0.73 -0.80 -0.17 0.00 0.02 0.00 0.00 55.36 55.14 3mep s GLN 79 Cb -0.48 -1.03 0.07 0.00 1.00 0.00 0.00 33.01 32.56 3mep s GLN 79 CO 0.33 0.26 0.61 0.00 -2.12 0.00 0.00 175.29 174.36 3mep s ALA 80 N -0.86 -1.59 0.00 6.09 0.00 -1.15 -0.10 121.76 124.15 3mep s ALA 80 Ca 0.02 2.00 0.00 0.00 0.00 0.00 0.00 51.96 53.98 3mep s ALA 80 Cb -0.08 -1.18 0.00 0.00 0.00 0.00 0.00 23.12 21.86 3mep s ALA 80 CO 0.01 -0.33 0.00 0.41 0.00 0.00 0.00 175.76 175.86 3mep n GLY 81 N 3.72 -0.55 3.44 0.00 0.00 -1.26 -2.39 105.19 108.15 3mep n GLY 81 Ca -0.18 0.09 -0.22 0.00 0.00 0.00 0.00 46.02 45.70 3mep n GLY 81 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 3mep s ILE 82 N -0.04 2.02 0.00 -0.61 -5.25 -0.10 -4.52 121.20 112.71 3mep s ILE 82 Ca 0.00 -2.24 -0.01 0.00 -0.99 0.00 0.00 60.65 57.40 3mep s ILE 82 Cb 0.00 -2.34 -0.01 0.00 2.95 0.00 0.00 42.46 43.06 3mep s ILE 82 CO 0.00 -0.38 0.02 0.12 -1.79 0.00 0.00 174.94 172.90 3mep s PHE 83 N -2.78 0.11 -0.21 1.37 5.36 -0.29 -2.00 117.98 119.54 3mep s PHE 83 Ca 0.28 -0.22 -0.03 0.00 -0.96 0.00 0.00 56.93 56.01 3mep s PHE 83 Cb -0.00 -0.09 0.06 0.00 -0.34 0.00 0.00 43.02 42.66 3mep s PHE 83 CO 0.12 -0.13 0.05 0.42 -1.46 0.00 0.00 175.22 174.22 3mep s ILE 84 N -0.82 0.49 0.01 3.12 1.01 0.89 -2.09 121.20 123.81 3mep s ILE 84 Ca -0.09 -0.62 0.01 0.00 0.00 0.00 0.00 60.65 59.95 3mep s ILE 84 Cb -0.06 -1.06 -0.04 0.00 0.01 0.00 0.00 42.46 41.32 3mep s ILE 84 CO -0.00 -0.28 0.06 -0.83 0.00 0.00 0.00 174.94 173.89 3mep s GLY 85 N 1.86 1.98 0.10 6.18 0.00 0.48 -0.58 107.32 117.34 3mep s GLY 85 Ca 0.00 -0.92 0.00 0.00 0.00 0.00 0.00 44.72 43.81 3mep s GLY 85 CO -0.11 -0.81 0.00 0.61 0.00 0.00 0.00 173.10 172.80 3mep n GLY 86 N 1.13 -0.05 1.63 0.20 0.00 0.47 -0.66 105.19 107.91 3mep n GLY 86 Ca -0.13 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 45.81 3mep n GLY 86 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3mep n THR 87 N -3.46 0.00 0.65 2.61 -2.24 -0.21 -4.91 114.28 106.72 3mep n THR 87 Ca 0.00 -0.99 0.11 0.00 -2.27 0.00 0.00 64.05 60.90 3mep n THR 87 Cb 0.04 0.56 0.46 0.00 -2.10 0.00 0.00 70.33 69.29 3mep n THR 87 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 3mep n GLU 88 N -0.29 0.09 -0.05 -0.78 1.02 -1.26 -2.69 120.64 116.68 3mep n GLU 88 Ca 0.02 0.21 0.05 0.00 -0.02 0.00 0.00 57.16 57.41 3mep n GLU 88 Cb 0.29 -1.64 0.07 0.00 -0.02 0.00 0.00 31.44 30.15 3mep n GLU 88 CO 0.00 0.00 0.00 0.25 1.18 0.00 0.00 177.13 178.56 3mep n THR 89 N -1.80 1.39 -3.40 2.62 -2.24 -1.26 -4.89 114.28 104.70 3mep n THR 89 Ca 0.05 -1.58 -0.18 0.00 -2.27 0.00 0.00 64.05 60.07 3mep n THR 89 Cb 0.28 0.14 -0.10 0.00 -2.10 0.00 0.00 70.33 68.56 3mep n THR 89 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3mep s ALA 90 N -1.88 -0.36 0.29 6.98 0.00 -1.09 0.63 121.76 126.32 3mep s ALA 90 Ca 0.16 -0.48 -0.19 0.00 0.00 0.00 0.00 51.96 51.44 3mep s ALA 90 Cb 0.14 -1.80 0.05 0.00 0.00 0.00 0.00 23.12 21.51 3mep s ALA 90 CO 0.02 -1.77 0.84 1.67 0.00 0.00 0.00 175.76 176.52 3mep s TRP 91 N 2.20 0.00 -0.11 0.00 1.48 -0.39 -0.40 118.94 121.73 3mep s TRP 91 Ca 0.10 -0.52 -0.08 0.00 -1.06 0.00 0.00 56.10 54.55 3mep s TRP 91 Cb -0.14 0.76 0.04 0.00 -1.16 0.00 0.00 33.47 32.96 3mep s TRP 91 CO -0.29 -1.27 0.27 0.42 -4.06 0.00 0.00 176.95 172.03 3mep s ILE 92 N -2.81 -0.02 0.11 0.66 1.01 0.25 -0.29 121.20 120.11 3mep s ILE 92 Ca 0.15 0.07 0.05 0.00 0.00 0.00 0.00 60.65 60.92 3mep s ILE 92 Cb -0.04 -0.40 -0.04 0.00 0.01 0.00 0.00 42.46 41.99 3mep s ILE 92 CO 0.08 0.03 -0.12 -1.59 0.00 0.00 0.00 174.94 173.33 3mep s LYS 93 N 0.72 0.93 -0.16 2.79 -2.85 -0.36 -0.08 119.74 120.74 3mep s LYS 93 Ca -0.05 -1.18 -0.28 0.00 -1.00 0.00 0.00 55.97 53.46 3mep s LYS 93 Cb -0.06 -0.75 0.08 0.00 -2.06 0.00 0.00 37.83 35.04 3mep s LYS 93 CO -0.05 0.14 0.75 0.00 0.10 0.00 0.00 175.35 176.29 3mep s ALA 94 N -2.17 -1.80 0.00 0.59 0.00 -0.84 -0.62 121.76 116.91 3mep s ALA 94 Ca 0.06 1.66 0.00 0.00 0.00 0.00 0.00 51.96 53.68 3mep s ALA 94 Cb -0.05 -0.62 0.00 0.00 0.00 0.00 0.00 23.12 22.45 3mep s ALA 94 CO 0.02 -0.34 0.00 0.41 0.00 0.00 0.00 175.76 175.84 3mep n GLY 95 N 1.68 -0.24 3.84 0.00 0.00 -0.77 -0.93 105.19 108.77 3mep n GLY 95 Ca -0.16 -1.27 -0.32 0.00 0.00 0.00 0.00 46.02 44.27 3mep n GLY 95 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3mep s ILE 96 N -2.99 4.61 -0.08 -0.61 -1.09 -1.01 -1.76 121.20 118.27 3mep s ILE 96 Ca 0.00 1.07 -0.04 0.00 -2.23 0.00 0.00 60.65 59.46 3mep s ILE 96 Cb 0.00 -3.61 0.05 0.00 -1.58 0.00 0.00 42.46 37.31 3mep s ILE 96 CO 0.00 -0.23 0.18 -0.70 -1.23 0.00 0.00 174.94 172.95 3mep s GLU 97 N -3.07 0.10 0.29 2.79 2.12 -0.15 -2.94 118.70 117.83 3mep s GLU 97 Ca 0.56 0.50 -0.26 0.00 0.36 0.00 0.00 54.97 56.13 3mep s GLU 97 Cb -0.10 -0.19 -0.09 0.00 0.26 0.00 0.00 34.13 34.01 3mep s GLU 97 CO 0.17 -0.22 0.92 0.12 -0.54 0.00 0.00 175.26 175.70 3mep s PHE 98 N 1.68 3.76 -0.29 5.30 5.36 -0.62 -1.86 117.98 131.31 3mep s PHE 98 Ca -0.04 1.77 -0.18 0.00 -0.96 0.00 0.00 56.93 57.51 3mep s PHE 98 Cb -0.12 -2.90 0.12 0.00 -0.34 0.00 0.00 43.02 39.79 3mep s PHE 98 CO -0.07 0.28 0.92 0.54 -1.46 0.00 0.00 175.22 175.44 3mep s ASN 99 N -1.52 -0.59 -1.40 6.13 2.20 -1.15 -0.40 114.94 118.22 3mep s ASN 99 Ca 0.47 0.98 -0.05 0.00 -0.94 0.00 0.00 52.86 53.33 3mep s ASN 99 Cb -0.20 1.18 0.05 0.00 -2.00 0.00 0.00 41.25 40.28 3mep s ASN 99 CO 0.25 -0.16 0.12 0.47 -2.94 0.00 0.00 177.10 174.85 3mep n ASP 100 N 3.47 0.25 0.00 3.54 8.00 -1.26 -2.81 116.55 127.74 3mep n ASP 100 Ca -0.17 -1.09 0.00 0.00 0.71 0.00 0.00 54.79 54.24 3mep n ASP 100 Cb 0.57 -1.36 0.00 0.00 -0.02 0.00 0.00 41.12 40.31 3mep n ASP 100 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3mep n GLY 101 N -2.03 2.28 3.54 0.44 0.00 -1.26 -4.96 105.19 103.20 3mep n GLY 101 Ca -0.19 -0.11 -0.46 0.00 0.00 0.00 0.00 46.02 45.26 3mep n GLY 101 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 3mep n GLN 102 N 0.00 0.96 -3.52 1.61 -0.06 -1.12 -4.96 117.38 110.29 3mep n GLN 102 Ca 0.00 0.34 -0.38 0.00 -2.00 0.00 0.00 57.00 54.96 3mep n GLN 102 Cb 0.00 -1.62 -0.06 0.00 -4.06 0.00 0.00 30.24 24.50 3mep n GLN 102 CO 0.00 0.00 0.00 -1.25 -0.20 0.00 0.00 177.06 175.61 3mep s PRO 103 N -1.27 3.91 0.20 3.69 0.04 -1.26 -2.95 135.00 137.36 3mep s PRO 103 Ca 0.62 0.36 0.11 0.00 0.04 0.00 0.00 61.00 62.13 3mep s PRO 103 Cb -0.78 -3.23 -0.04 0.00 0.04 0.00 0.00 34.50 30.48 3mep s PRO 103 CO 0.58 0.66 -0.19 -1.12 0.04 0.00 0.00 177.00 176.97 3mep s SER 104 N -0.95 3.69 -0.15 6.66 0.01 -0.78 -3.70 113.70 118.48 3mep s SER 104 Ca 0.23 -0.80 -0.02 0.00 1.31 0.00 0.00 55.95 56.67 3mep s SER 104 Cb -0.16 -0.39 -0.02 0.00 0.21 0.00 0.00 66.02 65.66 3mep s SER 104 CO 0.12 0.11 -0.09 -0.51 0.41 0.00 0.00 173.24 173.28 3mep s ILE 105 N -1.78 3.38 0.06 1.44 1.10 -0.53 -0.98 121.20 123.88 3mep s ILE 105 Ca 0.23 -0.53 -0.01 0.00 -0.51 0.00 0.00 60.65 59.82 3mep s ILE 105 Cb -0.08 -2.46 0.01 0.00 0.15 0.00 0.00 42.46 40.08 3mep s ILE 105 CO 0.12 0.50 0.10 0.61 -2.11 0.00 0.00 174.94 174.16 3mep n GLY 106 N 3.72 2.25 3.36 1.50 0.00 -0.72 -1.87 105.19 113.44 3mep n GLY 106 Ca -0.18 -1.18 -0.15 0.00 0.00 0.00 0.00 46.02 44.52 3mep n GLY 106 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3mep s VAL 108 N -1.74 0.66 -0.26 0.00 1.01 0.21 -1.16 120.40 119.11 3mep s VAL 108 Ca -0.10 -0.07 -0.06 0.00 0.00 0.00 0.00 61.98 61.76 3mep s VAL 108 Cb -0.02 -0.74 -0.01 0.00 0.00 0.00 0.00 36.38 35.61 3mep s VAL 108 CO 0.03 0.30 0.05 -0.69 0.00 0.00 0.00 175.10 174.79 3mep s VAL 109 N 1.77 3.97 -0.30 2.92 1.01 -0.59 -1.22 120.40 127.96 3mep s VAL 109 Ca 0.03 -0.43 -0.04 0.00 0.00 0.00 0.00 61.98 61.55 3mep s VAL 109 Cb -0.13 -2.91 0.04 0.00 0.00 0.00 0.00 36.38 33.38 3mep s VAL 109 CO -0.06 0.27 0.03 -0.89 0.00 0.00 0.00 175.10 174.45 3mep s THR 110 N 1.54 3.33 -0.58 3.92 2.01 0.60 -0.49 115.64 125.97 3mep s THR 110 Ca 0.05 -1.17 0.04 0.00 0.31 0.00 0.00 61.69 60.92 3mep s THR 110 Cb -0.16 -2.85 0.16 0.00 0.01 0.00 0.00 72.50 69.66 3mep s THR 110 CO 0.02 -0.06 0.39 0.21 -0.69 0.00 0.00 174.62 174.48 3mep s ASN 111 N 1.34 3.99 0.00 3.53 2.47 -1.26 -1.26 114.94 123.75 3mep s ASN 111 Ca -0.02 -3.38 0.00 0.00 0.42 0.00 0.00 52.86 49.88 3mep s ASN 111 Cb -0.19 -1.34 0.00 0.00 -1.45 0.00 0.00 41.25 38.27 3mep s ASN 111 CO 0.00 -0.15 0.00 0.59 -3.72 0.00 0.00 177.10 173.82 3mep n ASN 112 N 2.57 0.00 -4.03 -4.21 5.03 0.21 -4.82 115.26 110.00 3mep n ASN 112 Ca 0.17 0.00 -0.17 0.00 0.87 0.00 0.00 54.58 55.45 3mep n ASN 112 Cb 0.36 0.00 -0.14 0.00 -1.02 0.00 0.00 39.78 38.99 3mep n ASN 112 CO 0.00 0.00 0.00 0.20 -1.83 0.00 0.00 177.26 175.63 3mep s ASN 113 N 0.00 0.98 0.15 6.41 0.02 -1.26 -4.82 114.94 116.42 3mep s ASN 113 Ca 0.00 -0.26 -0.30 0.00 -1.02 0.00 0.00 52.86 51.28 3mep s ASN 113 Cb 0.00 -0.07 -0.07 0.00 0.02 0.00 0.00 41.25 41.13 3mep s ASN 113 CO 0.00 0.02 1.08 -0.44 0.02 0.00 0.00 177.10 177.78 3mep s SER 114 N -0.60 7.29 -0.30 -1.22 0.01 -0.85 -4.28 113.70 113.76 3mep s SER 114 Ca 0.00 2.01 0.01 0.00 1.31 0.00 0.00 55.95 59.29 3mep s SER 114 Cb -0.05 -2.60 0.09 0.00 0.21 0.00 0.00 66.02 63.67 3mep s SER 114 CO 0.00 -0.22 0.03 -0.62 0.41 0.00 0.00 173.24 172.84 3mep s ASP 115 N 0.07 4.21 0.03 2.44 -1.08 0.35 -4.69 116.67 118.01 3mep s ASP 115 Ca 0.50 -1.66 0.06 0.00 -0.52 0.00 0.00 52.55 50.93 3mep s ASP 115 Cb -0.28 -1.22 -0.03 0.00 -1.46 0.00 0.00 42.92 39.93 3mep s ASP 115 CO 0.33 -0.35 -0.14 -1.66 0.52 0.00 0.00 175.17 173.88 3mep s TRP 116 N 1.31 2.67 0.13 -5.34 1.48 -1.26 -1.54 118.94 116.39 3mep s TRP 116 Ca 0.05 -0.18 0.10 0.00 -1.06 0.00 0.00 56.10 55.01 3mep s TRP 116 Cb -0.18 -1.51 -0.04 0.00 -1.16 0.00 0.00 33.47 30.58 3mep s TRP 116 CO -0.13 0.30 -0.24 -1.54 -4.06 0.00 0.00 176.95 171.28 3mep s SER 117 N -1.47 2.97 0.25 -2.66 1.04 -0.31 -5.01 113.70 108.51 3mep s SER 117 Ca 0.16 -0.74 -0.08 0.00 0.48 0.00 0.00 55.95 55.76 3mep s SER 117 Cb -0.11 -0.19 -0.01 0.00 0.10 0.00 0.00 66.02 65.82 3mep s SER 117 CO 0.06 0.11 0.40 0.28 0.98 0.00 0.00 173.24 175.07 3mep s THR 118 N -1.22 0.00 -0.57 2.02 -1.32 -1.26 -1.35 115.64 111.93 3mep s THR 118 Ca 0.12 -1.58 0.00 0.00 -1.21 0.00 0.00 61.69 59.02 3mep s THR 118 Cb -0.10 -2.35 0.00 0.00 -1.51 0.00 0.00 72.50 68.54 3mep s THR 118 CO 0.06 0.00 0.00 0.61 -2.21 0.00 0.00 174.62 173.08 3mep n GLY 119 N -0.39 -1.28 3.76 6.08 0.00 -0.78 -4.96 105.19 107.62 3mep n GLY 119 Ca -0.00 -1.00 -0.41 0.00 0.00 0.00 0.00 46.02 44.61 3mep n GLY 119 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3mep s LEU 120 N 0.00 4.41 -0.23 0.99 1.43 -1.26 -1.46 118.68 122.56 3mep s LEU 120 Ca 0.00 2.69 -0.01 0.00 -1.03 0.00 0.00 54.13 55.78 3mep s LEU 120 Cb 0.00 -3.64 0.02 0.00 0.03 0.00 0.00 46.19 42.60 3mep s LEU 120 CO 0.00 -0.59 -0.10 0.12 0.23 0.00 0.00 176.35 176.01 3mep s PHE 121 N -0.83 2.99 0.02 0.29 5.36 -1.24 -4.49 117.98 120.07 3mep s PHE 121 Ca 0.52 -1.54 -0.05 0.00 -0.96 0.00 0.00 56.93 54.90 3mep s PHE 121 Cb -0.40 -2.02 -0.29 0.00 -0.34 0.00 0.00 43.02 39.97 3mep s PHE 121 CO 0.51 -0.73 0.92 -1.00 -1.46 0.00 0.00 175.22 173.45 3mep h PRO 122 N 7.99 0.28 0.00 10.12 0.13 -1.95 -3.47 132.00 145.09 3mep h PRO 122 Ca -0.36 -0.48 0.00 0.00 -0.87 0.00 0.00 66.00 64.29 3mep h PRO 122 Cb 1.12 0.18 0.00 0.00 0.13 0.00 0.00 31.00 32.43 3mep h PRO 122 CO 0.59 1.17 0.00 0.41 -0.23 0.00 0.00 178.00 179.93 3mep n GLY 123 N 1.65 -2.82 3.51 1.56 0.00 -1.26 -4.94 105.19 102.89 3mep n GLY 123 Ca -0.15 -1.29 -0.43 0.00 0.00 0.00 0.00 46.02 44.15 3mep n GLY 123 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 3mep s ASN 124 N -1.76 6.33 0.63 1.61 3.84 -1.26 -4.93 114.94 119.39 3mep s ASN 124 Ca 0.00 -0.41 0.26 0.00 0.21 0.00 0.00 52.86 52.92 3mep s ASN 124 Cb 0.00 -2.40 1.34 0.00 -0.55 0.00 0.00 41.25 39.64 3mep s ASN 124 CO 0.00 -1.11 1.76 1.55 -2.79 0.00 0.00 177.10 176.51 3mep h PRO 125 N 9.19 0.00 -0.66 0.43 0.13 -1.94 0.25 132.00 139.41 3mep h PRO 125 Ca -0.26 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.87 3mep h PRO 125 Cb 1.08 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.21 3mep h PRO 125 CO 1.04 0.00 0.00 0.41 -0.23 0.00 0.00 178.00 179.22 3mep n GLY 126 N -1.42 2.46 3.07 1.56 0.00 -1.26 -4.64 105.19 104.96 3mep n GLY 126 Ca 0.05 -0.78 0.03 0.00 0.00 0.00 0.00 46.02 45.32 3mep n GLY 126 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3mep s ASP 127 N -0.88 -0.98 0.25 1.61 -1.08 0.08 -4.08 116.67 111.58 3mep s ASP 127 Ca 0.47 -0.20 -0.04 0.00 -0.52 0.00 0.00 52.55 52.26 3mep s ASP 127 Cb 0.30 1.42 -0.02 0.00 -1.46 0.00 0.00 42.92 43.15 3mep s ASP 127 CO 0.24 -0.14 0.30 0.72 0.52 0.00 0.00 175.17 176.82 3mep s PHE 128 N 2.37 0.95 0.00 -5.34 -0.12 -0.81 -4.43 117.98 110.59 3mep s PHE 128 Ca 0.17 -1.18 0.00 0.00 -0.05 0.00 0.00 56.93 55.87 3mep s PHE 128 Cb -0.03 -0.26 0.00 0.00 -0.63 0.00 0.00 43.02 42.10 3mep s PHE 128 CO -0.17 -0.85 0.00 0.91 -0.05 0.00 0.00 175.22 175.06 3mep n TRP 129 N -0.38 -0.10 0.00 3.49 8.01 -0.32 0.15 117.44 128.28 3mep n TRP 129 Ca 0.01 0.00 0.00 0.00 -1.31 0.00 0.00 57.50 56.20 3mep n TRP 129 Cb 0.64 0.00 0.00 0.00 -2.01 0.00 0.00 31.31 29.94 3mep n TRP 129 CO 0.00 0.00 0.00 -2.13 -1.01 0.00 0.00 177.69 174.55 3mep n ARG 131 N -0.03 0.00 -4.83 -0.99 0.63 -0.28 -1.52 116.66 109.64 3mep n ARG 131 Ca 0.00 0.00 -0.27 0.00 -0.92 0.00 0.00 57.85 56.66 3mep n ARG 131 Cb 0.00 0.00 -0.17 0.00 0.45 0.00 0.00 32.46 32.74 3mep n ARG 131 CO 0.00 0.00 0.00 0.08 -2.51 0.00 0.00 177.63 175.20 3mep s VAL 132 N -0.14 1.48 -0.12 5.15 1.01 0.91 -1.05 120.40 127.65 3mep s VAL 132 Ca 0.00 -0.69 0.03 0.00 0.00 0.00 0.00 61.98 61.32 3mep s VAL 132 Cb 0.00 -1.31 0.01 0.00 0.00 0.00 0.00 36.38 35.07 3mep s VAL 132 CO 0.00 0.43 -0.21 -0.89 0.00 0.00 0.00 175.10 174.43 3mep s THR 133 N 0.50 1.94 -0.38 3.92 2.01 -0.19 0.09 115.64 123.53 3mep s THR 133 Ca -0.15 -0.92 0.02 0.00 0.31 0.00 0.00 61.69 60.94 3mep s THR 133 Cb -0.16 -1.71 0.12 0.00 0.01 0.00 0.00 72.50 70.76 3mep s THR 133 CO 0.05 0.53 0.16 -0.55 -0.69 0.00 0.00 174.62 174.12 3mep s SER 134 N 0.66 4.03 -0.08 3.53 0.15 0.27 -1.10 113.70 121.17 3mep s SER 134 Ca -0.12 -2.21 0.03 0.00 0.70 0.00 0.00 55.95 54.35 3mep s SER 134 Cb -0.16 -1.12 0.01 0.00 -1.71 0.00 0.00 66.02 63.03 3mep s SER 134 CO 0.02 -0.34 -0.16 -1.59 1.20 0.00 0.00 173.24 172.37 3mep s LYS 135 N 0.86 2.20 6.79 5.44 -2.85 -1.07 -1.44 119.74 129.67 3mep s LYS 135 Ca 0.14 -0.58 0.00 0.00 -1.00 0.00 0.00 55.97 54.52 3mep s LYS 135 Cb -0.21 -1.76 0.00 0.00 -2.06 0.00 0.00 37.83 33.80 3mep s LYS 135 CO -0.10 0.06 0.00 0.43 0.10 0.00 0.00 175.35 175.84 3mep n SER 136 N 3.77 0.00 -0.71 0.03 7.64 -1.26 -2.35 113.62 120.74 3mep n SER 136 Ca -0.21 0.00 0.07 0.00 1.01 0.00 0.00 58.87 59.74 3mep n SER 136 Cb 0.52 0.00 0.20 0.00 -1.01 0.00 0.00 64.21 63.92 3mep n SER 136 CO 0.00 0.00 0.00 0.47 -3.01 0.00 0.00 175.04 172.50 3mep n ASP 137 N 6.40 3.38 -4.89 6.43 8.00 -1.26 -4.99 116.55 129.62 3mep n ASP 137 Ca 0.00 -2.64 -0.35 0.00 0.71 0.00 0.00 54.79 52.51 3mep n ASP 137 Cb 0.00 -0.41 -0.05 0.00 -0.02 0.00 0.00 41.12 40.64 3mep n ASP 137 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 3mep s VAL 138 N -2.15 5.38 -0.12 2.53 1.01 -0.99 0.51 120.40 126.58 3mep s VAL 138 Ca 0.33 0.12 0.01 0.00 0.00 0.00 0.00 61.98 62.45 3mep s VAL 138 Cb 0.25 -3.52 0.02 0.00 0.00 0.00 0.00 36.38 33.12 3mep s VAL 138 CO 0.10 0.44 -0.15 -0.63 0.00 0.00 0.00 175.10 174.86 3mep s ILE 139 N -1.22 1.50 -0.16 2.22 -1.09 0.01 -2.60 121.20 119.85 3mep s ILE 139 Ca 0.24 -0.63 0.01 0.00 -2.23 0.00 0.00 60.65 58.04 3mep s ILE 139 Cb -0.13 -1.38 0.02 0.00 -1.58 0.00 0.00 42.46 39.39 3mep s ILE 139 CO 0.13 0.44 -0.20 -0.60 -1.23 0.00 0.00 174.94 173.49 3mep s ARG 140 N 1.10 2.91 -0.13 2.79 3.52 -0.26 -1.75 118.95 127.13 3mep s ARG 140 Ca -0.04 -0.80 0.01 0.00 -0.13 0.00 0.00 55.73 54.76 3mep s ARG 140 Cb -0.14 -2.46 -0.01 0.00 -1.56 0.00 0.00 34.95 30.78 3mep s ARG 140 CO -0.04 -0.14 -0.16 0.42 -0.81 0.00 0.00 175.30 174.57 3mep s ILE 141 N 1.14 2.66 0.21 4.11 1.01 0.63 -1.02 121.20 129.94 3mep s ILE 141 Ca 0.01 -0.79 0.04 0.00 0.00 0.00 0.00 60.65 59.90 3mep s ILE 141 Cb -0.14 -2.10 -0.05 0.00 0.01 0.00 0.00 42.46 40.18 3mep s ILE 141 CO -0.09 0.53 -0.02 -1.10 0.00 0.00 0.00 174.94 174.26 3mep s GLN 142 N 0.55 1.27 0.22 2.79 -0.21 -0.22 0.19 119.66 124.25 3mep s GLN 142 Ca -0.10 -1.62 0.00 0.00 0.02 0.00 0.00 55.36 53.66 3mep s GLN 142 Cb -0.16 -0.58 -0.05 0.00 1.00 0.00 0.00 33.01 33.22 3mep s GLN 142 CO 0.04 -0.07 0.11 1.52 -2.12 0.00 0.00 175.29 174.76 3mep s TYR 143 N -3.43 1.32 -0.04 0.91 -0.85 -0.95 -1.13 117.35 113.18 3mep s TYR 143 Ca 0.26 -1.27 -0.13 0.00 -0.52 0.00 0.00 57.07 55.41 3mep s TYR 143 Cb 0.05 -0.71 0.02 0.00 0.38 0.00 0.00 41.96 41.70 3mep s TYR 143 CO 0.07 -0.48 0.29 0.45 -1.52 0.00 0.00 175.55 174.36 3mep s SER 144 N -3.22 -0.20 0.00 -0.18 0.15 -0.58 -2.55 113.70 107.13 3mep s SER 144 Ca 0.37 0.18 0.11 0.00 0.70 0.00 0.00 55.95 57.31 3mep s SER 144 Cb 0.07 0.38 -0.08 0.00 -1.71 0.00 0.00 66.02 64.68 3mep s SER 144 CO 0.12 -0.36 0.53 2.30 1.20 0.00 0.00 173.24 177.04 3mep n ILE 145 N 1.69 0.00 -0.67 6.45 -5.35 -1.26 -1.18 119.36 119.04 3mep n ILE 145 Ca -0.20 -0.29 0.00 0.00 -0.27 0.00 0.00 62.75 61.99 3mep n ILE 145 Cb 0.56 1.05 0.00 0.00 -1.74 0.00 0.00 39.64 39.51 3mep n ILE 145 CO 0.00 0.00 0.00 -0.90 -1.76 0.00 0.00 176.55 173.89 3mep n ASP 146 N -0.89 0.38 0.00 7.28 5.68 -1.26 -4.71 116.55 123.02 3mep n ASP 146 Ca 0.03 -1.05 0.00 0.00 -0.50 0.00 0.00 54.79 53.27 3mep n ASP 146 Cb 0.19 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 40.17 3mep n ASP 146 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 3mep n GLY 147 N -0.03 0.62 0.39 6.12 0.00 -1.26 -4.81 105.19 106.22 3mep n GLY 147 Ca 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 45.98 3mep n GLY 147 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3mep n LYS 148 N -2.05 0.10 -3.88 1.61 5.02 -1.26 -5.02 118.16 112.68 3mep n LYS 148 Ca 0.00 0.03 -0.35 0.00 -2.02 0.00 0.00 58.31 55.97 3mep n LYS 148 Cb 0.05 -0.90 -0.09 0.00 -0.02 0.00 0.00 35.03 34.07 3mep n LYS 148 CO 0.00 0.00 0.00 -0.80 -0.52 0.00 0.00 177.40 176.08 3mep s ASN 149 N -4.86 5.93 -0.70 4.39 -0.87 -1.26 -5.06 114.94 112.51 3mep s ASN 149 Ca -0.06 0.17 0.05 0.00 -1.57 0.00 0.00 52.86 51.45 3mep s ASN 149 Cb 0.02 -2.02 0.17 0.00 -0.02 0.00 0.00 41.25 39.40 3mep s ASN 149 CO 0.09 0.20 0.49 0.26 -2.57 0.00 0.00 177.10 175.57 3mep s TRP 150 N 0.25 3.56 0.62 2.20 0.52 -1.26 -4.22 118.94 120.61 3mep s TRP 150 Ca 0.06 -3.34 -0.18 0.00 0.02 0.00 0.00 56.10 52.66 3mep s TRP 150 Cb -0.12 -2.71 -0.02 0.00 -1.15 0.00 0.00 33.47 29.47 3mep s TRP 150 CO -0.01 -0.55 1.24 -1.25 0.02 0.00 0.00 176.95 176.40 3mep s PRO 151 N -1.43 2.79 0.41 4.98 0.04 -1.06 -4.69 135.00 136.04 3mep s PRO 151 Ca 0.25 1.90 -0.24 0.00 0.04 0.00 0.00 61.00 62.95 3mep s PRO 151 Cb -0.05 -1.90 -0.09 0.00 0.04 0.00 0.00 34.50 32.51 3mep s PRO 151 CO -0.16 -1.37 1.07 -1.17 0.04 0.00 0.00 177.00 175.41 3mep s LEU 152 N -4.23 4.12 -0.00 -3.56 2.96 -1.26 -2.25 118.68 114.46 3mep s LEU 152 Ca 0.79 2.08 -0.00 0.00 -0.22 0.00 0.00 54.13 56.78 3mep s LEU 152 Cb -0.33 -4.19 -0.00 0.00 0.50 0.00 0.00 46.19 42.17 3mep s LEU 152 CO 0.36 -0.56 -0.00 -0.11 -1.32 0.00 0.00 176.35 174.72 3mep n LEU 153 N -0.13 0.79 -3.71 -0.68 7.94 0.13 -4.89 117.00 116.46 3mep n LEU 153 Ca 0.05 0.00 -0.14 0.00 -1.11 0.00 0.00 56.01 54.81 3mep n LEU 153 Cb 0.49 -0.00 -0.09 0.00 0.53 0.00 0.00 43.42 44.36 3mep n LEU 153 CO 0.45 0.13 0.13 -0.60 -1.11 0.00 0.00 177.39 176.39 3mep s ARG 154 N -2.00 0.68 -0.16 1.96 6.06 -0.90 -4.97 118.95 119.62 3mep s ARG 154 Ca -0.00 0.16 -0.04 0.00 -2.50 0.00 0.00 55.73 53.35 3mep s ARG 154 Cb 0.00 0.31 0.07 0.00 0.06 0.00 0.00 34.95 35.39 3mep s ARG 154 CO 0.00 -0.17 0.13 -1.17 -2.50 0.00 0.00 175.30 171.60 3mep s LEU 155 N -0.76 0.16 0.00 -0.88 2.96 -1.26 -0.27 118.68 118.63 3mep s LEU 155 Ca -0.08 -0.38 0.00 0.00 -0.22 0.00 0.00 54.13 53.45 3mep s LEU 155 Cb -0.04 -0.01 -0.00 0.00 0.50 0.00 0.00 46.19 46.64 3mep s LEU 155 CO 0.04 -0.33 0.11 0.00 -1.32 0.00 0.00 176.35 174.85 3mep s THR 157 N -2.47 3.49 0.07 0.00 -4.23 -1.26 -0.81 115.64 110.44 3mep s THR 157 Ca 0.09 -0.56 -0.35 0.00 -1.18 0.00 0.00 61.69 59.69 3mep s THR 157 Cb 0.00 -2.41 -0.14 0.00 1.34 0.00 0.00 72.50 71.29 3mep s THR 157 CO 0.06 0.59 1.60 1.87 -0.54 0.00 0.00 174.62 178.20 3mep n TRP 158 N 2.29 2.12 0.98 3.99 -0.00 0.18 -4.88 117.44 122.12 3mep n TRP 158 Ca -0.18 0.30 0.13 0.00 -0.00 0.00 0.00 57.50 57.75 3mep n TRP 158 Cb 0.53 -2.52 0.36 0.00 -0.00 0.00 0.00 31.31 29.68 3mep n TRP 158 CO 0.00 0.00 0.00 -0.35 -0.00 0.00 0.00 177.69 177.34 3mep n PRO 159 N 3.97 0.01 0.00 5.87 -0.04 -1.26 -4.92 135.00 138.64 3mep n PRO 159 Ca 0.19 0.01 0.00 0.00 -0.04 0.00 0.00 63.50 63.65 3mep n PRO 159 Cb 0.26 -1.51 0.00 0.00 -0.04 0.00 0.00 33.50 32.21 3mep n PRO 159 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 3mep n GLY 160 N 1.49 1.55 0.00 0.55 0.00 -1.26 -4.95 105.19 102.56 3mep n GLY 160 Ca 0.06 -1.81 0.00 0.00 0.00 0.00 0.00 46.02 44.27 3mep n GLY 160 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3mep n THR 161 N 0.00 0.00 0.17 2.61 -2.24 -1.26 -5.05 114.28 108.51 3mep n THR 161 Ca 0.00 0.00 -0.14 0.00 -2.27 0.00 0.00 64.05 61.64 3mep n THR 161 Cb 0.00 -0.07 -0.08 0.00 -2.10 0.00 0.00 70.33 68.08 3mep n THR 161 CO 0.00 0.00 0.00 0.03 -0.57 0.00 0.00 175.07 174.53 3mep h ARG 162 N 0.00 -0.40 -6.25 -0.78 2.47 -1.96 -3.42 114.38 104.05 3mep h ARG 162 Ca 0.00 0.03 -0.56 0.00 -1.26 0.00 0.00 59.98 58.19 3mep h ARG 162 Cb 0.00 0.09 -0.02 0.00 -1.65 0.00 0.00 29.97 28.39 3mep h ARG 162 CO 0.00 -0.16 1.06 0.15 0.56 0.00 0.00 179.97 181.58 3mep s LYS 163 N -5.37 4.03 -0.07 0.04 1.02 -1.26 -4.47 119.74 113.66 3mep s LYS 163 Ca -0.15 1.83 0.05 0.00 0.02 0.00 0.00 55.97 57.72 3mep s LYS 163 Cb 0.03 -3.95 -0.00 0.00 -0.52 0.00 0.00 37.83 33.39 3mep s LYS 163 CO 0.60 -1.00 -0.24 1.03 -0.92 0.00 0.00 175.35 174.83 3mep s ARG 164 N 4.16 2.67 -0.34 1.68 0.52 -0.33 -4.62 118.95 122.68 3mep s ARG 164 Ca 0.68 -0.86 -0.13 0.00 -0.52 0.00 0.00 55.73 54.90 3mep s ARG 164 Cb -0.27 -2.15 -0.02 0.00 0.52 0.00 0.00 34.95 33.04 3mep s ARG 164 CO 0.26 0.28 0.25 0.12 0.02 0.00 0.00 175.30 176.22 3mep s PHE 165 N 0.09 3.23 -0.12 -0.53 5.36 0.16 -0.90 117.98 125.27 3mep s PHE 165 Ca -0.10 -0.22 -0.01 0.00 -0.96 0.00 0.00 56.93 55.64 3mep s PHE 165 Cb -0.15 -2.49 -0.02 0.00 -0.34 0.00 0.00 43.02 40.02 3mep s PHE 165 CO 0.06 -0.37 -0.10 -1.50 -1.46 0.00 0.00 175.22 171.85 3mep s ILE 166 N 1.73 3.39 0.02 3.12 1.10 -0.64 -0.38 121.20 129.53 3mep s ILE 166 Ca 0.06 -0.55 -0.15 0.00 -0.51 0.00 0.00 60.65 59.50 3mep s ILE 166 Cb -0.17 -2.43 0.05 0.00 0.15 0.00 0.00 42.46 40.05 3mep s ILE 166 CO 0.11 0.53 0.69 0.61 -2.11 0.00 0.00 174.94 174.76 3mep n GLY 167 N 3.28 0.53 3.99 1.50 0.00 -0.89 -2.03 105.19 111.57 3mep n GLY 167 Ca -0.18 -0.98 -0.24 0.00 0.00 0.00 0.00 46.02 44.62 3mep n GLY 167 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3mep s VAL 168 N -2.13 2.04 0.00 1.61 -7.23 -0.42 -1.14 120.40 113.14 3mep s VAL 168 Ca 0.16 -0.54 0.00 0.00 -1.81 0.00 0.00 61.98 59.79 3mep s VAL 168 Cb -0.01 -2.50 0.00 0.00 0.56 0.00 0.00 36.38 34.43 3mep s VAL 168 CO 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 175.10 174.79 3mep n SER 172 N 2.19 0.97 -0.19 0.00 7.64 -0.93 -1.20 113.62 122.10 3mep n SER 172 Ca -0.17 -2.79 0.05 0.00 1.01 0.00 0.00 58.87 56.96 3mep n SER 172 Cb 0.56 -0.63 0.32 0.00 -1.01 0.00 0.00 64.21 63.45 3mep n SER 172 CO 0.00 0.00 0.00 -0.65 -3.01 0.00 0.00 175.04 171.38 3mep h PRO 173 N 4.74 0.81 -0.06 1.43 0.11 -1.49 0.01 132.00 137.54 3mep h PRO 173 Ca 0.17 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 66.23 3mep h PRO 173 Cb 0.83 -0.18 0.00 0.00 0.11 0.00 0.00 31.00 31.76 3mep h PRO 173 CO 0.53 0.53 0.00 1.63 -0.21 0.00 0.00 178.00 180.49 3mep n LYS 174 N -4.47 0.92 -0.03 1.05 4.76 -1.25 -4.29 118.16 114.85 3mep n LYS 174 Ca 0.10 -1.16 0.00 0.00 -2.87 0.00 0.00 58.31 54.38 3mep n LYS 174 Cb 0.17 -1.11 0.00 0.00 -1.84 0.00 0.00 35.03 32.25 3mep n LYS 174 CO 0.00 0.00 0.00 2.89 -1.37 0.00 0.00 177.40 178.92 3mep n ARG 175 N 0.17 0.00 -3.74 1.97 1.85 -1.20 -4.89 116.66 110.82 3mep n ARG 175 Ca 0.04 0.00 -0.14 0.00 -1.00 0.00 0.00 57.85 56.75 3mep n ARG 175 Cb 0.21 0.00 -0.09 0.00 -1.05 0.00 0.00 32.46 31.53 3mep n ARG 175 CO 0.00 0.00 0.00 0.21 -0.01 0.00 0.00 177.63 177.83 3mep s LYS 176 N 0.95 0.65 0.00 2.89 2.20 -1.26 -1.68 119.74 123.48 3mep s LYS 176 Ca 0.00 -0.02 0.00 0.00 -0.36 0.00 0.00 55.97 55.59 3mep s LYS 176 Cb 0.00 0.29 0.00 0.00 -1.51 0.00 0.00 37.83 36.61 3mep s LYS 176 CO 0.00 -0.17 0.00 0.41 -0.36 0.00 0.00 175.35 175.23 3mep n GLY 177 N 1.58 0.64 3.65 5.54 0.00 -0.54 -4.99 105.19 111.07 3mep n GLY 177 Ca -0.20 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.40 3mep n GLY 177 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3mep s LEU 178 N 0.00 4.26 -0.28 0.99 2.96 -1.26 -4.62 118.68 120.72 3mep s LEU 178 Ca 0.00 2.53 -0.11 0.00 -0.22 0.00 0.00 54.13 56.32 3mep s LEU 178 Cb 0.00 -3.53 -0.05 0.00 0.50 0.00 0.00 46.19 43.12 3mep s LEU 178 CO 0.00 -1.21 0.20 -0.55 -1.32 0.00 0.00 176.35 173.47 3mep s SER 179 N 5.10 6.04 -0.13 3.68 0.15 -1.26 -1.57 113.70 125.71 3mep s SER 179 Ca 0.90 -0.03 0.02 0.00 0.70 0.00 0.00 55.95 57.55 3mep s SER 179 Cb -0.41 -2.13 0.00 0.00 -1.71 0.00 0.00 66.02 61.78 3mep s SER 179 CO 0.40 -0.07 -0.20 0.00 1.20 0.00 0.00 173.24 174.57 3mep s ALA 180 N 1.77 2.31 -0.18 5.45 0.00 0.07 -3.32 121.76 127.86 3mep s ALA 180 Ca 0.07 -1.02 -0.07 0.00 0.00 0.00 0.00 51.96 50.94 3mep s ALA 180 Cb -0.16 -1.00 -0.04 0.00 0.00 0.00 0.00 23.12 21.92 3mep s ALA 180 CO 0.11 0.11 0.05 -2.00 0.00 0.00 0.00 175.76 174.02 3mep s GLU 181 N 0.61 3.92 -0.17 0.00 2.12 -0.46 -1.01 118.70 123.70 3mep s GLU 181 Ca -0.11 -0.38 -0.01 0.00 0.36 0.00 0.00 54.97 54.84 3mep s GLU 181 Cb -0.16 -3.18 0.00 0.00 0.26 0.00 0.00 34.13 31.04 3mep s GLU 181 CO 0.03 0.24 -0.14 -0.06 -0.54 0.00 0.00 175.26 174.79 3mep s PHE 182 N 0.45 2.82 0.40 5.30 0.08 0.13 -1.02 117.98 126.14 3mep s PHE 182 Ca 0.02 -1.12 0.05 0.00 0.12 0.00 0.00 56.93 56.00 3mep s PHE 182 Cb -0.13 -1.94 -0.02 0.00 -0.57 0.00 0.00 43.02 40.36 3mep s PHE 182 CO 0.01 -0.55 0.19 0.95 -0.10 0.00 0.00 175.22 175.72 3mep s THR 183 N 1.04 0.36 -1.66 0.64 -4.23 -0.67 -1.27 115.64 109.85 3mep s THR 183 Ca -0.01 -2.00 -0.16 0.00 -1.18 0.00 0.00 61.69 58.34 3mep s THR 183 Cb -0.15 -2.35 0.14 0.00 1.34 0.00 0.00 72.50 71.49 3mep s THR 183 CO -0.03 0.00 0.78 -0.62 -0.54 0.00 0.00 174.62 174.20 3mep n GLU 184 N -0.86 -3.43 -2.46 3.99 1.02 -1.26 -1.37 120.64 116.27 3mep n GLU 184 Ca -0.02 0.40 -0.41 0.00 -0.02 0.00 0.00 57.16 57.10 3mep n GLU 184 Cb 0.64 -5.09 -0.03 0.00 -0.02 0.00 0.00 31.44 26.94 3mep n GLU 184 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 3mep s ILE 185 N -3.35 3.92 -0.23 -3.67 1.01 -1.26 -4.26 121.20 113.36 3mep s ILE 185 Ca 0.67 1.52 -0.03 0.00 0.00 0.00 0.00 60.65 62.81 3mep s ILE 185 Cb -0.36 -3.97 0.10 0.00 0.01 0.00 0.00 42.46 38.24 3mep s ILE 185 CO 0.91 0.20 0.24 -0.22 0.00 0.00 0.00 174.94 176.07 3mep s LEU 186 N 0.26 -0.13 -0.22 2.97 0.20 -0.29 -5.00 118.68 116.46 3mep s LEU 186 Ca 0.54 -0.36 -0.07 0.00 0.69 0.00 0.00 54.13 54.93 3mep s LEU 186 Cb -0.30 0.42 -0.04 0.00 -0.43 0.00 0.00 46.19 45.85 3mep s LEU 186 CO 0.33 -0.34 0.07 -0.22 -0.29 0.00 0.00 176.35 175.90 3mep s LEU 187 N 2.34 3.63 0.00 -0.68 2.96 -1.26 -1.62 118.68 124.04 3mep s LEU 187 Ca 0.08 -0.07 -0.07 0.00 -0.22 0.00 0.00 54.13 53.85 3mep s LEU 187 Cb -0.15 -1.95 0.03 0.00 0.50 0.00 0.00 46.19 44.62 3mep s LEU 187 CO -0.18 0.06 0.41 1.07 -1.32 0.00 0.00 176.35 176.39 3mep n THR 188 N 4.31 0.00 -1.97 3.68 5.66 0.01 -4.96 114.28 121.01 3mep n THR 188 Ca -0.16 -0.60 -0.37 0.00 -3.05 0.00 0.00 64.05 59.87 3mep n THR 188 Cb 0.52 0.55 0.03 0.00 -1.55 0.00 0.00 70.33 69.87 3mep n THR 188 CO 0.00 0.00 0.00 0.42 -3.05 0.00 0.00 175.07 172.44 3mep s THR 189 N -2.53 2.50 -1.70 1.09 -4.23 -1.26 0.12 115.64 109.62 3mep s THR 189 Ca 0.10 0.35 0.00 0.00 -1.18 0.00 0.00 61.69 60.96 3mep s THR 189 Cb -0.02 -3.17 0.00 0.00 1.34 0.00 0.00 72.50 70.65 3mep s THR 189 CO 0.07 -0.03 0.43 -0.81 -0.54 0.00 0.00 174.62 173.74