#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1q2r n PRO 12 N 0.00 1.29 -0.22 5.56 -0.04 -1.26 -4.33 135.00 136.00 1q2r n PRO 12 Ca 0.00 0.45 -0.03 0.00 -0.04 0.00 0.00 63.50 63.88 1q2r n PRO 12 Cb 0.00 -1.85 0.08 0.00 -0.04 0.00 0.00 33.50 31.68 1q2r n PRO 12 CO 0.00 0.00 0.00 -0.09 -0.04 0.00 0.00 175.50 175.37 1q2r h ARG 13 N 1.81 0.68 -0.44 0.54 2.43 -1.87 -2.54 114.38 114.99 1q2r h ARG 13 Ca -0.40 -0.04 0.19 0.00 -0.81 0.00 0.00 59.98 58.91 1q2r h ARG 13 Cb 1.34 -0.15 -0.20 0.00 -0.42 0.00 0.00 29.97 30.54 1q2r h ARG 13 CO 0.59 0.45 -0.03 0.12 -1.51 0.00 0.00 179.97 179.60 1q2r s PHE 14 N -6.11 -0.77 -0.22 2.20 5.36 -1.24 -4.15 117.98 113.06 1q2r s PHE 14 Ca -0.13 0.60 -0.00 0.00 -0.96 0.00 0.00 56.93 56.44 1q2r s PHE 14 Cb 0.15 0.19 0.06 0.00 -0.34 0.00 0.00 43.02 43.08 1q2r s PHE 14 CO 0.76 -0.44 -0.04 0.45 -1.46 0.00 0.00 175.22 174.49 1q2r s SER 15 N 2.93 3.51 -0.10 6.13 0.15 -0.55 -4.96 113.70 120.81 1q2r s SER 15 Ca 0.14 -1.02 -0.14 0.00 0.70 0.00 0.00 55.95 55.63 1q2r s SER 15 Cb -0.07 -1.04 -0.05 0.00 -1.71 0.00 0.00 66.02 63.15 1q2r s SER 15 CO -0.19 -0.24 0.34 0.12 1.20 0.00 0.00 173.24 174.48 1q2r s PHE 16 N 1.51 3.57 -0.04 3.44 5.36 -1.26 -1.26 117.98 129.30 1q2r s PHE 16 Ca -0.04 0.75 -0.02 0.00 -0.96 0.00 0.00 56.93 56.67 1q2r s PHE 16 Cb -0.18 -2.31 0.03 0.00 -0.34 0.00 0.00 43.02 40.22 1q2r s PHE 16 CO -0.07 0.41 0.06 -1.12 -1.46 0.00 0.00 175.22 173.04 1q2r s SER 17 N -0.15 0.99 -0.36 6.13 0.01 -0.39 -5.01 113.70 114.92 1q2r s SER 17 Ca 0.20 0.09 -0.24 0.00 1.31 0.00 0.00 55.95 57.31 1q2r s SER 17 Cb -0.14 -0.11 0.01 0.00 0.21 0.00 0.00 66.02 65.99 1q2r s SER 17 CO 0.08 -0.23 0.81 -0.63 0.41 0.00 0.00 173.24 173.67 1q2r s ILE 18 N 2.04 4.72 -0.58 1.44 1.01 -1.26 -1.58 121.20 126.99 1q2r s ILE 18 Ca 0.03 0.97 0.24 0.00 0.00 0.00 0.00 60.65 61.89 1q2r s ILE 18 Cb -0.12 -4.22 -0.00 0.00 0.01 0.00 0.00 42.46 38.12 1q2r s ILE 18 CO -0.03 -0.43 1.20 0.00 0.00 0.00 0.00 174.94 175.68 1q2r n ALA 19 N 6.45 3.00 -3.58 9.38 0.00 -0.42 -4.96 120.51 130.38 1q2r n ALA 19 Ca 0.04 -0.29 -0.05 0.00 0.00 0.00 0.00 53.44 53.14 1q2r n ALA 19 Cb 0.48 -1.11 -0.02 0.00 0.00 0.00 0.00 19.45 18.80 1q2r n ALA 19 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1q2r s ALA 20 N -3.20 -2.03 -0.05 0.00 0.00 -1.01 -5.03 121.76 110.45 1q2r s ALA 20 Ca 0.05 1.51 -0.31 0.00 0.00 0.00 0.00 51.96 53.21 1q2r s ALA 20 Cb 0.13 -0.08 0.07 0.00 0.00 0.00 0.00 23.12 23.24 1q2r s ALA 20 CO 0.75 -0.59 0.67 -0.98 0.00 0.00 0.00 175.76 175.62 1q2r s ARG 21 N -2.46 1.05 -0.32 0.00 1.70 -1.26 -0.75 118.95 116.91 1q2r s ARG 21 Ca 0.08 0.25 -0.00 0.00 -0.47 0.00 0.00 55.73 55.59 1q2r s ARG 21 Cb -0.01 0.50 0.10 0.00 -0.57 0.00 0.00 34.95 34.97 1q2r s ARG 21 CO -0.05 -0.33 0.10 -2.00 -1.08 0.00 0.00 175.30 171.94 1q2r s GLU 22 N -1.20 0.80 4.15 3.89 2.12 0.06 -4.97 118.70 123.55 1q2r s GLU 22 Ca -0.11 -1.18 0.00 0.00 0.36 0.00 0.00 54.97 54.04 1q2r s GLU 22 Cb -0.00 -2.11 0.00 0.00 0.26 0.00 0.00 34.13 32.28 1q2r s GLU 22 CO 0.10 -0.99 0.00 0.41 -0.54 0.00 0.00 175.26 174.24 1q2r n GLY 23 N 4.75 0.84 0.26 -1.50 0.00 -1.26 -2.55 105.19 105.72 1q2r n GLY 23 Ca -0.01 -0.80 0.05 0.00 0.00 0.00 0.00 46.02 45.26 1q2r n GLY 23 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1q2r h LYS 24 N 0.00 0.19 -6.95 1.61 1.57 -1.90 -3.43 116.57 107.66 1q2r h LYS 24 Ca 0.00 -0.03 -0.53 0.00 -1.87 0.00 0.00 60.65 58.23 1q2r h LYS 24 Cb 0.00 -0.04 0.08 0.00 0.08 0.00 0.00 32.23 32.36 1q2r h LYS 24 CO 0.00 0.24 0.61 0.00 -0.57 0.00 0.00 179.45 179.73 1q2r s ALA 25 N -4.95 3.22 -0.15 3.86 0.00 -1.06 -3.96 121.76 118.73 1q2r s ALA 25 Ca -0.06 1.22 -0.16 0.00 0.00 0.00 0.00 51.96 52.96 1q2r s ALA 25 Cb 0.16 -3.48 0.04 0.00 0.00 0.00 0.00 23.12 19.84 1q2r s ALA 25 CO 0.71 -0.84 0.45 -0.98 0.00 0.00 0.00 175.76 175.10 1q2r s ARG 26 N -2.30 0.57 0.02 0.00 3.03 -1.26 -0.76 118.95 118.25 1q2r s ARG 26 Ca 0.58 0.52 0.08 0.00 2.03 0.00 0.00 55.73 58.94 1q2r s ARG 26 Cb -0.38 0.27 -0.03 0.00 -1.03 0.00 0.00 34.95 33.79 1q2r s ARG 26 CO 0.48 -0.09 -0.23 -0.08 -1.13 0.00 0.00 175.30 174.25 1q2r s THR 27 N 0.00 2.39 0.00 4.99 -1.32 0.07 -4.31 115.64 117.46 1q2r s THR 27 Ca -0.02 -1.22 0.00 0.00 -1.21 0.00 0.00 61.69 59.24 1q2r s THR 27 Cb -0.03 -1.93 0.00 0.00 -1.51 0.00 0.00 72.50 69.02 1q2r s THR 27 CO 0.01 0.42 0.00 0.61 -2.21 0.00 0.00 174.62 173.45 1q2r n GLY 28 N 1.89 1.99 3.26 6.08 0.00 -0.65 -1.30 105.19 116.46 1q2r n GLY 28 Ca -0.17 -0.39 -0.09 0.00 0.00 0.00 0.00 46.02 45.38 1q2r n GLY 28 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1q2r s THR 29 N -1.19 0.11 -0.20 2.61 -4.23 -0.61 -0.06 115.64 112.06 1q2r s THR 29 Ca 0.00 -1.29 0.00 0.00 -1.18 0.00 0.00 61.69 59.22 1q2r s THR 29 Cb 0.00 -1.58 0.05 0.00 1.34 0.00 0.00 72.50 72.31 1q2r s THR 29 CO 0.00 -0.49 -0.06 -0.63 -0.54 0.00 0.00 174.62 172.90 1q2r s ILE 30 N -3.91 1.36 -0.10 2.99 1.01 0.59 -1.26 121.20 121.89 1q2r s ILE 30 Ca 0.11 -0.94 -0.17 0.00 0.00 0.00 0.00 60.65 59.64 1q2r s ILE 30 Cb 0.04 -1.57 -0.05 0.00 0.01 0.00 0.00 42.46 40.90 1q2r s ILE 30 CO -0.06 0.03 0.46 -1.61 0.00 0.00 0.00 174.94 173.77 1q2r s GLU 31 N 1.50 4.28 0.12 2.79 2.02 -0.39 -0.33 118.70 128.69 1q2r s GLU 31 Ca -0.02 0.43 0.01 0.00 0.02 0.00 0.00 54.97 55.41 1q2r s GLU 31 Cb -0.17 -3.40 -0.04 0.00 0.10 0.00 0.00 34.13 30.62 1q2r s GLU 31 CO -0.07 0.25 -0.02 -1.64 0.02 0.00 0.00 175.26 173.80 1q2r s MET 32 N 0.32 0.92 0.29 1.61 -1.94 0.09 -1.48 119.30 119.09 1q2r s MET 32 Ca 0.25 -1.40 0.03 0.00 -1.71 0.00 0.00 55.69 52.85 1q2r s MET 32 Cb -0.15 -0.12 0.62 0.00 2.01 0.00 0.00 34.83 37.18 1q2r s MET 32 CO 0.11 -0.10 1.80 0.87 -0.01 0.00 0.00 175.02 177.69 1q2r h LYS 33 N 2.88 0.82 0.00 2.03 1.57 -1.61 -0.81 116.57 121.45 1q2r h LYS 33 Ca -0.36 -0.05 0.00 0.00 -1.87 0.00 0.00 60.65 58.37 1q2r h LYS 33 Cb 1.18 -0.19 0.00 0.00 0.08 0.00 0.00 32.23 33.30 1q2r h LYS 33 CO 0.63 0.54 0.00 0.54 -0.57 0.00 0.00 179.45 180.60 1q2r n ARG 34 N -4.72 0.03 -2.78 3.15 1.74 -1.26 -4.53 116.66 108.29 1q2r n ARG 34 Ca 0.20 0.03 0.00 0.00 -0.77 0.00 0.00 57.85 57.32 1q2r n ARG 34 Cb 0.45 -1.53 0.00 0.00 -1.02 0.00 0.00 32.46 30.35 1q2r n ARG 34 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1q2r n GLY 35 N 1.42 -1.67 3.86 -0.13 0.00 -0.31 -4.28 105.19 104.09 1q2r n GLY 35 Ca 0.07 -1.51 -0.28 0.00 0.00 0.00 0.00 46.02 44.29 1q2r n GLY 35 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1q2r s VAL 36 N -1.76 4.95 -0.23 1.61 -7.23 -1.26 -0.74 120.40 115.74 1q2r s VAL 36 Ca 0.00 -0.74 0.00 0.00 -1.81 0.00 0.00 61.98 59.43 1q2r s VAL 36 Cb 0.00 -3.48 0.06 0.00 0.56 0.00 0.00 36.38 33.52 1q2r s VAL 36 CO 0.00 0.00 -0.04 -0.63 -0.31 0.00 0.00 175.10 174.12 1q2r s ILE 37 N -1.62 1.37 0.12 -0.62 1.01 0.55 -4.86 121.20 117.15 1q2r s ILE 37 Ca 0.33 -1.10 -0.30 0.00 0.00 0.00 0.00 60.65 59.58 1q2r s ILE 37 Cb -0.11 -1.67 -0.06 0.00 0.01 0.00 0.00 42.46 40.63 1q2r s ILE 37 CO 0.26 -0.10 0.98 -0.13 0.00 0.00 0.00 174.94 175.95 1q2r s ARG 38 N 1.47 4.68 0.15 2.79 0.52 -1.26 -0.30 118.95 127.01 1q2r s ARG 38 Ca -0.05 1.49 0.09 0.00 -0.52 0.00 0.00 55.73 56.75 1q2r s ARG 38 Cb -0.18 -3.36 -0.04 0.00 0.52 0.00 0.00 34.95 31.88 1q2r s ARG 38 CO -0.06 0.19 -0.21 0.95 0.02 0.00 0.00 175.30 176.19 1q2r s THR 39 N -0.04 1.95 0.52 0.02 -4.23 0.91 -3.65 115.64 111.12 1q2r s THR 39 Ca 0.47 -1.85 -0.22 0.00 -1.18 0.00 0.00 61.69 58.91 1q2r s THR 39 Cb -0.24 -1.85 -0.06 0.00 1.34 0.00 0.00 72.50 71.69 1q2r s THR 39 CO 0.30 -0.18 1.32 -2.65 -0.54 0.00 0.00 174.62 172.88 1q2r n PRO 40 N 0.51 1.72 -4.28 3.99 -0.02 -1.26 -1.64 135.00 134.03 1q2r n PRO 40 Ca -0.15 0.63 -0.20 0.00 -2.02 0.00 0.00 63.50 61.76 1q2r n PRO 40 Cb 0.56 -2.52 -0.13 0.00 -0.02 0.00 0.00 33.50 31.39 1q2r n PRO 40 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1q2r s ALA 41 N -1.28 1.28 -0.15 3.55 0.00 -0.27 -4.86 121.76 120.03 1q2r s ALA 41 Ca 0.69 -0.96 -0.02 0.00 0.00 0.00 0.00 51.96 51.67 1q2r s ALA 41 Cb -0.43 -0.16 -0.02 0.00 0.00 0.00 0.00 23.12 22.51 1q2r s ALA 41 CO 0.51 0.22 -0.09 0.12 0.00 0.00 0.00 175.76 176.52 1q2r s PHE 42 N -1.07 2.89 -0.32 0.00 5.36 -1.26 -1.02 117.98 122.56 1q2r s PHE 42 Ca 0.01 -0.59 -0.10 0.00 -0.96 0.00 0.00 56.93 55.29 1q2r s PHE 42 Cb -0.09 -1.91 -0.01 0.00 -0.34 0.00 0.00 43.02 40.67 1q2r s PHE 42 CO 0.02 -0.20 0.17 -1.64 -1.46 0.00 0.00 175.22 172.11 1q2r s MET 43 N 0.49 3.37 0.32 10.12 -1.94 0.87 -4.76 119.30 127.78 1q2r s MET 43 Ca -0.07 -0.70 -0.29 0.00 -1.71 0.00 0.00 55.69 52.92 1q2r s MET 43 Cb -0.15 -3.62 -0.10 0.00 2.01 0.00 0.00 34.83 32.96 1q2r s MET 43 CO 0.04 -0.42 1.41 -2.14 -0.01 0.00 0.00 175.02 173.90 1q2r s PRO 44 N 1.64 4.25 0.03 2.03 0.02 -1.25 -3.99 135.00 137.72 1q2r s PRO 44 Ca 0.05 2.37 -0.29 0.00 0.02 0.00 0.00 61.00 63.14 1q2r s PRO 44 Cb -0.17 -3.05 -0.04 0.00 0.02 0.00 0.00 34.50 31.26 1q2r s PRO 44 CO 0.07 -0.38 0.94 0.08 -0.33 0.00 0.00 177.00 177.38 1q2r s VAL 45 N -0.75 4.78 -0.53 3.83 1.01 -1.25 -1.59 120.40 125.90 1q2r s VAL 45 Ca 0.54 1.98 0.07 0.00 0.00 0.00 0.00 61.98 64.57 1q2r s VAL 45 Cb -0.43 -4.28 0.29 0.00 0.00 0.00 0.00 36.38 31.96 1q2r s VAL 45 CO 0.53 0.22 0.76 0.61 0.00 0.00 0.00 175.10 177.23 1q2r n GLY 46 N 2.71 4.50 0.19 4.51 0.00 0.12 -4.46 105.19 112.76 1q2r n GLY 46 Ca 0.04 -2.38 -0.06 0.00 0.00 0.00 0.00 46.02 43.62 1q2r n GLY 46 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 1q2r h THR 47 N 2.54 0.00 -0.11 2.61 2.02 -1.73 -2.97 112.91 115.27 1q2r h THR 47 Ca 0.14 0.00 -0.07 0.00 0.77 0.00 0.00 66.41 67.25 1q2r h THR 47 Cb 0.70 0.00 -0.03 0.00 -1.74 0.00 0.00 68.15 67.08 1q2r h THR 47 CO 0.71 0.00 0.09 0.00 0.37 0.00 0.00 175.52 176.68 1q2r n ALA 48 N -2.76 3.73 -2.03 6.16 0.00 -1.26 -4.23 120.51 120.12 1q2r n ALA 48 Ca -0.02 -0.36 -0.12 0.00 0.00 0.00 0.00 53.44 52.94 1q2r n ALA 48 Cb 0.15 -1.07 -0.02 0.00 0.00 0.00 0.00 19.45 18.51 1q2r n ALA 48 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1q2r n ALA 49 N 0.89 -0.32 -3.55 0.00 0.00 -1.12 -4.98 120.51 111.43 1q2r n ALA 49 Ca 0.07 0.12 -0.15 0.00 0.00 0.00 0.00 53.44 53.48 1q2r n ALA 49 Cb 0.56 -1.48 -0.06 0.00 0.00 0.00 0.00 19.45 18.47 1q2r n ALA 49 CO 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 177.50 177.42 1q2r s THR 50 N -2.57 0.00 -0.57 0.00 -1.32 -1.25 -4.72 115.64 105.21 1q2r s THR 50 Ca 0.00 0.00 -0.18 0.00 -1.21 0.00 0.00 61.69 60.30 1q2r s THR 50 Cb 0.00 -1.00 0.10 0.00 -1.51 0.00 0.00 72.50 70.09 1q2r s THR 50 CO 0.00 0.00 0.65 -0.69 -2.21 0.00 0.00 174.62 172.37 1q2r s VAL 51 N -1.08 4.89 -0.03 5.08 1.01 -1.26 -3.65 120.40 125.37 1q2r s VAL 51 Ca -0.07 -0.97 -0.03 0.00 0.00 0.00 0.00 61.98 60.92 1q2r s VAL 51 Cb -0.00 -4.42 -0.01 0.00 0.00 0.00 0.00 36.38 31.94 1q2r s VAL 51 CO 0.06 -1.01 0.13 0.29 0.00 0.00 0.00 175.10 174.56 1q2r n LYS 52 N 6.12 0.00 -1.27 2.72 4.76 -1.26 -0.79 118.16 128.44 1q2r n LYS 52 Ca -0.10 0.00 -0.09 0.00 -2.87 0.00 0.00 58.31 55.25 1q2r n LYS 52 Cb 0.43 -0.09 -0.04 0.00 -1.84 0.00 0.00 35.03 33.49 1q2r n LYS 52 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1q2r n ALA 53 N 0.45 -0.14 -2.90 7.82 0.00 -1.26 -4.96 120.51 119.52 1q2r n ALA 53 Ca 0.03 0.15 -0.17 0.00 0.00 0.00 0.00 53.44 53.45 1q2r n ALA 53 Cb -0.00 -1.21 -0.15 0.00 0.00 0.00 0.00 19.45 18.09 1q2r n ALA 53 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1q2r s LEU 54 N -2.13 1.89 0.54 0.00 1.43 0.03 -4.56 118.68 115.87 1q2r s LEU 54 Ca 0.00 -0.11 -0.17 0.00 -1.03 0.00 0.00 54.13 52.82 1q2r s LEU 54 Cb 0.00 -0.33 -0.06 0.00 0.03 0.00 0.00 46.19 45.82 1q2r s LEU 54 CO 0.00 0.05 1.02 -0.54 0.23 0.00 0.00 176.35 177.11 1q2r s LYS 55 N 0.04 3.68 0.24 1.70 1.02 -1.26 -4.43 119.74 120.72 1q2r s LYS 55 Ca -0.00 1.15 -0.05 0.00 0.02 0.00 0.00 55.97 57.08 1q2r s LYS 55 Cb -0.04 -2.09 0.37 0.00 -0.52 0.00 0.00 37.83 35.55 1q2r s LYS 55 CO -0.00 -0.51 1.81 -1.35 -0.92 0.00 0.00 175.35 174.37 1q2r h PRO 56 N 0.90 0.74 -0.93 -1.68 0.11 -1.86 -1.38 132.00 127.91 1q2r h PRO 56 Ca -0.47 -0.04 0.11 0.00 0.11 0.00 0.00 66.00 65.70 1q2r h PRO 56 Cb 1.21 -0.17 -0.08 0.00 0.11 0.00 0.00 31.00 32.07 1q2r h PRO 56 CO 0.59 0.49 0.56 1.05 -0.21 0.00 0.00 178.00 180.49 1q2r h GLU 57 N 0.77 0.89 -0.53 1.05 9.09 -1.92 -0.20 114.58 123.73 1q2r h GLU 57 Ca 0.38 -0.05 -0.11 0.00 0.05 0.00 0.00 59.36 59.62 1q2r h GLU 57 Cb 0.34 -0.20 -0.02 0.00 -1.65 0.00 0.00 28.75 27.22 1q2r h GLU 57 CO -0.24 0.59 -0.12 1.15 0.05 0.00 0.00 179.01 180.44 1q2r h THR 58 N 0.92 1.27 -0.29 -1.06 2.02 -1.65 -0.77 112.91 113.35 1q2r h THR 58 Ca 0.45 -1.28 -0.00 0.00 0.77 0.00 0.00 66.41 66.35 1q2r h THR 58 Cb 0.41 0.99 -0.01 0.00 -1.74 0.00 0.00 68.15 67.79 1q2r h THR 58 CO -0.25 0.45 0.18 0.58 0.37 0.00 0.00 175.52 176.84 1q2r h VAL 59 N 0.89 1.10 -0.07 3.16 2.07 -0.42 -2.17 116.25 120.81 1q2r h VAL 59 Ca 0.14 -0.24 0.01 0.00 0.82 0.00 0.00 66.70 67.43 1q2r h VAL 59 Cb 0.68 0.74 -0.01 0.00 -1.52 0.00 0.00 31.29 31.18 1q2r h VAL 59 CO 0.05 0.10 0.00 -0.09 0.02 0.00 0.00 177.57 177.66 1q2r h ARG 60 N 0.37 0.03 -0.85 1.57 9.65 -0.86 -2.49 114.38 121.81 1q2r h ARG 60 Ca 0.10 -0.00 0.21 0.00 -1.10 0.00 0.00 59.98 59.19 1q2r h ARG 60 Cb 0.01 -0.01 -0.13 0.00 -1.39 0.00 0.00 29.97 28.46 1q2r h ARG 60 CO -0.02 0.02 0.27 0.00 2.80 0.00 0.00 179.97 183.04 1q2r h ALA 61 N 1.05 1.24 0.00 2.80 0.00 -0.80 0.41 119.26 123.96 1q2r h ALA 61 Ca 0.03 0.19 0.00 0.00 0.00 0.00 0.00 54.91 55.13 1q2r h ALA 61 Cb 0.03 0.24 0.00 0.00 0.00 0.00 0.00 17.79 18.06 1q2r h ALA 61 CO -0.05 -0.39 0.00 0.25 0.00 0.00 0.00 179.25 179.06 1q2r n THR 62 N -5.15 1.21 0.00 0.00 -2.24 -0.85 -4.80 114.28 102.45 1q2r n THR 62 Ca 0.20 0.67 0.00 0.00 -2.27 0.00 0.00 64.05 62.65 1q2r n THR 62 Cb 0.61 -1.66 0.00 0.00 -2.10 0.00 0.00 70.33 67.18 1q2r n THR 62 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1q2r n GLY 63 N -1.27 0.88 3.76 3.38 0.00 0.14 -4.71 105.19 107.37 1q2r n GLY 63 Ca -0.01 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.60 1q2r n GLY 63 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1q2r s ALA 64 N -2.00 3.46 -0.26 4.61 0.00 -1.23 -4.92 121.76 121.42 1q2r s ALA 64 Ca 0.00 1.06 0.14 0.00 0.00 0.00 0.00 51.96 53.15 1q2r s ALA 64 Cb 0.00 -3.41 -0.19 0.00 0.00 0.00 0.00 23.12 19.53 1q2r s ALA 64 CO 0.00 -0.39 0.41 -0.25 0.00 0.00 0.00 175.76 175.52 1q2r n ASP 65 N 1.31 1.37 -3.63 0.00 8.00 -1.26 -4.63 116.55 117.71 1q2r n ASP 65 Ca 0.00 -0.33 -0.15 0.00 0.71 0.00 0.00 54.79 55.03 1q2r n ASP 65 Cb 0.43 1.37 -0.07 0.00 -0.02 0.00 0.00 41.12 42.84 1q2r n ASP 65 CO 0.00 0.00 0.00 -0.51 -0.39 0.00 0.00 177.20 176.30 1q2r s ILE 66 N -2.67 0.00 0.29 0.53 2.07 -1.26 -4.25 121.20 115.91 1q2r s ILE 66 Ca -0.01 -0.03 0.11 0.00 -1.41 0.00 0.00 60.65 59.31 1q2r s ILE 66 Cb 0.09 -0.90 -0.05 0.00 0.13 0.00 0.00 42.46 41.73 1q2r s ILE 66 CO 0.56 -0.02 -0.15 0.27 -1.91 0.00 0.00 174.94 173.69 1q2r s ILE 67 N -0.20 2.60 -0.06 2.00 -4.36 -1.23 -3.85 121.20 116.09 1q2r s ILE 67 Ca -0.04 -2.29 -0.00 0.00 -0.26 0.00 0.00 60.65 58.06 1q2r s ILE 67 Cb -0.03 -2.45 -0.03 0.00 1.25 0.00 0.00 42.46 41.19 1q2r s ILE 67 CO 0.04 -0.36 -0.01 -0.22 0.24 0.00 0.00 174.94 174.62 1q2r s LEU 68 N -3.56 3.48 0.17 0.37 0.20 -0.62 -1.66 118.68 117.06 1q2r s LEU 68 Ca 0.31 0.07 0.06 0.00 0.69 0.00 0.00 54.13 55.26 1q2r s LEU 68 Cb -0.04 -1.84 -0.05 0.00 -0.43 0.00 0.00 46.19 43.84 1q2r s LEU 68 CO 0.16 0.35 -0.12 -0.83 -0.29 0.00 0.00 176.35 175.63 1q2r s GLY 69 N -1.03 1.24 -0.10 7.98 0.00 -0.49 0.14 107.32 115.06 1q2r s GLY 69 Ca 0.15 -1.57 0.01 0.00 0.00 0.00 0.00 44.72 43.31 1q2r s GLY 69 CO 0.04 -1.67 -0.14 -1.31 0.00 0.00 0.00 173.10 170.03 1q2r s ASN 70 N -3.24 4.00 0.04 1.64 -0.87 -1.26 -1.96 114.94 113.29 1q2r s ASN 70 Ca 0.19 -0.28 -0.25 0.00 -1.57 0.00 0.00 52.86 50.96 1q2r s ASN 70 Cb 0.01 -1.30 -0.17 0.00 -0.02 0.00 0.00 41.25 39.77 1q2r s ASN 70 CO 0.03 0.24 1.51 0.74 -2.57 0.00 0.00 177.10 177.06 1q2r h THR 71 N 4.98 1.10 -0.14 1.60 2.02 -1.79 -2.41 112.91 118.27 1q2r h THR 71 Ca -0.34 -0.49 0.05 0.00 0.77 0.00 0.00 66.41 66.40 1q2r h THR 71 Cb 1.19 1.43 -0.07 0.00 -1.74 0.00 0.00 68.15 68.96 1q2r h THR 71 CO 0.53 0.12 -0.36 0.22 0.37 0.00 0.00 175.52 176.41 1q2r h TYR 72 N -0.28 -1.00 -0.21 3.16 3.20 -1.82 -0.29 116.97 119.72 1q2r h TYR 72 Ca -0.01 0.04 -0.02 0.00 3.14 0.00 0.00 58.73 61.89 1q2r h TYR 72 Cb 0.25 0.46 -0.01 0.00 1.54 0.00 0.00 36.73 38.97 1q2r h TYR 72 CO -0.00 -0.43 0.07 0.45 -1.64 0.00 0.00 178.16 176.61 1q2r h HIS 73 N -0.43 0.34 0.00 -3.82 3.86 -1.89 -3.13 115.15 110.08 1q2r h HIS 73 Ca 0.09 -0.03 -0.05 0.00 -1.16 0.00 0.00 60.37 59.22 1q2r h HIS 73 Cb 0.58 -0.10 -0.01 0.00 1.06 0.00 0.00 27.41 28.94 1q2r h HIS 73 CO -0.44 0.41 -0.24 -0.07 0.86 0.00 0.00 177.93 178.45 1q2r h LEU 74 N 0.18 0.00 -0.33 2.43 3.38 -1.32 -2.44 115.31 117.21 1q2r h LEU 74 Ca 0.07 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.04 1q2r h LEU 74 Cb 0.22 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.97 1q2r h LEU 74 CO -0.00 0.24 0.00 0.00 0.09 0.00 0.00 178.44 178.77 1q2r h MET 75 N 0.00 0.00 0.06 1.13 -0.00 -1.00 0.11 114.93 115.24 1q2r h MET 75 Ca -0.00 0.00 -0.37 0.00 -0.00 0.00 0.00 59.70 59.33 1q2r h MET 75 Cb 0.72 0.00 -0.04 0.00 -0.00 0.00 0.00 31.60 32.28 1q2r h MET 75 CO 0.03 0.00 -2.20 1.28 -0.00 0.00 0.00 176.91 176.02 1q2r n LEU 76 N -2.49 2.52 -3.67 -0.10 4.77 -1.08 -4.30 117.00 112.65 1q2r n LEU 76 Ca 0.04 0.06 -0.08 0.00 -0.03 0.00 0.00 56.01 56.00 1q2r n LEU 76 Cb 0.38 -0.86 -0.09 0.00 -2.33 0.00 0.00 43.42 40.53 1q2r n LEU 76 CO 0.28 0.84 0.16 -0.60 -1.33 0.00 0.00 177.39 176.74 1q2r s ARG 77 N -2.54 0.50 0.00 3.23 3.52 -0.94 -4.41 118.95 118.31 1q2r s ARG 77 Ca -0.26 1.03 0.29 0.00 -0.13 0.00 0.00 55.73 56.66 1q2r s ARG 77 Cb 0.08 0.18 1.20 0.00 -1.56 0.00 0.00 34.95 34.85 1q2r s ARG 77 CO 0.71 -0.18 1.90 -0.35 -0.81 0.00 0.00 175.30 176.57 1q2r n PRO 78 N 4.60 0.04 0.00 5.12 -0.04 -1.22 -3.91 135.00 139.59 1q2r n PRO 78 Ca -0.19 -0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.27 1q2r n PRO 78 Cb 0.55 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 32.51 1q2r n PRO 78 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1q2r n GLY 79 N 1.48 3.59 0.44 0.55 0.00 0.02 -4.75 105.19 106.53 1q2r n GLY 79 Ca 0.08 -1.49 -0.18 0.00 0.00 0.00 0.00 46.02 44.42 1q2r n GLY 79 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1q2r h ALA 80 N 0.00 -1.10 -0.58 4.61 0.00 -1.75 -1.10 119.26 119.35 1q2r h ALA 80 Ca 0.00 -0.25 0.05 0.00 0.00 0.00 0.00 54.91 54.72 1q2r h ALA 80 Cb 0.00 0.43 -0.05 0.00 0.00 0.00 0.00 17.79 18.17 1q2r h ALA 80 CO 0.00 -1.07 0.30 0.93 0.00 0.00 0.00 179.25 179.41 1q2r h GLU 81 N -1.20 0.55 -0.01 0.00 3.07 -1.94 -1.62 114.58 113.44 1q2r h GLU 81 Ca -0.11 -0.03 0.02 0.00 -0.50 0.00 0.00 59.36 58.73 1q2r h GLU 81 Cb 0.85 -0.12 -0.02 0.00 -0.84 0.00 0.00 28.75 28.62 1q2r h GLU 81 CO 0.18 0.36 -0.10 -0.09 -1.40 0.00 0.00 179.01 177.97 1q2r h ARG 82 N 0.57 -0.16 -0.85 2.33 2.43 -1.84 -0.29 114.38 116.57 1q2r h ARG 82 Ca 0.26 0.01 0.07 0.00 -0.81 0.00 0.00 59.98 59.51 1q2r h ARG 82 Cb 0.17 0.04 -0.05 0.00 -0.42 0.00 0.00 29.97 29.70 1q2r h ARG 82 CO -0.18 -0.11 0.55 0.82 -1.51 0.00 0.00 179.97 179.55 1q2r h ILE 83 N -0.16 1.05 0.06 1.20 2.04 -0.91 0.52 117.51 121.30 1q2r h ILE 83 Ca 0.04 -0.32 0.02 0.00 1.00 0.00 0.00 64.86 65.60 1q2r h ILE 83 Cb 0.22 0.03 -0.02 0.00 -0.74 0.00 0.00 36.82 36.30 1q2r h ILE 83 CO -0.11 0.17 -0.15 0.00 0.00 0.00 0.00 178.15 178.06 1q2r h ALA 84 N 1.54 -0.23 -0.39 1.87 0.00 -0.58 -0.08 119.26 121.39 1q2r h ALA 84 Ca 0.37 -0.01 0.07 0.00 0.00 0.00 0.00 54.91 55.33 1q2r h ALA 84 Cb 0.23 0.25 -0.02 0.00 0.00 0.00 0.00 17.79 18.25 1q2r h ALA 84 CO -0.13 -0.67 0.27 -0.22 0.00 0.00 0.00 179.25 178.50 1q2r h LYS 85 N -0.29 0.22 0.00 0.00 3.64 0.47 -0.02 116.57 120.59 1q2r h LYS 85 Ca 0.03 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.40 1q2r h LYS 85 Cb 0.32 -0.05 0.00 0.00 -0.41 0.00 0.00 32.23 32.09 1q2r h LYS 85 CO -0.11 0.14 0.00 1.28 -2.27 0.00 0.00 179.45 178.50 1q2r n LEU 86 N -4.47 0.00 0.00 5.20 7.99 0.02 -4.89 117.00 120.86 1q2r n LEU 86 Ca 0.05 0.34 0.00 0.00 -0.01 0.00 0.00 56.01 56.40 1q2r n LEU 86 Cb 0.30 -0.34 0.00 0.00 -0.11 0.00 0.00 43.42 43.27 1q2r n LEU 86 CO 0.35 -0.01 0.00 0.61 -1.51 0.00 0.00 177.39 176.82 1q2r n GLY 87 N 1.23 1.34 0.00 -0.72 0.00 -0.02 -4.74 105.19 102.27 1q2r n GLY 87 Ca 0.12 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.14 1q2r n GLY 87 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1q2r n GLY 88 N -0.90 0.19 0.25 -0.02 0.00 -0.15 -4.40 105.19 100.16 1q2r n GLY 88 Ca 0.00 -1.61 -0.07 0.00 0.00 0.00 0.00 46.02 44.34 1q2r n GLY 88 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1q2r h LEU 89 N 0.00 -0.66 -0.56 0.99 5.85 -0.87 -0.93 115.31 119.12 1q2r h LEU 89 Ca 0.00 0.14 0.09 0.00 0.84 0.00 0.00 57.88 58.95 1q2r h LEU 89 Cb 0.00 0.34 -0.11 0.00 0.37 0.00 0.00 40.66 41.26 1q2r h LEU 89 CO 0.00 -0.24 -0.41 0.45 -0.34 0.00 0.00 178.44 177.90 1q2r h HIS 90 N -0.17 -1.19 -0.03 1.25 3.86 -1.78 -0.87 115.15 116.21 1q2r h HIS 90 Ca 0.16 0.08 -0.14 0.00 -1.16 0.00 0.00 60.37 59.31 1q2r h HIS 90 Cb 0.42 0.60 -0.02 0.00 1.06 0.00 0.00 27.41 29.47 1q2r h HIS 90 CO -0.39 -0.42 -0.61 0.66 0.86 0.00 0.00 177.93 178.03 1q2r h SER 91 N -0.22 0.13 0.15 2.45 4.64 -1.71 -1.23 113.55 117.76 1q2r h SER 91 Ca 0.19 -0.07 0.01 0.00 -0.47 0.00 0.00 61.79 61.44 1q2r h SER 91 Cb 0.56 -0.04 -0.02 0.00 -0.31 0.00 0.00 62.40 62.60 1q2r h SER 91 CO -0.67 0.71 -0.16 0.15 -0.87 0.00 0.00 176.83 175.99 1q2r h PHE 92 N 0.08 -0.42 0.00 4.77 3.57 0.11 -3.23 116.94 121.83 1q2r h PHE 92 Ca -0.01 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.50 1q2r h PHE 92 Cb 1.10 0.17 0.00 0.00 2.79 0.00 0.00 35.95 40.00 1q2r h PHE 92 CO 0.01 -0.24 -0.87 0.00 -2.23 0.00 0.00 178.31 174.98 1q2r n MET 93 N -5.29 0.28 -0.39 1.11 0.00 -0.47 -4.99 117.12 107.38 1q2r n MET 93 Ca -0.07 0.03 0.00 0.00 0.00 0.00 0.00 57.70 57.65 1q2r n MET 93 Cb 0.20 -1.62 0.00 0.00 0.00 0.00 0.00 33.22 31.80 1q2r n MET 93 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 1q2r n GLY 94 N 1.36 0.83 3.26 3.17 0.00 -0.52 -4.77 105.19 108.53 1q2r n GLY 94 Ca 0.03 -0.39 -0.36 0.00 0.00 0.00 0.00 46.02 45.29 1q2r n GLY 94 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 1q2r s TRP 95 N -2.00 3.19 -2.11 1.61 -0.11 -0.87 -4.78 118.94 113.86 1q2r s TRP 95 Ca 0.00 -1.39 0.26 0.00 1.22 0.00 0.00 56.10 56.19 1q2r s TRP 95 Cb 0.00 -2.20 0.58 0.00 -1.50 0.00 0.00 33.47 30.35 1q2r s TRP 95 CO 0.00 -0.70 1.46 -0.40 -4.62 0.00 0.00 176.95 172.69 1q2r n ASP 96 N 4.77 1.58 -4.75 5.86 5.75 -1.26 -4.47 116.55 124.02 1q2r n ASP 96 Ca -0.14 -1.29 -0.26 0.00 -0.01 0.00 0.00 54.79 53.10 1q2r n ASP 96 Cb 0.46 0.17 0.09 0.00 -1.03 0.00 0.00 41.12 40.82 1q2r n ASP 96 CO 0.00 0.00 0.00 -0.13 -0.11 0.00 0.00 177.20 176.96 1q2r s ARG 97 N -2.34 1.85 0.79 0.11 1.81 -1.26 -4.87 118.95 115.04 1q2r s ARG 97 Ca 0.26 -0.48 -0.14 0.00 -1.72 0.00 0.00 55.73 53.65 1q2r s ARG 97 Cb 0.19 -2.17 0.05 0.00 -0.45 0.00 0.00 34.95 32.58 1q2r s ARG 97 CO 0.47 -1.45 1.02 -0.35 -0.68 0.00 0.00 175.30 174.31 1q2r n PRO 98 N -3.01 0.24 -4.06 3.54 -0.04 -1.26 -4.94 135.00 125.46 1q2r n PRO 98 Ca 0.11 0.15 -0.16 0.00 -0.04 0.00 0.00 63.50 63.56 1q2r n PRO 98 Cb 0.60 -2.28 -0.15 0.00 -0.04 0.00 0.00 33.50 31.63 1q2r n PRO 98 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 1q2r s ILE 99 N -2.05 0.30 -0.16 0.52 1.01 -1.26 -3.56 121.20 116.01 1q2r s ILE 99 Ca 0.71 -0.11 -0.04 0.00 0.00 0.00 0.00 60.65 61.22 1q2r s ILE 99 Cb -0.30 -0.29 -0.03 0.00 0.01 0.00 0.00 42.46 41.85 1q2r s ILE 99 CO 0.53 0.11 -0.03 -0.22 0.00 0.00 0.00 174.94 175.32 1q2r s LEU 100 N 0.25 3.27 -0.19 2.97 0.20 -0.66 -1.46 118.68 123.05 1q2r s LEU 100 Ca -0.02 -0.12 -0.02 0.00 0.69 0.00 0.00 54.13 54.66 1q2r s LEU 100 Cb -0.05 -1.79 -0.00 0.00 -0.43 0.00 0.00 46.19 43.91 1q2r s LEU 100 CO -0.00 0.17 -0.10 0.42 -0.29 0.00 0.00 176.35 176.54 1q2r s THR 101 N 0.37 2.96 0.68 3.68 -4.23 -0.75 -1.40 115.64 116.95 1q2r s THR 101 Ca -0.04 -0.64 -0.15 0.00 -1.18 0.00 0.00 61.69 59.67 1q2r s THR 101 Cb -0.14 -2.30 0.01 0.00 1.34 0.00 0.00 72.50 71.41 1q2r s THR 101 CO 0.03 0.47 1.16 -0.62 -0.54 0.00 0.00 174.62 175.12 1q2r s ASP 102 N 1.20 4.72 0.03 3.99 2.15 -0.83 -3.10 116.67 124.85 1q2r s ASP 102 Ca 0.02 2.19 0.27 0.00 0.43 0.00 0.00 52.55 55.46 1q2r s ASP 102 Cb -0.14 -2.57 1.10 0.00 -0.30 0.00 0.00 42.92 41.01 1q2r s ASP 102 CO -0.04 -1.90 1.85 -1.54 -0.17 0.00 0.00 175.17 173.37 1q2r n SER 103 N -2.45 0.11 0.00 -0.34 3.41 -1.26 -2.53 113.62 110.56 1q2r n SER 103 Ca 0.12 0.51 0.00 0.00 -0.26 0.00 0.00 58.87 59.24 1q2r n SER 103 Cb 0.51 -0.54 0.00 0.00 -0.26 0.00 0.00 64.21 63.92 1q2r n SER 103 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1q2r n GLY 104 N 1.24 0.70 0.33 5.00 0.00 -1.26 -4.58 105.19 106.62 1q2r n GLY 104 Ca 0.06 0.00 0.03 0.00 0.00 0.00 0.00 46.02 46.11 1q2r n GLY 104 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1q2r h GLY 105 N 0.00 0.82 0.95 -0.02 0.00 -1.90 -1.16 103.07 101.76 1q2r h GLY 105 Ca 0.00 -0.30 -0.35 0.00 0.00 0.00 0.00 47.33 46.68 1q2r h GLY 105 CO 0.00 0.29 -1.71 -1.82 0.00 0.00 0.00 176.54 173.30 1q2r h TYR 106 N 0.78 0.75 -0.74 5.60 3.20 -1.91 -3.33 116.97 121.33 1q2r h TYR 106 Ca 0.22 -0.55 0.03 0.00 3.14 0.00 0.00 58.73 61.57 1q2r h TYR 106 Cb -0.05 -0.03 -0.04 0.00 1.54 0.00 0.00 36.73 38.15 1q2r h TYR 106 CO -0.00 1.67 0.49 1.96 -1.64 0.00 0.00 178.16 180.64 1q2r h GLN 107 N 0.10 0.88 0.47 1.82 1.08 -1.89 0.49 115.11 118.06 1q2r h GLN 107 Ca -0.33 -0.05 -0.02 0.00 -1.45 0.00 0.00 58.65 56.79 1q2r h GLN 107 Cb 2.10 -0.20 0.00 0.00 -0.05 0.00 0.00 27.48 29.34 1q2r h GLN 107 CO 0.19 0.58 -0.22 0.28 -0.95 0.00 0.00 178.83 178.71 1q2r h VAL 108 N 0.91 0.52 -0.52 -0.54 2.07 -1.36 -1.70 116.25 115.63 1q2r h VAL 108 Ca 0.30 -0.22 0.01 0.00 0.82 0.00 0.00 66.70 67.60 1q2r h VAL 108 Cb 0.05 0.62 -0.03 0.00 -1.52 0.00 0.00 31.29 30.42 1q2r h VAL 108 CO -0.08 0.04 0.34 -0.03 0.02 0.00 0.00 177.57 177.86 1q2r h MET 109 N -0.76 0.68 -0.51 1.57 1.85 -1.58 -2.15 114.93 114.03 1q2r h MET 109 Ca -0.06 -0.04 0.06 0.00 -0.61 0.00 0.00 59.70 59.05 1q2r h MET 109 Cb 0.54 -0.15 -0.03 0.00 0.43 0.00 0.00 31.60 32.39 1q2r h MET 109 CO 0.11 0.45 0.34 1.03 -0.40 0.00 0.00 176.91 178.44 1q2r h SER 110 N 0.70 0.40 0.00 1.39 0.87 0.13 -3.39 113.55 113.65 1q2r h SER 110 Ca 0.19 0.00 -0.17 0.00 -1.23 0.00 0.00 61.79 60.58 1q2r h SER 110 Cb -0.08 -0.08 -0.14 0.00 -0.44 0.00 0.00 62.40 61.66 1q2r h SER 110 CO -0.04 0.26 -0.25 0.00 -0.53 0.00 0.00 176.83 176.26 1q2r n LEU 111 N -4.47 -1.48 0.00 2.23 -0.00 -0.65 -5.05 117.00 107.57 1q2r n LEU 111 Ca 0.07 -3.06 0.00 0.00 -0.00 0.00 0.00 56.01 53.02 1q2r n LEU 111 Cb 0.25 0.17 0.00 0.00 -0.00 0.00 0.00 43.42 43.84 1q2r n LEU 111 CO 0.34 1.69 0.00 -1.20 -0.00 0.00 0.00 177.39 178.23 1q2r n SER 112 N -1.11 0.00 0.00 1.45 7.64 -0.81 -4.44 113.62 116.34 1q2r n SER 112 Ca -0.13 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.75 1q2r n SER 112 Cb 0.83 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 64.03 1q2r n SER 112 CO 0.00 0.00 0.00 -0.24 -3.01 0.00 0.00 175.04 171.79 1q2r n SER 113 N 0.00 0.00 -4.23 6.43 2.88 -1.22 -4.68 113.62 112.79 1q2r n SER 113 Ca 0.00 0.00 -0.34 0.00 -1.33 0.00 0.00 58.87 57.20 1q2r n SER 113 Cb 0.00 0.00 -0.05 0.00 -0.75 0.00 0.00 64.21 63.41 1q2r n SER 113 CO 0.00 0.00 0.00 0.18 -1.23 0.00 0.00 175.04 173.99 1q2r n LEU 114 N 0.00 -1.56 -4.58 2.46 4.77 -1.26 -0.42 117.00 116.42 1q2r n LEU 114 Ca 0.00 -1.09 -0.40 0.00 -0.03 0.00 0.00 56.01 54.48 1q2r n LEU 114 Cb 0.00 -1.96 -0.03 0.00 -2.33 0.00 0.00 43.42 39.10 1q2r n LEU 114 CO 0.00 0.32 1.75 0.42 -1.33 0.00 0.00 177.39 178.55 1q2r s THR 115 N -3.61 3.22 -0.63 -5.08 -4.23 -1.25 -4.30 115.64 99.77 1q2r s THR 115 Ca 0.48 0.19 -0.16 0.00 -1.18 0.00 0.00 61.69 61.02 1q2r s THR 115 Cb -0.26 -3.40 0.15 0.00 1.34 0.00 0.00 72.50 70.33 1q2r s THR 115 CO 0.95 -0.32 0.61 -0.75 -0.54 0.00 0.00 174.62 174.57 1q2r s LYS 116 N 6.76 3.16 0.02 3.99 2.36 0.49 -4.90 119.74 131.62 1q2r s LYS 116 Ca 0.87 -1.83 -0.17 0.00 -2.55 0.00 0.00 55.97 52.29 1q2r s LYS 116 Cb -0.22 -4.34 -0.06 0.00 -1.05 0.00 0.00 37.83 32.16 1q2r s LYS 116 CO 0.29 -1.37 0.47 -0.65 1.55 0.00 0.00 175.35 175.65 1q2r s GLN 117 N 1.46 4.04 0.17 4.03 -0.21 -1.26 -0.09 119.66 127.80 1q2r s GLN 117 Ca 0.09 0.53 -0.16 0.00 0.02 0.00 0.00 55.36 55.83 1q2r s GLN 117 Cb -0.24 -3.24 0.03 0.00 1.00 0.00 0.00 33.01 30.56 1q2r s GLN 117 CO 0.00 0.65 0.46 -1.54 -2.12 0.00 0.00 175.29 172.74 1q2r s SER 118 N -1.01 -0.23 0.54 5.90 1.04 -1.03 -5.00 113.70 113.91 1q2r s SER 118 Ca 0.26 -0.45 0.22 0.00 0.48 0.00 0.00 55.95 56.45 1q2r s SER 118 Cb -0.18 0.53 1.39 0.00 0.10 0.00 0.00 66.02 67.87 1q2r s SER 118 CO 0.15 -0.97 2.08 -0.08 0.98 0.00 0.00 173.24 175.40 1q2r h GLU 119 N 2.28 0.00 -0.07 4.02 4.57 -2.02 -2.07 114.58 121.29 1q2r h GLU 119 Ca -0.31 0.00 -0.01 0.00 -1.18 0.00 0.00 59.36 57.86 1q2r h GLU 119 Cb 1.26 0.00 -0.00 0.00 -0.16 0.00 0.00 28.75 29.85 1q2r h GLU 119 CO 0.42 0.00 -0.00 1.49 -1.18 0.00 0.00 179.01 179.73 1q2r h GLU 120 N 0.00 0.13 0.00 1.92 4.22 -1.99 -3.49 114.58 115.37 1q2r h GLU 120 Ca 0.12 -0.04 0.00 0.00 0.08 0.00 0.00 59.36 59.52 1q2r h GLU 120 Cb 0.52 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.76 1q2r h GLU 120 CO -0.00 0.41 0.00 0.41 -2.18 0.00 0.00 179.01 177.65 1q2r n GLY 121 N -0.25 0.82 3.64 1.92 0.00 -0.78 -4.69 105.19 105.85 1q2r n GLY 121 Ca -0.07 0.35 -0.08 0.00 0.00 0.00 0.00 46.02 46.22 1q2r n GLY 121 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1q2r s VAL 122 N 2.11 0.00 -0.11 1.61 0.11 -0.14 -2.46 120.40 121.53 1q2r s VAL 122 Ca 0.00 0.00 0.01 0.00 -2.93 0.00 0.00 61.98 59.06 1q2r s VAL 122 Cb 0.00 -1.00 -0.02 0.00 -1.53 0.00 0.00 36.38 33.83 1q2r s VAL 122 CO 0.00 0.00 -0.13 -0.89 -3.33 0.00 0.00 175.10 170.75 1q2r s THR 123 N 0.57 3.10 0.35 5.04 2.01 0.87 -0.37 115.64 127.21 1q2r s THR 123 Ca -0.01 -0.66 0.06 0.00 0.31 0.00 0.00 61.69 61.39 1q2r s THR 123 Cb -0.05 -2.28 -0.03 0.00 0.01 0.00 0.00 72.50 70.16 1q2r s THR 123 CO -0.08 0.54 0.23 0.72 -0.69 0.00 0.00 174.62 175.35 1q2r s PHE 124 N 0.03 1.76 -0.18 4.92 -0.71 -0.19 0.19 117.98 123.79 1q2r s PHE 124 Ca -0.04 -1.56 0.01 0.00 -1.04 0.00 0.00 56.93 54.29 1q2r s PHE 124 Cb -0.14 -0.84 0.02 0.00 -1.21 0.00 0.00 43.02 40.84 1q2r s PHE 124 CO 0.04 -0.71 -0.19 0.21 -1.34 0.00 0.00 175.22 173.24 1q2r s LYS 125 N -3.53 3.03 -0.09 1.99 2.20 0.44 -1.57 119.74 122.21 1q2r s LYS 125 Ca 0.35 -0.81 -0.40 0.00 -0.36 0.00 0.00 55.97 54.75 1q2r s LYS 125 Cb 0.02 -2.60 -0.18 0.00 -1.51 0.00 0.00 37.83 33.56 1q2r s LYS 125 CO 0.24 -0.19 1.35 0.45 -0.36 0.00 0.00 175.35 176.83 1q2r n SER 126 N 4.59 1.11 0.00 1.43 2.88 -0.25 -3.43 113.62 119.96 1q2r n SER 126 Ca -0.21 1.14 0.05 0.00 -1.33 0.00 0.00 58.87 58.53 1q2r n SER 126 Cb 0.50 -1.04 0.26 0.00 -0.75 0.00 0.00 64.21 63.18 1q2r n SER 126 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1q2r n HIS 127 N 2.84 0.00 0.00 0.66 1.44 -1.26 -1.59 115.22 117.31 1q2r n HIS 127 Ca 0.22 0.00 0.00 0.00 -2.01 0.00 0.00 57.72 55.93 1q2r n HIS 127 Cb 0.10 -0.40 0.00 0.00 0.12 0.00 0.00 29.99 29.82 1q2r n HIS 127 CO 0.00 0.00 0.00 1.47 -2.81 0.00 0.00 176.34 175.00 1q2r n LEU 128 N -1.40 0.00 -0.09 2.39 -0.00 -1.26 -4.91 117.00 111.74 1q2r n LEU 128 Ca 0.04 0.00 -0.10 0.00 -0.00 0.00 0.00 56.01 55.95 1q2r n LEU 128 Cb 0.11 0.00 -0.03 0.00 -0.00 0.00 0.00 43.42 43.50 1q2r n LEU 128 CO 0.10 0.00 -0.70 -0.67 -0.00 0.00 0.00 177.39 176.12 1q2r n ASP 129 N -1.14 1.89 0.00 1.45 -0.08 -1.19 -5.03 116.55 112.45 1q2r n ASP 129 Ca 0.00 0.32 0.00 0.00 -1.51 0.00 0.00 54.79 53.60 1q2r n ASP 129 Cb 0.11 -0.72 0.00 0.00 2.34 0.00 0.00 41.12 42.85 1q2r n ASP 129 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 1q2r n GLY 130 N 1.57 0.93 3.79 0.27 0.00 -0.62 -4.96 105.19 106.16 1q2r n GLY 130 Ca -0.16 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.52 1q2r n GLY 130 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1q2r s SER 131 N -1.68 5.88 0.44 1.61 1.04 -1.26 -4.48 113.70 115.26 1q2r s SER 131 Ca 0.00 1.97 -0.17 0.00 0.48 0.00 0.00 55.95 58.23 1q2r s SER 131 Cb 0.00 -2.56 -0.09 0.00 0.10 0.00 0.00 66.02 63.47 1q2r s SER 131 CO 0.00 -1.10 0.91 -0.13 0.98 0.00 0.00 173.24 173.90 1q2r s ARG 132 N -3.57 4.02 -0.09 4.02 0.52 -1.26 -1.09 118.95 121.49 1q2r s ARG 132 Ca 0.68 0.89 -0.21 0.00 -0.52 0.00 0.00 55.73 56.57 1q2r s ARG 132 Cb -0.19 -2.23 0.05 0.00 0.52 0.00 0.00 34.95 33.10 1q2r s ARG 132 CO 0.29 -0.10 0.50 -1.01 0.02 0.00 0.00 175.30 175.00 1q2r s HIS 133 N -2.35 -0.47 -0.16 -0.53 3.76 -0.61 -4.93 115.29 110.00 1q2r s HIS 133 Ca 0.58 0.94 0.00 0.00 -0.15 0.00 0.00 55.06 56.43 1q2r s HIS 133 Cb -0.10 0.23 -0.00 0.00 1.11 0.00 0.00 32.58 33.82 1q2r s HIS 133 CO 0.24 -0.41 -0.15 1.41 -0.85 0.00 0.00 174.74 174.97 1q2r s MET 134 N -0.69 3.21 -0.05 1.40 1.75 -1.26 -1.02 119.30 122.64 1q2r s MET 134 Ca -0.08 -0.75 0.06 0.00 -1.25 0.00 0.00 55.69 53.68 1q2r s MET 134 Cb -0.03 -2.64 -0.01 0.00 2.84 0.00 0.00 34.83 34.98 1q2r s MET 134 CO 0.05 -0.01 -0.24 -1.17 -0.65 0.00 0.00 175.02 172.99 1q2r s LEU 135 N 0.88 2.13 0.10 4.11 2.96 0.50 -4.95 118.68 124.40 1q2r s LEU 135 Ca -0.04 -0.47 -0.11 0.00 -0.22 0.00 0.00 54.13 53.29 1q2r s LEU 135 Cb -0.15 -1.38 0.01 0.00 0.50 0.00 0.00 46.19 45.17 1q2r s LEU 135 CO -0.01 0.27 0.24 -0.94 -1.32 0.00 0.00 176.35 174.60 1q2r s SER 136 N -0.33 0.03 0.28 3.68 1.04 -1.26 -0.96 113.70 116.17 1q2r s SER 136 Ca 0.02 -0.56 -0.06 0.00 0.48 0.00 0.00 55.95 55.83 1q2r s SER 136 Cb -0.12 0.37 0.53 0.00 0.10 0.00 0.00 66.02 66.90 1q2r s SER 136 CO 0.02 -0.76 1.57 -0.65 0.98 0.00 0.00 173.24 174.40 1q2r h PRO 137 N 2.65 0.01 -0.09 4.02 0.11 -1.90 0.29 132.00 137.10 1q2r h PRO 137 Ca -0.34 -0.00 -0.12 0.00 0.11 0.00 0.00 66.00 65.65 1q2r h PRO 137 Cb 1.21 -0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.31 1q2r h PRO 137 CO 0.54 0.01 -0.47 1.05 -0.21 0.00 0.00 178.00 178.91 1q2r h GLU 138 N 0.01 0.21 0.02 1.05 9.09 -1.94 -2.34 114.58 120.69 1q2r h GLU 138 Ca 0.50 -0.11 -0.24 0.00 0.05 0.00 0.00 59.36 59.55 1q2r h GLU 138 Cb 0.85 0.00 0.01 0.00 -1.65 0.00 0.00 28.75 27.97 1q2r h GLU 138 CO -0.94 0.65 -1.00 -0.09 0.05 0.00 0.00 179.01 177.67 1q2r h ARG 139 N 0.17 0.48 0.11 1.06 9.65 -1.12 -0.79 114.38 123.95 1q2r h ARG 139 Ca 0.01 -0.54 -0.01 0.00 -1.10 0.00 0.00 59.98 58.35 1q2r h ARG 139 Cb 0.90 0.16 0.00 0.00 -1.39 0.00 0.00 29.97 29.64 1q2r h ARG 139 CO 0.07 1.18 -0.05 1.03 2.80 0.00 0.00 179.97 185.00 1q2r h SER 140 N 0.26 -0.13 0.10 -3.80 0.87 -0.52 0.27 113.55 110.61 1q2r h SER 140 Ca -0.10 -0.13 -0.03 0.00 -1.23 0.00 0.00 61.79 60.29 1q2r h SER 140 Cb 1.65 0.03 -0.01 0.00 -0.44 0.00 0.00 62.40 63.64 1q2r h SER 140 CO 0.18 0.06 -0.12 0.40 -0.53 0.00 0.00 176.83 176.82 1q2r h ILE 141 N -0.31 1.11 -0.38 2.23 1.08 -1.46 0.47 117.51 120.26 1q2r h ILE 141 Ca -0.02 -0.50 -0.15 0.00 -0.39 0.00 0.00 64.86 63.81 1q2r h ILE 141 Cb 0.25 1.22 -0.01 0.00 -3.07 0.00 0.00 36.82 35.21 1q2r h ILE 141 CO 0.02 0.15 -0.35 -0.08 -0.69 0.00 0.00 178.15 177.20 1q2r h GLU 142 N 0.05 0.91 0.18 2.37 4.81 -0.47 -1.81 114.58 120.62 1q2r h GLU 142 Ca 0.01 -0.47 -0.01 0.00 -0.13 0.00 0.00 59.36 58.76 1q2r h GLU 142 Cb 0.25 0.01 0.00 0.00 0.63 0.00 0.00 28.75 29.64 1q2r h GLU 142 CO 0.02 1.12 -0.09 0.82 -0.73 0.00 0.00 179.01 180.15 1q2r h ILE 143 N 0.72 0.93 -0.02 2.32 2.04 0.46 -2.34 117.51 121.62 1q2r h ILE 143 Ca 0.06 -0.60 0.00 0.00 1.00 0.00 0.00 64.86 65.33 1q2r h ILE 143 Cb 0.94 1.28 -0.00 0.00 -0.74 0.00 0.00 36.82 38.30 1q2r h ILE 143 CO 0.09 0.14 0.07 1.56 0.00 0.00 0.00 178.15 180.00 1q2r h GLN 144 N -0.54 0.00 0.12 2.37 4.20 -0.93 0.21 115.11 120.53 1q2r h GLN 144 Ca -0.02 0.00 -0.27 0.00 0.06 0.00 0.00 58.65 58.41 1q2r h GLN 144 Cb 0.41 0.00 0.01 0.00 0.30 0.00 0.00 27.48 28.20 1q2r h GLN 144 CO 0.04 0.00 -1.20 1.25 -0.67 0.00 0.00 178.83 178.25 1q2r h HIS 145 N 0.00 0.62 -0.54 2.96 2.76 -1.04 -2.57 115.15 117.35 1q2r h HIS 145 Ca 0.01 -0.42 -0.09 0.00 -2.20 0.00 0.00 60.37 57.67 1q2r h HIS 145 Cb 0.15 -0.04 -0.02 0.00 1.55 0.00 0.00 27.41 29.05 1q2r h HIS 145 CO 0.00 1.30 -0.00 -0.07 -1.30 0.00 0.00 177.93 177.86 1q2r h LEU 146 N 0.14 0.93 -1.34 0.26 3.38 -0.11 -2.56 115.31 116.00 1q2r h LEU 146 Ca -0.14 -0.31 -0.06 0.00 0.09 0.00 0.00 57.88 57.46 1q2r h LEU 146 Cb 1.90 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 42.39 1q2r h LEU 146 CO 0.21 1.01 -0.19 -0.07 0.09 0.00 0.00 178.44 179.49 1q2r h LEU 147 N 0.82 0.20 0.00 1.67 3.38 -1.27 -3.37 115.31 116.75 1q2r h LEU 147 Ca 0.15 -0.05 0.00 0.00 0.09 0.00 0.00 57.88 58.07 1q2r h LEU 147 Cb 0.54 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 41.23 1q2r h LEU 147 CO 0.03 0.41 0.00 0.61 0.09 0.00 0.00 178.44 179.57 1q2r n GLY 148 N -0.76 0.68 3.58 0.83 0.00 -0.97 -0.26 105.19 108.29 1q2r n GLY 148 Ca -0.01 -0.45 -0.36 0.00 0.00 0.00 0.00 46.02 45.21 1q2r n GLY 148 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1q2r n SER 149 N 0.81 0.06 -0.04 1.61 3.41 -1.07 -4.93 113.62 113.48 1q2r n SER 149 Ca 0.00 0.64 -0.21 0.00 -0.26 0.00 0.00 58.87 59.04 1q2r n SER 149 Cb 0.00 -1.36 -0.13 0.00 -0.26 0.00 0.00 64.21 62.46 1q2r n SER 149 CO 0.00 0.00 0.00 0.44 -0.16 0.00 0.00 175.04 175.32 1q2r h ASP 150 N -0.35 0.23 -3.65 4.04 3.32 -1.61 -3.44 116.42 114.96 1q2r h ASP 150 Ca -0.47 -0.77 -0.70 0.00 0.02 0.00 0.00 57.03 55.12 1q2r h ASP 150 Cb 1.33 -0.08 -0.30 0.00 0.22 0.00 0.00 39.33 40.51 1q2r h ASP 150 CO 0.46 1.57 -0.60 -0.63 -1.72 0.00 0.00 179.24 178.32 1q2r s ILE 151 N -2.43 3.66 -0.01 0.35 1.01 -0.88 0.81 121.20 123.70 1q2r s ILE 151 Ca -0.23 -1.28 -0.19 0.00 0.00 0.00 0.00 60.65 58.95 1q2r s ILE 151 Cb 0.05 -3.13 -0.05 0.00 0.01 0.00 0.00 42.46 39.33 1q2r s ILE 151 CO 0.70 -0.25 0.53 -0.69 0.00 0.00 0.00 174.94 175.24 1q2r s VAL 152 N 1.36 4.96 0.00 2.92 1.01 0.51 -1.82 120.40 129.35 1q2r s VAL 152 Ca -0.01 1.10 -0.02 0.00 0.00 0.00 0.00 61.98 63.05 1q2r s VAL 152 Cb -0.20 -3.86 -0.04 0.00 0.00 0.00 0.00 36.38 32.28 1q2r s VAL 152 CO 0.01 0.45 0.18 -0.04 0.00 0.00 0.00 175.10 175.71 1q2r s MET 153 N -0.33 3.41 0.66 2.72 -1.94 -1.18 -0.93 119.30 121.71 1q2r s MET 153 Ca 0.28 -0.35 -0.13 0.00 -1.71 0.00 0.00 55.69 53.77 1q2r s MET 153 Cb -0.17 -3.07 -0.00 0.00 2.01 0.00 0.00 34.83 33.59 1q2r s MET 153 CO 0.15 0.66 1.07 0.00 -0.01 0.00 0.00 175.02 176.90 1q2r s ALA 154 N -1.35 2.59 0.30 3.03 0.00 -0.81 -4.46 121.76 121.06 1q2r s ALA 154 Ca 0.28 0.33 -0.22 0.00 0.00 0.00 0.00 51.96 52.35 1q2r s ALA 154 Cb -0.13 -3.24 -0.09 0.00 0.00 0.00 0.00 23.12 19.66 1q2r s ALA 154 CO 0.20 -1.17 0.85 0.12 0.00 0.00 0.00 175.76 175.76 1q2r s PHE 155 N -2.65 3.60 0.08 0.00 5.36 -1.26 -4.54 117.98 118.57 1q2r s PHE 155 Ca 0.62 1.57 -0.16 0.00 -0.96 0.00 0.00 56.93 58.01 1q2r s PHE 155 Cb -0.17 -2.77 0.03 0.00 -0.34 0.00 0.00 43.02 39.77 1q2r s PHE 155 CO 0.46 0.21 0.37 0.16 -1.46 0.00 0.00 175.22 174.95 1q2r s ASP 156 N -1.76 -0.20 -0.18 6.13 -4.77 -1.26 -4.24 116.67 110.39 1q2r s ASP 156 Ca 0.49 -0.23 -0.16 0.00 -3.30 0.00 0.00 52.55 49.36 1q2r s ASP 156 Cb -0.16 0.43 -0.04 0.00 -1.09 0.00 0.00 42.92 42.06 1q2r s ASP 156 CO 0.21 -0.75 0.38 -0.70 0.70 0.00 0.00 175.17 175.01 1q2r s GLU 157 N -3.22 4.22 0.03 2.11 2.12 -1.26 -4.50 118.70 118.19 1q2r s GLU 157 Ca -0.01 0.21 0.05 0.00 0.36 0.00 0.00 54.97 55.58 1q2r s GLU 157 Cb 0.01 -3.50 -0.03 0.00 0.26 0.00 0.00 34.13 30.87 1q2r s GLU 157 CO -0.08 0.06 -0.11 0.00 -0.54 0.00 0.00 175.26 174.59 1q2r s THR 159 N -0.99 2.50 1.17 0.00 -4.23 -1.26 -4.97 115.64 107.85 1q2r s THR 159 Ca 0.17 -0.91 -0.18 0.00 -1.18 0.00 0.00 61.69 59.59 1q2r s THR 159 Cb -0.11 -1.95 0.21 0.00 1.34 0.00 0.00 72.50 71.99 1q2r s THR 159 CO 0.07 0.57 0.40 -0.81 -0.54 0.00 0.00 174.62 174.31 1q2r n PRO 160 N 2.79 -2.56 -4.70 3.99 -0.04 -1.26 -4.90 135.00 128.32 1q2r n PRO 160 Ca -0.17 -0.74 -0.33 0.00 -0.04 0.00 0.00 63.50 62.21 1q2r n PRO 160 Cb 0.52 -1.75 -0.13 0.00 -0.04 0.00 0.00 33.50 32.10 1q2r n PRO 160 CO 0.00 0.00 0.00 -0.47 -0.04 0.00 0.00 175.50 174.99 1q2r s TYR 161 N -2.19 2.85 0.76 0.54 5.04 -1.26 -3.70 117.35 119.39 1q2r s TYR 161 Ca 0.55 -0.35 -0.10 0.00 -2.44 0.00 0.00 57.07 54.74 1q2r s TYR 161 Cb -0.12 -1.79 0.07 0.00 0.35 0.00 0.00 41.96 40.46 1q2r s TYR 161 CO 0.56 0.01 1.10 -2.14 -1.34 0.00 0.00 175.55 173.74 1q2r s PRO 162 N -0.10 2.08 -0.11 4.97 0.02 -1.26 -5.11 135.00 135.50 1q2r s PRO 162 Ca -0.01 -0.05 0.02 0.00 0.02 0.00 0.00 61.00 60.99 1q2r s PRO 162 Cb -0.14 -2.05 0.01 0.00 0.02 0.00 0.00 34.50 32.34 1q2r s PRO 162 CO 0.03 -1.43 -0.18 0.00 -0.33 0.00 0.00 177.00 175.09 1q2r s ALA 163 N -3.43 1.89 0.51 -1.55 0.00 -1.24 -5.11 121.76 112.83 1q2r s ALA 163 Ca 0.61 -0.84 -0.22 0.00 0.00 0.00 0.00 51.96 51.51 1q2r s ALA 163 Cb -0.11 -0.85 -0.06 0.00 0.00 0.00 0.00 23.12 22.11 1q2r s ALA 163 CO 0.47 0.02 1.27 0.95 0.00 0.00 0.00 175.76 178.47 1q2r s THR 164 N 0.79 2.54 0.37 0.00 -4.23 -1.26 -4.72 115.64 109.13 1q2r s THR 164 Ca -0.10 0.40 0.17 0.00 -1.18 0.00 0.00 61.69 60.99 1q2r s THR 164 Cb -0.16 -3.20 0.37 0.00 1.34 0.00 0.00 72.50 70.85 1q2r s THR 164 CO 0.01 -0.01 1.70 -0.65 -0.54 0.00 0.00 174.62 175.12 1q2r h PRO 165 N 1.65 0.34 0.38 3.99 0.11 -1.99 0.19 132.00 136.67 1q2r h PRO 165 Ca -0.50 -0.02 -0.02 0.00 0.11 0.00 0.00 66.00 65.57 1q2r h PRO 165 Cb 1.28 -0.08 0.00 0.00 0.11 0.00 0.00 31.00 32.31 1q2r h PRO 165 CO 0.58 0.23 -0.18 0.66 -0.21 0.00 0.00 178.00 179.08 1q2r h SER 166 N 0.35 -0.43 -0.36 -2.05 4.64 -1.99 -1.24 113.55 112.47 1q2r h SER 166 Ca 0.69 -0.13 0.08 0.00 -0.47 0.00 0.00 61.79 61.97 1q2r h SER 166 Cb 1.70 0.11 -0.02 0.00 -0.31 0.00 0.00 62.40 63.88 1q2r h SER 166 CO -0.46 -0.00 0.25 -0.09 -0.87 0.00 0.00 176.83 175.65 1q2r h ARG 167 N -0.97 0.10 -0.20 4.77 2.43 -1.61 -0.10 114.38 118.80 1q2r h ARG 167 Ca -0.05 -0.01 -0.21 0.00 -0.81 0.00 0.00 59.98 58.90 1q2r h ARG 167 Cb 0.53 -0.02 0.01 0.00 -0.42 0.00 0.00 29.97 30.07 1q2r h ARG 167 CO 0.09 0.07 -0.69 0.00 -1.51 0.00 0.00 179.97 177.93 1q2r h ALA 168 N 1.82 0.35 0.03 2.80 0.00 -0.64 -2.77 119.26 120.85 1q2r h ALA 168 Ca 0.17 -0.57 -0.00 0.00 0.00 0.00 0.00 54.91 54.51 1q2r h ALA 168 Cb 0.53 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.28 1q2r h ALA 168 CO -0.02 0.66 -0.01 0.00 0.00 0.00 0.00 179.25 179.88 1q2r h ALA 169 N 0.59 -0.04 -0.34 0.00 0.00 0.17 -2.08 119.26 117.55 1q2r h ALA 169 Ca -0.03 -0.17 -0.00 0.00 0.00 0.00 0.00 54.91 54.71 1q2r h ALA 169 Cb 1.31 0.02 -0.02 0.00 0.00 0.00 0.00 17.79 19.10 1q2r h ALA 169 CO 0.15 -0.36 0.20 0.66 0.00 0.00 0.00 179.25 179.90 1q2r h SER 170 N -0.37 0.42 -0.84 0.00 4.64 -1.21 -0.47 113.55 115.72 1q2r h SER 170 Ca -0.00 -0.07 -0.03 0.00 -0.47 0.00 0.00 61.79 61.22 1q2r h SER 170 Cb 0.35 -0.11 -0.04 0.00 -0.31 0.00 0.00 62.40 62.29 1q2r h SER 170 CO 0.01 0.37 0.41 0.77 -0.87 0.00 0.00 176.83 177.52 1q2r h SER 171 N 0.44 1.09 -0.21 4.97 4.64 -1.55 0.19 113.55 123.11 1q2r h SER 171 Ca 0.12 -0.13 0.00 0.00 -0.47 0.00 0.00 61.79 61.31 1q2r h SER 171 Cb 0.03 -0.28 -0.01 0.00 -0.31 0.00 0.00 62.40 61.83 1q2r h SER 171 CO -0.02 0.91 0.13 -0.03 -0.87 0.00 0.00 176.83 176.95 1q2r h MET 172 N 1.18 0.28 -0.75 4.77 -1.53 -1.04 0.18 114.93 118.03 1q2r h MET 172 Ca 0.29 -0.02 -0.03 0.00 -3.44 0.00 0.00 59.70 56.49 1q2r h MET 172 Cb 0.10 -0.06 -0.03 0.00 -0.55 0.00 0.00 31.60 31.06 1q2r h MET 172 CO -0.04 0.21 0.34 0.93 0.14 0.00 0.00 176.91 178.50 1q2r h GLU 173 N 0.27 1.09 -0.17 0.39 5.08 -0.59 -0.09 114.58 120.57 1q2r h GLU 173 Ca 0.08 -0.17 -0.00 0.00 -1.00 0.00 0.00 59.36 58.26 1q2r h GLU 173 Cb -0.00 -0.19 -0.01 0.00 0.50 0.00 0.00 28.75 29.05 1q2r h GLU 173 CO -0.02 0.86 0.10 -0.09 -1.00 0.00 0.00 179.01 178.87 1q2r h ARG 174 N 1.06 0.24 -0.63 2.33 9.65 -0.22 -1.75 114.38 125.06 1q2r h ARG 174 Ca 0.26 -0.02 0.06 0.00 -1.10 0.00 0.00 59.98 59.17 1q2r h ARG 174 Cb 0.14 -0.05 -0.05 0.00 -1.39 0.00 0.00 29.97 28.62 1q2r h ARG 174 CO -0.03 0.22 0.34 0.77 2.80 0.00 0.00 179.97 184.07 1q2r h SER 175 N 0.19 0.49 -0.67 -3.80 0.02 -0.20 0.69 113.55 110.28 1q2r h SER 175 Ca 0.06 0.03 -0.02 0.00 -0.84 0.00 0.00 61.79 61.02 1q2r h SER 175 Cb 0.05 -0.06 -0.03 0.00 0.14 0.00 0.00 62.40 62.49 1q2r h SER 175 CO -0.01 0.32 0.34 0.24 -1.14 0.00 0.00 176.83 176.58 1q2r h MET 176 N 0.63 0.97 -0.40 3.45 2.86 -0.77 0.56 114.93 122.22 1q2r h MET 176 Ca 0.29 -0.12 -0.05 0.00 -2.06 0.00 0.00 59.70 57.76 1q2r h MET 176 Cb 0.19 -0.18 -0.02 0.00 0.06 0.00 0.00 31.60 31.65 1q2r h MET 176 CO -0.19 0.74 0.07 0.00 1.06 0.00 0.00 176.91 178.60 1q2r h ARG 177 N 0.97 0.66 0.00 1.72 3.08 -0.24 -2.11 114.38 118.45 1q2r h ARG 177 Ca 0.24 -0.17 -0.07 0.00 0.07 0.00 0.00 59.98 60.05 1q2r h ARG 177 Cb 0.08 -0.08 -0.01 0.00 0.08 0.00 0.00 29.97 30.04 1q2r h ARG 177 CO -0.03 0.70 -0.35 -1.49 -1.07 0.00 0.00 179.97 177.73 1q2r h TRP 178 N 0.51 0.00 -0.93 3.04 6.55 -0.15 -2.11 115.95 122.86 1q2r h TRP 178 Ca 0.12 0.00 0.01 0.00 0.95 0.00 0.00 58.89 59.98 1q2r h TRP 178 Cb 0.35 0.00 -0.05 0.00 -0.86 0.00 0.00 29.16 28.61 1q2r h TRP 178 CO 0.02 0.35 0.61 0.00 -1.05 0.00 0.00 178.44 178.37 1q2r h ALA 179 N 1.65 1.35 -0.34 1.49 0.00 0.75 0.26 119.26 124.43 1q2r h ALA 179 Ca -0.00 -0.06 -0.04 0.00 0.00 0.00 0.00 54.91 54.80 1q2r h ALA 179 Cb 0.63 -0.37 -0.01 0.00 0.00 0.00 0.00 17.79 18.05 1q2r h ALA 179 CO 0.04 0.59 0.04 -0.22 0.00 0.00 0.00 179.25 179.70 1q2r h LYS 180 N 1.24 0.58 -0.53 0.00 1.63 -0.95 -0.13 116.57 118.41 1q2r h LYS 180 Ca 0.35 -0.16 -0.10 0.00 -0.85 0.00 0.00 60.65 59.88 1q2r h LYS 180 Cb -0.11 -0.06 -0.02 0.00 -0.60 0.00 0.00 32.23 31.44 1q2r h LYS 180 CO -0.08 0.67 -0.06 0.00 -3.45 0.00 0.00 179.45 176.53 1q2r h ARG 181 N 0.41 0.95 0.20 1.90 3.08 -1.22 -0.68 114.38 119.01 1q2r h ARG 181 Ca 0.10 -0.32 -0.01 0.00 0.07 0.00 0.00 59.98 59.83 1q2r h ARG 181 Cb 0.38 -0.08 0.00 0.00 0.08 0.00 0.00 29.97 30.36 1q2r h ARG 181 CO 0.01 0.98 -0.09 0.77 -1.07 0.00 0.00 179.97 180.56 1q2r h SER 182 N 0.86 -0.22 -0.20 7.04 0.02 -0.32 0.16 113.55 120.89 1q2r h SER 182 Ca 0.15 -0.00 0.05 0.00 -0.84 0.00 0.00 61.79 61.14 1q2r h SER 182 Cb 0.59 0.06 -0.05 0.00 0.14 0.00 0.00 62.40 63.14 1q2r h SER 182 CO 0.04 -0.15 -0.11 -0.09 -1.14 0.00 0.00 176.83 175.38 1q2r h ARG 183 N -0.28 -0.09 -0.29 3.45 9.65 -0.80 0.12 114.38 126.15 1q2r h ARG 183 Ca -0.03 0.01 -0.01 0.00 -1.10 0.00 0.00 59.98 58.85 1q2r h ARG 183 Cb 0.21 0.02 -0.01 0.00 -1.39 0.00 0.00 29.97 28.80 1q2r h ARG 183 CO 0.04 -0.06 0.16 -0.44 2.80 0.00 0.00 179.97 182.47 1q2r h ASP 184 N -0.09 0.36 -0.53 -3.80 3.32 -0.96 -2.28 116.42 112.43 1q2r h ASP 184 Ca 0.11 -0.09 0.04 0.00 0.02 0.00 0.00 57.03 57.11 1q2r h ASP 184 Cb 0.26 -0.09 -0.04 0.00 0.22 0.00 0.00 39.33 39.67 1q2r h ASP 184 CO -0.26 0.35 0.29 0.00 -1.72 0.00 0.00 179.24 177.90 1q2r h ALA 185 N 1.03 0.69 -0.60 3.45 0.00 -0.29 -1.05 119.26 122.49 1q2r h ALA 185 Ca 0.10 0.01 0.03 0.00 0.00 0.00 0.00 54.91 55.05 1q2r h ALA 185 Cb 0.07 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 17.72 1q2r h ALA 185 CO -0.02 -0.04 0.39 0.35 0.00 0.00 0.00 179.25 179.94 1q2r h PHE 186 N 0.56 0.68 0.00 0.00 3.04 -0.51 -1.67 116.94 119.04 1q2r h PHE 186 Ca 0.23 0.02 0.00 0.00 3.98 0.00 0.00 57.97 62.20 1q2r h PHE 186 Cb 0.10 -0.23 0.00 0.00 2.56 0.00 0.00 35.95 38.39 1q2r h PHE 186 CO -0.09 0.40 0.00 -0.44 -2.02 0.00 0.00 178.31 176.17 1q2r h ASP 187 N 0.71 0.00 0.38 0.41 3.32 -0.63 -3.24 116.42 117.38 1q2r h ASP 187 Ca 0.24 0.00 -0.08 0.00 0.02 0.00 0.00 57.03 57.21 1q2r h ASP 187 Cb 0.06 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.60 1q2r h ASP 187 CO -0.06 0.00 -0.36 0.77 -1.72 0.00 0.00 179.24 177.87 1q2r h SER 188 N 0.00 0.00 -3.42 6.45 4.64 -0.58 -3.40 113.55 117.24 1q2r h SER 188 Ca 0.00 0.00 -0.73 0.00 -0.47 0.00 0.00 61.79 60.59 1q2r h SER 188 Cb 0.66 0.00 -0.22 0.00 -0.31 0.00 0.00 62.40 62.53 1q2r h SER 188 CO 0.00 0.36 -0.39 -0.13 -0.87 0.00 0.00 176.83 175.80 1q2r s ARG 189 N -4.18 2.95 0.13 4.77 0.52 -1.22 -4.97 118.95 116.95 1q2r s ARG 189 Ca -0.03 -1.19 -0.23 0.00 -0.52 0.00 0.00 55.73 53.77 1q2r s ARG 189 Cb 0.14 -4.02 -0.03 0.00 0.52 0.00 0.00 34.95 31.55 1q2r s ARG 189 CO 0.72 -0.88 1.67 0.87 0.02 0.00 0.00 175.30 177.70 1q2r h LYS 190 N 8.66 -0.21 -0.72 3.54 1.57 -1.87 0.34 116.57 127.88 1q2r h LYS 190 Ca -0.27 0.01 0.14 0.00 -1.87 0.00 0.00 60.65 58.66 1q2r h LYS 190 Cb 1.11 0.05 -0.14 0.00 0.08 0.00 0.00 32.23 33.33 1q2r h LYS 190 CO 0.79 -0.14 -0.18 0.93 -0.57 0.00 0.00 179.45 180.28 1q2r h GLU 191 N -0.22 -0.00 0.56 3.15 4.39 -1.96 0.31 114.58 120.81 1q2r h GLU 191 Ca 0.08 0.00 -0.03 0.00 0.34 0.00 0.00 59.36 59.75 1q2r h GLU 191 Cb 0.33 0.00 0.01 0.00 -0.10 0.00 0.00 28.75 28.99 1q2r h GLU 191 CO -0.22 -0.00 -0.27 0.37 -1.16 0.00 0.00 179.01 177.73 1q2r h GLN 192 N -0.00 -0.73 -0.54 2.33 4.15 -1.70 -2.82 115.11 115.80 1q2r h GLN 192 Ca 0.35 0.05 0.16 0.00 0.77 0.00 0.00 58.65 59.97 1q2r h GLN 192 Cb 0.53 0.17 -0.02 0.00 0.21 0.00 0.00 27.48 28.36 1q2r h GLN 192 CO -0.74 -0.46 0.41 0.00 -1.93 0.00 0.00 178.83 176.10 1q2r h ALA 193 N -1.10 2.47 0.00 3.38 0.00 0.10 0.28 119.26 124.39 1q2r h ALA 193 Ca -0.08 -0.02 -0.03 0.00 0.00 0.00 0.00 54.91 54.79 1q2r h ALA 193 Cb 0.61 0.04 -0.00 0.00 0.00 0.00 0.00 17.79 18.43 1q2r h ALA 193 CO 0.13 -0.68 -0.81 0.93 0.00 0.00 0.00 179.25 178.81 1q2r h GLU 194 N 0.00 0.00 0.00 0.00 5.08 -0.44 -3.39 114.58 115.83 1q2r h GLU 194 Ca 0.26 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.60 1q2r h GLU 194 Cb 1.07 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.31 1q2r h GLU 194 CO -0.00 0.06 -1.28 0.09 -1.00 0.00 0.00 179.01 176.88 1q2r n ASN 195 N -2.82 3.68 -4.87 1.42 3.02 -0.75 -4.81 115.26 110.12 1q2r n ASN 195 Ca -0.00 0.00 -0.21 0.00 -0.03 0.00 0.00 54.58 54.34 1q2r n ASN 195 Cb 0.59 1.17 -0.03 0.00 -0.61 0.00 0.00 39.78 40.90 1q2r n ASN 195 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1q2r s ALA 196 N -2.36 4.06 0.26 5.41 0.00 0.91 -4.78 121.76 125.26 1q2r s ALA 196 Ca -0.02 -1.89 0.11 0.00 0.00 0.00 0.00 51.96 50.16 1q2r s ALA 196 Cb 0.03 -1.00 -0.05 0.00 0.00 0.00 0.00 23.12 22.11 1q2r s ALA 196 CO 0.24 -0.23 -0.17 0.00 0.00 0.00 0.00 175.76 175.60 1q2r s ALA 197 N -2.48 2.79 -0.02 0.00 0.00 0.24 -4.74 121.76 117.55 1q2r s ALA 197 Ca 0.48 -1.79 0.04 0.00 0.00 0.00 0.00 51.96 50.69 1q2r s ALA 197 Cb -0.03 -0.37 -0.01 0.00 0.00 0.00 0.00 23.12 22.72 1q2r s ALA 197 CO 0.28 0.31 -0.16 -1.17 0.00 0.00 0.00 175.76 175.02 1q2r s LEU 198 N -3.38 1.96 0.14 0.00 2.96 -1.26 -0.36 118.68 118.75 1q2r s LEU 198 Ca 0.29 -0.30 0.10 0.00 -0.22 0.00 0.00 54.13 54.00 1q2r s LEU 198 Cb -0.06 -0.84 -0.04 0.00 0.50 0.00 0.00 46.19 45.75 1q2r s LEU 198 CO 0.15 0.17 -0.22 -0.36 -1.32 0.00 0.00 176.35 174.77 1q2r s PHE 199 N -0.17 2.41 -0.03 5.38 0.40 -0.10 -0.72 117.98 125.14 1q2r s PHE 199 Ca 0.02 -0.32 0.03 0.00 -0.60 0.00 0.00 56.93 56.06 1q2r s PHE 199 Cb -0.08 -1.26 -0.03 0.00 0.51 0.00 0.00 43.02 42.16 1q2r s PHE 199 CO 0.00 0.41 -0.11 0.20 0.70 0.00 0.00 175.22 176.42 1q2r s GLY 200 N -2.29 1.63 -0.22 4.36 0.00 -0.72 -1.93 107.32 108.14 1q2r s GLY 200 Ca 0.18 -0.98 -0.08 0.00 0.00 0.00 0.00 44.72 43.84 1q2r s GLY 200 CO 0.09 -0.79 0.08 -0.42 0.00 0.00 0.00 173.10 172.06 1q2r s ILE 201 N -0.83 4.65 0.03 0.90 1.01 -1.26 -0.80 121.20 124.89 1q2r s ILE 201 Ca 0.13 -0.07 -0.21 0.00 0.00 0.00 0.00 60.65 60.50 1q2r s ILE 201 Cb -0.11 -3.14 -0.06 0.00 0.01 0.00 0.00 42.46 39.16 1q2r s ILE 201 CO 0.03 0.38 0.63 -1.58 0.00 0.00 0.00 174.94 174.40 1q2r s GLN 202 N 1.07 4.35 0.00 2.79 0.74 0.22 -4.88 119.66 123.94 1q2r s GLN 202 Ca 0.05 0.82 0.00 0.00 0.05 0.00 0.00 55.36 56.28 1q2r s GLN 202 Cb -0.14 -3.33 0.00 0.00 1.10 0.00 0.00 33.01 30.64 1q2r s GLN 202 CO 0.03 0.40 0.00 1.04 -0.55 0.00 0.00 175.29 176.22 1q2r n GLN 203 N 2.53 2.21 0.00 1.67 1.13 -1.26 -1.22 117.38 122.45 1q2r n GLN 203 Ca -0.06 0.00 0.00 0.00 -1.94 0.00 0.00 57.00 55.00 1q2r n GLN 203 Cb 0.51 0.00 0.00 0.00 0.11 0.00 0.00 30.24 30.86 1q2r n GLN 203 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1q2r n GLY 204 N 5.00 0.81 7.00 1.08 0.00 -1.26 -4.14 105.19 113.69 1q2r n GLY 204 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1q2r n GLY 204 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1q2r n SER 205 N 0.00 0.00 0.19 1.61 2.88 -1.26 -2.65 113.62 114.39 1q2r n SER 205 Ca 0.00 0.00 0.08 0.00 -1.33 0.00 0.00 58.87 57.62 1q2r n SER 205 Cb 0.00 0.00 0.17 0.00 -0.75 0.00 0.00 64.21 63.63 1q2r n SER 205 CO 0.00 0.00 0.00 0.58 -1.23 0.00 0.00 175.04 174.39 1q2r h VAL 206 N 0.00 0.42 -2.97 2.46 2.07 -1.94 -3.45 116.25 112.84 1q2r h VAL 206 Ca 0.00 -1.49 -0.57 0.00 0.82 0.00 0.00 66.70 65.46 1q2r h VAL 206 Cb 0.00 2.12 -0.04 0.00 -1.52 0.00 0.00 31.29 31.85 1q2r h VAL 206 CO 0.00 0.23 1.02 -0.36 0.02 0.00 0.00 177.57 178.48 1q2r s PHE 207 N -3.18 2.48 0.33 1.57 0.08 -1.09 -4.92 117.98 113.25 1q2r s PHE 207 Ca 0.05 0.75 0.11 0.00 0.12 0.00 0.00 56.93 57.96 1q2r s PHE 207 Cb 0.07 -3.89 0.57 0.00 -0.57 0.00 0.00 43.02 39.20 1q2r s PHE 207 CO 0.69 -2.20 1.74 1.05 -0.10 0.00 0.00 175.22 176.40 1q2r h GLU 208 N 9.67 0.02 -0.40 0.44 4.11 -1.87 -2.17 114.58 124.39 1q2r h GLU 208 Ca -0.29 -0.01 -0.01 0.00 0.07 0.00 0.00 59.36 59.12 1q2r h GLU 208 Cb 1.12 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 30.35 1q2r h GLU 208 CO 1.01 0.48 0.21 -2.95 0.07 0.00 0.00 179.01 177.84 1q2r h ASN 209 N 0.02 0.51 -0.63 3.06 -1.07 -1.94 0.72 115.58 116.24 1q2r h ASN 209 Ca -0.00 -0.10 -0.01 0.00 0.07 0.00 0.00 56.30 56.26 1q2r h ASN 209 Cb 0.82 -0.13 -0.03 0.00 -2.07 0.00 0.00 38.32 36.91 1q2r h ASN 209 CO 0.06 0.46 0.34 -0.07 0.07 0.00 0.00 177.43 178.29 1q2r h LEU 210 N 0.51 0.79 0.15 6.14 4.07 -1.83 -0.16 115.31 125.00 1q2r h LEU 210 Ca 0.14 -0.10 0.00 0.00 0.08 0.00 0.00 57.88 58.00 1q2r h LEU 210 Cb 0.07 -0.20 -0.01 0.00 1.08 0.00 0.00 40.66 41.59 1q2r h LEU 210 CO -0.02 0.67 -0.14 0.03 -1.08 0.00 0.00 178.44 177.90 1q2r h ARG 211 N 0.86 -0.30 -0.38 1.13 2.47 -0.72 0.16 114.38 117.60 1q2r h ARG 211 Ca 0.22 0.02 0.08 0.00 -1.26 0.00 0.00 59.98 59.04 1q2r h ARG 211 Cb 0.05 0.07 -0.07 0.00 -1.65 0.00 0.00 29.97 28.37 1q2r h ARG 211 CO -0.03 -0.20 -0.10 0.37 0.56 0.00 0.00 179.97 180.57 1q2r h GLN 212 N -0.31 -0.00 0.32 0.04 5.75 0.84 0.65 115.11 122.40 1q2r h GLN 212 Ca -0.00 0.00 -0.01 0.00 -0.15 0.00 0.00 58.65 58.49 1q2r h GLN 212 Cb 0.29 0.00 -0.01 0.00 1.07 0.00 0.00 27.48 28.83 1q2r h GLN 212 CO -0.03 -0.00 -0.25 1.96 -2.65 0.00 0.00 178.83 177.86 1q2r h GLN 213 N -0.00 -0.56 -0.72 1.69 4.20 -0.76 0.11 115.11 119.06 1q2r h GLN 213 Ca 0.18 0.04 0.16 0.00 0.06 0.00 0.00 58.65 59.09 1q2r h GLN 213 Cb 0.28 0.13 -0.12 0.00 0.30 0.00 0.00 27.48 28.06 1q2r h GLN 213 CO -0.39 -0.37 0.04 1.03 -0.67 0.00 0.00 178.83 178.47 1q2r h SER 214 N -0.58 -0.26 0.21 1.46 0.87 0.22 0.57 113.55 116.05 1q2r h SER 214 Ca -0.02 0.18 -0.01 0.00 -1.23 0.00 0.00 61.79 60.70 1q2r h SER 214 Cb 0.51 0.30 0.00 0.00 -0.44 0.00 0.00 62.40 62.77 1q2r h SER 214 CO -0.01 -0.14 -0.10 0.00 -0.53 0.00 0.00 176.83 176.05 1q2r h ALA 215 N 1.66 -0.29 -0.07 6.23 0.00 0.96 0.56 119.26 128.32 1q2r h ALA 215 Ca 0.40 -0.07 0.02 0.00 0.00 0.00 0.00 54.91 55.26 1q2r h ALA 215 Cb 0.69 0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.57 1q2r h ALA 215 CO -0.61 -0.65 -0.05 -0.44 0.00 0.00 0.00 179.25 177.50 1q2r h ASP 216 N -0.30 -0.15 0.08 0.00 3.32 0.11 0.49 116.42 119.98 1q2r h ASP 216 Ca -0.03 0.03 0.02 0.00 0.02 0.00 0.00 57.03 57.08 1q2r h ASP 216 Cb 0.23 0.08 -0.05 0.00 0.22 0.00 0.00 39.33 39.82 1q2r h ASP 216 CO 0.05 -0.07 -0.35 0.00 -1.72 0.00 0.00 179.24 177.15 1q2r h ALA 217 N 1.01 -0.59 -0.53 3.45 0.00 0.15 0.25 119.26 123.00 1q2r h ALA 217 Ca 0.04 -0.05 0.08 0.00 0.00 0.00 0.00 54.91 54.99 1q2r h ALA 217 Cb 0.12 0.60 -0.07 0.00 0.00 0.00 0.00 17.79 18.44 1q2r h ALA 217 CO -0.10 -0.90 0.15 -0.07 0.00 0.00 0.00 179.25 178.34 1q2r h LEU 218 N -0.56 0.10 -1.04 0.00 4.07 -0.52 -0.67 115.31 116.70 1q2r h LEU 218 Ca 0.04 0.08 0.02 0.00 0.08 0.00 0.00 57.88 58.09 1q2r h LEU 218 Cb 0.61 0.09 -0.05 0.00 1.08 0.00 0.00 40.66 42.39 1q2r h LEU 218 CO -0.23 0.08 0.65 0.00 -1.08 0.00 0.00 178.44 177.85 1q2r h ALA 219 N 1.39 1.32 -0.10 1.53 0.00 0.64 -0.97 119.26 123.07 1q2r h ALA 219 Ca 0.27 -0.06 0.03 0.00 0.00 0.00 0.00 54.91 55.15 1q2r h ALA 219 Cb 0.34 -0.39 -0.04 0.00 0.00 0.00 0.00 17.79 17.70 1q2r h ALA 219 CO -0.31 0.62 -0.12 1.49 0.00 0.00 0.00 179.25 180.94 1q2r h GLU 220 N 1.31 -0.15 0.68 0.00 4.57 0.10 -3.03 114.58 118.07 1q2r h GLU 220 Ca 0.37 0.01 -0.03 0.00 -1.18 0.00 0.00 59.36 58.52 1q2r h GLU 220 Cb -0.12 0.03 0.01 0.00 -0.16 0.00 0.00 28.75 28.51 1q2r h GLU 220 CO -0.09 -0.10 -0.33 0.82 -1.18 0.00 0.00 179.01 178.14 1q2r h ILE 221 N -0.15 0.26 -0.01 2.32 2.04 -1.01 -3.50 117.51 117.46 1q2r h ILE 221 Ca 0.08 -0.17 0.00 0.00 1.00 0.00 0.00 64.86 65.77 1q2r h ILE 221 Cb 0.26 0.31 0.00 0.00 -0.74 0.00 0.00 36.82 36.65 1q2r h ILE 221 CO -0.19 0.02 0.00 0.61 0.00 0.00 0.00 178.15 178.59 1q2r n GLY 222 N -1.12 1.41 3.13 5.37 0.00 -0.41 -5.13 105.19 108.44 1q2r n GLY 222 Ca -0.13 -1.30 -0.09 0.00 0.00 0.00 0.00 46.02 44.51 1q2r n GLY 222 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1q2r s PHE 223 N -0.02 0.69 -0.47 1.61 0.08 -1.26 -5.02 117.98 113.59 1q2r s PHE 223 Ca 0.00 -1.05 0.25 0.00 0.12 0.00 0.00 56.93 56.24 1q2r s PHE 223 Cb 0.00 -0.45 0.98 0.00 -0.57 0.00 0.00 43.02 42.98 1q2r s PHE 223 CO 0.00 -0.34 1.74 -0.44 -0.10 0.00 0.00 175.22 176.09 1q2r h ASP 224 N 3.04 0.00 -4.77 1.36 3.32 -1.31 -3.45 116.42 114.61 1q2r h ASP 224 Ca -0.35 0.00 0.05 0.00 0.02 0.00 0.00 57.03 56.75 1q2r h ASP 224 Cb 1.16 0.00 -0.15 0.00 0.22 0.00 0.00 39.33 40.56 1q2r h ASP 224 CO 0.65 0.00 0.37 -0.83 -1.72 0.00 0.00 179.24 177.71 1q2r s GLY 225 N -3.61 -0.52 -0.08 2.75 0.00 -1.16 -4.49 107.32 100.21 1q2r s GLY 225 Ca 0.05 0.89 0.03 0.00 0.00 0.00 0.00 44.72 45.68 1q2r s GLY 225 CO 0.44 0.34 -0.16 -0.19 0.00 0.00 0.00 173.10 173.53 1q2r s TYR 226 N -3.15 1.83 -0.01 1.90 1.51 -0.77 -1.76 117.35 116.91 1q2r s TYR 226 Ca 0.02 -0.73 0.04 0.00 -1.01 0.00 0.00 57.07 55.39 1q2r s TYR 226 Cb -0.01 -1.29 -0.03 0.00 -0.11 0.00 0.00 41.96 40.52 1q2r s TYR 226 CO -0.09 -0.34 -0.11 0.00 -1.11 0.00 0.00 175.55 173.90 1q2r s ALA 227 N 0.62 2.85 -0.42 3.71 0.00 0.02 -1.68 121.76 126.86 1q2r s ALA 227 Ca -0.15 -1.04 -0.19 0.00 0.00 0.00 0.00 51.96 50.59 1q2r s ALA 227 Cb -0.16 -1.02 0.02 0.00 0.00 0.00 0.00 23.12 21.96 1q2r s ALA 227 CO 0.04 0.59 0.53 0.08 0.00 0.00 0.00 175.76 177.00 1q2r s VAL 228 N -0.91 4.97 0.18 0.00 1.01 0.10 -0.61 120.40 125.14 1q2r s VAL 228 Ca 0.15 -0.07 0.03 0.00 0.00 0.00 0.00 61.98 62.08 1q2r s VAL 228 Cb -0.11 -4.10 0.03 0.00 0.00 0.00 0.00 36.38 32.20 1q2r s VAL 228 CO 0.05 -0.47 0.23 0.61 0.00 0.00 0.00 175.10 175.52 1q2r n GLY 229 N 5.04 2.06 2.40 4.51 0.00 -0.35 -2.83 105.19 116.03 1q2r n GLY 229 Ca -0.05 -2.17 -0.16 0.00 0.00 0.00 0.00 46.02 43.65 1q2r n GLY 229 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1q2r n GLY 230 N 2.85 -0.32 3.64 -0.02 0.00 -1.26 -4.77 105.19 105.31 1q2r n GLY 230 Ca 0.04 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.77 1q2r n GLY 230 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1q2r s LEU 231 N -5.63 2.17 -1.48 0.99 1.43 -1.26 -4.70 118.68 110.20 1q2r s LEU 231 Ca 0.00 -1.65 -0.13 0.00 -1.03 0.00 0.00 54.13 51.32 1q2r s LEU 231 Cb 0.00 -0.44 0.10 0.00 0.03 0.00 0.00 46.19 45.88 1q2r s LEU 231 CO 0.00 -0.88 0.74 0.00 0.23 0.00 0.00 176.35 176.44 1q2r n ALA 232 N -1.08 -1.17 -1.05 4.21 0.00 -1.26 -4.83 120.51 115.32 1q2r n ALA 232 Ca -0.12 0.11 0.10 0.00 0.00 0.00 0.00 53.44 53.52 1q2r n ALA 232 Cb 0.66 -3.60 0.17 0.00 0.00 0.00 0.00 19.45 16.68 1q2r n ALA 232 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 177.50 179.05 1q2r n VAL 233 N -4.32 1.99 0.00 0.00 3.14 -1.26 -4.92 118.33 112.95 1q2r n VAL 233 Ca 0.03 -2.17 0.00 0.00 -2.96 0.00 0.00 64.34 59.23 1q2r n VAL 233 Cb 0.53 -0.24 0.00 0.00 -1.06 0.00 0.00 33.84 33.06 1q2r n VAL 233 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 1q2r n GLY 234 N -1.21 1.00 0.27 7.55 0.00 -1.26 -4.78 105.19 106.77 1q2r n GLY 234 Ca 0.17 0.00 0.15 0.00 0.00 0.00 0.00 46.02 46.34 1q2r n GLY 234 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 1q2r n GLU 235 N 0.00 1.38 -0.02 1.61 0.00 -1.26 -5.03 120.64 117.32 1q2r n GLU 235 Ca 0.00 -0.55 0.00 0.00 0.00 0.00 0.00 57.16 56.61 1q2r n GLU 235 Cb 0.00 -1.48 -0.00 0.00 0.00 0.00 0.00 31.44 29.96 1q2r n GLU 235 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 1q2r n GLY 236 N 1.09 -2.71 0.29 -1.84 0.00 -1.26 -3.89 105.19 96.87 1q2r n GLY 236 Ca 0.21 -1.38 0.00 0.00 0.00 0.00 0.00 46.02 44.85 1q2r n GLY 236 CO 0.00 0.00 0.00 -1.61 0.00 0.00 0.00 173.32 171.71 1q2r h GLN 237 N -0.01 0.59 0.69 1.61 4.15 -1.99 -2.33 115.11 117.82 1q2r h GLN 237 Ca -0.00 -0.10 -0.03 0.00 0.77 0.00 0.00 58.65 59.29 1q2r h GLN 237 Cb 0.01 -0.10 -0.00 0.00 0.21 0.00 0.00 27.48 27.60 1q2r h GLN 237 CO 0.00 0.54 -0.41 -0.44 -1.93 0.00 0.00 178.83 176.59 1q2r h ASP 238 N 0.58 -1.02 -0.38 -0.69 5.19 -2.00 -0.73 116.42 117.37 1q2r h ASP 238 Ca 0.13 0.05 0.04 0.00 -0.62 0.00 0.00 57.03 56.64 1q2r h ASP 238 Cb 0.22 0.29 -0.04 0.00 0.18 0.00 0.00 39.33 39.98 1q2r h ASP 238 CO -0.00 -0.64 0.15 -0.33 -3.12 0.00 0.00 179.24 175.30 1q2r h GLU 239 N -1.03 0.31 -0.40 3.56 4.39 -1.65 -0.74 114.58 119.02 1q2r h GLU 239 Ca -0.09 -0.02 0.07 0.00 0.34 0.00 0.00 59.36 59.66 1q2r h GLU 239 Cb 0.83 -0.07 -0.06 0.00 -0.10 0.00 0.00 28.75 29.34 1q2r h GLU 239 CO 0.10 0.21 0.02 1.98 -1.16 0.00 0.00 179.01 180.16 1q2r h MET 240 N 0.32 0.12 -0.78 2.33 4.05 -1.27 0.26 114.93 119.97 1q2r h MET 240 Ca 0.17 -0.01 -0.03 0.00 -0.28 0.00 0.00 59.70 59.55 1q2r h MET 240 Cb 0.12 -0.03 -0.04 0.00 -0.80 0.00 0.00 31.60 30.86 1q2r h MET 240 CO -0.15 0.08 0.37 0.74 0.23 0.00 0.00 176.91 178.18 1q2r h PHE 241 N 0.13 1.13 -0.86 1.39 0.04 -0.76 0.85 116.94 118.86 1q2r h PHE 241 Ca 0.19 -0.06 0.00 0.00 2.80 0.00 0.00 57.97 60.91 1q2r h PHE 241 Cb 0.27 -0.35 -0.04 0.00 2.20 0.00 0.00 35.95 38.03 1q2r h PHE 241 CO -0.25 0.83 0.54 -0.09 -0.60 0.00 0.00 178.31 178.74 1q2r h ARG 242 N 1.10 1.15 -0.09 1.51 2.43 0.41 0.70 114.38 121.60 1q2r h ARG 242 Ca 0.27 -0.09 -0.20 0.00 -0.81 0.00 0.00 59.98 59.14 1q2r h ARG 242 Cb 0.13 -0.25 0.00 0.00 -0.42 0.00 0.00 29.97 29.43 1q2r h ARG 242 CO -0.03 0.79 -0.77 0.28 -1.51 0.00 0.00 179.97 178.73 1q2r h VAL 243 N 1.17 1.35 -0.15 0.20 2.07 -0.20 -3.05 116.25 117.64 1q2r h VAL 243 Ca 0.31 -2.14 -0.05 0.00 0.82 0.00 0.00 66.70 65.64 1q2r h VAL 243 Cb -0.08 2.12 -0.01 0.00 -1.52 0.00 0.00 31.29 31.80 1q2r h VAL 243 CO -0.06 0.65 -0.15 -0.07 0.02 0.00 0.00 177.57 177.96 1q2r h LEU 244 N 0.34 0.23 -0.89 2.57 3.38 -0.28 0.77 115.31 121.44 1q2r h LEU 244 Ca -0.04 -0.05 0.06 0.00 0.09 0.00 0.00 57.88 57.93 1q2r h LEU 244 Cb 1.37 -0.06 -0.06 0.00 0.09 0.00 0.00 40.66 41.99 1q2r h LEU 244 CO 0.14 0.41 0.56 0.44 0.09 0.00 0.00 178.44 180.08 1q2r h ASP 245 N 0.23 0.89 0.00 -0.43 3.32 -0.76 -2.90 116.42 116.77 1q2r h ASP 245 Ca 0.05 0.01 -0.00 0.00 0.02 0.00 0.00 57.03 57.11 1q2r h ASP 245 Cb 0.41 -0.17 -0.00 0.00 0.22 0.00 0.00 39.33 39.78 1q2r h ASP 245 CO 0.02 0.57 -1.95 2.22 -1.72 0.00 0.00 179.24 178.38 1q2r n PHE 246 N -4.59 0.00 0.09 4.55 1.16 -1.05 -4.53 117.46 113.09 1q2r n PHE 246 Ca 0.13 0.00 -0.10 0.00 -1.87 0.00 0.00 57.45 55.61 1q2r n PHE 246 Cb 0.17 -0.48 -0.06 0.00 -1.61 0.00 0.00 39.48 37.50 1q2r n PHE 246 CO 0.00 0.00 0.00 0.77 -1.87 0.00 0.00 176.76 175.66 1q2r h SER 247 N 0.00 -0.26 -0.63 5.98 0.02 -0.80 -3.31 113.55 114.54 1q2r h SER 247 Ca -0.00 -0.23 0.13 0.00 -0.84 0.00 0.00 61.79 60.85 1q2r h SER 247 Cb 0.96 0.07 -0.11 0.00 0.14 0.00 0.00 62.40 63.45 1q2r h SER 247 CO 0.00 0.25 -0.08 0.58 -1.14 0.00 0.00 176.83 176.45 1q2r h VAL 248 N -0.95 0.42 -0.99 2.27 2.07 -1.74 -0.82 116.25 116.50 1q2r h VAL 248 Ca -0.03 -0.02 0.18 0.00 0.82 0.00 0.00 66.70 67.65 1q2r h VAL 248 Cb 0.48 0.36 -0.10 0.00 -1.52 0.00 0.00 31.29 30.51 1q2r h VAL 248 CO 0.05 0.01 0.61 -0.65 0.02 0.00 0.00 177.57 177.62 1q2r h PRO 249 N 0.05 0.71 -0.00 1.57 0.11 -1.80 -0.03 132.00 132.61 1q2r h PRO 249 Ca 0.32 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 66.39 1q2r h PRO 249 Cb 0.52 -0.16 -0.00 0.00 0.11 0.00 0.00 31.00 31.47 1q2r h PRO 249 CO -0.60 0.47 0.00 0.52 -0.21 0.00 0.00 178.00 178.18 1q2r h MET 250 N 0.73 0.00 -6.59 1.05 2.86 -1.23 -3.43 114.93 108.32 1q2r h MET 250 Ca 0.55 0.00 -0.52 0.00 -2.06 0.00 0.00 59.70 57.67 1q2r h MET 250 Cb 0.90 0.00 -0.03 0.00 0.06 0.00 0.00 31.60 32.53 1q2r h MET 250 CO -0.33 0.00 0.17 -0.51 1.06 0.00 0.00 176.91 177.30 1q2r s LEU 251 N -7.97 4.44 -0.39 1.22 1.43 -0.03 -4.83 118.68 112.56 1q2r s LEU 251 Ca -0.05 1.56 -0.42 0.00 -1.03 0.00 0.00 54.13 54.19 1q2r s LEU 251 Cb 0.16 -3.52 -0.17 0.00 0.03 0.00 0.00 46.19 42.68 1q2r s LEU 251 CO 0.57 0.09 1.83 -2.65 0.23 0.00 0.00 176.35 176.42 1q2r n PRO 252 N 1.06 0.62 -0.31 1.29 -0.02 -1.26 -4.87 135.00 131.50 1q2r n PRO 252 Ca -0.03 0.21 -0.04 0.00 -2.02 0.00 0.00 63.50 61.62 1q2r n PRO 252 Cb 0.50 -1.87 0.08 0.00 -0.02 0.00 0.00 33.50 32.18 1q2r n PRO 252 CO 0.00 0.00 0.00 0.22 1.98 0.00 0.00 175.50 177.70 1q2r h ASP 253 N 7.52 1.01 0.00 2.55 3.58 -1.92 -2.69 116.42 126.48 1q2r h ASP 253 Ca -0.37 -0.06 0.00 0.00 0.42 0.00 0.00 57.03 57.01 1q2r h ASP 253 Cb 1.35 -0.26 0.00 0.00 1.72 0.00 0.00 39.33 42.14 1q2r h ASP 253 CO 1.00 0.78 0.00 -0.90 -2.88 0.00 0.00 179.24 177.23 1q2r n ASP 254 N -4.44 0.07 -4.33 2.28 5.75 -1.26 -4.73 116.55 109.89 1q2r n ASP 254 Ca 0.09 -1.26 -0.25 0.00 -0.01 0.00 0.00 54.79 53.35 1q2r n ASP 254 Cb 0.05 -0.04 -0.13 0.00 -1.03 0.00 0.00 41.12 39.98 1q2r n ASP 254 CO 0.00 0.00 0.00 -0.54 -0.11 0.00 0.00 177.20 176.55 1q2r s LYS 255 N -1.89 1.24 0.30 0.11 -0.14 -1.02 -4.94 119.74 113.40 1q2r s LYS 255 Ca 0.00 -1.25 -0.29 0.00 -1.36 0.00 0.00 55.97 53.06 1q2r s LYS 255 Cb 0.00 -1.56 -0.10 0.00 -1.68 0.00 0.00 37.83 34.49 1q2r s LYS 255 CO 0.00 0.36 1.21 -1.25 -0.76 0.00 0.00 175.35 174.92 1q2r s PRO 256 N -2.06 4.49 -0.09 -1.68 0.04 -1.26 -4.86 135.00 129.58 1q2r s PRO 256 Ca 0.10 2.02 -0.03 0.00 0.04 0.00 0.00 61.00 63.13 1q2r s PRO 256 Cb -0.10 -3.14 -0.04 0.00 0.04 0.00 0.00 34.50 31.27 1q2r s PRO 256 CO 0.05 -0.02 0.05 -1.01 0.04 0.00 0.00 177.00 176.12 1q2r s HIS 257 N -1.03 3.30 -0.14 0.56 3.76 -1.26 -1.84 115.29 118.64 1q2r s HIS 257 Ca 0.48 0.30 -0.02 0.00 -0.15 0.00 0.00 55.06 55.67 1q2r s HIS 257 Cb -0.36 -1.83 0.04 0.00 1.11 0.00 0.00 32.58 31.54 1q2r s HIS 257 CO 0.46 0.56 -0.01 -0.47 -0.85 0.00 0.00 174.74 174.44 1q2r s TYR 258 N -0.96 1.14 -0.81 1.40 5.04 -0.67 -1.06 117.35 121.43 1q2r s TYR 258 Ca 0.15 -0.71 -0.19 0.00 -2.44 0.00 0.00 57.07 53.88 1q2r s TYR 258 Cb -0.12 -1.05 0.12 0.00 0.35 0.00 0.00 41.96 41.27 1q2r s TYR 258 CO 0.04 -0.52 0.98 -1.17 -1.34 0.00 0.00 175.55 173.54 1q2r s LEU 259 N 1.82 5.18 0.33 6.97 2.96 -0.92 0.01 118.68 135.03 1q2r s LEU 259 Ca 0.02 -1.81 -0.29 0.00 -0.22 0.00 0.00 54.13 51.83 1q2r s LEU 259 Cb -0.15 -2.36 -0.12 0.00 0.50 0.00 0.00 46.19 44.06 1q2r s LEU 259 CO -0.07 -1.09 1.47 0.23 -1.32 0.00 0.00 176.35 175.57 1q2r n MET 260 N 6.44 2.52 0.00 1.98 2.81 -1.13 -3.17 117.12 126.57 1q2r n MET 260 Ca 0.11 0.89 0.00 0.00 -1.81 0.00 0.00 57.70 56.89 1q2r n MET 260 Cb 0.47 -2.60 0.00 0.00 -0.71 0.00 0.00 33.22 30.38 1q2r n MET 260 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1q2r n GLY 261 N 1.14 2.77 3.72 3.03 0.00 -1.18 -4.78 105.19 109.90 1q2r n GLY 261 Ca 0.05 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.65 1q2r n GLY 261 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1q2r s VAL 262 N -0.83 3.90 0.00 1.61 1.01 -1.19 -4.60 120.40 120.30 1q2r s VAL 262 Ca 0.00 1.46 0.00 0.00 0.00 0.00 0.00 61.98 63.44 1q2r s VAL 262 Cb 0.00 -3.94 0.00 0.00 0.00 0.00 0.00 36.38 32.44 1q2r s VAL 262 CO 0.00 0.17 0.00 0.61 0.00 0.00 0.00 175.10 175.88 1q2r n GLY 263 N 2.75 0.64 3.73 4.51 0.00 -1.26 -3.21 105.19 112.35 1q2r n GLY 263 Ca 0.07 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.66 1q2r n GLY 263 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1q2r n LYS 264 N 0.00 2.68 -0.40 1.61 4.81 -1.26 -4.78 118.16 120.82 1q2r n LYS 264 Ca 0.00 0.96 -0.06 0.00 -0.87 0.00 0.00 58.31 58.33 1q2r n LYS 264 Cb 0.00 -2.76 -0.04 0.00 0.02 0.00 0.00 35.03 32.26 1q2r n LYS 264 CO 0.00 0.00 0.00 -2.30 1.17 0.00 0.00 177.40 176.27 1q2r n PRO 265 N 2.79 -0.34 0.27 1.64 -0.02 -1.26 -0.16 135.00 137.92 1q2r n PRO 265 Ca 0.11 1.51 0.15 0.00 -2.02 0.00 0.00 63.50 63.26 1q2r n PRO 265 Cb 0.36 -2.23 0.76 0.00 -0.02 0.00 0.00 33.50 32.37 1q2r n PRO 265 CO 0.00 0.00 0.00 0.38 1.98 0.00 0.00 175.50 177.86 1q2r h ASP 266 N 0.00 0.00 0.69 2.55 2.03 -2.00 -2.28 116.42 117.41 1q2r h ASP 266 Ca 0.24 0.00 -0.19 0.00 -0.73 0.00 0.00 57.03 56.35 1q2r h ASP 266 Cb 0.49 0.00 -0.02 0.00 -0.83 0.00 0.00 39.33 38.97 1q2r h ASP 266 CO -0.95 0.08 -0.87 0.44 -1.03 0.00 0.00 179.24 176.91 1q2r h ASP 267 N 0.00 0.16 0.18 4.15 3.32 -0.90 -2.78 116.42 120.55 1q2r h ASP 267 Ca -0.00 -0.13 -0.01 0.00 0.02 0.00 0.00 57.03 56.91 1q2r h ASP 267 Cb 0.39 -0.05 0.00 0.00 0.22 0.00 0.00 39.33 39.89 1q2r h ASP 267 CO 0.01 0.95 -0.09 0.40 -1.72 0.00 0.00 179.24 178.80 1q2r h ILE 268 N 0.06 0.92 -0.72 0.35 2.04 -0.71 -2.03 117.51 117.42 1q2r h ILE 268 Ca -0.03 -0.88 0.11 0.00 1.00 0.00 0.00 64.86 65.06 1q2r h ILE 268 Cb 1.51 1.42 -0.08 0.00 -0.74 0.00 0.00 36.82 38.93 1q2r h ILE 268 CO 0.13 0.19 0.33 0.58 0.00 0.00 0.00 178.15 179.38 1q2r h VAL 269 N -0.70 0.78 -0.56 1.67 2.07 -1.55 0.23 116.25 118.19 1q2r h VAL 269 Ca -0.02 -0.19 -0.05 0.00 0.82 0.00 0.00 66.70 67.26 1q2r h VAL 269 Cb 0.49 0.19 -0.03 0.00 -1.52 0.00 0.00 31.29 30.43 1q2r h VAL 269 CO 0.04 0.10 0.13 1.23 0.02 0.00 0.00 177.57 179.09 1q2r h GLY 270 N 0.54 0.93 1.73 2.17 0.00 -1.49 -2.47 103.07 104.48 1q2r h GLY 270 Ca 0.37 -0.55 -0.16 0.00 0.00 0.00 0.00 47.33 46.99 1q2r h GLY 270 CO -0.31 0.51 -0.66 0.00 0.00 0.00 0.00 176.54 176.08 1q2r h ALA 271 N 1.31 0.76 -0.41 3.60 0.00 -0.42 -2.64 119.26 121.46 1q2r h ALA 271 Ca 0.18 -0.58 -0.06 0.00 0.00 0.00 0.00 54.91 54.46 1q2r h ALA 271 Cb 0.31 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.00 1q2r h ALA 271 CO -0.00 0.76 0.00 0.28 0.00 0.00 0.00 179.25 180.29 1q2r h VAL 272 N 0.19 1.22 0.00 0.00 2.07 -0.78 0.02 116.25 118.97 1q2r h VAL 272 Ca -0.01 -0.89 -0.03 0.00 0.82 0.00 0.00 66.70 66.59 1q2r h VAL 272 Cb 1.19 0.91 -0.00 0.00 -1.52 0.00 0.00 31.29 31.87 1q2r h VAL 272 CO 0.10 0.31 -0.14 -0.33 0.02 0.00 0.00 177.57 177.53 1q2r h GLU 273 N 0.62 0.00 -0.01 1.57 5.08 -1.12 -2.02 114.58 118.70 1q2r h GLU 273 Ca 0.13 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.49 1q2r h GLU 273 Cb 0.39 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.64 1q2r h GLU 273 CO 0.01 0.14 -0.34 0.54 -1.00 0.00 0.00 179.01 178.36 1q2r n ARG 274 N -3.56 0.74 0.00 2.33 3.00 -0.13 -3.87 116.66 115.17 1q2r n ARG 274 Ca -0.01 -0.47 0.00 0.00 -0.01 0.00 0.00 57.85 57.36 1q2r n ARG 274 Cb 0.28 -1.49 0.00 0.00 0.00 0.00 0.00 32.46 31.25 1q2r n ARG 274 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 1q2r n GLY 275 N 1.38 0.84 3.77 -0.13 0.00 -0.66 -4.79 105.19 105.60 1q2r n GLY 275 Ca 0.11 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.78 1q2r n GLY 275 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1q2r s ILE 276 N -2.00 3.15 0.00 -0.61 -1.09 -0.47 -4.68 121.20 115.50 1q2r s ILE 276 Ca 0.00 0.67 0.00 0.00 -2.23 0.00 0.00 60.65 59.09 1q2r s ILE 276 Cb 0.00 -3.24 0.00 0.00 -1.58 0.00 0.00 42.46 37.64 1q2r s ILE 276 CO 0.00 -0.20 0.00 0.47 -1.23 0.00 0.00 174.94 173.98 1q2r n ASP 277 N -1.58 2.43 -3.84 3.58 8.00 -0.23 -4.49 116.55 120.42 1q2r n ASP 277 Ca 0.11 -0.17 -0.12 0.00 0.71 0.00 0.00 54.79 55.33 1q2r n ASP 277 Cb 0.51 0.82 -0.12 0.00 -0.02 0.00 0.00 41.12 42.31 1q2r n ASP 277 CO 0.00 0.00 0.00 -0.04 -0.39 0.00 0.00 177.20 176.77 1q2r s MET 278 N -1.31 0.22 0.14 -1.24 -1.94 -0.70 -1.11 119.30 113.36 1q2r s MET 278 Ca 0.00 0.04 0.02 0.00 -1.71 0.00 0.00 55.69 54.04 1q2r s MET 278 Cb 0.00 0.10 -0.04 0.00 2.01 0.00 0.00 34.83 36.89 1q2r s MET 278 CO 0.00 -0.04 -0.03 -0.06 -0.01 0.00 0.00 175.02 174.88 1q2r s PHE 279 N -0.26 1.06 -0.21 -0.03 0.40 -0.19 -2.16 117.98 116.58 1q2r s PHE 279 Ca -0.03 -0.96 -0.17 0.00 -0.60 0.00 0.00 56.93 55.17 1q2r s PHE 279 Cb -0.03 -0.60 0.06 0.00 0.51 0.00 0.00 43.02 42.96 1q2r s PHE 279 CO 0.00 -0.18 0.55 0.16 0.70 0.00 0.00 175.22 176.46 1q2r s ASP 280 N -3.11 -0.64 0.07 1.36 -4.77 -1.20 -0.09 116.67 108.30 1q2r s ASP 280 Ca 0.18 1.15 -0.26 0.00 -3.30 0.00 0.00 52.55 50.32 1q2r s ASP 280 Cb 0.06 1.12 0.09 0.00 -1.09 0.00 0.00 42.92 43.09 1q2r s ASP 280 CO -0.00 -0.20 0.75 0.00 0.70 0.00 0.00 175.17 176.41 1q2r n VAL 282 N -0.29 0.44 0.14 0.00 0.24 -1.26 -3.95 118.33 113.65 1q2r n VAL 282 Ca -0.13 -0.72 -0.15 0.00 -2.04 0.00 0.00 64.34 61.30 1q2r n VAL 282 Cb 0.63 0.99 -0.08 0.00 -1.47 0.00 0.00 33.84 33.92 1q2r n VAL 282 CO 0.00 0.00 0.00 0.25 -2.14 0.00 0.00 176.83 174.94 1q2r h LEU 283 N 3.52 -1.22 -0.81 1.34 5.85 -1.95 0.35 115.31 122.38 1q2r h LEU 283 Ca 0.00 0.13 0.11 0.00 0.84 0.00 0.00 57.88 58.96 1q2r h LEU 283 Cb 0.82 0.45 -0.08 0.00 0.37 0.00 0.00 40.66 42.22 1q2r h LEU 283 CO 0.00 -0.50 0.44 1.55 -0.34 0.00 0.00 178.44 179.59 1q2r h PRO 284 N -0.69 0.69 0.15 5.25 0.13 -1.92 0.29 132.00 135.91 1q2r h PRO 284 Ca 0.01 -0.04 -0.01 0.00 -0.87 0.00 0.00 66.00 65.09 1q2r h PRO 284 Cb 0.69 -0.16 0.00 0.00 0.13 0.00 0.00 31.00 31.67 1q2r h PRO 284 CO -0.21 0.46 -0.07 1.79 -0.23 0.00 0.00 178.00 179.73 1q2r h THR 285 N 0.71 0.88 0.03 1.56 1.35 -1.80 -2.37 112.91 113.28 1q2r h THR 285 Ca 0.41 -1.16 -0.00 0.00 -0.55 0.00 0.00 66.41 65.11 1q2r h THR 285 Cb 0.45 1.49 0.00 0.00 -1.73 0.00 0.00 68.15 68.36 1q2r h THR 285 CO -0.29 0.23 -0.02 -0.09 -0.25 0.00 0.00 175.52 175.11 1q2r h ARG 286 N -0.85 -0.04 -0.13 4.72 2.43 -0.24 -1.98 114.38 118.29 1q2r h ARG 286 Ca -0.02 0.00 -0.05 0.00 -0.81 0.00 0.00 59.98 59.10 1q2r h ARG 286 Cb 0.53 0.01 -0.01 0.00 -0.42 0.00 0.00 29.97 30.08 1q2r h ARG 286 CO 0.03 0.26 -0.17 0.66 -1.51 0.00 0.00 179.97 179.24 1q2r h SER 287 N -0.35 0.19 0.07 -3.80 4.64 -1.09 -2.07 113.55 111.15 1q2r h SER 287 Ca -0.00 -0.04 0.02 0.00 -0.47 0.00 0.00 61.79 61.29 1q2r h SER 287 Cb 0.32 -0.05 -0.04 0.00 -0.31 0.00 0.00 62.40 62.32 1q2r h SER 287 CO 0.01 0.38 -0.24 1.23 -0.87 0.00 0.00 176.83 177.34 1q2r h GLY 288 N 0.78 -0.40 2.00 -0.77 0.00 -1.15 -0.19 103.07 103.34 1q2r h GLY 288 Ca 0.04 0.28 -0.02 0.00 0.00 0.00 0.00 47.33 47.63 1q2r h GLY 288 CO 0.03 -0.21 -0.08 3.21 0.00 0.00 0.00 176.54 179.49 1q2r h ARG 289 N -0.41 0.00 -0.15 4.80 3.08 -1.07 -2.12 114.38 118.51 1q2r h ARG 289 Ca 0.04 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.09 1q2r h ARG 289 Cb 0.46 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.51 1q2r h ARG 289 CO -0.17 0.08 0.00 -1.71 -1.07 0.00 0.00 179.97 177.11 1q2r n ASN 290 N -3.84 0.90 0.00 7.04 5.15 -0.24 -4.85 115.26 119.42 1q2r n ASN 290 Ca -0.02 -1.91 0.00 0.00 -0.60 0.00 0.00 54.58 52.05 1q2r n ASN 290 Cb 0.18 -0.10 0.00 0.00 -0.53 0.00 0.00 39.78 39.33 1q2r n ASN 290 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1q2r n GLY 291 N 0.81 0.69 3.48 8.20 0.00 -0.80 -4.98 105.19 112.59 1q2r n GLY 291 Ca 0.08 -0.01 -0.39 0.00 0.00 0.00 0.00 46.02 45.70 1q2r n GLY 291 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1q2r s GLN 292 N -0.39 3.50 -0.10 1.61 0.74 -0.28 -0.91 119.66 123.82 1q2r s GLN 292 Ca 0.00 -0.62 -0.01 0.00 0.05 0.00 0.00 55.36 54.79 1q2r s GLN 292 Cb 0.00 -3.60 -0.03 0.00 1.10 0.00 0.00 33.01 30.48 1q2r s GLN 292 CO 0.00 -0.36 -0.07 0.00 -0.55 0.00 0.00 175.29 174.31 1q2r s ALA 293 N 1.66 2.93 0.13 1.58 0.00 0.08 -3.78 121.76 124.36 1q2r s ALA 293 Ca 0.05 -0.87 -0.26 0.00 0.00 0.00 0.00 51.96 50.88 1q2r s ALA 293 Cb -0.17 -1.32 -0.07 0.00 0.00 0.00 0.00 23.12 21.57 1q2r s ALA 293 CO 0.07 0.43 0.82 -0.06 0.00 0.00 0.00 175.76 177.02 1q2r s PHE 294 N -0.32 3.86 0.05 0.00 0.08 -1.26 -1.09 117.98 119.29 1q2r s PHE 294 Ca 0.05 1.64 -0.01 0.00 0.12 0.00 0.00 56.93 58.73 1q2r s PHE 294 Cb -0.13 -2.84 -0.04 0.00 -0.57 0.00 0.00 43.02 39.44 1q2r s PHE 294 CO 0.02 0.40 -0.03 0.95 -0.10 0.00 0.00 175.22 176.47 1q2r s THR 295 N -0.69 0.21 -0.50 0.64 -4.23 -1.20 -4.80 115.64 105.06 1q2r s THR 295 Ca 0.39 -1.70 0.18 0.00 -1.18 0.00 0.00 61.69 59.38 1q2r s THR 295 Cb -0.23 -1.38 0.19 0.00 1.34 0.00 0.00 72.50 72.42 1q2r s THR 295 CO 0.26 -0.94 1.56 0.79 -0.54 0.00 0.00 174.62 175.76 1q2r n TRP 296 N 0.27 0.57 -0.82 3.99 7.02 -1.26 -0.99 117.44 126.23 1q2r n TRP 296 Ca -0.15 0.26 0.08 0.00 -1.02 0.00 0.00 57.50 56.67 1q2r n TRP 296 Cb 0.60 -0.92 0.36 0.00 -2.42 0.00 0.00 31.31 28.93 1q2r n TRP 296 CO 0.00 0.00 0.00 -0.25 -2.02 0.00 0.00 177.69 175.42 1q2r n ASP 297 N -2.06 5.05 0.00 -0.99 8.00 -1.26 -3.18 116.55 122.11 1q2r n ASP 297 Ca 0.01 -2.78 0.00 0.00 0.71 0.00 0.00 54.79 52.73 1q2r n ASP 297 Cb 0.11 -0.62 0.00 0.00 -0.02 0.00 0.00 41.12 40.60 1q2r n ASP 297 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1q2r n GLY 298 N 0.56 2.07 3.74 0.44 0.00 -0.16 -4.72 105.19 107.13 1q2r n GLY 298 Ca 0.26 -1.94 -0.37 0.00 0.00 0.00 0.00 46.02 43.96 1q2r n GLY 298 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 1q2r s PRO 299 N -2.67 2.85 0.03 1.61 0.02 -1.26 -3.27 135.00 132.31 1q2r s PRO 299 Ca 0.00 2.05 0.02 0.00 0.02 0.00 0.00 61.00 63.09 1q2r s PRO 299 Cb 0.00 -2.00 -0.02 0.00 0.02 0.00 0.00 34.50 32.50 1q2r s PRO 299 CO 0.00 -1.36 -0.06 0.96 -0.33 0.00 0.00 177.00 176.21 1q2r s ILE 300 N -1.42 0.40 -0.42 2.83 -4.36 -0.25 -4.94 121.20 113.04 1q2r s ILE 300 Ca 0.78 -0.79 -0.15 0.00 -0.26 0.00 0.00 60.65 60.23 1q2r s ILE 300 Cb -0.36 -0.45 0.03 0.00 1.25 0.00 0.00 42.46 42.92 1q2r s ILE 300 CO 0.40 -0.26 0.31 0.21 0.24 0.00 0.00 174.94 175.84 1q2r s ASN 301 N -1.13 6.12 0.65 4.36 3.84 -1.26 -0.74 114.94 126.78 1q2r s ASN 301 Ca -0.08 -0.95 0.42 0.00 0.21 0.00 0.00 52.86 52.46 1q2r s ASN 301 Cb -0.08 -2.16 2.31 0.00 -0.55 0.00 0.00 41.25 40.77 1q2r s ASN 301 CO 0.00 -0.48 2.34 -0.29 -2.79 0.00 0.00 177.10 175.89 1q2r h ILE 302 N 5.65 0.07 0.00 -5.21 6.09 -1.41 -1.90 117.51 120.79 1q2r h ILE 302 Ca -0.27 -0.03 -0.05 0.00 -1.37 0.00 0.00 64.86 63.13 1q2r h ILE 302 Cb 1.12 1.03 -0.01 0.00 0.47 0.00 0.00 36.82 39.43 1q2r h ILE 302 CO 0.75 0.00 -0.25 0.03 -3.07 0.00 0.00 178.15 175.62 1q2r h ARG 303 N 0.00 0.00 -6.44 2.19 3.08 -1.89 -3.41 114.38 107.90 1q2r h ARG 303 Ca -0.00 0.00 -0.62 0.00 0.07 0.00 0.00 59.98 59.43 1q2r h ARG 303 Cb 0.03 0.00 0.09 0.00 0.08 0.00 0.00 29.97 30.17 1q2r h ARG 303 CO 0.00 0.25 0.27 -1.71 -1.07 0.00 0.00 179.97 177.70 1q2r n ASN 304 N -4.00 1.57 0.28 7.04 2.85 -0.72 -4.83 115.26 117.45 1q2r n ASN 304 Ca -0.02 1.16 0.19 0.00 -0.11 0.00 0.00 54.58 55.80 1q2r n ASN 304 Cb 0.32 -1.28 1.00 0.00 1.24 0.00 0.00 39.78 41.06 1q2r n ASN 304 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 1q2r h ALA 305 N 2.88 1.01 0.00 5.20 0.00 -1.90 -2.44 119.26 124.01 1q2r h ALA 305 Ca -0.42 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.49 1q2r h ALA 305 Cb 1.33 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.12 1q2r h ALA 305 CO 0.67 -0.01 0.00 2.89 0.00 0.00 0.00 179.25 182.80 1q2r n ARG 306 N -2.80 0.53 0.00 0.00 1.85 -1.26 -2.66 116.66 112.32 1q2r n ARG 306 Ca -0.02 0.03 0.05 0.00 -1.00 0.00 0.00 57.85 56.90 1q2r n ARG 306 Cb 0.07 -1.50 -0.03 0.00 -1.05 0.00 0.00 32.46 29.95 1q2r n ARG 306 CO 0.00 0.00 0.00 1.19 -0.01 0.00 0.00 177.63 178.81 1q2r n PHE 307 N -1.08 0.00 -0.35 2.89 3.72 -0.92 -4.67 117.46 117.05 1q2r n PHE 307 Ca 0.13 0.00 0.35 0.00 -0.05 0.00 0.00 57.45 57.88 1q2r n PHE 307 Cb 0.09 0.00 0.72 0.00 -0.94 0.00 0.00 39.48 39.35 1q2r n PHE 307 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 176.76 177.37 1q2r h SER 308 N 0.65 0.08 0.00 4.37 4.64 -1.68 -1.52 113.55 120.09 1q2r h SER 308 Ca 0.00 0.02 -0.02 0.00 -0.47 0.00 0.00 61.79 61.31 1q2r h SER 308 Cb 0.30 0.01 -0.05 0.00 -0.31 0.00 0.00 62.40 62.34 1q2r h SER 308 CO 0.00 0.00 -0.39 -0.62 -0.87 0.00 0.00 176.83 174.95 1q2r n GLU 309 N -4.25 1.03 -2.71 4.77 1.02 -1.26 -4.60 120.64 114.64 1q2r n GLU 309 Ca 0.27 -2.54 -0.42 0.00 -0.02 0.00 0.00 57.16 54.45 1q2r n GLU 309 Cb 1.25 -1.19 -0.03 0.00 -0.02 0.00 0.00 31.44 31.44 1q2r n GLU 309 CO 0.00 0.00 0.00 0.34 1.18 0.00 0.00 177.13 178.65 1q2r s ASP 310 N -2.62 6.26 0.09 1.62 -1.08 -0.59 -4.90 116.67 115.45 1q2r s ASP 310 Ca 0.30 -0.47 0.17 0.00 -0.52 0.00 0.00 52.55 52.03 1q2r s ASP 310 Cb 0.29 -2.49 0.72 0.00 -1.46 0.00 0.00 42.92 39.98 1q2r s ASP 310 CO -0.04 -1.52 1.53 0.18 0.52 0.00 0.00 175.17 175.84 1q2r n LEU 311 N 8.30 0.22 -4.78 -1.34 4.32 -1.26 -2.04 117.00 120.42 1q2r n LEU 311 Ca 0.02 0.56 -0.32 0.00 -0.02 0.00 0.00 56.01 56.25 1q2r n LEU 311 Cb 0.48 -0.53 0.07 0.00 -1.62 0.00 0.00 43.42 41.82 1q2r n LEU 311 CO 0.67 -0.36 0.71 -0.54 -1.22 0.00 0.00 177.39 176.65 1q2r s LYS 312 N -3.11 2.58 0.92 3.23 1.02 -1.26 -4.61 119.74 118.52 1q2r s LYS 312 Ca 0.06 1.19 -0.13 0.00 0.02 0.00 0.00 55.97 57.11 1q2r s LYS 312 Cb 0.09 -1.94 0.14 0.00 -0.52 0.00 0.00 37.83 35.61 1q2r s LYS 312 CO 0.30 -1.39 1.15 -1.25 -0.92 0.00 0.00 175.35 173.24 1q2r s PRO 313 N -4.68 1.06 0.19 -1.68 0.04 -1.26 -1.47 135.00 127.20 1q2r s PRO 313 Ca 0.62 0.21 -0.13 0.00 0.04 0.00 0.00 61.00 61.73 1q2r s PRO 313 Cb -0.17 -1.84 0.20 0.00 0.04 0.00 0.00 34.50 32.73 1q2r s PRO 313 CO 0.51 -2.24 1.68 -0.07 0.04 0.00 0.00 177.00 176.92 1q2r h LEU 314 N -1.52 -0.24 -8.04 -3.56 4.07 -1.88 -3.41 115.31 100.73 1q2r h LEU 314 Ca -0.49 0.13 -0.39 0.00 0.08 0.00 0.00 57.88 57.21 1q2r h LEU 314 Cb 1.32 0.23 -0.28 0.00 1.08 0.00 0.00 40.66 43.01 1q2r h LEU 314 CO 0.59 -0.08 -0.78 -0.62 -1.08 0.00 0.00 178.44 176.47 1q2r s ASP 315 N -5.25 1.04 0.22 -0.43 -1.08 -1.26 -4.89 116.67 105.02 1q2r s ASP 315 Ca -0.14 -0.18 -0.08 0.00 -0.52 0.00 0.00 52.55 51.63 1q2r s ASP 315 Cb 0.17 -0.11 0.18 0.00 -1.46 0.00 0.00 42.92 41.70 1q2r s ASP 315 CO 0.73 0.09 1.84 0.77 0.52 0.00 0.00 175.17 179.12 1q2r h SER 316 N 5.84 1.06 0.27 -0.34 4.64 -1.99 -3.29 113.55 119.74 1q2r h SER 316 Ca -0.31 -0.11 -0.34 0.00 -0.47 0.00 0.00 61.79 60.57 1q2r h SER 316 Cb 1.18 -0.27 -0.03 0.00 -0.31 0.00 0.00 62.40 62.97 1q2r h SER 316 CO 0.49 0.86 -1.91 -0.62 -0.87 0.00 0.00 176.83 174.79 1q2r n GLU 317 N -4.37 0.70 -1.47 4.77 1.02 -1.26 -4.95 120.64 115.08 1q2r n GLU 317 Ca 0.08 0.27 -0.48 0.00 -0.02 0.00 0.00 57.16 57.01 1q2r n GLU 317 Cb 0.10 -1.73 -0.03 0.00 -0.02 0.00 0.00 31.44 29.76 1q2r n GLU 317 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1q2r n HIS 319 N 0.21 0.00 -1.31 0.00 1.44 -1.26 -4.82 115.22 109.48 1q2r n HIS 319 Ca 0.16 -1.40 -0.31 0.00 -2.01 0.00 0.00 57.72 54.16 1q2r n HIS 319 Cb 0.26 -0.23 0.09 0.00 0.12 0.00 0.00 29.99 30.23 1q2r n HIS 319 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 1q2r h ALA 321 N -1.14 1.91 -0.02 0.00 0.00 -1.94 -2.29 119.26 115.79 1q2r h ALA 321 Ca -0.45 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.46 1q2r h ALA 321 Cb 1.24 -0.12 -0.00 0.00 0.00 0.00 0.00 17.79 18.91 1q2r h ALA 321 CO 0.53 -0.07 0.01 0.28 0.00 0.00 0.00 179.25 180.00 1q2r h VAL 322 N 0.57 1.09 0.00 0.00 2.07 -1.93 -2.77 116.25 115.28 1q2r h VAL 322 Ca 0.33 -0.28 0.00 0.00 0.82 0.00 0.00 66.70 67.58 1q2r h VAL 322 Cb 0.54 1.25 0.00 0.00 -1.52 0.00 0.00 31.29 31.57 1q2r h VAL 322 CO -0.11 0.07 0.00 0.00 0.02 0.00 0.00 177.57 177.55 1q2r n GLN 324 N -1.88 2.34 0.00 0.00 1.13 -0.91 -4.66 117.38 113.40 1q2r n GLN 324 Ca 0.04 -3.32 0.00 0.00 -1.94 0.00 0.00 57.00 51.77 1q2r n GLN 324 Cb 0.24 -2.05 0.00 0.00 0.11 0.00 0.00 30.24 28.54 1q2r n GLN 324 CO 0.00 0.00 0.00 1.17 -1.44 0.00 0.00 177.06 176.79 1q2r n LYS 325 N -1.03 0.00 -4.38 -1.09 3.00 -1.07 -4.99 118.16 108.60 1q2r n LYS 325 Ca 0.46 0.00 -0.28 0.00 -0.00 0.00 0.00 58.31 58.49 1q2r n LYS 325 Cb 1.09 0.00 -0.12 0.00 0.00 0.00 0.00 35.03 36.00 1q2r n LYS 325 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.40 175.82 1q2r s TRP 326 N -1.00 2.38 0.49 5.64 0.51 -0.31 -5.11 118.94 121.55 1q2r s TRP 326 Ca 0.00 -0.34 0.03 0.00 -2.12 0.00 0.00 56.10 53.68 1q2r s TRP 326 Cb 0.00 -1.23 0.02 0.00 -0.81 0.00 0.00 33.47 31.45 1q2r s TRP 326 CO 0.00 0.42 0.69 -1.54 -0.51 0.00 0.00 176.95 176.01 1q2r s SER 327 N -2.35 5.47 0.09 2.95 1.04 -1.26 -4.56 113.70 115.08 1q2r s SER 327 Ca 0.18 -0.12 -0.17 0.00 0.48 0.00 0.00 55.95 56.32 1q2r s SER 327 Cb -0.09 -0.88 -0.08 0.00 0.10 0.00 0.00 66.02 65.07 1q2r s SER 327 CO 0.09 -0.96 1.49 0.03 0.98 0.00 0.00 173.24 174.86 1q2r h ARG 328 N 0.31 0.54 -0.94 4.02 3.08 -1.00 -2.55 114.38 117.83 1q2r h ARG 328 Ca -0.42 -0.21 0.20 0.00 0.07 0.00 0.00 59.98 59.62 1q2r h ARG 328 Cb 1.29 -0.03 -0.11 0.00 0.08 0.00 0.00 29.97 31.19 1q2r h ARG 328 CO 0.50 0.74 0.51 0.00 -1.07 0.00 0.00 179.97 180.66 1q2r h ALA 329 N 0.78 1.54 -0.22 0.04 0.00 -1.24 1.41 119.26 121.57 1q2r h ALA 329 Ca 0.07 0.11 -0.09 0.00 0.00 0.00 0.00 54.91 55.00 1q2r h ALA 329 Cb 0.55 0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.34 1q2r h ALA 329 CO 0.03 -0.18 -0.22 -0.92 0.00 0.00 0.00 179.25 177.96 1q2r h TYR 330 N 0.60 0.65 -0.21 0.00 3.20 -1.81 -1.70 116.97 117.69 1q2r h TYR 330 Ca 0.56 -0.19 -0.10 0.00 3.14 0.00 0.00 58.73 62.14 1q2r h TYR 330 Cb 0.95 -0.14 -0.01 0.00 1.54 0.00 0.00 36.73 39.07 1q2r h TYR 330 CO -0.06 0.88 -0.31 0.82 -1.64 0.00 0.00 178.16 177.85 1q2r h ILE 331 N 0.23 1.28 -0.84 1.81 2.04 -0.59 -1.50 117.51 119.93 1q2r h ILE 331 Ca 0.04 -1.36 0.06 0.00 1.00 0.00 0.00 64.86 64.59 1q2r h ILE 331 Cb 0.77 1.46 -0.06 0.00 -0.74 0.00 0.00 36.82 38.25 1q2r h ILE 331 CO 0.05 0.42 0.52 -0.74 0.00 0.00 0.00 178.15 178.41 1q2r h HIS 332 N 0.37 0.97 0.39 1.37 2.76 0.20 -0.49 115.15 120.72 1q2r h HIS 332 Ca 0.05 0.03 -0.02 0.00 -2.20 0.00 0.00 60.37 58.23 1q2r h HIS 332 Cb 0.73 -0.31 0.00 0.00 1.55 0.00 0.00 27.41 29.38 1q2r h HIS 332 CO 0.02 0.50 -0.19 1.25 -1.30 0.00 0.00 177.93 178.22 1q2r h HIS 333 N 0.96 -0.48 -0.85 5.26 -0.00 -0.53 -1.38 115.15 118.12 1q2r h HIS 333 Ca 0.36 -0.01 0.15 0.00 -0.00 0.00 0.00 60.37 60.88 1q2r h HIS 333 Cb 0.15 0.16 -0.15 0.00 -0.00 0.00 0.00 27.41 27.57 1q2r h HIS 333 CO -0.03 -0.30 -0.30 -0.07 -0.00 0.00 0.00 177.93 177.22 1q2r h LEU 334 N -0.56 -1.11 -0.33 0.26 4.07 -1.03 0.28 115.31 116.89 1q2r h LEU 334 Ca -0.05 0.27 -0.03 0.00 0.08 0.00 0.00 57.88 58.15 1q2r h LEU 334 Cb 0.40 0.62 -0.01 0.00 1.08 0.00 0.00 40.66 42.75 1q2r h LEU 334 CO 0.09 -0.29 0.08 0.40 -1.08 0.00 0.00 178.44 177.64 1q2r h ILE 335 N -0.04 1.22 0.00 1.22 1.08 -1.14 0.72 117.51 120.57 1q2r h ILE 335 Ca 0.35 -0.74 -0.00 0.00 -0.39 0.00 0.00 64.86 64.08 1q2r h ILE 335 Cb 0.61 1.07 -0.00 0.00 -3.07 0.00 0.00 36.82 35.43 1q2r h ILE 335 CO -0.88 0.25 -0.02 -0.09 -0.69 0.00 0.00 178.15 176.72 1q2r h ARG 336 N 0.38 0.00 -0.01 2.37 9.65 0.10 -1.46 114.38 125.42 1q2r h ARG 336 Ca 0.10 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 58.98 1q2r h ARG 336 Cb 0.29 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 28.87 1q2r h ARG 336 CO 0.00 0.02 -0.52 0.00 2.80 0.00 0.00 179.97 182.27 1q2r n ALA 337 N -2.51 3.66 -1.08 2.80 0.00 0.80 -4.96 120.51 119.21 1q2r n ALA 337 Ca -0.03 -0.49 -0.03 0.00 0.00 0.00 0.00 53.44 52.89 1q2r n ALA 337 Cb 0.10 -0.97 -0.01 0.00 0.00 0.00 0.00 19.45 18.57 1q2r n ALA 337 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1q2r n GLY 338 N 1.43 0.59 3.73 0.00 0.00 0.05 -5.00 105.19 106.00 1q2r n GLY 338 Ca 0.08 -0.73 -0.41 0.00 0.00 0.00 0.00 46.02 44.96 1q2r n GLY 338 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1q2r s GLU 339 N -1.86 4.43 0.37 1.61 0.41 -0.08 -4.92 118.70 118.66 1q2r s GLU 339 Ca 0.00 1.96 0.13 0.00 -0.41 0.00 0.00 54.97 56.64 1q2r s GLU 339 Cb 0.00 -3.23 0.94 0.00 -1.78 0.00 0.00 34.13 30.06 1q2r s GLU 339 CO 0.00 -0.20 1.81 0.82 -0.49 0.00 0.00 175.26 177.20 1q2r h ILE 340 N 3.86 0.66 -0.04 -1.63 2.04 -1.94 0.46 117.51 120.92 1q2r h ILE 340 Ca -0.44 -0.19 0.01 0.00 1.00 0.00 0.00 64.86 65.24 1q2r h ILE 340 Cb 1.21 0.06 -0.00 0.00 -0.74 0.00 0.00 36.82 37.35 1q2r h ILE 340 CO 0.77 0.10 0.07 0.25 0.00 0.00 0.00 178.15 179.35 1q2r h LEU 341 N 0.56 0.00 -0.41 1.44 5.85 -1.94 -1.21 115.31 119.60 1q2r h LEU 341 Ca 0.54 0.00 -0.01 0.00 0.84 0.00 0.00 57.88 59.25 1q2r h LEU 341 Cb 1.11 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 42.13 1q2r h LEU 341 CO -0.28 0.00 0.21 1.23 -0.34 0.00 0.00 178.44 179.26 1q2r h GLY 342 N 0.00 0.63 0.84 3.75 0.00 -0.33 -1.36 103.07 106.60 1q2r h GLY 342 Ca 0.02 -0.31 -0.04 0.00 0.00 0.00 0.00 47.33 47.01 1q2r h GLY 342 CO -0.00 0.29 -0.00 0.00 0.00 0.00 0.00 176.54 176.83 1q2r h ALA 343 N 1.06 0.31 -0.51 3.60 0.00 -1.33 -1.64 119.26 120.75 1q2r h ALA 343 Ca 0.14 -0.22 0.09 0.00 0.00 0.00 0.00 54.91 54.93 1q2r h ALA 343 Cb 0.10 -0.08 -0.07 0.00 0.00 0.00 0.00 17.79 17.73 1q2r h ALA 343 CO -0.02 0.04 0.08 0.52 0.00 0.00 0.00 179.25 179.86 1q2r h MET 344 N 0.17 0.20 0.16 0.00 2.07 -1.27 0.48 114.93 116.73 1q2r h MET 344 Ca 0.06 -0.01 -0.01 0.00 -2.07 0.00 0.00 59.70 57.68 1q2r h MET 344 Cb 0.41 -0.04 0.00 0.00 -1.87 0.00 0.00 31.60 30.10 1q2r h MET 344 CO 0.01 0.13 -0.07 -0.07 1.07 0.00 0.00 176.91 177.98 1q2r h LEU 345 N 0.20 -0.18 -0.61 1.22 4.07 -1.25 -2.11 115.31 116.66 1q2r h LEU 345 Ca 0.26 -0.32 0.12 0.00 0.08 0.00 0.00 57.88 58.01 1q2r h LEU 345 Cb 0.36 0.05 -0.12 0.00 1.08 0.00 0.00 40.66 42.03 1q2r h LEU 345 CO -0.36 0.40 -0.26 0.24 -1.08 0.00 0.00 178.44 177.38 1q2r h MET 346 N -0.93 -0.10 -0.35 1.13 2.86 -1.18 0.46 114.93 116.81 1q2r h MET 346 Ca -0.02 0.01 -0.02 0.00 -2.06 0.00 0.00 59.70 57.61 1q2r h MET 346 Cb 0.49 0.02 -0.02 0.00 0.06 0.00 0.00 31.60 32.16 1q2r h MET 346 CO 0.04 -0.07 0.15 1.15 1.06 0.00 0.00 176.91 179.24 1q2r h THR 347 N -0.10 1.18 -0.42 2.22 2.02 -0.14 -1.84 112.91 115.84 1q2r h THR 347 Ca 0.27 -0.55 -0.01 0.00 0.77 0.00 0.00 66.41 66.88 1q2r h THR 347 Cb 0.53 0.89 -0.02 0.00 -1.74 0.00 0.00 68.15 67.80 1q2r h THR 347 CO -0.67 0.20 0.20 -0.08 0.37 0.00 0.00 175.52 175.54 1q2r h GLU 348 N 0.43 0.57 -0.01 6.66 4.81 -0.57 -1.59 114.58 124.89 1q2r h GLU 348 Ca 0.12 -0.06 -0.00 0.00 -0.13 0.00 0.00 59.36 59.29 1q2r h GLU 348 Cb 0.17 -0.12 -0.00 0.00 0.63 0.00 0.00 28.75 29.44 1q2r h GLU 348 CO -0.01 0.45 -0.00 1.25 -0.73 0.00 0.00 179.01 179.96 1q2r h HIS 349 N 0.58 0.02 -0.36 0.92 2.76 -0.71 -2.64 115.15 115.72 1q2r h HIS 349 Ca 0.15 -0.01 0.04 0.00 -2.20 0.00 0.00 60.37 58.35 1q2r h HIS 349 Cb 0.06 -0.00 -0.04 0.00 1.55 0.00 0.00 27.41 28.98 1q2r h HIS 349 CO 0.00 0.45 0.13 -0.91 -1.30 0.00 0.00 177.93 176.30 1q2r h ASN 350 N -0.42 0.14 -0.48 3.26 -0.26 -0.97 0.11 115.58 116.97 1q2r h ASN 350 Ca 0.00 0.04 -0.05 0.00 -0.56 0.00 0.00 56.30 55.73 1q2r h ASN 350 Cb 0.44 0.02 -0.02 0.00 -1.06 0.00 0.00 38.32 37.70 1q2r h ASN 350 CO 0.00 0.11 0.14 0.40 -1.06 0.00 0.00 177.43 177.02 1q2r h ILE 351 N 0.28 1.22 -0.51 2.81 5.03 -1.38 -1.72 117.51 123.24 1q2r h ILE 351 Ca 0.16 -0.79 -0.01 0.00 -0.12 0.00 0.00 64.86 64.11 1q2r h ILE 351 Cb 0.14 0.66 -0.02 0.00 -3.03 0.00 0.00 36.82 34.57 1q2r h ILE 351 CO -0.17 0.29 0.27 0.00 -0.68 0.00 0.00 178.15 177.87 1q2r h ALA 352 N 1.37 0.65 0.36 1.87 0.00 -0.98 -1.03 119.26 121.48 1q2r h ALA 352 Ca 0.18 -0.09 -0.00 0.00 0.00 0.00 0.00 54.91 54.99 1q2r h ALA 352 Cb 0.28 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.84 1q2r h ALA 352 CO -0.00 0.17 -0.32 0.35 0.00 0.00 0.00 179.25 179.45 1q2r h PHE 353 N 0.67 -0.86 -0.63 0.00 3.57 -0.16 -0.34 116.94 119.20 1q2r h PHE 353 Ca 0.18 0.00 0.11 0.00 3.53 0.00 0.00 57.97 61.79 1q2r h PHE 353 Cb 0.06 0.33 -0.08 0.00 2.79 0.00 0.00 35.95 39.04 1q2r h PHE 353 CO -0.02 -0.46 0.20 1.88 -2.23 0.00 0.00 178.31 177.68 1q2r h TYR 354 N -0.69 0.34 -0.78 0.41 -1.99 -1.15 0.15 116.97 113.26 1q2r h TYR 354 Ca -0.03 0.03 0.03 0.00 2.00 0.00 0.00 58.73 60.77 1q2r h TYR 354 Cb 0.62 -0.06 -0.04 0.00 2.00 0.00 0.00 36.73 39.24 1q2r h TYR 354 CO -0.17 0.05 0.52 1.96 -0.00 0.00 0.00 178.16 180.51 1q2r h GLN 355 N 0.36 0.95 -0.19 4.88 1.08 -0.77 -0.17 115.11 121.25 1q2r h GLN 355 Ca 0.32 -0.06 -0.04 0.00 -1.45 0.00 0.00 58.65 57.42 1q2r h GLN 355 Cb 0.45 -0.21 -0.01 0.00 -0.05 0.00 0.00 27.48 27.66 1q2r h GLN 355 CO -0.35 0.63 -0.06 1.96 -0.95 0.00 0.00 178.83 180.06 1q2r h GLN 356 N 0.97 0.36 -0.61 1.46 4.20 0.87 0.37 115.11 122.74 1q2r h GLN 356 Ca 0.31 -0.14 0.09 0.00 0.06 0.00 0.00 58.65 58.97 1q2r h GLN 356 Cb 0.03 -0.02 -0.07 0.00 0.30 0.00 0.00 27.48 27.72 1q2r h GLN 356 CO -0.09 0.64 0.23 1.25 -0.67 0.00 0.00 178.83 180.19 1q2r h LEU 357 N 0.07 0.24 -0.71 1.46 5.85 -0.09 0.32 115.31 122.44 1q2r h LEU 357 Ca 0.05 0.08 -0.03 0.00 0.84 0.00 0.00 57.88 58.81 1q2r h LEU 357 Cb 0.51 0.05 -0.03 0.00 0.37 0.00 0.00 40.66 41.56 1q2r h LEU 357 CO 0.02 0.14 0.33 0.24 -0.34 0.00 0.00 178.44 178.83 1q2r h MET 358 N 0.42 1.04 -0.32 1.25 2.86 -0.87 -1.17 114.93 118.14 1q2r h MET 358 Ca 0.30 -0.16 -0.02 0.00 -2.06 0.00 0.00 59.70 57.76 1q2r h MET 358 Cb 0.37 -0.18 -0.01 0.00 0.06 0.00 0.00 31.60 31.83 1q2r h MET 358 CO -0.30 0.83 0.13 0.37 1.06 0.00 0.00 176.91 179.01 1q2r h GLN 359 N 1.00 0.47 -0.78 1.72 5.75 0.11 -0.34 115.11 123.04 1q2r h GLN 359 Ca 0.24 -0.08 -0.01 0.00 -0.15 0.00 0.00 58.65 58.66 1q2r h GLN 359 Cb 0.15 -0.08 -0.04 0.00 1.07 0.00 0.00 27.48 28.58 1q2r h GLN 359 CO -0.03 0.46 0.46 0.87 -2.65 0.00 0.00 178.83 177.95 1q2r h LYS 360 N 0.37 1.06 0.11 1.69 1.57 -0.25 -0.21 116.57 120.91 1q2r h LYS 360 Ca 0.11 -0.10 -0.01 0.00 -1.87 0.00 0.00 60.65 58.78 1q2r h LYS 360 Cb 0.17 -0.22 0.00 0.00 0.08 0.00 0.00 32.23 32.25 1q2r h LYS 360 CO -0.01 0.75 -0.05 0.82 -0.57 0.00 0.00 179.45 180.39 1q2r h ILE 361 N 1.08 0.98 -0.56 1.86 2.04 -0.91 0.22 117.51 122.22 1q2r h ILE 361 Ca 0.28 -0.37 0.09 0.00 1.00 0.00 0.00 64.86 65.86 1q2r h ILE 361 Cb -0.03 1.22 -0.07 0.00 -0.74 0.00 0.00 36.82 37.20 1q2r h ILE 361 CO -0.05 0.09 0.16 0.03 0.00 0.00 0.00 178.15 178.38 1q2r h ARG 362 N -0.33 0.31 -0.21 2.37 3.08 -0.61 0.32 114.38 119.31 1q2r h ARG 362 Ca -0.02 -0.02 -0.02 0.00 0.07 0.00 0.00 59.98 60.00 1q2r h ARG 362 Cb 0.27 -0.07 -0.01 0.00 0.08 0.00 0.00 29.97 30.24 1q2r h ARG 362 CO 0.03 0.21 0.05 -0.44 -1.07 0.00 0.00 179.97 178.74 1q2r h ASP 363 N 0.32 0.32 0.30 7.04 3.32 -0.88 -1.93 116.42 124.91 1q2r h ASP 363 Ca 0.28 -0.23 -0.01 0.00 0.02 0.00 0.00 57.03 57.10 1q2r h ASP 363 Cb 0.37 -0.08 -0.02 0.00 0.22 0.00 0.00 39.33 39.82 1q2r h ASP 363 CO -0.33 0.46 -0.39 -1.28 -1.72 0.00 0.00 179.24 175.99 1q2r h SER 364 N 0.16 -1.10 -0.81 6.45 0.87 0.15 -1.27 113.55 117.99 1q2r h SER 364 Ca 0.07 0.10 0.19 0.00 -1.23 0.00 0.00 61.79 60.91 1q2r h SER 364 Cb 0.27 0.37 -0.12 0.00 -0.44 0.00 0.00 62.40 62.48 1q2r h SER 364 CO 0.00 -0.48 0.25 0.40 -0.53 0.00 0.00 176.83 176.47 1q2r h ILE 365 N -0.71 0.48 0.00 2.23 2.04 -0.40 0.18 117.51 121.33 1q2r h ILE 365 Ca -0.04 -0.11 0.00 0.00 1.00 0.00 0.00 64.86 65.72 1q2r h ILE 365 Cb 0.64 0.14 0.00 0.00 -0.74 0.00 0.00 36.82 36.86 1q2r h ILE 365 CO -0.10 0.06 0.00 -1.28 0.00 0.00 0.00 178.15 176.83 1q2r h SER 366 N 0.31 0.00 -0.40 1.72 0.87 -1.03 -2.84 113.55 112.18 1q2r h SER 366 Ca 0.48 0.00 -0.02 0.00 -1.23 0.00 0.00 61.79 61.02 1q2r h SER 366 Cb 0.87 0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 62.82 1q2r h SER 366 CO -0.54 0.00 0.02 -0.62 -0.53 0.00 0.00 176.83 175.16 1q2r n GLU 367 N -2.48 3.59 -0.38 2.24 1.02 0.57 -4.93 120.64 120.27 1q2r n GLU 367 Ca 0.03 -2.98 0.00 0.00 -0.02 0.00 0.00 57.16 54.18 1q2r n GLU 367 Cb 0.31 -2.01 0.00 0.00 -0.02 0.00 0.00 31.44 29.72 1q2r n GLU 367 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1q2r n GLY 368 N -0.14 0.00 2.03 0.62 0.00 -0.88 -4.71 105.19 102.11 1q2r n GLY 368 Ca 0.25 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 46.23 1q2r n GLY 368 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 1q2r n ARG 369 N -1.20 3.93 -0.17 1.61 1.85 -0.94 -4.53 116.66 117.21 1q2r n ARG 369 Ca 0.00 -3.11 -0.11 0.00 -1.00 0.00 0.00 57.85 53.63 1q2r n ARG 369 Cb 0.01 -2.24 0.01 0.00 -1.05 0.00 0.00 32.46 29.19 1q2r n ARG 369 CO 0.00 0.00 0.00 0.35 -0.01 0.00 0.00 177.63 177.97 1q2r h PHE 370 N 2.88 1.14 -0.37 2.89 3.57 -1.80 -2.24 116.94 123.00 1q2r h PHE 370 Ca 0.24 -0.26 0.05 0.00 3.53 0.00 0.00 57.97 61.53 1q2r h PHE 370 Cb 2.33 -0.27 -0.05 0.00 2.79 0.00 0.00 35.95 40.75 1q2r h PHE 370 CO 1.29 1.09 0.08 1.03 -2.23 0.00 0.00 178.31 179.57 1q2r h SER 371 N 0.87 0.03 -0.52 0.41 0.87 -1.91 -0.77 113.55 112.53 1q2r h SER 371 Ca 0.12 0.06 -0.05 0.00 -1.23 0.00 0.00 61.79 60.69 1q2r h SER 371 Cb 0.75 0.08 -0.02 0.00 -0.44 0.00 0.00 62.40 62.77 1q2r h SER 371 CO 0.06 0.05 0.15 -0.61 -0.53 0.00 0.00 176.83 175.95 1q2r h GLN 372 N 0.21 0.82 -0.27 2.24 5.75 -1.88 -2.86 115.11 119.12 1q2r h GLN 372 Ca 0.18 -0.19 0.06 0.00 -0.15 0.00 0.00 58.65 58.55 1q2r h GLN 372 Cb 0.20 -0.11 -0.07 0.00 1.07 0.00 0.00 27.48 28.57 1q2r h GLN 372 CO -0.23 0.77 -0.19 0.35 -2.65 0.00 0.00 178.83 176.89 1q2r h PHE 373 N 0.72 -0.47 -0.66 3.99 3.57 -0.75 0.00 116.94 123.35 1q2r h PHE 373 Ca 0.17 0.04 0.14 0.00 3.53 0.00 0.00 57.97 61.84 1q2r h PHE 373 Cb 0.30 0.25 -0.11 0.00 2.79 0.00 0.00 35.95 39.19 1q2r h PHE 373 CO 0.02 -0.26 0.05 0.00 -2.23 0.00 0.00 178.31 175.89 1q2r h ALA 374 N 0.99 0.71 0.67 2.41 0.00 -0.95 0.32 119.26 123.41 1q2r h ALA 374 Ca 0.15 0.18 -0.03 0.00 0.00 0.00 0.00 54.91 55.21 1q2r h ALA 374 Cb 0.39 0.30 0.01 0.00 0.00 0.00 0.00 17.79 18.49 1q2r h ALA 374 CO -0.37 -0.38 -0.32 0.37 0.00 0.00 0.00 179.25 178.55 1q2r h GLN 375 N 0.16 -0.87 -0.47 0.00 5.75 -1.06 -1.90 115.11 116.71 1q2r h GLN 375 Ca 0.35 0.06 0.09 0.00 -0.15 0.00 0.00 58.65 59.01 1q2r h GLN 375 Cb 0.58 0.20 -0.09 0.00 1.07 0.00 0.00 27.48 29.24 1q2r h GLN 375 CO -0.53 -0.57 -0.12 -0.44 -2.65 0.00 0.00 178.83 174.52 1q2r h ASP 376 N -0.93 -0.44 0.00 -0.69 3.32 -0.20 -0.14 116.42 117.34 1q2r h ASP 376 Ca -0.09 0.14 0.00 0.00 0.02 0.00 0.00 57.03 57.10 1q2r h ASP 376 Cb 0.70 0.29 0.00 0.00 0.22 0.00 0.00 39.33 40.54 1q2r h ASP 376 CO 0.15 -0.16 0.00 0.33 -1.72 0.00 0.00 179.24 177.85 1q2r n PHE 377 N -5.35 0.00 -0.21 4.55 7.35 0.11 -1.61 117.46 122.30 1q2r n PHE 377 Ca 0.04 0.00 -0.01 0.00 -0.76 0.00 0.00 57.45 56.72 1q2r n PHE 377 Cb 0.25 -0.43 0.06 0.00 0.35 0.00 0.00 39.48 39.71 1q2r n PHE 377 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 1q2r h ARG 378 N 0.00 0.00 -0.40 -4.13 3.08 -1.18 0.14 114.38 111.89 1q2r h ARG 378 Ca 0.00 -0.00 0.04 0.00 0.07 0.00 0.00 59.98 60.09 1q2r h ARG 378 Cb 0.00 -0.00 -0.07 0.00 0.08 0.00 0.00 29.97 29.98 1q2r h ARG 378 CO 0.00 0.00 -0.46 0.00 -1.07 0.00 0.00 179.97 178.44 1q2r h ALA 379 N 1.63 -0.67 -0.46 0.04 0.00 -0.84 -1.53 119.26 117.43 1q2r h ALA 379 Ca 0.30 0.01 -0.11 0.00 0.00 0.00 0.00 54.91 55.12 1q2r h ALA 379 Cb 0.46 1.09 -0.01 0.00 0.00 0.00 0.00 17.79 19.33 1q2r h ALA 379 CO -0.65 -0.91 -0.13 -0.09 0.00 0.00 0.00 179.25 177.47 1q2r h ARG 380 N -0.29 0.89 0.00 0.00 2.43 -0.32 -3.11 114.38 113.99 1q2r h ARG 380 Ca 0.07 -0.35 0.00 0.00 -0.81 0.00 0.00 59.98 58.89 1q2r h ARG 380 Cb 0.47 -0.05 0.00 0.00 -0.42 0.00 0.00 29.97 29.98 1q2r h ARG 380 CO -0.53 1.00 0.00 -0.92 -1.51 0.00 0.00 179.97 178.01 1q2r h TYR 381 N 0.73 0.00 -0.00 2.20 3.20 -0.49 -3.41 116.97 119.20 1q2r h TYR 381 Ca 0.11 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.98 1q2r h TYR 381 Cb 0.68 0.00 0.00 0.00 1.54 0.00 0.00 36.73 38.95 1q2r h TYR 381 CO 0.05 0.00 0.00 1.19 -1.64 0.00 0.00 178.16 177.76