#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1n4s s ASP 19 N 0.00 4.26 -0.41 -1.43 3.84 -1.26 -5.11 116.67 116.56 1n4s s ASP 19 Ca 0.00 -1.04 -0.16 0.00 -0.00 0.00 0.00 52.55 51.35 1n4s s ASP 19 Cb 0.00 -0.52 0.02 0.00 -1.38 0.00 0.00 42.92 41.04 1n4s s ASP 19 CO 0.00 -0.35 0.34 0.12 -0.00 0.00 0.00 175.17 175.28 1n4s s PHE 20 N -2.55 3.22 -1.26 2.11 5.36 -1.26 -4.99 117.98 118.60 1n4s s PHE 20 Ca 0.37 -0.52 -0.10 0.00 -0.96 0.00 0.00 56.93 55.72 1n4s s PHE 20 Cb 0.02 -2.68 -0.07 0.00 -0.34 0.00 0.00 43.02 39.95 1n4s s PHE 20 CO 0.20 -0.62 2.45 1.28 -1.46 0.00 0.00 175.22 177.08 1n4s n LEU 21 N 5.29 6.67 -0.24 6.12 4.32 -1.26 -4.79 117.00 133.13 1n4s n LEU 21 Ca -0.10 -3.66 -0.03 0.00 -0.02 0.00 0.00 56.01 52.20 1n4s n LEU 21 Cb 0.47 -1.36 0.03 0.00 -1.62 0.00 0.00 43.42 40.94 1n4s n LEU 21 CO 0.42 1.18 0.65 -0.09 -1.22 0.00 0.00 177.39 178.33 1n4s h ARG 22 N 5.90 -0.10 -0.99 3.23 2.43 -1.99 -1.53 114.38 121.34 1n4s h ARG 22 Ca 0.65 0.01 0.03 0.00 -0.81 0.00 0.00 59.98 59.86 1n4s h ARG 22 Cb 0.33 0.02 -0.05 0.00 -0.42 0.00 0.00 29.97 29.84 1n4s h ARG 22 CO 1.70 -0.07 0.65 -0.44 -1.51 0.00 0.00 179.97 180.30 1n4s h ASP 23 N -0.10 1.09 -0.70 -3.80 3.32 -2.00 -1.17 116.42 113.07 1n4s h ASP 23 Ca 0.28 -0.02 -0.04 0.00 0.02 0.00 0.00 57.03 57.27 1n4s h ASP 23 Cb 0.55 -0.26 -0.03 0.00 0.22 0.00 0.00 39.33 39.82 1n4s h ASP 23 CO -0.74 0.76 0.29 -0.09 -1.72 0.00 0.00 179.24 177.75 1n4s h ARG 24 N 1.28 1.03 -0.04 3.56 9.65 -1.70 -1.77 114.38 126.38 1n4s h ARG 24 Ca 0.38 -0.18 -0.08 0.00 -1.10 0.00 0.00 59.98 59.01 1n4s h ARG 24 Cb -0.04 -0.17 -0.01 0.00 -1.39 0.00 0.00 29.97 28.35 1n4s h ARG 24 CO -0.11 0.84 -0.35 0.45 2.80 0.00 0.00 179.97 183.61 1n4s h HIS 25 N 0.99 0.09 -0.33 2.20 3.86 -0.82 0.09 115.15 121.22 1n4s h HIS 25 Ca 0.23 -0.02 -0.06 0.00 -1.16 0.00 0.00 60.37 59.36 1n4s h HIS 25 Cb 0.19 -0.02 -0.01 0.00 1.06 0.00 0.00 27.41 28.62 1n4s h HIS 25 CO 0.01 0.42 -0.03 0.28 0.86 0.00 0.00 177.93 179.48 1n4s h VAL 26 N 0.07 1.27 -0.62 2.45 2.07 -0.68 -1.86 116.25 118.94 1n4s h VAL 26 Ca 0.01 -1.02 -0.09 0.00 0.82 0.00 0.00 66.70 66.42 1n4s h VAL 26 Cb 0.65 1.26 -0.02 0.00 -1.52 0.00 0.00 31.29 31.66 1n4s h VAL 26 CO 0.05 0.33 0.04 0.03 0.02 0.00 0.00 177.57 178.04 1n4s h ARG 27 N 0.40 1.06 -0.26 1.57 3.08 -1.00 -1.68 114.38 117.56 1n4s h ARG 27 Ca 0.09 -0.31 0.05 0.00 0.07 0.00 0.00 59.98 59.88 1n4s h ARG 27 Cb 0.49 -0.11 -0.04 0.00 0.08 0.00 0.00 29.97 30.39 1n4s h ARG 27 CO 0.02 1.01 -0.03 0.35 -1.07 0.00 0.00 179.97 180.25 1n4s h PHE 28 N 0.98 -0.07 -0.28 3.04 3.57 -0.78 -0.57 116.94 122.83 1n4s h PHE 28 Ca 0.18 0.02 -0.06 0.00 3.53 0.00 0.00 57.97 61.64 1n4s h PHE 28 Cb 0.51 0.07 -0.02 0.00 2.79 0.00 0.00 35.95 39.30 1n4s h PHE 28 CO 0.04 -0.08 -0.09 0.74 -2.23 0.00 0.00 178.31 176.69 1n4s h PHE 29 N 0.04 0.49 -0.42 0.41 0.05 -1.15 -2.36 116.94 114.00 1n4s h PHE 29 Ca 0.12 -0.06 -0.02 0.00 3.82 0.00 0.00 57.97 61.83 1n4s h PHE 29 Cb 0.18 -0.14 -0.02 0.00 2.00 0.00 0.00 35.95 37.97 1n4s h PHE 29 CO -0.23 0.55 0.17 1.96 -0.18 0.00 0.00 178.31 180.58 1n4s h GLN 30 N 0.43 0.62 -0.21 1.51 4.20 -0.32 -2.01 115.11 119.33 1n4s h GLN 30 Ca 0.09 -0.11 -0.02 0.00 0.06 0.00 0.00 58.65 58.67 1n4s h GLN 30 Cb 0.43 -0.10 -0.01 0.00 0.30 0.00 0.00 27.48 28.10 1n4s h GLN 30 CO 0.02 0.58 0.05 0.00 -0.67 0.00 0.00 178.83 178.81 1n4s h ARG 31 N 0.53 0.30 -0.47 1.46 3.08 -0.81 -1.98 114.38 116.49 1n4s h ARG 31 Ca 0.14 -0.04 -0.04 0.00 0.07 0.00 0.00 59.98 60.12 1n4s h ARG 31 Cb 0.18 -0.06 -0.02 0.00 0.08 0.00 0.00 29.97 30.15 1n4s h ARG 31 CO -0.01 0.28 0.14 0.00 -1.07 0.00 0.00 179.97 179.31 1n4s n LEU 33 N -4.32 0.00 0.00 0.00 7.99 -0.76 -4.72 117.00 115.19 1n4s n LEU 33 Ca 0.03 0.39 0.00 0.00 -0.01 0.00 0.00 56.01 56.43 1n4s n LEU 33 Cb 0.19 -0.39 0.00 0.00 -0.11 0.00 0.00 43.42 43.11 1n4s n LEU 33 CO 0.39 -0.02 0.00 0.00 -1.51 0.00 0.00 177.39 176.25 1n4s n GLN 34 N -1.39 0.00 -4.86 3.23 6.02 -0.70 -5.07 117.38 114.60 1n4s n GLN 34 Ca 0.10 0.00 -0.26 0.00 -0.01 0.00 0.00 57.00 56.83 1n4s n GLN 34 Cb 0.28 0.00 -0.16 0.00 1.02 0.00 0.00 30.24 31.38 1n4s n GLN 34 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 177.06 176.13 1n4s s VAL 35 N 1.09 1.44 0.10 5.09 1.01 -1.25 -5.12 120.40 122.77 1n4s s VAL 35 Ca 0.00 -0.74 0.07 0.00 0.00 0.00 0.00 61.98 61.31 1n4s s VAL 35 Cb 0.00 -1.23 -0.04 0.00 0.00 0.00 0.00 36.38 35.11 1n4s s VAL 35 CO 0.00 0.41 -0.12 -0.76 0.00 0.00 0.00 175.10 174.64 1n4s s LEU 36 N -0.11 2.97 0.72 3.92 1.43 -1.26 -4.95 118.68 121.40 1n4s s LEU 36 Ca -0.00 -0.42 -0.13 0.00 -1.03 0.00 0.00 54.13 52.55 1n4s s LEU 36 Cb -0.10 -1.77 0.03 0.00 0.03 0.00 0.00 46.19 44.38 1n4s s LEU 36 CO 0.01 0.18 1.12 -2.84 0.23 0.00 0.00 176.35 175.05 1n4s s PRO 37 N -2.17 2.47 0.04 1.29 0.02 -1.26 -4.89 135.00 130.50 1n4s s PRO 37 Ca 0.20 1.37 0.02 0.00 0.02 0.00 0.00 61.00 62.62 1n4s s PRO 37 Cb -0.11 -1.91 0.13 0.00 0.02 0.00 0.00 34.50 32.63 1n4s s PRO 37 CO 0.13 -1.51 1.06 -1.91 -0.33 0.00 0.00 177.00 174.44 1n4s n GLU 38 N -2.89 0.02 0.00 5.54 2.13 -1.26 -1.57 120.64 122.61 1n4s n GLU 38 Ca 0.10 0.50 0.08 0.00 0.66 0.00 0.00 57.16 58.50 1n4s n GLU 38 Cb 0.52 -1.57 0.34 0.00 0.27 0.00 0.00 31.44 31.01 1n4s n GLU 38 CO 0.00 0.00 0.00 2.89 -0.41 0.00 0.00 177.13 179.61 1n4s n ARG 39 N -1.58 0.03 -0.62 5.31 1.85 -1.26 -2.15 116.66 118.23 1n4s n ARG 39 Ca -0.00 0.22 0.08 0.00 -1.00 0.00 0.00 57.85 57.15 1n4s n ARG 39 Cb 0.02 -1.50 0.33 0.00 -1.05 0.00 0.00 32.46 30.25 1n4s n ARG 39 CO 0.00 0.00 0.00 0.66 -0.01 0.00 0.00 177.63 178.28 1n4s n TYR 40 N -1.48 1.44 -0.14 2.89 4.02 -0.61 -4.64 117.16 118.65 1n4s n TYR 40 Ca 0.04 -0.73 0.20 0.00 -0.01 0.00 0.00 57.90 57.40 1n4s n TYR 40 Cb 0.18 -0.34 0.60 0.00 -0.02 0.00 0.00 39.34 39.75 1n4s n TYR 40 CO 0.00 0.00 0.00 0.66 -1.01 0.00 0.00 176.86 176.51 1n4s h SER 41 N 3.14 0.21 0.12 7.72 4.64 -1.64 -0.67 113.55 127.08 1n4s h SER 41 Ca 0.00 0.02 0.00 0.00 -0.47 0.00 0.00 61.79 61.34 1n4s h SER 41 Cb 1.58 -0.02 0.00 0.00 -0.31 0.00 0.00 62.40 63.64 1n4s h SER 41 CO 0.30 0.10 0.00 -1.54 -0.87 0.00 0.00 176.83 174.82 1n4s n SER 42 N -4.42 0.00 -0.78 4.97 3.41 -1.26 -1.75 113.62 113.79 1n4s n SER 42 Ca 0.15 -0.24 0.12 0.00 -0.26 0.00 0.00 58.87 58.64 1n4s n SER 42 Cb 0.67 -0.13 0.13 0.00 -0.26 0.00 0.00 64.21 64.62 1n4s n SER 42 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 1n4s n LEU 43 N -1.13 2.55 -0.20 1.04 4.77 -0.26 -4.60 117.00 119.18 1n4s n LEU 43 Ca 0.10 -0.87 -0.05 0.00 -0.03 0.00 0.00 56.01 55.16 1n4s n LEU 43 Cb 0.08 -0.00 0.01 0.00 -2.33 0.00 0.00 43.42 41.18 1n4s n LEU 43 CO 0.10 0.44 0.64 -0.08 -1.33 0.00 0.00 177.39 177.16 1n4s h GLU 44 N 3.82 -0.15 0.00 3.23 4.57 -1.49 -0.69 114.58 123.87 1n4s h GLU 44 Ca 0.00 0.01 0.00 0.00 -1.18 0.00 0.00 59.36 58.19 1n4s h GLU 44 Cb 0.88 0.03 0.00 0.00 -0.16 0.00 0.00 28.75 29.50 1n4s h GLU 44 CO 0.00 -0.10 0.00 0.25 -1.18 0.00 0.00 179.01 177.98 1n4s n THR 45 N -5.43 0.14 -2.61 0.32 -2.24 -1.26 -3.08 114.28 100.10 1n4s n THR 45 Ca 0.04 0.03 -0.04 0.00 -2.27 0.00 0.00 64.05 61.82 1n4s n THR 45 Cb 0.35 -0.72 0.05 0.00 -2.10 0.00 0.00 70.33 67.91 1n4s n THR 45 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 1n4s n SER 46 N -1.09 2.11 0.15 3.42 3.41 -0.30 -3.97 113.62 117.34 1n4s n SER 46 Ca 0.13 -2.39 0.02 0.00 -0.26 0.00 0.00 58.87 56.38 1n4s n SER 46 Cb 0.09 -0.44 0.39 0.00 -0.26 0.00 0.00 64.21 64.00 1n4s n SER 46 CO 0.00 0.00 0.00 0.03 -0.16 0.00 0.00 175.04 174.91 1n4s h ARG 47 N 2.29 0.15 -0.66 4.33 3.08 -1.33 -2.54 114.38 119.71 1n4s h ARG 47 Ca -0.05 -0.04 -0.02 0.00 0.07 0.00 0.00 59.98 59.93 1n4s h ARG 47 Cb 1.38 -0.02 -0.03 0.00 0.08 0.00 0.00 29.97 31.39 1n4s h ARG 47 CO 0.27 0.36 0.32 1.25 -1.07 0.00 0.00 179.97 181.10 1n4s h LEU 48 N 0.14 0.83 -0.71 3.04 5.85 -1.57 0.30 115.31 123.19 1n4s h LEU 48 Ca 0.02 -0.09 -0.07 0.00 0.84 0.00 0.00 57.88 58.59 1n4s h LEU 48 Cb 0.46 -0.21 -0.01 0.00 0.37 0.00 0.00 40.66 41.27 1n4s h LEU 48 CO 0.03 0.71 -0.33 0.71 -0.34 0.00 0.00 178.44 179.22 1n4s h THR 49 N 0.92 0.69 -0.32 1.05 1.35 -1.76 -0.80 112.91 114.04 1n4s h THR 49 Ca 0.23 -1.52 -0.14 0.00 -0.55 0.00 0.00 66.41 64.43 1n4s h THR 49 Cb 0.09 2.00 -0.00 0.00 -1.73 0.00 0.00 68.15 68.51 1n4s h THR 49 CO -0.03 0.32 -0.35 0.40 -0.25 0.00 0.00 175.52 175.61 1n4s h ILE 50 N 0.00 1.29 -0.68 6.82 1.08 -1.10 -1.15 117.51 123.78 1n4s h ILE 50 Ca -0.00 -1.52 0.01 0.00 -0.39 0.00 0.00 64.86 62.95 1n4s h ILE 50 Cb 0.97 1.52 -0.03 0.00 -3.07 0.00 0.00 36.82 36.21 1n4s h ILE 50 CO 0.04 0.50 0.45 0.00 -0.69 0.00 0.00 178.15 178.44 1n4s h ALA 51 N 0.72 0.86 -0.02 1.87 0.00 -0.61 -1.69 119.26 120.39 1n4s h ALA 51 Ca 0.05 -0.04 0.03 0.00 0.00 0.00 0.00 54.91 54.94 1n4s h ALA 51 Cb 0.93 -0.27 -0.03 0.00 0.00 0.00 0.00 17.79 18.42 1n4s h ALA 51 CO 0.08 0.28 -0.16 0.35 0.00 0.00 0.00 179.25 179.80 1n4s h PHE 52 N 0.91 -0.40 -0.85 0.00 3.57 -0.86 0.49 116.94 119.79 1n4s h PHE 52 Ca 0.25 0.01 0.09 0.00 3.53 0.00 0.00 57.97 61.86 1n4s h PHE 52 Cb -0.10 0.18 -0.07 0.00 2.79 0.00 0.00 35.95 38.75 1n4s h PHE 52 CO -0.03 -0.23 0.50 0.74 -2.23 0.00 0.00 178.31 177.07 1n4s h PHE 53 N -0.25 0.92 -0.00 0.41 0.05 -0.79 0.30 116.94 117.56 1n4s h PHE 53 Ca 0.06 0.03 -0.00 0.00 3.82 0.00 0.00 57.97 61.87 1n4s h PHE 53 Cb 0.32 -0.28 0.00 0.00 2.00 0.00 0.00 35.95 37.99 1n4s h PHE 53 CO -0.22 0.39 -0.01 0.00 -0.18 0.00 0.00 178.31 178.29 1n4s h ALA 54 N 1.46 0.01 -0.04 2.45 0.00 -0.77 -1.22 119.26 121.14 1n4s h ALA 54 Ca 0.41 -0.33 -0.00 0.00 0.00 0.00 0.00 54.91 54.98 1n4s h ALA 54 Cb 0.34 -0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.13 1n4s h ALA 54 CO -0.24 -0.15 0.01 -0.07 0.00 0.00 0.00 179.25 178.80 1n4s h LEU 55 N -0.64 0.06 -1.47 0.00 3.38 0.18 0.21 115.31 117.03 1n4s h LEU 55 Ca -0.00 -0.19 -0.06 0.00 0.09 0.00 0.00 57.88 57.73 1n4s h LEU 55 Cb 0.67 -0.02 -0.01 0.00 0.09 0.00 0.00 40.66 41.40 1n4s h LEU 55 CO 0.00 0.23 -0.27 -1.28 0.09 0.00 0.00 178.44 177.21 1n4s h SER 56 N -0.12 0.00 -0.33 -0.43 0.87 -0.54 0.15 113.55 113.15 1n4s h SER 56 Ca 0.01 0.00 -0.10 0.00 -1.23 0.00 0.00 61.79 60.48 1n4s h SER 56 Cb 0.19 0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 62.14 1n4s h SER 56 CO -0.00 0.27 -0.17 1.23 -0.53 0.00 0.00 176.83 177.63 1n4s h GLY 57 N 0.89 0.76 1.10 5.77 0.00 -0.76 0.53 103.07 111.35 1n4s h GLY 57 Ca -0.00 -0.69 -0.12 0.00 0.00 0.00 0.00 47.33 46.52 1n4s h GLY 57 CO 0.04 0.63 -0.13 1.41 0.00 0.00 0.00 176.54 178.48 1n4s h LEU 58 N 0.47 1.04 -0.19 3.11 3.38 0.14 -2.04 115.31 121.22 1n4s h LEU 58 Ca 0.07 -0.36 0.01 0.00 0.09 0.00 0.00 57.88 57.69 1n4s h LEU 58 Cb 0.71 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 41.16 1n4s h LEU 58 CO 0.05 1.16 0.11 -0.78 0.09 0.00 0.00 178.44 179.07 1n4s h ASP 59 N 0.90 0.17 -0.14 -0.43 -0.00 -0.64 0.16 116.42 116.44 1n4s h ASP 59 Ca 0.13 0.00 0.04 0.00 -0.00 0.00 0.00 57.03 57.21 1n4s h ASP 59 Cb 0.71 -0.03 -0.01 0.00 -0.00 0.00 0.00 39.33 40.00 1n4s h ASP 59 CO 0.05 0.13 0.12 -0.03 -0.00 0.00 0.00 179.24 179.51 1n4s h MET 60 N 0.22 0.00 -0.20 0.28 4.05 -0.63 0.16 114.93 118.81 1n4s h MET 60 Ca 0.07 0.00 0.00 0.00 -0.28 0.00 0.00 59.70 59.49 1n4s h MET 60 Cb -0.00 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 30.80 1n4s h MET 60 CO -0.04 0.00 0.00 1.28 0.23 0.00 0.00 176.91 178.38 1n4s n LEU 61 N -4.16 2.93 -3.36 3.39 4.77 -0.64 -0.39 117.00 119.54 1n4s n LEU 61 Ca 0.00 -1.14 -0.17 0.00 -0.03 0.00 0.00 56.01 54.68 1n4s n LEU 61 Cb 0.24 -0.12 0.09 0.00 -2.33 0.00 0.00 43.42 41.29 1n4s n LEU 61 CO 0.31 0.57 0.12 -0.67 -1.33 0.00 0.00 177.39 176.39 1n4s n ASP 62 N 1.20 -2.39 -1.26 -1.43 2.03 0.55 -4.95 116.55 110.31 1n4s n ASP 62 Ca 0.17 -0.59 0.05 0.00 0.52 0.00 0.00 54.79 54.93 1n4s n ASP 62 Cb 0.55 -4.96 0.07 0.00 -0.72 0.00 0.00 41.12 36.07 1n4s n ASP 62 CO 0.00 0.00 0.00 -1.20 -1.92 0.00 0.00 177.20 174.08 1n4s n SER 63 N -3.04 1.19 0.03 1.67 7.64 0.33 -4.85 113.62 116.59 1n4s n SER 63 Ca -0.26 -2.51 0.06 0.00 1.01 0.00 0.00 58.87 57.17 1n4s n SER 63 Cb 0.66 -0.36 0.25 0.00 -1.01 0.00 0.00 64.21 63.75 1n4s n SER 63 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 1n4s n LEU 64 N 0.07 0.12 0.26 -3.43 4.77 -1.25 -2.42 117.00 115.12 1n4s n LEU 64 Ca 0.09 0.54 0.16 0.00 -0.03 0.00 0.00 56.01 56.78 1n4s n LEU 64 Cb 1.03 -0.54 0.60 0.00 -2.33 0.00 0.00 43.42 42.18 1n4s n LEU 64 CO -0.04 -0.43 0.96 -2.24 -1.33 0.00 0.00 177.39 174.32 1n4s h ASP 65 N 0.00 0.00 0.00 -1.43 2.03 -1.94 -3.03 116.42 112.05 1n4s h ASP 65 Ca 0.00 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.30 1n4s h ASP 65 Cb 0.16 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 38.66 1n4s h ASP 65 CO 0.00 0.00 0.00 1.33 -1.03 0.00 0.00 179.24 179.54 1n4s n VAL 66 N -3.06 0.00 -4.25 4.15 0.24 -1.02 -4.78 118.33 109.62 1n4s n VAL 66 Ca 0.01 0.00 -0.14 0.00 -2.04 0.00 0.00 64.34 62.17 1n4s n VAL 66 Cb 0.34 -0.15 -0.10 0.00 -1.47 0.00 0.00 33.84 32.46 1n4s n VAL 66 CO 0.00 0.00 0.00 0.68 -2.14 0.00 0.00 176.83 175.37 1n4s s VAL 67 N -2.00 1.08 -0.83 3.34 -7.23 -1.15 -5.09 120.40 108.53 1n4s s VAL 67 Ca 0.07 -2.04 -0.17 0.00 -1.81 0.00 0.00 61.98 58.02 1n4s s VAL 67 Cb 0.03 -1.88 0.15 0.00 0.56 0.00 0.00 36.38 35.24 1n4s s VAL 67 CO 0.05 -0.71 0.94 0.21 -0.31 0.00 0.00 175.10 175.27 1n4s s ASN 68 N -3.17 6.58 0.28 4.85 3.84 -1.26 -4.90 114.94 121.17 1n4s s ASN 68 Ca 0.17 -2.12 0.03 0.00 0.21 0.00 0.00 52.86 51.15 1n4s s ASN 68 Cb 0.03 -2.32 0.69 0.00 -0.55 0.00 0.00 41.25 39.10 1n4s s ASN 68 CO 0.01 -0.93 1.71 0.11 -2.79 0.00 0.00 177.10 175.21 1n4s h LYS 69 N 8.58 0.43 -0.69 0.43 1.57 -1.93 -1.74 116.57 123.23 1n4s h LYS 69 Ca 0.05 -0.03 -0.02 0.00 -1.87 0.00 0.00 60.65 58.79 1n4s h LYS 69 Cb 1.04 -0.10 -0.03 0.00 0.08 0.00 0.00 32.23 33.22 1n4s h LYS 69 CO 0.99 0.28 0.36 -0.44 -0.57 0.00 0.00 179.45 180.08 1n4s h ASP 70 N 0.44 0.87 0.08 0.86 3.32 -1.92 0.23 116.42 120.30 1n4s h ASP 70 Ca 0.54 -0.11 -0.00 0.00 0.02 0.00 0.00 57.03 57.48 1n4s h ASP 70 Cb 0.98 -0.22 0.00 0.00 0.22 0.00 0.00 39.33 40.31 1n4s h ASP 70 CO -0.50 0.73 -0.04 0.44 -1.72 0.00 0.00 179.24 178.15 1n4s h ASP 71 N 0.94 -0.10 -0.83 6.45 3.32 -1.75 -2.60 116.42 121.86 1n4s h ASP 71 Ca 0.24 -0.17 0.03 0.00 0.02 0.00 0.00 57.03 57.14 1n4s h ASP 71 Cb 0.07 0.02 -0.04 0.00 0.22 0.00 0.00 39.33 39.60 1n4s h ASP 71 CO -0.04 0.12 0.55 0.40 -1.72 0.00 0.00 179.24 178.54 1n4s h ILE 72 N -0.31 1.16 -0.73 0.35 2.04 -1.31 -1.53 117.51 117.18 1n4s h ILE 72 Ca -0.01 -0.36 -0.03 0.00 1.00 0.00 0.00 64.86 65.45 1n4s h ILE 72 Cb 0.26 0.01 -0.03 0.00 -0.74 0.00 0.00 36.82 36.32 1n4s h ILE 72 CO 0.02 0.19 0.32 0.40 0.00 0.00 0.00 178.15 179.09 1n4s h ILE 73 N 1.06 1.24 -0.46 -0.67 2.04 -0.83 -0.77 117.51 119.12 1n4s h ILE 73 Ca 0.32 -0.71 -0.13 0.00 1.00 0.00 0.00 64.86 65.34 1n4s h ILE 73 Cb -0.02 0.33 -0.01 0.00 -0.74 0.00 0.00 36.82 36.38 1n4s h ILE 73 CO -0.09 0.29 -0.24 -0.33 0.00 0.00 0.00 178.15 177.79 1n4s h GLU 74 N 1.04 0.95 -0.21 2.37 4.39 -0.95 -1.48 114.58 120.70 1n4s h GLU 74 Ca 0.25 -0.41 -0.00 0.00 0.34 0.00 0.00 59.36 59.54 1n4s h GLU 74 Cb 0.15 -0.03 -0.01 0.00 -0.10 0.00 0.00 28.75 28.76 1n4s h GLU 74 CO -0.03 1.08 0.13 2.35 -1.16 0.00 0.00 179.01 181.38 1n4s h TRP 75 N 0.82 0.27 -0.52 4.33 7.01 -0.86 -1.35 115.95 125.65 1n4s h TRP 75 Ca 0.10 0.00 0.01 0.00 2.11 0.00 0.00 58.89 61.12 1n4s h TRP 75 Cb 0.81 -0.09 -0.03 0.00 -2.10 0.00 0.00 29.16 27.75 1n4s h TRP 75 CO 0.05 0.21 0.33 0.82 -2.79 0.00 0.00 178.44 177.05 1n4s h ILE 76 N 0.26 1.09 0.00 2.65 2.04 -1.02 -1.62 117.51 120.91 1n4s h ILE 76 Ca 0.07 -0.23 -0.01 0.00 1.00 0.00 0.00 64.86 65.70 1n4s h ILE 76 Cb 0.01 0.38 -0.00 0.00 -0.74 0.00 0.00 36.82 36.47 1n4s h ILE 76 CO -0.01 0.12 -0.04 1.88 0.00 0.00 0.00 178.15 180.09 1n4s h TYR 77 N 0.66 0.00 0.00 1.37 0.05 -0.95 0.12 116.97 118.22 1n4s h TYR 77 Ca 0.20 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.98 1n4s h TYR 77 Cb -0.03 0.00 0.00 0.00 1.01 0.00 0.00 36.73 37.71 1n4s h TYR 77 CO -0.05 0.04 0.00 -1.13 -1.05 0.00 0.00 178.16 175.97 1n4s n SER 78 N -3.28 0.29 -0.37 3.88 3.41 -0.54 -2.57 113.62 114.44 1n4s n SER 78 Ca -0.01 0.54 0.13 0.00 -0.26 0.00 0.00 58.87 59.27 1n4s n SER 78 Cb 0.21 -0.61 0.29 0.00 -0.26 0.00 0.00 64.21 63.83 1n4s n SER 78 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 1n4s n LEU 79 N -1.79 1.43 -4.71 1.04 4.77 0.03 -4.62 117.00 113.15 1n4s n LEU 79 Ca 0.05 -0.45 -0.42 0.00 -0.03 0.00 0.00 56.01 55.16 1n4s n LEU 79 Cb 0.29 -0.07 -0.03 0.00 -2.33 0.00 0.00 43.42 41.28 1n4s n LEU 79 CO 0.23 0.26 0.73 -1.58 -1.33 0.00 0.00 177.39 175.70 1n4s s GLN 80 N -2.41 4.52 -0.58 3.23 0.74 -1.06 -0.19 119.66 123.91 1n4s s GLN 80 Ca 0.25 1.49 -0.22 0.00 0.05 0.00 0.00 55.36 56.92 1n4s s GLN 80 Cb 0.19 -3.45 0.06 0.00 1.10 0.00 0.00 33.01 30.92 1n4s s GLN 80 CO 0.50 -0.11 0.87 0.08 -0.55 0.00 0.00 175.29 176.07 1n4s s VAL 81 N 1.10 4.50 0.32 1.34 1.01 0.99 -4.90 120.40 124.77 1n4s s VAL 81 Ca 0.53 -0.21 -0.07 0.00 0.00 0.00 0.00 61.98 62.24 1n4s s VAL 81 Cb -0.22 -4.54 -0.06 0.00 0.00 0.00 0.00 36.38 31.56 1n4s s VAL 81 CO 0.27 -1.17 0.62 -0.76 0.00 0.00 0.00 175.10 174.06 1n4s s LEU 82 N 3.62 3.99 0.44 3.92 1.43 -1.26 -3.04 118.68 127.78 1n4s s LEU 82 Ca 0.23 0.84 -0.24 0.00 -1.03 0.00 0.00 54.13 53.93 1n4s s LEU 82 Cb -0.16 -3.68 -0.08 0.00 0.03 0.00 0.00 46.19 42.30 1n4s s LEU 82 CO 0.13 -0.25 1.19 -2.16 0.23 0.00 0.00 176.35 175.49 1n4s s PRO 83 N -3.63 3.85 0.87 1.29 0.04 -1.26 -4.35 135.00 131.82 1n4s s PRO 83 Ca 0.46 1.86 -0.12 0.00 0.04 0.00 0.00 61.00 63.24 1n4s s PRO 83 Cb -0.11 -2.53 0.11 0.00 0.04 0.00 0.00 34.50 32.02 1n4s s PRO 83 CO 0.30 -0.50 1.12 0.95 0.04 0.00 0.00 177.00 178.92 1n4s s THR 84 N -1.45 2.37 0.23 1.26 -4.23 -1.26 -3.01 115.64 109.55 1n4s s THR 84 Ca 0.61 0.12 -0.12 0.00 -1.18 0.00 0.00 61.69 61.12 1n4s s THR 84 Cb -0.31 -2.86 0.31 0.00 1.34 0.00 0.00 72.50 70.97 1n4s s THR 84 CO 0.38 -0.16 1.61 1.05 -0.54 0.00 0.00 174.62 176.96 1n4s h GLU 85 N -1.36 0.00 0.00 3.99 9.09 -1.95 0.62 114.58 124.97 1n4s h GLU 85 Ca -0.49 -0.00 0.00 0.00 0.05 0.00 0.00 59.36 58.92 1n4s h GLU 85 Cb 1.31 -0.00 0.00 0.00 -1.65 0.00 0.00 28.75 28.41 1n4s h GLU 85 CO 0.61 0.00 0.00 -0.40 0.05 0.00 0.00 179.01 179.27 1n4s n ASP 86 N -5.49 0.00 -4.25 3.06 3.85 -1.26 -4.90 116.55 107.55 1n4s n ASP 86 Ca 0.10 -1.43 -0.34 0.00 -0.71 0.00 0.00 54.79 52.41 1n4s n ASP 86 Cb 0.38 0.00 -0.05 0.00 -1.35 0.00 0.00 41.12 40.10 1n4s n ASP 86 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.20 176.73 1n4s n ARG 87 N -0.77 -2.23 -0.22 0.11 1.74 0.22 -4.84 116.66 110.67 1n4s n ARG 87 Ca 0.13 0.27 0.12 0.00 -0.77 0.00 0.00 57.85 57.60 1n4s n ARG 87 Cb 0.06 -4.58 0.25 0.00 -1.02 0.00 0.00 32.46 27.17 1n4s n ARG 87 CO 0.00 0.00 0.00 -1.13 -1.52 0.00 0.00 177.63 174.98 1n4s n SER 88 N -2.74 3.38 -0.81 0.55 3.41 -1.26 -4.27 113.62 111.89 1n4s n SER 88 Ca -0.09 -1.98 0.06 0.00 -0.26 0.00 0.00 58.87 56.60 1n4s n SER 88 Cb 0.57 -0.29 0.16 0.00 -0.26 0.00 0.00 64.21 64.39 1n4s n SER 88 CO 0.00 0.00 0.00 -0.46 -0.16 0.00 0.00 175.04 174.42 1n4s n ASN 89 N 1.42 1.53 -0.32 4.04 6.94 -1.26 -4.83 115.26 122.77 1n4s n ASN 89 Ca 0.20 -3.36 -0.02 0.00 -0.02 0.00 0.00 54.58 51.38 1n4s n ASN 89 Cb 0.58 -0.46 0.11 0.00 -2.36 0.00 0.00 39.78 37.65 1n4s n ASN 89 CO 0.00 0.00 0.00 -0.07 -1.03 0.00 0.00 177.26 176.16 1n4s h LEU 90 N 0.95 0.96 0.00 -4.53 3.38 -1.95 -1.65 115.31 112.47 1n4s h LEU 90 Ca -0.06 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.90 1n4s h LEU 90 Cb 1.23 -0.22 0.00 0.00 0.09 0.00 0.00 40.66 41.76 1n4s h LEU 90 CO 0.03 0.67 0.00 0.47 0.09 0.00 0.00 178.44 179.69 1n4s n ASP 91 N -4.52 0.00 -0.03 -0.43 9.92 -1.26 -1.99 116.55 118.25 1n4s n ASP 91 Ca 0.11 0.17 0.02 0.00 -0.53 0.00 0.00 54.79 54.56 1n4s n ASP 91 Cb 0.07 -0.22 0.03 0.00 -0.64 0.00 0.00 41.12 40.36 1n4s n ASP 91 CO 0.00 0.00 0.00 0.54 0.13 0.00 0.00 177.20 177.87 1n4s n ARG 92 N -1.22 2.30 -2.35 -1.24 1.74 -0.62 -4.62 116.66 110.65 1n4s n ARG 92 Ca 0.01 -1.62 -0.30 0.00 -0.77 0.00 0.00 57.85 55.17 1n4s n ARG 92 Cb 0.02 -1.05 -0.01 0.00 -1.02 0.00 0.00 32.46 30.40 1n4s n ARG 92 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1n4s n GLY 94 N -2.11 0.17 3.33 0.00 0.00 -1.17 -4.41 105.19 101.00 1n4s n GLY 94 Ca 0.04 -1.08 -0.25 0.00 0.00 0.00 0.00 46.02 44.73 1n4s n GLY 94 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1n4s s PHE 95 N -4.00 1.95 0.32 1.61 0.40 -1.26 -0.01 117.98 117.00 1n4s s PHE 95 Ca 0.00 -0.41 -0.01 0.00 -0.60 0.00 0.00 56.93 55.91 1n4s s PHE 95 Cb 0.00 -1.05 -0.04 0.00 0.51 0.00 0.00 43.02 42.45 1n4s s PHE 95 CO 0.00 0.28 0.54 1.03 0.70 0.00 0.00 175.22 177.76 1n4s s ARG 96 N -2.13 3.52 0.32 0.44 0.52 0.73 -0.78 118.95 121.57 1n4s s ARG 96 Ca 0.11 -0.25 0.17 0.00 -0.52 0.00 0.00 55.73 55.23 1n4s s ARG 96 Cb -0.09 -2.67 0.32 0.00 0.52 0.00 0.00 34.95 33.02 1n4s s ARG 96 CO 0.05 0.18 1.56 0.78 0.02 0.00 0.00 175.30 177.90 1n4s h GLY 97 N 1.08 0.00 -0.15 -3.53 0.00 -1.89 -3.46 103.07 95.12 1n4s h GLY 97 Ca -0.49 0.00 0.02 0.00 0.00 0.00 0.00 47.33 46.86 1n4s h GLY 97 CO 0.63 0.00 0.07 -1.14 0.00 0.00 0.00 176.54 176.10 1n4s n SER 98 N -3.33 -0.17 -1.99 0.19 3.41 -1.26 -1.46 113.62 109.01 1n4s n SER 98 Ca 0.01 -1.09 -0.08 0.00 -0.26 0.00 0.00 58.87 57.46 1n4s n SER 98 Cb 0.65 0.28 0.28 0.00 -0.26 0.00 0.00 64.21 65.16 1n4s n SER 98 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 1n4s n SER 99 N -0.60 4.62 0.15 4.04 3.41 -1.26 -4.65 113.62 119.33 1n4s n SER 99 Ca -0.00 -3.19 0.09 0.00 -0.26 0.00 0.00 58.87 55.51 1n4s n SER 99 Cb 0.06 -0.75 0.47 0.00 -0.26 0.00 0.00 64.21 63.73 1n4s n SER 99 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1n4s n TYR 100 N -0.21 0.58 0.63 7.33 4.11 -1.26 -1.72 117.16 126.62 1n4s n TYR 100 Ca 0.41 0.31 0.13 0.00 -0.00 0.00 0.00 57.90 58.74 1n4s n TYR 100 Cb 1.37 -0.93 0.35 0.00 -0.00 0.00 0.00 39.34 40.13 1n4s n TYR 100 CO 0.00 0.00 0.00 1.28 -0.00 0.00 0.00 176.86 178.14 1n4s n LEU 101 N -2.12 0.76 0.00 -3.48 4.77 -1.26 -4.94 117.00 110.73 1n4s n LEU 101 Ca -0.01 0.48 0.00 0.00 -0.03 0.00 0.00 56.01 56.45 1n4s n LEU 101 Cb 0.11 -0.29 0.00 0.00 -2.33 0.00 0.00 43.42 40.91 1n4s n LEU 101 CO 0.08 -0.14 0.00 0.61 -1.33 0.00 0.00 177.39 176.61 1n4s n GLY 102 N 1.32 0.66 3.73 -0.72 0.00 -0.70 -5.03 105.19 104.45 1n4s n GLY 102 Ca 0.05 -0.25 -0.42 0.00 0.00 0.00 0.00 46.02 45.40 1n4s n GLY 102 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1n4s s ILE 103 N -2.00 3.58 0.20 -0.61 1.01 -1.26 -4.94 121.20 117.17 1n4s s ILE 103 Ca 0.00 1.22 -0.33 0.00 0.00 0.00 0.00 60.65 61.54 1n4s s ILE 103 Cb 0.00 -3.78 -0.14 0.00 0.01 0.00 0.00 42.46 38.55 1n4s s ILE 103 CO 0.00 0.14 1.47 -0.81 0.00 0.00 0.00 174.94 175.75 1n4s n PRO 104 N 3.24 2.02 -1.67 2.79 -0.04 -1.26 -4.85 135.00 135.24 1n4s n PRO 104 Ca 0.07 0.73 -0.55 0.00 -0.04 0.00 0.00 63.50 63.71 1n4s n PRO 104 Cb 0.44 -2.43 -0.07 0.00 -0.04 0.00 0.00 33.50 31.41 1n4s n PRO 104 CO 0.00 0.00 0.00 0.34 -0.04 0.00 0.00 175.50 175.80 1n4s n PHE 105 N 2.58 1.86 -3.28 0.54 7.35 -1.26 -4.95 117.46 120.29 1n4s n PHE 105 Ca 0.14 0.56 -0.07 0.00 -0.76 0.00 0.00 57.45 57.32 1n4s n PHE 105 Cb 0.30 -2.42 -0.05 0.00 0.35 0.00 0.00 39.48 37.66 1n4s n PHE 105 CO 0.00 0.00 0.00 1.21 -0.76 0.00 0.00 176.76 177.21 1n4s s ASN 106 N 2.41 -0.03 -0.57 -2.13 2.47 -1.26 -5.06 114.94 110.77 1n4s s ASN 106 Ca 0.93 -0.52 -0.05 0.00 0.42 0.00 0.00 52.86 53.64 1n4s s ASN 106 Cb -1.02 1.27 -0.05 0.00 -1.45 0.00 0.00 41.25 40.00 1n4s s ASN 106 CO 0.58 -0.31 1.70 -0.81 -3.72 0.00 0.00 177.10 174.54 1n4s n PRO 107 N 5.10 1.28 -4.07 0.43 -0.04 -1.26 -4.07 135.00 132.36 1n4s n PRO 107 Ca 0.04 -1.14 -0.31 0.00 -0.04 0.00 0.00 63.50 62.05 1n4s n PRO 107 Cb 0.50 -2.32 -0.01 0.00 -0.04 0.00 0.00 33.50 31.62 1n4s n PRO 107 CO 0.00 0.00 0.00 0.43 -0.04 0.00 0.00 175.50 175.89 1n4s n SER 108 N 4.80 -2.59 0.00 3.54 7.64 -1.10 -4.75 113.62 121.16 1n4s n SER 108 Ca 0.30 -0.96 0.00 0.00 1.01 0.00 0.00 58.87 59.21 1n4s n SER 108 Cb 0.11 -3.08 0.00 0.00 -1.01 0.00 0.00 64.21 60.23 1n4s n SER 108 CO 0.00 0.00 0.00 0.29 -3.01 0.00 0.00 175.04 172.32 1n4s n LYS 109 N -4.44 0.00 -1.32 1.43 5.02 -1.26 -5.01 118.16 112.57 1n4s n LYS 109 Ca -0.06 0.00 -0.29 0.00 -2.02 0.00 0.00 58.31 55.94 1n4s n LYS 109 Cb 0.56 -0.14 0.19 0.00 -0.02 0.00 0.00 35.03 35.62 1n4s n LYS 109 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 1n4s s ASN 110 N -1.00 2.31 0.80 4.39 2.20 -1.26 -5.05 114.94 117.33 1n4s s ASN 110 Ca 0.00 0.83 0.00 0.00 -0.94 0.00 0.00 52.86 52.75 1n4s s ASN 110 Cb 0.00 -1.26 0.00 0.00 -2.00 0.00 0.00 41.25 37.99 1n4s s ASN 110 CO 0.00 -3.29 0.00 -0.81 -2.94 0.00 0.00 177.10 170.06 1n4s n PRO 111 N -4.23 -0.96 -3.23 3.55 -0.04 -1.26 -4.98 135.00 123.85 1n4s n PRO 111 Ca 0.09 0.00 -0.39 0.00 -0.04 0.00 0.00 63.50 63.17 1n4s n PRO 111 Cb 0.59 0.00 -0.06 0.00 -0.04 0.00 0.00 33.50 33.99 1n4s n PRO 111 CO 0.00 0.00 0.00 0.20 -0.04 0.00 0.00 175.50 175.66 1n4s s GLY 112 N -2.03 2.68 -0.51 0.55 0.00 -1.16 -4.98 107.32 101.87 1n4s s GLY 112 Ca 0.00 0.06 -0.20 0.00 0.00 0.00 0.00 44.72 44.58 1n4s s GLY 112 CO 0.00 0.59 0.67 -0.51 0.00 0.00 0.00 173.10 173.84 1n4s s THR 113 N -0.83 4.81 0.14 0.90 -4.23 -1.26 -4.50 115.64 110.67 1n4s s THR 113 Ca 0.30 -0.35 -0.34 0.00 -1.18 0.00 0.00 61.69 60.12 1n4s s THR 113 Cb -0.19 -4.32 -0.17 0.00 1.34 0.00 0.00 72.50 69.16 1n4s s THR 113 CO 0.19 -0.83 1.05 0.00 -0.54 0.00 0.00 174.62 174.49 1n4s n ALA 114 N 6.34 -1.66 -3.69 3.99 0.00 -1.26 -5.00 120.51 119.23 1n4s n ALA 114 Ca -0.05 0.49 -0.10 0.00 0.00 0.00 0.00 53.44 53.77 1n4s n ALA 114 Cb 0.46 -1.91 -0.11 0.00 0.00 0.00 0.00 19.45 17.89 1n4s n ALA 114 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.50 175.92 1n4s s HIS 115 N -0.27 -0.62 0.45 0.00 5.04 -1.26 -5.06 115.29 113.57 1n4s s HIS 115 Ca 0.75 1.30 0.26 0.00 -1.54 0.00 0.00 55.06 55.84 1n4s s HIS 115 Cb -0.95 0.26 1.30 0.00 0.04 0.00 0.00 32.58 33.23 1n4s s HIS 115 CO 0.54 -0.36 1.76 -1.35 -2.34 0.00 0.00 174.74 172.99 1n4s h PRO 116 N 7.35 0.21 0.00 2.88 0.11 -2.05 -2.94 132.00 137.56 1n4s h PRO 116 Ca -0.33 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.77 1n4s h PRO 116 Cb 1.17 -0.05 0.00 0.00 0.11 0.00 0.00 31.00 32.23 1n4s h PRO 116 CO 0.26 0.14 -0.08 0.66 -0.21 0.00 0.00 178.00 178.78 1n4s n TYR 117 N -4.48 0.00 -3.16 0.65 4.01 -1.26 -5.02 117.16 107.90 1n4s n TYR 117 Ca 0.27 -0.61 -0.40 0.00 -0.16 0.00 0.00 57.90 57.00 1n4s n TYR 117 Cb 1.08 -0.09 -0.06 0.00 -0.31 0.00 0.00 39.34 39.95 1n4s n TYR 117 CO 0.00 0.00 0.00 0.34 -0.46 0.00 0.00 176.86 176.74 1n4s s ASP 118 N -1.79 6.61 0.26 7.72 2.15 -1.11 -5.02 116.67 125.48 1n4s s ASP 118 Ca 0.15 0.74 -0.18 0.00 0.43 0.00 0.00 52.55 53.69 1n4s s ASP 118 Cb 0.13 -2.32 0.02 0.00 -0.30 0.00 0.00 42.92 40.44 1n4s s ASP 118 CO 0.01 -0.26 0.62 -0.94 -0.17 0.00 0.00 175.17 174.44 1n4s s SER 119 N 1.26 -0.23 0.80 -0.34 1.04 -1.26 -4.89 113.70 110.08 1n4s s SER 119 Ca 0.26 -0.66 -0.09 0.00 0.48 0.00 0.00 55.95 55.94 1n4s s SER 119 Cb -0.16 0.67 0.12 0.00 0.10 0.00 0.00 66.02 66.75 1n4s s SER 119 CO 0.10 -1.24 1.13 -0.83 0.98 0.00 0.00 173.24 173.38 1n4s s GLY 120 N -2.93 1.72 -0.08 7.32 0.00 -0.60 -4.62 107.32 108.13 1n4s s GLY 120 Ca 0.13 -1.13 0.00 0.00 0.00 0.00 0.00 44.72 43.73 1n4s s GLY 120 CO 0.05 -0.57 -0.06 -1.58 0.00 0.00 0.00 173.10 170.95 1n4s s HIS 121 N -3.48 1.10 0.30 1.90 5.04 0.04 -4.60 115.29 115.58 1n4s s HIS 121 Ca 0.66 -0.44 0.05 0.00 -1.54 0.00 0.00 55.06 53.79 1n4s s HIS 121 Cb -0.08 -0.97 0.78 0.00 0.04 0.00 0.00 32.58 32.35 1n4s s HIS 121 CO 0.48 -0.36 1.67 0.97 -2.34 0.00 0.00 174.74 175.17 1n4s h ILE 122 N 6.18 0.39 0.00 0.89 2.10 -1.07 0.38 117.51 126.38 1n4s h ILE 122 Ca -0.29 -0.11 -0.04 0.00 1.08 0.00 0.00 64.86 65.49 1n4s h ILE 122 Cb 1.14 0.04 -0.01 0.00 -1.09 0.00 0.00 36.82 36.91 1n4s h ILE 122 CO 0.39 0.06 -0.21 0.00 -1.08 0.00 0.00 178.15 177.31 1n4s h ALA 123 N 1.75 1.07 0.16 0.18 0.00 -1.94 -1.56 119.26 118.92 1n4s h ALA 123 Ca 0.58 -0.19 -0.32 0.00 0.00 0.00 0.00 54.91 54.98 1n4s h ALA 123 Cb 1.17 -0.03 0.01 0.00 0.00 0.00 0.00 17.79 18.93 1n4s h ALA 123 CO -0.58 0.27 -1.57 0.52 0.00 0.00 0.00 179.25 177.89 1n4s h MET 124 N 0.00 0.34 -0.81 0.00 2.86 -0.65 -1.63 114.93 115.03 1n4s h MET 124 Ca -0.00 -0.57 -0.02 0.00 -2.06 0.00 0.00 59.70 57.04 1n4s h MET 124 Cb 0.67 0.21 -0.04 0.00 0.06 0.00 0.00 31.60 32.51 1n4s h MET 124 CO 0.03 1.23 0.43 1.15 1.06 0.00 0.00 176.91 180.81 1n4s h THR 125 N 0.09 1.25 0.73 2.22 2.02 -0.69 0.52 112.91 119.04 1n4s h THR 125 Ca -0.27 -0.63 -0.04 0.00 0.77 0.00 0.00 66.41 66.24 1n4s h THR 125 Cb 2.06 0.17 0.01 0.00 -1.74 0.00 0.00 68.15 68.65 1n4s h THR 125 CO 0.19 0.28 -0.35 0.22 0.37 0.00 0.00 175.52 176.23 1n4s h TYR 126 N 1.14 -0.91 -0.09 3.16 3.20 -1.32 -1.81 116.97 120.34 1n4s h TYR 126 Ca 0.28 -0.02 -0.04 0.00 3.14 0.00 0.00 58.73 62.09 1n4s h TYR 126 Cb 0.06 0.30 -0.01 0.00 1.54 0.00 0.00 36.73 38.62 1n4s h TYR 126 CO 0.01 -0.54 -0.13 1.79 -1.64 0.00 0.00 178.16 177.64 1n4s h THR 127 N -1.19 1.15 0.72 1.81 1.35 -1.22 -1.11 112.91 114.43 1n4s h THR 127 Ca -0.10 -0.68 -0.04 0.00 -0.55 0.00 0.00 66.41 65.05 1n4s h THR 127 Cb 0.77 1.23 0.01 0.00 -1.73 0.00 0.00 68.15 68.43 1n4s h THR 127 CO 0.16 0.21 -0.35 1.23 -0.25 0.00 0.00 175.52 176.52 1n4s h GLY 128 N 0.64 -1.02 0.66 5.82 0.00 0.08 0.11 103.07 109.36 1n4s h GLY 128 Ca 0.03 0.38 0.06 0.00 0.00 0.00 0.00 47.33 47.80 1n4s h GLY 128 CO 0.02 -0.37 0.39 1.41 0.00 0.00 0.00 176.54 177.99 1n4s h LEU 129 N -1.08 0.58 -0.74 3.11 3.38 -1.20 -0.98 115.31 118.38 1n4s h LEU 129 Ca -0.10 0.03 0.03 0.00 0.09 0.00 0.00 57.88 57.94 1n4s h LEU 129 Cb 0.77 -0.08 -0.05 0.00 0.09 0.00 0.00 40.66 41.39 1n4s h LEU 129 CO 0.16 0.37 0.47 -1.28 0.09 0.00 0.00 178.44 178.25 1n4s h SER 130 N 0.71 0.76 -0.46 -0.43 0.87 -1.09 -1.82 113.55 112.08 1n4s h SER 130 Ca 0.32 0.00 -0.06 0.00 -1.23 0.00 0.00 61.79 60.82 1n4s h SER 130 Cb 0.21 -0.16 -0.02 0.00 -0.44 0.00 0.00 62.40 61.99 1n4s h SER 130 CO -0.19 0.52 0.07 0.00 -0.53 0.00 0.00 176.83 176.70 1n4s h LEU 132 N 0.64 0.50 -0.60 0.00 3.38 -0.78 0.00 115.31 118.45 1n4s h LEU 132 Ca 0.14 0.03 -0.06 0.00 0.09 0.00 0.00 57.88 58.08 1n4s h LEU 132 Cb 0.40 -0.07 -0.02 0.00 0.09 0.00 0.00 40.66 41.05 1n4s h LEU 132 CO 0.01 0.33 0.16 0.40 0.09 0.00 0.00 178.44 179.43 1n4s h ILE 133 N 0.64 1.25 -0.88 1.22 2.04 -1.16 -1.12 117.51 119.50 1n4s h ILE 133 Ca 0.28 -0.88 -0.02 0.00 1.00 0.00 0.00 64.86 65.24 1n4s h ILE 133 Cb 0.17 0.68 -0.04 0.00 -0.74 0.00 0.00 36.82 36.88 1n4s h ILE 133 CO -0.17 0.33 0.49 0.40 0.00 0.00 0.00 178.15 179.19 1n4s h ILE 134 N 0.87 1.25 0.00 -0.67 2.04 -0.74 -2.21 117.51 118.05 1n4s h ILE 134 Ca 0.19 -0.62 0.00 0.00 1.00 0.00 0.00 64.86 65.43 1n4s h ILE 134 Cb 0.33 0.07 0.00 0.00 -0.74 0.00 0.00 36.82 36.48 1n4s h ILE 134 CO -0.00 0.28 0.00 0.18 0.00 0.00 0.00 178.15 178.61 1n4s n LEU 135 N -4.36 0.00 0.00 1.44 4.77 -0.07 -4.89 117.00 113.89 1n4s n LEU 135 Ca 0.09 0.30 0.00 0.00 -0.03 0.00 0.00 56.01 56.37 1n4s n LEU 135 Cb 0.09 -0.30 0.00 0.00 -2.33 0.00 0.00 43.42 40.89 1n4s n LEU 135 CO 0.39 -0.07 0.00 0.61 -1.33 0.00 0.00 177.39 176.99 1n4s n GLY 136 N 0.70 0.61 3.75 -0.72 0.00 -0.83 -4.95 105.19 103.76 1n4s n GLY 136 Ca 0.11 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.80 1n4s n GLY 136 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1n4s s ASP 137 N -2.96 4.65 0.00 1.61 -1.08 -0.46 -4.95 116.67 113.47 1n4s s ASP 137 Ca 0.00 2.06 0.22 0.00 -0.52 0.00 0.00 52.55 54.30 1n4s s ASP 137 Cb 0.00 -2.55 0.51 0.00 -1.46 0.00 0.00 42.92 39.42 1n4s s ASP 137 CO 0.00 -1.94 1.44 -0.90 0.52 0.00 0.00 175.17 174.29 1n4s n ASP 138 N -2.81 3.63 -1.08 -0.34 5.68 -1.26 -4.50 116.55 115.87 1n4s n ASP 138 Ca 0.11 -1.98 -0.14 0.00 -0.50 0.00 0.00 54.79 52.27 1n4s n ASP 138 Cb 0.52 -0.36 -0.06 0.00 -1.14 0.00 0.00 41.12 40.08 1n4s n ASP 138 CO 0.00 0.00 0.00 0.18 -1.33 0.00 0.00 177.20 176.05 1n4s n LEU 139 N 1.47 -0.89 0.21 -2.12 4.32 -1.26 -4.88 117.00 113.85 1n4s n LEU 139 Ca 0.21 0.35 0.06 0.00 -0.02 0.00 0.00 56.01 56.61 1n4s n LEU 139 Cb 0.59 -2.38 0.45 0.00 -1.62 0.00 0.00 43.42 40.46 1n4s n LEU 139 CO 0.15 -0.88 0.78 0.77 -1.22 0.00 0.00 177.39 177.00 1n4s h SER 140 N 0.00 0.00 -0.10 -1.43 4.64 -2.02 -2.32 113.55 112.31 1n4s h SER 140 Ca -0.29 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.03 1n4s h SER 140 Cb 1.06 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.15 1n4s h SER 140 CO 0.42 0.30 0.00 0.54 -0.87 0.00 0.00 176.83 177.23 1n4s n ARG 141 N -3.81 1.52 -3.17 4.77 1.74 -1.26 -4.81 116.66 111.64 1n4s n ARG 141 Ca -0.01 -0.78 -0.39 0.00 -0.77 0.00 0.00 57.85 55.89 1n4s n ARG 141 Cb 0.39 -1.39 -0.06 0.00 -1.02 0.00 0.00 32.46 30.38 1n4s n ARG 141 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 1n4s s VAL 142 N -1.88 5.07 -1.23 1.55 1.01 -0.88 -4.97 120.40 119.07 1n4s s VAL 142 Ca 0.33 1.14 -0.19 0.00 0.00 0.00 0.00 61.98 63.26 1n4s s VAL 142 Cb 0.17 -3.92 0.08 0.00 0.00 0.00 0.00 36.38 32.71 1n4s s VAL 142 CO 0.27 0.18 1.65 -0.62 0.00 0.00 0.00 175.10 176.57 1n4s s ASP 143 N 1.04 6.80 0.23 3.32 -1.08 -1.26 -4.82 116.67 120.90 1n4s s ASP 143 Ca 0.28 -2.31 -0.07 0.00 -0.52 0.00 0.00 52.55 49.93 1n4s s ASP 143 Cb -0.16 -2.56 0.41 0.00 -1.46 0.00 0.00 42.92 39.15 1n4s s ASP 143 CO 0.11 -1.19 1.68 0.11 0.52 0.00 0.00 175.17 176.40 1n4s h LYS 144 N 7.96 0.21 -0.23 4.34 1.57 -1.93 -0.85 116.57 127.64 1n4s h LYS 144 Ca 0.39 -0.01 -0.06 0.00 -1.87 0.00 0.00 60.65 59.09 1n4s h LYS 144 Cb 0.90 -0.05 -0.01 0.00 0.08 0.00 0.00 32.23 33.15 1n4s h LYS 144 CO 1.43 0.14 -0.13 0.93 -0.57 0.00 0.00 179.45 181.25 1n4s h GLU 145 N 0.22 0.38 -0.20 3.15 4.39 -1.99 -1.74 114.58 118.78 1n4s h GLU 145 Ca 0.39 -0.10 -0.06 0.00 0.34 0.00 0.00 59.36 59.93 1n4s h GLU 145 Cb 0.65 -0.05 -0.01 0.00 -0.10 0.00 0.00 28.75 29.25 1n4s h GLU 145 CO -0.52 0.51 -0.10 0.00 -1.16 0.00 0.00 179.01 177.74 1n4s h ALA 146 N 1.52 0.29 -0.60 3.43 0.00 -1.57 -1.41 119.26 120.92 1n4s h ALA 146 Ca 0.07 -0.29 0.00 0.00 0.00 0.00 0.00 54.91 54.69 1n4s h ALA 146 Cb 0.44 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 18.13 1n4s h ALA 146 CO 0.03 0.12 0.38 0.00 0.00 0.00 0.00 179.25 179.77 1n4s h LEU 148 N 0.81 0.53 -0.47 0.00 3.38 -1.27 0.15 115.31 118.44 1n4s h LEU 148 Ca 0.22 -0.13 -0.08 0.00 0.09 0.00 0.00 57.88 57.98 1n4s h LEU 148 Cb -0.06 -0.14 -0.02 0.00 0.09 0.00 0.00 40.66 40.54 1n4s h LEU 148 CO -0.04 0.66 -0.03 0.00 0.09 0.00 0.00 178.44 179.12 1n4s h ALA 149 N 1.40 0.64 -0.65 1.53 0.00 -0.71 -1.15 119.26 120.33 1n4s h ALA 149 Ca 0.10 -0.29 -0.05 0.00 0.00 0.00 0.00 54.91 54.67 1n4s h ALA 149 Cb 0.46 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 18.05 1n4s h ALA 149 CO 0.02 0.46 0.21 0.78 0.00 0.00 0.00 179.25 180.72 1n4s h GLY 150 N 0.70 1.08 1.00 0.00 0.00 -0.34 -2.68 103.07 102.84 1n4s h GLY 150 Ca 0.13 -0.63 -0.01 0.00 0.00 0.00 0.00 47.33 46.82 1n4s h GLY 150 CO 0.03 0.59 -0.10 -2.00 0.00 0.00 0.00 176.54 175.06 1n4s h LEU 151 N 0.93 -0.23 -1.00 3.11 6.46 -0.47 -2.75 115.31 121.36 1n4s h LEU 151 Ca 0.21 0.01 0.17 0.00 -0.12 0.00 0.00 57.88 58.15 1n4s h LEU 151 Cb 0.29 0.06 -0.10 0.00 -0.73 0.00 0.00 40.66 40.18 1n4s h LEU 151 CO -0.01 -0.17 0.61 0.03 -0.62 0.00 0.00 178.44 178.29 1n4s h ARG 152 N -0.28 0.79 0.00 1.25 3.08 -0.95 0.48 114.38 118.76 1n4s h ARG 152 Ca -0.03 -0.05 -0.01 0.00 0.07 0.00 0.00 59.98 59.96 1n4s h ARG 152 Cb 0.21 -0.18 -0.00 0.00 0.08 0.00 0.00 29.97 30.08 1n4s h ARG 152 CO 0.05 0.52 -0.07 0.00 -1.07 0.00 0.00 179.97 179.40 1n4s h ALA 153 N 1.62 1.29 0.00 0.04 0.00 -1.18 -2.72 119.26 118.31 1n4s h ALA 153 Ca 0.56 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 55.41 1n4s h ALA 153 Cb 0.79 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.57 1n4s h ALA 153 CO -0.36 0.08 -0.17 -0.07 0.00 0.00 0.00 179.25 178.74 1n4s h LEU 154 N 0.00 0.00 -9.54 0.00 3.38 -0.77 -3.46 115.31 104.91 1n4s h LEU 154 Ca -0.00 -0.04 -0.53 0.00 0.09 0.00 0.00 57.88 57.41 1n4s h LEU 154 Cb 0.22 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.96 1n4s h LEU 154 CO 0.01 0.02 0.46 -1.58 0.09 0.00 0.00 178.44 177.43 1n4s s GLN 155 N -3.15 4.56 0.63 1.13 0.74 -1.03 -1.49 119.66 121.05 1n4s s GLN 155 Ca 0.08 1.62 -0.01 0.00 0.05 0.00 0.00 55.36 57.11 1n4s s GLN 155 Cb 0.11 -3.35 0.07 0.00 1.10 0.00 0.00 33.01 30.93 1n4s s GLN 155 CO 0.65 -0.01 0.89 -0.51 -0.55 0.00 0.00 175.29 175.75 1n4s s LEU 156 N 0.36 3.10 0.29 3.68 1.43 0.44 -4.97 118.68 123.02 1n4s s LEU 156 Ca 0.52 -0.05 -0.00 0.00 -1.03 0.00 0.00 54.13 53.57 1n4s s LEU 156 Cb -0.27 -2.62 0.49 0.00 0.03 0.00 0.00 46.19 43.82 1n4s s LEU 156 CO 0.31 -1.45 1.91 1.05 0.23 0.00 0.00 176.35 178.40 1n4s h GLU 157 N -0.24 1.05 0.00 1.70 4.11 -1.97 -1.42 114.58 117.82 1n4s h GLU 157 Ca -0.41 -0.06 0.00 0.00 0.07 0.00 0.00 59.36 58.96 1n4s h GLU 157 Cb 1.29 -0.24 0.00 0.00 0.50 0.00 0.00 28.75 30.30 1n4s h GLU 157 CO 0.50 0.69 0.00 -0.40 0.07 0.00 0.00 179.01 179.87 1n4s n ASP 158 N -4.48 0.00 0.00 3.06 3.85 -1.26 -4.87 116.55 112.84 1n4s n ASP 158 Ca 0.14 -0.51 0.00 0.00 -0.71 0.00 0.00 54.79 53.71 1n4s n ASP 158 Cb 0.18 -0.08 0.00 0.00 -1.35 0.00 0.00 41.12 39.87 1n4s n ASP 158 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 1n4s n GLY 159 N 0.41 2.72 3.93 6.12 0.00 -0.53 -4.06 105.19 113.78 1n4s n GLY 159 Ca 0.15 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.88 1n4s n GLY 159 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1n4s n SER 160 N 0.00 0.30 -4.32 1.61 3.41 -1.26 -3.92 113.62 109.44 1n4s n SER 160 Ca 0.00 -1.59 -0.20 0.00 -0.26 0.00 0.00 58.87 56.81 1n4s n SER 160 Cb 0.00 -0.98 -0.11 0.00 -0.26 0.00 0.00 64.21 62.86 1n4s n SER 160 CO 0.00 0.00 0.00 -0.36 -0.16 0.00 0.00 175.04 174.52 1n4s s PHE 161 N -3.83 1.71 0.39 7.33 0.40 -1.26 -0.42 117.98 122.30 1n4s s PHE 161 Ca 0.75 -0.51 0.08 0.00 -0.60 0.00 0.00 56.93 56.65 1n4s s PHE 161 Cb -0.02 -0.85 -0.00 0.00 0.51 0.00 0.00 43.02 42.66 1n4s s PHE 161 CO 0.52 0.30 0.50 0.00 0.70 0.00 0.00 175.22 177.24 1n4s n ALA 163 N -1.72 1.33 -2.86 0.00 0.00 -1.26 -4.76 120.51 111.25 1n4s n ALA 163 Ca 0.04 -0.73 -0.13 0.00 0.00 0.00 0.00 53.44 52.63 1n4s n ALA 163 Cb 0.59 -0.80 -0.12 0.00 0.00 0.00 0.00 19.45 19.12 1n4s n ALA 163 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.50 177.64 1n4s s VAL 164 N -2.59 0.44 0.57 0.00 -7.23 -1.26 -0.47 120.40 109.86 1n4s s VAL 164 Ca -0.09 -0.86 0.26 0.00 -1.81 0.00 0.00 61.98 59.48 1n4s s VAL 164 Cb 0.08 -0.49 0.34 0.00 0.56 0.00 0.00 36.38 36.87 1n4s s VAL 164 CO 0.81 -0.29 2.14 1.55 -0.31 0.00 0.00 175.10 179.00 1n4s h PRO 165 N 4.86 0.00 0.00 4.82 0.13 -1.86 -0.34 132.00 139.62 1n4s h PRO 165 Ca -0.33 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.80 1n4s h PRO 165 Cb 1.20 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.33 1n4s h PRO 165 CO 0.43 0.00 0.00 0.39 -0.23 0.00 0.00 178.00 178.59 1n4s n GLU 166 N -4.04 0.18 0.00 0.86 4.71 -1.26 -4.96 120.64 116.12 1n4s n GLU 166 Ca 0.00 0.43 0.00 0.00 -0.01 0.00 0.00 57.16 57.59 1n4s n GLU 166 Cb 0.25 -1.86 0.00 0.00 -1.01 0.00 0.00 31.44 28.82 1n4s n GLU 166 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 1n4s n GLY 167 N -0.12 2.75 1.36 0.62 0.00 -0.14 -5.17 105.19 104.49 1n4s n GLY 167 Ca 0.02 -1.70 0.00 0.00 0.00 0.00 0.00 46.02 44.34 1n4s n GLY 167 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1n4s n SER 168 N 0.00 -0.49 -4.77 1.61 3.41 -1.26 -4.73 113.62 107.39 1n4s n SER 168 Ca 0.00 -1.18 -0.32 0.00 -0.26 0.00 0.00 58.87 57.11 1n4s n SER 168 Cb 0.00 0.78 0.06 0.00 -0.26 0.00 0.00 64.21 64.79 1n4s n SER 168 CO 0.00 0.00 0.00 -1.83 -0.16 0.00 0.00 175.04 173.05 1n4s s GLU 169 N -2.01 2.65 -0.04 4.33 1.03 -1.26 -4.85 118.70 118.55 1n4s s GLU 169 Ca 0.09 1.30 0.02 0.00 0.03 0.00 0.00 54.97 56.41 1n4s s GLU 169 Cb -0.01 -1.94 0.01 0.00 -0.80 0.00 0.00 34.13 31.40 1n4s s GLU 169 CO 0.01 -1.35 -0.09 0.54 -1.33 0.00 0.00 175.26 173.03 1n4s s ASN 170 N -2.89 1.36 0.15 0.83 4.22 -1.26 -4.17 114.94 113.18 1n4s s ASN 170 Ca 0.65 -0.22 -0.12 0.00 -2.14 0.00 0.00 52.86 51.03 1n4s s ASN 170 Cb -0.19 -0.50 0.04 0.00 1.28 0.00 0.00 41.25 41.88 1n4s s ASN 170 CO 0.46 0.04 0.59 -0.90 -2.04 0.00 0.00 177.10 175.25 1n4s n ASP 171 N 3.57 -1.17 -0.28 3.54 5.68 -1.21 -4.94 116.55 121.74 1n4s n ASP 171 Ca -0.21 -1.68 0.16 0.00 -0.50 0.00 0.00 54.79 52.56 1n4s n ASP 171 Cb 0.53 1.92 0.44 0.00 -1.14 0.00 0.00 41.12 42.87 1n4s n ASP 171 CO 0.00 0.00 0.00 -0.03 -1.33 0.00 0.00 177.20 175.84 1n4s h MET 172 N 0.00 0.54 -0.67 0.11 1.85 -1.77 -2.23 114.93 112.76 1n4s h MET 172 Ca -0.18 -0.03 0.13 0.00 -0.61 0.00 0.00 59.70 59.01 1n4s h MET 172 Cb 0.75 -0.12 -0.09 0.00 0.43 0.00 0.00 31.60 32.56 1n4s h MET 172 CO 0.24 0.36 0.19 0.00 -0.40 0.00 0.00 176.91 177.30 1n4s h ARG 173 N 0.56 0.32 0.00 0.39 3.08 -1.94 -0.92 114.38 115.86 1n4s h ARG 173 Ca 0.50 -0.02 -0.01 0.00 0.07 0.00 0.00 59.98 60.52 1n4s h ARG 173 Cb 1.04 -0.07 -0.00 0.00 0.08 0.00 0.00 29.97 31.01 1n4s h ARG 173 CO -0.24 0.21 -0.06 0.74 -1.07 0.00 0.00 179.97 179.55 1n4s h PHE 174 N 0.33 0.00 -0.47 3.04 0.05 -1.69 -2.53 116.94 115.66 1n4s h PHE 174 Ca 0.36 0.00 -0.13 0.00 3.82 0.00 0.00 57.97 62.03 1n4s h PHE 174 Cb 0.55 0.00 -0.01 0.00 2.00 0.00 0.00 35.95 38.49 1n4s h PHE 174 CO -0.22 0.06 -0.20 0.28 -0.18 0.00 0.00 178.31 178.05 1n4s h VAL 175 N 0.00 1.27 -0.60 -0.55 2.07 -1.12 -1.12 116.25 116.20 1n4s h VAL 175 Ca -0.00 -1.35 -0.05 0.00 0.82 0.00 0.00 66.70 66.11 1n4s h VAL 175 Cb 0.91 1.14 -0.02 0.00 -1.52 0.00 0.00 31.29 31.80 1n4s h VAL 175 CO 0.01 0.47 0.17 0.22 0.02 0.00 0.00 177.57 178.45 1n4s h TYR 176 N 0.81 0.99 -0.32 1.57 3.20 -1.15 -0.88 116.97 121.19 1n4s h TYR 176 Ca 0.11 -0.11 -0.00 0.00 3.14 0.00 0.00 58.73 61.87 1n4s h TYR 176 Cb 0.77 -0.28 -0.01 0.00 1.54 0.00 0.00 36.73 38.74 1n4s h TYR 176 CO 0.05 0.83 0.18 0.00 -1.64 0.00 0.00 178.16 177.58 1n4s h ALA 178 N 1.05 0.64 -0.51 0.00 0.00 -1.01 -0.60 119.26 118.84 1n4s h ALA 178 Ca 0.11 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.01 1n4s h ALA 178 Cb 0.04 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 17.66 1n4s h ALA 178 CO -0.02 0.01 0.34 0.77 0.00 0.00 0.00 179.25 180.35 1n4s h SER 179 N 0.61 0.59 -0.67 0.00 0.02 -0.79 -1.27 113.55 112.03 1n4s h SER 179 Ca 0.20 -0.02 -0.04 0.00 -0.84 0.00 0.00 61.79 61.09 1n4s h SER 179 Cb 0.01 -0.15 -0.03 0.00 0.14 0.00 0.00 62.40 62.37 1n4s h SER 179 CO -0.09 0.43 0.27 0.00 -1.14 0.00 0.00 176.83 176.31 1n4s h ILE 181 N 0.95 0.77 -0.97 0.00 2.04 -0.79 0.29 117.51 119.81 1n4s h ILE 181 Ca 0.23 -0.15 0.09 0.00 1.00 0.00 0.00 64.86 66.02 1n4s h ILE 181 Cb 0.20 0.86 -0.07 0.00 -0.74 0.00 0.00 36.82 37.07 1n4s h ILE 181 CO -0.02 0.03 0.61 0.00 0.00 0.00 0.00 178.15 178.78 1n4s h TYR 183 N 1.05 0.38 -0.51 0.00 3.20 -0.88 0.12 116.97 120.34 1n4s h TYR 183 Ca 0.45 -0.06 -0.10 0.00 3.14 0.00 0.00 58.73 62.16 1n4s h TYR 183 Cb 0.30 -0.10 -0.02 0.00 1.54 0.00 0.00 36.73 38.45 1n4s h TYR 183 CO -0.01 0.51 -0.10 0.52 -1.64 0.00 0.00 178.16 177.44 1n4s h MET 184 N 0.14 0.93 -0.05 1.82 2.86 -0.37 -1.24 114.93 119.03 1n4s h MET 184 Ca 0.06 -0.32 0.00 0.00 -2.06 0.00 0.00 59.70 57.38 1n4s h MET 184 Cb 0.34 -0.07 0.00 0.00 0.06 0.00 0.00 31.60 31.93 1n4s h MET 184 CO 0.01 0.98 0.00 1.28 1.06 0.00 0.00 176.91 180.23 1n4s n LEU 185 N -4.15 0.57 -4.20 1.22 4.77 0.12 -4.90 117.00 110.43 1n4s n LEU 185 Ca 0.02 -0.23 -0.31 0.00 -0.03 0.00 0.00 56.01 55.46 1n4s n LEU 185 Cb 0.38 -0.03 -0.06 0.00 -2.33 0.00 0.00 43.42 41.38 1n4s n LEU 185 CO 0.44 0.12 -0.31 -3.20 -1.33 0.00 0.00 177.39 173.11 1n4s n ASN 186 N -0.42 -0.23 -3.46 -1.43 5.15 -0.17 -4.93 115.26 109.77 1n4s n ASN 186 Ca 0.15 -1.15 -0.02 0.00 -0.60 0.00 0.00 54.58 52.96 1n4s n ASN 186 Cb 0.16 -2.26 -0.05 0.00 -0.53 0.00 0.00 39.78 37.10 1n4s n ASN 186 CO 0.00 0.00 0.00 0.21 1.40 0.00 0.00 177.26 178.87 1n4s s ASN 187 N -4.16 -0.87 -0.09 1.20 3.84 -0.15 -5.02 114.94 109.69 1n4s s ASN 187 Ca 0.16 1.07 0.11 0.00 0.21 0.00 0.00 52.86 54.41 1n4s s ASN 187 Cb -0.09 1.93 0.47 0.00 -0.55 0.00 0.00 41.25 43.01 1n4s s ASN 187 CO 0.95 -0.25 1.30 0.79 -2.79 0.00 0.00 177.10 177.11 1n4s n TRP 188 N 5.42 1.05 0.84 0.43 7.02 -1.26 -4.00 117.44 126.94 1n4s n TRP 188 Ca -0.07 -0.40 0.09 0.00 -1.02 0.00 0.00 57.50 56.10 1n4s n TRP 188 Cb 0.50 -0.22 0.46 0.00 -2.42 0.00 0.00 31.31 29.62 1n4s n TRP 188 CO 0.00 0.00 0.00 -1.13 -2.02 0.00 0.00 177.69 174.54 1n4s n SER 189 N 0.56 0.00 0.04 -0.99 3.41 -1.26 -2.54 113.62 112.84 1n4s n SER 189 Ca 0.17 0.09 0.10 0.00 -0.26 0.00 0.00 58.87 58.96 1n4s n SER 189 Cb 0.67 -0.32 0.41 0.00 -0.26 0.00 0.00 64.21 64.71 1n4s n SER 189 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1n4s n GLY 190 N 0.31 -1.19 3.39 5.00 0.00 -1.26 -4.82 105.19 106.62 1n4s n GLY 190 Ca 0.08 -0.02 -0.10 0.00 0.00 0.00 0.00 46.02 45.98 1n4s n GLY 190 CO 0.00 0.00 0.00 -3.16 0.00 0.00 0.00 173.32 170.16 1n4s s MET 191 N -3.08 1.19 -0.91 1.61 0.23 -1.05 -2.58 119.30 114.70 1n4s s MET 191 Ca 0.08 -0.90 -0.16 0.00 -1.03 0.00 0.00 55.69 53.67 1n4s s MET 191 Cb 0.11 0.46 0.18 0.00 -1.53 0.00 0.00 34.83 34.04 1n4s s MET 191 CO 0.36 -0.47 0.99 0.34 -2.03 0.00 0.00 175.02 174.21 1n4s s ASP 192 N -2.88 6.75 0.30 -1.18 3.68 -1.26 -4.91 116.67 117.18 1n4s s ASP 192 Ca 0.09 -2.45 0.07 0.00 2.13 0.00 0.00 52.55 52.38 1n4s s ASP 192 Cb 0.01 -2.31 0.78 0.00 -1.45 0.00 0.00 42.92 39.95 1n4s s ASP 192 CO -0.05 -0.80 1.75 -0.03 0.13 0.00 0.00 175.17 176.17 1n4s h MET 193 N 8.18 0.64 -0.67 4.34 1.85 -1.98 -1.30 114.93 125.99 1n4s h MET 193 Ca 0.15 -0.04 0.02 0.00 -0.61 0.00 0.00 59.70 59.22 1n4s h MET 193 Cb 1.02 -0.14 -0.04 0.00 0.43 0.00 0.00 31.60 32.86 1n4s h MET 193 CO 0.96 0.42 0.43 -0.22 -0.40 0.00 0.00 176.91 178.10 1n4s h LYS 194 N 0.66 0.84 -0.28 0.39 3.64 -1.99 -0.17 116.57 119.65 1n4s h LYS 194 Ca 0.59 -0.05 -0.15 0.00 -1.27 0.00 0.00 60.65 59.77 1n4s h LYS 194 Cb 1.01 -0.19 -0.01 0.00 -0.41 0.00 0.00 32.23 32.64 1n4s h LYS 194 CO -0.43 0.55 -0.45 0.87 -2.27 0.00 0.00 179.45 177.73 1n4s h LYS 195 N 0.86 0.71 -0.43 1.90 1.57 -1.63 -2.17 116.57 117.39 1n4s h LYS 195 Ca 0.26 -0.40 -0.02 0.00 -1.87 0.00 0.00 60.65 58.62 1n4s h LYS 195 Cb -0.04 0.02 -0.02 0.00 0.08 0.00 0.00 32.23 32.27 1n4s h LYS 195 CO -0.08 1.02 0.19 0.00 -0.57 0.00 0.00 179.45 180.01 1n4s h ALA 196 N 0.92 0.55 -0.92 3.86 0.00 -0.97 -1.28 119.26 121.42 1n4s h ALA 196 Ca 0.04 -0.12 0.01 0.00 0.00 0.00 0.00 54.91 54.83 1n4s h ALA 196 Cb 1.00 -0.17 -0.05 0.00 0.00 0.00 0.00 17.79 18.58 1n4s h ALA 196 CO 0.09 0.13 0.61 0.82 0.00 0.00 0.00 179.25 180.91 1n4s h ILE 197 N 0.55 1.23 -0.68 0.00 2.04 -0.96 -1.11 117.51 118.58 1n4s h ILE 197 Ca 0.14 -0.43 -0.03 0.00 1.00 0.00 0.00 64.86 65.55 1n4s h ILE 197 Cb 0.15 -0.12 -0.03 0.00 -0.74 0.00 0.00 36.82 36.07 1n4s h ILE 197 CO -0.02 0.23 0.30 -1.28 0.00 0.00 0.00 178.15 177.38 1n4s h SER 198 N 1.24 0.91 -0.56 1.72 0.87 -0.93 -0.81 113.55 116.00 1n4s h SER 198 Ca 0.34 -0.15 -0.02 0.00 -1.23 0.00 0.00 61.79 60.73 1n4s h SER 198 Cb -0.13 -0.24 -0.03 0.00 -0.44 0.00 0.00 62.40 61.56 1n4s h SER 198 CO -0.08 0.81 0.28 0.22 -0.53 0.00 0.00 176.83 177.54 1n4s h TYR 199 N 0.96 0.80 -0.64 2.24 3.20 -0.28 -1.04 116.97 122.21 1n4s h TYR 199 Ca 0.23 -0.03 -0.03 0.00 3.14 0.00 0.00 58.73 62.04 1n4s h TYR 199 Cb 0.16 -0.25 -0.03 0.00 1.54 0.00 0.00 36.73 38.15 1n4s h TYR 199 CO 0.01 0.61 0.28 0.82 -1.64 0.00 0.00 178.16 178.24 1n4s h ILE 200 N 0.76 1.23 -0.24 1.81 2.04 -0.85 -2.49 117.51 119.77 1n4s h ILE 200 Ca 0.19 -0.68 -0.02 0.00 1.00 0.00 0.00 64.86 65.36 1n4s h ILE 200 Cb 0.10 0.49 -0.01 0.00 -0.74 0.00 0.00 36.82 36.66 1n4s h ILE 200 CO -0.03 0.27 0.08 0.03 0.00 0.00 0.00 178.15 178.50 1n4s h ARG 201 N 0.88 0.38 0.00 2.37 3.08 -0.87 -2.71 114.38 117.51 1n4s h ARG 201 Ca 0.22 -0.08 0.00 0.00 0.07 0.00 0.00 59.98 60.18 1n4s h ARG 201 Cb 0.16 -0.05 0.00 0.00 0.08 0.00 0.00 29.97 30.16 1n4s h ARG 201 CO -0.02 0.46 0.00 0.54 -1.07 0.00 0.00 179.97 179.88 1n4s n ARG 202 N -4.75 0.02 0.00 0.04 1.74 -0.42 -1.76 116.66 111.53 1n4s n ARG 202 Ca -0.03 0.41 0.13 0.00 -0.77 0.00 0.00 57.85 57.58 1n4s n ARG 202 Cb 0.16 -1.54 0.33 0.00 -1.02 0.00 0.00 32.46 30.38 1n4s n ARG 202 CO 0.00 0.00 0.00 -1.13 -1.52 0.00 0.00 177.63 174.98 1n4s n SER 203 N -1.57 0.83 -4.70 0.55 3.41 -0.95 -3.95 113.62 107.23 1n4s n SER 203 Ca 0.01 -0.65 -0.42 0.00 -0.26 0.00 0.00 58.87 57.55 1n4s n SER 203 Cb 0.08 0.18 -0.03 0.00 -0.26 0.00 0.00 64.21 64.18 1n4s n SER 203 CO 0.00 0.00 0.00 -0.32 -0.16 0.00 0.00 175.04 174.56 1n4s s MET 204 N -2.69 4.24 0.74 4.33 0.00 -0.72 -1.46 119.30 123.74 1n4s s MET 204 Ca 0.19 2.20 -0.08 0.00 0.00 0.00 0.00 55.69 58.01 1n4s s MET 204 Cb 0.19 -3.48 0.08 0.00 0.00 0.00 0.00 34.83 31.61 1n4s s MET 204 CO 0.59 -0.63 1.06 0.45 0.00 0.00 0.00 175.02 176.49 1n4s s SER 205 N 1.91 4.61 0.51 1.11 0.15 -0.07 -4.88 113.70 117.03 1n4s s SER 205 Ca 0.69 0.44 0.28 0.00 0.70 0.00 0.00 55.95 58.07 1n4s s SER 205 Cb -0.38 -1.01 1.34 0.00 -1.71 0.00 0.00 66.02 64.26 1n4s s SER 205 CO 0.30 -1.75 2.00 0.10 1.20 0.00 0.00 173.24 175.10 1n4s h TYR 206 N -0.74 0.00 -0.19 3.44 -0.00 -1.94 -1.06 116.97 116.47 1n4s h TYR 206 Ca -0.44 0.00 0.00 0.00 0.00 0.00 0.00 58.73 58.29 1n4s h TYR 206 Cb 1.31 0.00 0.00 0.00 0.00 0.00 0.00 36.73 38.04 1n4s h TYR 206 CO 0.18 0.13 0.00 -0.40 -0.00 0.00 0.00 178.16 178.08 1n4s n ASP 207 N -3.46 1.55 0.00 0.10 3.85 -1.26 -4.94 116.55 112.39 1n4s n ASP 207 Ca -0.01 -1.76 0.00 0.00 -0.71 0.00 0.00 54.79 52.31 1n4s n ASP 207 Cb 0.30 -0.12 0.00 0.00 -1.35 0.00 0.00 41.12 39.94 1n4s n ASP 207 CO 0.00 0.00 0.00 0.59 -1.01 0.00 0.00 177.20 176.78 1n4s n ASN 208 N 0.27 0.00 -4.53 -1.12 3.02 -0.40 -4.79 115.26 107.71 1n4s n ASN 208 Ca 0.15 0.00 -0.25 0.00 -0.03 0.00 0.00 54.58 54.45 1n4s n ASN 208 Cb 0.29 0.00 0.13 0.00 -0.61 0.00 0.00 39.78 39.59 1n4s n ASN 208 CO 0.00 0.00 0.00 -0.83 -2.62 0.00 0.00 177.26 173.81 1n4s s GLY 209 N -2.00 1.76 -0.08 7.41 0.00 -1.26 -4.17 107.32 108.98 1n4s s GLY 209 Ca 0.00 -1.67 -0.01 0.00 0.00 0.00 0.00 44.72 43.04 1n4s s GLY 209 CO 0.00 -1.03 -0.02 1.08 0.00 0.00 0.00 173.10 173.12 1n4s s LEU 210 N -5.32 3.43 0.58 0.66 1.02 -1.26 -0.90 118.68 116.89 1n4s s LEU 210 Ca 0.69 0.08 0.07 0.00 0.02 0.00 0.00 54.13 54.98 1n4s s LEU 210 Cb -0.04 -1.77 0.07 0.00 0.02 0.00 0.00 46.19 44.46 1n4s s LEU 210 CO 0.47 0.36 0.58 0.00 0.02 0.00 0.00 176.35 177.77 1n4s s ALA 211 N -0.80 4.61 0.40 4.21 0.00 -0.54 -0.84 121.76 128.80 1n4s s ALA 211 Ca 0.12 -1.55 0.17 0.00 0.00 0.00 0.00 51.96 50.70 1n4s s ALA 211 Cb -0.11 -0.99 1.00 0.00 0.00 0.00 0.00 23.12 23.01 1n4s s ALA 211 CO 0.02 -0.66 1.94 1.96 0.00 0.00 0.00 175.76 179.02 1n4s h GLN 212 N 0.46 0.00 -2.39 0.00 1.08 -1.88 -3.45 115.11 108.93 1n4s h GLN 212 Ca -0.33 0.00 0.17 0.00 -1.45 0.00 0.00 58.65 57.04 1n4s h GLN 212 Cb 1.30 0.00 -0.07 0.00 -0.05 0.00 0.00 27.48 28.66 1n4s h GLN 212 CO 0.50 0.24 0.49 0.20 -0.95 0.00 0.00 178.83 179.32 1n4s s GLY 213 N -4.24 -0.15 0.18 3.46 0.00 -1.26 -2.31 107.32 103.00 1n4s s GLY 213 Ca -0.03 0.01 -0.33 0.00 0.00 0.00 0.00 44.72 44.37 1n4s s GLY 213 CO 0.68 0.39 1.37 0.00 0.00 0.00 0.00 173.10 175.54 1n4s n ALA 214 N -0.51 0.36 0.00 3.20 0.00 -1.25 -2.18 120.51 120.13 1n4s n ALA 214 Ca -0.06 0.45 0.00 0.00 0.00 0.00 0.00 53.44 53.83 1n4s n ALA 214 Cb 0.60 -2.20 0.00 0.00 0.00 0.00 0.00 19.45 17.86 1n4s n ALA 214 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1n4s n GLY 215 N 2.46 3.07 3.82 0.00 0.00 -1.26 -5.02 105.19 108.25 1n4s n GLY 215 Ca 0.15 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.87 1n4s n GLY 215 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1n4s s LEU 216 N 0.00 2.64 0.15 0.99 2.01 -0.93 -4.99 118.68 118.55 1n4s s LEU 216 Ca 0.00 1.27 -0.31 0.00 0.01 0.00 0.00 54.13 55.10 1n4s s LEU 216 Cb 0.00 -3.91 -0.09 0.00 0.01 0.00 0.00 46.19 42.20 1n4s s LEU 216 CO 0.00 -1.88 1.47 -0.70 1.01 0.00 0.00 176.35 176.25 1n4s s GLU 217 N -5.19 4.27 0.52 1.70 2.12 -1.26 -4.68 118.70 116.18 1n4s s GLU 217 Ca 0.60 2.21 -0.22 0.00 0.36 0.00 0.00 54.97 57.93 1n4s s GLU 217 Cb -0.14 -3.20 -0.06 0.00 0.26 0.00 0.00 34.13 31.00 1n4s s GLU 217 CO 0.54 -0.51 1.27 -1.54 -0.54 0.00 0.00 175.26 174.49 1n4s s SER 218 N 1.06 5.60 0.01 -1.70 1.04 -1.26 -4.35 113.70 114.10 1n4s s SER 218 Ca 0.66 2.56 -0.03 0.00 0.48 0.00 0.00 55.95 59.63 1n4s s SER 218 Cb -0.40 -2.62 -0.01 0.00 0.10 0.00 0.00 66.02 63.09 1n4s s SER 218 CO 0.32 -1.33 0.03 -2.28 0.98 0.00 0.00 173.24 170.96 1n4s s HIS 219 N -1.42 0.15 0.28 5.02 2.46 -0.02 -4.81 115.29 116.96 1n4s s HIS 219 Ca 0.69 -0.33 -0.02 0.00 0.47 0.00 0.00 55.06 55.88 1n4s s HIS 219 Cb -0.35 -0.12 0.44 0.00 -0.13 0.00 0.00 32.58 32.42 1n4s s HIS 219 CO 0.42 -0.20 1.92 0.78 -2.47 0.00 0.00 174.74 175.18 1n4s h GLY 220 N 4.68 1.35 0.82 1.59 0.00 -0.39 -0.43 103.07 110.69 1n4s h GLY 220 Ca -0.31 -0.45 -0.03 0.00 0.00 0.00 0.00 47.33 46.54 1n4s h GLY 220 CO 0.42 0.37 0.00 -1.33 0.00 0.00 0.00 176.54 175.99 1n4s h GLY 221 N 1.14 0.38 2.00 4.60 0.00 -1.92 -2.09 103.07 107.18 1n4s h GLY 221 Ca 0.38 -0.28 -0.12 0.00 0.00 0.00 0.00 47.33 47.31 1n4s h GLY 221 CO -0.13 0.26 -0.58 1.48 0.00 0.00 0.00 176.54 177.57 1n4s h SER 222 N 0.12 0.00 -0.62 0.19 4.64 -1.77 -1.76 113.55 114.36 1n4s h SER 222 Ca 0.06 0.00 -0.09 0.00 -0.47 0.00 0.00 61.79 61.29 1n4s h SER 222 Cb 0.39 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.46 1n4s h SER 222 CO 0.01 0.58 0.04 0.74 -0.87 0.00 0.00 176.83 177.33 1n4s h THR 223 N 0.00 1.26 -0.13 2.95 2.02 -1.02 0.36 112.91 118.36 1n4s h THR 223 Ca -0.01 -1.11 -0.01 0.00 0.77 0.00 0.00 66.41 66.06 1n4s h THR 223 Cb 1.08 0.76 -0.01 0.00 -1.74 0.00 0.00 68.15 68.25 1n4s h THR 223 CO 0.08 0.41 0.06 0.15 0.37 0.00 0.00 175.52 176.58 1n4s h PHE 224 N 0.97 0.20 -0.78 3.16 3.57 -1.13 -0.71 116.94 122.22 1n4s h PHE 224 Ca 0.18 -0.01 0.06 0.00 3.53 0.00 0.00 57.97 61.72 1n4s h PHE 224 Cb 0.52 -0.06 -0.06 0.00 2.79 0.00 0.00 35.95 39.14 1n4s h PHE 224 CO 0.04 0.27 0.47 0.00 -2.23 0.00 0.00 178.31 176.86 1n4s h GLY 226 N 0.86 -0.29 0.99 0.00 0.00 -0.79 -1.84 103.07 102.00 1n4s h GLY 226 Ca 0.34 0.11 -0.02 0.00 0.00 0.00 0.00 47.33 47.76 1n4s h GLY 226 CO -0.17 -0.11 0.32 -2.22 0.00 0.00 0.00 176.54 174.37 1n4s h ILE 227 N -0.68 1.20 -0.49 2.60 1.08 -1.00 -2.04 117.51 118.18 1n4s h ILE 227 Ca -0.03 -0.53 -0.08 0.00 -0.39 0.00 0.00 64.86 63.84 1n4s h ILE 227 Cb 0.48 0.44 -0.02 0.00 -3.07 0.00 0.00 36.82 34.64 1n4s h ILE 227 CO 0.05 0.22 -0.00 0.00 -0.69 0.00 0.00 178.15 177.73 1n4s h ALA 228 N 1.15 1.07 -0.19 1.87 0.00 -0.67 -1.25 119.26 121.24 1n4s h ALA 228 Ca 0.21 -0.27 -0.00 0.00 0.00 0.00 0.00 54.91 54.85 1n4s h ALA 228 Cb 0.07 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.65 1n4s h ALA 228 CO -0.03 0.58 0.11 0.77 0.00 0.00 0.00 179.25 180.68 1n4s h SER 229 N 0.77 0.23 -0.94 0.00 0.02 -1.00 0.18 113.55 112.81 1n4s h SER 229 Ca 0.15 -0.06 -0.01 0.00 -0.84 0.00 0.00 61.79 61.03 1n4s h SER 229 Cb 0.46 -0.06 -0.04 0.00 0.14 0.00 0.00 62.40 62.90 1n4s h SER 229 CO 0.02 0.22 0.55 -0.07 -1.14 0.00 0.00 176.83 176.41 1n4s h LEU 230 N 0.22 1.14 -0.47 5.07 3.38 -1.09 -0.95 115.31 122.61 1n4s h LEU 230 Ca 0.07 -0.08 -0.05 0.00 0.09 0.00 0.00 57.88 57.91 1n4s h LEU 230 Cb 0.03 -0.29 -0.02 0.00 0.09 0.00 0.00 40.66 40.48 1n4s h LEU 230 CO -0.01 0.88 0.09 0.00 0.09 0.00 0.00 178.44 179.49 1n4s h LEU 232 N 0.64 0.61 -0.01 0.00 4.07 -0.48 0.12 115.31 120.26 1n4s h LEU 232 Ca 0.14 -0.02 0.00 0.00 0.08 0.00 0.00 57.88 58.08 1n4s h LEU 232 Cb 0.37 -0.15 0.00 0.00 1.08 0.00 0.00 40.66 41.96 1n4s h LEU 232 CO 0.01 0.45 0.00 0.23 -1.08 0.00 0.00 178.44 178.05 1n4s n MET 233 N -4.45 0.19 -3.07 1.13 2.81 -0.40 -4.92 117.12 108.41 1n4s n MET 233 Ca 0.05 0.16 -0.13 0.00 -1.81 0.00 0.00 57.70 55.97 1n4s n MET 233 Cb 0.06 -1.73 0.05 0.00 -0.71 0.00 0.00 33.22 30.89 1n4s n MET 233 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1n4s n GLY 234 N 1.33 0.06 0.47 3.03 0.00 0.43 -4.95 105.19 105.57 1n4s n GLY 234 Ca 0.06 -0.14 0.02 0.00 0.00 0.00 0.00 46.02 45.97 1n4s n GLY 234 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1n4s n LYS 235 N -3.05 0.30 0.30 1.61 5.02 -0.02 -4.90 118.16 117.42 1n4s n LYS 235 Ca -0.03 -1.43 -0.18 0.00 -2.02 0.00 0.00 58.31 54.65 1n4s n LYS 235 Cb 0.55 -0.70 -0.09 0.00 -0.02 0.00 0.00 35.03 34.77 1n4s n LYS 235 CO 0.00 0.00 0.00 1.25 -0.52 0.00 0.00 177.40 178.13 1n4s h LEU 236 N 0.08 -1.29 -1.17 -0.35 6.46 -1.90 -1.09 115.31 116.04 1n4s h LEU 236 Ca -0.01 0.10 0.10 0.00 -0.12 0.00 0.00 57.88 57.95 1n4s h LEU 236 Cb 1.34 0.42 -0.07 0.00 -0.73 0.00 0.00 40.66 41.62 1n4s h LEU 236 CO 0.01 -0.65 0.59 -0.33 -0.62 0.00 0.00 178.44 177.43 1n4s h GLU 237 N -0.99 0.86 -0.14 1.25 4.39 -1.91 -2.01 114.58 116.03 1n4s h GLU 237 Ca -0.06 -0.05 -0.15 0.00 0.34 0.00 0.00 59.36 59.44 1n4s h GLU 237 Cb 0.85 -0.19 -0.01 0.00 -0.10 0.00 0.00 28.75 29.30 1n4s h GLU 237 CO -0.04 0.57 -0.55 1.49 -1.16 0.00 0.00 179.01 179.33 1n4s h GLU 238 N 0.89 0.42 0.20 2.33 4.81 -1.84 -3.34 114.58 118.05 1n4s h GLU 238 Ca 0.43 -0.26 -0.34 0.00 -0.13 0.00 0.00 59.36 59.05 1n4s h GLU 238 Cb 0.45 0.03 0.02 0.00 0.63 0.00 0.00 28.75 29.87 1n4s h GLU 238 CO -0.19 0.86 -1.63 0.28 -0.73 0.00 0.00 179.01 177.59 1n4s h VAL 239 N 0.33 1.08 -3.73 0.32 2.07 -0.74 -3.46 116.25 112.12 1n4s h VAL 239 Ca 0.01 -2.62 -0.68 0.00 0.82 0.00 0.00 66.70 64.23 1n4s h VAL 239 Cb 1.06 2.86 -0.23 0.00 -1.52 0.00 0.00 31.29 33.46 1n4s h VAL 239 CO 0.10 0.84 -0.74 -0.36 0.02 0.00 0.00 177.57 177.42 1n4s s PHE 240 N -2.59 2.80 0.89 1.57 2.99 -0.80 -5.08 117.98 117.76 1n4s s PHE 240 Ca -0.13 -0.24 -0.12 0.00 0.00 0.00 0.00 56.93 56.45 1n4s s PHE 240 Cb 0.05 -1.72 0.13 0.00 0.00 0.00 0.00 43.02 41.48 1n4s s PHE 240 CO 0.89 0.11 1.12 -1.54 -0.00 0.00 0.00 175.22 175.80 1n4s s SER 241 N -0.43 3.66 0.25 1.36 1.04 -1.26 -4.62 113.70 113.70 1n4s s SER 241 Ca 0.05 1.11 -0.06 0.00 0.48 0.00 0.00 55.95 57.54 1n4s s SER 241 Cb -0.12 -1.75 0.27 0.00 0.10 0.00 0.00 66.02 64.52 1n4s s SER 241 CO 0.02 -2.48 1.93 -0.08 0.98 0.00 0.00 173.24 173.61 1n4s h GLU 242 N -1.44 1.31 -0.66 4.02 4.81 -1.99 0.45 114.58 121.07 1n4s h GLU 242 Ca -0.50 -0.09 -0.07 0.00 -0.13 0.00 0.00 59.36 58.58 1n4s h GLU 242 Cb 1.31 -0.29 -0.03 0.00 0.63 0.00 0.00 28.75 30.37 1n4s h GLU 242 CO 0.60 0.87 0.15 -0.22 -0.73 0.00 0.00 179.01 179.68 1n4s h LYS 243 N 1.34 1.07 -0.28 1.92 3.64 -1.99 -0.86 116.57 121.41 1n4s h LYS 243 Ca 0.36 -0.27 -0.03 0.00 -1.27 0.00 0.00 60.65 59.44 1n4s h LYS 243 Cb -0.14 -0.14 -0.01 0.00 -0.41 0.00 0.00 32.23 31.53 1n4s h LYS 243 CO -0.08 0.96 0.05 0.93 -2.27 0.00 0.00 179.45 179.04 1n4s h GLU 244 N 0.99 0.46 -0.44 1.90 5.08 -1.73 -1.98 114.58 118.86 1n4s h GLU 244 Ca 0.21 -0.12 -0.02 0.00 -1.00 0.00 0.00 59.36 58.42 1n4s h GLU 244 Cb 0.39 -0.05 -0.02 0.00 0.50 0.00 0.00 28.75 29.56 1n4s h GLU 244 CO 0.01 0.58 0.20 -0.07 -1.00 0.00 0.00 179.01 178.72 1n4s h LEU 245 N 0.28 0.55 -0.76 1.33 3.38 -0.76 -0.54 115.31 118.79 1n4s h LEU 245 Ca 0.09 -0.05 -0.09 0.00 0.09 0.00 0.00 57.88 57.92 1n4s h LEU 245 Cb 0.34 -0.14 -0.02 0.00 0.09 0.00 0.00 40.66 40.92 1n4s h LEU 245 CO 0.01 0.48 -0.03 0.78 0.09 0.00 0.00 178.44 179.77 1n4s h ASN 246 N 0.62 0.89 -0.42 -0.43 -0.26 -0.87 0.34 115.58 115.45 1n4s h ASN 246 Ca 0.15 -0.24 -0.12 0.00 -0.56 0.00 0.00 56.30 55.53 1n4s h ASN 246 Cb 0.09 -0.24 -0.01 0.00 -1.06 0.00 0.00 38.32 37.10 1n4s h ASN 246 CO -0.02 0.96 -0.19 0.03 -1.06 0.00 0.00 177.43 177.15 1n4s h ARG 247 N 0.84 0.87 -0.43 0.81 3.08 -0.53 -1.42 114.38 117.61 1n4s h ARG 247 Ca 0.15 -0.38 -0.03 0.00 0.07 0.00 0.00 59.98 59.79 1n4s h ARG 247 Cb 0.53 -0.03 -0.02 0.00 0.08 0.00 0.00 29.97 30.54 1n4s h ARG 247 CO 0.03 1.02 0.13 0.82 -1.07 0.00 0.00 179.97 180.91 1n4s h ILE 248 N 0.69 1.22 -0.70 2.04 2.04 -0.93 -1.42 117.51 120.44 1n4s h ILE 248 Ca 0.09 -0.72 0.05 0.00 1.00 0.00 0.00 64.86 65.29 1n4s h ILE 248 Cb 0.76 0.89 -0.05 0.00 -0.74 0.00 0.00 36.82 37.67 1n4s h ILE 248 CO 0.06 0.26 0.41 0.11 0.00 0.00 0.00 178.15 178.99 1n4s h LYS 249 N 0.55 0.74 -0.59 2.37 1.57 -0.78 -0.16 116.57 120.27 1n4s h LYS 249 Ca 0.14 -0.04 -0.00 0.00 -1.87 0.00 0.00 60.65 58.87 1n4s h LYS 249 Cb 0.26 -0.17 -0.03 0.00 0.08 0.00 0.00 32.23 32.37 1n4s h LYS 249 CO -0.00 0.49 0.36 -0.09 -0.57 0.00 0.00 179.45 179.64 1n4s h ARG 250 N 0.77 0.80 -0.56 3.15 9.65 -0.92 0.02 114.38 127.29 1n4s h ARG 250 Ca 0.31 -0.07 -0.03 0.00 -1.10 0.00 0.00 59.98 59.08 1n4s h ARG 250 Cb 0.15 -0.17 -0.02 0.00 -1.39 0.00 0.00 29.97 28.53 1n4s h ARG 250 CO -0.16 0.57 0.22 2.35 2.80 0.00 0.00 179.97 185.74 1n4s h TRP 251 N 0.80 0.85 -0.10 2.20 7.01 -0.43 -2.48 115.95 123.80 1n4s h TRP 251 Ca 0.21 -0.07 -0.02 0.00 2.11 0.00 0.00 58.89 61.13 1n4s h TRP 251 Cb -0.03 -0.25 -0.00 0.00 -2.10 0.00 0.00 29.16 26.77 1n4s h TRP 251 CO -0.02 0.69 -0.00 0.00 -2.79 0.00 0.00 178.44 176.32 1n4s h ILE 253 N -0.11 0.01 0.00 0.00 2.10 -0.99 -1.37 117.51 117.16 1n4s h ILE 253 Ca 0.03 -0.38 0.00 0.00 1.08 0.00 0.00 64.86 65.58 1n4s h ILE 253 Cb 0.36 1.38 0.00 0.00 -1.09 0.00 0.00 36.82 37.47 1n4s h ILE 253 CO 0.01 0.00 0.00 0.23 -1.08 0.00 0.00 178.15 177.31 1n4s n MET 254 N -3.09 0.07 0.13 2.19 2.81 -0.94 -3.09 117.12 115.21 1n4s n MET 254 Ca -0.00 0.10 0.13 0.00 -1.81 0.00 0.00 57.70 56.12 1n4s n MET 254 Cb 0.25 -1.50 0.44 0.00 -0.71 0.00 0.00 33.22 31.69 1n4s n MET 254 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 1n4s h ARG 255 N 0.00 0.00 -6.31 0.03 2.47 -1.29 -3.44 114.38 105.83 1n4s h ARG 255 Ca 0.00 0.00 -0.55 0.00 -1.26 0.00 0.00 59.98 58.17 1n4s h ARG 255 Cb 0.35 0.00 -0.03 0.00 -1.65 0.00 0.00 29.97 28.64 1n4s h ARG 255 CO 0.00 0.00 0.45 -1.14 0.56 0.00 0.00 179.97 179.84 1n4s s GLN 256 N -3.23 4.48 -0.07 0.04 0.74 -1.18 -2.28 119.66 118.17 1n4s s GLN 256 Ca 0.07 1.38 0.02 0.00 0.05 0.00 0.00 55.36 56.88 1n4s s GLN 256 Cb 0.10 -3.50 -0.06 0.00 1.10 0.00 0.00 33.01 30.66 1n4s s GLN 256 CO 0.53 -0.18 -0.04 1.04 -0.55 0.00 0.00 175.29 176.09 1n4s n GLN 257 N 4.46 1.09 0.07 1.67 1.13 -1.26 -4.97 117.38 119.56 1n4s n GLN 257 Ca 0.07 0.03 0.00 0.00 -1.94 0.00 0.00 57.00 55.16 1n4s n GLN 257 Cb 0.50 -1.15 0.00 0.00 0.11 0.00 0.00 30.24 29.70 1n4s n GLN 257 CO 0.00 0.00 0.00 0.27 -1.44 0.00 0.00 177.06 175.89 1n4s n ASN 258 N -2.56 -1.20 -0.63 1.08 0.23 -1.26 -5.07 115.26 105.86 1n4s n ASN 258 Ca -0.12 0.37 0.00 0.00 -0.53 0.00 0.00 54.58 54.30 1n4s n ASN 258 Cb 0.66 1.36 0.00 0.00 -2.08 0.00 0.00 39.78 39.71 1n4s n ASN 258 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1n4s n GLY 259 N -1.39 1.38 3.34 4.83 0.00 -1.26 -2.30 105.19 109.79 1n4s n GLY 259 Ca 0.00 -1.94 -0.28 0.00 0.00 0.00 0.00 46.02 43.80 1n4s n GLY 259 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1n4s s TYR 260 N 1.65 2.13 0.35 1.61 1.51 -1.26 -4.45 117.35 118.88 1n4s s TYR 260 Ca 0.00 -0.40 0.08 0.00 -1.01 0.00 0.00 57.07 55.74 1n4s s TYR 260 Cb 0.00 -1.20 -0.03 0.00 -0.11 0.00 0.00 41.96 40.61 1n4s s TYR 260 CO 0.00 0.22 0.25 -3.38 -1.11 0.00 0.00 175.55 171.53 1n4s s HIS 261 N -0.98 2.79 -0.29 2.71 -3.43 -0.97 -0.64 115.29 114.49 1n4s s HIS 261 Ca 0.11 -0.37 0.21 0.00 -0.80 0.00 0.00 55.06 54.20 1n4s s HIS 261 Cb -0.10 -1.81 0.12 0.00 -1.43 0.00 0.00 32.58 29.37 1n4s s HIS 261 CO 0.04 0.19 1.31 0.78 -2.00 0.00 0.00 174.74 175.06 1n4s h GLY 262 N 1.32 0.00 -3.55 -1.38 0.00 -1.87 -3.45 103.07 94.14 1n4s h GLY 262 Ca -0.44 0.00 -0.04 0.00 0.00 0.00 0.00 47.33 46.85 1n4s h GLY 262 CO 0.60 0.00 0.20 1.09 0.00 0.00 0.00 176.54 178.43 1n4s s ARG 263 N -3.18 1.16 0.20 4.80 1.70 -1.26 0.35 118.95 122.72 1n4s s ARG 263 Ca 0.03 -0.07 -0.30 0.00 -0.47 0.00 0.00 55.73 54.92 1n4s s ARG 263 Cb 0.07 0.54 -0.16 0.00 -0.57 0.00 0.00 34.95 34.83 1n4s s ARG 263 CO 0.74 -0.43 0.80 -2.30 -1.08 0.00 0.00 175.30 173.03 1n4s n PRO 264 N 0.33 0.54 -1.84 3.89 -0.02 -1.26 -2.36 135.00 134.27 1n4s n PRO 264 Ca -0.18 0.19 -0.19 0.00 -2.02 0.00 0.00 63.50 61.30 1n4s n PRO 264 Cb 0.61 -1.42 -0.05 0.00 -0.02 0.00 0.00 33.50 32.62 1n4s n PRO 264 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 1n4s n ASN 265 N 1.75 -5.29 -4.51 2.55 3.02 -1.26 -5.01 115.26 106.51 1n4s n ASN 265 Ca 0.15 0.28 -0.27 0.00 -0.03 0.00 0.00 54.58 54.72 1n4s n ASN 265 Cb 0.25 -4.40 -0.10 0.00 -0.61 0.00 0.00 39.78 34.92 1n4s n ASN 265 CO 0.00 0.00 0.00 -0.54 -2.62 0.00 0.00 177.26 174.10 1n4s s LYS 266 N -4.08 1.83 0.54 3.52 -0.14 -1.00 -5.12 119.74 115.30 1n4s s LYS 266 Ca 0.00 -1.36 -0.20 0.00 -1.36 0.00 0.00 55.97 53.05 1n4s s LYS 266 Cb 0.00 -2.03 -0.06 0.00 -1.68 0.00 0.00 37.83 34.06 1n4s s LYS 266 CO 0.00 0.42 1.16 -1.25 -0.76 0.00 0.00 175.35 174.92 1n4s s PRO 267 N -2.71 3.32 0.73 -1.68 0.04 -1.26 -4.79 135.00 128.65 1n4s s PRO 267 Ca 0.23 1.70 -0.14 0.00 0.04 0.00 0.00 61.00 62.83 1n4s s PRO 267 Cb -0.09 -2.06 0.04 0.00 0.04 0.00 0.00 34.50 32.44 1n4s s PRO 267 CO 0.13 -0.89 1.14 0.14 0.04 0.00 0.00 177.00 177.56 1n4s s VAL 268 N -1.68 2.82 -0.11 -0.36 -7.23 -1.26 -4.54 120.40 108.03 1n4s s VAL 268 Ca 0.72 0.35 -0.05 0.00 -1.81 0.00 0.00 61.98 61.19 1n4s s VAL 268 Cb -0.27 -2.82 0.05 0.00 0.56 0.00 0.00 36.38 33.91 1n4s s VAL 268 CO 0.30 -0.26 0.26 -0.62 -0.31 0.00 0.00 175.10 174.47 1n4s s ASP 269 N -2.56 -0.20 0.31 4.85 -1.08 0.19 -4.84 116.67 113.35 1n4s s ASP 269 Ca 0.68 0.56 0.02 0.00 -0.52 0.00 0.00 52.55 53.30 1n4s s ASP 269 Cb -0.23 0.48 0.77 0.00 -1.46 0.00 0.00 42.92 42.48 1n4s s ASP 269 CO 0.47 -0.18 1.57 0.74 0.52 0.00 0.00 175.17 178.30 1n4s h THR 270 N 5.91 0.03 -0.04 1.71 2.02 -1.65 -0.42 112.91 120.46 1n4s h THR 270 Ca -0.37 -0.00 0.01 0.00 0.77 0.00 0.00 66.41 66.82 1n4s h THR 270 Cb 1.15 0.01 -0.00 0.00 -1.74 0.00 0.00 68.15 67.57 1n4s h THR 270 CO 0.33 0.00 0.06 0.00 0.37 0.00 0.00 175.52 176.29 1n4s h TYR 272 N 0.00 0.00 0.00 0.00 0.05 -1.31 -1.69 116.97 114.02 1n4s h TYR 272 Ca 0.02 0.00 -0.01 0.00 0.05 0.00 0.00 58.73 58.79 1n4s h TYR 272 Cb 0.15 0.00 -0.00 0.00 1.01 0.00 0.00 36.73 37.89 1n4s h TYR 272 CO 0.00 0.00 -0.04 0.77 -1.05 0.00 0.00 178.16 177.84 1n4s h SER 273 N 0.00 0.00 0.00 3.88 0.02 -1.14 0.36 113.55 116.66 1n4s h SER 273 Ca 0.00 0.00 -0.24 0.00 -0.84 0.00 0.00 61.79 60.71 1n4s h SER 273 Cb 0.49 0.00 -0.04 0.00 0.14 0.00 0.00 62.40 62.99 1n4s h SER 273 CO 0.00 0.04 -1.57 0.33 -1.14 0.00 0.00 176.83 174.49 1n4s n PHE 274 N -3.96 0.48 -0.02 3.45 7.35 -0.69 -3.06 117.46 121.00 1n4s n PHE 274 Ca -0.03 0.21 -0.10 0.00 -0.76 0.00 0.00 57.45 56.77 1n4s n PHE 274 Cb 0.13 -0.92 -0.04 0.00 0.35 0.00 0.00 39.48 39.01 1n4s n PHE 274 CO 0.00 0.00 0.00 -1.49 -0.76 0.00 0.00 176.76 174.51 1n4s h TRP 275 N -1.00 -0.94 0.09 -5.13 -0.00 -1.28 0.79 115.95 108.48 1n4s h TRP 275 Ca -0.37 0.04 -0.20 0.00 -0.00 0.00 0.00 58.89 58.37 1n4s h TRP 275 Cb 1.25 0.44 0.02 0.00 -0.00 0.00 0.00 29.16 30.87 1n4s h TRP 275 CO -0.10 -0.41 -0.82 0.28 -0.00 0.00 0.00 178.44 177.38 1n4s h VAL 276 N -0.38 1.44 -0.61 1.49 2.07 -1.16 -2.97 116.25 116.13 1n4s h VAL 276 Ca 0.11 -2.36 0.05 0.00 0.82 0.00 0.00 66.70 65.32 1n4s h VAL 276 Cb 0.56 2.90 -0.05 0.00 -1.52 0.00 0.00 31.29 33.18 1n4s h VAL 276 CO -0.40 0.68 0.33 1.23 0.02 0.00 0.00 177.57 179.44 1n4s h GLY 277 N -0.16 0.87 1.64 2.17 0.00 -1.39 -0.09 103.07 106.12 1n4s h GLY 277 Ca -0.13 -0.23 -0.07 0.00 0.00 0.00 0.00 47.33 46.91 1n4s h GLY 277 CO 0.16 0.14 -0.12 0.00 0.00 0.00 0.00 176.54 176.71 1n4s h ALA 278 N 1.32 1.30 -0.36 3.60 0.00 0.51 -0.58 119.26 125.05 1n4s h ALA 278 Ca 0.27 -0.26 -0.06 0.00 0.00 0.00 0.00 54.91 54.86 1n4s h ALA 278 Cb 0.16 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.82 1n4s h ALA 278 CO -0.17 0.46 -0.02 1.15 0.00 0.00 0.00 179.25 180.68 1n4s h THR 279 N 0.41 1.26 -0.55 0.00 2.02 -1.11 -0.71 112.91 114.24 1n4s h THR 279 Ca 0.08 -1.02 -0.02 0.00 0.77 0.00 0.00 66.41 66.22 1n4s h THR 279 Cb 0.47 1.21 -0.03 0.00 -1.74 0.00 0.00 68.15 68.06 1n4s h THR 279 CO 0.03 0.34 0.25 -0.07 0.37 0.00 0.00 175.52 176.44 1n4s h LEU 280 N 0.45 0.69 -0.33 2.58 3.38 -0.62 -0.74 115.31 120.72 1n4s h LEU 280 Ca 0.10 -0.07 -0.05 0.00 0.09 0.00 0.00 57.88 57.95 1n4s h LEU 280 Cb 0.49 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 41.05 1n4s h LEU 280 CO 0.02 0.60 0.02 0.50 0.09 0.00 0.00 178.44 179.67 1n4s h LYS 281 N 0.77 0.57 0.00 1.13 1.63 -0.74 -0.51 116.57 119.42 1n4s h LYS 281 Ca 0.19 -0.17 -0.04 0.00 -0.85 0.00 0.00 60.65 59.78 1n4s h LYS 281 Cb 0.09 -0.06 -0.01 0.00 -0.60 0.00 0.00 32.23 31.66 1n4s h LYS 281 CO -0.02 0.68 -0.19 -0.07 -3.45 0.00 0.00 179.45 176.40 1n4s h LEU 282 N 0.38 0.00 -1.41 5.20 3.38 -0.49 -1.03 115.31 121.34 1n4s h LEU 282 Ca 0.10 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.07 1n4s h LEU 282 Cb 0.41 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.16 1n4s h LEU 282 CO 0.01 0.19 0.00 0.18 0.09 0.00 0.00 178.44 178.91 1n4s n LEU 283 N -4.22 2.07 -2.75 1.67 4.77 -0.34 -4.95 117.00 113.25 1n4s n LEU 283 Ca -0.02 -0.98 -0.21 0.00 -0.03 0.00 0.00 56.01 54.77 1n4s n LEU 283 Cb 0.25 -0.21 0.01 0.00 -2.33 0.00 0.00 43.42 41.14 1n4s n LEU 283 CO 0.36 0.49 -0.12 0.29 -1.33 0.00 0.00 177.39 177.07 1n4s n LYS 284 N 0.61 -3.35 -0.04 3.23 5.02 -0.39 -4.87 118.16 118.37 1n4s n LYS 284 Ca 0.15 0.91 0.01 0.00 -2.02 0.00 0.00 58.31 57.36 1n4s n LYS 284 Cb 0.35 -5.67 0.01 0.00 -0.02 0.00 0.00 35.03 29.70 1n4s n LYS 284 CO 0.00 0.00 0.00 0.44 -0.52 0.00 0.00 177.40 177.32 1n4s n ILE 285 N -4.21 0.45 0.21 -0.18 -5.35 -0.30 -4.74 119.36 105.24 1n4s n ILE 285 Ca -0.17 -0.47 0.07 0.00 -0.27 0.00 0.00 62.75 61.91 1n4s n ILE 285 Cb 0.64 0.72 0.57 0.00 -1.74 0.00 0.00 39.64 39.84 1n4s n ILE 285 CO 0.00 0.00 0.00 0.15 -1.76 0.00 0.00 176.55 174.94 1n4s h PHE 286 N 0.00 0.08 0.00 4.28 3.57 -1.78 -0.93 116.94 122.16 1n4s h PHE 286 Ca 0.00 -0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.50 1n4s h PHE 286 Cb 0.85 -0.03 0.00 0.00 2.79 0.00 0.00 35.95 39.57 1n4s h PHE 286 CO 0.01 0.10 0.04 -0.56 -2.23 0.00 0.00 178.31 175.67 1n4s h GLN 287 N 0.08 0.00 -0.31 1.11 3.07 -1.89 -1.44 115.11 115.73 1n4s h GLN 287 Ca 0.02 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.76 1n4s h GLN 287 Cb 0.08 0.00 0.00 0.00 0.08 0.00 0.00 27.48 27.64 1n4s h GLN 287 CO 0.00 0.00 0.00 0.66 0.09 0.00 0.00 178.83 179.58 1n4s n TYR 288 N -2.88 0.40 -2.23 0.06 0.53 -0.35 -4.94 117.16 107.74 1n4s n TYR 288 Ca -0.03 -0.20 -0.26 0.00 -1.02 0.00 0.00 57.90 56.40 1n4s n TYR 288 Cb 0.10 0.00 0.10 0.00 -1.03 0.00 0.00 39.34 38.51 1n4s n TYR 288 CO 0.00 0.00 0.00 0.95 -1.02 0.00 0.00 176.86 176.79 1n4s s THR 289 N -1.60 2.21 -0.48 -0.72 -4.23 -0.55 -5.02 115.64 105.24 1n4s s THR 289 Ca 0.36 -0.29 -0.20 0.00 -1.18 0.00 0.00 61.69 60.38 1n4s s THR 289 Cb 0.21 -2.92 0.04 0.00 1.34 0.00 0.00 72.50 71.17 1n4s s THR 289 CO 0.30 0.00 0.67 0.21 -0.54 0.00 0.00 174.62 175.26 1n4s s ASN 290 N -4.62 6.27 0.05 3.99 3.84 -1.26 -4.95 114.94 118.26 1n4s s ASN 290 Ca 0.64 -0.61 -0.21 0.00 0.21 0.00 0.00 52.86 52.88 1n4s s ASN 290 Cb -0.09 -2.32 -0.13 0.00 -0.55 0.00 0.00 41.25 38.17 1n4s s ASN 290 CO 0.46 -0.89 1.43 -0.26 -2.79 0.00 0.00 177.10 175.06 1n4s h PHE 291 N 8.99 0.33 -0.38 0.43 0.05 -1.95 -3.17 116.94 121.23 1n4s h PHE 291 Ca -0.26 -0.07 0.03 0.00 3.82 0.00 0.00 57.97 61.48 1n4s h PHE 291 Cb 1.09 -0.08 -0.03 0.00 2.00 0.00 0.00 35.95 38.93 1n4s h PHE 291 CO 0.76 0.58 0.19 0.93 -0.18 0.00 0.00 178.31 180.59 1n4s h GLU 292 N -0.01 0.38 -0.32 1.51 4.39 -1.97 0.16 114.58 118.72 1n4s h GLU 292 Ca 0.04 -0.02 -0.08 0.00 0.34 0.00 0.00 59.36 59.63 1n4s h GLU 292 Cb 0.48 -0.09 -0.02 0.00 -0.10 0.00 0.00 28.75 29.03 1n4s h GLU 292 CO 0.02 0.25 -0.15 0.87 -1.16 0.00 0.00 179.01 178.84 1n4s h LYS 293 N 0.39 0.55 -0.02 2.33 1.57 -1.85 0.15 116.57 119.70 1n4s h LYS 293 Ca 0.16 -0.18 -0.00 0.00 -1.87 0.00 0.00 60.65 58.76 1n4s h LYS 293 Cb 0.07 -0.05 -0.00 0.00 0.08 0.00 0.00 32.23 32.33 1n4s h LYS 293 CO -0.11 0.69 -0.00 -0.97 -0.57 0.00 0.00 179.45 178.48 1n4s h ASN 294 N 0.51 0.03 -0.61 0.86 -1.24 -1.02 -1.65 115.58 112.45 1n4s h ASN 294 Ca 0.09 -0.37 0.01 0.00 0.71 0.00 0.00 56.30 56.74 1n4s h ASN 294 Cb 0.55 -0.01 -0.03 0.00 0.73 0.00 0.00 38.32 39.56 1n4s h ASN 294 CO 0.04 0.39 0.41 -0.09 -1.29 0.00 0.00 177.43 176.88 1n4s h ARG 295 N -0.33 0.80 -0.77 6.67 2.43 -0.46 -1.43 114.38 121.29 1n4s h ARG 295 Ca 0.00 -0.05 -0.03 0.00 -0.81 0.00 0.00 59.98 59.09 1n4s h ARG 295 Cb 0.38 -0.18 -0.04 0.00 -0.42 0.00 0.00 29.97 29.71 1n4s h ARG 295 CO 0.00 0.53 0.35 -0.91 -1.51 0.00 0.00 179.97 178.43 1n4s h ASN 296 N 0.83 1.01 0.03 -3.80 2.35 -0.65 -1.61 115.58 113.75 1n4s h ASN 296 Ca 0.23 -0.13 -0.00 0.00 -0.55 0.00 0.00 56.30 55.85 1n4s h ASN 296 Cb -0.09 -0.26 0.00 0.00 0.05 0.00 0.00 38.32 38.02 1n4s h ASN 296 CO -0.05 0.87 -0.02 0.22 -1.65 0.00 0.00 177.43 176.80 1n4s h TYR 297 N 1.10 -0.04 -0.34 1.19 3.20 -0.84 -1.70 116.97 119.53 1n4s h TYR 297 Ca 0.26 -0.00 0.07 0.00 3.14 0.00 0.00 58.73 62.20 1n4s h TYR 297 Cb 0.14 0.01 -0.06 0.00 1.54 0.00 0.00 36.73 38.36 1n4s h TYR 297 CO 0.01 0.21 -0.07 0.82 -1.64 0.00 0.00 178.16 177.50 1n4s h ILE 298 N -0.30 0.68 0.00 1.81 2.04 -1.09 -0.99 117.51 119.66 1n4s h ILE 298 Ca -0.00 -0.01 -0.03 0.00 1.00 0.00 0.00 64.86 65.82 1n4s h ILE 298 Cb 0.27 0.66 -0.00 0.00 -0.74 0.00 0.00 36.82 37.00 1n4s h ILE 298 CO 0.01 0.00 -0.15 -0.07 0.00 0.00 0.00 178.15 177.94 1n4s h LEU 299 N 0.02 0.00 -0.57 1.44 3.38 -1.24 -1.69 115.31 116.65 1n4s h LEU 299 Ca 0.16 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.13 1n4s h LEU 299 Cb 0.25 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.00 1n4s h LEU 299 CO -0.33 0.15 0.00 -1.54 0.09 0.00 0.00 178.44 176.80 1n4s n SER 300 N -4.03 0.51 -1.18 -0.43 3.41 -0.39 -1.62 113.62 109.89 1n4s n SER 300 Ca -0.02 0.63 0.11 0.00 -0.26 0.00 0.00 58.87 59.32 1n4s n SER 300 Cb 0.23 -0.74 0.27 0.00 -0.26 0.00 0.00 64.21 63.72 1n4s n SER 300 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 1n4s n THR 301 N -2.07 0.91 -2.50 6.66 -2.24 -0.64 -4.33 114.28 110.07 1n4s n THR 301 Ca 0.02 -0.96 -0.41 0.00 -2.27 0.00 0.00 64.05 60.43 1n4s n THR 301 Cb 0.20 0.58 -0.04 0.00 -2.10 0.00 0.00 70.33 68.98 1n4s n THR 301 CO 0.00 0.00 0.00 -1.58 -0.57 0.00 0.00 175.07 172.92 1n4s s GLN 302 N -1.07 4.56 -0.55 -0.78 0.74 -0.64 -1.08 119.66 120.84 1n4s s GLN 302 Ca 0.42 1.71 -0.20 0.00 0.05 0.00 0.00 55.36 57.35 1n4s s GLN 302 Cb 0.22 -3.30 0.07 0.00 1.10 0.00 0.00 33.01 31.10 1n4s s GLN 302 CO 0.30 -0.00 0.72 0.34 -0.55 0.00 0.00 175.29 176.10 1n4s s ASP 303 N 0.19 6.22 0.20 6.67 -1.08 -0.62 -4.90 116.67 123.35 1n4s s ASP 303 Ca 0.51 -1.02 0.20 0.00 -0.52 0.00 0.00 52.55 51.73 1n4s s ASP 303 Cb -0.29 -2.32 0.88 0.00 -1.46 0.00 0.00 42.92 39.73 1n4s s ASP 303 CO 0.33 -1.06 1.63 0.54 0.52 0.00 0.00 175.17 177.13 1n4s n ARG 304 N 6.53 0.14 -0.10 4.34 1.74 -1.26 -0.28 116.66 127.78 1n4s n ARG 304 Ca -0.06 0.41 -0.15 0.00 -0.77 0.00 0.00 57.85 57.28 1n4s n ARG 304 Cb 0.45 -1.78 -0.06 0.00 -1.02 0.00 0.00 32.46 30.04 1n4s n ARG 304 CO 0.00 0.00 0.00 -0.11 -1.52 0.00 0.00 177.63 176.00 1n4s n LEU 305 N -2.05 1.88 0.01 0.55 -0.00 -1.26 -4.65 117.00 111.47 1n4s n LEU 305 Ca 0.02 0.46 0.11 0.00 -0.00 0.00 0.00 56.01 56.60 1n4s n LEU 305 Cb 0.19 -0.86 -0.08 0.00 -0.00 0.00 0.00 43.42 42.67 1n4s n LEU 305 CO 0.17 -0.03 -0.22 1.33 -0.00 0.00 0.00 177.39 178.63 1n4s n VAL 306 N -4.47 0.06 -0.24 1.96 0.24 -1.24 -5.10 118.33 109.55 1n4s n VAL 306 Ca -0.24 -0.23 0.00 0.00 -2.04 0.00 0.00 64.34 61.83 1n4s n VAL 306 Cb 0.54 0.43 0.00 0.00 -1.47 0.00 0.00 33.84 33.34 1n4s n VAL 306 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1n4s n GLY 307 N 1.39 -3.35 0.42 7.63 0.00 0.62 -4.45 105.19 107.45 1n4s n GLY 307 Ca 0.01 -1.90 0.06 0.00 0.00 0.00 0.00 46.02 44.18 1n4s n GLY 307 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1n4s n GLY 308 N -0.29 -1.77 3.35 -0.02 0.00 -1.26 -4.27 105.19 100.92 1n4s n GLY 308 Ca 0.00 -1.41 -0.21 0.00 0.00 0.00 0.00 46.02 44.41 1n4s n GLY 308 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1n4s s PHE 309 N -1.82 1.82 0.45 1.61 0.40 -1.26 -1.59 117.98 117.59 1n4s s PHE 309 Ca 0.00 -0.50 0.06 0.00 -0.60 0.00 0.00 56.93 55.89 1n4s s PHE 309 Cb 0.00 -0.87 -0.04 0.00 0.51 0.00 0.00 43.02 42.62 1n4s s PHE 309 CO 0.00 0.38 0.12 0.00 0.70 0.00 0.00 175.22 176.42 1n4s s ALA 310 N -2.47 3.68 0.14 5.36 0.00 -0.24 -2.56 121.76 125.68 1n4s s ALA 310 Ca 0.20 -1.71 -0.09 0.00 0.00 0.00 0.00 51.96 50.36 1n4s s ALA 310 Cb -0.04 -0.18 -0.03 0.00 0.00 0.00 0.00 23.12 22.87 1n4s s ALA 310 CO 0.08 -0.16 1.43 1.57 0.00 0.00 0.00 175.76 178.68 1n4s h LYS 311 N 1.43 0.78 -5.41 0.00 2.10 -1.88 -3.41 116.57 110.18 1n4s h LYS 311 Ca -0.43 -0.50 -0.43 0.00 -2.00 0.00 0.00 60.65 57.29 1n4s h LYS 311 Cb 1.27 0.06 -0.14 0.00 -0.90 0.00 0.00 32.23 32.52 1n4s h LYS 311 CO 0.72 1.13 -0.70 -1.58 -2.00 0.00 0.00 179.45 177.02 1n4s s TRP 312 N -4.06 1.68 0.48 0.07 0.51 -1.26 -2.11 118.94 114.26 1n4s s TRP 312 Ca -0.10 -0.68 -0.23 0.00 -2.12 0.00 0.00 56.10 52.97 1n4s s TRP 312 Cb 0.10 -0.87 -0.07 0.00 -0.81 0.00 0.00 33.47 31.83 1n4s s TRP 312 CO 0.88 0.24 1.24 -1.25 -0.51 0.00 0.00 176.95 177.55 1n4s s PRO 313 N -3.71 3.57 -1.36 4.98 0.04 -1.26 -2.80 135.00 134.46 1n4s s PRO 313 Ca 0.24 1.95 -0.04 0.00 0.04 0.00 0.00 61.00 63.19 1n4s s PRO 313 Cb 0.02 -2.38 0.00 0.00 0.04 0.00 0.00 34.50 32.18 1n4s s PRO 313 CO 0.07 -0.76 0.57 -0.25 0.04 0.00 0.00 177.00 176.68 1n4s n ASP 314 N -0.62 -5.61 -4.43 6.66 10.43 -1.26 -5.00 116.55 116.72 1n4s n ASP 314 Ca 0.08 -0.27 -0.22 0.00 2.57 0.00 0.00 54.79 56.95 1n4s n ASP 314 Cb 0.47 -4.43 -0.10 0.00 1.84 0.00 0.00 41.12 38.90 1n4s n ASP 314 CO 0.00 0.00 0.00 -0.55 -1.07 0.00 0.00 177.20 175.58 1n4s s SER 315 N -2.78 3.16 0.17 -2.24 0.15 -1.12 -5.11 113.70 105.93 1n4s s SER 315 Ca 0.28 -1.06 -0.30 0.00 0.70 0.00 0.00 55.95 55.57 1n4s s SER 315 Cb -0.12 -0.23 -0.08 0.00 -1.71 0.00 0.00 66.02 63.88 1n4s s SER 315 CO 0.35 -0.10 1.16 -1.00 1.20 0.00 0.00 173.24 174.85 1n4s s HIS 316 N -2.73 3.50 0.57 3.44 3.76 -1.26 -4.70 115.29 117.86 1n4s s HIS 316 Ca 0.28 1.49 -0.16 0.00 -0.15 0.00 0.00 55.06 56.52 1n4s s HIS 316 Cb -0.02 -3.36 -0.05 0.00 1.11 0.00 0.00 32.58 30.26 1n4s s HIS 316 CO 0.12 -0.95 1.03 -1.25 -0.85 0.00 0.00 174.74 172.83 1n4s s PRO 317 N -0.20 3.55 0.11 8.40 0.04 -1.26 -4.59 135.00 141.05 1n4s s PRO 317 Ca 0.52 1.08 -0.08 0.00 0.04 0.00 0.00 61.00 62.55 1n4s s PRO 317 Cb -0.31 -2.07 -0.01 0.00 0.04 0.00 0.00 34.50 32.15 1n4s s PRO 317 CO 0.35 -0.61 0.20 0.16 0.04 0.00 0.00 177.00 177.15 1n4s s ASP 318 N -3.01 0.12 0.25 6.66 1.47 -1.06 -4.96 116.67 116.15 1n4s s ASP 318 Ca 0.61 -0.75 -0.03 0.00 1.18 0.00 0.00 52.55 53.56 1n4s s ASP 318 Cb -0.13 0.36 0.41 0.00 -0.34 0.00 0.00 42.92 43.22 1n4s s ASP 318 CO 0.36 -0.77 1.84 0.00 0.68 0.00 0.00 175.17 177.29 1n4s h ALA 319 N 2.72 1.29 -0.04 2.11 0.00 -1.98 -1.01 119.26 122.34 1n4s h ALA 319 Ca -0.33 0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.58 1n4s h ALA 319 Cb 1.20 -0.21 -0.00 0.00 0.00 0.00 0.00 17.79 18.78 1n4s h ALA 319 CO 0.55 0.24 0.02 1.25 0.00 0.00 0.00 179.25 181.31 1n4s h LEU 320 N 0.96 0.05 -0.79 0.00 6.46 -1.95 -0.95 115.31 119.09 1n4s h LEU 320 Ca 0.42 -0.09 -0.08 0.00 -0.12 0.00 0.00 57.88 58.00 1n4s h LEU 320 Cb 0.30 -0.01 -0.01 0.00 -0.73 0.00 0.00 40.66 40.20 1n4s h LEU 320 CO -0.22 0.13 -0.39 0.45 -0.62 0.00 0.00 178.44 177.79 1n4s h HIS 321 N -0.03 0.00 -0.20 1.25 3.86 -1.74 -1.48 115.15 116.80 1n4s h HIS 321 Ca 0.02 0.00 -0.05 0.00 -1.16 0.00 0.00 60.37 59.18 1n4s h HIS 321 Cb 0.09 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 28.55 1n4s h HIS 321 CO -0.04 0.39 -0.05 0.00 0.86 0.00 0.00 177.93 179.09 1n4s h ALA 322 N 1.61 0.28 -0.09 2.45 0.00 -1.00 0.47 119.26 122.98 1n4s h ALA 322 Ca -0.00 -0.25 -0.01 0.00 0.00 0.00 0.00 54.91 54.64 1n4s h ALA 322 Cb 0.98 -0.07 -0.00 0.00 0.00 0.00 0.00 17.79 18.69 1n4s h ALA 322 CO 0.05 0.06 0.00 -0.92 0.00 0.00 0.00 179.25 178.45 1n4s h TYR 323 N 0.12 0.17 0.00 0.00 3.20 -1.02 -2.19 116.97 117.25 1n4s h TYR 323 Ca 0.05 -0.03 -0.08 0.00 3.14 0.00 0.00 58.73 61.81 1n4s h TYR 323 Cb 0.50 -0.04 -0.01 0.00 1.54 0.00 0.00 36.73 38.71 1n4s h TYR 323 CO 0.05 0.41 -0.40 0.74 -1.64 0.00 0.00 178.16 177.32 1n4s h PHE 324 N -0.11 0.00 -0.42 -3.82 -1.00 -1.31 -0.41 116.94 109.87 1n4s h PHE 324 Ca 0.03 0.00 -0.10 0.00 2.81 0.00 0.00 57.97 60.70 1n4s h PHE 324 Cb 0.34 0.00 -0.01 0.00 3.61 0.00 0.00 35.95 39.88 1n4s h PHE 324 CO 0.03 0.40 -0.15 0.78 -1.61 0.00 0.00 178.31 177.76 1n4s h GLY 325 N 1.97 0.91 1.03 -1.45 0.00 -0.85 0.19 103.07 104.87 1n4s h GLY 325 Ca -0.00 -0.78 -0.08 0.00 0.00 0.00 0.00 47.33 46.46 1n4s h GLY 325 CO 0.05 0.71 0.03 -2.22 0.00 0.00 0.00 176.54 175.12 1n4s h ILE 326 N 0.66 1.26 -0.24 2.60 2.04 -1.06 -0.53 117.51 122.24 1n4s h ILE 326 Ca 0.10 -1.06 -0.09 0.00 1.00 0.00 0.00 64.86 64.81 1n4s h ILE 326 Cb 0.69 0.86 -0.01 0.00 -0.74 0.00 0.00 36.82 37.62 1n4s h ILE 326 CO 0.05 0.38 -0.24 0.00 0.00 0.00 0.00 178.15 178.34 1n4s h GLY 328 N 1.01 0.74 1.09 0.00 0.00 -0.17 -1.51 103.07 104.23 1n4s h GLY 328 Ca 0.06 -0.45 -0.03 0.00 0.00 0.00 0.00 47.33 46.91 1n4s h GLY 328 CO 0.05 0.42 0.39 1.41 0.00 0.00 0.00 176.54 178.81 1n4s h LEU 329 N 0.57 1.07 -0.90 3.11 4.07 -0.74 -2.83 115.31 119.66 1n4s h LEU 329 Ca 0.14 -0.13 0.03 0.00 0.08 0.00 0.00 57.88 58.00 1n4s h LEU 329 Cb 0.29 -0.27 -0.05 0.00 1.08 0.00 0.00 40.66 41.70 1n4s h LEU 329 CO -0.00 0.90 0.59 -1.28 -1.08 0.00 0.00 178.44 177.57 1n4s h SER 330 N 1.17 0.98 -0.67 -0.43 0.87 -0.41 -1.50 113.55 113.56 1n4s h SER 330 Ca 0.28 -0.01 0.20 0.00 -1.23 0.00 0.00 61.79 61.02 1n4s h SER 330 Cb 0.12 -0.23 -0.03 0.00 -0.44 0.00 0.00 62.40 61.83 1n4s h SER 330 CO -0.03 0.68 0.52 -0.07 -0.53 0.00 0.00 176.83 177.40 1n4s h LEU 331 N 1.15 0.00 -2.85 2.23 4.07 -1.03 0.52 115.31 119.41 1n4s h LEU 331 Ca 0.35 0.00 0.00 0.00 0.08 0.00 0.00 57.88 58.31 1n4s h LEU 331 Cb -0.03 0.00 0.00 0.00 1.08 0.00 0.00 40.66 41.71 1n4s h LEU 331 CO -0.11 0.00 0.00 0.23 -1.08 0.00 0.00 178.44 177.48 1n4s n MET 332 N -4.16 3.00 -3.32 1.13 2.81 -0.58 -4.97 117.12 111.03 1n4s n MET 332 Ca 0.13 -2.75 -0.16 0.00 -1.81 0.00 0.00 57.70 53.12 1n4s n MET 332 Cb 0.78 -1.66 0.08 0.00 -0.71 0.00 0.00 33.22 31.71 1n4s n MET 332 CO 0.00 0.00 0.00 0.39 1.51 0.00 0.00 175.97 177.87 1n4s n GLU 333 N 1.56 -4.66 -1.72 0.03 1.02 0.18 -4.95 120.64 112.10 1n4s n GLU 333 Ca 0.25 0.84 -0.42 0.00 -0.02 0.00 0.00 57.16 57.81 1n4s n GLU 333 Cb 0.70 -5.77 -0.02 0.00 -0.02 0.00 0.00 31.44 26.32 1n4s n GLU 333 CO 0.00 0.00 0.00 -1.91 1.18 0.00 0.00 177.13 176.40 1n4s n GLU 334 N -3.69 2.62 -1.77 3.49 4.07 -1.12 -4.88 120.64 119.36 1n4s n GLU 334 Ca -0.19 0.94 -0.43 0.00 -0.06 0.00 0.00 57.16 57.42 1n4s n GLU 334 Cb 0.65 -2.73 -0.03 0.00 -0.06 0.00 0.00 31.44 29.27 1n4s n GLU 334 CO 0.00 0.00 0.00 0.45 -0.06 0.00 0.00 177.13 177.52 1n4s s SER 335 N 0.72 6.10 0.00 4.31 0.15 -1.26 -1.72 113.70 121.99 1n4s s SER 335 Ca 0.69 2.13 0.00 0.00 0.70 0.00 0.00 55.95 59.47 1n4s s SER 335 Cb -0.53 -2.52 0.00 0.00 -1.71 0.00 0.00 66.02 61.26 1n4s s SER 335 CO 0.43 -1.41 0.00 0.61 1.20 0.00 0.00 173.24 174.07 1n4s n GLY 336 N 4.98 1.03 3.38 9.45 0.00 -1.26 -5.07 105.19 117.70 1n4s n GLY 336 Ca 0.23 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.92 1n4s n GLY 336 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1n4s s ILE 337 N -2.07 2.93 1.02 -0.61 1.01 -0.70 -4.72 121.20 118.06 1n4s s ILE 337 Ca 0.00 -0.72 -0.11 0.00 0.00 0.00 0.00 60.65 59.82 1n4s s ILE 337 Cb 0.00 -2.20 0.20 0.00 0.01 0.00 0.00 42.46 40.48 1n4s s ILE 337 CO 0.00 0.54 1.10 0.00 0.00 0.00 0.00 174.94 176.58 1n4s s LYS 339 N -4.56 4.34 0.31 0.00 2.20 -1.26 -4.75 119.74 116.01 1n4s s LYS 339 Ca 0.67 0.93 -0.22 0.00 -0.36 0.00 0.00 55.97 56.99 1n4s s LYS 339 Cb -0.24 -3.53 -0.09 0.00 -1.51 0.00 0.00 37.83 32.46 1n4s s LYS 339 CO 0.61 -0.18 0.85 0.54 -0.36 0.00 0.00 175.35 176.81 1n4s s VAL 340 N 1.64 4.40 -0.48 4.02 0.11 -1.26 -0.78 120.40 128.05 1n4s s VAL 340 Ca 0.37 1.51 -0.24 0.00 -2.93 0.00 0.00 61.98 60.69 1n4s s VAL 340 Cb -0.17 -3.86 0.03 0.00 -1.53 0.00 0.00 36.38 30.85 1n4s s VAL 340 CO 0.15 0.06 0.89 -2.28 -3.33 0.00 0.00 175.10 170.58 1n4s s HIS 341 N -1.71 2.91 0.51 1.54 2.46 0.25 -4.69 115.29 116.57 1n4s s HIS 341 Ca 0.50 0.23 0.28 0.00 0.47 0.00 0.00 55.06 56.54 1n4s s HIS 341 Cb -0.16 -3.91 1.40 0.00 -0.13 0.00 0.00 32.58 29.78 1n4s s HIS 341 CO 0.21 -1.13 1.88 -1.00 -2.47 0.00 0.00 174.74 172.23 1n4s h PRO 342 N 9.10 0.09 0.01 2.88 0.13 -1.92 0.13 132.00 142.42 1n4s h PRO 342 Ca -0.25 -0.01 -0.37 0.00 -0.87 0.00 0.00 66.00 64.51 1n4s h PRO 342 Cb 1.08 -0.02 -0.06 0.00 0.13 0.00 0.00 31.00 32.13 1n4s h PRO 342 CO 1.02 0.06 -2.33 0.00 -0.23 0.00 0.00 178.00 176.51 1n4s n ALA 343 N -2.67 1.42 0.31 -0.56 0.00 -1.26 -4.39 120.51 113.36 1n4s n ALA 343 Ca 0.19 -1.12 0.12 0.00 0.00 0.00 0.00 53.44 52.62 1n4s n ALA 343 Cb 0.91 -0.25 0.14 0.00 0.00 0.00 0.00 19.45 20.24 1n4s n ALA 343 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 1n4s h LEU 344 N 0.01 0.00 -1.54 0.00 5.85 -1.91 -3.47 115.31 114.25 1n4s h LEU 344 Ca -0.53 -0.05 -0.29 0.00 0.84 0.00 0.00 57.88 57.84 1n4s h LEU 344 Cb 2.06 0.00 0.14 0.00 0.37 0.00 0.00 40.66 43.23 1n4s h LEU 344 CO -0.01 0.03 -0.65 -3.20 -0.34 0.00 0.00 178.44 174.27 1n4s n ASN 345 N -2.61 -2.76 -4.02 1.25 5.15 0.45 -5.03 115.26 107.70 1n4s n ASN 345 Ca 0.03 -0.52 -0.09 0.00 -0.60 0.00 0.00 54.58 53.39 1n4s n ASN 345 Cb 0.50 -4.45 -0.06 0.00 -0.53 0.00 0.00 39.78 35.24 1n4s n ASN 345 CO 0.00 0.00 0.00 0.68 1.40 0.00 0.00 177.26 179.34 1n4s s VAL 346 N -3.30 0.00 0.56 3.44 -7.23 -1.24 -4.96 120.40 107.67 1n4s s VAL 346 Ca 0.10 -1.46 -0.19 0.00 -1.81 0.00 0.00 61.98 58.61 1n4s s VAL 346 Cb -0.04 -2.21 -0.05 0.00 0.56 0.00 0.00 36.38 34.63 1n4s s VAL 346 CO 0.63 -0.01 1.15 -0.94 -0.31 0.00 0.00 175.10 175.62 1n4s s SER 347 N -3.03 5.57 0.45 4.85 1.04 -1.26 0.87 113.70 122.18 1n4s s SER 347 Ca 0.24 2.24 0.14 0.00 0.48 0.00 0.00 55.95 59.05 1n4s s SER 347 Cb 0.00 -2.59 1.01 0.00 0.10 0.00 0.00 66.02 64.54 1n4s s SER 347 CO 0.09 -1.33 2.01 0.71 0.98 0.00 0.00 173.24 175.70 1n4s h THR 348 N 1.12 1.11 -0.83 2.02 1.35 -1.23 0.16 112.91 116.60 1n4s h THR 348 Ca -0.50 -0.51 0.09 0.00 -0.55 0.00 0.00 66.41 64.93 1n4s h THR 348 Cb 1.27 1.21 -0.07 0.00 -1.73 0.00 0.00 68.15 68.84 1n4s h THR 348 CO 0.56 0.15 0.49 -0.09 -0.25 0.00 0.00 175.52 176.38 1n4s h ARG 349 N 0.06 0.80 -0.06 4.72 2.43 -1.90 0.83 114.38 121.27 1n4s h ARG 349 Ca 0.01 -0.05 -0.20 0.00 -0.81 0.00 0.00 59.98 58.94 1n4s h ARG 349 Cb 0.25 -0.18 -0.00 0.00 -0.42 0.00 0.00 29.97 29.62 1n4s h ARG 349 CO 0.02 0.53 -0.79 1.15 -1.51 0.00 0.00 179.97 179.37 1n4s h THR 350 N 0.83 1.38 0.00 0.20 2.02 -1.38 -2.26 112.91 113.70 1n4s h THR 350 Ca 0.39 -2.22 -0.07 0.00 0.77 0.00 0.00 66.41 65.28 1n4s h THR 350 Cb 0.33 2.19 -0.01 0.00 -1.74 0.00 0.00 68.15 68.92 1n4s h THR 350 CO -0.23 0.67 -0.34 0.77 0.37 0.00 0.00 175.52 176.76 1n4s h SER 351 N 0.28 0.00 -0.05 4.18 4.64 -0.12 -0.07 113.55 122.41 1n4s h SER 351 Ca -0.05 0.00 -0.19 0.00 -0.47 0.00 0.00 61.79 61.09 1n4s h SER 351 Cb 1.39 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 63.49 1n4s h SER 351 CO 0.14 0.34 -0.69 -0.33 -0.87 0.00 0.00 176.83 175.41 1n4s h GLU 352 N 0.00 0.56 -0.57 4.77 5.08 -0.82 -0.23 114.58 123.38 1n4s h GLU 352 Ca -0.00 -0.54 0.05 0.00 -1.00 0.00 0.00 59.36 57.87 1n4s h GLU 352 Cb 0.61 0.14 -0.03 0.00 0.50 0.00 0.00 28.75 29.97 1n4s h GLU 352 CO 0.04 1.16 0.37 -0.09 -1.00 0.00 0.00 179.01 179.50 1n4s h ARG 353 N 0.17 0.57 -0.19 2.33 1.12 -1.05 0.15 114.38 117.48 1n4s h ARG 353 Ca -0.07 -0.03 -0.18 0.00 -1.11 0.00 0.00 59.98 58.58 1n4s h ARG 353 Cb 1.36 -0.13 -0.00 0.00 -0.01 0.00 0.00 29.97 31.19 1n4s h ARG 353 CO 0.14 0.38 -0.62 1.25 -3.11 0.00 0.00 179.97 178.01 1n4s h LEU 354 N 0.59 0.74 -1.59 3.80 5.85 -0.77 -2.65 115.31 121.27 1n4s h LEU 354 Ca 0.24 -0.42 -0.01 0.00 0.84 0.00 0.00 57.88 58.53 1n4s h LEU 354 Cb 0.19 -0.21 -0.02 0.00 0.37 0.00 0.00 40.66 40.99 1n4s h LEU 354 CO -0.07 1.18 0.18 -0.09 -0.34 0.00 0.00 178.44 179.30 1n4s h ARG 355 N 0.48 0.45 -0.20 1.25 2.43 0.85 -2.13 114.38 117.51 1n4s h ARG 355 Ca -0.01 -0.04 -0.10 0.00 -0.81 0.00 0.00 59.98 59.02 1n4s h ARG 355 Cb 1.20 -0.10 -0.00 0.00 -0.42 0.00 0.00 29.97 30.65 1n4s h ARG 355 CO 0.12 0.34 -0.27 -0.44 -1.51 0.00 0.00 179.97 178.20 1n4s h ASP 356 N 0.46 0.59 -0.69 -3.80 3.32 -1.07 -2.43 116.42 112.79 1n4s h ASP 356 Ca 0.12 -0.51 0.08 0.00 0.02 0.00 0.00 57.03 56.74 1n4s h ASP 356 Cb 0.02 -0.17 -0.04 0.00 0.22 0.00 0.00 39.33 39.36 1n4s h ASP 356 CO -0.02 0.98 0.46 -0.07 -1.72 0.00 0.00 179.24 178.87 1n4s h LEU 357 N 0.21 0.58 -0.03 1.55 3.38 -1.07 -0.34 115.31 119.58 1n4s h LEU 357 Ca 0.02 0.01 -0.01 0.00 0.09 0.00 0.00 57.88 57.99 1n4s h LEU 357 Cb 0.85 -0.12 -0.00 0.00 0.09 0.00 0.00 40.66 41.48 1n4s h LEU 357 CO 0.06 0.36 -0.02 0.45 0.09 0.00 0.00 178.44 179.39 1n4s h HIS 358 N 0.65 0.08 -0.70 1.13 3.86 -1.29 -1.96 115.15 116.93 1n4s h HIS 358 Ca 0.31 -0.02 0.05 0.00 -1.16 0.00 0.00 60.37 59.55 1n4s h HIS 358 Cb 0.36 -0.02 -0.05 0.00 1.06 0.00 0.00 27.41 28.76 1n4s h HIS 358 CO -0.00 0.47 0.42 1.96 0.86 0.00 0.00 177.93 181.64 1n4s h GLN 359 N -0.34 0.77 -0.57 2.45 7.50 -0.93 -2.17 115.11 121.82 1n4s h GLN 359 Ca 0.01 -0.05 -0.05 0.00 0.50 0.00 0.00 58.65 59.06 1n4s h GLN 359 Cb 0.45 -0.17 -0.03 0.00 0.05 0.00 0.00 27.48 27.78 1n4s h GLN 359 CO 0.00 0.51 0.16 0.66 -1.50 0.00 0.00 178.83 178.66 1n4s h SER 360 N 0.79 0.80 0.24 1.46 4.64 -1.03 -2.12 113.55 118.33 1n4s h SER 360 Ca 0.30 -0.14 -0.06 0.00 -0.47 0.00 0.00 61.79 61.42 1n4s h SER 360 Cb 0.11 -0.21 -0.01 0.00 -0.31 0.00 0.00 62.40 61.99 1n4s h SER 360 CO -0.15 0.77 -0.26 -0.50 -0.87 0.00 0.00 176.83 175.82 1n4s h TRP 361 N 0.84 0.04 -1.92 4.77 6.55 -0.72 -3.37 115.95 122.14 1n4s h TRP 361 Ca 0.19 -0.01 -0.54 0.00 0.95 0.00 0.00 58.89 59.48 1n4s h TRP 361 Cb 0.27 -0.01 -0.08 0.00 -0.86 0.00 0.00 29.16 28.48 1n4s h TRP 361 CO 0.02 0.30 1.19 0.15 -1.05 0.00 0.00 178.44 179.05 1n4s s LYS 362 N -4.45 3.20 0.00 0.49 3.01 -0.80 -5.12 119.74 116.08 1n4s s LYS 362 Ca -0.04 -0.38 0.00 0.00 -1.01 0.00 0.00 55.97 54.54 1n4s s LYS 362 Cb 0.15 -4.55 0.00 0.00 -1.01 0.00 0.00 37.83 32.43 1n4s s LYS 362 CO 0.72 -2.28 0.00 0.25 0.51 0.00 0.00 175.35 174.54