#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jcc s SER 2 N 0.00 6.00 0.05 1.61 0.01 -1.26 -3.82 113.70 116.28 2jcc s SER 2 Ca 0.00 1.62 -0.11 0.00 1.31 0.00 0.00 55.95 58.77 2jcc s SER 2 Cb 0.00 -2.50 0.01 0.00 0.21 0.00 0.00 66.02 63.74 2jcc s SER 2 CO 0.00 -1.02 0.24 -1.00 0.41 0.00 0.00 173.24 171.87 2jcc s HIS 3 N -2.80 0.01 0.03 2.43 0.09 -0.81 -4.98 115.29 109.26 2jcc s HIS 3 Ca 0.59 -0.25 -0.02 0.00 -0.00 0.00 0.00 55.06 55.39 2jcc s HIS 3 Cb -0.13 0.02 -0.02 0.00 -0.00 0.00 0.00 32.58 32.45 2jcc s HIS 3 CO 0.44 -0.49 0.00 -1.54 -0.00 0.00 0.00 174.74 173.15 2jcc s SER 4 N -2.27 0.28 -0.03 1.40 1.04 -1.26 0.28 113.70 113.15 2jcc s SER 4 Ca -0.03 -0.61 0.07 0.00 0.48 0.00 0.00 55.95 55.86 2jcc s SER 4 Cb 0.00 0.15 -0.02 0.00 0.10 0.00 0.00 66.02 66.26 2jcc s SER 4 CO -0.05 -0.41 -0.25 -0.32 0.98 0.00 0.00 173.24 173.18 2jcc s MET 5 N -2.26 2.18 -0.01 4.02 -2.45 -0.48 -1.43 119.30 118.87 2jcc s MET 5 Ca -0.08 -0.90 -0.02 0.00 -1.25 0.00 0.00 55.69 53.44 2jcc s MET 5 Cb -0.04 -2.02 0.00 0.00 1.25 0.00 0.00 34.83 34.02 2jcc s MET 5 CO -0.04 0.49 0.04 1.03 1.05 0.00 0.00 175.02 177.59 2jcc s ARG 6 N -0.46 0.11 -0.02 4.11 1.81 -0.16 -2.43 118.95 121.92 2jcc s ARG 6 Ca 0.06 -0.05 0.05 0.00 -1.72 0.00 0.00 55.73 54.07 2jcc s ARG 6 Cb -0.11 0.05 -0.03 0.00 -0.45 0.00 0.00 34.95 34.41 2jcc s ARG 6 CO 0.00 -0.02 -0.17 0.71 -0.68 0.00 0.00 175.30 175.15 2jcc s TYR 7 N -0.25 2.62 -0.07 -0.53 2.02 -0.41 -0.55 117.35 120.19 2jcc s TYR 7 Ca -0.03 -0.22 0.02 0.00 -0.37 0.00 0.00 57.07 56.48 2jcc s TYR 7 Cb -0.02 -1.56 0.01 0.00 -0.40 0.00 0.00 41.96 39.99 2jcc s TYR 7 CO -0.00 0.19 -0.14 -0.06 -1.57 0.00 0.00 175.55 173.97 2jcc s PHE 8 N -0.79 1.63 -0.09 2.71 0.40 -0.14 -2.34 117.98 119.37 2jcc s PHE 8 Ca 0.13 -0.62 0.02 0.00 -0.60 0.00 0.00 56.93 55.85 2jcc s PHE 8 Cb -0.11 -1.17 0.01 0.00 0.51 0.00 0.00 43.02 42.26 2jcc s PHE 8 CO 0.02 -0.30 -0.15 -0.06 0.70 0.00 0.00 175.22 175.43 2jcc s PHE 9 N 0.63 1.79 -0.02 0.36 0.08 0.54 -1.59 117.98 119.76 2jcc s PHE 9 Ca -0.15 -0.75 0.05 0.00 0.12 0.00 0.00 56.93 56.20 2jcc s PHE 9 Cb -0.16 -1.29 -0.01 0.00 -0.57 0.00 0.00 43.02 40.99 2jcc s PHE 9 CO 0.04 -0.38 -0.18 0.99 -0.10 0.00 0.00 175.22 175.60 2jcc s THR 10 N 0.78 1.42 -0.03 0.64 2.01 -0.40 -1.11 115.64 118.95 2jcc s THR 10 Ca -0.11 -0.75 -0.01 0.00 0.31 0.00 0.00 61.69 61.12 2jcc s THR 10 Cb -0.16 -1.19 0.03 0.00 0.01 0.00 0.00 72.50 71.20 2jcc s THR 10 CO 0.02 0.40 0.06 -0.55 -0.69 0.00 0.00 174.62 173.86 2jcc s SER 11 N -0.30 0.22 -0.14 3.53 0.15 -0.60 -1.23 113.70 115.34 2jcc s SER 11 Ca 0.04 0.10 -0.01 0.00 0.70 0.00 0.00 55.95 56.78 2jcc s SER 11 Cb -0.08 -0.03 0.03 0.00 -1.71 0.00 0.00 66.02 64.23 2jcc s SER 11 CO 0.00 -0.15 -0.06 -0.69 1.20 0.00 0.00 173.24 173.54 2jcc s VAL 12 N 1.30 1.04 0.41 4.45 1.01 -0.13 -1.49 120.40 126.99 2jcc s VAL 12 Ca -0.07 -0.44 -0.25 0.00 0.00 0.00 0.00 61.98 61.22 2jcc s VAL 12 Cb -0.13 -1.14 -0.08 0.00 0.00 0.00 0.00 36.38 35.03 2jcc s VAL 12 CO -0.04 0.24 1.20 -0.94 0.00 0.00 0.00 175.10 175.57 2jcc s SER 13 N 1.68 6.38 -0.58 3.32 1.04 -0.54 -0.75 113.70 124.25 2jcc s SER 13 Ca 0.03 2.42 0.05 0.00 0.48 0.00 0.00 55.95 58.94 2jcc s SER 13 Cb -0.14 -2.62 0.20 0.00 0.10 0.00 0.00 66.02 63.56 2jcc s SER 13 CO -0.08 -0.78 0.51 0.54 0.98 0.00 0.00 173.24 174.42 2jcc n ARG 14 N -0.03 1.44 0.00 4.02 1.74 -1.26 -4.23 116.66 118.35 2jcc n ARG 14 Ca 0.05 -4.06 0.00 0.00 -0.77 0.00 0.00 57.85 53.07 2jcc n ARG 14 Cb 0.46 -2.00 0.00 0.00 -1.02 0.00 0.00 32.46 29.90 2jcc n ARG 14 CO 0.00 0.00 0.00 -2.30 -1.52 0.00 0.00 177.63 173.81 2jcc n PRO 15 N 1.87 0.00 -0.95 5.56 -0.02 -1.26 -1.08 135.00 139.13 2jcc n PRO 15 Ca 0.25 0.23 -0.06 0.00 -2.02 0.00 0.00 63.50 61.91 2jcc n PRO 15 Cb 0.42 -1.63 0.28 0.00 -0.02 0.00 0.00 33.50 32.54 2jcc n PRO 15 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2jcc n GLY 16 N -1.19 3.95 0.00 -1.23 0.00 -1.26 -4.68 105.19 100.78 2jcc n GLY 16 Ca 0.00 -1.04 0.00 0.00 0.00 0.00 0.00 46.02 44.98 2jcc n GLY 16 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 2jcc n ARG 17 N -0.42 0.00 -0.70 1.61 1.85 -0.24 -5.07 116.66 113.69 2jcc n ARG 17 Ca 0.39 0.00 0.00 0.00 -1.00 0.00 0.00 57.85 57.24 2jcc n ARG 17 Cb 1.31 0.00 0.00 0.00 -1.05 0.00 0.00 32.46 32.72 2jcc n ARG 17 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 2jcc n GLY 18 N 0.00 1.38 3.05 2.89 0.00 -1.18 -5.00 105.19 106.33 2jcc n GLY 18 Ca 0.00 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.77 2jcc n GLY 18 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2jcc s GLU 19 N -0.09 1.80 0.57 1.61 0.41 -1.26 -5.05 118.70 116.70 2jcc s GLU 19 Ca 0.00 -0.47 -0.15 0.00 -0.41 0.00 0.00 54.97 53.95 2jcc s GLU 19 Cb 0.00 -1.48 -0.05 0.00 -1.78 0.00 0.00 34.13 30.82 2jcc s GLU 19 CO 0.00 0.06 1.02 -2.14 -0.49 0.00 0.00 175.26 173.71 2jcc s PRO 20 N 0.56 3.64 -0.03 0.39 0.02 -1.26 -4.37 135.00 133.94 2jcc s PRO 20 Ca -0.14 0.97 -0.25 0.00 0.02 0.00 0.00 61.00 61.60 2jcc s PRO 20 Cb -0.15 -2.09 -0.04 0.00 0.02 0.00 0.00 34.50 32.24 2jcc s PRO 20 CO 0.04 -0.54 0.75 0.50 -0.33 0.00 0.00 177.00 177.43 2jcc s ARG 21 N -4.40 4.46 -0.07 5.54 6.06 0.07 -4.89 118.95 125.72 2jcc s ARG 21 Ca 0.59 0.99 0.03 0.00 -2.50 0.00 0.00 55.73 54.84 2jcc s ARG 21 Cb -0.12 -3.43 0.01 0.00 0.06 0.00 0.00 34.95 31.47 2jcc s ARG 21 CO 0.40 0.10 -0.15 0.12 -2.50 0.00 0.00 175.30 173.26 2jcc s PHE 22 N 0.63 1.73 -0.04 5.12 5.36 -1.26 -0.96 117.98 128.56 2jcc s PHE 22 Ca 0.40 -0.64 0.01 0.00 -0.96 0.00 0.00 56.93 55.74 2jcc s PHE 22 Cb -0.19 -1.22 0.02 0.00 -0.34 0.00 0.00 43.02 41.29 2jcc s PHE 22 CO 0.21 -0.29 -0.05 0.42 -1.46 0.00 0.00 175.22 174.04 2jcc s ILE 23 N 0.51 0.55 -0.03 3.12 1.01 -0.37 -0.81 121.20 125.18 2jcc s ILE 23 Ca -0.14 -0.15 0.04 0.00 0.00 0.00 0.00 60.65 60.39 2jcc s ILE 23 Cb -0.16 -0.56 -0.00 0.00 0.01 0.00 0.00 42.46 41.75 2jcc s ILE 23 CO 0.05 0.22 -0.14 0.00 0.00 0.00 0.00 174.94 175.07 2jcc s ALA 24 N 0.76 1.23 0.03 9.38 0.00 -0.07 -1.28 121.76 131.82 2jcc s ALA 24 Ca -0.10 -0.56 0.02 0.00 0.00 0.00 0.00 51.96 51.32 2jcc s ALA 24 Cb -0.13 -0.39 -0.02 0.00 0.00 0.00 0.00 23.12 22.58 2jcc s ALA 24 CO 0.00 0.24 -0.07 0.14 0.00 0.00 0.00 175.76 176.07 2jcc s VAL 25 N -0.03 0.50 -0.05 0.00 -7.23 -0.62 -0.65 120.40 112.31 2jcc s VAL 25 Ca -0.01 -0.95 0.05 0.00 -1.81 0.00 0.00 61.98 59.26 2jcc s VAL 25 Cb -0.09 -0.55 -0.02 0.00 0.56 0.00 0.00 36.38 36.28 2jcc s VAL 25 CO 0.01 -0.32 -0.20 -0.83 -0.31 0.00 0.00 175.10 173.45 2jcc s GLY 26 N -1.37 1.41 -0.02 2.32 0.00 -0.77 -0.97 107.32 107.92 2jcc s GLY 26 Ca -0.09 -1.02 0.06 0.00 0.00 0.00 0.00 44.72 43.68 2jcc s GLY 26 CO 0.00 -0.71 -0.21 -0.19 0.00 0.00 0.00 173.10 171.99 2jcc s TYR 27 N -0.44 1.89 -0.32 1.90 1.51 0.29 -0.37 117.35 121.81 2jcc s TYR 27 Ca 0.05 -0.37 -0.08 0.00 -1.01 0.00 0.00 57.07 55.66 2jcc s TYR 27 Cb -0.12 -1.22 0.01 0.00 -0.11 0.00 0.00 41.96 40.53 2jcc s TYR 27 CO 0.02 -0.04 0.13 0.08 -1.11 0.00 0.00 175.55 174.62 2jcc s VAL 28 N -0.46 4.20 0.00 0.71 1.01 -0.17 -0.99 120.40 124.69 2jcc s VAL 28 Ca 0.07 -0.74 0.00 0.00 0.00 0.00 0.00 61.98 61.31 2jcc s VAL 28 Cb -0.08 -3.23 0.00 0.00 0.00 0.00 0.00 36.38 33.06 2jcc s VAL 28 CO -0.01 -0.03 0.00 0.47 0.00 0.00 0.00 175.10 175.53 2jcc n ASP 29 N 4.91 0.00 -1.29 3.32 8.00 -0.51 -1.62 116.55 129.36 2jcc n ASP 29 Ca -0.13 0.00 0.08 0.00 0.71 0.00 0.00 54.79 55.45 2jcc n ASP 29 Cb 0.47 0.00 0.31 0.00 -0.02 0.00 0.00 41.12 41.88 2jcc n ASP 29 CO 0.00 0.00 0.00 0.47 -0.39 0.00 0.00 177.20 177.28 2jcc n ASP 30 N 7.72 4.52 -4.33 -2.24 8.00 -1.26 -4.92 116.55 124.05 2jcc n ASP 30 Ca 0.00 -2.82 -0.35 0.00 0.71 0.00 0.00 54.79 52.33 2jcc n ASP 30 Cb 0.00 -0.57 -0.14 0.00 -0.02 0.00 0.00 41.12 40.39 2jcc n ASP 30 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 2jcc s THR 31 N -2.51 3.37 0.12 -3.53 2.01 -0.64 -5.03 115.64 109.42 2jcc s THR 31 Ca 0.46 -0.50 -0.31 0.00 0.31 0.00 0.00 61.69 61.65 2jcc s THR 31 Cb 0.34 -2.52 -0.07 0.00 0.01 0.00 0.00 72.50 70.27 2jcc s THR 31 CO 0.14 0.44 1.26 -1.58 -0.69 0.00 0.00 174.62 174.19 2jcc s GLN 32 N 1.30 4.41 0.00 4.92 0.74 -1.26 -1.00 119.66 128.77 2jcc s GLN 32 Ca 0.04 1.90 0.00 0.00 0.05 0.00 0.00 55.36 57.34 2jcc s GLN 32 Cb -0.14 -3.28 0.00 0.00 1.10 0.00 0.00 33.01 30.68 2jcc s GLN 32 CO -0.02 -0.26 0.00 1.97 -0.55 0.00 0.00 175.29 176.42 2jcc n PHE 33 N 3.50 0.00 -4.03 1.67 -1.74 0.50 -3.95 117.46 113.41 2jcc n PHE 33 Ca 0.08 0.00 -0.08 0.00 -0.56 0.00 0.00 57.45 56.89 2jcc n PHE 33 Cb 0.45 0.00 -0.11 0.00 1.52 0.00 0.00 39.48 41.34 2jcc n PHE 33 CO 0.00 0.00 0.00 0.14 -0.56 0.00 0.00 176.76 176.34 2jcc s VAL 34 N -1.88 0.17 0.03 1.97 -7.23 -1.24 -0.14 120.40 112.08 2jcc s VAL 34 Ca 0.00 -1.29 -0.03 0.00 -1.81 0.00 0.00 61.98 58.85 2jcc s VAL 34 Cb 0.00 -0.80 -0.02 0.00 0.56 0.00 0.00 36.38 36.12 2jcc s VAL 34 CO 0.00 -0.71 0.03 0.00 -0.31 0.00 0.00 175.10 174.12 2jcc s ARG 35 N -2.49 0.50 -0.01 4.82 1.70 -0.24 -1.85 118.95 121.38 2jcc s ARG 35 Ca -0.06 -0.79 0.02 0.00 -0.47 0.00 0.00 55.73 54.42 2jcc s ARG 35 Cb -0.02 0.19 0.00 0.00 -0.57 0.00 0.00 34.95 34.54 2jcc s ARG 35 CO -0.05 -0.11 -0.05 0.12 -1.08 0.00 0.00 175.30 174.13 2jcc s PHE 36 N -2.47 0.56 -0.10 5.89 5.36 0.17 -0.48 117.98 126.91 2jcc s PHE 36 Ca -0.06 -0.11 -0.02 0.00 -0.96 0.00 0.00 56.93 55.77 2jcc s PHE 36 Cb -0.02 -0.41 0.04 0.00 -0.34 0.00 0.00 43.02 42.29 2jcc s PHE 36 CO -0.04 -0.05 0.03 0.34 -1.46 0.00 0.00 175.22 174.04 2jcc s ASP 37 N 0.10 1.87 0.59 6.13 2.15 -1.26 -0.89 116.67 125.37 2jcc s ASP 37 Ca -0.01 -0.28 0.31 0.00 0.43 0.00 0.00 52.55 53.00 2jcc s ASP 37 Cb -0.05 -0.38 1.67 0.00 -0.30 0.00 0.00 42.92 43.86 2jcc s ASP 37 CO -0.00 -0.25 1.92 0.77 -0.17 0.00 0.00 175.17 177.44 2jcc h SER 38 N 8.35 0.00 0.43 -0.34 4.64 -1.37 -0.21 113.55 125.05 2jcc h SER 38 Ca -0.17 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.15 2jcc h SER 38 Cb 1.13 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.22 2jcc h SER 38 CO 0.26 0.00 -0.94 0.47 -0.87 0.00 0.00 176.83 175.75 2jcc n ASP 39 N -2.76 0.63 -4.78 4.97 9.92 -1.26 -4.95 116.55 118.33 2jcc n ASP 39 Ca -0.02 -0.26 -0.37 0.00 -0.53 0.00 0.00 54.79 53.61 2jcc n ASP 39 Cb 0.26 0.71 -0.03 0.00 -0.64 0.00 0.00 41.12 41.41 2jcc n ASP 39 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 2jcc s ALA 40 N -3.15 3.08 0.40 2.24 0.00 -0.09 -4.95 121.76 119.28 2jcc s ALA 40 Ca 0.05 0.76 0.32 0.00 0.00 0.00 0.00 51.96 53.09 2jcc s ALA 40 Cb 0.15 -3.30 1.63 0.00 0.00 0.00 0.00 23.12 21.60 2jcc s ALA 40 CO 0.79 -0.30 2.11 0.00 0.00 0.00 0.00 175.76 178.36 2jcc h ALA 41 N 2.48 1.16 -0.04 0.00 0.00 -1.92 -3.20 119.26 117.74 2jcc h ALA 41 Ca -0.48 -0.06 -0.13 0.00 0.00 0.00 0.00 54.91 54.23 2jcc h ALA 41 Cb 1.22 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.99 2jcc h ALA 41 CO 0.62 0.09 -0.59 0.66 0.00 0.00 0.00 179.25 180.03 2jcc h SER 42 N 0.00 0.15 -6.08 0.00 4.64 -1.92 -3.47 113.55 106.87 2jcc h SER 42 Ca -0.00 -0.08 -0.46 0.00 -0.47 0.00 0.00 61.79 60.77 2jcc h SER 42 Cb 0.31 -0.04 -0.06 0.00 -0.31 0.00 0.00 62.40 62.29 2jcc h SER 42 CO 0.01 0.70 -0.72 0.00 -0.87 0.00 0.00 176.83 175.96 2jcc n GLN 43 N -3.86 -4.78 -3.97 4.77 1.13 -1.21 -4.98 117.38 104.49 2jcc n GLN 43 Ca -0.02 0.56 -0.08 0.00 -1.94 0.00 0.00 57.00 55.52 2jcc n GLN 43 Cb 0.60 -5.40 -0.09 0.00 0.11 0.00 0.00 30.24 25.46 2jcc n GLN 43 CO 0.00 0.00 0.00 1.03 -1.44 0.00 0.00 177.06 176.65 2jcc s ARG 44 N -6.49 0.66 -0.02 -1.09 0.52 -1.26 -5.08 118.95 106.20 2jcc s ARG 44 Ca 0.61 -0.97 -0.30 0.00 -0.52 0.00 0.00 55.73 54.55 2jcc s ARG 44 Cb -0.31 0.25 -0.07 0.00 0.52 0.00 0.00 34.95 35.34 2jcc s ARG 44 CO 0.75 -0.17 1.78 1.41 0.02 0.00 0.00 175.30 179.10 2jcc s MET 45 N -3.40 4.16 -0.11 3.54 -2.45 -1.26 -4.72 119.30 115.06 2jcc s MET 45 Ca 0.02 2.36 -0.04 0.00 -1.25 0.00 0.00 55.69 56.77 2jcc s MET 45 Cb 0.04 -4.06 -0.04 0.00 1.25 0.00 0.00 34.83 32.02 2jcc s MET 45 CO -0.08 -0.90 0.04 -1.21 1.05 0.00 0.00 175.02 173.92 2jcc s GLU 46 N 4.23 3.23 0.34 4.11 2.02 0.37 -4.93 118.70 128.07 2jcc s GLU 46 Ca 0.80 -0.33 -0.27 0.00 0.02 0.00 0.00 54.97 55.19 2jcc s GLU 46 Cb -0.37 -2.95 -0.09 0.00 0.10 0.00 0.00 34.13 30.82 2jcc s GLU 46 CO 0.34 0.67 1.12 -1.25 0.02 0.00 0.00 175.26 176.17 2jcc s PRO 47 N -0.76 4.35 0.00 0.39 0.04 -1.26 -1.08 135.00 136.68 2jcc s PRO 47 Ca 0.12 1.78 0.00 0.00 0.04 0.00 0.00 61.00 62.95 2jcc s PRO 47 Cb -0.12 -2.89 0.00 0.00 0.04 0.00 0.00 34.50 31.53 2jcc s PRO 47 CO 0.03 -0.05 0.62 0.54 0.04 0.00 0.00 177.00 178.18 2jcc n ARG 48 N 0.57 0.96 -4.24 4.56 5.12 0.80 -4.86 116.66 119.57 2jcc n ARG 48 Ca 0.02 -0.79 -0.20 0.00 -1.93 0.00 0.00 57.85 54.94 2jcc n ARG 48 Cb 0.46 -0.72 -0.12 0.00 -1.16 0.00 0.00 32.46 30.92 2jcc n ARG 48 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 2jcc s ALA 49 N -0.35 1.39 0.20 7.54 0.00 -1.20 -4.70 121.76 124.65 2jcc s ALA 49 Ca 0.00 -1.07 0.27 0.00 0.00 0.00 0.00 51.96 51.16 2jcc s ALA 49 Cb 0.00 -0.16 1.15 0.00 0.00 0.00 0.00 23.12 24.11 2jcc s ALA 49 CO 0.00 0.24 1.92 -1.35 0.00 0.00 0.00 175.76 176.57 2jcc h PRO 50 N 4.29 0.00 0.00 0.00 0.11 -1.94 -3.15 132.00 131.31 2jcc h PRO 50 Ca -0.42 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.69 2jcc h PRO 50 Cb 1.19 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.30 2jcc h PRO 50 CO 0.40 0.16 -0.28 0.11 -0.21 0.00 0.00 178.00 178.18 2jcc h TRP 51 N 0.00 0.00 0.00 0.65 5.08 -1.97 -3.06 115.95 116.66 2jcc h TRP 51 Ca -0.00 0.00 0.00 0.00 1.08 0.00 0.00 58.89 59.97 2jcc h TRP 51 Cb 0.60 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 26.76 2jcc h TRP 51 CO 0.00 0.00 -0.21 0.97 -1.28 0.00 0.00 178.44 177.92 2jcc h ILE 52 N 0.00 0.00 0.00 0.12 6.09 -1.89 -3.33 117.51 118.50 2jcc h ILE 52 Ca 0.00 -0.60 -0.01 0.00 -1.37 0.00 0.00 64.86 62.87 2jcc h ILE 52 Cb 0.75 1.47 -0.00 0.00 0.47 0.00 0.00 36.82 39.51 2jcc h ILE 52 CO 0.00 0.00 -0.07 -0.33 -3.07 0.00 0.00 178.15 174.68 2jcc h GLU 53 N 0.00 0.00 0.00 2.19 5.08 -1.65 -2.30 114.58 117.91 2jcc h GLU 53 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 2jcc h GLU 53 Cb 0.80 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.05 2jcc h GLU 53 CO 0.00 0.07 0.00 0.00 -1.00 0.00 0.00 179.01 178.08 2jcc n GLN 54 N -3.80 0.39 -2.33 2.33 10.64 -1.25 -4.77 117.38 118.59 2jcc n GLN 54 Ca -0.02 0.05 -0.39 0.00 -1.83 0.00 0.00 57.00 54.81 2jcc n GLN 54 Cb 0.16 -1.50 -0.03 0.00 -0.86 0.00 0.00 30.24 28.02 2jcc n GLN 54 CO 0.00 0.00 0.00 -1.21 -1.83 0.00 0.00 177.06 174.02 2jcc s GLU 55 N -2.49 4.20 0.58 2.61 0.41 -0.87 -5.05 118.70 118.10 2jcc s GLU 55 Ca 0.24 1.84 -0.08 0.00 -0.41 0.00 0.00 54.97 56.57 2jcc s GLU 55 Cb 0.16 -2.80 0.13 0.00 -1.78 0.00 0.00 34.13 29.84 2jcc s GLU 55 CO 0.35 -0.19 0.79 0.41 -0.49 0.00 0.00 175.26 176.14 2jcc n GLY 56 N 0.72 -0.83 0.23 -1.39 0.00 -1.26 -4.89 105.19 97.77 2jcc n GLY 56 Ca 0.03 -1.78 0.08 0.00 0.00 0.00 0.00 46.02 44.36 2jcc n GLY 56 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 2jcc h PRO 57 N 0.00 0.00 -0.57 1.61 0.11 -1.98 -2.40 132.00 128.76 2jcc h PRO 57 Ca -0.26 0.00 -0.00 0.00 0.11 0.00 0.00 66.00 65.85 2jcc h PRO 57 Cb 0.76 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 31.85 2jcc h PRO 57 CO 0.20 0.22 0.35 0.93 -0.21 0.00 0.00 178.00 179.49 2jcc h GLU 58 N 0.00 0.77 -0.28 1.05 5.08 -1.99 0.56 114.58 119.77 2jcc h GLU 58 Ca -0.00 -0.07 -0.01 0.00 -1.00 0.00 0.00 59.36 58.28 2jcc h GLU 58 Cb 0.49 -0.16 -0.01 0.00 0.50 0.00 0.00 28.75 29.56 2jcc h GLU 58 CO 0.03 0.56 0.13 -0.92 -1.00 0.00 0.00 179.01 177.80 2jcc h TYR 59 N 0.77 0.41 -0.26 4.33 3.20 -1.81 -1.43 116.97 122.19 2jcc h TYR 59 Ca 0.20 -0.02 -0.19 0.00 3.14 0.00 0.00 58.73 61.86 2jcc h TYR 59 Cb -0.02 -0.13 0.00 0.00 1.54 0.00 0.00 36.73 38.13 2jcc h TYR 59 CO -0.02 0.39 -0.58 -1.49 -1.64 0.00 0.00 178.16 174.82 2jcc h TRP 60 N 0.32 1.08 -0.48 -3.82 4.06 -1.26 -0.44 115.95 115.40 2jcc h TRP 60 Ca 0.10 -0.40 -0.00 0.00 2.06 0.00 0.00 58.89 60.64 2jcc h TRP 60 Cb 0.14 -0.20 -0.02 0.00 -1.00 0.00 0.00 29.16 28.08 2jcc h TRP 60 CO -0.02 1.23 0.29 -0.44 -3.56 0.00 0.00 178.44 175.95 2jcc h ASP 61 N 0.62 0.58 0.13 -3.49 3.32 -0.95 -1.47 116.42 115.16 2jcc h ASP 61 Ca 0.00 -0.06 -0.01 0.00 0.02 0.00 0.00 57.03 56.99 2jcc h ASP 61 Cb 1.20 -0.15 -0.00 0.00 0.22 0.00 0.00 39.33 40.60 2jcc h ASP 61 CO 0.13 0.47 -0.07 1.23 -1.72 0.00 0.00 179.24 179.28 2jcc h GLY 62 N 0.65 -0.19 1.20 2.75 0.00 -1.13 -1.92 103.07 104.43 2jcc h GLY 62 Ca 0.17 0.08 -0.10 0.00 0.00 0.00 0.00 47.33 47.48 2jcc h GLY 62 CO -0.03 -0.08 -0.09 0.83 0.00 0.00 0.00 176.54 177.17 2jcc h GLU 63 N -0.19 0.94 -0.40 4.80 4.39 -1.05 -0.88 114.58 122.19 2jcc h GLU 63 Ca -0.02 -0.33 0.03 0.00 0.34 0.00 0.00 59.36 59.39 2jcc h GLU 63 Cb 0.15 -0.07 -0.03 0.00 -0.10 0.00 0.00 28.75 28.70 2jcc h GLU 63 CO 0.02 0.98 0.19 1.15 -1.16 0.00 0.00 179.01 180.20 2jcc h THR 64 N 0.84 0.96 -0.16 1.13 2.02 -1.25 0.63 112.91 117.10 2jcc h THR 64 Ca 0.14 -0.13 -0.11 0.00 0.77 0.00 0.00 66.41 67.08 2jcc h THR 64 Cb 0.63 0.54 0.00 0.00 -1.74 0.00 0.00 68.15 67.58 2jcc h THR 64 CO 0.04 0.07 -0.32 0.08 0.37 0.00 0.00 175.52 175.76 2jcc h ARG 65 N 0.39 0.49 -0.79 6.66 0.11 -0.88 -1.56 114.38 118.81 2jcc h ARG 65 Ca 0.17 -0.32 0.09 0.00 0.10 0.00 0.00 59.98 60.02 2jcc h ARG 65 Cb 0.09 0.04 -0.07 0.00 1.11 0.00 0.00 29.97 31.14 2jcc h ARG 65 CO -0.13 0.93 0.44 0.87 0.10 0.00 0.00 179.97 182.19 2jcc h LYS 66 N 0.12 0.73 -0.05 0.08 1.57 -1.18 -1.40 116.57 116.43 2jcc h LYS 66 Ca 0.00 -0.04 -0.14 0.00 -1.87 0.00 0.00 60.65 58.60 2jcc h LYS 66 Cb 0.92 -0.16 -0.01 0.00 0.08 0.00 0.00 32.23 33.05 2jcc h LYS 66 CO 0.07 0.48 -0.58 -0.24 -0.57 0.00 0.00 179.45 178.61 2jcc h VAL 67 N 0.75 1.39 -0.04 0.50 3.04 -0.66 -1.46 116.25 119.77 2jcc h VAL 67 Ca 0.38 -1.95 -0.15 0.00 -1.01 0.00 0.00 66.70 63.97 2jcc h VAL 67 Cb 0.35 2.00 -0.01 0.00 -2.01 0.00 0.00 31.29 31.62 2jcc h VAL 67 CO -0.25 0.57 -0.63 0.11 -1.01 0.00 0.00 177.57 176.37 2jcc h LYS 68 N 0.13 0.17 -0.35 4.17 1.57 -1.00 -0.89 116.57 120.36 2jcc h LYS 68 Ca -0.00 -0.12 -0.12 0.00 -1.87 0.00 0.00 60.65 58.53 2jcc h LYS 68 Cb 1.06 0.02 -0.01 0.00 0.08 0.00 0.00 32.23 33.38 2jcc h LYS 68 CO 0.09 0.74 -0.28 0.00 -0.57 0.00 0.00 179.45 179.43 2jcc h ALA 69 N 1.23 0.84 -0.25 3.86 0.00 -1.00 -0.58 119.26 123.35 2jcc h ALA 69 Ca -0.01 -0.40 -0.00 0.00 0.00 0.00 0.00 54.91 54.50 2jcc h ALA 69 Cb 1.14 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.78 2jcc h ALA 69 CO 0.09 0.64 0.16 0.45 0.00 0.00 0.00 179.25 180.59 2jcc h HIS 70 N 0.63 0.32 -0.38 0.00 3.86 -1.03 -1.16 115.15 117.39 2jcc h HIS 70 Ca 0.08 0.00 0.06 0.00 -1.16 0.00 0.00 60.37 59.35 2jcc h HIS 70 Cb 0.80 -0.11 -0.05 0.00 1.06 0.00 0.00 27.41 29.11 2jcc h HIS 70 CO 0.04 0.23 0.06 1.03 0.86 0.00 0.00 177.93 180.15 2jcc h SER 71 N 0.32 -0.03 -0.53 2.45 0.87 -1.05 -0.95 113.55 114.63 2jcc h SER 71 Ca 0.09 0.07 -0.02 0.00 -1.23 0.00 0.00 61.79 60.70 2jcc h SER 71 Cb -0.00 0.10 -0.02 0.00 -0.44 0.00 0.00 62.40 62.03 2jcc h SER 71 CO -0.02 0.02 0.27 -0.61 -0.53 0.00 0.00 176.83 175.97 2jcc h GLN 72 N 0.18 0.76 -0.33 2.24 5.75 -0.98 -0.75 115.11 121.98 2jcc h GLN 72 Ca 0.18 -0.10 0.04 0.00 -0.15 0.00 0.00 58.65 58.62 2jcc h GLN 72 Cb 0.22 -0.14 -0.04 0.00 1.07 0.00 0.00 27.48 28.59 2jcc h GLN 72 CO -0.25 0.61 0.10 1.15 -2.65 0.00 0.00 178.83 177.78 2jcc h THR 73 N 0.71 0.88 0.00 2.39 2.02 -0.76 -1.36 112.91 116.80 2jcc h THR 73 Ca 0.19 -0.08 -0.12 0.00 0.77 0.00 0.00 66.41 67.17 2jcc h THR 73 Cb 0.08 0.64 -0.02 0.00 -1.74 0.00 0.00 68.15 67.11 2jcc h THR 73 CO -0.03 0.04 -0.55 0.45 0.37 0.00 0.00 175.52 175.80 2jcc h HIS 74 N 0.23 0.00 -0.58 3.16 3.86 -1.08 0.15 115.15 120.89 2jcc h HIS 74 Ca 0.15 0.00 0.04 0.00 -1.16 0.00 0.00 60.37 59.40 2jcc h HIS 74 Cb 0.14 0.00 -0.04 0.00 1.06 0.00 0.00 27.41 28.56 2jcc h HIS 74 CO -0.15 0.55 0.33 -0.09 0.86 0.00 0.00 177.93 179.43 2jcc h ARG 75 N 0.00 0.62 -0.13 2.45 2.43 -0.77 -1.86 114.38 117.12 2jcc h ARG 75 Ca -0.01 -0.04 -0.20 0.00 -0.81 0.00 0.00 59.98 58.92 2jcc h ARG 75 Cb 1.04 -0.14 0.00 0.00 -0.42 0.00 0.00 29.97 30.45 2jcc h ARG 75 CO 0.07 0.41 -0.73 0.28 -1.51 0.00 0.00 179.97 178.48 2jcc h VAL 76 N 0.63 1.32 -0.89 0.20 2.07 -0.74 -3.18 116.25 115.67 2jcc h VAL 76 Ca 0.24 -2.01 0.10 0.00 0.82 0.00 0.00 66.70 65.85 2jcc h VAL 76 Cb 0.09 2.00 -0.07 0.00 -1.52 0.00 0.00 31.29 31.79 2jcc h VAL 76 CO -0.13 0.63 0.57 0.44 0.02 0.00 0.00 177.57 179.09 2jcc h ASP 77 N 0.44 0.77 -0.50 0.57 3.32 -0.43 -0.87 116.42 119.71 2jcc h ASP 77 Ca -0.04 0.03 0.08 0.00 0.02 0.00 0.00 57.03 57.12 2jcc h ASP 77 Cb 1.34 -0.13 -0.07 0.00 0.22 0.00 0.00 39.33 40.69 2jcc h ASP 77 CO 0.14 0.44 0.11 -0.07 -1.72 0.00 0.00 179.24 178.15 2jcc h LEU 78 N 0.84 0.03 0.35 1.55 3.38 -1.32 0.20 115.31 120.34 2jcc h LEU 78 Ca 0.42 0.08 -0.01 0.00 0.09 0.00 0.00 57.88 58.46 2jcc h LEU 78 Cb 0.46 0.11 -0.00 0.00 0.09 0.00 0.00 40.66 41.32 2jcc h LEU 78 CO -0.18 0.05 -0.20 1.23 0.09 0.00 0.00 178.44 179.42 2jcc h GLY 79 N 0.26 -0.55 0.19 0.83 0.00 -1.28 -2.37 103.07 100.15 2jcc h GLY 79 Ca 0.25 0.23 0.07 0.00 0.00 0.00 0.00 47.33 47.88 2jcc h GLY 79 CO -0.31 -0.21 -0.14 -0.84 0.00 0.00 0.00 176.54 175.04 2jcc h THR 80 N -0.53 0.54 -0.30 4.70 2.02 -0.98 -0.45 112.91 117.91 2jcc h THR 80 Ca -0.04 0.00 -0.05 0.00 0.77 0.00 0.00 66.41 67.10 2jcc h THR 80 Cb 0.43 0.54 -0.01 0.00 -1.74 0.00 0.00 68.15 67.36 2jcc h THR 80 CO 0.05 0.00 0.01 -0.07 0.37 0.00 0.00 175.52 175.88 2jcc h LEU 81 N -0.08 0.51 -0.92 2.58 3.38 -0.99 0.72 115.31 120.52 2jcc h LEU 81 Ca 0.18 -0.30 0.22 0.00 0.09 0.00 0.00 57.88 58.07 2jcc h LEU 81 Cb 0.34 -0.14 -0.12 0.00 0.09 0.00 0.00 40.66 40.83 2jcc h LEU 81 CO -0.40 0.69 0.44 -0.09 0.09 0.00 0.00 178.44 179.16 2jcc h ARG 82 N 0.33 0.43 0.21 1.13 2.43 -1.26 -1.97 114.38 115.67 2jcc h ARG 82 Ca 0.09 -0.03 -0.01 0.00 -0.81 0.00 0.00 59.98 59.22 2jcc h ARG 82 Cb 0.42 -0.10 0.00 0.00 -0.42 0.00 0.00 29.97 29.87 2jcc h ARG 82 CO 0.01 0.29 -0.10 0.78 -1.51 0.00 0.00 179.97 179.44 2jcc h GLY 83 N 0.45 -0.29 0.23 2.80 0.00 -0.27 -1.28 103.07 104.70 2jcc h GLY 83 Ca 0.58 0.11 0.14 0.00 0.00 0.00 0.00 47.33 48.16 2jcc h GLY 83 CO -0.51 -0.11 0.40 -0.97 0.00 0.00 0.00 176.54 175.35 2jcc h TYR 84 N -0.51 0.70 -0.21 5.60 0.05 -0.15 -0.65 116.97 121.80 2jcc h TYR 84 Ca -0.03 0.03 0.00 0.00 0.05 0.00 0.00 58.73 58.79 2jcc h TYR 84 Cb 0.38 -0.19 0.00 0.00 1.01 0.00 0.00 36.73 37.93 2jcc h TYR 84 CO 0.00 0.16 0.00 0.66 -1.05 0.00 0.00 178.16 177.93 2jcc n TYR 85 N -4.90 0.26 -3.92 4.88 4.01 -0.92 -4.94 117.16 111.64 2jcc n TYR 85 Ca 0.16 -0.13 -0.31 0.00 -0.16 0.00 0.00 57.90 57.46 2jcc n TYR 85 Cb 0.42 0.00 0.02 0.00 -0.31 0.00 0.00 39.34 39.46 2jcc n TYR 85 CO 0.00 0.00 0.00 0.09 -0.46 0.00 0.00 176.86 176.49 2jcc n ASN 86 N 0.75 -4.58 -4.83 7.72 5.03 -0.25 -4.96 115.26 114.14 2jcc n ASN 86 Ca 0.17 -0.79 -0.34 0.00 0.87 0.00 0.00 54.58 54.50 2jcc n ASN 86 Cb 0.44 -3.67 -0.06 0.00 -1.02 0.00 0.00 39.78 35.46 2jcc n ASN 86 CO 0.00 0.00 0.00 -1.10 -1.83 0.00 0.00 177.26 174.33 2jcc s GLN 87 N -6.63 4.16 1.23 3.52 -0.21 -0.50 -5.04 119.66 116.19 2jcc s GLN 87 Ca 0.67 0.87 -0.21 0.00 0.02 0.00 0.00 55.36 56.71 2jcc s GLN 87 Cb -0.34 -2.52 0.32 0.00 1.00 0.00 0.00 33.01 31.47 2jcc s GLN 87 CO 0.82 0.19 0.84 -1.13 -2.12 0.00 0.00 175.29 173.89 2jcc n SER 88 N -0.08 -3.25 -0.91 5.90 3.41 -1.26 -4.67 113.62 112.77 2jcc n SER 88 Ca 0.03 -0.89 0.08 0.00 -0.26 0.00 0.00 58.87 57.82 2jcc n SER 88 Cb 0.53 -0.89 0.24 0.00 -0.26 0.00 0.00 64.21 63.83 2jcc n SER 88 CO 0.00 0.00 0.00 -1.84 -0.16 0.00 0.00 175.04 173.04 2jcc n GLU 89 N -5.07 3.06 -0.03 4.33 0.28 -1.26 -4.60 120.64 117.35 2jcc n GLU 89 Ca 0.13 -2.57 -0.14 0.00 -0.16 0.00 0.00 57.16 54.42 2jcc n GLU 89 Cb 0.53 -1.65 -0.10 0.00 1.43 0.00 0.00 31.44 31.64 2jcc n GLU 89 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 2jcc h ALA 90 N 2.20 0.04 -2.41 -1.84 0.00 -1.97 -3.45 119.26 111.83 2jcc h ALA 90 Ca 0.00 -0.36 -0.50 0.00 0.00 0.00 0.00 54.91 54.05 2jcc h ALA 90 Cb 1.20 -0.00 0.07 0.00 0.00 0.00 0.00 17.79 19.06 2jcc h ALA 90 CO 0.15 -0.07 0.39 0.20 0.00 0.00 0.00 179.25 179.92 2jcc s GLY 91 N -3.60 2.25 0.18 0.00 0.00 -1.26 -4.72 107.32 100.17 2jcc s GLY 91 Ca -0.16 0.52 -0.26 0.00 0.00 0.00 0.00 44.72 44.82 2jcc s GLY 91 CO 0.71 0.86 0.81 -0.45 0.00 0.00 0.00 173.10 175.03 2jcc s SER 92 N -2.49 7.44 0.09 1.64 0.15 -1.26 -4.79 113.70 114.49 2jcc s SER 92 Ca 0.66 1.71 0.04 0.00 0.70 0.00 0.00 55.95 59.06 2jcc s SER 92 Cb -0.18 -2.52 -0.03 0.00 -1.71 0.00 0.00 66.02 61.57 2jcc s SER 92 CO 0.35 0.19 -0.12 -1.00 1.20 0.00 0.00 173.24 173.87 2jcc s HIS 93 N -1.12 1.15 -0.07 3.44 3.76 -1.26 -4.96 115.29 116.22 2jcc s HIS 93 Ca 0.37 -0.59 0.05 0.00 -0.15 0.00 0.00 55.06 54.74 2jcc s HIS 93 Cb -0.24 -0.62 -0.01 0.00 1.11 0.00 0.00 32.58 32.82 2jcc s HIS 93 CO 0.27 0.04 -0.23 0.99 -0.85 0.00 0.00 174.74 174.96 2jcc s THR 94 N -2.09 1.96 -0.07 1.30 2.01 -1.26 -1.47 115.64 116.03 2jcc s THR 94 Ca 0.04 -1.00 0.03 0.00 0.31 0.00 0.00 61.69 61.07 2jcc s THR 94 Cb -0.05 -1.68 -0.02 0.00 0.01 0.00 0.00 72.50 70.76 2jcc s THR 94 CO 0.01 0.54 -0.14 -0.69 -0.69 0.00 0.00 174.62 173.66 2jcc s VAL 95 N 0.05 3.06 0.02 3.82 1.01 -0.56 -0.14 120.40 127.67 2jcc s VAL 95 Ca -0.09 -0.71 0.04 0.00 0.00 0.00 0.00 61.98 61.21 2jcc s VAL 95 Cb -0.15 -2.22 -0.02 0.00 0.00 0.00 0.00 36.38 34.00 2jcc s VAL 95 CO 0.05 0.58 -0.11 -1.10 0.00 0.00 0.00 175.10 174.52 2jcc s GLN 96 N -0.51 0.78 0.00 2.72 -0.21 0.47 -1.55 119.66 121.37 2jcc s GLN 96 Ca 0.07 -0.57 -0.01 0.00 0.02 0.00 0.00 55.36 54.86 2jcc s GLN 96 Cb -0.12 -0.73 -0.01 0.00 1.00 0.00 0.00 33.01 33.15 2jcc s GLN 96 CO 0.02 0.19 0.01 0.50 -2.12 0.00 0.00 175.29 173.89 2jcc s ARG 97 N -0.82 0.20 -0.03 2.91 3.52 -0.26 -0.28 118.95 124.18 2jcc s ARG 97 Ca 0.00 -0.28 -0.03 0.00 -0.13 0.00 0.00 55.73 55.29 2jcc s ARG 97 Cb -0.06 0.07 0.01 0.00 -1.56 0.00 0.00 34.95 33.41 2jcc s ARG 97 CO 0.00 -0.03 0.09 1.41 -0.81 0.00 0.00 175.30 175.96 2jcc s MET 98 N -0.76 0.09 0.07 5.12 1.75 -0.54 -0.34 119.30 124.70 2jcc s MET 98 Ca -0.08 0.14 -0.12 0.00 -1.25 0.00 0.00 55.69 54.38 2jcc s MET 98 Cb -0.05 0.02 0.01 0.00 2.84 0.00 0.00 34.83 37.65 2jcc s MET 98 CO -0.00 -0.03 0.27 1.52 -0.65 0.00 0.00 175.02 176.13 2jcc s TYR 99 N 0.18 -0.02 0.00 4.11 -0.85 -0.99 -1.49 117.35 118.29 2jcc s TYR 99 Ca -0.01 -0.25 0.00 0.00 -0.52 0.00 0.00 57.07 56.29 2jcc s TYR 99 Cb -0.02 0.06 0.00 0.00 0.38 0.00 0.00 41.96 42.38 2jcc s TYR 99 CO -0.01 -0.54 0.00 0.41 -1.52 0.00 0.00 175.55 173.89 2jcc n GLY 100 N 0.24 -0.70 3.59 5.49 0.00 -0.97 -1.28 105.19 111.56 2jcc n GLY 100 Ca -0.17 -1.26 -0.27 0.00 0.00 0.00 0.00 46.02 44.33 2jcc n GLY 100 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2jcc s ASP 102 N -3.67 2.61 0.14 0.00 1.01 0.93 -1.39 116.67 116.30 2jcc s ASP 102 Ca 0.34 -0.56 0.10 0.00 0.71 0.00 0.00 52.55 53.13 2jcc s ASP 102 Cb 0.05 -0.21 -0.04 0.00 1.01 0.00 0.00 42.92 43.74 2jcc s ASP 102 CO 0.18 0.16 -0.22 0.68 0.21 0.00 0.00 175.17 176.17 2jcc s VAL 103 N -0.86 2.00 0.71 -1.27 -7.23 0.14 -1.62 120.40 112.27 2jcc s VAL 103 Ca 0.08 -1.78 -0.12 0.00 -1.81 0.00 0.00 61.98 58.35 2jcc s VAL 103 Cb -0.09 -1.84 0.16 0.00 0.56 0.00 0.00 36.38 35.17 2jcc s VAL 103 CO 0.02 -0.09 0.91 0.61 -0.31 0.00 0.00 175.10 176.24 2jcc n GLY 104 N 0.69 -1.57 0.29 2.32 0.00 -0.83 -1.92 105.19 104.17 2jcc n GLY 104 Ca -0.16 -1.67 0.19 0.00 0.00 0.00 0.00 46.02 44.38 2jcc n GLY 104 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 2jcc h SER 105 N -1.36 0.00 0.36 1.61 4.64 -1.91 0.11 113.55 117.01 2jcc h SER 105 Ca -0.30 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.02 2jcc h SER 105 Cb 0.84 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.93 2jcc h SER 105 CO 0.21 0.00 -0.03 -0.90 -0.87 0.00 0.00 176.83 175.24 2jcc n ASP 106 N -2.98 0.15 -1.29 4.97 5.75 -1.26 -4.93 116.55 116.95 2jcc n ASP 106 Ca -0.01 -0.49 -0.14 0.00 -0.01 0.00 0.00 54.79 54.14 2jcc n ASP 106 Cb 0.20 -0.16 -0.04 0.00 -1.03 0.00 0.00 41.12 40.09 2jcc n ASP 106 CO 0.00 0.00 0.00 0.79 -0.11 0.00 0.00 177.20 177.88 2jcc n TRP 107 N -1.10 -0.28 -4.06 2.11 7.02 0.39 -5.02 117.44 116.49 2jcc n TRP 107 Ca 0.17 0.00 -0.33 0.00 -1.02 0.00 0.00 57.50 56.32 2jcc n TRP 107 Cb 0.22 -2.70 -0.07 0.00 -2.42 0.00 0.00 31.31 26.34 2jcc n TRP 107 CO 0.00 0.00 0.00 1.03 -2.02 0.00 0.00 177.69 176.70 2jcc s ARG 108 N -3.83 3.15 0.52 -0.99 0.52 -1.26 -4.83 118.95 112.23 2jcc s ARG 108 Ca 0.00 -0.44 -0.21 0.00 -0.52 0.00 0.00 55.73 54.56 2jcc s ARG 108 Cb 0.00 -2.92 -0.08 0.00 0.52 0.00 0.00 34.95 32.47 2jcc s ARG 108 CO 0.00 0.66 0.89 0.34 0.02 0.00 0.00 175.30 177.21 2jcc n PHE 109 N 1.19 0.65 0.00 -0.53 7.35 -1.26 -1.96 117.46 122.91 2jcc n PHE 109 Ca -0.13 0.49 0.00 0.00 -0.76 0.00 0.00 57.45 57.05 2jcc n PHE 109 Cb 0.53 -2.14 0.00 0.00 0.35 0.00 0.00 39.48 38.22 2jcc n PHE 109 CO 0.00 0.00 0.00 -0.11 -0.76 0.00 0.00 176.76 175.89 2jcc n LEU 110 N 0.06 0.06 -3.66 -2.13 7.94 -0.64 -4.77 117.00 113.86 2jcc n LEU 110 Ca 0.11 0.00 -0.15 0.00 -1.11 0.00 0.00 56.01 54.86 2jcc n LEU 110 Cb 0.44 0.00 -0.08 0.00 0.53 0.00 0.00 43.42 44.31 2jcc n LEU 110 CO 0.53 -0.36 0.20 -0.13 -1.11 0.00 0.00 177.39 176.52 2jcc s ARG 111 N -1.91 0.83 0.13 1.96 0.52 -1.22 -4.99 118.95 114.27 2jcc s ARG 111 Ca 0.00 0.03 0.03 0.00 -0.52 0.00 0.00 55.73 55.27 2jcc s ARG 111 Cb 0.00 0.38 -0.04 0.00 0.52 0.00 0.00 34.95 35.81 2jcc s ARG 111 CO 0.00 -0.24 -0.08 0.20 0.02 0.00 0.00 175.30 175.20 2jcc s GLY 112 N -1.22 0.96 0.03 -3.53 0.00 -1.26 -0.05 107.32 102.25 2jcc s GLY 112 Ca -0.12 -1.44 0.02 0.00 0.00 0.00 0.00 44.72 43.17 2jcc s GLY 112 CO 0.07 -1.53 -0.07 -0.19 0.00 0.00 0.00 173.10 171.38 2jcc s TYR 113 N -3.48 0.58 -0.30 1.90 1.51 0.36 -4.96 117.35 112.97 2jcc s TYR 113 Ca 0.15 -0.43 -0.05 0.00 -1.01 0.00 0.00 57.07 55.73 2jcc s TYR 113 Cb 0.04 -0.36 0.18 0.00 -0.11 0.00 0.00 41.96 41.71 2jcc s TYR 113 CO -0.01 -0.08 0.73 -1.58 -1.11 0.00 0.00 175.55 173.50 2jcc s HIS 114 N -1.17 -1.28 0.10 2.71 2.46 -1.25 -2.28 115.29 114.58 2jcc s HIS 114 Ca -0.09 1.45 -0.20 0.00 0.47 0.00 0.00 55.06 56.69 2jcc s HIS 114 Cb -0.09 0.48 0.05 0.00 -0.13 0.00 0.00 32.58 32.90 2jcc s HIS 114 CO 0.00 -0.69 0.49 1.14 -2.47 0.00 0.00 174.74 173.20 2jcc s GLN 115 N 2.87 1.10 0.10 2.88 -2.07 -0.56 -0.30 119.66 123.68 2jcc s GLN 115 Ca 0.13 -0.48 0.04 0.00 -1.82 0.00 0.00 55.36 53.23 2jcc s GLN 115 Cb -0.13 0.49 -0.04 0.00 -1.09 0.00 0.00 33.01 32.25 2jcc s GLN 115 CO -0.18 -0.43 -0.11 0.71 -1.32 0.00 0.00 175.29 173.96 2jcc s TYR 116 N -3.26 1.12 0.02 9.60 1.51 0.41 -1.46 117.35 125.28 2jcc s TYR 116 Ca -0.01 -0.62 0.02 0.00 -1.01 0.00 0.00 57.07 55.45 2jcc s TYR 116 Cb 0.00 -0.61 -0.01 0.00 -0.11 0.00 0.00 41.96 41.23 2jcc s TYR 116 CO -0.08 0.03 -0.07 0.00 -1.11 0.00 0.00 175.55 174.32 2jcc s ALA 117 N -2.27 0.51 -0.13 3.71 0.00 0.61 -0.85 121.76 123.34 2jcc s ALA 117 Ca 0.05 -0.48 0.02 0.00 0.00 0.00 0.00 51.96 51.55 2jcc s ALA 117 Cb -0.04 -0.04 0.01 0.00 0.00 0.00 0.00 23.12 23.05 2jcc s ALA 117 CO 0.01 0.05 -0.21 -0.47 0.00 0.00 0.00 175.76 175.14 2jcc s TYR 118 N -0.71 2.55 -1.32 0.00 5.04 -0.73 -0.39 117.35 121.79 2jcc s TYR 118 Ca -0.03 -1.27 -0.13 0.00 -2.44 0.00 0.00 57.07 53.19 2jcc s TYR 118 Cb -0.06 -1.75 0.12 0.00 0.35 0.00 0.00 41.96 40.63 2jcc s TYR 118 CO 0.00 -0.59 0.50 -0.25 -1.34 0.00 0.00 175.55 173.87 2jcc n ASP 119 N 4.08 -2.75 0.00 4.32 8.00 0.81 -2.40 116.55 128.60 2jcc n ASP 119 Ca -0.20 -0.59 0.00 0.00 0.71 0.00 0.00 54.79 54.71 2jcc n ASP 119 Cb 0.51 -2.32 0.00 0.00 -0.02 0.00 0.00 41.12 39.29 2jcc n ASP 119 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2jcc n GLY 120 N -1.08 3.25 3.84 0.44 0.00 -1.26 -5.02 105.19 105.35 2jcc n GLY 120 Ca 0.04 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.70 2jcc n GLY 120 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2jcc s LYS 121 N -0.66 4.01 0.27 1.61 2.47 -1.01 -5.03 119.74 121.40 2jcc s LYS 121 Ca 0.00 0.53 -0.28 0.00 -1.56 0.00 0.00 55.97 54.66 2jcc s LYS 121 Cb 0.00 -2.95 -0.14 0.00 -1.46 0.00 0.00 37.83 33.27 2jcc s LYS 121 CO 0.00 0.49 0.99 -0.25 0.16 0.00 0.00 175.35 176.73 2jcc n ASP 122 N 0.88 1.11 0.02 1.43 8.00 -1.26 -1.77 116.55 124.96 2jcc n ASP 122 Ca -0.06 1.17 -0.01 0.00 0.71 0.00 0.00 54.79 56.61 2jcc n ASP 122 Cb 0.52 -1.26 -0.00 0.00 -0.02 0.00 0.00 41.12 40.36 2jcc n ASP 122 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2jcc n TYR 123 N 0.32 0.00 -3.81 1.24 9.36 -0.03 -4.74 117.16 119.50 2jcc n TYR 123 Ca 0.11 0.00 -0.12 0.00 3.32 0.00 0.00 57.90 61.21 2jcc n TYR 123 Cb 0.31 -0.06 -0.09 0.00 -0.63 0.00 0.00 39.34 38.87 2jcc n TYR 123 CO 0.00 0.00 0.00 -1.50 0.22 0.00 0.00 176.86 175.58 2jcc s ILE 124 N -1.82 0.07 -0.08 2.97 2.07 -1.21 -3.42 121.20 119.80 2jcc s ILE 124 Ca -0.03 -0.62 -0.14 0.00 -1.41 0.00 0.00 60.65 58.44 2jcc s ILE 124 Cb 0.00 -0.61 0.03 0.00 0.13 0.00 0.00 42.46 42.02 2jcc s ILE 124 CO 0.05 -0.34 0.35 0.00 -1.91 0.00 0.00 174.94 173.09 2jcc s ALA 125 N -1.58 -0.88 0.19 1.50 0.00 -0.85 -0.44 121.76 119.70 2jcc s ALA 125 Ca -0.12 0.71 -0.30 0.00 0.00 0.00 0.00 51.96 52.25 2jcc s ALA 125 Cb -0.05 -0.26 -0.09 0.00 0.00 0.00 0.00 23.12 22.72 2jcc s ALA 125 CO 0.02 -0.22 1.31 -1.17 0.00 0.00 0.00 175.76 175.70 2jcc s LEU 126 N -0.58 4.41 0.63 0.00 2.96 0.59 -0.61 118.68 126.09 2jcc s LEU 126 Ca -0.07 2.39 -0.10 0.00 -0.22 0.00 0.00 54.13 56.14 2jcc s LEU 126 Cb -0.04 -3.61 -0.02 0.00 0.50 0.00 0.00 46.19 43.03 2jcc s LEU 126 CO 0.03 -0.54 1.02 -0.54 -1.32 0.00 0.00 176.35 175.00 2jcc s LYS 127 N -0.03 3.27 0.39 1.98 1.02 -1.02 -4.75 119.74 120.60 2jcc s LYS 127 Ca 0.57 0.52 0.12 0.00 0.02 0.00 0.00 55.97 57.20 2jcc s LYS 127 Cb -0.36 -2.11 0.92 0.00 -0.52 0.00 0.00 37.83 35.76 2jcc s LYS 127 CO 0.38 -0.71 1.92 1.49 -0.92 0.00 0.00 175.35 177.50 2jcc h GLU 128 N -0.37 0.54 0.00 1.68 4.57 -1.93 -0.69 114.58 118.38 2jcc h GLU 128 Ca -0.45 -0.03 0.00 0.00 -1.18 0.00 0.00 59.36 57.70 2jcc h GLU 128 Cb 1.22 -0.12 0.00 0.00 -0.16 0.00 0.00 28.75 29.69 2jcc h GLU 128 CO 0.62 0.36 0.00 -0.40 -1.18 0.00 0.00 179.01 178.41 2jcc n ASP 129 N -4.50 0.00 -1.12 1.04 5.75 -1.26 -4.87 116.55 111.59 2jcc n ASP 129 Ca 0.14 0.50 -0.11 0.00 -0.01 0.00 0.00 54.79 55.31 2jcc n ASP 129 Cb 0.44 -0.50 -0.03 0.00 -1.03 0.00 0.00 41.12 40.01 2jcc n ASP 129 CO 0.00 0.00 0.00 0.18 -0.11 0.00 0.00 177.20 177.27 2jcc n LEU 130 N -1.50 -1.21 0.00 -2.12 4.77 -0.27 -4.83 117.00 111.84 2jcc n LEU 130 Ca 0.03 0.12 0.00 0.00 -0.03 0.00 0.00 56.01 56.13 2jcc n LEU 130 Cb 0.14 -1.82 0.00 0.00 -2.33 0.00 0.00 43.42 39.40 2jcc n LEU 130 CO 0.11 -0.34 -0.09 0.54 -1.33 0.00 0.00 177.39 176.28 2jcc n ARG 131 N -2.36 2.68 -3.86 3.23 1.74 -1.26 -4.82 116.66 112.01 2jcc n ARG 131 Ca -0.13 0.00 -0.25 0.00 -0.77 0.00 0.00 57.85 56.71 2jcc n ARG 131 Cb 0.50 -0.59 -0.03 0.00 -1.02 0.00 0.00 32.46 31.33 2jcc n ARG 131 CO 0.00 0.00 0.00 -1.12 -1.52 0.00 0.00 177.63 174.99 2jcc s SER 132 N -0.88 4.69 -0.00 0.55 0.01 -1.26 -4.91 113.70 111.88 2jcc s SER 132 Ca 0.00 -1.09 0.02 0.00 1.31 0.00 0.00 55.95 56.19 2jcc s SER 132 Cb 0.00 -0.01 -0.01 0.00 0.21 0.00 0.00 66.02 66.22 2jcc s SER 132 CO 0.00 -0.88 -0.07 0.26 0.41 0.00 0.00 173.24 172.96 2jcc s TRP 133 N -2.67 0.67 -0.26 2.43 0.52 -1.26 -2.42 118.94 115.95 2jcc s TRP 133 Ca 0.39 -0.14 -0.14 0.00 0.02 0.00 0.00 56.10 56.22 2jcc s TRP 133 Cb -0.01 -0.43 -0.04 0.00 -1.15 0.00 0.00 33.47 31.84 2jcc s TRP 133 CO 0.23 -0.01 0.34 0.99 0.02 0.00 0.00 176.95 178.52 2jcc s THR 134 N -0.22 5.21 -0.25 2.01 2.01 0.22 -4.93 115.64 119.68 2jcc s THR 134 Ca 0.02 0.51 0.03 0.00 0.31 0.00 0.00 61.69 62.56 2jcc s THR 134 Cb -0.03 -3.67 0.06 0.00 0.01 0.00 0.00 72.50 68.87 2jcc s THR 134 CO -0.00 0.20 -0.11 0.00 -0.69 0.00 0.00 174.62 174.01 2jcc s ALA 135 N 1.85 2.48 0.11 7.40 0.00 -1.26 -2.00 121.76 130.33 2jcc s ALA 135 Ca 0.14 -1.68 -0.17 0.00 0.00 0.00 0.00 51.96 50.25 2jcc s ALA 135 Cb -0.15 -1.54 -0.05 0.00 0.00 0.00 0.00 23.12 21.38 2jcc s ALA 135 CO 0.09 -1.14 1.58 0.00 0.00 0.00 0.00 175.76 176.29 2jcc h ALA 136 N 7.81 0.43 -3.16 0.00 0.00 -1.87 -3.46 119.26 119.00 2jcc h ALA 136 Ca -0.21 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 54.50 2jcc h ALA 136 Cb 1.05 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.72 2jcc h ALA 136 CO 0.47 0.14 0.00 -0.40 0.00 0.00 0.00 179.25 179.45 2jcc n ASP 137 N -4.59 1.56 0.05 0.00 5.68 -1.26 -5.04 116.55 112.95 2jcc n ASP 137 Ca -0.02 -0.21 -0.08 0.00 -0.50 0.00 0.00 54.79 53.98 2jcc n ASP 137 Cb 0.23 0.00 -0.12 0.00 -1.14 0.00 0.00 41.12 40.08 2jcc n ASP 137 CO 0.00 0.00 0.00 0.24 -1.33 0.00 0.00 177.20 176.11 2jcc h MET 138 N 0.00 0.03 -0.28 0.11 2.86 -1.99 -2.61 114.93 113.04 2jcc h MET 138 Ca 0.00 -0.04 -0.09 0.00 -2.06 0.00 0.00 59.70 57.51 2jcc h MET 138 Cb 0.00 0.02 -0.01 0.00 0.06 0.00 0.00 31.60 31.66 2jcc h MET 138 CO 0.00 0.96 -0.19 0.00 1.06 0.00 0.00 176.91 178.74 2jcc h ALA 139 N 0.96 1.15 0.00 6.32 0.00 -1.97 -1.87 119.26 123.85 2jcc h ALA 139 Ca -0.06 -0.31 -0.12 0.00 0.00 0.00 0.00 54.91 54.42 2jcc h ALA 139 Cb 1.82 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 19.46 2jcc h ALA 139 CO 0.13 0.54 -0.57 0.00 0.00 0.00 0.00 179.25 179.35 2jcc h ALA 140 N 1.34 1.03 -0.46 0.00 0.00 -1.84 -2.51 119.26 116.83 2jcc h ALA 140 Ca 0.08 -0.52 -0.12 0.00 0.00 0.00 0.00 54.91 54.35 2jcc h ALA 140 Cb 0.59 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.28 2jcc h ALA 140 CO 0.04 0.71 -0.17 1.96 0.00 0.00 0.00 179.25 181.79 2jcc h GLN 141 N 0.00 0.92 -0.75 0.00 1.08 -1.05 0.15 115.11 115.46 2jcc h GLN 141 Ca -0.01 -0.38 0.07 0.00 -1.45 0.00 0.00 58.65 56.88 2jcc h GLN 141 Cb 1.02 -0.04 -0.06 0.00 -0.05 0.00 0.00 27.48 28.35 2jcc h GLN 141 CO 0.07 1.04 0.43 1.15 -0.95 0.00 0.00 178.83 180.57 2jcc h THR 142 N 0.77 0.96 -0.51 -0.54 2.02 -1.29 -0.59 112.91 113.73 2jcc h THR 142 Ca 0.11 -0.26 -0.06 0.00 0.77 0.00 0.00 66.41 66.97 2jcc h THR 142 Cb 0.73 0.13 -0.02 0.00 -1.74 0.00 0.00 68.15 67.25 2jcc h THR 142 CO 0.06 0.14 0.09 0.74 0.37 0.00 0.00 175.52 176.92 2jcc h THR 143 N 0.76 1.25 -0.71 3.16 2.02 -1.12 -2.81 112.91 115.45 2jcc h THR 143 Ca 0.34 -0.92 -0.03 0.00 0.77 0.00 0.00 66.41 66.57 2jcc h THR 143 Cb 0.24 0.85 -0.03 0.00 -1.74 0.00 0.00 68.15 67.48 2jcc h THR 143 CO -0.21 0.33 0.31 0.50 0.37 0.00 0.00 175.52 176.82 2jcc h LYS 144 N 0.73 1.03 -0.21 6.66 3.64 -0.20 -2.72 116.57 125.49 2jcc h LYS 144 Ca 0.16 -0.16 -0.12 0.00 -1.27 0.00 0.00 60.65 59.25 2jcc h LYS 144 Cb 0.38 -0.18 -0.00 0.00 -0.41 0.00 0.00 32.23 32.02 2jcc h LYS 144 CO 0.01 0.82 -0.34 0.45 -2.27 0.00 0.00 179.45 178.12 2jcc h HIS 145 N 1.02 0.75 -0.79 1.91 3.86 -1.09 -1.34 115.15 119.46 2jcc h HIS 145 Ca 0.24 -0.26 0.19 0.00 -1.16 0.00 0.00 60.37 59.38 2jcc h HIS 145 Cb 0.16 -0.15 -0.14 0.00 1.06 0.00 0.00 27.41 28.35 2jcc h HIS 145 CO 0.01 1.00 0.05 0.87 0.86 0.00 0.00 177.93 180.72 2jcc h LYS 146 N 0.29 0.12 -0.19 2.45 1.57 -1.44 -2.44 116.57 116.93 2jcc h LYS 146 Ca 0.02 -0.01 -0.16 0.00 -1.87 0.00 0.00 60.65 58.63 2jcc h LYS 146 Cb 0.93 -0.03 -0.01 0.00 0.08 0.00 0.00 32.23 33.20 2jcc h LYS 146 CO 0.08 0.08 -0.55 -1.49 -0.57 0.00 0.00 179.45 176.99 2jcc h TRP 147 N 0.12 0.71 -0.31 -1.35 4.06 -1.17 -2.74 115.95 115.27 2jcc h TRP 147 Ca 0.45 -0.25 -0.14 0.00 2.06 0.00 0.00 58.89 61.01 2jcc h TRP 147 Cb 0.82 -0.13 -0.01 0.00 -1.00 0.00 0.00 29.16 28.84 2jcc h TRP 147 CO -0.40 0.99 -0.38 0.93 -3.56 0.00 0.00 178.44 176.02 2jcc h GLU 148 N 0.43 0.72 0.00 0.49 5.08 -0.90 -1.33 114.58 119.08 2jcc h GLU 148 Ca 0.01 -0.36 -0.05 0.00 -1.00 0.00 0.00 59.36 57.96 2jcc h GLU 148 Cb 1.10 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.35 2jcc h GLU 148 CO 0.10 0.98 -0.22 0.00 -1.00 0.00 0.00 179.01 178.88 2jcc h ALA 149 N 0.98 1.15 -0.54 3.43 0.00 -1.42 -2.36 119.26 120.50 2jcc h ALA 149 Ca 0.05 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 54.77 2jcc h ALA 149 Cb 0.92 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.67 2jcc h ALA 149 CO 0.08 0.27 0.00 0.00 0.00 0.00 0.00 179.25 179.60 2jcc n ALA 150 N -2.28 2.41 -4.09 0.00 0.00 -0.94 -4.97 120.51 110.64 2jcc n ALA 150 Ca -0.01 -1.02 -0.30 0.00 0.00 0.00 0.00 53.44 52.11 2jcc n ALA 150 Cb 0.36 -0.95 -0.04 0.00 0.00 0.00 0.00 19.45 18.83 2jcc n ALA 150 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 2jcc n HIS 151 N 1.28 -1.61 -0.17 0.00 -0.00 -0.78 -4.91 115.22 109.03 2jcc n HIS 151 Ca 0.20 0.74 -0.09 0.00 -0.00 0.00 0.00 57.72 58.57 2jcc n HIS 151 Cb 0.53 -3.35 0.00 0.00 -0.00 0.00 0.00 29.99 27.17 2jcc n HIS 151 CO 0.00 0.00 0.00 0.28 -0.00 0.00 0.00 176.34 176.62 2jcc h VAL 152 N -1.72 1.25 -0.36 1.59 2.07 -1.54 -2.82 116.25 114.72 2jcc h VAL 152 Ca -0.62 -0.89 0.05 0.00 0.82 0.00 0.00 66.70 66.05 2jcc h VAL 152 Cb 1.38 0.90 -0.05 0.00 -1.52 0.00 0.00 31.29 32.01 2jcc h VAL 152 CO 0.69 0.32 0.08 0.00 0.02 0.00 0.00 177.57 178.67 2jcc h ALA 153 N 0.97 0.38 -0.70 1.67 0.00 -1.91 0.85 119.26 120.52 2jcc h ALA 153 Ca 0.15 0.07 0.02 0.00 0.00 0.00 0.00 54.91 55.14 2jcc h ALA 153 Cb 0.37 0.08 -0.04 0.00 0.00 0.00 0.00 17.79 18.21 2jcc h ALA 153 CO 0.01 -0.33 0.46 1.49 0.00 0.00 0.00 179.25 180.88 2jcc h GLU 154 N 0.20 0.88 0.09 0.00 4.81 -1.86 0.11 114.58 118.81 2jcc h GLU 154 Ca 0.17 -0.05 -0.26 0.00 -0.13 0.00 0.00 59.36 59.09 2jcc h GLU 154 Cb 0.19 -0.20 -0.01 0.00 0.63 0.00 0.00 28.75 29.37 2jcc h GLU 154 CO -0.22 0.58 -1.19 1.96 -0.73 0.00 0.00 179.01 179.41 2jcc h GLN 155 N 0.91 0.19 -0.52 1.92 4.20 -1.12 -3.07 115.11 117.61 2jcc h GLN 155 Ca 0.27 -0.33 -0.11 0.00 0.06 0.00 0.00 58.65 58.53 2jcc h GLN 155 Cb -0.03 0.12 -0.02 0.00 0.30 0.00 0.00 27.48 27.85 2jcc h GLN 155 CO -0.07 1.15 -0.12 1.25 -0.67 0.00 0.00 178.83 180.37 2jcc h LEU 156 N 0.05 0.98 -0.92 1.46 5.85 -0.49 -2.45 115.31 119.80 2jcc h LEU 156 Ca -0.11 -0.33 0.08 0.00 0.84 0.00 0.00 57.88 58.37 2jcc h LEU 156 Cb 1.92 -0.27 -0.07 0.00 0.37 0.00 0.00 40.66 42.61 2jcc h LEU 156 CO 0.18 1.10 0.57 0.03 -0.34 0.00 0.00 178.44 179.99 2jcc h ARG 157 N 0.87 0.98 -0.67 1.25 3.08 -0.97 -0.54 114.38 118.39 2jcc h ARG 157 Ca 0.14 -0.06 0.11 0.00 0.07 0.00 0.00 59.98 60.23 2jcc h ARG 157 Cb 0.67 -0.22 -0.08 0.00 0.08 0.00 0.00 29.97 30.42 2jcc h ARG 157 CO 0.05 0.65 0.26 0.00 -1.07 0.00 0.00 179.97 179.86 2jcc h ALA 158 N 1.45 0.89 0.09 0.04 0.00 -1.35 -0.41 119.26 119.98 2jcc h ALA 158 Ca 0.42 0.09 -0.00 0.00 0.00 0.00 0.00 54.91 55.41 2jcc h ALA 158 Cb 0.25 0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.10 2jcc h ALA 158 CO -0.20 -0.18 -0.05 -0.92 0.00 0.00 0.00 179.25 177.90 2jcc h TYR 159 N 0.44 -0.12 -0.64 0.00 3.20 -1.08 -2.77 116.97 116.00 2jcc h TYR 159 Ca 0.35 -0.00 -0.08 0.00 3.14 0.00 0.00 58.73 62.14 2jcc h TYR 159 Cb 0.45 0.04 -0.02 0.00 1.54 0.00 0.00 36.73 38.74 2jcc h TYR 159 CO -0.16 0.23 0.10 -0.07 -1.64 0.00 0.00 178.16 176.62 2jcc h LEU 160 N -0.48 1.01 -1.71 2.82 3.38 -0.96 0.51 115.31 119.88 2jcc h LEU 160 Ca -0.01 -0.26 0.00 0.00 0.09 0.00 0.00 57.88 57.69 2jcc h LEU 160 Cb 0.40 -0.27 0.00 0.00 0.09 0.00 0.00 40.66 40.88 2jcc h LEU 160 CO 0.02 1.02 0.00 -0.62 0.09 0.00 0.00 178.44 178.95 2jcc n GLU 161 N -4.26 2.11 0.00 1.13 1.02 -0.18 -3.71 120.64 116.76 2jcc n GLU 161 Ca 0.04 -1.68 0.00 0.00 -0.02 0.00 0.00 57.16 55.50 2jcc n GLU 161 Cb 0.29 -1.44 0.00 0.00 -0.02 0.00 0.00 31.44 30.27 2jcc n GLU 161 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2jcc n GLY 162 N 1.30 0.00 0.05 0.62 0.00 -1.05 -4.82 105.19 101.30 2jcc n GLY 162 Ca 0.17 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 46.07 2jcc n GLY 162 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 2jcc h THR 163 N 0.00 1.20 -0.03 2.61 2.02 -0.97 -0.71 112.91 117.02 2jcc h THR 163 Ca 0.00 -0.60 0.01 0.00 0.77 0.00 0.00 66.41 66.59 2jcc h THR 163 Cb 0.00 1.61 -0.02 0.00 -1.74 0.00 0.00 68.15 68.00 2jcc h THR 163 CO 0.00 0.16 -0.05 0.00 0.37 0.00 0.00 175.52 176.00 2jcc h VAL 165 N -0.07 1.19 -0.50 0.00 2.07 -1.63 -2.11 116.25 115.19 2jcc h VAL 165 Ca 0.03 -0.59 0.04 0.00 0.82 0.00 0.00 66.70 67.00 2jcc h VAL 165 Cb 0.12 1.16 -0.04 0.00 -1.52 0.00 0.00 31.29 31.00 2jcc h VAL 165 CO -0.08 0.19 0.26 -0.08 0.02 0.00 0.00 177.57 177.88 2jcc h GLU 166 N 0.20 0.49 -0.45 1.57 4.81 -0.88 -0.56 114.58 119.75 2jcc h GLU 166 Ca 0.07 -0.03 -0.11 0.00 -0.13 0.00 0.00 59.36 59.16 2jcc h GLU 166 Cb 0.23 -0.11 -0.01 0.00 0.63 0.00 0.00 28.75 29.48 2jcc h GLU 166 CO -0.00 0.32 -0.15 0.00 -0.73 0.00 0.00 179.01 178.45 2jcc h ALA 167 N 1.27 0.63 -0.49 2.92 0.00 -1.12 -2.04 119.26 120.41 2jcc h ALA 167 Ca 0.22 -0.35 0.03 0.00 0.00 0.00 0.00 54.91 54.81 2jcc h ALA 167 Cb 0.13 -0.16 -0.04 0.00 0.00 0.00 0.00 17.79 17.72 2jcc h ALA 167 CO -0.15 0.55 0.27 1.25 0.00 0.00 0.00 179.25 181.17 2jcc h LEU 168 N 0.73 0.42 -1.46 0.00 5.85 -1.02 0.12 115.31 119.96 2jcc h LEU 168 Ca 0.11 0.02 -0.03 0.00 0.84 0.00 0.00 57.88 58.82 2jcc h LEU 168 Cb 0.71 -0.07 -0.02 0.00 0.37 0.00 0.00 40.66 41.65 2jcc h LEU 168 CO 0.05 0.30 0.08 0.03 -0.34 0.00 0.00 178.44 178.56 2jcc h ARG 169 N 0.54 0.44 -0.22 1.25 3.08 -0.93 -0.90 114.38 117.63 2jcc h ARG 169 Ca 0.21 -0.06 -0.16 0.00 0.07 0.00 0.00 59.98 60.03 2jcc h ARG 169 Cb 0.07 -0.08 -0.01 0.00 0.08 0.00 0.00 29.97 30.03 2jcc h ARG 169 CO -0.12 0.40 -0.53 -0.09 -1.07 0.00 0.00 179.97 178.57 2jcc h ARG 170 N 0.43 0.65 -0.21 0.04 2.43 -0.49 -2.81 114.38 114.42 2jcc h ARG 170 Ca 0.10 -0.40 -0.15 0.00 -0.81 0.00 0.00 59.98 58.73 2jcc h ARG 170 Cb 0.16 0.04 0.00 0.00 -0.42 0.00 0.00 29.97 29.76 2jcc h ARG 170 CO -0.00 1.01 -0.44 1.88 -1.51 0.00 0.00 179.97 180.90 2jcc h TYR 171 N 0.50 0.84 0.00 2.20 0.05 -0.24 -2.17 116.97 118.15 2jcc h TYR 171 Ca 0.02 -0.31 -0.03 0.00 0.05 0.00 0.00 58.73 58.45 2jcc h TYR 171 Cb 1.08 -0.15 -0.00 0.00 1.01 0.00 0.00 36.73 38.66 2jcc h TYR 171 CO 0.05 1.08 -0.16 -0.07 -1.05 0.00 0.00 178.16 178.02 2jcc h LEU 172 N 0.36 0.00 0.14 3.88 3.38 -1.23 0.34 115.31 122.18 2jcc h LEU 172 Ca 0.00 0.00 -0.28 0.00 0.09 0.00 0.00 57.88 57.69 2jcc h LEU 172 Cb 1.05 0.00 0.03 0.00 0.09 0.00 0.00 40.66 41.83 2jcc h LEU 172 CO 0.10 0.16 -1.20 -0.33 0.09 0.00 0.00 178.44 177.26 2jcc h GLU 173 N 0.00 0.56 0.15 1.13 4.39 -1.43 -2.89 114.58 116.49 2jcc h GLU 173 Ca -0.00 -0.79 -0.29 0.00 0.34 0.00 0.00 59.36 58.61 2jcc h GLU 173 Cb 0.30 0.27 0.02 0.00 -0.10 0.00 0.00 28.75 29.24 2jcc h GLU 173 CO 0.02 1.36 -1.27 -0.91 -1.16 0.00 0.00 179.01 177.05 2jcc h ASN 174 N 0.14 0.70 -0.54 1.42 2.35 -1.13 -3.19 115.58 115.33 2jcc h ASN 174 Ca -0.19 -0.69 -0.22 0.00 -0.55 0.00 0.00 56.30 54.65 2jcc h ASN 174 Cb 1.89 -0.22 -0.13 0.00 0.05 0.00 0.00 38.32 39.91 2jcc h ASN 174 CO 0.23 1.52 0.27 0.61 -1.65 0.00 0.00 177.43 178.41 2jcc n GLY 175 N 1.46 3.18 0.32 2.83 0.00 0.12 -4.69 105.19 108.41 2jcc n GLY 175 Ca -0.12 -0.65 -0.02 0.00 0.00 0.00 0.00 46.02 45.23 2jcc n GLY 175 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 2jcc h LYS 176 N 1.25 -0.08 -0.88 1.61 3.64 -1.50 0.17 116.57 120.77 2jcc h LYS 176 Ca 0.27 0.01 0.23 0.00 -1.27 0.00 0.00 60.65 59.88 2jcc h LYS 176 Cb 1.93 0.02 -0.05 0.00 -0.41 0.00 0.00 32.23 33.71 2jcc h LYS 176 CO 0.57 -0.05 0.61 1.05 -2.27 0.00 0.00 179.45 179.35 2jcc h GLU 177 N -0.08 0.20 0.00 1.90 9.09 -1.88 -1.81 114.58 122.01 2jcc h GLU 177 Ca 0.30 -0.01 -0.29 0.00 0.05 0.00 0.00 59.36 59.41 2jcc h GLU 177 Cb 0.56 -0.05 -0.05 0.00 -1.65 0.00 0.00 28.75 27.56 2jcc h GLU 177 CO -0.75 0.13 -2.06 2.41 0.05 0.00 0.00 179.01 178.79 2jcc n THR 178 N -4.41 1.06 0.05 -1.06 -1.04 -0.16 -4.46 114.28 104.26 2jcc n THR 178 Ca 0.19 -0.38 -0.01 0.00 -2.04 0.00 0.00 64.05 61.81 2jcc n THR 178 Cb 0.82 -1.27 -0.07 0.00 -1.82 0.00 0.00 70.33 67.98 2jcc n THR 178 CO 0.00 0.00 0.00 -0.07 -0.64 0.00 0.00 175.07 174.36 2jcc h LEU 179 N -0.14 0.00 -2.34 -4.42 3.38 -0.75 -3.31 115.31 107.73 2jcc h LEU 179 Ca -0.43 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.54 2jcc h LEU 179 Cb 1.60 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.35 2jcc h LEU 179 CO -0.11 0.61 0.00 0.00 0.09 0.00 0.00 178.44 179.03 2jcc n GLN 180 N -2.97 2.48 -3.10 1.13 6.02 -0.68 -4.95 117.38 115.32 2jcc n GLN 180 Ca -0.08 -2.29 -0.33 0.00 -0.01 0.00 0.00 57.00 54.29 2jcc n GLN 180 Cb 0.84 -1.51 -0.06 0.00 1.02 0.00 0.00 30.24 30.53 2jcc n GLN 180 CO 0.00 0.00 0.00 -0.98 -1.01 0.00 0.00 177.06 175.07 2jcc s ARG 181 N -1.24 4.06 -0.16 -1.09 1.70 -1.25 -4.99 118.95 115.98 2jcc s ARG 181 Ca 0.42 0.74 0.01 0.00 -0.47 0.00 0.00 55.73 56.43 2jcc s ARG 181 Cb 0.23 -2.46 0.02 0.00 -0.57 0.00 0.00 34.95 32.17 2jcc s ARG 181 CO 0.30 0.16 -0.15 0.95 -1.08 0.00 0.00 175.30 175.49 2jcc s THR 182 N -1.95 1.68 -0.37 4.99 -4.23 -1.26 -4.58 115.64 109.91 2jcc s THR 182 Ca 0.54 -0.73 -0.13 0.00 -1.18 0.00 0.00 61.69 60.20 2jcc s THR 182 Cb -0.11 -1.57 0.01 0.00 1.34 0.00 0.00 72.50 72.17 2jcc s THR 182 CO 0.17 0.45 0.24 -1.81 -0.54 0.00 0.00 174.62 173.14 2jcc s ASP 183 N 1.44 5.93 0.38 3.99 1.01 -0.06 -4.89 116.67 124.46 2jcc s ASP 183 Ca 0.05 -0.75 -0.28 0.00 0.71 0.00 0.00 52.55 52.28 2jcc s ASP 183 Cb -0.13 -2.10 -0.11 0.00 1.01 0.00 0.00 42.92 41.59 2jcc s ASP 183 CO -0.11 -0.34 1.48 0.00 0.21 0.00 0.00 175.17 176.40 2jcc s ALA 184 N 1.65 3.56 0.50 5.23 0.00 -1.26 -2.07 121.76 129.36 2jcc s ALA 184 Ca 0.04 1.56 -0.22 0.00 0.00 0.00 0.00 51.96 53.34 2jcc s ALA 184 Cb -0.18 -3.60 -0.06 0.00 0.00 0.00 0.00 23.12 19.27 2jcc s ALA 184 CO 0.09 -1.05 1.21 -1.25 0.00 0.00 0.00 175.76 174.76 2jcc s PRO 185 N -2.10 3.52 -0.23 0.00 0.04 -1.26 -4.54 135.00 130.43 2jcc s PRO 185 Ca 0.53 1.86 -0.13 0.00 0.04 0.00 0.00 61.00 63.29 2jcc s PRO 185 Cb -0.46 -2.29 -0.04 0.00 0.04 0.00 0.00 34.50 31.74 2jcc s PRO 185 CO 0.62 -0.77 0.29 0.15 0.04 0.00 0.00 177.00 177.34 2jcc s LYS 186 N -2.85 4.10 0.07 4.56 1.02 0.51 -4.85 119.74 122.30 2jcc s LYS 186 Ca 0.67 -0.02 0.10 0.00 0.02 0.00 0.00 55.97 56.74 2jcc s LYS 186 Cb -0.31 -3.56 -0.03 0.00 -0.52 0.00 0.00 37.83 33.41 2jcc s LYS 186 CO 0.36 -0.04 -0.26 0.95 -0.92 0.00 0.00 175.35 175.45 2jcc s THR 187 N 1.33 2.20 0.28 2.17 -4.23 -1.26 -1.00 115.64 115.13 2jcc s THR 187 Ca 0.14 -1.47 -0.17 0.00 -1.18 0.00 0.00 61.69 59.00 2jcc s THR 187 Cb -0.14 -1.89 0.01 0.00 1.34 0.00 0.00 72.50 71.82 2jcc s THR 187 CO 0.07 0.30 0.64 -1.38 -0.54 0.00 0.00 174.62 173.70 2jcc s HIS 188 N -0.87 0.06 0.14 3.99 -3.43 -1.09 -5.01 115.29 109.08 2jcc s HIS 188 Ca 0.12 -0.50 0.10 0.00 -0.80 0.00 0.00 55.06 53.98 2jcc s HIS 188 Cb -0.10 0.52 -0.04 0.00 -1.43 0.00 0.00 32.58 31.53 2jcc s HIS 188 CO 0.03 -1.18 -0.24 1.41 -2.00 0.00 0.00 174.74 172.76 2jcc s MET 189 N -3.78 1.35 0.07 -0.38 1.75 -1.26 -1.21 119.30 115.83 2jcc s MET 189 Ca 0.16 -1.35 0.06 0.00 -1.25 0.00 0.00 55.69 53.31 2jcc s MET 189 Cb -0.04 -1.72 -0.03 0.00 2.84 0.00 0.00 34.83 35.88 2jcc s MET 189 CO 0.09 0.39 -0.16 0.95 -0.65 0.00 0.00 175.02 175.64 2jcc s THR 190 N -1.30 1.29 -0.06 10.11 -4.23 -0.25 -4.99 115.64 116.22 2jcc s THR 190 Ca 0.14 -1.30 0.05 0.00 -1.18 0.00 0.00 61.69 59.40 2jcc s THR 190 Cb -0.09 -1.20 -0.01 0.00 1.34 0.00 0.00 72.50 72.54 2jcc s THR 190 CO 0.06 -0.12 -0.23 -2.28 -0.54 0.00 0.00 174.62 171.52 2jcc s HIS 191 N -1.14 2.28 -0.03 3.99 2.46 -1.26 -1.17 115.29 120.41 2jcc s HIS 191 Ca 0.01 -0.71 -0.01 0.00 0.47 0.00 0.00 55.06 54.83 2jcc s HIS 191 Cb -0.10 -1.51 0.03 0.00 -0.13 0.00 0.00 32.58 30.88 2jcc s HIS 191 CO 0.03 -0.23 0.03 -1.01 -2.47 0.00 0.00 174.74 171.08 2jcc s HIS 192 N -0.05 0.18 -0.51 3.88 3.76 -0.55 -5.01 115.29 117.00 2jcc s HIS 192 Ca -0.06 0.10 -0.29 0.00 -0.15 0.00 0.00 55.06 54.67 2jcc s HIS 192 Cb -0.14 -0.41 0.03 0.00 1.11 0.00 0.00 32.58 33.17 2jcc s HIS 192 CO 0.04 -0.15 1.18 0.00 -0.85 0.00 0.00 174.74 174.95 2jcc s ALA 193 N 1.46 3.09 0.01 -1.40 0.00 -1.26 0.38 121.76 124.05 2jcc s ALA 193 Ca -0.04 -0.57 -0.19 0.00 0.00 0.00 0.00 51.96 51.17 2jcc s ALA 193 Cb -0.13 -3.95 -0.25 0.00 0.00 0.00 0.00 23.12 18.80 2jcc s ALA 193 CO -0.03 -2.41 1.09 -0.39 0.00 0.00 0.00 175.76 174.03 2jcc h VAL 194 N 6.23 1.40 -1.99 0.00 -1.51 -1.79 -3.48 116.25 115.11 2jcc h VAL 194 Ca -0.24 -2.18 0.00 0.00 -1.23 0.00 0.00 66.70 63.05 2jcc h VAL 194 Cb 1.06 2.63 0.00 0.00 -2.13 0.00 0.00 31.29 32.86 2jcc h VAL 194 CO 1.15 0.64 0.00 -0.24 -1.23 0.00 0.00 177.57 177.89 2jcc n SER 195 N -4.12 0.22 0.09 4.19 2.88 -0.91 -5.00 113.62 110.97 2jcc n SER 195 Ca -0.11 -0.78 -0.06 0.00 -1.33 0.00 0.00 58.87 56.59 2jcc n SER 195 Cb 0.74 0.00 0.01 0.00 -0.75 0.00 0.00 64.21 64.21 2jcc n SER 195 CO 0.00 0.00 0.00 -0.78 -1.23 0.00 0.00 175.04 173.03 2jcc h ASP 196 N 0.00 0.12 -0.24 -3.46 3.58 -2.03 -3.29 116.42 111.09 2jcc h ASP 196 Ca 0.00 -0.10 0.00 0.00 0.42 0.00 0.00 57.03 57.35 2jcc h ASP 196 Cb 0.00 -0.04 0.00 0.00 1.72 0.00 0.00 39.33 41.01 2jcc h ASP 196 CO 0.00 0.90 0.00 1.57 -2.88 0.00 0.00 179.24 178.83 2jcc n HIS 197 N -3.62 0.32 -4.03 0.28 -0.00 -1.26 -4.83 115.22 102.08 2jcc n HIS 197 Ca -0.02 -0.37 -0.11 0.00 0.46 0.00 0.00 57.72 57.69 2jcc n HIS 197 Cb 0.79 -0.02 -0.11 0.00 -0.12 0.00 0.00 29.99 30.53 2jcc n HIS 197 CO 0.00 0.00 0.00 -1.21 0.46 0.00 0.00 176.34 175.59 2jcc s GLU 198 N -0.97 0.45 -0.09 1.57 2.02 -1.24 -1.19 118.70 119.26 2jcc s GLU 198 Ca 0.19 -0.75 -0.16 0.00 0.02 0.00 0.00 54.97 54.28 2jcc s GLU 198 Cb 0.11 -0.07 0.03 0.00 0.10 0.00 0.00 34.13 34.31 2jcc s GLU 198 CO 0.14 -0.01 0.38 0.00 0.02 0.00 0.00 175.26 175.80 2jcc s ALA 199 N -1.69 -0.97 -0.20 5.21 0.00 0.85 -2.13 121.76 122.84 2jcc s ALA 199 Ca -0.11 0.81 -0.09 0.00 0.00 0.00 0.00 51.96 52.57 2jcc s ALA 199 Cb -0.08 -0.30 -0.05 0.00 0.00 0.00 0.00 23.12 22.69 2jcc s ALA 199 CO -0.01 -0.23 0.11 0.99 0.00 0.00 0.00 175.76 176.61 2jcc s THR 200 N -0.54 5.22 -0.22 0.00 2.01 0.16 0.33 115.64 122.60 2jcc s THR 200 Ca -0.06 0.12 -0.07 0.00 0.31 0.00 0.00 61.69 61.99 2jcc s THR 200 Cb -0.04 -3.37 -0.03 0.00 0.01 0.00 0.00 72.50 69.07 2jcc s THR 200 CO 0.03 0.44 0.06 -0.76 -0.69 0.00 0.00 174.62 173.70 2jcc s LEU 201 N 0.38 3.55 -0.16 4.42 1.02 -0.40 -1.48 118.68 126.01 2jcc s LEU 201 Ca 0.06 -0.10 0.02 0.00 0.02 0.00 0.00 54.13 54.13 2jcc s LEU 201 Cb -0.11 -1.92 0.01 0.00 0.02 0.00 0.00 46.19 44.18 2jcc s LEU 201 CO -0.01 0.06 -0.20 -0.60 0.02 0.00 0.00 176.35 175.61 2jcc s ARG 202 N 1.07 3.03 -0.26 1.70 3.52 -0.32 -1.55 118.95 126.14 2jcc s ARG 202 Ca 0.04 -0.83 -0.11 0.00 -0.13 0.00 0.00 55.73 54.70 2jcc s ARG 202 Cb -0.14 -2.52 -0.05 0.00 -1.56 0.00 0.00 34.95 30.68 2jcc s ARG 202 CO 0.03 -0.10 0.19 0.00 -0.81 0.00 0.00 175.30 174.61 2jcc s TRP 204 N 1.52 3.04 -0.15 0.00 0.52 -0.35 -1.48 118.94 122.04 2jcc s TRP 204 Ca 0.08 -0.25 -0.00 0.00 0.02 0.00 0.00 56.10 55.95 2jcc s TRP 204 Cb -0.15 -1.95 -0.01 0.00 -1.15 0.00 0.00 33.47 30.22 2jcc s TRP 204 CO 0.09 0.01 -0.14 0.00 0.02 0.00 0.00 176.95 176.93 2jcc s ALA 205 N 0.26 2.56 0.10 0.98 0.00 0.82 -2.67 121.76 123.81 2jcc s ALA 205 Ca -0.03 -0.99 0.02 0.00 0.00 0.00 0.00 51.96 50.97 2jcc s ALA 205 Cb -0.14 -1.25 -0.04 0.00 0.00 0.00 0.00 23.12 21.69 2jcc s ALA 205 CO 0.03 0.06 -0.08 -0.51 0.00 0.00 0.00 175.76 175.26 2jcc s LEU 206 N 0.67 2.49 -1.44 0.00 1.43 -0.17 -0.78 118.68 120.88 2jcc s LEU 206 Ca -0.07 -0.96 -0.13 0.00 -1.03 0.00 0.00 54.13 51.94 2jcc s LEU 206 Cb -0.16 -0.15 0.11 0.00 0.03 0.00 0.00 46.19 46.02 2jcc s LEU 206 CO 0.02 -0.40 0.63 -1.20 0.23 0.00 0.00 176.35 175.63 2jcc n SER 207 N 0.10 -3.55 -4.90 2.29 7.64 -1.11 -0.36 113.62 113.73 2jcc n SER 207 Ca -0.13 -0.65 -0.28 0.00 1.01 0.00 0.00 58.87 58.83 2jcc n SER 207 Cb 0.60 -2.92 -0.04 0.00 -1.01 0.00 0.00 64.21 60.84 2jcc n SER 207 CO 0.00 0.00 0.00 0.72 -3.01 0.00 0.00 175.04 172.75 2jcc s PHE 208 N -3.07 3.40 -0.15 1.43 -0.12 -0.97 -4.67 117.98 113.84 2jcc s PHE 208 Ca 0.55 0.12 -0.13 0.00 -0.05 0.00 0.00 56.93 57.43 2jcc s PHE 208 Cb -0.30 -1.66 0.04 0.00 -0.63 0.00 0.00 43.02 40.48 2jcc s PHE 208 CO 0.68 0.54 0.40 -0.47 -0.05 0.00 0.00 175.22 176.31 2jcc s TYR 209 N -1.65 -0.47 1.09 3.49 6.14 -0.88 0.18 117.35 125.25 2jcc s TYR 209 Ca 0.33 1.12 -0.18 0.00 0.64 0.00 0.00 57.07 58.98 2jcc s TYR 209 Cb -0.11 0.17 0.25 0.00 0.42 0.00 0.00 41.96 42.69 2jcc s TYR 209 CO 0.27 -0.24 1.23 -1.25 0.64 0.00 0.00 175.55 176.20 2jcc s PRO 210 N 0.50 -0.37 0.53 4.97 0.04 -1.26 -0.88 135.00 138.53 2jcc s PRO 210 Ca -0.02 -0.31 0.35 0.00 0.04 0.00 0.00 61.00 61.05 2jcc s PRO 210 Cb -0.04 -1.72 1.59 0.00 0.04 0.00 0.00 34.50 34.37 2jcc s PRO 210 CO -0.03 -3.10 2.04 0.00 0.04 0.00 0.00 177.00 175.95 2jcc h ALA 211 N -2.14 1.00 -1.92 8.56 0.00 -1.96 -3.44 119.26 119.36 2jcc h ALA 211 Ca -0.44 0.00 -0.57 0.00 0.00 0.00 0.00 54.91 53.90 2jcc h ALA 211 Cb 1.25 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 19.01 2jcc h ALA 211 CO 0.33 0.00 1.18 -1.21 0.00 0.00 0.00 179.25 179.55 2jcc s GLU 212 N -3.74 3.56 0.02 0.00 8.01 -1.26 -4.97 118.70 120.32 2jcc s GLU 212 Ca -0.00 1.43 -0.05 0.00 0.01 0.00 0.00 54.97 56.36 2jcc s GLU 212 Cb 0.10 -4.10 -0.01 0.00 -4.31 0.00 0.00 34.13 25.81 2jcc s GLU 212 CO 0.47 -1.58 0.07 -1.50 0.01 0.00 0.00 175.26 172.74 2jcc s ILE 213 N 5.94 0.10 -0.11 -1.63 2.07 -1.26 -4.61 121.20 121.71 2jcc s ILE 213 Ca 0.73 -0.87 0.02 0.00 -1.41 0.00 0.00 60.65 59.13 2jcc s ILE 213 Cb -0.22 -0.50 0.01 0.00 0.13 0.00 0.00 42.46 41.89 2jcc s ILE 213 CO 0.32 -0.48 -0.17 -0.89 -1.91 0.00 0.00 174.94 171.81 2jcc s THR 214 N -1.71 1.61 -0.15 4.00 2.01 -0.45 -5.00 115.64 115.94 2jcc s THR 214 Ca -0.13 -0.72 0.02 0.00 0.31 0.00 0.00 61.69 61.17 2jcc s THR 214 Cb -0.07 -1.46 0.01 0.00 0.01 0.00 0.00 72.50 71.00 2jcc s THR 214 CO -0.01 0.46 -0.20 -0.76 -0.69 0.00 0.00 174.62 173.42 2jcc s LEU 215 N 0.90 2.06 -0.02 4.42 1.43 -1.26 -1.11 118.68 125.10 2jcc s LEU 215 Ca -0.08 -0.60 0.02 0.00 -1.03 0.00 0.00 54.13 52.44 2jcc s LEU 215 Cb -0.15 -1.41 0.01 0.00 0.03 0.00 0.00 46.19 44.66 2jcc s LEU 215 CO -0.01 0.04 -0.06 0.28 0.23 0.00 0.00 176.35 176.84 2jcc s THR 216 N 1.03 0.54 0.23 5.49 -1.32 -0.51 -4.98 115.64 116.12 2jcc s THR 216 Ca -0.02 -0.20 -0.09 0.00 -1.21 0.00 0.00 61.69 60.16 2jcc s THR 216 Cb -0.14 -0.51 -0.07 0.00 -1.51 0.00 0.00 72.50 70.27 2jcc s THR 216 CO -0.06 0.19 0.54 0.26 -2.21 0.00 0.00 174.62 173.34 2jcc s TRP 217 N 0.39 3.43 -0.02 9.09 0.52 -1.26 -0.55 118.94 130.54 2jcc s TRP 217 Ca -0.05 0.85 -0.00 0.00 0.02 0.00 0.00 56.10 56.92 2jcc s TRP 217 Cb -0.09 -2.24 0.02 0.00 -1.15 0.00 0.00 33.47 30.01 2jcc s TRP 217 CO 0.00 0.27 0.03 -0.65 0.02 0.00 0.00 176.95 176.62 2jcc s GLN 218 N -2.83 -0.01 -0.23 4.98 -0.21 0.40 -1.30 119.66 120.46 2jcc s GLN 218 Ca 0.47 0.13 -0.02 0.00 0.02 0.00 0.00 55.36 55.96 2jcc s GLN 218 Cb -0.11 -0.13 0.02 0.00 1.00 0.00 0.00 33.01 33.78 2jcc s GLN 218 CO 0.22 -0.10 -0.07 0.50 -2.12 0.00 0.00 175.29 173.72 2jcc s ARG 219 N 0.62 2.98 -1.62 2.91 3.52 -1.19 -0.08 118.95 126.09 2jcc s ARG 219 Ca -0.05 -0.88 -0.03 0.00 -0.13 0.00 0.00 55.73 54.64 2jcc s ARG 219 Cb -0.07 -2.95 0.00 0.00 -1.56 0.00 0.00 34.95 30.37 2jcc s ARG 219 CO -0.02 -0.33 0.45 -0.25 -0.81 0.00 0.00 175.30 174.34 2jcc n ASP 220 N 4.70 -6.11 -0.02 -2.12 9.92 -0.73 -2.17 116.55 120.02 2jcc n ASP 220 Ca -0.17 -0.22 -0.00 0.00 -0.53 0.00 0.00 54.79 53.87 2jcc n ASP 220 Cb 0.48 -4.97 -0.00 0.00 -0.64 0.00 0.00 41.12 35.99 2jcc n ASP 220 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 2jcc n GLY 221 N -1.40 0.42 3.86 0.44 0.00 -1.26 -5.05 105.19 102.20 2jcc n GLY 221 Ca -0.15 -0.82 -0.23 0.00 0.00 0.00 0.00 46.02 44.82 2jcc n GLY 221 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2jcc s GLU 222 N -1.53 2.38 -0.22 1.61 0.41 -0.92 -5.10 118.70 115.33 2jcc s GLU 222 Ca 0.00 -1.74 -0.16 0.00 -0.41 0.00 0.00 54.97 52.66 2jcc s GLU 222 Cb 0.00 -2.22 -0.04 0.00 -1.78 0.00 0.00 34.13 30.09 2jcc s GLU 222 CO 0.00 -0.30 0.40 0.16 -0.49 0.00 0.00 175.26 175.03 2jcc s ASP 223 N -4.13 6.39 -0.87 -0.19 -4.77 -1.26 -3.16 116.67 108.68 2jcc s ASP 223 Ca 0.43 0.46 -0.09 0.00 -3.30 0.00 0.00 52.55 50.05 2jcc s ASP 223 Cb -0.01 -2.23 0.22 0.00 -1.09 0.00 0.00 42.92 39.81 2jcc s ASP 223 CO 0.25 -0.13 0.80 -1.10 0.70 0.00 0.00 175.17 175.70 2jcc s GLN 224 N 1.60 3.55 -0.15 2.11 -1.52 -0.42 -4.77 119.66 120.05 2jcc s GLN 224 Ca 0.18 -2.76 0.17 0.00 -1.95 0.00 0.00 55.36 51.00 2jcc s GLN 224 Cb -0.15 -4.29 0.76 0.00 -0.22 0.00 0.00 33.01 29.11 2jcc s GLN 224 CO 0.08 -1.26 1.67 2.41 -0.25 0.00 0.00 175.29 177.95 2jcc n THR 225 N 3.37 2.12 -3.96 -0.19 -1.04 -1.26 -4.46 114.28 108.87 2jcc n THR 225 Ca 0.16 -1.24 -0.31 0.00 -2.04 0.00 0.00 64.05 60.62 2jcc n THR 225 Cb 0.42 -0.01 -0.15 0.00 -1.82 0.00 0.00 70.33 68.77 2jcc n THR 225 CO 0.00 0.00 0.00 -1.58 -0.64 0.00 0.00 175.07 172.85 2jcc s GLN 226 N -2.14 1.43 0.00 -2.82 0.74 -1.26 -4.47 119.66 111.14 2jcc s GLN 226 Ca 0.52 -1.52 0.00 0.00 0.05 0.00 0.00 55.36 54.41 2jcc s GLN 226 Cb 0.36 -2.83 0.00 0.00 1.10 0.00 0.00 33.01 31.63 2jcc s GLN 226 CO 0.22 -0.85 0.00 -3.47 -0.55 0.00 0.00 175.29 170.63 2jcc n ASP 227 N 4.46 0.00 -4.79 6.67 -0.08 -1.26 -5.01 116.55 116.54 2jcc n ASP 227 Ca -0.02 0.00 -0.39 0.00 -1.51 0.00 0.00 54.79 52.88 2jcc n ASP 227 Cb 0.42 0.00 -0.06 0.00 2.34 0.00 0.00 41.12 43.82 2jcc n ASP 227 CO 0.00 0.00 0.00 -0.89 0.12 0.00 0.00 177.20 176.43 2jcc s THR 228 N -2.00 4.50 -0.10 5.18 2.01 -1.26 -3.47 115.64 120.50 2jcc s THR 228 Ca 0.00 1.50 0.04 0.00 0.31 0.00 0.00 61.69 63.54 2jcc s THR 228 Cb 0.00 -4.02 0.00 0.00 0.01 0.00 0.00 72.50 68.49 2jcc s THR 228 CO 0.00 0.47 -0.24 -0.70 -0.69 0.00 0.00 174.62 173.46 2jcc s GLU 229 N -1.31 3.05 -0.07 4.92 2.12 -0.72 -4.99 118.70 121.70 2jcc s GLU 229 Ca 0.35 -0.88 0.03 0.00 0.36 0.00 0.00 54.97 54.84 2jcc s GLU 229 Cb -0.21 -2.31 0.01 0.00 0.26 0.00 0.00 34.13 31.88 2jcc s GLU 229 CO 0.23 0.17 -0.15 -1.17 -0.54 0.00 0.00 175.26 173.80 2jcc s LEU 230 N 0.38 1.75 0.25 2.70 2.96 -1.26 0.01 118.68 125.47 2jcc s LEU 230 Ca -0.18 -0.35 -0.01 0.00 -0.22 0.00 0.00 54.13 53.36 2jcc s LEU 230 Cb -0.18 -0.95 -0.04 0.00 0.50 0.00 0.00 46.19 45.52 2jcc s LEU 230 CO 0.08 0.07 0.46 0.68 -1.32 0.00 0.00 176.35 176.31 2jcc s VAL 231 N 0.55 5.15 0.17 1.68 -7.23 -0.96 -5.04 120.40 114.72 2jcc s VAL 231 Ca -0.15 -0.32 -0.32 0.00 -1.81 0.00 0.00 61.98 59.39 2jcc s VAL 231 Cb -0.16 -3.76 -0.12 0.00 0.56 0.00 0.00 36.38 32.90 2jcc s VAL 231 CO 0.05 -0.29 1.75 1.21 -0.31 0.00 0.00 175.10 177.51 2jcc n GLU 232 N -0.97 2.72 -1.62 4.82 4.07 -1.26 -4.68 120.64 123.72 2jcc n GLU 232 Ca -0.04 0.99 -0.48 0.00 -0.06 0.00 0.00 57.16 57.57 2jcc n GLU 232 Cb 0.54 -2.84 -0.04 0.00 -0.06 0.00 0.00 31.44 29.04 2jcc n GLU 232 CO 0.00 0.00 0.00 2.41 -0.06 0.00 0.00 177.13 179.48 2jcc n THR 233 N 4.18 0.73 -4.39 6.31 -1.04 -1.26 -4.90 114.28 113.91 2jcc n THR 233 Ca 0.17 -0.18 -0.22 0.00 -2.04 0.00 0.00 64.05 61.78 2jcc n THR 233 Cb 0.35 -1.11 -0.13 0.00 -1.82 0.00 0.00 70.33 67.62 2jcc n THR 233 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2jcc s ARG 234 N -0.17 1.08 0.17 -2.82 1.70 -0.13 -4.97 118.95 113.81 2jcc s ARG 234 Ca 0.73 -0.93 -0.30 0.00 -0.47 0.00 0.00 55.73 54.76 2jcc s ARG 234 Cb -0.78 -1.18 -0.07 0.00 -0.57 0.00 0.00 34.95 32.35 2jcc s ARG 234 CO 0.49 0.29 1.01 -1.25 -1.08 0.00 0.00 175.30 174.76 2jcc s PRO 235 N -1.42 4.69 0.19 3.89 0.04 -1.26 -0.45 135.00 140.68 2jcc s PRO 235 Ca 0.04 1.57 0.09 0.00 0.04 0.00 0.00 61.00 62.73 2jcc s PRO 235 Cb -0.09 -3.31 0.06 0.00 0.04 0.00 0.00 34.50 31.19 2jcc s PRO 235 CO 0.02 0.23 1.44 0.00 0.04 0.00 0.00 177.00 178.73 2jcc h ALA 236 N 5.03 0.65 0.00 8.56 0.00 -1.58 -3.46 119.26 128.45 2jcc h ALA 236 Ca -0.44 -0.74 0.00 0.00 0.00 0.00 0.00 54.91 53.73 2jcc h ALA 236 Cb 1.21 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.87 2jcc h ALA 236 CO 0.71 1.02 0.00 0.41 0.00 0.00 0.00 179.25 181.39 2jcc n GLY 237 N 0.83 0.85 1.22 0.00 0.00 -1.26 -4.97 105.19 101.86 2jcc n GLY 237 Ca -0.01 0.00 0.04 0.00 0.00 0.00 0.00 46.02 46.06 2jcc n GLY 237 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2jcc n ASP 238 N 0.00 1.16 0.00 1.61 5.75 -1.26 -4.98 116.55 118.84 2jcc n ASP 238 Ca 0.00 -2.50 0.00 0.00 -0.01 0.00 0.00 54.79 52.28 2jcc n ASP 238 Cb 0.00 -0.36 0.00 0.00 -1.03 0.00 0.00 41.12 39.73 2jcc n ASP 238 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2jcc n GLY 239 N 0.05 0.68 3.78 6.12 0.00 -1.26 -5.03 105.19 109.53 2jcc n GLY 239 Ca 0.09 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.89 2jcc n GLY 239 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2jcc s THR 240 N -2.80 3.31 0.25 2.61 -4.23 -1.26 -4.75 115.64 108.76 2jcc s THR 240 Ca 0.00 -1.55 0.12 0.00 -1.18 0.00 0.00 61.69 59.07 2jcc s THR 240 Cb 0.00 -3.08 -0.05 0.00 1.34 0.00 0.00 72.50 70.71 2jcc s THR 240 CO 0.00 -0.19 -0.21 -0.36 -0.54 0.00 0.00 174.62 173.32 2jcc s PHE 241 N -2.36 2.26 0.04 3.99 0.40 0.49 -1.44 117.98 121.36 2jcc s PHE 241 Ca 0.39 -0.35 0.06 0.00 -0.60 0.00 0.00 56.93 56.42 2jcc s PHE 241 Cb -0.04 -1.03 -0.02 0.00 0.51 0.00 0.00 43.02 42.44 2jcc s PHE 241 CO 0.24 0.63 -0.16 -0.65 0.70 0.00 0.00 175.22 175.99 2jcc s GLN 242 N -3.25 1.09 -0.03 0.44 -0.21 0.41 -2.28 119.66 115.82 2jcc s GLN 242 Ca 0.27 -0.80 -0.17 0.00 0.02 0.00 0.00 55.36 54.68 2jcc s GLN 242 Cb -0.06 -1.13 0.03 0.00 1.00 0.00 0.00 33.01 32.85 2jcc s GLN 242 CO 0.13 0.28 0.36 0.21 -2.12 0.00 0.00 175.29 174.15 2jcc s LYS 243 N -1.11 0.70 0.13 2.91 2.20 0.04 -0.96 119.74 123.65 2jcc s LYS 243 Ca 0.04 -0.08 0.03 0.00 -0.36 0.00 0.00 55.97 55.60 2jcc s LYS 243 Cb -0.08 0.31 -0.04 0.00 -1.51 0.00 0.00 37.83 36.51 2jcc s LYS 243 CO 0.01 -0.19 -0.08 1.67 -0.36 0.00 0.00 175.35 176.40 2jcc s TRP 244 N -1.19 1.15 -0.02 4.03 1.48 -1.26 -0.13 118.94 123.01 2jcc s TRP 244 Ca -0.12 -0.82 0.00 0.00 -1.06 0.00 0.00 56.10 54.10 2jcc s TRP 244 Cb -0.04 -0.61 0.03 0.00 -1.16 0.00 0.00 33.47 31.68 2jcc s TRP 244 CO 0.05 -0.01 0.03 0.00 -4.06 0.00 0.00 176.95 172.96 2jcc s ALA 245 N -3.44 0.08 0.28 2.67 0.00 -0.55 -2.28 121.76 118.53 2jcc s ALA 245 Ca 0.16 0.27 0.11 0.00 0.00 0.00 0.00 51.96 52.49 2jcc s ALA 245 Cb 0.04 -0.22 -0.05 0.00 0.00 0.00 0.00 23.12 22.88 2jcc s ALA 245 CO -0.01 -0.10 -0.09 0.00 0.00 0.00 0.00 175.76 175.56 2jcc s ALA 246 N 0.95 2.97 -0.16 0.00 0.00 0.10 -0.53 121.76 125.09 2jcc s ALA 246 Ca -0.08 -1.77 -0.13 0.00 0.00 0.00 0.00 51.96 49.98 2jcc s ALA 246 Cb -0.12 -0.51 0.05 0.00 0.00 0.00 0.00 23.12 22.54 2jcc s ALA 246 CO -0.03 0.26 0.41 0.54 0.00 0.00 0.00 175.76 176.95 2jcc s VAL 247 N -2.42 -0.01 -0.30 0.00 0.11 -0.60 -1.76 120.40 115.43 2jcc s VAL 247 Ca 0.31 0.03 -0.16 0.00 -2.93 0.00 0.00 61.98 59.23 2jcc s VAL 247 Cb -0.05 -0.59 -0.03 0.00 -1.53 0.00 0.00 36.38 34.18 2jcc s VAL 247 CO 0.18 0.01 0.40 -0.69 -3.33 0.00 0.00 175.10 171.67 2jcc s VAL 248 N 0.58 5.14 -0.03 2.04 1.01 -1.23 -1.27 120.40 126.64 2jcc s VAL 248 Ca -0.03 0.43 0.06 0.00 0.00 0.00 0.00 61.98 62.44 2jcc s VAL 248 Cb -0.05 -3.77 -0.01 0.00 0.00 0.00 0.00 36.38 32.55 2jcc s VAL 248 CO -0.03 0.04 -0.20 -0.69 0.00 0.00 0.00 175.10 174.21 2jcc s VAL 249 N 2.12 1.65 0.24 2.92 1.01 0.15 -4.95 120.40 123.54 2jcc s VAL 249 Ca 0.15 -0.86 -0.31 0.00 0.00 0.00 0.00 61.98 60.95 2jcc s VAL 249 Cb -0.16 -1.39 -0.12 0.00 0.00 0.00 0.00 36.38 34.71 2jcc s VAL 249 CO 0.11 0.47 1.62 -2.65 0.00 0.00 0.00 175.10 174.64 2jcc n PRO 250 N 2.84 2.58 -1.68 2.72 -0.02 -1.26 -0.10 135.00 140.08 2jcc n PRO 250 Ca -0.17 0.92 -0.54 0.00 -2.02 0.00 0.00 63.50 61.70 2jcc n PRO 250 Cb 0.53 -2.71 -0.06 0.00 -0.02 0.00 0.00 33.50 31.23 2jcc n PRO 250 CO 0.00 0.00 0.00 0.43 1.98 0.00 0.00 175.50 177.91 2jcc n SER 251 N 2.97 2.47 0.00 2.55 7.64 -0.33 -0.79 113.62 128.12 2jcc n SER 251 Ca 0.13 1.07 0.00 0.00 1.01 0.00 0.00 58.87 61.07 2jcc n SER 251 Cb 0.34 -1.21 0.00 0.00 -1.01 0.00 0.00 64.21 62.33 2jcc n SER 251 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2jcc n GLY 252 N 3.81 0.78 0.89 0.23 0.00 -1.26 -4.92 105.19 104.72 2jcc n GLY 252 Ca 0.23 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.33 2jcc n GLY 252 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2jcc n GLN 253 N -2.00 3.04 -0.36 1.61 6.02 0.03 -4.75 117.38 120.97 2jcc n GLN 253 Ca 0.00 -2.57 0.01 0.00 -0.01 0.00 0.00 57.00 54.43 2jcc n GLN 253 Cb 0.00 -1.65 0.16 0.00 1.02 0.00 0.00 30.24 29.76 2jcc n GLN 253 CO 0.00 0.00 0.00 0.93 -1.01 0.00 0.00 177.06 176.98 2jcc h GLU 254 N 2.14 1.20 0.00 -1.09 3.07 -1.92 -3.02 114.58 114.97 2jcc h GLU 254 Ca 0.00 -0.07 0.00 0.00 -0.50 0.00 0.00 59.36 58.79 2jcc h GLU 254 Cb 1.20 -0.27 0.00 0.00 -0.84 0.00 0.00 28.75 28.84 2jcc h GLU 254 CO 0.15 0.80 0.00 1.04 -1.40 0.00 0.00 179.01 179.60 2jcc n GLN 255 N -4.44 0.15 0.00 2.33 6.02 -1.26 -2.35 117.38 117.83 2jcc n GLN 255 Ca 0.13 0.08 0.14 0.00 -0.01 0.00 0.00 57.00 57.34 2jcc n GLN 255 Cb 0.10 -1.50 0.65 0.00 1.02 0.00 0.00 30.24 30.50 2jcc n GLN 255 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.06 176.59 2jcc n ARG 256 N -1.41 0.15 -4.07 -1.09 1.74 -1.14 -4.83 116.66 106.02 2jcc n ARG 256 Ca 0.08 0.02 -0.35 0.00 -0.77 0.00 0.00 57.85 56.83 2jcc n ARG 256 Cb 0.23 -1.50 -0.09 0.00 -1.02 0.00 0.00 32.46 30.09 2jcc n ARG 256 CO 0.00 0.00 0.00 0.71 -1.52 0.00 0.00 177.63 176.82 2jcc s TYR 257 N -2.84 3.31 0.03 -1.55 1.51 -0.99 -1.78 117.35 115.03 2jcc s TYR 257 Ca 0.19 0.20 0.07 0.00 -1.01 0.00 0.00 57.07 56.52 2jcc s TYR 257 Cb 0.19 -1.97 -0.02 0.00 -0.11 0.00 0.00 41.96 40.04 2jcc s TYR 257 CO 0.48 0.36 -0.21 0.95 -1.11 0.00 0.00 175.55 176.03 2jcc s THR 258 N -0.26 1.70 -0.13 -0.71 -4.23 0.88 -4.38 115.64 108.50 2jcc s THR 258 Ca 0.08 -1.13 -0.06 0.00 -1.18 0.00 0.00 61.69 59.39 2jcc s THR 258 Cb -0.12 -1.46 -0.04 0.00 1.34 0.00 0.00 72.50 72.22 2jcc s THR 258 CO 0.01 0.28 0.10 0.00 -0.54 0.00 0.00 174.62 174.48 2jcc s HIS 260 N -0.58 2.34 -0.27 0.00 3.76 0.29 -0.07 115.29 120.77 2jcc s HIS 260 Ca 0.12 -0.99 0.01 0.00 -0.15 0.00 0.00 55.06 54.04 2jcc s HIS 260 Cb -0.12 -1.59 0.05 0.00 1.11 0.00 0.00 32.58 32.03 2jcc s HIS 260 CO 0.02 -0.43 -0.07 0.08 -0.85 0.00 0.00 174.74 173.50 2jcc s VAL 261 N 0.51 2.52 -0.17 -0.90 1.01 -0.86 -1.42 120.40 121.09 2jcc s VAL 261 Ca -0.16 -1.46 -0.07 0.00 0.00 0.00 0.00 61.98 60.29 2jcc s VAL 261 Cb -0.17 -2.43 -0.04 0.00 0.00 0.00 0.00 36.38 33.74 2jcc s VAL 261 CO 0.06 -0.01 0.08 -1.10 0.00 0.00 0.00 175.10 174.13 2jcc s GLN 262 N 1.18 3.89 -0.05 2.72 -0.21 -0.27 -1.96 119.66 124.97 2jcc s GLN 262 Ca -0.06 -0.30 -0.26 0.00 0.02 0.00 0.00 55.36 54.76 2jcc s GLN 262 Cb -0.19 -3.22 0.05 0.00 1.00 0.00 0.00 33.01 30.65 2jcc s GLN 262 CO -0.04 0.36 0.56 -1.58 -2.12 0.00 0.00 175.29 172.47 2jcc s HIS 263 N 0.13 -0.51 0.46 0.91 2.46 -1.26 -1.35 115.29 116.14 2jcc s HIS 263 Ca 0.06 0.88 0.20 0.00 0.47 0.00 0.00 55.06 56.67 2jcc s HIS 263 Cb -0.12 0.30 1.24 0.00 -0.13 0.00 0.00 32.58 33.88 2jcc s HIS 263 CO 0.00 -0.53 2.06 1.49 -2.47 0.00 0.00 174.74 175.29 2jcc h GLU 264 N 3.37 0.00 -0.15 2.88 4.81 -1.96 -2.36 114.58 121.16 2jcc h GLU 264 Ca -0.28 0.00 -0.09 0.00 -0.13 0.00 0.00 59.36 58.86 2jcc h GLU 264 Cb 1.15 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 30.52 2jcc h GLU 264 CO 0.38 0.13 -0.33 0.78 -0.73 0.00 0.00 179.01 179.24 2jcc h GLY 265 N 0.50 0.32 -4.39 1.92 0.00 -1.88 -3.44 103.07 96.10 2jcc h GLY 265 Ca -0.00 -0.28 -0.53 0.00 0.00 0.00 0.00 47.33 46.53 2jcc h GLY 265 CO 0.02 0.25 0.61 1.08 0.00 0.00 0.00 176.54 178.50 2jcc s LEU 266 N -8.44 4.40 0.32 3.11 1.02 -0.89 -4.69 118.68 113.51 2jcc s LEU 266 Ca -0.05 2.19 0.13 0.00 0.02 0.00 0.00 54.13 56.42 2jcc s LEU 266 Cb 0.14 -3.59 0.52 0.00 0.02 0.00 0.00 46.19 43.28 2jcc s LEU 266 CO 0.77 -0.49 1.69 -0.65 0.02 0.00 0.00 176.35 177.69 2jcc h PRO 267 N 6.23 0.00 -3.89 1.29 0.11 -1.86 -3.45 132.00 130.43 2jcc h PRO 267 Ca -0.43 0.00 -0.13 0.00 0.11 0.00 0.00 66.00 65.55 2jcc h PRO 267 Cb 1.21 0.00 -0.18 0.00 0.11 0.00 0.00 31.00 32.14 2jcc h PRO 267 CO 0.80 0.51 -0.58 0.15 -0.21 0.00 0.00 178.00 178.67 2jcc s LYS 268 N -3.73 0.54 0.32 1.05 1.02 -1.26 -5.14 119.74 112.54 2jcc s LYS 268 Ca -0.01 -0.79 -0.28 0.00 0.02 0.00 0.00 55.97 54.91 2jcc s LYS 268 Cb 0.13 0.20 -0.09 0.00 -0.52 0.00 0.00 37.83 37.55 2jcc s LYS 268 CO 0.73 -0.12 1.16 -2.14 -0.92 0.00 0.00 175.35 174.06 2jcc s PRO 269 N -2.56 4.43 0.39 -1.68 0.02 -1.26 -4.95 135.00 129.38 2jcc s PRO 269 Ca -0.05 1.89 -0.13 0.00 0.02 0.00 0.00 61.00 62.73 2jcc s PRO 269 Cb -0.02 -3.02 -0.08 0.00 0.02 0.00 0.00 34.50 31.40 2jcc s PRO 269 CO -0.05 -0.00 0.78 -0.51 -0.33 0.00 0.00 177.00 176.90 2jcc s LEU 270 N -1.80 3.90 -0.21 -5.54 1.43 -0.83 -4.90 118.68 110.73 2jcc s LEU 270 Ca 0.49 1.24 -0.02 0.00 -1.03 0.00 0.00 54.13 54.81 2jcc s LEU 270 Cb -0.33 -4.10 0.06 0.00 0.03 0.00 0.00 46.19 41.85 2jcc s LEU 270 CO 0.43 -0.35 0.02 -0.89 0.23 0.00 0.00 176.35 175.79 2jcc s THR 271 N -2.25 0.70 -0.17 5.49 2.01 -1.26 -2.03 115.64 118.14 2jcc s THR 271 Ca 0.53 -0.71 -0.05 0.00 0.31 0.00 0.00 61.69 61.77 2jcc s THR 271 Cb -0.10 -1.19 -0.03 0.00 0.01 0.00 0.00 72.50 71.19 2jcc s THR 271 CO 0.26 -0.22 0.01 -0.76 -0.69 0.00 0.00 174.62 173.22 2jcc s LEU 272 N 1.77 3.48 0.08 4.42 1.43 0.90 -4.92 118.68 125.84 2jcc s LEU 272 Ca -0.01 -0.05 0.09 0.00 -1.03 0.00 0.00 54.13 53.13 2jcc s LEU 272 Cb -0.17 -1.86 -0.03 0.00 0.03 0.00 0.00 46.19 44.15 2jcc s LEU 272 CO -0.09 0.16 -0.24 -0.60 0.23 0.00 0.00 176.35 175.82 2jcc s ARG 273 N 0.42 1.42 0.15 1.70 3.52 -1.26 -0.23 118.95 124.66 2jcc s ARG 273 Ca -0.01 -1.13 -0.31 0.00 -0.13 0.00 0.00 55.73 54.14 2jcc s ARG 273 Cb -0.13 -1.68 -0.10 0.00 -1.56 0.00 0.00 34.95 31.48 2jcc s ARG 273 CO 0.02 0.42 1.55 -0.46 -0.81 0.00 0.00 175.30 176.01 2jcc s TRP 274 N -0.95 3.03 0.00 5.12 -0.11 -1.26 -5.05 118.94 119.72 2jcc s TRP 274 Ca 0.10 0.65 0.00 0.00 1.22 0.00 0.00 56.10 58.07 2jcc s TRP 274 Cb -0.10 -3.89 0.00 0.00 -1.50 0.00 0.00 33.47 27.98 2jcc s TRP 274 CO 0.03 -3.29 0.00 -1.91 -4.62 0.00 0.00 176.95 167.17