#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2c2t n GLY 2 N 0.00 -0.97 3.39 2.92 0.00 -1.26 -4.86 105.19 104.41 2c2t n GLY 2 Ca 0.00 -0.34 -0.15 0.00 0.00 0.00 0.00 46.02 45.54 2c2t n GLY 2 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2c2t s SER 3 N -2.72 -0.46 0.15 1.61 0.15 -1.26 -4.22 113.70 106.94 2c2t s SER 3 Ca 0.19 0.63 0.08 0.00 0.70 0.00 0.00 55.95 57.56 2c2t s SER 3 Cb 0.19 0.66 -0.04 0.00 -1.71 0.00 0.00 66.02 65.12 2c2t s SER 3 CO 0.58 -0.40 -0.19 -0.76 1.20 0.00 0.00 173.24 173.68 2c2t s LEU 4 N -0.69 2.40 -0.03 3.45 1.43 -1.10 -4.55 118.68 119.59 2c2t s LEU 4 Ca -0.08 -0.81 0.05 0.00 -1.03 0.00 0.00 54.13 52.26 2c2t s LEU 4 Cb -0.03 -0.83 -0.01 0.00 0.03 0.00 0.00 46.19 45.35 2c2t s LEU 4 CO 0.05 -0.01 -0.17 0.20 0.23 0.00 0.00 176.35 176.64 2c2t s ASN 5 N -2.45 2.10 0.09 2.29 0.01 -0.59 -2.07 114.94 114.33 2c2t s ASN 5 Ca 0.13 -0.33 0.06 0.00 -0.71 0.00 0.00 52.86 52.01 2c2t s ASN 5 Cb -0.07 -0.40 -0.04 0.00 0.41 0.00 0.00 41.25 41.16 2c2t s ASN 5 CO 0.06 0.19 -0.08 0.00 -1.51 0.00 0.00 177.10 175.75 2c2t s ILE 7 N -1.20 -0.03 0.04 0.00 2.07 -0.59 -0.74 121.20 120.75 2c2t s ILE 7 Ca 0.21 0.13 -0.19 0.00 -1.41 0.00 0.00 60.65 59.39 2c2t s ILE 7 Cb -0.11 -0.14 0.04 0.00 0.13 0.00 0.00 42.46 42.38 2c2t s ILE 7 CO 0.13 0.05 0.44 0.54 -1.91 0.00 0.00 174.94 174.20 2c2t s VAL 8 N 0.73 0.05 -0.08 4.00 0.11 -0.54 -4.52 120.40 120.15 2c2t s VAL 8 Ca -0.06 -0.40 0.05 0.00 -2.93 0.00 0.00 61.98 58.64 2c2t s VAL 8 Cb -0.08 -0.95 -0.00 0.00 -1.53 0.00 0.00 36.38 33.82 2c2t s VAL 8 CO -0.03 -0.22 -0.23 0.00 -3.33 0.00 0.00 175.10 171.29 2c2t s ALA 9 N -2.41 2.06 -0.01 1.54 0.00 -1.26 -1.03 121.76 120.66 2c2t s ALA 9 Ca -0.06 -0.95 0.00 0.00 0.00 0.00 0.00 51.96 50.96 2c2t s ALA 9 Cb -0.01 -0.72 0.01 0.00 0.00 0.00 0.00 23.12 22.40 2c2t s ALA 9 CO -0.02 0.33 0.00 0.08 0.00 0.00 0.00 175.76 176.15 2c2t s VAL 10 N 0.14 0.01 0.83 0.00 1.01 -0.12 -4.62 120.40 117.66 2c2t s VAL 10 Ca -0.12 0.04 -0.12 0.00 0.00 0.00 0.00 61.98 61.78 2c2t s VAL 10 Cb -0.16 -0.05 0.09 0.00 0.00 0.00 0.00 36.38 36.26 2c2t s VAL 10 CO 0.06 0.03 1.19 -0.94 0.00 0.00 0.00 175.10 175.44 2c2t s SER 11 N 0.28 4.31 0.41 3.32 1.04 -0.34 -0.55 113.70 122.18 2c2t s SER 11 Ca -0.02 0.76 0.08 0.00 0.48 0.00 0.00 55.95 57.24 2c2t s SER 11 Cb -0.04 -1.22 0.87 0.00 0.10 0.00 0.00 66.02 65.73 2c2t s SER 11 CO -0.01 -2.02 2.05 -0.61 0.98 0.00 0.00 173.24 173.63 2c2t h GLN 12 N -1.14 0.54 -0.83 4.02 4.15 -0.67 -0.37 115.11 120.81 2c2t h GLN 12 Ca -0.46 -0.03 -0.03 0.00 0.77 0.00 0.00 58.65 58.90 2c2t h GLN 12 Cb 1.32 -0.12 -0.02 0.00 0.21 0.00 0.00 27.48 28.88 2c2t h GLN 12 CO 0.64 0.36 0.03 0.27 -1.93 0.00 0.00 178.83 178.20 2c2t n ASN 13 N -4.47 3.22 -0.56 -0.69 6.94 -1.26 -4.89 115.26 113.55 2c2t n ASN 13 Ca 0.04 -2.47 -0.07 0.00 -0.02 0.00 0.00 54.58 52.06 2c2t n ASN 13 Cb 0.09 -0.60 -0.03 0.00 -2.36 0.00 0.00 39.78 36.89 2c2t n ASN 13 CO 0.00 0.00 0.00 0.23 -1.03 0.00 0.00 177.26 176.46 2c2t n MET 14 N 0.23 -0.72 -2.64 -3.83 2.81 -0.15 -4.98 117.12 107.83 2c2t n MET 14 Ca 0.15 0.70 -0.40 0.00 -1.81 0.00 0.00 57.70 56.33 2c2t n MET 14 Cb 0.73 -4.55 -0.05 0.00 -0.71 0.00 0.00 33.22 28.64 2c2t n MET 14 CO 0.00 0.00 0.00 0.20 1.51 0.00 0.00 175.97 177.68 2c2t s GLY 15 N -2.69 3.07 0.00 3.03 0.00 -1.25 -0.70 107.32 108.77 2c2t s GLY 15 Ca 0.00 0.72 0.00 0.00 0.00 0.00 0.00 44.72 45.44 2c2t s GLY 15 CO 0.00 1.30 0.00 0.29 0.00 0.00 0.00 173.10 174.69 2c2t n ILE 16 N 1.29 0.00 -3.68 0.90 -5.35 0.73 -1.20 119.36 112.04 2c2t n ILE 16 Ca -0.01 -0.15 -0.11 0.00 -0.27 0.00 0.00 62.75 62.21 2c2t n ILE 16 Cb 0.46 0.62 -0.06 0.00 -1.74 0.00 0.00 39.64 38.93 2c2t n ILE 16 CO 0.00 0.00 0.00 -0.83 -1.76 0.00 0.00 176.55 173.96 2c2t s GLY 17 N -1.44 -0.21 -0.20 3.28 0.00 -1.03 -4.42 107.32 103.30 2c2t s GLY 17 Ca 0.00 -0.02 -0.07 0.00 0.00 0.00 0.00 44.72 44.63 2c2t s GLY 17 CO 0.00 -0.27 0.42 1.25 0.00 0.00 0.00 173.10 174.50 2c2t s LYS 18 N -3.33 0.33 -1.48 2.90 2.47 0.05 -0.49 119.74 120.19 2c2t s LYS 18 Ca 0.00 1.02 -0.11 0.00 -1.56 0.00 0.00 55.97 55.32 2c2t s LYS 18 Cb 0.01 0.31 0.07 0.00 -1.46 0.00 0.00 37.83 36.76 2c2t s LYS 18 CO -0.08 -0.24 0.93 0.09 0.16 0.00 0.00 175.35 176.21 2c2t n ASN 19 N 5.29 -4.11 -0.06 1.43 3.02 -1.26 -1.74 115.26 117.84 2c2t n ASN 19 Ca -0.10 -0.78 -0.01 0.00 -0.03 0.00 0.00 54.58 53.67 2c2t n ASN 19 Cb 0.50 -3.96 -0.00 0.00 -0.61 0.00 0.00 39.78 35.71 2c2t n ASN 19 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2c2t n GLY 20 N -1.69 0.44 1.00 7.41 0.00 -1.26 -4.99 105.19 106.10 2c2t n GLY 20 Ca -0.03 -0.13 -0.06 0.00 0.00 0.00 0.00 46.02 45.80 2c2t n GLY 20 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2c2t n ASP 21 N -0.00 0.01 -4.82 1.61 -0.08 -0.71 -4.71 116.55 107.85 2c2t n ASP 21 Ca -0.01 -1.68 -0.33 0.00 -1.51 0.00 0.00 54.79 51.27 2c2t n ASP 21 Cb 0.12 0.48 -0.03 0.00 2.34 0.00 0.00 41.12 44.03 2c2t n ASP 21 CO 0.00 0.00 0.00 -0.76 0.12 0.00 0.00 177.20 176.56 2c2t s LEU 22 N 0.00 3.70 0.44 -2.67 1.43 -1.26 -0.77 118.68 119.54 2c2t s LEU 22 Ca 0.11 1.74 0.28 0.00 -1.03 0.00 0.00 54.13 55.23 2c2t s LEU 22 Cb 0.01 -4.53 0.94 0.00 0.03 0.00 0.00 46.19 42.64 2c2t s LEU 22 CO 0.08 -0.74 1.81 -0.65 0.23 0.00 0.00 176.35 177.08 2c2t h PRO 23 N 1.11 0.00 -6.18 1.29 0.11 -1.83 -3.40 132.00 123.09 2c2t h PRO 23 Ca -0.48 0.00 -0.54 0.00 0.11 0.00 0.00 66.00 65.09 2c2t h PRO 23 Cb 1.20 0.00 -0.08 0.00 0.11 0.00 0.00 31.00 32.23 2c2t h PRO 23 CO 0.60 0.00 -0.59 1.67 -0.21 0.00 0.00 178.00 179.47 2c2t s TRP 24 N -3.42 2.81 0.71 0.65 -2.14 -1.26 -4.75 118.94 111.55 2c2t s TRP 24 Ca 0.04 -0.22 -0.13 0.00 2.66 0.00 0.00 56.10 58.46 2c2t s TRP 24 Cb 0.08 -1.34 0.02 0.00 -3.10 0.00 0.00 33.47 29.14 2c2t s TRP 24 CO 0.56 0.54 1.09 -1.25 -2.66 0.00 0.00 176.95 175.23 2c2t s PRO 25 N -3.76 2.59 0.24 3.25 0.04 -1.26 -4.91 135.00 131.19 2c2t s PRO 25 Ca 0.33 1.23 -0.31 0.00 0.04 0.00 0.00 61.00 62.29 2c2t s PRO 25 Cb -0.06 -1.93 -0.13 0.00 0.04 0.00 0.00 34.50 32.41 2c2t s PRO 25 CO 0.22 -1.39 1.46 -2.30 0.04 0.00 0.00 177.00 175.03 2c2t n PRO 26 N -2.98 2.17 -3.94 0.56 -0.02 -1.26 -4.97 135.00 124.56 2c2t n PRO 26 Ca 0.09 0.77 -0.33 0.00 -2.02 0.00 0.00 63.50 62.02 2c2t n PRO 26 Cb 0.53 -2.47 -0.14 0.00 -0.02 0.00 0.00 33.50 31.40 2c2t n PRO 26 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 2c2t s LEU 27 N 0.13 4.93 0.13 2.45 1.43 -1.26 -4.99 118.68 121.50 2c2t s LEU 27 Ca 0.69 -2.11 -0.18 0.00 -1.03 0.00 0.00 54.13 51.49 2c2t s LEU 27 Cb -0.63 -1.70 -0.03 0.00 0.03 0.00 0.00 46.19 43.86 2c2t s LEU 27 CO 0.48 -0.44 1.78 -0.09 0.23 0.00 0.00 176.35 178.31 2c2t h ARG 28 N 7.76 0.31 0.00 1.70 2.43 -1.98 -0.93 114.38 123.68 2c2t h ARG 28 Ca -0.07 -0.02 -0.10 0.00 -0.81 0.00 0.00 59.98 58.98 2c2t h ARG 28 Cb 1.03 -0.07 -0.01 0.00 -0.42 0.00 0.00 29.97 30.50 2c2t h ARG 28 CO 0.58 0.21 -0.46 -0.91 -1.51 0.00 0.00 179.97 177.88 2c2t h ASN 29 N 0.32 0.00 -0.30 -3.80 -0.26 -1.98 0.51 115.58 110.07 2c2t h ASN 29 Ca 0.10 0.00 -0.07 0.00 -0.56 0.00 0.00 56.30 55.77 2c2t h ASN 29 Cb -0.01 0.00 -0.01 0.00 -1.06 0.00 0.00 38.32 37.24 2c2t h ASN 29 CO -0.04 0.46 -0.08 -0.08 -1.06 0.00 0.00 177.43 176.62 2c2t h GLU 30 N 0.00 0.58 -0.42 0.81 4.22 -1.88 -1.04 114.58 116.85 2c2t h GLU 30 Ca -0.00 -0.23 0.04 0.00 0.08 0.00 0.00 59.36 59.25 2c2t h GLU 30 Cb 0.82 -0.03 -0.04 0.00 0.50 0.00 0.00 28.75 30.00 2c2t h GLU 30 CO 0.06 0.78 0.19 0.35 -2.18 0.00 0.00 179.01 178.21 2c2t h PHE 31 N 0.35 0.34 -0.20 0.92 3.57 -0.91 -1.79 116.94 119.22 2c2t h PHE 31 Ca 0.07 0.02 -0.01 0.00 3.53 0.00 0.00 57.97 61.58 2c2t h PHE 31 Cb 0.58 -0.09 -0.01 0.00 2.79 0.00 0.00 35.95 39.21 2c2t h PHE 31 CO 0.05 0.16 0.08 0.00 -2.23 0.00 0.00 178.31 176.38 2c2t h ARG 32 N 0.38 0.28 -0.14 1.11 3.08 -0.66 0.30 114.38 118.72 2c2t h ARG 32 Ca 0.19 -0.03 -0.02 0.00 0.07 0.00 0.00 59.98 60.19 2c2t h ARG 32 Cb 0.13 -0.06 -0.00 0.00 0.08 0.00 0.00 29.97 30.12 2c2t h ARG 32 CO -0.16 0.23 -0.00 -0.92 -1.07 0.00 0.00 179.97 178.05 2c2t h TYR 33 N 0.28 0.27 -0.39 3.04 5.03 -0.63 0.41 116.97 124.98 2c2t h TYR 33 Ca 0.07 -0.05 0.05 0.00 2.58 0.00 0.00 58.73 61.38 2c2t h TYR 33 Cb 0.06 -0.07 -0.05 0.00 1.55 0.00 0.00 36.73 38.22 2c2t h TYR 33 CO 0.00 0.48 0.12 0.35 -1.32 0.00 0.00 178.16 177.80 2c2t h PHE 34 N -0.02 0.21 -0.28 -3.82 3.57 -0.58 -0.39 116.94 115.64 2c2t h PHE 34 Ca 0.04 0.02 0.03 0.00 3.53 0.00 0.00 57.97 61.59 2c2t h PHE 34 Cb 0.38 -0.04 -0.03 0.00 2.79 0.00 0.00 35.95 39.05 2c2t h PHE 34 CO 0.04 0.07 0.08 0.37 -2.23 0.00 0.00 178.31 176.64 2c2t h GLN 35 N 0.27 0.19 -0.14 1.11 4.15 -0.79 -1.34 115.11 118.56 2c2t h GLN 35 Ca 0.18 -0.01 -0.01 0.00 0.77 0.00 0.00 58.65 59.58 2c2t h GLN 35 Cb 0.18 -0.04 -0.01 0.00 0.21 0.00 0.00 27.48 27.82 2c2t h GLN 35 CO -0.20 0.13 0.05 -0.09 -1.93 0.00 0.00 178.83 176.79 2c2t h ARG 36 N 0.20 0.22 -0.29 1.69 2.43 -0.48 -0.32 114.38 117.82 2c2t h ARG 36 Ca 0.12 -0.04 -0.04 0.00 -0.81 0.00 0.00 59.98 59.21 2c2t h ARG 36 Cb 0.11 -0.03 -0.01 0.00 -0.42 0.00 0.00 29.97 29.61 2c2t h ARG 36 CO -0.14 0.32 0.03 0.52 -1.51 0.00 0.00 179.97 179.19 2c2t h MET 37 N 0.07 0.49 0.00 0.20 2.86 -0.95 -1.88 114.93 115.72 2c2t h MET 37 Ca 0.05 -0.14 -0.11 0.00 -2.06 0.00 0.00 59.70 57.43 2c2t h MET 37 Cb 0.19 -0.05 -0.02 0.00 0.06 0.00 0.00 31.60 31.78 2c2t h MET 37 CO -0.00 0.61 -0.53 1.79 1.06 0.00 0.00 176.91 179.84 2c2t h THR 38 N 0.30 1.12 0.00 2.22 1.35 -1.23 -3.31 112.91 113.37 2c2t h THR 38 Ca 0.09 -2.01 -0.22 0.00 -0.55 0.00 0.00 66.41 63.71 2c2t h THR 38 Cb 0.37 2.17 -0.04 0.00 -1.73 0.00 0.00 68.15 68.92 2c2t h THR 38 CO 0.01 0.52 -1.47 0.74 -0.25 0.00 0.00 175.52 175.07 2c2t h THR 39 N 0.00 0.75 -2.98 6.82 2.02 -0.96 -3.43 112.91 115.13 2c2t h THR 39 Ca -0.01 -2.41 -0.57 0.00 0.77 0.00 0.00 66.41 64.19 2c2t h THR 39 Cb 1.13 2.28 -0.04 0.00 -1.74 0.00 0.00 68.15 69.77 2c2t h THR 39 CO 0.07 0.43 0.92 -0.89 0.37 0.00 0.00 175.52 176.42 2c2t s THR 40 N -2.77 4.25 0.04 3.16 2.01 -0.71 -4.63 115.64 116.99 2c2t s THR 40 Ca -0.03 1.48 0.00 0.00 0.31 0.00 0.00 61.69 63.45 2c2t s THR 40 Cb 0.08 -4.05 -0.04 0.00 0.01 0.00 0.00 72.50 68.50 2c2t s THR 40 CO 0.81 -0.24 0.16 -0.55 -0.69 0.00 0.00 174.62 174.12 2c2t s SER 41 N 2.21 6.10 0.14 3.53 0.15 -1.26 -4.93 113.70 119.64 2c2t s SER 41 Ca 0.55 0.21 0.14 0.00 0.70 0.00 0.00 55.95 57.54 2c2t s SER 41 Cb -0.20 -1.82 -0.09 0.00 -1.71 0.00 0.00 66.02 62.20 2c2t s SER 41 CO 0.17 0.20 1.11 0.77 1.20 0.00 0.00 173.24 176.69 2c2t h SER 42 N 3.37 0.00 -3.44 5.45 4.64 -1.94 -3.47 113.55 118.16 2c2t h SER 42 Ca -0.47 0.00 -0.64 0.00 -0.47 0.00 0.00 61.79 60.21 2c2t h SER 42 Cb 1.17 0.00 -0.22 0.00 -0.31 0.00 0.00 62.40 63.03 2c2t h SER 42 CO 0.71 0.68 -0.65 -0.69 -0.87 0.00 0.00 176.83 176.01 2c2t s VAL 43 N -2.86 4.04 0.34 0.95 1.01 -1.26 -5.07 120.40 117.55 2c2t s VAL 43 Ca 0.00 -0.28 -0.29 0.00 0.00 0.00 0.00 61.98 61.41 2c2t s VAL 43 Cb 0.08 -2.83 -0.11 0.00 0.00 0.00 0.00 36.38 33.52 2c2t s VAL 43 CO 0.79 0.42 1.42 -1.61 0.00 0.00 0.00 175.10 176.13 2c2t s GLU 44 N 1.01 4.22 0.00 2.72 2.02 -1.26 -2.67 118.70 124.74 2c2t s GLU 44 Ca 0.02 2.42 0.00 0.00 0.02 0.00 0.00 54.97 57.43 2c2t s GLU 44 Cb -0.14 -3.02 0.00 0.00 0.10 0.00 0.00 34.13 31.06 2c2t s GLU 44 CO 0.02 -0.40 0.00 0.41 0.02 0.00 0.00 175.26 175.31 2c2t n GLY 45 N 0.88 0.84 3.36 -1.39 0.00 -1.26 -5.03 105.19 102.60 2c2t n GLY 45 Ca 0.02 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.77 2c2t n GLY 45 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2c2t s LYS 46 N -0.15 1.33 0.20 1.61 1.02 -1.09 -4.83 119.74 117.83 2c2t s LYS 46 Ca 0.00 -1.32 0.07 0.00 0.02 0.00 0.00 55.97 54.75 2c2t s LYS 46 Cb 0.00 -1.72 -0.04 0.00 -0.52 0.00 0.00 37.83 35.55 2c2t s LYS 46 CO 0.00 0.40 0.04 -0.65 -0.92 0.00 0.00 175.35 174.22 2c2t s GLN 47 N -2.12 2.51 0.49 1.68 -0.21 -0.37 -4.79 119.66 116.86 2c2t s GLN 47 Ca 0.13 -1.12 -0.16 0.00 0.02 0.00 0.00 55.36 54.23 2c2t s GLN 47 Cb -0.10 -2.38 -0.08 0.00 1.00 0.00 0.00 33.01 31.45 2c2t s GLN 47 CO 0.06 0.44 0.95 -0.80 -2.12 0.00 0.00 175.29 173.81 2c2t s ASN 48 N -3.19 6.61 -0.16 5.90 0.01 -1.26 -0.25 114.94 122.60 2c2t s ASN 48 Ca 0.29 1.50 -0.06 0.00 -0.71 0.00 0.00 52.86 53.88 2c2t s ASN 48 Cb -0.09 -2.48 -0.04 0.00 0.41 0.00 0.00 41.25 39.06 2c2t s ASN 48 CO 0.20 -0.55 0.04 -0.22 -1.51 0.00 0.00 177.10 175.06 2c2t s LEU 49 N -4.02 3.74 -0.13 0.60 2.96 0.04 -1.15 118.68 120.73 2c2t s LEU 49 Ca 0.58 0.09 -0.03 0.00 -0.22 0.00 0.00 54.13 54.54 2c2t s LEU 49 Cb -0.10 -1.92 -0.03 0.00 0.50 0.00 0.00 46.19 44.64 2c2t s LEU 49 CO 0.31 0.22 -0.03 0.68 -1.32 0.00 0.00 176.35 176.22 2c2t s VAL 50 N 0.07 4.03 -0.13 1.68 -7.23 0.32 -0.43 120.40 118.70 2c2t s VAL 50 Ca 0.04 -0.32 0.01 0.00 -1.81 0.00 0.00 61.98 59.90 2c2t s VAL 50 Cb -0.12 -2.74 -0.01 0.00 0.56 0.00 0.00 36.38 34.07 2c2t s VAL 50 CO 0.01 0.53 -0.17 -0.63 -0.31 0.00 0.00 175.10 174.53 2c2t s ILE 51 N -0.08 2.63 0.07 -0.62 1.01 -0.15 -1.19 121.20 122.87 2c2t s ILE 51 Ca 0.03 -0.80 -0.06 0.00 0.00 0.00 0.00 60.65 59.82 2c2t s ILE 51 Cb -0.13 -2.09 -0.02 0.00 0.01 0.00 0.00 42.46 40.24 2c2t s ILE 51 CO 0.02 0.53 0.11 0.00 0.00 0.00 0.00 174.94 175.60 2c2t s MET 52 N 0.55 0.74 0.85 2.79 0.23 -0.77 -1.36 119.30 122.32 2c2t s MET 52 Ca -0.10 -1.02 -0.13 0.00 -1.03 0.00 0.00 55.69 53.41 2c2t s MET 52 Cb -0.16 0.29 0.12 0.00 -1.53 0.00 0.00 34.83 33.54 2c2t s MET 52 CO 0.04 -0.20 1.21 0.20 -2.03 0.00 0.00 175.02 174.24 2c2t s GLY 53 N -2.80 1.66 0.15 3.16 0.00 0.11 -0.36 107.32 109.24 2c2t s GLY 53 Ca 0.04 -0.87 -0.11 0.00 0.00 0.00 0.00 44.72 43.79 2c2t s GLY 53 CO -0.10 -0.29 1.51 1.70 0.00 0.00 0.00 173.10 175.92 2c2t h LYS 54 N -1.20 0.97 -0.35 2.90 3.64 -1.90 -1.89 116.57 118.74 2c2t h LYS 54 Ca -0.45 -0.46 -0.10 0.00 -1.27 0.00 0.00 60.65 58.37 2c2t h LYS 54 Cb 1.30 -0.01 -0.02 0.00 -0.41 0.00 0.00 32.23 33.09 2c2t h LYS 54 CO 0.56 1.12 -0.20 0.87 -2.27 0.00 0.00 179.45 179.54 2c2t h LYS 55 N 0.80 0.65 -0.54 1.90 1.57 -1.94 -1.64 116.57 117.38 2c2t h LYS 55 Ca 0.09 -0.24 -0.04 0.00 -1.87 0.00 0.00 60.65 58.58 2c2t h LYS 55 Cb 0.88 -0.04 -0.02 0.00 0.08 0.00 0.00 32.23 33.12 2c2t h LYS 55 CO 0.08 0.81 0.17 1.15 -0.57 0.00 0.00 179.45 181.09 2c2t h THR 56 N 0.58 1.23 -0.07 -0.16 2.02 -1.83 -1.75 112.91 112.94 2c2t h THR 56 Ca 0.09 -0.78 0.04 0.00 0.77 0.00 0.00 66.41 66.53 2c2t h THR 56 Cb 0.66 0.73 -0.05 0.00 -1.74 0.00 0.00 68.15 67.75 2c2t h THR 56 CO 0.05 0.29 -0.26 -0.25 0.37 0.00 0.00 175.52 175.71 2c2t h TRP 57 N 0.74 -0.71 0.00 3.16 2.91 -0.96 -1.87 115.95 119.22 2c2t h TRP 57 Ca 0.17 0.03 0.00 0.00 1.13 0.00 0.00 58.89 60.22 2c2t h TRP 57 Cb 0.27 0.33 0.00 0.00 -0.51 0.00 0.00 29.16 29.25 2c2t h TRP 57 CO 0.02 -0.35 0.00 1.19 -1.03 0.00 0.00 178.44 178.27 2c2t n PHE 58 N -5.38 0.38 0.62 2.65 3.01 -0.65 -1.88 117.46 116.20 2c2t n PHE 58 Ca -0.04 0.15 0.13 0.00 1.01 0.00 0.00 57.45 58.70 2c2t n PHE 58 Cb 0.29 -0.74 0.39 0.00 -0.01 0.00 0.00 39.48 39.41 2c2t n PHE 58 CO 0.00 0.00 0.00 -1.13 1.01 0.00 0.00 176.76 176.64 2c2t n SER 59 N -1.84 0.82 -4.72 4.37 3.41 -0.68 -4.79 113.62 110.19 2c2t n SER 59 Ca 0.03 0.55 -0.41 0.00 -0.26 0.00 0.00 58.87 58.77 2c2t n SER 59 Cb 0.21 -0.73 -0.04 0.00 -0.26 0.00 0.00 64.21 63.39 2c2t n SER 59 CO 0.00 0.00 0.00 -0.63 -0.16 0.00 0.00 175.04 174.25 2c2t s ILE 60 N -3.11 4.68 0.36 -1.33 1.01 -0.79 -4.98 121.20 117.05 2c2t s ILE 60 Ca 0.10 2.04 -0.28 0.00 0.00 0.00 0.00 60.65 62.51 2c2t s ILE 60 Cb 0.12 -4.31 -0.12 0.00 0.01 0.00 0.00 42.46 38.17 2c2t s ILE 60 CO 0.61 0.25 1.41 -2.65 0.00 0.00 0.00 174.94 174.55 2c2t n PRO 61 N 3.29 2.45 -0.29 2.79 -0.02 -1.26 -4.83 135.00 137.14 2c2t n PRO 61 Ca 0.04 0.86 0.17 0.00 -2.02 0.00 0.00 63.50 62.55 2c2t n PRO 61 Cb 0.50 -2.53 0.45 0.00 -0.02 0.00 0.00 33.50 31.90 2c2t n PRO 61 CO 0.00 0.00 0.00 1.49 1.98 0.00 0.00 175.50 178.97 2c2t h GLU 62 N 2.80 0.51 -0.04 -0.52 4.81 -1.93 0.14 114.58 120.34 2c2t h GLU 62 Ca -0.49 -0.03 0.01 0.00 -0.13 0.00 0.00 59.36 58.72 2c2t h GLU 62 Cb 1.26 -0.12 -0.00 0.00 0.63 0.00 0.00 28.75 30.52 2c2t h GLU 62 CO 0.63 0.34 0.06 1.57 -0.73 0.00 0.00 179.01 180.88 2c2t h LYS 63 N 0.53 0.00 -0.31 1.92 2.10 -2.01 -2.29 116.57 116.51 2c2t h LYS 63 Ca 0.51 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 59.16 2c2t h LYS 63 Cb 1.11 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.44 2c2t h LYS 63 CO -0.25 0.00 0.00 0.09 -2.00 0.00 0.00 179.45 177.29 2c2t n ASN 64 N -3.67 2.87 -4.77 7.07 5.03 0.49 -4.96 115.26 117.33 2c2t n ASN 64 Ca -0.02 -1.87 -0.36 0.00 0.87 0.00 0.00 54.58 53.21 2c2t n ASN 64 Cb 0.15 -0.20 -0.08 0.00 -1.02 0.00 0.00 39.78 38.63 2c2t n ASN 64 CO 0.00 0.00 0.00 -0.13 -1.83 0.00 0.00 177.26 175.30 2c2t s ARG 65 N -1.07 3.55 0.66 3.52 0.52 -0.86 -3.03 118.95 122.23 2c2t s ARG 65 Ca 0.26 -0.25 -0.14 0.00 -0.52 0.00 0.00 55.73 55.08 2c2t s ARG 65 Cb 0.14 -3.14 -0.00 0.00 0.52 0.00 0.00 34.95 32.48 2c2t s ARG 65 CO 0.20 0.60 1.09 -1.25 0.02 0.00 0.00 175.30 175.95 2c2t s PRO 66 N -0.53 2.87 -0.03 3.54 0.04 -1.26 -4.98 135.00 134.64 2c2t s PRO 66 Ca 0.11 1.26 -0.34 0.00 0.04 0.00 0.00 61.00 62.07 2c2t s PRO 66 Cb -0.12 -1.97 -0.13 0.00 0.04 0.00 0.00 34.50 32.33 2c2t s PRO 66 CO 0.02 -1.18 1.79 1.28 0.04 0.00 0.00 177.00 178.95 2c2t n LEU 67 N -2.55 3.27 -4.77 -3.56 4.77 -1.17 -4.87 117.00 108.12 2c2t n LEU 67 Ca 0.09 1.01 -0.41 0.00 -0.03 0.00 0.00 56.01 56.68 2c2t n LEU 67 Cb 0.52 -1.37 0.00 0.00 -2.33 0.00 0.00 43.42 40.25 2c2t n LEU 67 CO 0.49 -0.15 1.11 -1.59 -1.33 0.00 0.00 177.39 175.92 2c2t s LYS 68 N 3.20 3.99 -0.19 3.23 -2.85 -1.26 -3.26 119.74 122.59 2c2t s LYS 68 Ca 0.89 2.51 0.00 0.00 -1.00 0.00 0.00 55.97 58.37 2c2t s LYS 68 Cb -0.71 -2.88 0.00 0.00 -2.06 0.00 0.00 37.83 32.18 2c2t s LYS 68 CO 0.49 -0.60 0.00 0.41 0.10 0.00 0.00 175.35 175.74 2c2t n GLY 69 N 0.51 0.48 3.00 0.59 0.00 -1.26 -4.98 105.19 103.52 2c2t n GLY 69 Ca 0.02 -0.19 -0.12 0.00 0.00 0.00 0.00 46.02 45.74 2c2t n GLY 69 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2c2t s ARG 70 N -1.16 0.38 -0.05 1.61 0.52 -1.20 -4.53 118.95 114.52 2c2t s ARG 70 Ca 0.00 -0.54 -0.30 0.00 -0.52 0.00 0.00 55.73 54.37 2c2t s ARG 70 Cb 0.00 -0.14 -0.03 0.00 0.52 0.00 0.00 34.95 35.30 2c2t s ARG 70 CO 0.00 0.02 1.10 0.42 0.02 0.00 0.00 175.30 176.86 2c2t s ILE 71 N -1.07 4.50 -0.23 1.52 1.01 -0.30 -4.78 121.20 121.85 2c2t s ILE 71 Ca -0.09 1.79 -0.07 0.00 0.00 0.00 0.00 60.65 62.28 2c2t s ILE 71 Cb -0.08 -4.15 -0.03 0.00 0.01 0.00 0.00 42.46 38.21 2c2t s ILE 71 CO -0.00 0.04 0.05 0.20 0.00 0.00 0.00 174.94 175.23 2c2t s ASN 72 N 1.23 5.11 -0.10 3.58 0.02 -1.26 -0.53 114.94 123.00 2c2t s ASN 72 Ca 0.53 -0.17 0.03 0.00 -1.02 0.00 0.00 52.86 52.22 2c2t s ASN 72 Cb -0.23 -1.90 0.01 0.00 0.02 0.00 0.00 41.25 39.15 2c2t s ASN 72 CO 0.22 0.01 -0.18 -0.22 0.02 0.00 0.00 177.10 176.96 2c2t s LEU 73 N 1.32 1.87 -0.09 0.60 0.20 -0.33 -1.30 118.68 120.95 2c2t s LEU 73 Ca 0.05 -0.46 -0.02 0.00 0.69 0.00 0.00 54.13 54.39 2c2t s LEU 73 Cb -0.15 -1.16 -0.03 0.00 -0.43 0.00 0.00 46.19 44.42 2c2t s LEU 73 CO 0.03 0.08 -0.01 -0.69 -0.29 0.00 0.00 176.35 175.47 2c2t s VAL 74 N 0.65 4.22 -0.15 1.68 1.01 -0.44 -1.85 120.40 125.52 2c2t s VAL 74 Ca -0.13 -0.28 -0.14 0.00 0.00 0.00 0.00 61.98 61.43 2c2t s VAL 74 Cb -0.16 -2.78 -0.05 0.00 0.00 0.00 0.00 36.38 33.39 2c2t s VAL 74 CO 0.04 0.59 0.30 -0.76 0.00 0.00 0.00 175.10 175.27 2c2t s LEU 75 N -0.75 4.26 -0.15 3.92 1.43 0.51 -1.61 118.68 126.29 2c2t s LEU 75 Ca 0.12 0.54 -0.29 0.00 -1.03 0.00 0.00 54.13 53.47 2c2t s LEU 75 Cb -0.12 -2.38 0.09 0.00 0.03 0.00 0.00 46.19 43.81 2c2t s LEU 75 CO 0.02 0.12 0.78 -0.55 0.23 0.00 0.00 176.35 176.96 2c2t s SER 76 N 0.32 -0.61 0.02 2.29 0.15 -0.72 -3.17 113.70 111.98 2c2t s SER 76 Ca 0.17 0.88 0.19 0.00 0.70 0.00 0.00 55.95 57.89 2c2t s SER 76 Cb -0.13 0.79 -0.18 0.00 -1.71 0.00 0.00 66.02 64.78 2c2t s SER 76 CO 0.05 -0.42 0.66 0.54 1.20 0.00 0.00 173.24 175.27 2c2t n ARG 77 N 1.50 0.64 -0.01 5.44 1.74 -1.26 -4.04 116.66 120.67 2c2t n ARG 77 Ca -0.15 0.06 -0.16 0.00 -0.77 0.00 0.00 57.85 56.82 2c2t n ARG 77 Cb 0.56 -1.69 -0.14 0.00 -1.02 0.00 0.00 32.46 30.17 2c2t n ARG 77 CO 0.00 0.00 0.00 0.39 -1.52 0.00 0.00 177.63 176.50 2c2t n GLU 78 N -2.66 0.71 -2.28 5.56 -0.58 -1.26 -4.90 120.64 115.22 2c2t n GLU 78 Ca -0.10 0.27 -0.36 0.00 -0.42 0.00 0.00 57.16 56.55 2c2t n GLU 78 Cb 0.76 -1.74 -0.01 0.00 -0.57 0.00 0.00 31.44 29.89 2c2t n GLU 78 CO 0.00 0.00 0.00 -0.51 -0.48 0.00 0.00 177.13 176.14 2c2t s LEU 79 N -6.63 3.87 -0.02 -4.62 1.43 -1.26 -4.96 118.68 106.49 2c2t s LEU 79 Ca -0.15 2.21 0.12 0.00 -1.03 0.00 0.00 54.13 55.28 2c2t s LEU 79 Cb 0.07 -4.43 -0.18 0.00 0.03 0.00 0.00 46.19 41.68 2c2t s LEU 79 CO 0.79 -1.05 0.24 0.29 0.23 0.00 0.00 176.35 176.85 2c2t n LYS 80 N -0.91 0.48 -4.25 1.70 4.76 -1.26 -4.97 118.16 113.71 2c2t n LYS 80 Ca 0.10 -0.10 -0.14 0.00 -2.87 0.00 0.00 58.31 55.29 2c2t n LYS 80 Cb 0.50 -1.28 -0.10 0.00 -1.84 0.00 0.00 35.03 32.31 2c2t n LYS 80 CO 0.00 0.00 0.00 -1.21 -1.37 0.00 0.00 177.40 174.82 2c2t s GLU 81 N -2.78 1.06 0.53 1.97 2.02 -1.26 -5.09 118.70 115.15 2c2t s GLU 81 Ca -0.04 -1.44 -0.22 0.00 0.02 0.00 0.00 54.97 53.29 2c2t s GLU 81 Cb 0.07 -0.64 -0.05 0.00 0.10 0.00 0.00 34.13 33.61 2c2t s GLU 81 CO 0.49 0.08 1.29 -2.14 0.02 0.00 0.00 175.26 175.00 2c2t s PRO 82 N -3.67 3.29 0.65 0.39 0.02 -1.26 -4.95 135.00 129.47 2c2t s PRO 82 Ca 0.16 2.06 -0.18 0.00 0.02 0.00 0.00 61.00 63.06 2c2t s PRO 82 Cb 0.02 -2.26 -0.01 0.00 0.02 0.00 0.00 34.50 32.27 2c2t s PRO 82 CO 0.01 -1.02 1.29 -2.30 -0.33 0.00 0.00 177.00 174.65 2c2t n PRO 83 N -0.94 1.09 -1.68 5.54 -0.02 -1.26 -4.82 135.00 132.91 2c2t n PRO 83 Ca 0.10 0.43 -0.51 0.00 -2.02 0.00 0.00 63.50 61.50 2c2t n PRO 83 Cb 0.46 -2.53 -0.06 0.00 -0.02 0.00 0.00 33.50 31.35 2c2t n PRO 83 CO 0.00 0.00 0.00 0.94 1.98 0.00 0.00 175.50 178.42 2c2t n GLN 84 N -1.94 1.74 0.00 -0.52 0.00 -1.26 -0.55 117.38 114.84 2c2t n GLN 84 Ca 0.16 0.63 0.00 0.00 -0.00 0.00 0.00 57.00 57.79 2c2t n GLN 84 Cb 0.48 -2.40 0.00 0.00 0.00 0.00 0.00 30.24 28.32 2c2t n GLN 84 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 2c2t n GLY 85 N 4.00 2.48 3.81 1.69 0.00 -1.26 -4.96 105.19 110.95 2c2t n GLY 85 Ca 0.23 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.89 2c2t n GLY 85 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2c2t s ALA 86 N -2.51 3.26 0.03 4.61 0.00 0.29 -4.13 121.76 123.31 2c2t s ALA 86 Ca 0.00 0.33 -0.12 0.00 0.00 0.00 0.00 51.96 52.18 2c2t s ALA 86 Cb 0.00 -3.02 -0.33 0.00 0.00 0.00 0.00 23.12 19.78 2c2t s ALA 86 CO 0.00 0.23 0.99 0.45 0.00 0.00 0.00 175.76 177.43 2c2t h HIS 87 N 2.93 0.80 -3.88 0.00 -0.00 -1.50 -3.44 115.15 110.06 2c2t h HIS 87 Ca -0.48 -0.59 -0.12 0.00 -0.00 0.00 0.00 60.37 59.19 2c2t h HIS 87 Cb 1.19 -0.03 -0.16 0.00 -0.00 0.00 0.00 27.41 28.40 2c2t h HIS 87 CO 0.62 1.50 -0.52 -0.06 -0.00 0.00 0.00 177.93 179.47 2c2t s PHE 88 N -2.61 0.25 -0.03 2.45 0.08 -0.96 -4.98 117.98 112.18 2c2t s PHE 88 Ca -0.09 -0.62 0.02 0.00 0.12 0.00 0.00 56.93 56.36 2c2t s PHE 88 Cb 0.05 -0.17 0.01 0.00 -0.57 0.00 0.00 43.02 42.34 2c2t s PHE 88 CO 0.92 -0.41 -0.09 -1.17 -0.10 0.00 0.00 175.22 174.37 2c2t s LEU 89 N -2.44 1.75 0.08 -0.37 2.96 -1.26 -1.33 118.68 118.06 2c2t s LEU 89 Ca -0.00 -0.18 0.02 0.00 -0.22 0.00 0.00 54.13 53.74 2c2t s LEU 89 Cb 0.02 -0.54 -0.04 0.00 0.50 0.00 0.00 46.19 46.14 2c2t s LEU 89 CO -0.07 0.05 -0.07 -0.44 -1.32 0.00 0.00 176.35 174.50 2c2t s SER 90 N 0.27 1.04 0.00 3.68 0.01 -0.64 -4.96 113.70 113.10 2c2t s SER 90 Ca -0.04 -0.86 0.26 0.00 1.31 0.00 0.00 55.95 56.62 2c2t s SER 90 Cb -0.09 0.08 0.68 0.00 0.21 0.00 0.00 66.02 66.90 2c2t s SER 90 CO 0.01 -0.39 1.53 0.54 0.41 0.00 0.00 173.24 175.34 2c2t n ARG 91 N 0.43 0.30 -3.62 12.44 1.74 -1.26 -1.76 116.66 124.94 2c2t n ARG 91 Ca -0.16 -0.16 -0.07 0.00 -0.77 0.00 0.00 57.85 56.69 2c2t n ARG 91 Cb 0.59 -1.50 -0.02 0.00 -1.02 0.00 0.00 32.46 30.51 2c2t n ARG 91 CO 0.00 0.00 0.00 -1.54 -1.52 0.00 0.00 177.63 174.57 2c2t s SER 92 N -2.81 -0.33 0.16 0.55 1.04 -1.26 -4.68 113.70 106.36 2c2t s SER 92 Ca 0.17 -0.22 -0.14 0.00 0.48 0.00 0.00 55.95 56.24 2c2t s SER 92 Cb 0.18 0.51 0.04 0.00 0.10 0.00 0.00 66.02 66.85 2c2t s SER 92 CO 0.62 -0.89 1.70 0.25 0.98 0.00 0.00 173.24 175.90 2c2t h LEU 93 N 2.00 0.71 -0.54 2.42 5.85 -1.99 -1.15 115.31 122.61 2c2t h LEU 93 Ca -0.25 -0.18 0.03 0.00 0.84 0.00 0.00 57.88 58.33 2c2t h LEU 93 Cb 1.25 -0.19 -0.04 0.00 0.37 0.00 0.00 40.66 42.06 2c2t h LEU 93 CO 0.29 0.70 0.31 0.44 -0.34 0.00 0.00 178.44 179.84 2c2t h ASP 94 N 0.69 0.48 -0.87 1.25 3.32 -2.00 -0.52 116.42 118.77 2c2t h ASP 94 Ca 0.17 0.01 0.01 0.00 0.02 0.00 0.00 57.03 57.25 2c2t h ASP 94 Cb 0.21 -0.08 -0.04 0.00 0.22 0.00 0.00 39.33 39.64 2c2t h ASP 94 CO -0.01 0.33 0.57 0.44 -1.72 0.00 0.00 179.24 178.85 2c2t h ASP 95 N 0.60 0.99 -0.59 6.45 3.45 -1.92 -1.75 116.42 123.66 2c2t h ASP 95 Ca 0.23 -0.02 -0.01 0.00 0.43 0.00 0.00 57.03 57.65 2c2t h ASP 95 Cb 0.07 -0.24 -0.03 0.00 -0.56 0.00 0.00 39.33 38.57 2c2t h ASP 95 CO -0.12 0.71 0.33 0.00 -1.57 0.00 0.00 179.24 178.59 2c2t h ALA 96 N 1.33 0.75 -0.18 3.45 0.00 -0.37 -2.00 119.26 122.24 2c2t h ALA 96 Ca 0.32 -0.09 -0.13 0.00 0.00 0.00 0.00 54.91 55.01 2c2t h ALA 96 Cb -0.11 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.43 2c2t h ALA 96 CO -0.08 0.26 -0.44 -0.07 0.00 0.00 0.00 179.25 178.93 2c2t h LEU 97 N 0.80 0.47 -1.16 0.00 3.38 -0.81 -2.57 115.31 115.42 2c2t h LEU 97 Ca 0.21 -0.22 -0.02 0.00 0.09 0.00 0.00 57.88 57.94 2c2t h LEU 97 Cb 0.03 -0.13 -0.03 0.00 0.09 0.00 0.00 40.66 40.62 2c2t h LEU 97 CO -0.04 0.85 0.28 0.11 0.09 0.00 0.00 178.44 179.74 2c2t h LYS 98 N 0.36 0.87 -0.18 1.13 1.57 -1.16 -2.97 116.57 116.19 2c2t h LYS 98 Ca 0.03 -0.12 -0.02 0.00 -1.87 0.00 0.00 60.65 58.67 2c2t h LYS 98 Cb 0.91 -0.16 -0.01 0.00 0.08 0.00 0.00 32.23 33.05 2c2t h LYS 98 CO 0.08 0.68 0.03 1.25 -0.57 0.00 0.00 179.45 180.92 2c2t h LEU 99 N 0.87 0.23 -0.89 2.94 5.85 -0.93 -2.89 115.31 120.47 2c2t h LEU 99 Ca 0.21 -0.02 0.00 0.00 0.84 0.00 0.00 57.88 58.91 2c2t h LEU 99 Cb 0.11 -0.06 0.00 0.00 0.37 0.00 0.00 40.66 41.08 2c2t h LEU 99 CO -0.03 0.25 0.00 0.71 -0.34 0.00 0.00 178.44 179.03 2c2t h THR 100 N 0.25 0.00 0.00 1.05 1.35 -1.50 -2.53 112.91 111.53 2c2t h THR 100 Ca 0.06 -0.22 0.00 0.00 -0.55 0.00 0.00 66.41 65.71 2c2t h THR 100 Cb 0.13 0.94 0.00 0.00 -1.73 0.00 0.00 68.15 67.48 2c2t h THR 100 CO -0.00 0.00 -1.41 -0.62 -0.25 0.00 0.00 175.52 173.24 2c2t n GLU 101 N -2.32 0.43 -0.86 4.72 -0.58 -1.09 -3.19 120.64 117.75 2c2t n GLU 101 Ca 0.01 -0.09 -0.32 0.00 -0.42 0.00 0.00 57.16 56.35 2c2t n GLU 101 Cb 0.21 -1.48 0.15 0.00 -0.57 0.00 0.00 31.44 29.74 2c2t n GLU 101 CO 0.00 0.00 0.00 -0.65 -0.48 0.00 0.00 177.13 176.00 2c2t s GLN 102 N -3.17 1.31 0.26 3.49 -1.52 -0.95 -4.47 119.66 114.61 2c2t s GLN 102 Ca 0.01 1.55 -0.02 0.00 -1.95 0.00 0.00 55.36 54.94 2c2t s GLN 102 Cb 0.15 -1.76 0.56 0.00 -0.22 0.00 0.00 33.01 31.74 2c2t s GLN 102 CO 0.85 -2.41 1.67 -1.35 -0.25 0.00 0.00 175.29 173.80 2c2t h PRO 103 N -1.56 0.25 -0.67 2.91 0.11 -1.93 0.30 132.00 131.40 2c2t h PRO 103 Ca -0.44 -0.01 0.03 0.00 0.11 0.00 0.00 66.00 65.69 2c2t h PRO 103 Cb 1.27 -0.06 -0.04 0.00 0.11 0.00 0.00 31.00 32.28 2c2t h PRO 103 CO 0.44 0.16 0.42 1.49 -0.21 0.00 0.00 178.00 180.30 2c2t h GLU 104 N 0.25 0.80 -0.00 1.05 4.81 -1.90 -2.80 114.58 116.78 2c2t h GLU 104 Ca 0.47 -0.05 0.00 0.00 -0.13 0.00 0.00 59.36 59.65 2c2t h GLU 104 Cb 0.86 -0.18 0.00 0.00 0.63 0.00 0.00 28.75 30.06 2c2t h GLU 104 CO -0.57 0.53 -0.70 1.28 -0.73 0.00 0.00 179.01 178.82 2c2t n LEU 105 N -4.68 1.16 -4.67 1.64 4.77 -1.01 -4.88 117.00 109.33 2c2t n LEU 105 Ca 0.07 -0.45 -0.46 0.00 -0.03 0.00 0.00 56.01 55.15 2c2t n LEU 105 Cb 0.08 -0.06 -0.04 0.00 -2.33 0.00 0.00 43.42 41.07 2c2t n LEU 105 CO 0.33 0.25 1.18 0.00 -1.33 0.00 0.00 177.39 177.83 2c2t n ALA 106 N -1.05 1.39 -1.46 -1.18 0.00 0.06 -1.31 120.51 116.96 2c2t n ALA 106 Ca 0.06 0.44 -0.16 0.00 0.00 0.00 0.00 53.44 53.79 2c2t n ALA 106 Cb 0.37 -2.35 -0.07 0.00 0.00 0.00 0.00 19.45 17.40 2c2t n ALA 106 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 2c2t n ASN 107 N 3.33 -5.15 -0.00 0.00 3.02 -1.26 -4.86 115.26 110.34 2c2t n ASN 107 Ca 0.16 0.39 0.04 0.00 -0.03 0.00 0.00 54.58 55.15 2c2t n ASN 107 Cb 0.29 -4.05 -0.05 0.00 -0.61 0.00 0.00 39.78 35.36 2c2t n ASN 107 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 2c2t n LYS 108 N -2.23 2.46 -4.48 3.52 5.02 -0.42 -4.77 118.16 117.24 2c2t n LYS 108 Ca -0.16 -0.03 -0.34 0.00 -2.02 0.00 0.00 58.31 55.76 2c2t n LYS 108 Cb 0.56 -1.01 -0.12 0.00 -0.02 0.00 0.00 35.03 34.44 2c2t n LYS 108 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 2c2t s VAL 109 N -2.10 3.80 0.00 -0.18 1.01 -1.25 -1.24 120.40 120.45 2c2t s VAL 109 Ca 0.00 -0.41 0.00 0.00 0.00 0.00 0.00 61.98 61.58 2c2t s VAL 109 Cb 0.05 -2.63 0.00 0.00 0.00 0.00 0.00 36.38 33.80 2c2t s VAL 109 CO 0.31 0.53 0.00 -0.67 0.00 0.00 0.00 175.10 175.26 2c2t n ASP 110 N 3.17 0.00 -4.86 3.32 4.64 0.65 -4.86 116.55 118.61 2c2t n ASP 110 Ca -0.18 0.00 -0.31 0.00 -1.38 0.00 0.00 54.79 52.92 2c2t n ASP 110 Cb 0.53 0.00 -0.05 0.00 -1.04 0.00 0.00 41.12 40.56 2c2t n ASP 110 CO 0.00 0.00 0.00 -0.04 -0.82 0.00 0.00 177.20 176.34 2c2t s MET 111 N 0.34 3.90 -0.17 -0.67 -1.94 -1.26 -4.88 119.30 114.61 2c2t s MET 111 Ca 0.00 0.60 -0.02 0.00 -1.71 0.00 0.00 55.69 54.56 2c2t s MET 111 Cb 0.00 -2.39 -0.01 0.00 2.01 0.00 0.00 34.83 34.44 2c2t s MET 111 CO 0.00 0.03 -0.08 0.08 -0.01 0.00 0.00 175.02 175.04 2c2t s VAL 112 N -2.21 3.29 -0.14 -6.03 1.01 -1.26 -0.78 120.40 114.28 2c2t s VAL 112 Ca 0.53 -0.55 0.02 0.00 0.00 0.00 0.00 61.98 61.98 2c2t s VAL 112 Cb -0.10 -2.44 0.01 0.00 0.00 0.00 0.00 36.38 33.84 2c2t s VAL 112 CO 0.25 0.48 -0.20 0.26 0.00 0.00 0.00 175.10 175.88 2c2t s TRP 113 N 0.85 2.69 -0.23 5.22 0.52 0.42 -1.53 118.94 126.88 2c2t s TRP 113 Ca -0.02 -1.24 -0.15 0.00 0.02 0.00 0.00 56.10 54.71 2c2t s TRP 113 Cb -0.15 -1.82 -0.04 0.00 -1.15 0.00 0.00 33.47 30.31 2c2t s TRP 113 CO 0.01 -0.56 0.36 0.42 0.02 0.00 0.00 176.95 177.20 2c2t s ILE 114 N 0.77 5.21 -0.26 2.03 1.09 0.11 -0.97 121.20 129.17 2c2t s ILE 114 Ca -0.08 0.60 0.09 0.00 -1.10 0.00 0.00 60.65 60.17 2c2t s ILE 114 Cb -0.16 -3.69 0.21 0.00 -1.06 0.00 0.00 42.46 37.77 2c2t s ILE 114 CO -0.01 0.23 1.15 1.33 -0.10 0.00 0.00 174.94 177.55 2c2t n VAL 115 N 4.59 1.40 0.00 2.92 0.24 -0.47 -1.55 118.33 125.47 2c2t n VAL 115 Ca -0.09 -1.43 0.00 0.00 -2.04 0.00 0.00 64.34 60.78 2c2t n VAL 115 Cb 0.51 0.21 0.00 0.00 -1.47 0.00 0.00 33.84 33.09 2c2t n VAL 115 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2c2t n GLY 116 N -0.50 1.03 0.00 7.63 0.00 -1.26 -4.96 105.19 107.13 2c2t n GLY 116 Ca 0.10 -2.13 0.00 0.00 0.00 0.00 0.00 46.02 43.99 2c2t n GLY 116 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2c2t n GLY 117 N 0.26 1.52 0.21 -0.02 0.00 -1.26 -0.71 105.19 105.19 2c2t n GLY 117 Ca 0.00 -1.67 -0.09 0.00 0.00 0.00 0.00 46.02 44.26 2c2t n GLY 117 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 2c2t h SER 118 N 0.00 -0.51 0.62 1.61 4.64 -1.98 -0.82 113.55 117.11 2c2t h SER 118 Ca 0.00 0.09 -0.07 0.00 -0.47 0.00 0.00 61.79 61.35 2c2t h SER 118 Cb 0.00 0.24 -0.01 0.00 -0.31 0.00 0.00 62.40 62.32 2c2t h SER 118 CO 0.00 -0.21 -0.31 0.28 -0.87 0.00 0.00 176.83 175.71 2c2t h SER 119 N -0.21 0.00 -0.18 4.97 0.02 -1.97 -0.83 113.55 115.36 2c2t h SER 119 Ca 0.09 0.00 -0.09 0.00 -0.84 0.00 0.00 61.79 60.96 2c2t h SER 119 Cb 0.35 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 62.89 2c2t h SER 119 CO -0.25 0.31 -0.23 0.58 -1.14 0.00 0.00 176.83 176.10 2c2t h VAL 120 N 0.00 1.34 -0.51 2.27 2.07 -1.63 -2.49 116.25 117.31 2c2t h VAL 120 Ca -0.00 -1.43 0.01 0.00 0.82 0.00 0.00 66.70 66.10 2c2t h VAL 120 Cb 0.71 1.86 -0.03 0.00 -1.52 0.00 0.00 31.29 32.31 2c2t h VAL 120 CO 0.04 0.43 0.33 1.88 0.02 0.00 0.00 177.57 180.27 2c2t h TYR 121 N 0.12 0.62 -0.47 1.57 0.99 -1.00 -1.62 116.97 117.18 2c2t h TYR 121 Ca 0.02 0.02 0.01 0.00 2.00 0.00 0.00 58.73 60.78 2c2t h TYR 121 Cb 0.79 -0.21 -0.03 0.00 1.00 0.00 0.00 36.73 38.29 2c2t h TYR 121 CO 0.09 0.38 0.30 -0.22 -0.00 0.00 0.00 178.16 178.71 2c2t h LYS 122 N 0.67 0.58 -0.07 4.88 3.64 -1.12 -0.46 116.57 124.69 2c2t h LYS 122 Ca 0.19 -0.04 -0.00 0.00 -1.27 0.00 0.00 60.65 59.53 2c2t h LYS 122 Cb -0.06 -0.13 -0.00 0.00 -0.41 0.00 0.00 32.23 31.63 2c2t h LYS 122 CO -0.05 0.39 0.03 1.49 -2.27 0.00 0.00 179.45 179.03 2c2t h GLU 123 N 0.60 0.11 -0.73 1.90 4.81 -1.37 -3.17 114.58 116.73 2c2t h GLU 123 Ca 0.18 -0.02 -0.03 0.00 -0.13 0.00 0.00 59.36 59.35 2c2t h GLU 123 Cb -0.03 -0.02 -0.03 0.00 0.63 0.00 0.00 28.75 29.30 2c2t h GLU 123 CO -0.06 0.25 0.32 0.00 -0.73 0.00 0.00 179.01 178.80 2c2t h ALA 124 N 0.85 0.95 0.00 2.92 0.00 -1.00 -2.26 119.26 120.72 2c2t h ALA 124 Ca 0.02 -0.17 -0.00 0.00 0.00 0.00 0.00 54.91 54.77 2c2t h ALA 124 Cb 0.18 -0.29 -0.00 0.00 0.00 0.00 0.00 17.79 17.69 2c2t h ALA 124 CO -0.00 0.54 -0.01 0.52 0.00 0.00 0.00 179.25 180.30 2c2t h MET 125 N 1.04 0.00 -0.01 0.00 2.86 -1.08 -0.50 114.93 117.24 2c2t h MET 125 Ca 0.25 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.89 2c2t h MET 125 Cb 0.16 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.82 2c2t h MET 125 CO -0.03 0.01 -0.31 0.09 1.06 0.00 0.00 176.91 177.73 2c2t n ASN 126 N -3.11 1.61 -4.76 1.22 5.03 -0.89 -4.97 115.26 109.38 2c2t n ASN 126 Ca -0.01 -1.27 -0.39 0.00 0.87 0.00 0.00 54.58 53.78 2c2t n ASN 126 Cb 0.19 0.25 0.01 0.00 -1.02 0.00 0.00 39.78 39.21 2c2t n ASN 126 CO 0.00 0.00 0.00 -2.28 -1.83 0.00 0.00 177.26 173.15 2c2t s HIS 127 N -2.41 2.66 0.67 3.10 2.46 -0.20 -4.97 115.29 116.60 2c2t s HIS 127 Ca 0.23 1.39 -0.14 0.00 0.47 0.00 0.00 55.06 57.01 2c2t s HIS 127 Cb 0.19 -3.70 0.01 0.00 -0.13 0.00 0.00 32.58 28.95 2c2t s HIS 127 CO 0.51 -2.31 1.11 -1.25 -2.47 0.00 0.00 174.74 170.33 2c2t s PRO 128 N -2.46 2.70 0.88 2.88 0.04 -1.26 -4.92 135.00 132.85 2c2t s PRO 128 Ca 0.61 1.39 0.00 0.00 0.04 0.00 0.00 61.00 63.04 2c2t s PRO 128 Cb -0.38 -1.94 0.00 0.00 0.04 0.00 0.00 34.50 32.22 2c2t s PRO 128 CO 0.48 -1.33 0.00 0.41 0.04 0.00 0.00 177.00 176.60 2c2t n GLY 129 N -0.54 -1.77 3.73 0.56 0.00 -1.25 -4.92 105.19 101.00 2c2t n GLY 129 Ca 0.10 -1.67 -0.42 0.00 0.00 0.00 0.00 46.02 44.04 2c2t n GLY 129 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 2c2t s HIS 130 N 0.00 3.30 -0.09 1.61 5.65 -1.21 -3.74 115.29 120.81 2c2t s HIS 130 Ca 0.00 1.18 -0.06 0.00 0.25 0.00 0.00 55.06 56.43 2c2t s HIS 130 Cb 0.00 -3.58 0.04 0.00 -1.18 0.00 0.00 32.58 27.86 2c2t s HIS 130 CO 0.00 -1.86 0.23 -1.17 -0.65 0.00 0.00 174.74 171.29 2c2t s LEU 131 N 0.42 0.70 -0.05 8.88 0.20 -0.32 -2.72 118.68 125.79 2c2t s LEU 131 Ca 0.59 0.47 0.04 0.00 0.69 0.00 0.00 54.13 55.92 2c2t s LEU 131 Cb -0.35 0.70 -0.02 0.00 -0.43 0.00 0.00 46.19 46.08 2c2t s LEU 131 CO 0.34 -0.13 -0.16 -0.54 -0.29 0.00 0.00 176.35 175.57 2c2t s LYS 132 N 0.86 2.48 -0.21 1.98 1.02 -0.88 -1.05 119.74 123.94 2c2t s LYS 132 Ca -0.06 -0.73 -0.01 0.00 0.02 0.00 0.00 55.97 55.20 2c2t s LYS 132 Cb -0.07 -2.34 0.01 0.00 -0.52 0.00 0.00 37.83 34.91 2c2t s LYS 132 CO -0.05 0.60 -0.13 -0.51 -0.92 0.00 0.00 175.35 174.34 2c2t s LEU 133 N -0.68 2.58 -0.50 3.17 1.43 0.18 -0.71 118.68 124.14 2c2t s LEU 133 Ca 0.10 -0.65 -0.17 0.00 -1.03 0.00 0.00 54.13 52.39 2c2t s LEU 133 Cb -0.11 -1.59 0.08 0.00 0.03 0.00 0.00 46.19 44.61 2c2t s LEU 133 CO 0.00 -0.03 0.50 -0.36 0.23 0.00 0.00 176.35 176.69 2c2t s PHE 134 N 1.34 3.18 -0.23 0.29 0.40 0.09 -0.70 117.98 122.34 2c2t s PHE 134 Ca 0.04 -0.91 -0.01 0.00 -0.60 0.00 0.00 56.93 55.45 2c2t s PHE 134 Cb -0.14 -3.45 0.03 0.00 0.51 0.00 0.00 43.02 39.97 2c2t s PHE 134 CO -0.09 -0.94 -0.09 0.08 0.70 0.00 0.00 175.22 174.89 2c2t s VAL 135 N 1.96 2.69 -0.31 -0.44 1.01 -0.23 -1.46 120.40 123.62 2c2t s VAL 135 Ca 0.07 -1.02 -0.22 0.00 0.00 0.00 0.00 61.98 60.81 2c2t s VAL 135 Cb -0.24 -2.34 -0.00 0.00 0.00 0.00 0.00 36.38 33.80 2c2t s VAL 135 CO 0.07 0.26 0.72 -0.89 0.00 0.00 0.00 175.10 175.26 2c2t s THR 136 N 1.31 4.85 -0.51 3.92 2.01 -0.20 -0.54 115.64 126.49 2c2t s THR 136 Ca 0.01 1.02 -0.21 0.00 0.31 0.00 0.00 61.69 62.82 2c2t s THR 136 Cb -0.16 -4.08 0.05 0.00 0.01 0.00 0.00 72.50 68.31 2c2t s THR 136 CO -0.06 -0.21 0.73 -0.13 -0.69 0.00 0.00 174.62 174.26 2c2t s ARG 137 N 2.81 3.22 -0.37 4.92 1.81 0.05 -0.94 118.95 130.45 2c2t s ARG 137 Ca 0.29 -0.60 -0.28 0.00 -1.72 0.00 0.00 55.73 53.43 2c2t s ARG 137 Cb -0.14 -4.06 0.02 0.00 -0.45 0.00 0.00 34.95 30.32 2c2t s ARG 137 CO 0.12 -1.27 1.03 0.42 -0.68 0.00 0.00 175.30 174.92 2c2t s ILE 138 N 3.08 4.49 -0.23 1.52 -1.09 0.29 -1.25 121.20 128.00 2c2t s ILE 138 Ca 0.21 1.43 -0.01 0.00 -2.23 0.00 0.00 60.65 60.05 2c2t s ILE 138 Cb -0.16 -4.42 0.12 0.00 -1.58 0.00 0.00 42.46 36.42 2c2t s ILE 138 CO 0.15 -0.59 2.17 0.23 -1.23 0.00 0.00 174.94 175.67 2c2t n MET 139 N 7.00 1.67 -3.77 2.79 2.81 -0.34 -2.11 117.12 125.15 2c2t n MET 139 Ca 0.10 -1.22 -0.08 0.00 -1.81 0.00 0.00 57.70 54.69 2c2t n MET 139 Cb 0.48 -1.53 -0.02 0.00 -0.71 0.00 0.00 33.22 31.43 2c2t n MET 139 CO 0.00 0.00 0.00 1.14 1.51 0.00 0.00 175.97 178.62 2c2t s GLN 140 N -1.20 1.64 0.39 0.03 -2.07 -1.26 -4.92 119.66 112.26 2c2t s GLN 140 Ca 0.28 -0.89 -0.23 0.00 -1.82 0.00 0.00 55.36 52.69 2c2t s GLN 140 Cb 0.20 0.59 -0.10 0.00 -1.09 0.00 0.00 33.01 32.61 2c2t s GLN 140 CO -0.02 -0.74 0.98 -0.51 -1.32 0.00 0.00 175.29 173.68 2c2t s ASP 141 N -2.89 6.97 -0.00 12.60 1.11 -1.26 -1.37 116.67 131.83 2c2t s ASP 141 Ca 0.10 1.85 -0.00 0.00 0.18 0.00 0.00 52.55 54.67 2c2t s ASP 141 Cb -0.04 -2.57 0.00 0.00 1.07 0.00 0.00 42.92 41.38 2c2t s ASP 141 CO 0.02 -0.33 0.00 -0.36 1.18 0.00 0.00 175.17 175.68 2c2t s PHE 142 N -1.84 -0.00 0.14 4.23 0.08 -1.26 -4.94 117.98 114.38 2c2t s PHE 142 Ca 0.57 0.01 -0.31 0.00 0.12 0.00 0.00 56.93 57.32 2c2t s PHE 142 Cb -0.16 0.00 -0.11 0.00 -0.57 0.00 0.00 43.02 42.18 2c2t s PHE 142 CO 0.21 -0.00 1.83 0.39 -0.10 0.00 0.00 175.22 177.54 2c2t n GLU 143 N 3.07 2.82 -4.08 0.44 1.02 -1.26 -4.82 120.64 117.84 2c2t n GLU 143 Ca -0.12 1.03 -0.09 0.00 -0.02 0.00 0.00 57.16 57.95 2c2t n GLU 143 Cb 0.60 -2.92 -0.11 0.00 -0.02 0.00 0.00 31.44 29.00 2c2t n GLU 143 CO 0.00 0.00 0.00 -1.12 1.18 0.00 0.00 177.13 177.19 2c2t s SER 144 N 2.50 0.65 0.00 1.62 0.01 -1.26 -4.75 113.70 112.47 2c2t s SER 144 Ca 0.81 -0.80 0.00 0.00 1.31 0.00 0.00 55.95 57.27 2c2t s SER 144 Cb -0.48 0.12 0.00 0.00 0.21 0.00 0.00 66.02 65.88 2c2t s SER 144 CO 0.36 -0.42 0.59 -0.90 0.41 0.00 0.00 173.24 173.28 2c2t n ASP 145 N 0.69 1.11 -3.83 2.44 5.68 0.36 -4.97 116.55 118.03 2c2t n ASP 145 Ca -0.18 -1.29 -0.13 0.00 -0.50 0.00 0.00 54.79 52.69 2c2t n ASP 145 Cb 0.58 0.00 -0.14 0.00 -1.14 0.00 0.00 41.12 40.42 2c2t n ASP 145 CO 0.00 0.00 0.00 -0.89 -1.33 0.00 0.00 177.20 174.98 2c2t s THR 146 N -0.29 -0.02 0.13 2.12 2.01 -1.03 -4.99 115.64 113.58 2c2t s THR 146 Ca 0.00 0.07 0.04 0.00 0.31 0.00 0.00 61.69 62.12 2c2t s THR 146 Cb 0.00 -0.06 -0.04 0.00 0.01 0.00 0.00 72.50 72.41 2c2t s THR 146 CO 0.00 0.03 -0.10 -0.36 -0.69 0.00 0.00 174.62 173.50 2c2t s PHE 147 N 0.38 1.23 -0.12 4.92 0.40 -1.26 -0.20 117.98 123.33 2c2t s PHE 147 Ca -0.03 -0.73 -0.11 0.00 -0.60 0.00 0.00 56.93 55.47 2c2t s PHE 147 Cb -0.04 -0.64 -0.05 0.00 0.51 0.00 0.00 43.02 42.80 2c2t s PHE 147 CO -0.01 0.07 0.22 0.12 0.70 0.00 0.00 175.22 176.32 2c2t s PHE 148 N -3.08 3.55 0.34 0.36 5.36 0.12 -4.59 117.98 120.04 2c2t s PHE 148 Ca 0.14 0.59 -0.29 0.00 -0.96 0.00 0.00 56.93 56.41 2c2t s PHE 148 Cb 0.01 -2.14 -0.11 0.00 -0.34 0.00 0.00 43.02 40.44 2c2t s PHE 148 CO 0.01 0.51 1.44 -2.14 -1.46 0.00 0.00 175.22 173.57 2c2t s PRO 149 N -0.40 4.21 0.48 10.12 0.02 -1.26 -4.94 135.00 143.22 2c2t s PRO 149 Ca 0.16 2.43 -0.22 0.00 0.02 0.00 0.00 61.00 63.38 2c2t s PRO 149 Cb -0.13 -3.02 -0.07 0.00 0.02 0.00 0.00 34.50 31.30 2c2t s PRO 149 CO 0.04 -0.42 1.19 -1.83 -0.33 0.00 0.00 177.00 175.65 2c2t s GLU 150 N -1.60 3.63 -0.07 5.54 1.03 -1.26 -4.95 118.70 121.01 2c2t s GLU 150 Ca 0.54 1.83 -0.26 0.00 0.03 0.00 0.00 54.97 57.10 2c2t s GLU 150 Cb -0.44 -2.35 -0.03 0.00 -0.80 0.00 0.00 34.13 30.51 2c2t s GLU 150 CO 0.56 -0.67 0.83 0.42 -1.33 0.00 0.00 175.26 175.07 2c2t s ILE 151 N -1.53 4.94 -0.51 1.83 1.01 -1.26 -5.00 121.20 120.69 2c2t s ILE 151 Ca 0.65 1.71 -0.27 0.00 0.00 0.00 0.00 60.65 62.75 2c2t s ILE 151 Cb -0.30 -4.16 0.03 0.00 0.01 0.00 0.00 42.46 38.04 2c2t s ILE 151 CO 0.36 0.15 1.03 -0.62 0.00 0.00 0.00 174.94 175.87 2c2t s ASP 152 N 0.97 6.49 0.00 3.58 3.68 -1.26 -4.89 116.67 125.24 2c2t s ASP 152 Ca 0.43 0.12 0.27 0.00 2.13 0.00 0.00 52.55 55.49 2c2t s ASP 152 Cb -0.18 -2.49 1.27 0.00 -1.45 0.00 0.00 42.92 40.06 2c2t s ASP 152 CO 0.20 -1.22 1.89 0.18 0.13 0.00 0.00 175.17 176.34 2c2t n LEU 153 N 7.64 0.00 0.07 -1.34 4.77 -1.26 -0.53 117.00 126.35 2c2t n LEU 153 Ca 0.07 0.36 0.03 0.00 -0.03 0.00 0.00 56.01 56.45 2c2t n LEU 153 Cb 0.49 -0.36 0.43 0.00 -2.33 0.00 0.00 43.42 41.64 2c2t n LEU 153 CO 0.67 -0.04 1.04 -0.08 -1.33 0.00 0.00 177.39 177.66 2c2t h GLU 154 N 0.00 0.38 0.00 3.23 4.57 -2.03 -3.34 114.58 117.38 2c2t h GLU 154 Ca 0.00 -0.05 -0.41 0.00 -1.18 0.00 0.00 59.36 57.72 2c2t h GLU 154 Cb 0.32 -0.07 -0.06 0.00 -0.16 0.00 0.00 28.75 28.77 2c2t h GLU 154 CO 0.00 0.34 -2.38 1.63 -1.18 0.00 0.00 179.01 177.42 2c2t n LYS 155 N -4.40 0.53 -3.68 1.92 5.02 -0.57 -5.03 118.16 111.95 2c2t n LYS 155 Ca 0.01 0.22 -0.33 0.00 -2.02 0.00 0.00 58.31 56.19 2c2t n LYS 155 Cb 0.15 -1.39 -0.05 0.00 -0.02 0.00 0.00 35.03 33.72 2c2t n LYS 155 CO 0.00 0.00 0.00 0.71 -0.52 0.00 0.00 177.40 177.59 2c2t s TYR 156 N -2.45 3.54 -0.06 2.13 1.51 0.31 -4.49 117.35 117.84 2c2t s TYR 156 Ca -0.34 0.61 0.06 0.00 -1.01 0.00 0.00 57.07 56.39 2c2t s TYR 156 Cb 0.13 -2.03 -0.01 0.00 -0.11 0.00 0.00 41.96 39.93 2c2t s TYR 156 CO 0.44 0.52 -0.24 0.15 -1.11 0.00 0.00 175.55 175.31 2c2t s LYS 157 N -2.18 2.56 -0.10 -0.62 1.02 -0.34 -4.35 119.74 115.74 2c2t s LYS 157 Ca 0.35 -0.88 -0.30 0.00 0.02 0.00 0.00 55.97 55.16 2c2t s LYS 157 Cb -0.13 -2.19 -0.02 0.00 -0.52 0.00 0.00 37.83 34.96 2c2t s LYS 157 CO 0.20 0.40 1.21 -1.17 -0.92 0.00 0.00 175.35 175.07 2c2t s LEU 158 N -0.21 4.24 0.08 3.17 2.96 -1.26 -1.29 118.68 126.37 2c2t s LEU 158 Ca -0.02 1.74 -0.28 0.00 -0.22 0.00 0.00 54.13 55.36 2c2t s LEU 158 Cb -0.13 -3.55 -0.06 0.00 0.50 0.00 0.00 46.19 42.95 2c2t s LEU 158 CO 0.03 -0.64 0.88 -0.76 -1.32 0.00 0.00 176.35 174.54 2c2t s LEU 159 N 2.66 4.48 0.33 -0.68 1.43 0.00 -4.96 118.68 121.95 2c2t s LEU 159 Ca 0.55 1.65 0.05 0.00 -1.03 0.00 0.00 54.13 55.34 2c2t s LEU 159 Cb -0.23 -3.44 0.59 0.00 0.03 0.00 0.00 46.19 43.14 2c2t s LEU 159 CO 0.19 -0.03 1.85 -0.65 0.23 0.00 0.00 176.35 177.94 2c2t h PRO 160 N 5.61 0.49 -3.68 1.29 0.11 -1.95 -3.42 132.00 130.43 2c2t h PRO 160 Ca -0.43 -0.12 -0.13 0.00 0.11 0.00 0.00 66.00 65.43 2c2t h PRO 160 Cb 1.21 -0.06 -0.07 0.00 0.11 0.00 0.00 31.00 32.19 2c2t h PRO 160 CO 0.71 0.56 -0.06 -1.83 -0.21 0.00 0.00 178.00 177.18 2c2t s GLU 161 N -4.86 1.83 -0.15 1.05 -1.05 -1.26 -5.03 118.70 109.24 2c2t s GLU 161 Ca -0.07 -1.47 -0.09 0.00 -0.15 0.00 0.00 54.97 53.19 2c2t s GLU 161 Cb 0.15 0.50 0.05 0.00 -0.44 0.00 0.00 34.13 34.39 2c2t s GLU 161 CO 0.77 -0.79 0.36 -0.47 0.95 0.00 0.00 175.26 176.08 2c2t s TYR 162 N -3.31 -0.49 0.21 4.83 5.04 -1.26 -5.04 117.35 117.32 2c2t s TYR 162 Ca 0.24 1.10 -0.32 0.00 -2.44 0.00 0.00 57.07 55.64 2c2t s TYR 162 Cb -0.02 0.18 -0.13 0.00 0.35 0.00 0.00 41.96 42.35 2c2t s TYR 162 CO 0.14 -0.29 1.55 -2.30 -1.34 0.00 0.00 175.55 173.31 2c2t n PRO 163 N 4.01 2.26 -0.37 4.97 -0.02 -1.26 -1.91 135.00 142.67 2c2t n PRO 163 Ca -0.22 0.81 0.00 0.00 -2.02 0.00 0.00 63.50 62.07 2c2t n PRO 163 Cb 0.55 -2.56 0.00 0.00 -0.02 0.00 0.00 33.50 31.47 2c2t n PRO 163 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2c2t n GLY 164 N 2.94 0.94 3.21 -1.23 0.00 -1.26 -5.03 105.19 104.76 2c2t n GLY 164 Ca 0.14 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.84 2c2t n GLY 164 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2c2t s VAL 165 N -2.88 2.26 0.38 1.61 1.01 -0.80 -5.11 120.40 116.87 2c2t s VAL 165 Ca 0.00 -0.92 -0.26 0.00 0.00 0.00 0.00 61.98 60.80 2c2t s VAL 165 Cb 0.00 -1.91 -0.09 0.00 0.00 0.00 0.00 36.38 34.38 2c2t s VAL 165 CO 0.00 0.54 1.26 -0.76 0.00 0.00 0.00 175.10 176.14 2c2t s LEU 166 N 0.72 4.27 -0.11 3.92 1.43 -1.26 -4.56 118.68 123.09 2c2t s LEU 166 Ca -0.09 2.56 0.17 0.00 -1.03 0.00 0.00 54.13 55.75 2c2t s LEU 166 Cb -0.16 -3.87 -0.24 0.00 0.03 0.00 0.00 46.19 41.95 2c2t s LEU 166 CO 0.01 -0.71 0.35 -1.20 0.23 0.00 0.00 176.35 175.03 2c2t n SER 167 N 0.29 0.31 -4.87 2.29 7.64 -1.26 -4.41 113.62 113.62 2c2t n SER 167 Ca 0.03 0.14 -0.31 0.00 1.01 0.00 0.00 58.87 59.74 2c2t n SER 167 Cb 0.44 0.78 -0.00 0.00 -1.01 0.00 0.00 64.21 64.41 2c2t n SER 167 CO 0.00 0.00 0.00 -1.81 -3.01 0.00 0.00 175.04 170.22 2c2t s ASP 168 N -5.54 6.34 0.24 6.43 1.01 -1.26 -4.83 116.67 119.06 2c2t s ASP 168 Ca -0.08 1.42 -0.31 0.00 0.71 0.00 0.00 52.55 54.29 2c2t s ASP 168 Cb 0.08 -2.46 -0.11 0.00 1.01 0.00 0.00 42.92 41.44 2c2t s ASP 168 CO 0.84 -0.77 1.59 -0.69 0.21 0.00 0.00 175.17 176.34 2c2t s VAL 169 N -3.00 2.29 0.21 -1.27 1.01 -1.26 -4.70 120.40 113.68 2c2t s VAL 169 Ca 0.55 0.22 0.05 0.00 0.00 0.00 0.00 61.98 62.80 2c2t s VAL 169 Cb -0.11 -3.14 -0.03 0.00 0.00 0.00 0.00 36.38 33.10 2c2t s VAL 169 CO 0.47 0.03 0.30 -1.10 0.00 0.00 0.00 175.10 174.80 2c2t s GLN 170 N 0.23 3.32 -0.09 2.72 -1.52 0.11 -4.96 119.66 119.47 2c2t s GLN 170 Ca 0.66 -0.77 -0.04 0.00 -1.95 0.00 0.00 55.36 53.27 2c2t s GLN 170 Cb -0.46 -2.84 0.05 0.00 -0.22 0.00 0.00 33.01 29.53 2c2t s GLN 170 CO 0.40 0.46 0.19 -2.00 -0.25 0.00 0.00 175.29 174.08 2c2t s GLU 171 N -3.68 0.11 -0.01 2.91 2.12 -1.26 -1.08 118.70 117.80 2c2t s GLU 171 Ca 0.34 0.51 0.01 0.00 0.36 0.00 0.00 54.97 56.18 2c2t s GLU 171 Cb -0.09 -0.17 0.01 0.00 0.26 0.00 0.00 34.13 34.13 2c2t s GLU 171 CO 0.28 -0.22 -0.02 -1.21 -0.54 0.00 0.00 175.26 173.55 2c2t s GLU 172 N 1.67 0.27 -1.46 4.30 2.02 -0.81 -4.86 118.70 119.82 2c2t s GLU 172 Ca -0.04 -0.03 -0.12 0.00 0.02 0.00 0.00 54.97 54.79 2c2t s GLU 172 Cb -0.12 -0.33 0.09 0.00 0.10 0.00 0.00 34.13 33.87 2c2t s GLU 172 CO -0.07 -0.02 0.71 1.63 0.02 0.00 0.00 175.26 177.53 2c2t n LYS 173 N 3.47 -4.15 -0.94 1.61 4.76 -1.26 -0.87 118.16 120.78 2c2t n LYS 173 Ca -0.18 0.53 0.00 0.00 -2.87 0.00 0.00 58.31 55.78 2c2t n LYS 173 Cb 0.55 -5.31 0.00 0.00 -1.84 0.00 0.00 35.03 28.43 2c2t n LYS 173 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2c2t n GLY 174 N -1.40 0.51 3.38 0.72 0.00 -1.26 -5.00 105.19 102.14 2c2t n GLY 174 Ca 0.01 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.69 2c2t n GLY 174 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2c2t s ILE 175 N -2.34 3.64 0.11 -0.61 1.01 -0.04 -5.09 121.20 117.87 2c2t s ILE 175 Ca 0.00 -0.42 -0.22 0.00 0.00 0.00 0.00 60.65 60.01 2c2t s ILE 175 Cb 0.00 -2.64 -0.07 0.00 0.01 0.00 0.00 42.46 39.76 2c2t s ILE 175 CO 0.00 0.43 0.66 -0.54 0.00 0.00 0.00 174.94 175.49 2c2t s LYS 176 N 1.17 4.37 0.16 2.79 1.02 -1.26 -1.93 119.74 126.05 2c2t s LYS 176 Ca 0.02 0.92 -0.13 0.00 0.02 0.00 0.00 55.97 56.81 2c2t s LYS 176 Cb -0.14 -3.26 0.01 0.00 -0.52 0.00 0.00 37.83 33.92 2c2t s LYS 176 CO 0.00 0.59 0.37 1.52 -0.92 0.00 0.00 175.35 176.91 2c2t s TYR 177 N -1.06 0.08 0.01 3.18 -0.85 -0.25 -1.20 117.35 117.26 2c2t s TYR 177 Ca 0.32 -0.43 -0.04 0.00 -0.52 0.00 0.00 57.07 56.40 2c2t s TYR 177 Cb -0.21 0.15 -0.01 0.00 0.38 0.00 0.00 41.96 42.27 2c2t s TYR 177 CO 0.22 -0.76 0.05 -1.59 -1.52 0.00 0.00 175.55 171.96 2c2t s LYS 178 N -3.89 0.38 -0.22 -3.49 -2.85 -0.38 0.08 119.74 109.38 2c2t s LYS 178 Ca 0.10 -0.48 -0.17 0.00 -1.00 0.00 0.00 55.97 54.43 2c2t s LYS 178 Cb 0.02 0.15 -0.04 0.00 -2.06 0.00 0.00 37.83 35.90 2c2t s LYS 178 CO -0.05 -0.08 0.43 -0.06 0.10 0.00 0.00 175.35 175.70 2c2t s PHE 179 N -1.35 3.34 0.16 1.78 2.99 -1.26 -0.77 117.98 122.87 2c2t s PHE 179 Ca -0.15 0.63 0.10 0.00 0.00 0.00 0.00 56.93 57.51 2c2t s PHE 179 Cb -0.08 -2.59 -0.04 0.00 0.00 0.00 0.00 43.02 40.31 2c2t s PHE 179 CO 0.00 -0.09 -0.18 -1.21 -0.00 0.00 0.00 175.22 173.74 2c2t s GLU 180 N 1.60 1.75 -0.09 0.44 2.02 0.30 -4.81 118.70 119.91 2c2t s GLU 180 Ca 0.20 -1.31 0.00 0.00 0.02 0.00 0.00 54.97 53.88 2c2t s GLU 180 Cb -0.15 -2.03 0.02 0.00 0.10 0.00 0.00 34.13 32.07 2c2t s GLU 180 CO 0.09 0.44 -0.08 0.08 0.02 0.00 0.00 175.26 175.81 2c2t s VAL 181 N -1.43 0.96 0.15 2.63 1.01 -1.26 -1.07 120.40 121.38 2c2t s VAL 181 Ca 0.20 -0.28 0.07 0.00 0.00 0.00 0.00 61.98 61.97 2c2t s VAL 181 Cb -0.09 -0.96 -0.04 0.00 0.00 0.00 0.00 36.38 35.29 2c2t s VAL 181 CO 0.11 0.34 -0.03 -0.31 0.00 0.00 0.00 175.10 175.22 2c2t s TYR 182 N 1.42 2.83 -0.03 5.22 1.51 0.12 -0.82 117.35 127.60 2c2t s TYR 182 Ca -0.01 -0.13 -0.06 0.00 -1.01 0.00 0.00 57.07 55.86 2c2t s TYR 182 Cb -0.13 -1.41 0.01 0.00 -0.11 0.00 0.00 41.96 40.31 2c2t s TYR 182 CO -0.04 0.49 0.14 -2.00 -1.11 0.00 0.00 175.55 173.03 2c2t s GLU 183 N -2.67 0.31 0.10 -0.62 2.12 -0.41 -0.65 118.70 116.87 2c2t s GLU 183 Ca 0.26 -0.05 0.06 0.00 0.36 0.00 0.00 54.97 55.60 2c2t s GLU 183 Cb -0.10 0.14 -0.03 0.00 0.26 0.00 0.00 34.13 34.39 2c2t s GLU 183 CO 0.17 -0.06 -0.15 -1.59 -0.54 0.00 0.00 175.26 173.09 2c2t s LYS 184 N -0.55 0.97 -0.01 4.30 -2.85 -0.22 -1.19 119.74 120.20 2c2t s LYS 184 Ca -0.06 -1.13 0.10 0.00 -1.00 0.00 0.00 55.97 53.88 2c2t s LYS 184 Cb -0.04 -0.96 -0.13 0.00 -2.06 0.00 0.00 37.83 34.64 2c2t s LYS 184 CO 0.01 0.20 0.35 0.09 0.10 0.00 0.00 175.35 176.10 2c2t n ASN 185 N 0.89 1.31 0.00 0.03 3.02 -1.26 -1.18 115.26 118.07 2c2t n ASN 185 Ca -0.18 -0.45 0.00 0.00 -0.03 0.00 0.00 54.58 53.92 2c2t n ASN 185 Cb 0.55 1.18 0.00 0.00 -0.61 0.00 0.00 39.78 40.90 2c2t n ASN 185 CO 0.00 0.00 0.00 0.47 -2.62 0.00 0.00 177.26 175.11