#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jch s GLU 107 N 0.00 1.08 -0.20 1.43 2.02 0.34 -2.56 118.70 120.81 2jch s GLU 107 Ca 0.00 -1.54 -0.05 0.00 0.02 0.00 0.00 54.97 53.40 2jch s GLU 107 Cb 0.00 0.10 -0.03 0.00 0.10 0.00 0.00 34.13 34.31 2jch s GLU 107 CO 0.00 -0.27 0.01 0.42 0.02 0.00 0.00 175.26 175.43 2jch s ILE 108 N -3.97 4.02 0.20 -1.63 1.09 -0.38 0.12 121.20 120.64 2jch s ILE 108 Ca 0.29 -0.29 0.08 0.00 -1.10 0.00 0.00 60.65 59.63 2jch s ILE 108 Cb 0.07 -2.82 -0.04 0.00 -1.06 0.00 0.00 42.46 38.61 2jch s ILE 108 CO 0.06 0.43 0.02 0.42 -0.10 0.00 0.00 174.94 175.77 2jch s THR 109 N 0.97 3.77 0.80 2.92 -4.23 0.29 0.36 115.64 120.51 2jch s THR 109 Ca 0.02 -1.51 -0.12 0.00 -1.18 0.00 0.00 61.69 58.90 2jch s THR 109 Cb -0.14 -2.94 0.07 0.00 1.34 0.00 0.00 72.50 70.83 2jch s THR 109 CO 0.02 -0.19 1.10 -0.31 -0.54 0.00 0.00 174.62 174.70 2jch s TYR 110 N -1.90 2.87 0.45 3.99 2.02 -0.17 -0.51 117.35 124.10 2jch s TYR 110 Ca 0.29 1.10 0.25 0.00 -0.37 0.00 0.00 57.07 58.34 2jch s TYR 110 Cb -0.09 -3.15 1.27 0.00 -0.40 0.00 0.00 41.96 39.60 2jch s TYR 110 CO 0.20 -1.74 1.77 0.77 -1.57 0.00 0.00 175.55 174.97 2jch h SER 111 N -1.06 0.29 0.26 2.29 0.02 -1.17 0.16 113.55 114.34 2jch h SER 111 Ca -0.47 0.06 0.00 0.00 -0.84 0.00 0.00 61.79 60.54 2jch h SER 111 Cb 1.27 0.02 0.00 0.00 0.14 0.00 0.00 62.40 63.83 2jch h SER 111 CO 0.60 0.03 0.00 -0.90 -1.14 0.00 0.00 176.83 175.43 2jch n ASP 112 N -4.50 0.00 0.00 3.07 5.68 -1.26 -4.87 116.55 114.67 2jch n ASP 112 Ca 0.27 -0.36 0.00 0.00 -0.50 0.00 0.00 54.79 54.20 2jch n ASP 112 Cb 1.05 -0.17 0.00 0.00 -1.14 0.00 0.00 41.12 40.86 2jch n ASP 112 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2jch n GLY 113 N 0.67 3.28 3.68 6.12 0.00 0.56 -5.07 105.19 114.43 2jch n GLY 113 Ca 0.14 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.74 2jch n GLY 113 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 2jch n THR 114 N -2.00 2.23 -2.37 2.61 -1.04 -1.25 -4.63 114.28 107.83 2jch n THR 114 Ca 0.00 -0.50 -0.43 0.00 -2.04 0.00 0.00 64.05 61.08 2jch n THR 114 Cb 0.00 -1.49 -0.02 0.00 -1.82 0.00 0.00 70.33 66.99 2jch n THR 114 CO 0.00 0.00 0.00 -0.69 -0.64 0.00 0.00 175.07 173.74 2jch s VAL 115 N -1.15 4.15 0.00 12.58 1.01 -1.26 -1.00 120.40 134.73 2jch s VAL 115 Ca 0.58 1.36 -0.24 0.00 0.00 0.00 0.00 61.98 63.68 2jch s VAL 115 Cb -0.55 -3.99 -0.14 0.00 0.00 0.00 0.00 36.38 31.70 2jch s VAL 115 CO 0.60 -0.25 1.02 0.40 0.00 0.00 0.00 175.10 176.87 2jch h ILE 116 N 5.70 0.05 -1.55 2.22 2.04 -0.41 -3.47 117.51 122.08 2jch h ILE 116 Ca -0.28 -0.38 0.33 0.00 1.00 0.00 0.00 64.86 65.54 2jch h ILE 116 Cb 1.11 0.07 -0.11 0.00 -0.74 0.00 0.00 36.82 37.15 2jch h ILE 116 CO 0.99 0.01 0.85 0.00 0.00 0.00 0.00 178.15 180.00 2jch s ALA 117 N -4.74 -2.30 0.38 1.87 0.00 -1.08 -5.05 121.76 110.84 2jch s ALA 117 Ca -0.13 0.58 0.07 0.00 0.00 0.00 0.00 51.96 52.48 2jch s ALA 117 Cb 0.01 0.45 -0.01 0.00 0.00 0.00 0.00 23.12 23.58 2jch s ALA 117 CO 0.39 -1.07 0.43 -1.12 0.00 0.00 0.00 175.76 174.39 2jch s SER 118 N -3.15 5.49 -0.52 0.00 0.01 -1.26 -1.25 113.70 113.02 2jch s SER 118 Ca 0.17 -0.46 -0.19 0.00 1.31 0.00 0.00 55.95 56.78 2jch s SER 118 Cb 0.04 -0.86 0.07 0.00 0.21 0.00 0.00 66.02 65.48 2jch s SER 118 CO -0.03 -0.55 0.65 0.27 0.41 0.00 0.00 173.24 173.99 2jch s ILE 119 N -2.33 4.85 0.00 1.44 -4.36 -1.06 -4.96 121.20 114.78 2jch s ILE 119 Ca 0.47 -0.56 0.00 0.00 -0.26 0.00 0.00 60.65 60.30 2jch s ILE 119 Cb -0.07 -4.34 0.00 0.00 1.25 0.00 0.00 42.46 39.30 2jch s ILE 119 CO 0.30 -0.88 0.00 -0.67 0.24 0.00 0.00 174.94 173.93 2jch n ASP 337 N 6.24 3.02 0.05 4.36 -0.08 -1.26 -5.13 116.55 123.75 2jch n ASP 337 Ca -0.07 -0.16 0.05 0.00 -1.51 0.00 0.00 54.79 53.10 2jch n ASP 337 Cb 0.45 0.92 0.47 0.00 2.34 0.00 0.00 41.12 45.29 2jch n ASP 337 CO 0.00 0.00 0.00 1.88 0.12 0.00 0.00 177.20 179.20 2jch h TYR 338 N 0.00 0.42 0.19 -0.67 0.05 -1.99 -3.06 116.97 111.91 2jch h TYR 338 Ca 0.00 0.01 -0.01 0.00 0.05 0.00 0.00 58.73 58.78 2jch h TYR 338 Cb 0.00 -0.14 0.00 0.00 1.01 0.00 0.00 36.73 37.60 2jch h TYR 338 CO 0.00 0.26 -0.09 1.25 -1.05 0.00 0.00 178.16 178.53 2jch h LEU 339 N 0.45 -0.22 -0.18 3.88 5.85 -1.99 -0.08 115.31 123.02 2jch h LEU 339 Ca 0.13 -0.09 0.04 0.00 0.84 0.00 0.00 57.88 58.80 2jch h LEU 339 Cb -0.04 0.06 -0.04 0.00 0.37 0.00 0.00 40.66 41.01 2jch h LEU 339 CO -0.03 -0.05 -0.10 0.22 -0.34 0.00 0.00 178.44 178.15 2jch h TYR 340 N -0.38 -0.24 -0.56 1.25 5.03 -1.99 -2.29 116.97 117.79 2jch h TYR 340 Ca -0.03 0.02 -0.08 0.00 2.58 0.00 0.00 58.73 61.23 2jch h TYR 340 Cb 0.29 0.13 -0.02 0.00 1.55 0.00 0.00 36.73 38.68 2jch h TYR 340 CO -0.03 -0.15 0.04 0.74 -1.32 0.00 0.00 178.16 177.44 2jch h PHE 341 N -0.09 0.99 -0.13 -3.82 0.04 -1.42 -1.16 116.94 111.36 2jch h PHE 341 Ca 0.10 -0.14 -0.18 0.00 2.80 0.00 0.00 57.97 60.56 2jch h PHE 341 Cb 0.24 -0.27 -0.00 0.00 2.20 0.00 0.00 35.95 38.11 2jch h PHE 341 CO -0.25 0.87 -0.66 1.15 -0.60 0.00 0.00 178.31 178.82 2jch h THR 342 N 0.87 1.34 -0.04 -1.55 2.02 -0.95 -2.02 112.91 112.59 2jch h THR 342 Ca 0.17 -1.98 -0.02 0.00 0.77 0.00 0.00 66.41 65.35 2jch h THR 342 Cb 0.45 1.96 -0.00 0.00 -1.74 0.00 0.00 68.15 68.82 2jch h THR 342 CO 0.02 0.61 -0.06 0.74 0.37 0.00 0.00 175.52 177.19 2jch h THR 343 N 0.36 1.42 -0.35 3.16 2.02 -1.34 -2.69 112.91 115.49 2jch h THR 343 Ca -0.02 -1.33 0.03 0.00 0.77 0.00 0.00 66.41 65.86 2jch h THR 343 Cb 1.23 2.22 -0.03 0.00 -1.74 0.00 0.00 68.15 69.82 2jch h THR 343 CO 0.12 0.36 0.14 0.25 0.37 0.00 0.00 175.52 176.76 2jch h LEU 344 N -0.39 0.18 -0.53 2.58 5.85 -1.23 -1.64 115.31 120.14 2jch h LEU 344 Ca 0.00 0.03 0.11 0.00 0.84 0.00 0.00 57.88 58.86 2jch h LEU 344 Cb 0.61 0.00 -0.10 0.00 0.37 0.00 0.00 40.66 41.54 2jch h LEU 344 CO 0.01 0.14 -0.15 0.00 -0.34 0.00 0.00 178.44 178.11 2jch h ALA 345 N 1.20 0.31 -0.41 1.25 0.00 -1.46 0.49 119.26 120.65 2jch h ALA 345 Ca 0.15 0.20 -0.04 0.00 0.00 0.00 0.00 54.91 55.22 2jch h ALA 345 Cb 0.10 0.43 -0.02 0.00 0.00 0.00 0.00 17.79 18.30 2jch h ALA 345 CO -0.14 -0.46 0.07 1.49 0.00 0.00 0.00 179.25 180.22 2jch h GLU 346 N -0.02 0.62 -0.28 0.00 4.81 -1.21 -2.08 114.58 116.43 2jch h GLU 346 Ca 0.25 -0.12 -0.09 0.00 -0.13 0.00 0.00 59.36 59.28 2jch h GLU 346 Cb 0.41 -0.10 -0.01 0.00 0.63 0.00 0.00 28.75 29.68 2jch h GLU 346 CO -0.55 0.59 -0.16 0.00 -0.73 0.00 0.00 179.01 178.16 2jch h ALA 347 N 1.48 0.40 -0.62 2.92 0.00 -0.51 -1.60 119.26 121.32 2jch h ALA 347 Ca 0.14 -0.33 -0.06 0.00 0.00 0.00 0.00 54.91 54.65 2jch h ALA 347 Cb 0.27 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 17.94 2jch h ALA 347 CO 0.00 0.30 0.15 1.96 0.00 0.00 0.00 179.25 181.66 2jch h GLN 348 N 0.34 0.97 0.00 0.00 4.20 -0.79 0.18 115.11 120.02 2jch h GLN 348 Ca 0.06 -0.21 -0.05 0.00 0.06 0.00 0.00 58.65 58.51 2jch h GLN 348 Cb 0.68 -0.14 -0.01 0.00 0.30 0.00 0.00 27.48 28.32 2jch h GLN 348 CO 0.05 0.87 -0.23 1.49 -0.67 0.00 0.00 178.83 180.33 2jch h GLU 349 N 0.93 0.00 0.56 1.46 4.57 -1.26 -0.55 114.58 120.30 2jch h GLU 349 Ca 0.20 0.00 -0.03 0.00 -1.18 0.00 0.00 59.36 58.35 2jch h GLU 349 Cb 0.33 0.00 0.01 0.00 -0.16 0.00 0.00 28.75 28.93 2jch h GLU 349 CO -0.00 0.23 -0.27 0.00 -1.18 0.00 0.00 179.01 177.79 2jch h ARG 350 N 0.00 -0.73 0.35 1.92 2.47 0.32 -2.10 114.38 116.62 2jch h ARG 350 Ca -0.00 0.05 -0.00 0.00 -1.26 0.00 0.00 59.98 58.76 2jch h ARG 350 Cb 0.57 0.17 -0.03 0.00 -1.65 0.00 0.00 29.97 29.02 2jch h ARG 350 CO 0.03 -0.43 -0.52 1.98 0.56 0.00 0.00 179.97 181.60 2jch h MET 351 N -0.95 -0.88 -0.83 0.04 4.05 -1.16 -2.60 114.93 112.60 2jch h MET 351 Ca -0.08 0.06 0.21 0.00 -0.28 0.00 0.00 59.70 59.61 2jch h MET 351 Cb 0.64 0.20 -0.14 0.00 -0.80 0.00 0.00 31.60 31.50 2jch h MET 351 CO 0.13 -0.59 0.07 -0.92 0.23 0.00 0.00 176.91 175.83 2jch h TYR 352 N -0.91 0.05 -0.80 1.39 5.03 -1.12 0.45 116.97 121.06 2jch h TYR 352 Ca -0.04 0.06 -0.04 0.00 2.58 0.00 0.00 58.73 61.29 2jch h TYR 352 Cb 0.83 0.11 -0.04 0.00 1.55 0.00 0.00 36.73 39.19 2jch h TYR 352 CO -0.34 -0.26 0.36 -0.44 -1.32 0.00 0.00 178.16 176.16 2jch h ASP 353 N 0.12 1.07 0.34 -2.11 3.32 -1.19 -2.30 116.42 115.66 2jch h ASP 353 Ca 0.48 -0.14 -0.02 0.00 0.02 0.00 0.00 57.03 57.37 2jch h ASP 353 Cb 0.91 -0.27 0.00 0.00 0.22 0.00 0.00 39.33 40.19 2jch h ASP 353 CO -0.71 0.92 -0.16 0.22 -1.72 0.00 0.00 179.24 177.78 2jch h TYR 354 N 1.15 -0.42 -1.06 4.55 5.03 -0.54 -3.23 116.97 122.45 2jch h TYR 354 Ca 0.27 -0.01 0.28 0.00 2.58 0.00 0.00 58.73 61.85 2jch h TYR 354 Cb 0.15 0.14 -0.09 0.00 1.55 0.00 0.00 36.73 38.48 2jch h TYR 354 CO 0.02 -0.11 0.69 -0.07 -1.32 0.00 0.00 178.16 177.36 2jch h LEU 355 N -0.73 0.41 0.00 2.82 3.38 -0.04 1.75 115.31 122.89 2jch h LEU 355 Ca -0.05 0.08 0.00 0.00 0.09 0.00 0.00 57.88 58.00 2jch h LEU 355 Cb 0.50 0.02 0.00 0.00 0.09 0.00 0.00 40.66 41.27 2jch h LEU 355 CO 0.08 0.07 0.00 0.00 0.09 0.00 0.00 178.44 178.67 2jch n ALA 356 N -2.49 1.25 -2.72 1.53 0.00 -0.88 -2.69 120.51 114.50 2jch n ALA 356 Ca 0.26 0.00 -0.08 0.00 0.00 0.00 0.00 53.44 53.62 2jch n ALA 356 Cb 0.93 -0.83 0.09 0.00 0.00 0.00 0.00 19.45 19.63 2jch n ALA 356 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 2jch n GLN 357 N -0.46 0.79 -0.01 0.00 3.00 0.60 -3.85 117.38 117.44 2jch n GLN 357 Ca 0.00 -1.64 -0.03 0.00 -0.01 0.00 0.00 57.00 55.32 2jch n GLN 357 Cb 0.00 -0.94 -0.01 0.00 0.00 0.00 0.00 30.24 29.29 2jch n GLN 357 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.06 174.93 2jch n ARG 358 N 0.68 0.06 -0.51 -1.09 0.63 -1.09 -4.70 116.66 110.65 2jch n ARG 358 Ca 0.04 0.03 -0.04 0.00 -0.92 0.00 0.00 57.85 56.96 2jch n ARG 358 Cb 0.70 -0.61 -0.06 0.00 0.45 0.00 0.00 32.46 32.94 2jch n ARG 358 CO 0.00 0.00 0.00 -0.25 -2.51 0.00 0.00 177.63 174.87 2jch n ASP 359 N -3.15 3.49 0.00 6.15 9.92 -1.26 -4.82 116.55 126.87 2jch n ASP 359 Ca -0.06 -2.05 0.00 0.00 -0.53 0.00 0.00 54.79 52.15 2jch n ASP 359 Cb 0.52 -0.85 0.00 0.00 -0.64 0.00 0.00 41.12 40.15 2jch n ASP 359 CO 0.00 0.00 0.00 0.59 0.13 0.00 0.00 177.20 177.92 2jch n ASN 360 N 2.22 0.00 -1.05 -2.24 5.03 -1.26 -4.94 115.26 113.02 2jch n ASN 360 Ca 0.16 0.00 0.11 0.00 0.87 0.00 0.00 54.58 55.71 2jch n ASN 360 Cb 0.48 0.00 -0.06 0.00 -1.02 0.00 0.00 39.78 39.18 2jch n ASN 360 CO 0.00 0.00 0.00 0.52 -1.83 0.00 0.00 177.26 175.95 2jch n VAL 361 N 0.00 -0.89 -0.95 2.41 0.31 -1.26 -3.70 118.33 114.24 2jch n VAL 361 Ca 0.00 0.75 0.00 0.00 -0.01 0.00 0.00 64.34 65.08 2jch n VAL 361 Cb 0.00 -1.14 0.00 0.00 -0.91 0.00 0.00 33.84 31.79 2jch n VAL 361 CO 0.00 0.00 0.00 -1.20 -1.32 0.00 0.00 176.83 174.31 2jch n SER 362 N -3.50 0.89 -3.95 4.52 7.64 -1.25 -4.56 113.62 113.41 2jch n SER 362 Ca -0.06 0.00 -0.16 0.00 1.01 0.00 0.00 58.87 59.66 2jch n SER 362 Cb 0.48 0.00 -0.14 0.00 -1.01 0.00 0.00 64.21 63.53 2jch n SER 362 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2jch s ALA 363 N -1.53 0.43 -0.67 -0.43 0.00 -1.26 -4.89 121.76 113.42 2jch s ALA 363 Ca 0.00 -0.22 0.00 0.00 0.00 0.00 0.00 51.96 51.74 2jch s ALA 363 Cb 0.00 -0.11 0.00 0.00 0.00 0.00 0.00 23.12 23.01 2jch s ALA 363 CO 0.00 0.10 0.00 0.00 0.00 0.00 0.00 175.76 175.86 2jch n ALA 370 N 2.98 0.61 -3.32 0.00 0.00 -1.26 -5.24 120.51 114.28 2jch n ALA 370 Ca -0.13 0.00 -0.11 0.00 0.00 0.00 0.00 53.44 53.20 2jch n ALA 370 Cb 0.58 -0.55 -0.06 0.00 0.00 0.00 0.00 19.45 19.42 2jch n ALA 370 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 2jch s THR 371 N -0.67 -0.57 0.04 0.00 2.01 -1.26 -4.48 115.64 110.71 2jch s THR 371 Ca 0.00 -0.48 0.00 0.00 0.31 0.00 0.00 61.69 61.52 2jch s THR 371 Cb 0.00 -0.79 0.00 0.00 0.01 0.00 0.00 72.50 71.72 2jch s THR 371 CO 0.00 -0.35 0.00 1.67 -0.69 0.00 0.00 174.62 175.25 2jch n GLN 372 N 4.93 -0.33 0.00 4.92 -0.06 -1.26 -4.86 117.38 120.72 2jch n GLN 372 Ca 0.05 0.22 0.00 0.00 -2.00 0.00 0.00 57.00 55.26 2jch n GLN 372 Cb 0.49 -0.40 0.00 0.00 -4.06 0.00 0.00 30.24 26.27 2jch n GLN 372 CO 0.00 0.00 0.00 1.17 -0.20 0.00 0.00 177.06 178.03 2jch n LYS 373 N -1.57 0.00 0.22 3.69 3.00 -1.26 -1.87 118.16 120.37 2jch n LYS 373 Ca 0.00 0.00 -0.15 0.00 -0.00 0.00 0.00 58.31 58.16 2jch n LYS 373 Cb 0.07 0.00 -0.08 0.00 0.00 0.00 0.00 35.03 35.03 2jch n LYS 373 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 177.40 177.75 2jch h PHE 374 N 0.00 -0.92 0.00 5.64 3.57 -1.89 -2.75 116.94 120.59 2jch h PHE 374 Ca 0.00 0.01 -0.03 0.00 3.53 0.00 0.00 57.97 61.47 2jch h PHE 374 Cb 0.00 0.36 -0.00 0.00 2.79 0.00 0.00 35.95 39.09 2jch h PHE 374 CO 0.00 -0.49 -0.15 1.88 -2.23 0.00 0.00 178.31 177.33 2jch h TYR 375 N -0.72 0.00 -0.07 0.41 0.05 -1.73 0.13 116.97 115.04 2jch h TYR 375 Ca -0.02 0.00 -0.10 0.00 0.05 0.00 0.00 58.73 58.65 2jch h TYR 375 Cb 0.65 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 38.37 2jch h TYR 375 CO -0.19 0.15 -0.42 -0.09 -1.05 0.00 0.00 178.16 176.55 2jch h ARG 376 N 0.00 0.16 0.05 4.88 9.65 -1.78 -2.09 114.38 125.26 2jch h ARG 376 Ca -0.00 -0.07 -0.26 0.00 -1.10 0.00 0.00 59.98 58.55 2jch h ARG 376 Cb 0.28 -0.00 -0.02 0.00 -1.39 0.00 0.00 29.97 28.83 2jch h ARG 376 CO 0.02 0.56 -1.37 -0.44 2.80 0.00 0.00 179.97 181.53 2jch h ASP 377 N 0.13 0.18 -0.82 -3.80 3.32 -1.00 -2.97 116.42 111.46 2jch h ASP 377 Ca 0.01 -0.71 0.11 0.00 0.02 0.00 0.00 57.03 56.46 2jch h ASP 377 Cb 0.80 -0.06 -0.13 0.00 0.22 0.00 0.00 39.33 40.17 2jch h ASP 377 CO 0.06 1.57 -0.45 0.25 -1.72 0.00 0.00 179.24 178.95 2jch h LEU 378 N -0.61 -1.63 -0.59 1.55 6.46 -0.88 -2.14 115.31 117.46 2jch h LEU 378 Ca -0.33 0.29 0.09 0.00 -0.12 0.00 0.00 57.88 57.81 2jch h LEU 378 Cb 1.55 0.77 -0.07 0.00 -0.73 0.00 0.00 40.66 42.18 2jch h LEU 378 CO -0.07 -0.29 0.21 0.00 -0.62 0.00 0.00 178.44 177.66 2jch h ALA 379 N 0.85 0.75 0.00 1.25 0.00 -1.41 -0.01 119.26 120.69 2jch h ALA 379 Ca 0.23 0.09 -0.01 0.00 0.00 0.00 0.00 54.91 55.21 2jch h ALA 379 Cb 0.54 0.07 -0.00 0.00 0.00 0.00 0.00 17.79 18.40 2jch h ALA 379 CO -0.85 -0.21 -0.07 0.00 0.00 0.00 0.00 179.25 178.12 2jch h ALA 380 N 1.41 1.09 0.00 0.00 0.00 -1.34 -1.66 119.26 118.76 2jch h ALA 380 Ca 0.30 -0.06 -0.06 0.00 0.00 0.00 0.00 54.91 55.09 2jch h ALA 380 Cb 0.37 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.14 2jch h ALA 380 CO -0.31 0.09 -0.33 1.57 0.00 0.00 0.00 179.25 180.26 2jch h LYS 381 N 0.00 0.00 0.00 0.00 5.09 -0.73 -2.61 116.57 118.31 2jch h LYS 381 Ca -0.00 0.00 -0.02 0.00 0.09 0.00 0.00 60.65 60.72 2jch h LYS 381 Cb 0.39 0.00 -0.00 0.00 0.10 0.00 0.00 32.23 32.72 2jch h LYS 381 CO 0.01 0.91 -0.07 1.49 -2.09 0.00 0.00 179.45 179.69 2jch h GLU 382 N -1.00 0.00 0.06 0.07 4.57 -0.91 -0.49 114.58 116.87 2jch h GLU 382 Ca -0.09 0.00 -0.10 0.00 -1.18 0.00 0.00 59.36 57.99 2jch h GLU 382 Cb 1.00 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.59 2jch h GLU 382 CO -0.05 0.07 -0.50 0.82 -1.18 0.00 0.00 179.01 178.17 2jch h ILE 383 N 0.00 1.56 0.00 2.32 1.08 -1.42 -3.07 117.51 117.98 2jch h ILE 383 Ca -0.00 -2.40 -0.01 0.00 -0.39 0.00 0.00 64.86 62.06 2jch h ILE 383 Cb 0.17 3.18 -0.00 0.00 -3.07 0.00 0.00 36.82 37.10 2jch h ILE 383 CO 0.01 0.63 -0.02 -0.08 -0.69 0.00 0.00 178.15 177.99 2jch h GLU 384 N -0.73 0.00 0.00 2.37 4.81 -0.74 -3.35 114.58 116.94 2jch h GLU 384 Ca -0.10 0.00 -0.29 0.00 -0.13 0.00 0.00 59.36 58.84 2jch h GLU 384 Cb 1.30 0.00 -0.04 0.00 0.63 0.00 0.00 28.75 30.64 2jch h GLU 384 CO 0.04 0.02 -1.94 0.09 -0.73 0.00 0.00 179.01 176.49 2jch n ASN 385 N -3.13 1.85 -2.16 1.04 3.02 -0.42 -4.64 115.26 110.82 2jch n ASN 385 Ca 0.01 0.32 -0.14 0.00 -0.03 0.00 0.00 54.58 54.73 2jch n ASN 385 Cb 0.33 -0.75 0.01 0.00 -0.61 0.00 0.00 39.78 38.76 2jch n ASN 385 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2jch n GLY 386 N 1.44 -1.29 2.19 7.41 0.00 -1.16 -4.75 105.19 109.03 2jch n GLY 386 Ca -0.38 -0.04 -0.26 0.00 0.00 0.00 0.00 46.02 45.33 2jch n GLY 386 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2jch n GLY 387 N 1.84 6.23 3.73 -0.02 0.00 -1.26 -3.38 105.19 112.34 2jch n GLY 387 Ca -0.01 -2.65 -0.41 0.00 0.00 0.00 0.00 46.02 42.96 2jch n GLY 387 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2jch s TYR 388 N -3.63 3.57 -0.29 1.61 2.02 -1.26 -2.40 117.35 116.98 2jch s TYR 388 Ca 0.52 1.56 -0.09 0.00 -0.37 0.00 0.00 57.07 58.70 2jch s TYR 388 Cb 0.42 -3.29 -0.02 0.00 -0.40 0.00 0.00 41.96 38.68 2jch s TYR 388 CO -0.03 -0.67 0.12 0.21 -1.57 0.00 0.00 175.55 173.60 2jch s LYS 389 N -0.13 3.46 -0.24 -0.62 2.36 -0.13 0.13 119.74 124.57 2jch s LYS 389 Ca 0.51 -0.63 -0.07 0.00 -2.55 0.00 0.00 55.97 53.23 2jch s LYS 389 Cb -0.29 -3.47 -0.03 0.00 -1.05 0.00 0.00 37.83 33.00 2jch s LYS 389 CO 0.34 -0.33 0.05 0.42 1.55 0.00 0.00 175.35 177.38 2jch s ILE 390 N 1.61 4.16 -0.28 5.43 1.01 0.32 -0.21 121.20 133.24 2jch s ILE 390 Ca 0.05 -0.23 -0.12 0.00 0.00 0.00 0.00 60.65 60.36 2jch s ILE 390 Cb -0.16 -2.93 -0.05 0.00 0.01 0.00 0.00 42.46 39.33 2jch s ILE 390 CO 0.05 0.36 0.23 -0.89 0.00 0.00 0.00 174.94 174.69 2jch s THR 391 N 1.49 5.28 0.73 2.92 2.01 0.16 -0.54 115.64 127.70 2jch s THR 391 Ca 0.06 0.26 -0.03 0.00 0.31 0.00 0.00 61.69 62.28 2jch s THR 391 Cb -0.15 -3.56 0.12 0.00 0.01 0.00 0.00 72.50 68.92 2jch s THR 391 CO 0.02 0.24 1.02 0.42 -0.69 0.00 0.00 174.62 175.63 2jch s THR 392 N 1.79 2.19 -0.48 -0.82 -4.23 0.34 -1.97 115.64 112.45 2jch s THR 392 Ca 0.09 -0.48 0.23 0.00 -1.18 0.00 0.00 61.69 60.35 2jch s THR 392 Cb -0.16 -2.71 -0.06 0.00 1.34 0.00 0.00 72.50 70.90 2jch s THR 392 CO 0.10 0.00 1.06 0.35 -0.54 0.00 0.00 174.62 175.59 2jch n THR 393 N -2.92 0.31 -1.54 3.99 -2.24 -0.49 -3.66 114.28 107.73 2jch n THR 393 Ca 0.13 -0.34 -0.49 0.00 -2.27 0.00 0.00 64.05 61.08 2jch n THR 393 Cb 0.60 -0.02 -0.06 0.00 -2.10 0.00 0.00 70.33 68.76 2jch n THR 393 CO 0.00 0.00 0.00 -0.38 -0.57 0.00 0.00 175.07 174.12 2jch n ILE 394 N -2.19 0.31 -2.21 2.28 2.08 -1.22 -4.52 119.36 113.89 2jch n ILE 394 Ca 0.01 -0.26 -0.42 0.00 0.56 0.00 0.00 62.75 62.64 2jch n ILE 394 Cb 0.47 -1.87 -0.03 0.00 -0.75 0.00 0.00 39.64 37.47 2jch n ILE 394 CO 0.00 0.00 0.00 -0.62 0.56 0.00 0.00 176.55 176.49 2jch s ASP 395 N 6.62 6.82 0.01 4.38 -1.08 -0.93 -1.06 116.67 131.42 2jch s ASP 395 Ca 1.04 2.05 -0.22 0.00 -0.52 0.00 0.00 52.55 54.89 2jch s ASP 395 Cb -0.72 -2.55 -0.18 0.00 -1.46 0.00 0.00 42.92 38.01 2jch s ASP 395 CO 0.48 -0.79 1.24 -0.61 0.52 0.00 0.00 175.17 176.01 2jch h GLN 396 N 8.42 0.26 -0.57 4.34 4.15 -1.92 -0.97 115.11 128.82 2jch h GLN 396 Ca -0.35 -0.17 -0.08 0.00 0.77 0.00 0.00 58.65 58.81 2jch h GLN 396 Cb 1.16 0.02 -0.02 0.00 0.21 0.00 0.00 27.48 28.85 2jch h GLN 396 CO 0.93 0.77 0.03 0.87 -1.93 0.00 0.00 178.83 179.50 2jch h LYS 397 N -0.22 0.98 -0.09 1.69 1.57 -1.93 -2.44 116.57 116.13 2jch h LYS 397 Ca 0.00 -0.30 -0.00 0.00 -1.87 0.00 0.00 60.65 58.48 2jch h LYS 397 Cb 0.76 -0.10 -0.00 0.00 0.08 0.00 0.00 32.23 32.97 2jch h LYS 397 CO 0.04 0.97 0.05 0.82 -0.57 0.00 0.00 179.45 180.75 2jch h ILE 398 N 0.87 1.09 -0.73 1.86 2.04 -1.84 -1.86 117.51 118.93 2jch h ILE 398 Ca 0.16 -0.24 -0.04 0.00 1.00 0.00 0.00 64.86 65.74 2jch h ILE 398 Cb 0.50 1.08 -0.03 0.00 -0.74 0.00 0.00 36.82 37.63 2jch h ILE 398 CO 0.02 0.08 0.29 -0.74 0.00 0.00 0.00 178.15 177.79 2jch h HIS 399 N 0.05 1.12 -0.02 1.37 2.76 -1.15 -1.15 115.15 118.15 2jch h HIS 399 Ca 0.03 -0.09 -0.18 0.00 -2.20 0.00 0.00 60.37 57.93 2jch h HIS 399 Cb 0.08 -0.34 -0.01 0.00 1.55 0.00 0.00 27.41 28.69 2jch h HIS 399 CO -0.04 0.87 -0.79 0.77 -1.30 0.00 0.00 177.93 177.43 2jch h SER 400 N 1.06 0.27 -0.72 3.26 0.02 -1.44 -0.97 113.55 115.03 2jch h SER 400 Ca 0.24 -0.20 0.03 0.00 -0.84 0.00 0.00 61.79 61.03 2jch h SER 400 Cb 0.22 -0.08 -0.05 0.00 0.14 0.00 0.00 62.40 62.64 2jch h SER 400 CO -0.02 0.95 0.45 0.00 -1.14 0.00 0.00 176.83 177.07 2jch h ALA 401 N 1.03 0.94 -0.60 3.77 0.00 -1.02 -1.47 119.26 121.91 2jch h ALA 401 Ca -0.03 -0.02 -0.07 0.00 0.00 0.00 0.00 54.91 54.78 2jch h ALA 401 Cb 1.39 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 18.93 2jch h ALA 401 CO 0.12 0.22 0.09 0.52 0.00 0.00 0.00 179.25 180.21 2jch h MET 402 N 0.87 1.00 -0.61 0.00 2.86 -0.84 0.12 114.93 118.33 2jch h MET 402 Ca 0.29 -0.27 0.07 0.00 -2.06 0.00 0.00 59.70 57.73 2jch h MET 402 Cb 0.03 -0.12 -0.06 0.00 0.06 0.00 0.00 31.60 31.51 2jch h MET 402 CO -0.11 0.94 0.30 1.96 1.06 0.00 0.00 176.91 181.06 2jch h GLN 403 N 0.91 0.52 -0.42 1.72 1.08 -0.88 -2.37 115.11 115.67 2jch h GLN 403 Ca 0.18 -0.03 -0.11 0.00 -1.45 0.00 0.00 58.65 57.24 2jch h GLN 403 Cb 0.43 -0.12 -0.01 0.00 -0.05 0.00 0.00 27.48 27.73 2jch h GLN 403 CO 0.01 0.35 -0.15 0.77 -0.95 0.00 0.00 178.83 178.86 2jch h SER 404 N 0.54 0.86 -0.28 1.46 0.02 -0.83 -2.38 113.55 112.95 2jch h SER 404 Ca 0.29 -0.38 0.06 0.00 -0.84 0.00 0.00 61.79 60.91 2jch h SER 404 Cb 0.26 -0.24 -0.06 0.00 0.14 0.00 0.00 62.40 62.51 2jch h SER 404 CO -0.23 1.05 -0.09 0.00 -1.14 0.00 0.00 176.83 176.43 2jch h ALA 405 N 0.84 0.16 -0.72 3.77 0.00 -0.70 0.57 119.26 123.17 2jch h ALA 405 Ca 0.10 0.11 -0.00 0.00 0.00 0.00 0.00 54.91 55.11 2jch h ALA 405 Cb 0.70 0.24 -0.04 0.00 0.00 0.00 0.00 17.79 18.70 2jch h ALA 405 CO 0.05 -0.48 0.43 -0.24 0.00 0.00 0.00 179.25 179.01 2jch h VAL 406 N -0.02 1.20 0.33 0.00 3.04 -1.40 0.41 116.25 119.81 2jch h VAL 406 Ca 0.14 -0.45 -0.02 0.00 -1.01 0.00 0.00 66.70 65.36 2jch h VAL 406 Cb 0.23 0.19 0.00 0.00 -2.01 0.00 0.00 31.29 29.70 2jch h VAL 406 CO -0.30 0.21 -0.16 0.00 -1.01 0.00 0.00 177.57 176.31 2jch h ALA 407 N 1.48 -0.45 -0.79 3.17 0.00 -1.24 -0.68 119.26 120.76 2jch h ALA 407 Ca 0.26 -0.18 0.05 0.00 0.00 0.00 0.00 54.91 55.04 2jch h ALA 407 Cb -0.04 0.17 -0.05 0.00 0.00 0.00 0.00 17.79 17.88 2jch h ALA 407 CO -0.05 -0.60 0.52 -0.44 0.00 0.00 0.00 179.25 178.68 2jch h ASP 408 N -0.75 0.78 0.00 0.00 3.32 0.21 -3.40 116.42 116.59 2jch h ASP 408 Ca -0.05 -0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.00 2jch h ASP 408 Cb 0.50 -0.17 0.00 0.00 0.22 0.00 0.00 39.33 39.88 2jch h ASP 408 CO 0.07 0.52 0.00 -1.22 -1.72 0.00 0.00 179.24 176.89 2jch n TYR 409 N -4.47 0.00 0.06 4.55 4.01 0.14 -4.67 117.16 116.78 2jch n TYR 409 Ca 0.11 0.00 0.21 0.00 -0.16 0.00 0.00 57.90 58.06 2jch n TYR 409 Cb 0.18 0.00 0.69 0.00 -0.31 0.00 0.00 39.34 39.90 2jch n TYR 409 CO 0.00 0.00 0.00 0.78 -0.46 0.00 0.00 176.86 177.18 2jch h GLY 410 N 0.00 0.00 2.00 2.72 0.00 -1.22 -0.73 103.07 105.85 2jch h GLY 410 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 2jch h GLY 410 CO 0.00 0.00 0.00 0.10 0.00 0.00 0.00 176.54 176.64 2jch h TYR 411 N 0.00 0.00 -0.06 5.60 -0.00 -1.83 -1.17 116.97 119.51 2jch h TYR 411 Ca 0.23 0.00 0.02 0.00 -0.00 0.00 0.00 58.73 58.98 2jch h TYR 411 Cb 1.39 0.00 -0.00 0.00 -0.00 0.00 0.00 36.73 38.11 2jch h TYR 411 CO 0.00 0.00 0.05 -0.07 -0.00 0.00 0.00 178.16 178.14 2jch h LEU 412 N 0.00 0.00 -0.47 0.10 3.38 -1.49 -2.47 115.31 114.36 2jch h LEU 412 Ca 0.00 0.00 -0.11 0.00 0.09 0.00 0.00 57.88 57.86 2jch h LEU 412 Cb 0.37 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.10 2jch h LEU 412 CO 0.00 0.00 -0.54 -0.07 0.09 0.00 0.00 178.44 177.92 2jch h LEU 413 N 0.00 0.00 -9.69 1.67 3.38 -1.40 -3.46 115.31 105.81 2jch h LEU 413 Ca 0.03 0.00 -0.52 0.00 0.09 0.00 0.00 57.88 57.48 2jch h LEU 413 Cb 0.14 0.00 0.04 0.00 0.09 0.00 0.00 40.66 40.92 2jch h LEU 413 CO -0.00 0.54 0.67 -1.81 0.09 0.00 0.00 178.44 177.93 2jch s ASP 414 N -6.53 6.85 0.00 -0.43 1.01 -0.93 -4.87 116.67 111.77 2jch s ASP 414 Ca 0.01 2.45 0.00 0.00 0.71 0.00 0.00 52.55 55.73 2jch s ASP 414 Cb 0.10 -2.61 0.00 0.00 1.01 0.00 0.00 42.92 41.42 2jch s ASP 414 CO 0.73 -0.56 0.84 -0.90 0.21 0.00 0.00 175.17 175.50 2jch n ASP 415 N 2.55 0.00 -0.13 0.27 5.75 -1.26 -5.01 116.55 118.72 2jch n ASP 415 Ca 0.06 -1.71 0.00 0.00 -0.01 0.00 0.00 54.79 53.13 2jch n ASP 415 Cb 0.42 -0.14 0.00 0.00 -1.03 0.00 0.00 41.12 40.37 2jch n ASP 415 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2jch n GLY 416 N 0.00 0.71 0.00 6.12 0.00 -1.26 -4.78 105.19 105.98 2jch n GLY 416 Ca 0.00 -0.71 0.00 0.00 0.00 0.00 0.00 46.02 45.31 2jch n GLY 416 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2jch n THR 417 N -3.15 0.30 0.00 2.61 -2.24 -1.26 -5.04 114.28 105.50 2jch n THR 417 Ca 0.00 -0.30 0.00 0.00 -2.27 0.00 0.00 64.05 61.48 2jch n THR 417 Cb 0.43 0.86 0.00 0.00 -2.10 0.00 0.00 70.33 69.51 2jch n THR 417 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2jch n GLY 418 N -0.15 -1.19 3.59 3.38 0.00 -1.26 -4.93 105.19 104.63 2jch n GLY 418 Ca 0.00 -2.10 -0.42 0.00 0.00 0.00 0.00 46.02 43.50 2jch n GLY 418 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2jch s ARG 419 N 0.00 3.43 -0.37 1.61 3.52 -1.26 -4.74 118.95 121.14 2jch s ARG 419 Ca 0.00 0.74 -0.23 0.00 -0.13 0.00 0.00 55.73 56.12 2jch s ARG 419 Cb 0.00 -4.08 0.01 0.00 -1.56 0.00 0.00 34.95 29.32 2jch s ARG 419 CO 0.00 -1.76 0.75 0.08 -0.81 0.00 0.00 175.30 173.57 2jch s VAL 420 N 5.82 4.76 0.75 7.11 1.01 -1.26 -4.56 120.40 134.03 2jch s VAL 420 Ca 0.58 0.76 -0.08 0.00 0.00 0.00 0.00 61.98 63.24 2jch s VAL 420 Cb -0.13 -4.20 0.08 0.00 0.00 0.00 0.00 36.38 32.14 2jch s VAL 420 CO 0.29 -0.45 1.07 -1.61 0.00 0.00 0.00 175.10 174.41 2jch s GLU 421 N 3.04 2.00 -0.07 2.72 0.41 0.16 -4.86 118.70 122.10 2jch s GLU 421 Ca 0.30 -0.24 -0.17 0.00 -0.41 0.00 0.00 54.97 54.44 2jch s GLU 421 Cb -0.13 -2.11 0.04 0.00 -1.78 0.00 0.00 34.13 30.14 2jch s GLU 421 CO 0.17 -1.41 0.41 0.54 -0.49 0.00 0.00 175.26 174.48 2jch s VAL 422 N -3.35 0.03 -0.00 2.63 0.11 -1.26 -2.78 120.40 115.77 2jch s VAL 422 Ca 0.62 -0.24 0.01 0.00 -2.93 0.00 0.00 61.98 59.44 2jch s VAL 422 Cb -0.10 -0.67 -0.00 0.00 -1.53 0.00 0.00 36.38 34.08 2jch s VAL 422 CO 0.46 -0.13 -0.03 -0.83 -3.33 0.00 0.00 175.10 171.24 2jch s GLY 423 N -0.76 0.15 0.01 6.54 0.00 -0.82 -3.25 107.32 109.18 2jch s GLY 423 Ca -0.08 -0.10 -0.03 0.00 0.00 0.00 0.00 44.72 44.50 2jch s GLY 423 CO 0.04 -0.05 0.05 -1.31 0.00 0.00 0.00 173.10 171.83 2jch s ASN 424 N 0.01 0.11 -0.07 1.64 0.01 0.53 -2.28 114.94 114.89 2jch s ASN 424 Ca 0.00 -0.28 -0.01 0.00 -0.71 0.00 0.00 52.86 51.86 2jch s ASN 424 Cb -0.02 0.15 0.03 0.00 0.41 0.00 0.00 41.25 41.81 2jch s ASN 424 CO -0.00 -0.28 -0.01 -0.69 -1.51 0.00 0.00 177.10 174.61 2jch s VAL 425 N -1.19 0.42 -0.25 1.60 1.01 -1.14 -0.62 120.40 120.23 2jch s VAL 425 Ca -0.13 0.06 -0.10 0.00 0.00 0.00 0.00 61.98 61.81 2jch s VAL 425 Cb -0.08 -0.55 -0.05 0.00 0.00 0.00 0.00 36.38 35.71 2jch s VAL 425 CO 0.00 0.25 0.15 -0.22 0.00 0.00 0.00 175.10 175.29 2jch s LEU 426 N 1.75 3.97 -0.01 3.92 2.96 -0.77 -1.89 118.68 128.62 2jch s LEU 426 Ca 0.02 0.02 0.05 0.00 -0.22 0.00 0.00 54.13 54.00 2jch s LEU 426 Cb -0.13 -2.08 -0.01 0.00 0.50 0.00 0.00 46.19 44.47 2jch s LEU 426 CO -0.04 0.02 -0.15 -0.32 -1.32 0.00 0.00 176.35 174.53 2jch s MET 427 N 1.35 1.21 -0.16 1.98 -2.45 -0.95 0.06 119.30 120.34 2jch s MET 427 Ca 0.07 -0.58 -0.29 0.00 -1.25 0.00 0.00 55.69 53.64 2jch s MET 427 Cb -0.15 -1.18 -0.00 0.00 1.25 0.00 0.00 34.83 34.75 2jch s MET 427 CO 0.07 0.32 1.03 0.34 1.05 0.00 0.00 175.02 177.83 2jch s ASP 428 N -0.46 7.17 0.45 1.11 -1.08 0.13 -2.34 116.67 121.66 2jch s ASP 428 Ca 0.06 1.48 0.16 0.00 -0.52 0.00 0.00 52.55 53.73 2jch s ASP 428 Cb -0.06 -2.55 1.03 0.00 -1.46 0.00 0.00 42.92 39.88 2jch s ASP 428 CO -0.00 -0.55 1.98 0.78 0.52 0.00 0.00 175.17 177.89 2jch h ASN 429 N 7.28 0.00 1.37 -0.34 2.35 -1.38 -0.55 115.58 124.30 2jch h ASN 429 Ca -0.26 0.00 -0.05 0.00 -0.55 0.00 0.00 56.30 55.44 2jch h ASN 429 Cb 1.11 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 39.47 2jch h ASN 429 CO 0.91 0.21 -0.65 1.56 -1.65 0.00 0.00 177.43 177.81 2jch h GLN 430 N 0.00 0.00 0.00 0.81 4.20 -1.88 -3.42 115.11 114.82 2jch h GLN 430 Ca -0.00 0.00 -0.01 0.00 0.06 0.00 0.00 58.65 58.70 2jch h GLN 430 Cb 0.38 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 28.16 2jch h GLN 430 CO 0.03 0.15 -1.04 0.25 -0.67 0.00 0.00 178.83 177.54 2jch n THR 431 N -2.96 0.04 -0.48 -0.54 -2.24 -1.21 -4.96 114.28 101.94 2jch n THR 431 Ca 0.00 -0.02 0.00 0.00 -2.27 0.00 0.00 64.05 61.76 2jch n THR 431 Cb 0.63 -0.71 0.00 0.00 -2.10 0.00 0.00 70.33 68.15 2jch n THR 431 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2jch n GLY 432 N 3.26 0.81 3.76 3.38 0.00 -0.22 -4.53 105.19 111.65 2jch n GLY 432 Ca -0.01 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.60 2jch n GLY 432 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2jch s ALA 433 N -2.99 3.47 -0.20 4.61 0.00 -1.26 -3.22 121.76 122.18 2jch s ALA 433 Ca 0.00 1.10 -0.15 0.00 0.00 0.00 0.00 51.96 52.91 2jch s ALA 433 Cb 0.00 -3.43 -0.04 0.00 0.00 0.00 0.00 23.12 19.65 2jch s ALA 433 CO 0.00 -0.45 0.37 0.42 0.00 0.00 0.00 175.76 176.10 2jch s ILE 434 N -0.86 5.22 -0.58 0.00 1.01 -0.92 -0.69 121.20 124.38 2jch s ILE 434 Ca 0.49 0.65 0.23 0.00 0.00 0.00 0.00 60.65 62.02 2jch s ILE 434 Cb -0.36 -3.70 -0.10 0.00 0.01 0.00 0.00 42.46 38.30 2jch s ILE 434 CO 0.45 0.27 1.04 0.18 0.00 0.00 0.00 174.94 176.88 2jch n LEU 435 N 4.37 0.61 0.00 2.97 4.77 0.11 -3.38 117.00 126.46 2jch n LEU 435 Ca -0.09 0.02 0.00 0.00 -0.03 0.00 0.00 56.01 55.90 2jch n LEU 435 Cb 0.51 -0.10 0.00 0.00 -2.33 0.00 0.00 43.42 41.50 2jch n LEU 435 CO 0.40 0.02 0.00 0.61 -1.33 0.00 0.00 177.39 177.09 2jch n GLY 436 N 1.35 0.89 3.44 -0.72 0.00 -1.24 -2.19 105.19 106.74 2jch n GLY 436 Ca 0.02 -0.64 -0.13 0.00 0.00 0.00 0.00 46.02 45.26 2jch n GLY 436 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 2jch s PHE 437 N -2.00 -0.56 -0.22 1.61 -0.12 -1.26 -1.85 117.98 113.58 2jch s PHE 437 Ca 0.00 0.50 -0.02 0.00 -0.05 0.00 0.00 56.93 57.35 2jch s PHE 437 Cb 0.00 0.53 0.01 0.00 -0.63 0.00 0.00 43.02 42.92 2jch s PHE 437 CO 0.00 -0.79 -0.08 0.08 -0.05 0.00 0.00 175.22 174.39 2jch s VAL 438 N -3.17 2.98 -0.41 -2.49 1.01 0.21 -4.75 120.40 113.78 2jch s VAL 438 Ca -0.01 -0.74 0.23 0.00 0.00 0.00 0.00 61.98 61.45 2jch s VAL 438 Cb -0.01 -2.39 0.15 0.00 0.00 0.00 0.00 36.38 34.13 2jch s VAL 438 CO -0.08 0.37 1.35 1.23 0.00 0.00 0.00 175.10 177.97 2jch h GLY 439 N 8.05 0.00 0.00 4.51 0.00 -1.84 0.15 103.07 113.94 2jch h GLY 439 Ca -0.40 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.93 2jch h GLY 439 CO 0.60 0.00 0.00 0.61 0.00 0.00 0.00 176.54 177.75 2jch n GLY 440 N 1.19 -0.91 0.37 4.60 0.00 -1.20 -0.87 105.19 108.37 2jch n GLY 440 Ca 0.02 -1.16 0.03 0.00 0.00 0.00 0.00 46.02 44.91 2jch n GLY 440 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 2jch h ARG 441 N 0.00 1.12 -0.39 1.61 2.47 -1.89 -3.44 114.38 113.85 2jch h ARG 441 Ca 0.00 -0.07 0.22 0.00 -1.26 0.00 0.00 59.98 58.87 2jch h ARG 441 Cb 0.00 -0.25 -0.21 0.00 -1.65 0.00 0.00 29.97 27.86 2jch h ARG 441 CO 0.00 0.74 0.06 1.21 0.56 0.00 0.00 179.97 182.54 2jch s ASN 442 N -5.88 -0.56 0.45 7.04 2.47 -1.26 -4.65 114.94 112.55 2jch s ASN 442 Ca -0.12 0.29 0.12 0.00 0.42 0.00 0.00 52.86 53.56 2jch s ASN 442 Cb 0.20 1.45 1.00 0.00 -1.45 0.00 0.00 41.25 42.45 2jch s ASN 442 CO 0.81 -0.10 2.04 0.22 -3.72 0.00 0.00 177.10 176.34 2jch h TYR 443 N 7.88 0.17 -0.88 0.43 5.03 -1.86 -2.54 116.97 125.20 2jch h TYR 443 Ca -0.13 -0.01 -0.00 0.00 2.58 0.00 0.00 58.73 61.17 2jch h TYR 443 Cb 1.17 -0.05 -0.04 0.00 1.55 0.00 0.00 36.73 39.36 2jch h TYR 443 CO 0.05 0.20 0.54 1.96 -1.32 0.00 0.00 178.16 179.59 2jch h GLN 444 N 0.17 1.18 0.00 1.82 4.20 -2.00 -2.81 115.11 117.67 2jch h GLN 444 Ca 0.04 -0.10 0.00 0.00 0.06 0.00 0.00 58.65 58.66 2jch h GLN 444 Cb 0.16 -0.25 0.00 0.00 0.30 0.00 0.00 27.48 27.68 2jch h GLN 444 CO 0.00 0.81 -0.44 0.39 -0.67 0.00 0.00 178.83 178.92 2jch n GLU 445 N -4.43 0.24 -3.31 1.46 -0.58 -0.97 -4.88 120.64 108.17 2jch n GLU 445 Ca 0.09 0.10 0.02 0.00 -0.42 0.00 0.00 57.16 56.96 2jch n GLU 445 Cb 0.04 -1.69 -0.04 0.00 -0.57 0.00 0.00 31.44 29.19 2jch n GLU 445 CO 0.00 0.00 0.00 1.21 -0.48 0.00 0.00 177.13 177.86 2jch s ASN 446 N -4.12 -0.39 0.00 1.62 3.84 -1.06 -5.07 114.94 109.77 2jch s ASN 446 Ca 0.08 0.52 0.23 0.00 0.21 0.00 0.00 52.86 53.90 2jch s ASN 446 Cb 0.14 1.43 0.06 0.00 -0.55 0.00 0.00 41.25 42.33 2jch s ASN 446 CO 0.68 -0.07 1.11 0.00 -2.79 0.00 0.00 177.10 176.03 2jch n GLN 447 N 4.84 0.47 -1.75 0.43 3.00 -1.26 -4.06 117.38 119.05 2jch n GLN 447 Ca -0.08 -0.37 -0.42 0.00 -0.01 0.00 0.00 57.00 56.12 2jch n GLN 447 Cb 0.54 -1.49 -0.03 0.00 0.00 0.00 0.00 30.24 29.25 2jch n GLN 447 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.06 176.26 2jch s ASN 448 N -2.78 6.48 -0.58 1.08 0.02 -1.26 -4.94 114.94 112.96 2jch s ASN 448 Ca 0.14 2.63 -0.27 0.00 -1.02 0.00 0.00 52.86 54.34 2jch s ASN 448 Cb 0.17 -2.55 0.03 0.00 0.02 0.00 0.00 41.25 38.93 2jch s ASN 448 CO 0.71 -1.00 1.10 0.21 0.02 0.00 0.00 177.10 178.14 2jch s ASN 449 N 3.51 6.39 0.00 -1.22 3.84 -1.26 -4.64 114.94 121.56 2jch s ASN 449 Ca 0.83 -0.11 0.31 0.00 0.21 0.00 0.00 52.86 54.09 2jch s ASN 449 Cb -0.42 -2.51 1.67 0.00 -0.55 0.00 0.00 41.25 39.44 2jch s ASN 449 CO 0.37 -1.41 2.10 1.41 -2.79 0.00 0.00 177.10 176.78 2jch n HIS 450 N 8.13 0.00 -0.10 0.43 8.25 -0.05 -0.95 115.22 130.94 2jch n HIS 450 Ca 0.05 0.00 -0.13 0.00 -0.26 0.00 0.00 57.72 57.39 2jch n HIS 450 Cb 0.48 -0.03 -0.15 0.00 1.12 0.00 0.00 29.99 31.42 2jch n HIS 450 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2jch n ALA 451 N -0.79 1.45 0.00 -1.41 0.00 -1.26 -4.25 120.51 114.25 2jch n ALA 451 Ca 0.22 -1.18 0.00 0.00 0.00 0.00 0.00 53.44 52.48 2jch n ALA 451 Cb 0.18 -0.25 0.00 0.00 0.00 0.00 0.00 19.45 19.38 2jch n ALA 451 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 2jch n PHE 452 N -2.97 0.00 -0.06 0.00 3.72 -1.22 -1.60 117.46 115.33 2jch n PHE 452 Ca -0.35 0.00 -0.11 0.00 -0.05 0.00 0.00 57.45 56.94 2jch n PHE 452 Cb 1.09 0.00 -0.05 0.00 -0.94 0.00 0.00 39.48 39.59 2jch n PHE 452 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 176.76 176.46 2jch n ASP 453 N -0.87 1.62 -4.78 4.37 8.00 -0.12 -4.95 116.55 119.82 2jch n ASP 453 Ca 0.00 0.08 -0.37 0.00 0.71 0.00 0.00 54.79 55.21 2jch n ASP 453 Cb 0.00 -0.29 -0.06 0.00 -0.02 0.00 0.00 41.12 40.75 2jch n ASP 453 CO 0.00 0.00 0.00 0.42 -0.39 0.00 0.00 177.20 177.23 2jch s THR 454 N -2.22 4.01 -0.13 -3.53 -4.23 -1.15 -4.92 115.64 103.47 2jch s THR 454 Ca -0.16 1.65 0.03 0.00 -1.18 0.00 0.00 61.69 62.02 2jch s THR 454 Cb 0.06 -3.90 0.00 0.00 1.34 0.00 0.00 72.50 70.00 2jch s THR 454 CO 0.23 0.11 -0.22 -0.54 -0.54 0.00 0.00 174.62 173.66 2jch s LYS 455 N -2.15 3.06 0.11 3.99 1.02 -1.26 -3.95 119.74 120.56 2jch s LYS 455 Ca 0.52 -0.85 0.02 0.00 0.02 0.00 0.00 55.97 55.68 2jch s LYS 455 Cb -0.21 -2.41 -0.04 0.00 -0.52 0.00 0.00 37.83 34.66 2jch s LYS 455 CO 0.26 0.07 -0.07 1.03 -0.92 0.00 0.00 175.35 175.72 2jch s ARG 456 N 0.61 0.87 0.30 1.68 1.81 -0.05 -4.71 118.95 119.45 2jch s ARG 456 Ca -0.12 -1.34 -0.30 0.00 -1.72 0.00 0.00 55.73 52.26 2jch s ARG 456 Cb -0.16 -0.29 -0.11 0.00 -0.45 0.00 0.00 34.95 33.94 2jch s ARG 456 CO 0.03 0.00 1.54 0.45 -0.68 0.00 0.00 175.30 176.64 2jch s SER 457 N -3.02 6.43 0.23 0.23 0.15 -1.24 0.37 113.70 116.85 2jch s SER 457 Ca 0.12 2.90 0.25 0.00 0.70 0.00 0.00 55.95 59.92 2jch s SER 457 Cb 0.04 -2.64 0.90 0.00 -1.71 0.00 0.00 66.02 62.61 2jch s SER 457 CO -0.04 -0.86 1.75 -0.81 1.20 0.00 0.00 173.24 174.49 2jch n PRO 458 N 1.93 0.23 0.00 5.44 -0.04 -1.26 -4.90 135.00 136.39 2jch n PRO 458 Ca 0.07 0.32 0.00 0.00 -0.04 0.00 0.00 63.50 63.84 2jch n PRO 458 Cb 0.38 -1.84 0.00 0.00 -0.04 0.00 0.00 33.50 32.00 2jch n PRO 458 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2jch n ALA 459 N -1.78 0.00 0.39 0.55 0.00 -1.25 -2.72 120.51 115.70 2jch n ALA 459 Ca 0.04 0.00 0.11 0.00 0.00 0.00 0.00 53.44 53.59 2jch n ALA 459 Cb 0.33 0.00 0.47 0.00 0.00 0.00 0.00 19.45 20.25 2jch n ALA 459 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 2jch n SER 460 N 3.73 0.57 0.00 0.00 7.64 -1.23 -2.19 113.62 122.13 2jch n SER 460 Ca 0.00 0.65 0.07 0.00 1.01 0.00 0.00 58.87 60.60 2jch n SER 460 Cb 0.00 -0.76 0.39 0.00 -1.01 0.00 0.00 64.21 62.82 2jch n SER 460 CO 0.00 0.00 0.00 0.35 -3.01 0.00 0.00 175.04 172.38 2jch n THR 461 N -2.13 0.52 0.10 0.44 -2.24 -1.10 -1.95 114.28 107.92 2jch n THR 461 Ca 0.02 0.13 -0.03 0.00 -2.27 0.00 0.00 64.05 61.90 2jch n THR 461 Cb 0.21 -0.88 0.19 0.00 -2.10 0.00 0.00 70.33 67.75 2jch n THR 461 CO 0.00 0.00 0.00 0.74 -0.57 0.00 0.00 175.07 175.24 2jch h THR 462 N 0.00 1.35 -0.57 4.28 2.02 -1.60 -3.39 112.91 115.00 2jch h THR 462 Ca 0.00 -1.76 0.04 0.00 0.77 0.00 0.00 66.41 65.46 2jch h THR 462 Cb 0.13 1.87 -0.04 0.00 -1.74 0.00 0.00 68.15 68.36 2jch h THR 462 CO 0.00 0.52 0.32 0.11 0.37 0.00 0.00 175.52 176.84 2jch h LYS 463 N 0.15 0.61 -0.02 6.66 1.57 -1.40 -1.04 116.57 123.11 2jch h LYS 463 Ca 0.00 -0.04 -0.05 0.00 -1.87 0.00 0.00 60.65 58.70 2jch h LYS 463 Cb 0.95 -0.14 -0.01 0.00 0.08 0.00 0.00 32.23 33.12 2jch h LYS 463 CO 0.08 0.40 -0.23 -1.35 -0.57 0.00 0.00 179.45 177.77 2jch h PRO 464 N 0.63 0.03 0.00 3.15 0.11 -1.80 -1.00 132.00 133.12 2jch h PRO 464 Ca 0.24 -0.01 -0.01 0.00 0.11 0.00 0.00 66.00 66.34 2jch h PRO 464 Cb 0.09 -0.00 -0.00 0.00 0.11 0.00 0.00 31.00 31.19 2jch h PRO 464 CO -0.13 0.26 -0.04 -0.07 -0.21 0.00 0.00 178.00 177.81 2jch h LEU 465 N 0.02 0.00 0.06 2.35 3.38 -1.69 0.10 115.31 119.53 2jch h LEU 465 Ca 0.00 -0.59 -0.32 0.00 0.09 0.00 0.00 57.88 57.06 2jch h LEU 465 Cb 0.43 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.15 2jch h LEU 465 CO 0.03 0.82 -1.80 0.25 0.09 0.00 0.00 178.44 177.83 2jch h LEU 466 N -1.00 0.20 0.00 1.67 6.46 -1.26 -3.36 115.31 118.02 2jch h LEU 466 Ca -0.01 -0.43 0.00 0.00 -0.12 0.00 0.00 57.88 57.32 2jch h LEU 466 Cb 0.62 -0.07 0.00 0.00 -0.73 0.00 0.00 40.66 40.48 2jch h LEU 466 CO -0.00 1.39 0.00 0.00 -0.62 0.00 0.00 178.44 179.20 2jch n ALA 467 N -2.74 0.51 -0.13 1.25 0.00 -0.46 -4.65 120.51 114.29 2jch n ALA 467 Ca -0.23 -0.06 -0.09 0.00 0.00 0.00 0.00 53.44 53.07 2jch n ALA 467 Cb 1.05 0.00 -0.01 0.00 0.00 0.00 0.00 19.45 20.49 2jch n ALA 467 CO 0.00 0.00 0.00 1.88 0.00 0.00 0.00 177.50 179.38 2jch h TYR 468 N 0.00 0.55 -0.65 0.00 0.05 -1.54 -1.08 116.97 114.31 2jch h TYR 468 Ca 0.00 -0.02 -0.04 0.00 0.05 0.00 0.00 58.73 58.72 2jch h TYR 468 Cb 0.00 -0.17 -0.03 0.00 1.01 0.00 0.00 36.73 37.54 2jch h TYR 468 CO 0.00 0.45 0.25 0.78 -1.05 0.00 0.00 178.16 178.58 2jch h GLY 469 N 0.49 1.06 1.32 3.88 0.00 -0.96 -2.29 103.07 106.58 2jch h GLY 469 Ca 0.14 -0.59 -0.14 0.00 0.00 0.00 0.00 47.33 46.73 2jch h GLY 469 CO -0.02 0.55 -0.39 -2.22 0.00 0.00 0.00 176.54 174.47 2jch h ILE 470 N 0.92 1.29 -0.15 2.60 2.04 -1.69 -0.48 117.51 122.04 2jch h ILE 470 Ca 0.21 -1.56 -0.02 0.00 1.00 0.00 0.00 64.86 64.50 2jch h ILE 470 Cb 0.23 1.46 -0.01 0.00 -0.74 0.00 0.00 36.82 37.77 2jch h ILE 470 CO -0.01 0.51 0.03 0.00 0.00 0.00 0.00 178.15 178.67 2jch h ALA 471 N 0.95 0.19 -0.37 1.87 0.00 -0.87 0.21 119.26 121.25 2jch h ALA 471 Ca 0.05 -0.16 0.08 0.00 0.00 0.00 0.00 54.91 54.88 2jch h ALA 471 Cb 0.93 -0.06 -0.08 0.00 0.00 0.00 0.00 17.79 18.59 2jch h ALA 471 CO 0.09 -0.15 -0.21 0.82 0.00 0.00 0.00 179.25 179.79 2jch h ILE 472 N 0.02 0.41 -0.48 0.00 2.04 -1.48 0.36 117.51 118.38 2jch h ILE 472 Ca 0.04 0.00 -0.05 0.00 1.00 0.00 0.00 64.86 65.85 2jch h ILE 472 Cb 0.29 0.41 -0.02 0.00 -0.74 0.00 0.00 36.82 36.76 2jch h ILE 472 CO 0.00 0.00 0.08 -0.78 0.00 0.00 0.00 178.15 177.45 2jch h ASP 473 N -0.15 0.70 0.00 1.72 3.58 -0.79 0.03 116.42 121.50 2jch h ASP 473 Ca 0.18 -0.13 0.00 0.00 0.42 0.00 0.00 57.03 57.50 2jch h ASP 473 Cb 0.44 -0.18 0.00 0.00 1.72 0.00 0.00 39.33 41.30 2jch h ASP 473 CO -0.46 0.72 0.00 0.00 -2.88 0.00 0.00 179.24 176.62 2jch n GLN 474 N -4.27 0.95 -2.35 0.28 1.13 0.73 -4.87 117.38 108.98 2jch n GLN 474 Ca 0.03 0.00 -0.14 0.00 -1.94 0.00 0.00 57.00 54.95 2jch n GLN 474 Cb 0.24 -1.28 -0.00 0.00 0.11 0.00 0.00 30.24 29.31 2jch n GLN 474 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 2jch n GLY 475 N 0.70 -0.19 0.11 1.08 0.00 -0.00 -4.96 105.19 101.93 2jch n GLY 475 Ca 0.13 -0.28 0.10 0.00 0.00 0.00 0.00 46.02 45.97 2jch n GLY 475 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2jch n LEU 476 N -2.14 1.23 -3.78 0.99 4.77 0.12 -4.90 117.00 113.29 2jch n LEU 476 Ca -0.15 -0.56 -0.09 0.00 -0.03 0.00 0.00 56.01 55.18 2jch n LEU 476 Cb 0.62 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.67 2jch n LEU 476 CO 0.21 0.28 0.31 0.00 -1.33 0.00 0.00 177.39 176.86 2jch s MET 477 N -2.86 1.48 0.35 3.23 0.23 -1.22 -4.91 119.30 115.60 2jch s MET 477 Ca 0.10 -0.92 0.04 0.00 -1.03 0.00 0.00 55.69 53.88 2jch s MET 477 Cb 0.16 0.54 -0.01 0.00 -1.53 0.00 0.00 34.83 33.99 2jch s MET 477 CO 0.79 -0.64 0.14 0.41 -2.03 0.00 0.00 175.02 173.69 2jch n GLY 478 N -0.37 3.31 0.49 3.16 0.00 -1.26 -4.20 105.19 106.31 2jch n GLY 478 Ca -0.08 -2.07 0.31 0.00 0.00 0.00 0.00 46.02 44.18 2jch n GLY 478 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 2jch h SER 479 N 1.48 0.07 0.00 1.61 4.64 -0.49 -2.61 113.55 118.24 2jch h SER 479 Ca -0.27 0.01 0.00 0.00 -0.47 0.00 0.00 61.79 61.06 2jch h SER 479 Cb 1.07 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.16 2jch h SER 479 CO 0.43 0.02 -0.00 -0.62 -0.87 0.00 0.00 176.83 175.78 2jch n GLU 480 N -4.28 2.69 -1.58 4.77 -0.58 -1.26 -4.07 120.64 116.32 2jch n GLU 480 Ca 0.23 -1.53 -0.43 0.00 -0.42 0.00 0.00 57.16 55.00 2jch n GLU 480 Cb 1.08 -1.01 -0.01 0.00 -0.57 0.00 0.00 31.44 30.93 2jch n GLU 480 CO 0.00 0.00 0.00 2.41 -0.48 0.00 0.00 177.13 179.06 2jch n THR 481 N -0.54 2.09 -3.77 2.62 -1.04 -0.99 -4.34 114.28 108.31 2jch n THR 481 Ca 0.01 -0.50 -0.36 0.00 -2.04 0.00 0.00 64.05 61.17 2jch n THR 481 Cb 0.30 -1.00 -0.06 0.00 -1.82 0.00 0.00 70.33 67.76 2jch n THR 481 CO 0.00 0.00 0.00 -0.63 -0.64 0.00 0.00 175.07 173.80 2jch s ILE 482 N -1.16 5.33 0.12 12.58 -1.09 -1.26 -1.57 121.20 134.16 2jch s ILE 482 Ca 0.60 0.25 0.06 0.00 -2.23 0.00 0.00 60.65 59.32 2jch s ILE 482 Cb -0.65 -3.54 -0.04 0.00 -1.58 0.00 0.00 42.46 36.65 2jch s ILE 482 CO 0.59 0.46 -0.14 -0.76 -1.23 0.00 0.00 174.94 173.86 2jch s LEU 483 N -1.48 2.41 0.12 2.97 1.02 0.73 -1.97 118.68 122.49 2jch s LEU 483 Ca 0.23 -0.82 -0.30 0.00 0.02 0.00 0.00 54.13 53.27 2jch s LEU 483 Cb -0.13 -0.53 -0.07 0.00 0.02 0.00 0.00 46.19 45.48 2jch s LEU 483 CO 0.12 -0.16 1.13 -0.55 0.02 0.00 0.00 176.35 176.92 2jch s SER 484 N -2.48 7.19 -0.04 2.29 0.15 0.15 -1.83 113.70 119.13 2jch s SER 484 Ca 0.09 2.04 0.06 0.00 0.70 0.00 0.00 55.95 58.84 2jch s SER 484 Cb -0.05 -2.59 0.09 0.00 -1.71 0.00 0.00 66.02 61.77 2jch s SER 484 CO 0.03 -0.32 1.02 -3.20 1.20 0.00 0.00 173.24 171.97 2jch n ASN 485 N 3.07 1.95 -4.75 5.45 4.05 0.27 -3.08 115.26 122.23 2jch n ASN 485 Ca 0.05 -2.30 -0.39 0.00 0.45 0.00 0.00 54.58 52.39 2jch n ASN 485 Cb 0.47 -0.15 0.03 0.00 1.23 0.00 0.00 39.78 41.36 2jch n ASN 485 CO 0.00 0.00 0.00 -1.22 -3.05 0.00 0.00 177.26 172.99 2jch n TYR 486 N -0.77 2.46 -1.49 1.20 4.02 -1.23 -0.01 117.16 121.34 2jch n TYR 486 Ca 0.05 0.43 -0.44 0.00 -0.01 0.00 0.00 57.90 57.93 2jch n TYR 486 Cb 0.40 -2.40 -0.01 0.00 -0.02 0.00 0.00 39.34 37.31 2jch n TYR 486 CO 0.00 0.00 0.00 -2.30 -1.01 0.00 0.00 176.86 173.55 2jch n PRO 487 N -0.73 0.74 -3.61 -0.72 -0.02 -1.22 -4.83 135.00 124.60 2jch n PRO 487 Ca 0.09 0.26 -0.09 0.00 -2.02 0.00 0.00 63.50 61.73 2jch n PRO 487 Cb 0.43 -1.52 -0.02 0.00 -0.02 0.00 0.00 33.50 32.37 2jch n PRO 487 CO 0.00 0.00 0.00 -0.08 1.98 0.00 0.00 175.50 177.40 2jch s THR 488 N -1.22 0.00 0.09 3.45 -1.32 -1.26 -4.99 115.64 110.39 2jch s THR 488 Ca 0.62 -0.42 0.08 0.00 -1.21 0.00 0.00 61.69 60.76 2jch s THR 488 Cb -0.71 -1.44 -0.03 0.00 -1.51 0.00 0.00 72.50 68.81 2jch s THR 488 CO 0.58 0.00 -0.21 0.20 -2.21 0.00 0.00 174.62 172.98 2jch s ASN 489 N -2.81 2.60 1.12 8.08 0.01 -1.26 -2.29 114.94 120.39 2jch s ASN 489 Ca 0.06 -0.65 -0.13 0.00 -0.71 0.00 0.00 52.86 51.43 2jch s ASN 489 Cb -0.03 -0.16 0.26 0.00 0.41 0.00 0.00 41.25 41.73 2jch s ASN 489 CO -0.04 0.10 1.05 -0.36 -1.51 0.00 0.00 177.10 176.33 2jch s PHE 490 N -1.06 1.51 0.47 2.20 0.08 0.08 -4.88 117.98 116.38 2jch s PHE 490 Ca 0.07 1.18 0.21 0.00 0.12 0.00 0.00 56.93 58.52 2jch s PHE 490 Cb -0.10 -3.14 1.29 0.00 -0.57 0.00 0.00 43.02 40.51 2jch s PHE 490 CO 0.04 -3.64 2.08 0.00 -0.10 0.00 0.00 175.22 173.60 2jch h ALA 491 N -2.45 1.59 0.00 5.36 0.00 -2.01 0.51 119.26 122.26 2jch h ALA 491 Ca -0.59 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.21 2jch h ALA 491 Cb 1.33 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.10 2jch h ALA 491 CO 0.51 0.14 0.00 0.27 0.00 0.00 0.00 179.25 180.17 2jch n ASN 492 N -4.08 0.00 0.00 0.00 0.23 -1.26 -4.94 115.26 105.21 2jch n ASN 492 Ca -0.02 -0.23 0.00 0.00 -0.53 0.00 0.00 54.58 53.79 2jch n ASN 492 Cb 0.20 -0.22 0.00 0.00 -2.08 0.00 0.00 39.78 37.68 2jch n ASN 492 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 2jch n GLY 493 N 0.72 2.38 3.78 4.83 0.00 0.17 -5.06 105.19 112.01 2jch n GLY 493 Ca 0.13 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.74 2jch n GLY 493 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2jch s ASN 494 N -3.25 6.39 0.42 1.61 0.02 -1.26 -4.73 114.94 114.14 2jch s ASN 494 Ca 0.00 3.00 -0.26 0.00 -1.02 0.00 0.00 52.86 54.59 2jch s ASN 494 Cb 0.00 -2.66 -0.08 0.00 0.02 0.00 0.00 41.25 38.52 2jch s ASN 494 CO 0.00 -0.84 1.29 -2.16 0.02 0.00 0.00 177.10 175.41 2jch s PRO 495 N -1.97 3.92 -0.33 -0.60 0.04 -1.26 -0.74 135.00 134.05 2jch s PRO 495 Ca 0.53 2.12 -0.29 0.00 0.04 0.00 0.00 61.00 63.40 2jch s PRO 495 Cb -0.46 -2.71 0.01 0.00 0.04 0.00 0.00 34.50 31.39 2jch s PRO 495 CO 0.61 -0.52 1.15 0.42 0.04 0.00 0.00 177.00 178.70 2jch s ILE 496 N -1.29 4.35 0.08 0.56 1.01 -0.97 -4.80 121.20 120.15 2jch s ILE 496 Ca 0.58 1.53 0.03 0.00 0.00 0.00 0.00 60.65 62.79 2jch s ILE 496 Cb -0.37 -4.36 -0.04 0.00 0.01 0.00 0.00 42.46 37.70 2jch s ILE 496 CO 0.47 -0.55 0.09 -0.04 0.00 0.00 0.00 174.94 174.92 2jch s MET 497 N 3.92 2.93 -0.46 2.79 -1.94 -1.26 -4.67 119.30 120.60 2jch s MET 497 Ca 0.49 -0.68 0.03 0.00 -1.71 0.00 0.00 55.69 53.81 2jch s MET 497 Cb -0.13 -2.75 0.13 0.00 2.01 0.00 0.00 34.83 34.10 2jch s MET 497 CO 0.20 0.56 0.23 -0.47 -0.01 0.00 0.00 175.02 175.54 2jch s TYR 498 N -1.43 2.50 0.00 -0.03 5.04 0.30 -4.81 117.35 118.93 2jch s TYR 498 Ca 0.30 -2.71 0.00 0.00 -2.44 0.00 0.00 57.07 52.21 2jch s TYR 498 Cb -0.12 -2.28 0.00 0.00 0.35 0.00 0.00 41.96 39.91 2jch s TYR 498 CO 0.23 -0.78 0.00 0.00 -1.34 0.00 0.00 175.55 173.66 2jch n ALA 499 N 3.45 0.00 1.10 3.97 0.00 -1.26 -1.83 120.51 125.93 2jch n ALA 499 Ca 0.07 0.00 0.12 0.00 0.00 0.00 0.00 53.44 53.62 2jch n ALA 499 Cb 0.34 0.00 0.15 0.00 0.00 0.00 0.00 19.45 19.94 2jch n ALA 499 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 2jch n ASN 500 N 8.55 1.44 -4.83 0.00 3.02 -1.26 -4.95 115.26 117.24 2jch n ASN 500 Ca 0.00 -1.14 -0.36 0.00 -0.03 0.00 0.00 54.58 53.05 2jch n ASN 500 Cb 0.00 0.38 -0.06 0.00 -0.61 0.00 0.00 39.78 39.49 2jch n ASN 500 CO 0.00 0.00 0.00 -0.55 -2.62 0.00 0.00 177.26 174.09 2jch s SER 501 N -2.57 6.95 0.00 6.41 0.15 -0.76 -5.01 113.70 118.87 2jch s SER 501 Ca 0.19 1.25 0.24 0.00 0.70 0.00 0.00 55.95 58.34 2jch s SER 501 Cb 0.18 -2.36 0.48 0.00 -1.71 0.00 0.00 66.02 62.62 2jch s SER 501 CO 0.59 0.08 1.42 0.29 1.20 0.00 0.00 173.24 176.82 2jch n LYS 502 N 0.82 2.17 0.00 5.44 5.02 -1.26 -0.54 118.16 129.81 2jch n LYS 502 Ca -0.04 -1.72 0.00 0.00 -2.02 0.00 0.00 58.31 54.53 2jch n LYS 502 Cb 0.51 -1.47 0.00 0.00 -0.02 0.00 0.00 35.03 34.05 2jch n LYS 502 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2jch n GLY 503 N 1.33 1.01 0.00 0.72 0.00 -1.26 -3.41 105.19 103.58 2jch n GLY 503 Ca 0.17 -1.99 0.00 0.00 0.00 0.00 0.00 46.02 44.19 2jch n GLY 503 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2jch n THR 504 N -1.48 0.00 -2.10 2.61 -2.24 0.99 -4.79 114.28 107.26 2jch n THR 504 Ca 0.00 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.78 2jch n THR 504 Cb 0.00 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.23 2jch n THR 504 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2jch n GLY 505 N 0.52 4.86 3.77 3.38 0.00 -1.26 -3.87 105.19 112.59 2jch n GLY 505 Ca 0.00 -1.08 -0.40 0.00 0.00 0.00 0.00 46.02 44.54 2jch n GLY 505 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2jch s MET 506 N 1.66 3.95 0.01 1.61 -1.94 -1.26 -0.56 119.30 122.77 2jch s MET 506 Ca 0.00 2.28 -0.19 0.00 -1.71 0.00 0.00 55.69 56.07 2jch s MET 506 Cb 0.00 -2.79 0.04 0.00 2.01 0.00 0.00 34.83 34.09 2jch s MET 506 CO 0.00 -0.55 0.41 0.00 -0.01 0.00 0.00 175.02 174.88 2jch s MET 507 N -2.23 0.86 0.98 2.03 0.00 -0.76 -4.89 119.30 115.29 2jch s MET 507 Ca 0.57 -0.23 -0.12 0.00 0.00 0.00 0.00 55.69 55.91 2jch s MET 507 Cb -0.41 0.39 0.18 0.00 0.00 0.00 0.00 34.83 34.99 2jch s MET 507 CO 0.53 -0.27 1.08 0.95 0.00 0.00 0.00 175.02 177.31 2jch s THR 508 N -1.94 2.34 0.30 3.16 -4.23 -1.26 -0.19 115.64 113.82 2jch s THR 508 Ca -0.09 0.11 -0.01 0.00 -1.18 0.00 0.00 61.69 60.52 2jch s THR 508 Cb -0.02 -2.43 0.25 0.00 1.34 0.00 0.00 72.50 71.64 2jch s THR 508 CO 0.01 -0.14 1.96 0.25 -0.54 0.00 0.00 174.62 176.16 2jch h LEU 509 N -1.92 0.89 -0.67 4.79 5.85 -1.45 -1.90 115.31 120.91 2jch h LEU 509 Ca -0.52 -0.04 0.13 0.00 0.84 0.00 0.00 57.88 58.29 2jch h LEU 509 Cb 1.30 -0.22 -0.10 0.00 0.37 0.00 0.00 40.66 42.01 2jch h LEU 509 CO 0.52 0.67 0.17 1.23 -0.34 0.00 0.00 178.44 180.69 2jch h GLY 510 N 1.05 0.90 1.39 3.75 0.00 -1.88 -1.54 103.07 106.74 2jch h GLY 510 Ca 0.27 -0.05 -0.29 0.00 0.00 0.00 0.00 47.33 47.27 2jch h GLY 510 CO -0.05 -0.14 -1.24 -2.09 0.00 0.00 0.00 176.54 173.01 2jch h GLU 511 N 0.29 0.49 0.19 4.80 4.81 -1.73 -1.91 114.58 121.52 2jch h GLU 511 Ca 0.36 -0.70 0.01 0.00 -0.13 0.00 0.00 59.36 58.90 2jch h GLU 511 Cb 0.57 0.24 -0.04 0.00 0.63 0.00 0.00 28.75 30.15 2jch h GLU 511 CO -0.44 1.31 -0.43 0.00 -0.73 0.00 0.00 179.01 178.72 2jch h ALA 512 N 0.41 -0.81 -0.85 2.92 0.00 -1.19 -2.94 119.26 116.80 2jch h ALA 512 Ca -0.17 -0.10 0.06 0.00 0.00 0.00 0.00 54.91 54.70 2jch h ALA 512 Cb 1.93 0.70 -0.06 0.00 0.00 0.00 0.00 17.79 20.35 2jch h ALA 512 CO 0.23 -1.02 0.53 -0.07 0.00 0.00 0.00 179.25 178.92 2jch h LEU 513 N -0.71 0.84 -1.27 0.00 3.38 -1.34 0.70 115.31 116.90 2jch h LEU 513 Ca 0.01 0.01 -0.05 0.00 0.09 0.00 0.00 57.88 57.94 2jch h LEU 513 Cb 0.71 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 41.28 2jch h LEU 513 CO -0.21 0.54 -0.04 0.78 0.09 0.00 0.00 178.44 179.60 2jch h ASN 514 N 0.97 0.42 0.00 -0.43 -0.26 -1.29 -3.15 115.58 111.85 2jch h ASN 514 Ca 0.37 -0.08 -0.16 0.00 -0.56 0.00 0.00 56.30 55.87 2jch h ASN 514 Cb 0.15 -0.11 -0.03 0.00 -1.06 0.00 0.00 38.32 37.27 2jch h ASN 514 CO -0.16 0.52 -2.02 -1.22 -1.06 0.00 0.00 177.43 173.48 2jch n TYR 515 N -4.28 0.00 -2.35 1.19 4.02 -1.12 -4.08 117.16 110.55 2jch n TYR 515 Ca 0.01 0.00 -0.09 0.00 -0.01 0.00 0.00 57.90 57.81 2jch n TYR 515 Cb 0.25 -0.64 0.00 0.00 -0.02 0.00 0.00 39.34 38.94 2jch n TYR 515 CO 0.00 0.00 0.00 0.45 -1.01 0.00 0.00 176.86 176.30 2jch n SER 516 N -2.39 -3.25 -4.61 7.72 2.88 0.24 -4.96 113.62 109.24 2jch n SER 516 Ca -0.16 -0.06 -0.43 0.00 -1.33 0.00 0.00 58.87 56.90 2jch n SER 516 Cb 0.77 -2.38 -0.00 0.00 -0.75 0.00 0.00 64.21 61.86 2jch n SER 516 CO 0.00 0.00 0.00 0.79 -1.23 0.00 0.00 175.04 174.60 2jch n TRP 517 N -3.91 1.34 -0.03 0.66 7.02 -0.97 -4.94 117.44 116.61 2jch n TRP 517 Ca -0.08 0.61 -0.17 0.00 -1.02 0.00 0.00 57.50 56.84 2jch n TRP 517 Cb 0.57 -2.26 -0.14 0.00 -2.42 0.00 0.00 31.31 27.06 2jch n TRP 517 CO 0.00 0.00 0.00 0.09 -2.02 0.00 0.00 177.69 175.76 2jch n ASN 518 N 0.80 1.64 -0.08 -0.99 3.02 -1.26 -4.36 115.26 114.03 2jch n ASN 518 Ca 0.09 0.17 -0.09 0.00 -0.03 0.00 0.00 54.58 54.72 2jch n ASN 518 Cb 0.36 -0.44 -0.01 0.00 -0.61 0.00 0.00 39.78 39.08 2jch n ASN 518 CO 0.00 0.00 0.00 0.40 -2.62 0.00 0.00 177.26 175.04 2jch h ILE 519 N 0.04 1.04 -0.04 2.41 2.04 -1.89 -1.27 117.51 119.84 2jch h ILE 519 Ca -0.43 -0.12 0.01 0.00 1.00 0.00 0.00 64.86 65.31 2jch h ILE 519 Cb 2.02 0.65 -0.00 0.00 -0.74 0.00 0.00 36.82 38.75 2jch h ILE 519 CO 0.05 0.07 0.06 -0.65 0.00 0.00 0.00 178.15 177.67 2jch h PRO 520 N 0.36 0.00 0.18 2.37 0.11 -1.74 -2.33 132.00 130.94 2jch h PRO 520 Ca 0.11 0.00 -0.31 0.00 0.11 0.00 0.00 66.00 65.91 2jch h PRO 520 Cb -0.01 0.00 0.01 0.00 0.11 0.00 0.00 31.00 31.11 2jch h PRO 520 CO -0.05 0.00 -1.42 0.00 -0.21 0.00 0.00 178.00 176.32 2jch h ALA 521 N 1.92 0.04 -0.58 -0.75 0.00 -1.52 -2.05 119.26 116.32 2jch h ALA 521 Ca 0.02 -0.94 0.11 0.00 0.00 0.00 0.00 54.91 54.10 2jch h ALA 521 Cb 0.13 0.15 -0.11 0.00 0.00 0.00 0.00 17.79 17.96 2jch h ALA 521 CO -0.00 0.91 -0.22 -0.92 0.00 0.00 0.00 179.25 179.02 2jch h TYR 522 N 0.10 -0.54 -0.38 0.00 3.20 -0.78 -2.14 116.97 116.43 2jch h TYR 522 Ca -0.21 0.06 -0.12 0.00 3.14 0.00 0.00 58.73 61.60 2jch h TYR 522 Cb 2.06 0.33 -0.01 0.00 1.54 0.00 0.00 36.73 40.64 2jch h TYR 522 CO 0.09 -0.31 -0.25 -1.49 -1.64 0.00 0.00 178.16 174.56 2jch h TRP 523 N -0.08 0.88 -0.35 -3.82 -0.00 -1.49 -2.17 115.95 108.92 2jch h TRP 523 Ca 0.27 -0.21 -0.02 0.00 -0.00 0.00 0.00 58.89 58.93 2jch h TRP 523 Cb 0.49 -0.21 -0.02 0.00 -0.00 0.00 0.00 29.16 29.43 2jch h TRP 523 CO -0.54 0.94 0.15 1.15 -0.00 0.00 0.00 178.44 180.14 2jch h THR 524 N 0.67 1.18 -0.23 1.49 2.02 -1.31 0.14 112.91 116.86 2jch h THR 524 Ca 0.09 -0.53 -0.16 0.00 0.77 0.00 0.00 66.41 66.58 2jch h THR 524 Cb 0.76 0.87 -0.01 0.00 -1.74 0.00 0.00 68.15 68.04 2jch h THR 524 CO 0.06 0.19 -0.50 0.22 0.37 0.00 0.00 175.52 175.87 2jch h TYR 525 N 0.43 0.79 -0.61 3.16 3.20 -1.35 -1.39 116.97 121.19 2jch h TYR 525 Ca 0.12 -0.26 0.05 0.00 3.14 0.00 0.00 58.73 61.77 2jch h TYR 525 Cb 0.16 -0.16 -0.05 0.00 1.54 0.00 0.00 36.73 38.22 2jch h TYR 525 CO -0.01 1.01 0.35 -0.09 -1.64 0.00 0.00 178.16 177.78 2jch h ARG 526 N 0.51 0.64 -0.18 1.82 2.43 -1.38 -0.68 114.38 117.54 2jch h ARG 526 Ca 0.02 -0.04 -0.02 0.00 -0.81 0.00 0.00 59.98 59.13 2jch h ARG 526 Cb 1.04 -0.14 -0.01 0.00 -0.42 0.00 0.00 29.97 30.44 2jch h ARG 526 CO 0.10 0.42 0.01 1.98 -1.51 0.00 0.00 179.97 180.97 2jch h MET 527 N 0.66 0.25 -0.43 0.20 4.05 -0.84 -1.69 114.93 117.12 2jch h MET 527 Ca 0.26 -0.03 -0.14 0.00 -0.28 0.00 0.00 59.70 59.51 2jch h MET 527 Cb 0.12 -0.05 -0.01 0.00 -0.80 0.00 0.00 31.60 30.87 2jch h MET 527 CO -0.15 0.27 -0.29 -0.07 0.23 0.00 0.00 176.91 176.90 2jch h LEU 528 N 0.25 1.01 -0.66 3.39 3.38 -0.32 -2.87 115.31 119.49 2jch h LEU 528 Ca 0.06 -0.43 -0.11 0.00 0.09 0.00 0.00 57.88 57.50 2jch h LEU 528 Cb 0.16 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 40.61 2jch h LEU 528 CO 0.00 1.22 -0.10 0.03 0.09 0.00 0.00 178.44 179.68 2jch h ARG 529 N 0.80 0.94 0.00 1.13 3.08 -0.96 -2.41 114.38 116.96 2jch h ARG 529 Ca 0.09 -0.33 -0.01 0.00 0.07 0.00 0.00 59.98 59.80 2jch h ARG 529 Cb 0.87 -0.07 -0.00 0.00 0.08 0.00 0.00 29.97 30.86 2jch h ARG 529 CO 0.08 0.99 -0.02 0.93 -1.07 0.00 0.00 179.97 180.88 2jch h GLU 530 N 0.84 0.00 -0.31 0.04 5.08 -1.25 -1.83 114.58 117.16 2jch h GLU 530 Ca 0.14 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.50 2jch h GLU 530 Cb 0.64 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.89 2jch h GLU 530 CO 0.04 0.02 0.00 0.09 -1.00 0.00 0.00 179.01 178.17 2jch n ASN 531 N -3.74 2.61 -2.22 1.42 4.13 -1.09 -4.97 115.26 111.40 2jch n ASN 531 Ca -0.03 -1.88 -0.20 0.00 1.68 0.00 0.00 54.58 54.15 2jch n ASN 531 Cb 0.11 -0.20 -0.02 0.00 -1.54 0.00 0.00 39.78 38.14 2jch n ASN 531 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 2jch n GLY 532 N 1.32 -0.25 3.76 7.41 0.00 -0.69 -4.96 105.19 111.79 2jch n GLY 532 Ca 0.18 -0.04 -0.41 0.00 0.00 0.00 0.00 46.02 45.75 2jch n GLY 532 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2jch s VAL 533 N -2.98 3.28 -1.34 1.61 1.01 -0.92 -4.89 120.40 116.17 2jch s VAL 533 Ca 0.00 1.26 -0.16 0.00 0.00 0.00 0.00 61.98 63.07 2jch s VAL 533 Cb 0.00 -3.80 0.02 0.00 0.00 0.00 0.00 36.38 32.60 2jch s VAL 533 CO 0.00 0.29 2.06 -0.67 0.00 0.00 0.00 175.10 176.77 2jch n ASP 534 N 1.29 3.98 -0.25 3.32 2.03 -1.26 -4.76 116.55 120.89 2jch n ASP 534 Ca 0.00 -2.84 0.00 0.00 0.52 0.00 0.00 54.79 52.47 2jch n ASP 534 Cb 0.44 -1.63 0.22 0.00 -0.72 0.00 0.00 41.12 39.43 2jch n ASP 534 CO 0.00 0.00 0.00 0.58 -1.92 0.00 0.00 177.20 175.86 2jch h VAL 535 N 4.55 1.20 -0.25 5.18 2.07 -1.95 -2.54 116.25 124.51 2jch h VAL 535 Ca 0.51 -0.37 -0.12 0.00 0.82 0.00 0.00 66.70 67.54 2jch h VAL 535 Cb 0.71 0.02 -0.01 0.00 -1.52 0.00 0.00 31.29 30.49 2jch h VAL 535 CO 1.76 0.20 -0.34 0.50 0.02 0.00 0.00 177.57 179.71 2jch h LYS 536 N 1.09 0.54 -0.48 1.57 3.64 -2.00 -2.57 116.57 118.36 2jch h LYS 536 Ca 0.30 -0.25 0.10 0.00 -1.27 0.00 0.00 60.65 59.53 2jch h LYS 536 Cb -0.12 -0.01 -0.09 0.00 -0.41 0.00 0.00 32.23 31.60 2jch h LYS 536 CO -0.06 0.81 -0.08 0.78 -2.27 0.00 0.00 179.45 178.62 2jch h GLY 537 N 1.05 0.39 0.76 5.01 0.00 -1.86 -1.32 103.07 107.11 2jch h GLY 537 Ca 0.05 0.13 -0.01 0.00 0.00 0.00 0.00 47.33 47.51 2jch h GLY 537 CO 0.07 -0.17 -0.29 -0.97 0.00 0.00 0.00 176.54 175.17 2jch h TYR 538 N 0.03 -0.77 -0.55 5.60 0.05 -1.44 -2.90 116.97 116.98 2jch h TYR 538 Ca 0.24 -0.00 0.02 0.00 0.05 0.00 0.00 58.73 59.03 2jch h TYR 538 Cb 0.36 0.29 -0.03 0.00 1.01 0.00 0.00 36.73 38.36 2jch h TYR 538 CO -0.38 -0.43 0.37 0.52 -1.05 0.00 0.00 178.16 177.18 2jch h MET 539 N -0.66 0.68 0.00 4.88 2.86 -1.36 -2.75 114.93 118.58 2jch h MET 539 Ca -0.03 -0.04 -0.06 0.00 -2.06 0.00 0.00 59.70 57.51 2jch h MET 539 Cb 0.57 -0.15 -0.01 0.00 0.06 0.00 0.00 31.60 32.07 2jch h MET 539 CO -0.01 0.45 -0.28 0.93 1.06 0.00 0.00 176.91 179.06 2jch h GLU 540 N 0.70 0.00 0.00 1.72 5.08 -1.16 0.56 114.58 121.48 2jch h GLU 540 Ca 0.21 0.00 -0.06 0.00 -1.00 0.00 0.00 59.36 58.51 2jch h GLU 540 Cb -0.01 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.23 2jch h GLU 540 CO -0.05 0.28 -0.28 0.87 -1.00 0.00 0.00 179.01 178.83 2jch h LYS 541 N 0.00 0.00 -0.46 2.33 1.57 -1.28 -2.58 116.57 116.14 2jch h LYS 541 Ca -0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 2jch h LYS 541 Cb 0.98 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.29 2jch h LYS 541 CO 0.04 0.28 0.00 -1.33 -0.57 0.00 0.00 179.45 177.87 2jch n MET 542 N -4.06 2.17 -0.87 3.15 2.81 -1.13 -4.96 117.12 114.22 2jch n MET 542 Ca -0.02 -1.80 0.00 0.00 -1.81 0.00 0.00 57.70 54.07 2jch n MET 542 Cb 0.34 -1.41 0.00 0.00 -0.71 0.00 0.00 33.22 31.44 2jch n MET 542 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2jch n GLY 543 N 1.31 0.46 3.69 3.03 0.00 -0.97 -4.71 105.19 108.01 2jch n GLY 543 Ca 0.17 -0.91 -0.40 0.00 0.00 0.00 0.00 46.02 44.88 2jch n GLY 543 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2jch s TYR 544 N -2.00 3.49 -0.50 1.61 1.51 0.17 -4.99 117.35 116.65 2jch s TYR 544 Ca 0.00 1.14 -0.15 0.00 -1.01 0.00 0.00 57.07 57.05 2jch s TYR 544 Cb 0.00 -2.82 0.10 0.00 -0.11 0.00 0.00 41.96 39.13 2jch s TYR 544 CO 0.00 -0.03 0.43 -1.21 -1.11 0.00 0.00 175.55 173.63 2jch s GLU 545 N 1.31 2.95 -0.21 -0.62 2.02 -1.26 -4.13 118.70 118.74 2jch s GLU 545 Ca 0.35 -1.53 -0.01 0.00 0.02 0.00 0.00 54.97 53.79 2jch s GLU 545 Cb -0.17 -4.18 0.01 0.00 0.10 0.00 0.00 34.13 29.89 2jch s GLU 545 CO 0.15 -1.17 -0.11 0.42 0.02 0.00 0.00 175.26 174.57 2jch s ILE 546 N 1.60 2.73 0.26 -1.63 1.01 -1.26 -4.85 121.20 119.07 2jch s ILE 546 Ca 0.04 -0.82 0.21 0.00 0.00 0.00 0.00 60.65 60.07 2jch s ILE 546 Cb -0.27 -2.26 0.19 0.00 0.01 0.00 0.00 42.46 40.13 2jch s ILE 546 CO 0.04 0.40 1.85 1.55 0.00 0.00 0.00 174.94 178.79 2jch h PRO 547 N 8.02 0.00 -3.01 2.79 0.13 -1.97 -3.43 132.00 134.52 2jch h PRO 547 Ca -0.40 0.00 -0.32 0.00 -0.87 0.00 0.00 66.00 64.41 2jch h PRO 547 Cb 1.14 0.00 -0.37 0.00 0.13 0.00 0.00 31.00 31.90 2jch h PRO 547 CO 0.61 0.28 -0.65 -2.00 -0.23 0.00 0.00 178.00 176.01 2jch s GLU 548 N -3.87 0.05 0.04 0.86 2.56 -1.26 -5.00 118.70 112.07 2jch s GLU 548 Ca -0.01 0.43 0.24 0.00 0.00 0.00 0.00 54.97 55.63 2jch s GLU 548 Cb 0.12 -0.59 0.24 0.00 2.00 0.00 0.00 34.13 35.90 2jch s GLU 548 CO 0.66 -0.40 1.21 0.66 -0.56 0.00 0.00 175.26 176.82 2jch n TYR 549 N 5.32 0.18 -2.65 5.30 4.02 -1.26 -4.57 117.16 123.50 2jch n TYR 549 Ca -0.05 0.05 -0.43 0.00 -0.01 0.00 0.00 57.90 57.47 2jch n TYR 549 Cb 0.50 -0.35 0.01 0.00 -0.02 0.00 0.00 39.34 39.47 2jch n TYR 549 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 2jch n GLY 550 N 1.43 4.92 2.72 2.72 0.00 -1.26 -4.86 105.19 110.85 2jch n GLY 550 Ca 0.04 -2.35 -0.20 0.00 0.00 0.00 0.00 46.02 43.51 2jch n GLY 550 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2jch s ILE 551 N -1.00 -0.18 0.42 -0.61 1.01 -1.26 -5.07 121.20 114.51 2jch s ILE 551 Ca 0.36 0.19 0.23 0.00 0.00 0.00 0.00 60.65 61.43 2jch s ILE 551 Cb 0.07 -0.37 0.43 0.00 0.01 0.00 0.00 42.46 42.60 2jch s ILE 551 CO 0.05 0.01 1.72 -0.33 0.00 0.00 0.00 174.94 176.39 2jch h GLU 552 N 8.39 0.26 -0.69 2.79 5.08 -1.97 -1.92 114.58 126.53 2jch h GLU 552 Ca -0.14 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.21 2jch h GLU 552 Cb 1.13 -0.06 0.00 0.00 0.50 0.00 0.00 28.75 30.32 2jch h GLU 552 CO 0.20 0.17 0.00 -1.13 -1.00 0.00 0.00 179.01 177.25 2jch n SER 553 N -4.63 3.90 -0.24 1.42 3.41 -1.26 -4.56 113.62 111.66 2jch n SER 553 Ca 0.29 -2.03 0.03 0.00 -0.26 0.00 0.00 58.87 56.91 2jch n SER 553 Cb 1.08 -0.47 0.13 0.00 -0.26 0.00 0.00 64.21 64.69 2jch n SER 553 CO 0.00 0.00 0.00 0.25 -0.16 0.00 0.00 175.04 175.13 2jch h LEU 554 N 4.03 -0.34 -0.02 1.04 5.85 -1.49 -0.66 115.31 123.72 2jch h LEU 554 Ca 0.00 0.18 0.00 0.00 0.84 0.00 0.00 57.88 58.90 2jch h LEU 554 Cb 0.99 0.32 0.00 0.00 0.37 0.00 0.00 40.66 42.34 2jch h LEU 554 CO 0.01 -0.16 0.00 -0.81 -0.34 0.00 0.00 178.44 177.15 2jch n PRO 555 N -5.33 0.00 0.00 5.25 -0.04 -1.26 -1.03 135.00 132.59 2jch n PRO 555 Ca 0.12 0.32 0.12 0.00 -0.04 0.00 0.00 63.50 64.02 2jch n PRO 555 Cb 0.42 -1.51 0.24 0.00 -0.04 0.00 0.00 33.50 32.62 2jch n PRO 555 CO 0.00 0.00 0.00 -1.33 -0.04 0.00 0.00 175.50 174.13 2jch n MET 556 N -1.51 1.31 0.00 0.54 2.81 -0.27 -3.36 117.12 116.63 2jch n MET 556 Ca 0.03 -0.94 0.00 0.00 -1.81 0.00 0.00 57.70 54.98 2jch n MET 556 Cb 0.13 -1.48 0.00 0.00 -0.71 0.00 0.00 33.22 31.16 2jch n MET 556 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2jch n GLY 557 N 1.34 1.19 3.71 3.03 0.00 -0.20 -3.52 105.19 110.75 2jch n GLY 557 Ca 0.13 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.74 2jch n GLY 557 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2jch s GLY 558 N -2.00 2.69 0.00 -0.02 0.00 -1.10 -3.35 107.32 103.54 2jch s GLY 558 Ca 0.00 0.24 0.00 0.00 0.00 0.00 0.00 44.72 44.96 2jch s GLY 558 CO 0.00 1.33 0.00 0.61 0.00 0.00 0.00 173.10 175.04 2jch n GLY 559 N 3.06 0.54 2.88 0.20 0.00 -1.26 -4.09 105.19 106.51 2jch n GLY 559 Ca 0.01 -0.71 -0.18 0.00 0.00 0.00 0.00 46.02 45.14 2jch n GLY 559 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2jch s ILE 560 N -2.00 0.36 -0.01 -0.61 1.01 -1.21 -4.58 121.20 114.16 2jch s ILE 560 Ca 0.00 -0.06 0.01 0.00 0.00 0.00 0.00 60.65 60.60 2jch s ILE 560 Cb 0.00 -0.39 0.01 0.00 0.01 0.00 0.00 42.46 42.08 2jch s ILE 560 CO 0.00 0.17 -0.03 -1.83 0.00 0.00 0.00 174.94 173.25 2jch s GLU 561 N 0.71 0.30 0.07 2.79 -1.05 -1.26 -3.65 118.70 116.61 2jch s GLU 561 Ca -0.08 -0.08 0.02 0.00 -0.15 0.00 0.00 54.97 54.68 2jch s GLU 561 Cb -0.11 -0.33 -0.04 0.00 -0.44 0.00 0.00 34.13 33.21 2jch s GLU 561 CO -0.01 0.02 -0.06 0.14 0.95 0.00 0.00 175.26 176.30 2jch s VAL 562 N 0.21 0.58 0.64 1.83 -7.23 0.16 -4.72 120.40 111.86 2jch s VAL 562 Ca -0.02 -1.62 -0.12 0.00 -1.81 0.00 0.00 61.98 58.42 2jch s VAL 562 Cb -0.05 -1.28 -0.03 0.00 0.56 0.00 0.00 36.38 35.59 2jch s VAL 562 CO -0.00 -0.72 1.04 0.42 -0.31 0.00 0.00 175.10 175.53 2jch s THR 563 N -2.87 4.38 0.29 5.32 -4.23 -1.25 -0.88 115.64 116.41 2jch s THR 563 Ca 0.04 0.83 -0.02 0.00 -1.18 0.00 0.00 61.69 61.35 2jch s THR 563 Cb 0.00 -3.65 0.23 0.00 1.34 0.00 0.00 72.50 70.42 2jch s THR 563 CO -0.03 -0.96 1.93 0.58 -0.54 0.00 0.00 174.62 175.59 2jch h VAL 564 N -0.31 1.21 -0.24 2.29 2.07 -1.73 -1.69 116.25 117.85 2jch h VAL 564 Ca -0.44 -0.51 -0.05 0.00 0.82 0.00 0.00 66.70 66.52 2jch h VAL 564 Cb 1.20 0.20 -0.01 0.00 -1.52 0.00 0.00 31.29 31.16 2jch h VAL 564 CO 0.60 0.23 -0.04 0.00 0.02 0.00 0.00 177.57 178.38 2jch h ALA 565 N 1.44 0.33 -0.56 1.67 0.00 -1.66 0.79 119.26 121.27 2jch h ALA 565 Ca 0.26 -0.25 -0.09 0.00 0.00 0.00 0.00 54.91 54.83 2jch h ALA 565 Cb -0.00 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 17.68 2jch h ALA 565 CO -0.05 0.11 -0.02 0.37 0.00 0.00 0.00 179.25 179.66 2jch h GLN 566 N 0.20 0.99 -0.60 0.00 5.75 -1.84 -2.90 115.11 116.71 2jch h GLN 566 Ca 0.06 -0.31 -0.07 0.00 -0.15 0.00 0.00 58.65 58.18 2jch h GLN 566 Cb 0.49 -0.09 -0.02 0.00 1.07 0.00 0.00 27.48 28.93 2jch h GLN 566 CO 0.02 0.98 0.08 1.25 -2.65 0.00 0.00 178.83 178.52 2jch h HIS 567 N 0.90 1.03 -0.36 3.99 2.76 -0.99 -2.71 115.15 119.77 2jch h HIS 567 Ca 0.16 -0.13 0.02 0.00 -2.20 0.00 0.00 60.37 58.22 2jch h HIS 567 Cb 0.56 -0.29 -0.02 0.00 1.55 0.00 0.00 27.41 29.21 2jch h HIS 567 CO 0.04 0.88 0.24 1.15 -1.30 0.00 0.00 177.93 178.93 2jch h THR 568 N 0.91 1.04 -0.06 6.26 2.02 -0.75 -2.23 112.91 120.11 2jch h THR 568 Ca 0.18 -0.14 -0.12 0.00 0.77 0.00 0.00 66.41 67.10 2jch h THR 568 Cb 0.42 0.60 -0.01 0.00 -1.74 0.00 0.00 68.15 67.42 2jch h THR 568 CO 0.01 0.07 -0.51 -1.13 0.37 0.00 0.00 175.52 174.34 2jch h ASN 569 N 0.40 0.18 -0.32 4.18 -0.73 -1.28 0.32 115.58 118.34 2jch h ASN 569 Ca 0.14 -0.09 -0.11 0.00 1.87 0.00 0.00 56.30 58.11 2jch h ASN 569 Cb 0.07 -0.05 -0.01 0.00 0.27 0.00 0.00 38.32 38.60 2jch h ASN 569 CO -0.03 0.66 -0.23 1.23 -0.37 0.00 0.00 177.43 178.69 2jch h GLY 570 N 1.41 0.78 2.00 1.57 0.00 -1.28 -2.93 103.07 104.62 2jch h GLY 570 Ca 0.00 -0.76 -0.05 0.00 0.00 0.00 0.00 47.33 46.53 2jch h GLY 570 CO 0.07 0.68 -0.22 -0.97 0.00 0.00 0.00 176.54 176.11 2jch h TYR 571 N 0.48 0.00 -0.58 5.60 -1.99 -1.04 -2.71 116.97 116.73 2jch h TYR 571 Ca 0.06 0.00 -0.04 0.00 2.00 0.00 0.00 58.73 60.75 2jch h TYR 571 Cb 0.79 0.00 -0.03 0.00 2.00 0.00 0.00 36.73 39.49 2jch h TYR 571 CO 0.07 0.22 0.19 0.37 -0.00 0.00 0.00 178.16 179.01 2jch h GLN 572 N 0.00 0.87 -0.49 4.88 -0.00 -0.34 -1.85 115.11 118.18 2jch h GLN 572 Ca -0.00 -0.15 -0.11 0.00 -0.00 0.00 0.00 58.65 58.38 2jch h GLN 572 Cb 0.44 -0.14 -0.01 0.00 0.00 0.00 0.00 27.48 27.77 2jch h GLN 572 CO 0.03 0.74 -0.13 1.15 0.00 0.00 0.00 178.83 180.62 2jch h THR 573 N 0.85 1.27 -0.17 2.39 2.02 -1.29 -2.00 112.91 115.98 2jch h THR 573 Ca 0.19 -1.27 -0.11 0.00 0.77 0.00 0.00 66.41 65.98 2jch h THR 573 Cb 0.23 1.08 0.00 0.00 -1.74 0.00 0.00 68.15 67.72 2jch h THR 573 CO -0.01 0.44 -0.34 -0.07 0.37 0.00 0.00 175.52 175.91 2jch h LEU 574 N 0.80 0.59 -0.81 2.58 3.38 -1.48 1.00 115.31 121.37 2jch h LEU 574 Ca 0.12 -0.56 0.11 0.00 0.09 0.00 0.00 57.88 57.64 2jch h LEU 574 Cb 0.69 -0.17 -0.08 0.00 0.09 0.00 0.00 40.66 41.20 2jch h LEU 574 CO 0.05 1.04 0.44 0.00 0.09 0.00 0.00 178.44 180.06 2jch h ALA 575 N 0.57 1.16 -0.37 1.53 0.00 -1.27 -3.05 119.26 117.84 2jch h ALA 575 Ca 0.00 0.05 -0.27 0.00 0.00 0.00 0.00 54.91 54.69 2jch h ALA 575 Cb 0.94 -0.09 -0.11 0.00 0.00 0.00 0.00 17.79 18.53 2jch h ALA 575 CO 0.08 0.03 0.29 -1.71 0.00 0.00 0.00 179.25 177.94 2jch n ASN 576 N -4.79 6.19 -4.03 0.00 5.15 -0.76 -4.86 115.26 112.16 2jch n ASN 576 Ca 0.14 -2.92 -0.33 0.00 -0.60 0.00 0.00 54.58 50.86 2jch n ASN 576 Cb 0.31 -1.11 -0.06 0.00 -0.53 0.00 0.00 39.78 38.39 2jch n ASN 576 CO 0.00 0.00 0.00 0.59 1.40 0.00 0.00 177.26 179.25 2jch n ASN 577 N 0.74 -1.60 0.00 1.20 3.02 -1.15 -2.39 115.26 115.08 2jch n ASN 577 Ca 0.27 -0.88 0.00 0.00 -0.03 0.00 0.00 54.58 53.94 2jch n ASN 577 Cb 0.58 -1.42 0.00 0.00 -0.61 0.00 0.00 39.78 38.33 2jch n ASN 577 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2jch n GLY 578 N -0.93 0.68 3.28 7.41 0.00 0.34 -4.38 105.19 111.59 2jch n GLY 578 Ca 0.09 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.73 2jch n GLY 578 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2jch s VAL 579 N -2.00 3.89 0.10 1.61 1.01 -1.00 -0.43 120.40 123.57 2jch s VAL 579 Ca 0.00 -1.12 -0.31 0.00 0.00 0.00 0.00 61.98 60.56 2jch s VAL 579 Cb 0.00 -3.21 -0.07 0.00 0.00 0.00 0.00 36.38 33.10 2jch s VAL 579 CO 0.00 -0.20 1.25 -0.47 0.00 0.00 0.00 175.10 175.68 2jch s TYR 580 N 1.42 3.38 -0.06 5.22 5.04 0.33 -4.57 117.35 128.12 2jch s TYR 580 Ca -0.01 1.24 0.06 0.00 -2.44 0.00 0.00 57.07 55.91 2jch s TYR 580 Cb -0.20 -3.49 -0.01 0.00 0.35 0.00 0.00 41.96 38.61 2jch s TYR 580 CO 0.03 -1.56 -0.24 -1.01 -1.34 0.00 0.00 175.55 171.43 2jch s HIS 581 N 0.83 2.36 0.09 4.97 3.76 -1.26 -2.11 115.29 123.92 2jch s HIS 581 Ca 0.59 -0.70 -0.31 0.00 -0.15 0.00 0.00 55.06 54.50 2jch s HIS 581 Cb -0.32 -1.55 -0.07 0.00 1.11 0.00 0.00 32.58 31.76 2jch s HIS 581 CO 0.31 -0.21 1.26 -1.14 -0.85 0.00 0.00 174.74 174.12 2jch s GLN 582 N -0.15 4.40 0.75 1.40 0.74 -1.26 -4.47 119.66 121.06 2jch s GLN 582 Ca -0.03 1.88 -0.15 0.00 0.05 0.00 0.00 55.36 57.11 2jch s GLN 582 Cb -0.13 -3.31 0.04 0.00 1.10 0.00 0.00 33.01 30.71 2jch s GLN 582 CO 0.03 -0.31 1.14 0.36 -0.55 0.00 0.00 175.29 175.96 2jch n LYS 583 N 3.84 0.48 -3.63 1.67 2.85 -1.25 -4.62 118.16 117.50 2jch n LYS 583 Ca 0.09 0.23 -0.06 0.00 -1.05 0.00 0.00 58.31 57.52 2jch n LYS 583 Cb 0.45 -2.38 -0.06 0.00 -0.65 0.00 0.00 35.03 32.39 2jch n LYS 583 CO 0.00 0.00 0.00 -3.38 -0.05 0.00 0.00 177.40 173.97 2jch s HIS 584 N -1.87 -0.23 -0.17 5.58 -3.43 -1.20 -4.99 115.29 108.98 2jch s HIS 584 Ca 0.75 0.50 0.02 0.00 -0.80 0.00 0.00 55.06 55.53 2jch s HIS 584 Cb -0.33 0.45 0.00 0.00 -1.43 0.00 0.00 32.58 31.27 2jch s HIS 584 CO 0.49 -0.15 0.36 1.55 -2.00 0.00 0.00 174.74 174.98 2jch n VAL 585 N 1.31 0.00 -4.18 -5.38 3.14 -1.26 -2.16 118.33 109.80 2jch n VAL 585 Ca -0.09 -0.48 -0.30 0.00 -2.96 0.00 0.00 64.34 60.51 2jch n VAL 585 Cb 0.57 1.02 -0.16 0.00 -1.06 0.00 0.00 33.84 34.21 2jch n VAL 585 CO 0.00 0.00 0.00 -0.63 -6.46 0.00 0.00 176.83 169.74 2jch s ILE 586 N -0.58 1.61 -0.12 1.55 -1.09 -1.26 -1.39 121.20 119.92 2jch s ILE 586 Ca 0.02 -0.67 -0.04 0.00 -2.23 0.00 0.00 60.65 57.72 2jch s ILE 586 Cb 0.01 -1.49 -0.25 0.00 -1.58 0.00 0.00 42.46 39.15 2jch s ILE 586 CO 0.04 0.47 0.38 -1.54 -1.23 0.00 0.00 174.94 173.06 2jch n SER 587 N 4.57 1.95 -3.67 3.58 3.41 -0.83 -4.58 113.62 118.05 2jch n SER 587 Ca -0.18 0.22 -0.15 0.00 -0.26 0.00 0.00 58.87 58.50 2jch n SER 587 Cb 0.50 -0.73 -0.15 0.00 -0.26 0.00 0.00 64.21 63.58 2jch n SER 587 CO 0.00 0.00 0.00 -0.75 -0.16 0.00 0.00 175.04 174.13 2jch s LYS 588 N -2.56 0.08 -0.19 4.33 2.20 -1.20 0.67 119.74 123.07 2jch s LYS 588 Ca -0.20 0.63 -0.06 0.00 -0.36 0.00 0.00 55.97 55.97 2jch s LYS 588 Cb 0.07 -0.18 -0.03 0.00 -1.51 0.00 0.00 37.83 36.18 2jch s LYS 588 CO 0.77 -0.29 0.02 0.42 -0.36 0.00 0.00 175.35 175.91 2jch s ILE 589 N 2.29 4.31 0.02 5.43 1.01 0.06 0.39 121.20 134.70 2jch s ILE 589 Ca 0.02 -0.20 0.07 0.00 0.00 0.00 0.00 60.65 60.54 2jch s ILE 589 Cb -0.12 -2.94 -0.03 0.00 0.01 0.00 0.00 42.46 39.39 2jch s ILE 589 CO -0.07 0.45 -0.21 -1.61 0.00 0.00 0.00 174.94 173.50 2jch s GLU 590 N 0.63 2.07 1.12 2.79 2.02 0.71 -0.60 118.70 127.44 2jch s GLU 590 Ca 0.01 -0.97 -0.17 0.00 0.02 0.00 0.00 54.97 53.87 2jch s GLU 590 Cb -0.14 -2.14 0.19 0.00 0.10 0.00 0.00 34.13 32.15 2jch s GLU 590 CO 0.02 0.55 0.34 0.00 0.02 0.00 0.00 175.26 176.19 2jch n ALA 591 N 1.86 -2.39 0.22 5.21 0.00 0.25 -0.95 120.51 124.70 2jch n ALA 591 Ca -0.16 -1.26 0.06 0.00 0.00 0.00 0.00 53.44 52.08 2jch n ALA 591 Cb 0.52 -1.18 0.49 0.00 0.00 0.00 0.00 19.45 19.28 2jch n ALA 591 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2jch h ALA 592 N -2.69 1.45 -0.43 0.00 0.00 -1.82 -3.30 119.26 112.47 2jch h ALA 592 Ca -0.35 -0.22 -0.14 0.00 0.00 0.00 0.00 54.91 54.19 2jch h ALA 592 Cb 1.02 -0.04 -0.08 0.00 0.00 0.00 0.00 17.79 18.69 2jch h ALA 592 CO 0.24 0.31 0.18 -0.40 0.00 0.00 0.00 179.25 179.57 2jch n ASP 593 N -4.05 3.50 0.00 0.00 5.75 -1.26 -4.91 116.55 115.58 2jch n ASP 593 Ca -0.02 -2.69 0.00 0.00 -0.01 0.00 0.00 54.79 52.07 2jch n ASP 593 Cb 0.31 -0.64 0.00 0.00 -1.03 0.00 0.00 41.12 39.76 2jch n ASP 593 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2jch n GLY 594 N -0.02 0.24 3.77 6.12 0.00 -1.24 -4.97 105.19 109.08 2jch n GLY 594 Ca 0.24 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.85 2jch n GLY 594 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2jch s ARG 595 N -0.75 4.41 -0.63 1.61 0.52 -1.26 -4.77 118.95 118.07 2jch s ARG 595 Ca 0.00 2.13 -0.27 0.00 -0.52 0.00 0.00 55.73 57.08 2jch s ARG 595 Cb 0.00 -3.10 -0.01 0.00 0.52 0.00 0.00 34.95 32.36 2jch s ARG 595 CO 0.00 -0.12 1.74 0.08 0.02 0.00 0.00 175.30 177.02 2jch s VAL 596 N -1.07 3.43 -0.10 3.52 1.01 -1.26 -0.58 120.40 125.35 2jch s VAL 596 Ca 0.49 0.25 -0.20 0.00 0.00 0.00 0.00 61.98 62.52 2jch s VAL 596 Cb -0.38 -4.14 -0.17 0.00 0.00 0.00 0.00 36.38 31.69 2jch s VAL 596 CO 0.50 -1.10 0.63 0.58 0.00 0.00 0.00 175.10 175.71 2jch h VAL 597 N 6.71 1.12 -3.51 2.92 2.07 -1.21 -3.47 116.25 120.87 2jch h VAL 597 Ca -0.26 -1.68 -0.61 0.00 0.82 0.00 0.00 66.70 64.96 2jch h VAL 597 Cb 1.14 2.05 -0.33 0.00 -1.52 0.00 0.00 31.29 32.63 2jch h VAL 597 CO 1.23 0.36 -0.85 -0.47 0.02 0.00 0.00 177.57 177.85 2jch s TYR 598 N -2.42 2.06 -0.08 1.57 6.14 -0.54 -4.98 117.35 119.10 2jch s TYR 598 Ca -0.13 -0.77 0.02 0.00 0.64 0.00 0.00 57.07 56.84 2jch s TYR 598 Cb -0.01 -1.41 0.01 0.00 0.42 0.00 0.00 41.96 40.98 2jch s TYR 598 CO 0.47 -0.32 -0.13 -1.21 0.64 0.00 0.00 175.55 175.01 2jch s GLU 599 N 0.35 1.83 -0.01 4.97 2.02 -1.26 -0.76 118.70 125.84 2jch s GLU 599 Ca -0.14 -0.44 -0.36 0.00 0.02 0.00 0.00 54.97 54.05 2jch s GLU 599 Cb -0.16 -1.54 -0.14 0.00 0.10 0.00 0.00 34.13 32.39 2jch s GLU 599 CO 0.06 -0.01 1.66 0.98 0.02 0.00 0.00 175.26 177.97 2jch n TYR 600 N 3.97 2.11 -3.77 1.61 9.36 0.21 -4.94 117.16 125.71 2jch n TYR 600 Ca -0.21 0.29 -0.37 0.00 3.32 0.00 0.00 57.90 60.93 2jch n TYR 600 Cb 0.52 -2.53 -0.13 0.00 -0.63 0.00 0.00 39.34 36.57 2jch n TYR 600 CO 0.00 0.00 0.00 -0.65 0.22 0.00 0.00 176.86 176.43 2jch s GLN 601 N 2.34 2.90 -0.02 2.98 1.11 -1.26 -5.06 119.66 122.65 2jch s GLN 601 Ca 0.88 -0.99 -0.30 0.00 0.01 0.00 0.00 55.36 54.96 2jch s GLN 601 Cb -0.80 -3.39 -0.07 0.00 -1.01 0.00 0.00 33.01 27.74 2jch s GLN 601 CO 0.49 -0.53 1.79 0.34 0.01 0.00 0.00 175.29 177.39 2jch s ASP 602 N 1.45 6.57 -0.66 5.90 2.15 -1.26 -4.97 116.67 125.86 2jch s ASP 602 Ca 0.01 2.41 0.05 0.00 0.43 0.00 0.00 52.55 55.45 2jch s ASP 602 Cb -0.18 -2.53 0.19 0.00 -0.30 0.00 0.00 42.92 40.10 2jch s ASP 602 CO 0.02 -0.99 0.55 0.29 -0.17 0.00 0.00 175.17 174.88 2jch n LYS 603 N 7.31 1.87 -1.70 4.34 5.02 -1.26 -5.10 118.16 128.64 2jch n LYS 603 Ca 0.18 -4.41 -0.43 0.00 -2.02 0.00 0.00 58.31 51.63 2jch n LYS 603 Cb 0.42 -2.21 -0.02 0.00 -0.02 0.00 0.00 35.03 33.21 2jch n LYS 603 CO 0.00 0.00 0.00 -0.35 -0.52 0.00 0.00 177.40 176.53 2jch n PRO 604 N 1.71 2.25 -4.19 1.97 -0.04 -1.26 -4.78 135.00 130.66 2jch n PRO 604 Ca 0.23 0.80 -0.21 0.00 -0.04 0.00 0.00 63.50 64.28 2jch n PRO 604 Cb 0.38 -2.47 -0.16 0.00 -0.04 0.00 0.00 33.50 31.21 2jch n PRO 604 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 2jch s VAL 605 N -0.37 0.63 -1.01 0.52 1.01 -0.90 -4.99 120.40 115.31 2jch s VAL 605 Ca 0.63 -0.17 -0.23 0.00 0.00 0.00 0.00 61.98 62.21 2jch s VAL 605 Cb -0.58 -0.65 0.04 0.00 0.00 0.00 0.00 36.38 35.19 2jch s VAL 605 CO 0.53 0.25 1.49 -1.58 0.00 0.00 0.00 175.10 175.79 2jch s GLN 606 N 0.98 3.50 0.02 2.72 2.00 -1.26 -0.51 119.66 127.11 2jch s GLN 606 Ca -0.10 -1.04 -0.27 0.00 -2.00 0.00 0.00 55.36 51.95 2jch s GLN 606 Cb -0.14 -5.32 -0.16 0.00 0.80 0.00 0.00 33.01 28.18 2jch s GLN 606 CO -0.00 -2.31 1.22 0.28 -0.50 0.00 0.00 175.29 173.99 2jch h VAL 607 N 6.83 0.34 -2.77 1.34 2.07 -1.13 -3.45 116.25 119.48 2jch h VAL 607 Ca 0.19 -0.39 -0.59 0.00 0.82 0.00 0.00 66.70 66.72 2jch h VAL 607 Cb 1.01 0.47 -0.11 0.00 -1.52 0.00 0.00 31.29 31.14 2jch h VAL 607 CO 1.41 0.05 -0.65 -0.31 0.02 0.00 0.00 177.57 178.09 2jch s TYR 608 N -4.83 2.85 1.16 1.57 1.51 -1.10 -4.99 117.35 113.52 2jch s TYR 608 Ca -0.14 -0.14 -0.20 0.00 -1.01 0.00 0.00 57.07 55.58 2jch s TYR 608 Cb 0.02 -1.36 0.29 0.00 -0.11 0.00 0.00 41.96 40.79 2jch s TYR 608 CO 0.50 0.53 1.05 -1.13 -1.11 0.00 0.00 175.55 175.38 2jch n SER 609 N -0.25 -1.96 0.07 2.29 3.41 -1.26 -4.46 113.62 111.46 2jch n SER 609 Ca -0.09 -1.15 -0.20 0.00 -0.26 0.00 0.00 58.87 57.17 2jch n SER 609 Cb 0.56 -0.96 -0.15 0.00 -0.26 0.00 0.00 64.21 63.40 2jch n SER 609 CO 0.00 0.00 0.00 0.11 -0.16 0.00 0.00 175.04 174.99 2jch h LYS 610 N 0.00 0.33 -0.43 4.33 1.57 -1.96 -2.45 116.57 117.97 2jch h LYS 610 Ca -0.39 -0.57 0.05 0.00 -1.87 0.00 0.00 60.65 57.88 2jch h LYS 610 Cb 1.19 0.21 -0.09 0.00 0.08 0.00 0.00 32.23 33.63 2jch h LYS 610 CO 0.26 1.22 -0.54 0.00 -0.57 0.00 0.00 179.45 179.82 2jch h ALA 611 N 0.31 -0.72 0.25 3.86 0.00 -1.91 -2.26 119.26 118.78 2jch h ALA 611 Ca -0.29 0.01 0.01 0.00 0.00 0.00 0.00 54.91 54.64 2jch h ALA 611 Cb 2.06 1.10 -0.03 0.00 0.00 0.00 0.00 17.79 20.92 2jch h ALA 611 CO 0.18 -1.02 -0.37 1.15 0.00 0.00 0.00 179.25 179.18 2jch h THR 612 N -0.38 0.23 -0.36 0.00 2.02 -1.89 -1.46 112.91 111.08 2jch h THR 612 Ca 0.09 0.00 -0.01 0.00 0.77 0.00 0.00 66.41 67.26 2jch h THR 612 Cb 0.59 0.23 -0.02 0.00 -1.74 0.00 0.00 68.15 67.22 2jch h THR 612 CO -0.61 0.00 0.18 0.00 0.37 0.00 0.00 175.52 175.47 2jch h ALA 613 N -0.20 0.46 0.00 6.16 0.00 -1.43 -0.96 119.26 123.29 2jch h ALA 613 Ca -0.00 -0.09 -0.02 0.00 0.00 0.00 0.00 54.91 54.80 2jch h ALA 613 Cb 0.66 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 18.31 2jch h ALA 613 CO -0.14 0.01 -0.10 1.79 0.00 0.00 0.00 179.25 180.82 2jch h THR 614 N 0.45 0.54 -0.00 0.00 1.35 -1.37 -0.44 112.91 113.43 2jch h THR 614 Ca 0.13 -0.44 -0.01 0.00 -0.55 0.00 0.00 66.41 65.54 2jch h THR 614 Cb 0.09 1.29 0.00 0.00 -1.73 0.00 0.00 68.15 67.80 2jch h THR 614 CO -0.02 0.09 -0.03 0.40 -0.25 0.00 0.00 175.52 175.72 2jch h ILE 615 N 0.00 1.56 -0.69 6.82 2.04 -0.72 -3.06 117.51 123.46 2jch h ILE 615 Ca -0.00 -1.68 0.06 0.00 1.00 0.00 0.00 64.86 64.23 2jch h ILE 615 Cb 0.28 2.68 -0.04 0.00 -0.74 0.00 0.00 36.82 39.00 2jch h ILE 615 CO 0.01 0.44 0.45 0.24 0.00 0.00 0.00 178.15 179.30 2jch h MET 616 N -0.67 0.70 -0.54 2.37 2.86 -1.11 -1.13 114.93 117.41 2jch h MET 616 Ca -0.00 -0.04 0.03 0.00 -2.06 0.00 0.00 59.70 57.63 2jch h MET 616 Cb 0.74 -0.16 -0.04 0.00 0.06 0.00 0.00 31.60 32.20 2jch h MET 616 CO 0.01 0.46 0.32 1.96 1.06 0.00 0.00 176.91 180.72 2jch h GLN 617 N 0.72 0.61 -0.54 1.72 4.20 -1.11 -0.82 115.11 119.88 2jch h GLN 617 Ca 0.29 -0.04 -0.08 0.00 0.06 0.00 0.00 58.65 58.89 2jch h GLN 617 Cb 0.24 -0.14 -0.02 0.00 0.30 0.00 0.00 27.48 27.86 2jch h GLN 617 CO -0.09 0.40 0.03 0.78 -0.67 0.00 0.00 178.83 179.28 2jch h GLY 618 N 0.63 0.97 0.94 3.46 0.00 -1.13 -0.63 103.07 107.31 2jch h GLY 618 Ca 0.22 -0.65 -0.01 0.00 0.00 0.00 0.00 47.33 46.89 2jch h GLY 618 CO -0.11 0.60 0.15 1.41 0.00 0.00 0.00 176.54 178.59 2jch h LEU 619 N 0.84 0.42 -1.12 3.11 3.38 -1.16 -3.04 115.31 117.74 2jch h LEU 619 Ca 0.16 -0.13 -0.02 0.00 0.09 0.00 0.00 57.88 57.99 2jch h LEU 619 Cb 0.46 -0.11 -0.00 0.00 0.09 0.00 0.00 40.66 41.10 2jch h LEU 619 CO 0.02 0.43 -0.08 -0.07 0.09 0.00 0.00 178.44 178.83 2jch h LEU 620 N 0.38 0.00 -0.52 1.67 3.38 -1.03 -1.79 115.31 117.39 2jch h LEU 620 Ca 0.11 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 58.06 2jch h LEU 620 Cb 0.12 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.85 2jch h LEU 620 CO -0.01 0.08 0.24 -0.09 0.09 0.00 0.00 178.44 178.75 2jch h ARG 621 N 0.00 0.75 0.00 1.13 2.43 -1.00 -2.70 114.38 115.00 2jch h ARG 621 Ca -0.00 -0.12 -0.06 0.00 -0.81 0.00 0.00 59.98 58.99 2jch h ARG 621 Cb 0.67 -0.13 -0.01 0.00 -0.42 0.00 0.00 29.97 30.08 2jch h ARG 621 CO 0.01 0.63 -0.28 0.93 -1.51 0.00 0.00 179.97 179.75 2jch h GLU 622 N 0.70 0.00 -0.86 0.20 4.39 -1.24 -2.82 114.58 114.95 2jch h GLU 622 Ca 0.18 0.00 0.08 0.00 0.34 0.00 0.00 59.36 59.96 2jch h GLU 622 Cb 0.13 0.00 -0.07 0.00 -0.10 0.00 0.00 28.75 28.71 2jch h GLU 622 CO -0.02 0.28 0.51 0.28 -1.16 0.00 0.00 179.01 178.91 2jch h VAL 623 N 0.00 0.97 0.16 3.13 2.07 -1.32 -1.60 116.25 119.66 2jch h VAL 623 Ca -0.00 -0.30 -0.25 0.00 0.82 0.00 0.00 66.70 66.96 2jch h VAL 623 Cb 0.61 0.00 0.02 0.00 -1.52 0.00 0.00 31.29 30.40 2jch h VAL 623 CO 0.04 0.16 -1.17 -0.07 0.02 0.00 0.00 177.57 176.55 2jch h LEU 624 N 0.89 0.54 -0.47 2.57 3.38 -1.57 -3.27 115.31 117.38 2jch h LEU 624 Ca 0.40 -0.92 0.05 0.00 0.09 0.00 0.00 57.88 57.49 2jch h LEU 624 Cb 0.29 -0.18 -0.04 0.00 0.09 0.00 0.00 40.66 40.82 2jch h LEU 624 CO -0.22 1.55 0.22 0.28 0.09 0.00 0.00 178.44 180.36 2jch h SER 625 N -0.21 0.29 0.80 -0.43 0.02 -1.34 -3.17 113.55 109.52 2jch h SER 625 Ca -0.22 0.03 -0.02 0.00 -0.84 0.00 0.00 61.79 60.75 2jch h SER 625 Cb 1.82 -0.02 -0.00 0.00 0.14 0.00 0.00 62.40 64.34 2jch h SER 625 CO 0.16 0.21 -0.07 0.77 -1.14 0.00 0.00 176.83 176.75 2jch h SER 626 N 0.43 0.00 -1.08 3.07 4.64 -1.43 -3.47 113.55 115.72 2jch h SER 626 Ca 0.21 0.00 -0.34 0.00 -0.47 0.00 0.00 61.79 61.19 2jch h SER 626 Cb 0.14 0.00 -0.12 0.00 -0.31 0.00 0.00 62.40 62.12 2jch h SER 626 CO -0.17 0.07 -0.33 0.54 -0.87 0.00 0.00 176.83 176.08 2jch n ARG 627 N -3.25 -1.20 -0.04 4.77 1.74 -1.20 -4.88 116.66 112.60 2jch n ARG 627 Ca -0.00 1.05 -0.13 0.00 -0.77 0.00 0.00 57.85 58.00 2jch n ARG 627 Cb 0.30 -5.30 -0.07 0.00 -1.02 0.00 0.00 32.46 26.37 2jch n ARG 627 CO 0.00 0.00 0.00 0.28 -1.52 0.00 0.00 177.63 176.39 2jch h VAL 628 N 0.00 1.32 -0.12 1.55 2.07 -1.79 -3.33 116.25 115.95 2jch h VAL 628 Ca -0.35 -1.06 0.00 0.00 0.82 0.00 0.00 66.70 66.11 2jch h VAL 628 Cb 1.13 1.80 0.00 0.00 -1.52 0.00 0.00 31.29 32.70 2jch h VAL 628 CO 0.50 0.30 0.00 0.35 0.02 0.00 0.00 177.57 178.74 2jch n THR 629 N -4.73 0.30 -3.64 2.57 -2.24 -1.26 -4.95 114.28 100.34 2jch n THR 629 Ca -0.06 -0.65 -0.12 0.00 -2.27 0.00 0.00 64.05 60.94 2jch n THR 629 Cb 0.27 1.02 -0.07 0.00 -2.10 0.00 0.00 70.33 69.44 2jch n THR 629 CO 0.00 0.00 0.00 0.28 -0.57 0.00 0.00 175.07 174.78 2jch s THR 630 N -0.96 -0.00 -2.05 4.28 -1.32 -1.25 -4.23 115.64 110.11 2jch s THR 630 Ca 0.16 0.00 0.16 0.00 -1.21 0.00 0.00 61.69 60.81 2jch s THR 630 Cb 0.10 -0.98 0.44 0.00 -1.51 0.00 0.00 72.50 70.55 2jch s THR 630 CO 0.15 0.00 1.58 0.35 -2.21 0.00 0.00 174.62 174.49 2jch n THR 631 N 3.11 0.05 -0.07 5.08 -2.24 -0.46 -4.40 114.28 115.35 2jch n THR 631 Ca -0.16 -0.07 -0.07 0.00 -2.27 0.00 0.00 64.05 61.48 2jch n THR 631 Cb 0.56 -0.12 -0.01 0.00 -2.10 0.00 0.00 70.33 68.66 2jch n THR 631 CO 0.00 0.00 0.00 0.15 -0.57 0.00 0.00 175.07 174.65 2jch h PHE 632 N 0.45 -0.55 -0.99 4.78 3.04 -1.82 -1.07 116.94 120.78 2jch h PHE 632 Ca 0.00 0.04 0.10 0.00 3.98 0.00 0.00 57.97 62.09 2jch h PHE 632 Cb 0.10 0.29 -0.08 0.00 2.56 0.00 0.00 35.95 38.82 2jch h PHE 632 CO 0.03 -0.29 0.63 0.87 -2.02 0.00 0.00 178.31 177.53 2jch h LYS 633 N -0.20 1.01 -0.46 1.11 1.79 -1.83 -1.66 116.57 116.33 2jch h LYS 633 Ca 0.15 -0.06 -0.08 0.00 -2.18 0.00 0.00 60.65 58.48 2jch h LYS 633 Cb 0.43 -0.23 -0.02 0.00 -1.58 0.00 0.00 32.23 30.83 2jch h LYS 633 CO -0.40 0.67 -0.03 0.77 -1.08 0.00 0.00 179.45 179.38 2jch h SER 634 N 1.04 0.75 -0.57 0.86 0.02 -1.57 -0.63 113.55 113.45 2jch h SER 634 Ca 0.46 -0.19 -0.03 0.00 -0.84 0.00 0.00 61.79 61.19 2jch h SER 634 Cb 0.37 -0.20 -0.03 0.00 0.14 0.00 0.00 62.40 62.69 2jch h SER 634 CO -0.22 0.84 0.23 0.78 -1.14 0.00 0.00 176.83 177.32 2jch h ASN 635 N 0.72 0.78 0.67 3.07 2.35 -1.12 -2.85 115.58 119.20 2jch h ASN 635 Ca 0.14 -0.16 -0.27 0.00 -0.55 0.00 0.00 56.30 55.45 2jch h ASN 635 Cb 0.49 -0.20 -0.01 0.00 0.05 0.00 0.00 38.32 38.65 2jch h ASN 635 CO 0.02 0.73 -1.26 0.25 -1.65 0.00 0.00 177.43 175.52 2jch h LEU 636 N 0.78 0.31 -0.56 1.61 5.85 -1.10 -2.71 115.31 119.49 2jch h LEU 636 Ca 0.19 -0.36 0.10 0.00 0.84 0.00 0.00 57.88 58.65 2jch h LEU 636 Cb 0.19 -0.10 -0.08 0.00 0.37 0.00 0.00 40.66 41.04 2jch h LEU 636 CO -0.02 1.28 0.12 0.74 -0.34 0.00 0.00 178.44 180.23 2jch h THR 637 N 0.05 0.67 0.00 1.05 2.02 -1.06 0.15 112.91 115.80 2jch h THR 637 Ca -0.13 -0.09 -0.14 0.00 0.77 0.00 0.00 66.41 66.82 2jch h THR 637 Cb 1.94 0.39 -0.02 0.00 -1.74 0.00 0.00 68.15 68.72 2jch h THR 637 CO 0.18 0.05 -0.67 0.28 0.37 0.00 0.00 175.52 175.72 2jch h SER 638 N 0.26 0.00 0.19 4.18 0.02 -1.32 -2.74 113.55 114.14 2jch h SER 638 Ca 0.29 0.00 -0.33 0.00 -0.84 0.00 0.00 61.79 60.92 2jch h SER 638 Cb 0.42 0.00 0.02 0.00 0.14 0.00 0.00 62.40 62.97 2jch h SER 638 CO -0.37 0.67 -1.57 -0.07 -1.14 0.00 0.00 176.83 174.35 2jch h LEU 639 N 0.00 0.63 -5.78 5.07 3.38 -1.20 -3.45 115.31 113.96 2jch h LEU 639 Ca -0.01 -0.92 -0.26 0.00 0.09 0.00 0.00 57.88 56.78 2jch h LEU 639 Cb 1.29 -0.20 -0.24 0.00 0.09 0.00 0.00 40.66 41.59 2jch h LEU 639 CO 0.09 1.72 -0.61 0.21 0.09 0.00 0.00 178.44 179.93 2jch s ASN 640 N -7.30 -0.35 0.45 -0.43 3.04 0.50 -5.01 114.94 105.84 2jch s ASN 640 Ca -0.15 -1.73 0.12 0.00 0.04 0.00 0.00 52.86 51.14 2jch s ASN 640 Cb 0.05 1.19 1.03 0.00 -1.54 0.00 0.00 41.25 41.98 2jch s ASN 640 CO 0.86 -0.15 2.07 1.55 -3.04 0.00 0.00 177.10 178.40 2jch h PRO 641 N 6.03 0.33 -0.34 0.43 0.13 -1.62 0.04 132.00 137.00 2jch h PRO 641 Ca 0.09 -0.02 -0.14 0.00 -0.87 0.00 0.00 66.00 65.06 2jch h PRO 641 Cb 1.08 -0.07 -0.01 0.00 0.13 0.00 0.00 31.00 32.12 2jch h PRO 641 CO 0.14 0.22 -0.37 1.15 -0.23 0.00 0.00 178.00 178.91 2jch h THR 642 N 0.34 1.28 -0.12 1.56 2.02 -1.91 -3.09 112.91 112.99 2jch h THR 642 Ca 0.13 -1.53 -0.14 0.00 0.77 0.00 0.00 66.41 65.64 2jch h THR 642 Cb 0.10 1.41 -0.01 0.00 -1.74 0.00 0.00 68.15 67.91 2jch h THR 642 CO -0.03 0.50 -0.51 0.25 0.37 0.00 0.00 175.52 176.10 2jch h LEU 643 N 0.65 0.38 -2.24 2.58 5.85 -1.49 -3.05 115.31 117.99 2jch h LEU 643 Ca 0.06 -0.19 0.04 0.00 0.84 0.00 0.00 57.88 58.63 2jch h LEU 643 Cb 0.92 -0.11 -0.01 0.00 0.37 0.00 0.00 40.66 41.83 2jch h LEU 643 CO 0.08 0.83 0.24 0.00 -0.34 0.00 0.00 178.44 179.25 2jch h ALA 644 N 1.19 1.65 0.00 1.25 0.00 -1.00 -1.75 119.26 120.60 2jch h ALA 644 Ca 0.01 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2jch h ALA 644 Cb 1.00 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.80 2jch h ALA 644 CO 0.09 -0.32 -0.36 0.09 0.00 0.00 0.00 179.25 178.75 2jch n ASN 645 N -3.51 0.46 -4.18 0.00 3.02 -1.15 -4.85 115.26 105.05 2jch n ASN 645 Ca 0.01 0.12 -0.35 0.00 -0.03 0.00 0.00 54.58 54.33 2jch n ASN 645 Cb 0.34 -0.07 0.09 0.00 -0.61 0.00 0.00 39.78 39.53 2jch n ASN 645 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2jch n ALA 646 N -1.61 -4.38 -3.12 5.41 0.00 -0.66 -4.93 120.51 111.21 2jch n ALA 646 Ca 0.05 -0.86 -0.45 0.00 0.00 0.00 0.00 53.44 52.19 2jch n ALA 646 Cb 0.37 -1.37 -0.00 0.00 0.00 0.00 0.00 19.45 18.45 2jch n ALA 646 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 2jch s ASP 647 N -1.47 7.15 -0.06 0.00 2.15 -1.26 -5.01 116.67 118.17 2jch s ASP 647 Ca 0.47 -3.19 -0.26 0.00 0.43 0.00 0.00 52.55 50.00 2jch s ASP 647 Cb -0.14 -2.32 -0.03 0.00 -0.30 0.00 0.00 42.92 40.14 2jch s ASP 647 CO 0.73 -0.56 0.83 0.26 -0.17 0.00 0.00 175.17 176.25 2jch s TRP 648 N 0.40 3.58 0.27 -5.34 0.52 -1.26 -4.25 118.94 112.86 2jch s TRP 648 Ca 0.36 1.42 0.12 0.00 0.02 0.00 0.00 56.10 58.02 2jch s TRP 648 Cb -0.06 -2.96 -0.05 0.00 -1.15 0.00 0.00 33.47 29.25 2jch s TRP 648 CO -0.04 -0.01 -0.17 0.96 0.02 0.00 0.00 176.95 177.72 2jch s ILE 649 N 1.11 2.65 0.00 2.03 -4.36 0.39 -4.56 121.20 118.45 2jch s ILE 649 Ca 0.43 -2.29 0.00 0.00 -0.26 0.00 0.00 60.65 58.53 2jch s ILE 649 Cb -0.19 -2.39 0.00 0.00 1.25 0.00 0.00 42.46 41.13 2jch s ILE 649 CO 0.21 -0.38 0.00 0.61 0.24 0.00 0.00 174.94 175.62 2jch n GLY 650 N -0.61 -0.72 3.47 6.27 0.00 -1.03 -1.05 105.19 111.51 2jch n GLY 650 Ca -0.06 -0.99 -0.16 0.00 0.00 0.00 0.00 46.02 44.81 2jch n GLY 650 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2jch s LYS 651 N -2.00 0.91 0.33 1.61 2.47 0.25 -4.65 119.74 118.67 2jch s LYS 651 Ca 0.00 0.30 0.09 0.00 -1.56 0.00 0.00 55.97 54.80 2jch s LYS 651 Cb 0.00 0.43 -0.05 0.00 -1.46 0.00 0.00 37.83 36.75 2jch s LYS 651 CO 0.00 -0.25 0.04 0.95 0.16 0.00 0.00 175.35 176.25 2jch s THR 652 N -0.90 2.82 -0.06 3.43 -4.23 -1.26 -1.00 115.64 114.44 2jch s THR 652 Ca -0.09 -1.91 -0.17 0.00 -1.18 0.00 0.00 61.69 58.34 2jch s THR 652 Cb -0.02 -2.83 0.04 0.00 1.34 0.00 0.00 72.50 71.02 2jch s THR 652 CO 0.07 -0.22 0.40 -0.83 -0.54 0.00 0.00 174.62 173.50 2jch s GLY 653 N -3.74 -0.27 -0.07 3.99 0.00 -0.51 -3.34 107.32 103.38 2jch s GLY 653 Ca 0.35 0.74 0.01 0.00 0.00 0.00 0.00 44.72 45.82 2jch s GLY 653 CO 0.20 0.52 -0.06 -1.59 0.00 0.00 0.00 173.10 172.17 2jch s THR 654 N -0.83 0.78 0.58 0.90 2.01 -1.26 0.42 115.64 118.24 2jch s THR 654 Ca -0.09 -0.22 -0.14 0.00 0.31 0.00 0.00 61.69 61.55 2jch s THR 654 Cb -0.04 -0.80 -0.05 0.00 0.01 0.00 0.00 72.50 71.63 2jch s THR 654 CO 0.04 0.30 1.02 0.42 -0.69 0.00 0.00 174.62 175.71 2jch s THR 655 N 1.21 4.39 -1.34 -0.82 -4.23 -0.24 -4.56 115.64 110.05 2jch s THR 655 Ca -0.06 0.99 -0.09 0.00 -1.18 0.00 0.00 61.69 61.36 2jch s THR 655 Cb -0.14 -3.66 0.12 0.00 1.34 0.00 0.00 72.50 70.16 2jch s THR 655 CO -0.02 -0.81 2.17 -0.46 -0.54 0.00 0.00 174.62 174.96 2jch n ASN 656 N -2.19 6.24 0.00 3.99 2.04 -1.26 -0.71 115.26 123.38 2jch n ASN 656 Ca 0.07 -3.05 0.00 0.00 -0.44 0.00 0.00 54.58 51.16 2jch n ASN 656 Cb 0.54 -1.46 0.00 0.00 -2.53 0.00 0.00 39.78 36.32 2jch n ASN 656 CO 0.00 0.00 0.00 0.00 -0.44 0.00 0.00 177.26 176.82 2jch n GLN 657 N 3.35 0.00 -1.29 -3.83 1.13 -1.26 -5.00 117.38 110.49 2jch n GLN 657 Ca 0.52 0.00 -0.05 0.00 -1.94 0.00 0.00 57.00 55.52 2jch n GLN 657 Cb 0.32 0.00 -0.02 0.00 0.11 0.00 0.00 30.24 30.65 2jch n GLN 657 CO 0.00 0.00 0.00 -0.25 -1.44 0.00 0.00 177.06 175.37 2jch n ASP 658 N 0.00 -3.44 0.08 1.08 8.00 0.12 -4.39 116.55 117.99 2jch n ASP 658 Ca 0.00 0.11 -0.10 0.00 0.71 0.00 0.00 54.79 55.52 2jch n ASP 658 Cb 0.00 -1.61 -0.07 0.00 -0.02 0.00 0.00 41.12 39.43 2jch n ASP 658 CO 0.00 0.00 0.00 -0.33 -0.39 0.00 0.00 177.20 176.48 2jch h GLU 659 N 0.00 0.15 -4.13 -1.24 5.08 -1.82 0.15 114.58 112.78 2jch h GLU 659 Ca -0.11 -0.21 -0.32 0.00 -1.00 0.00 0.00 59.36 57.73 2jch h GLU 659 Cb 0.45 0.07 -0.29 0.00 0.50 0.00 0.00 28.75 29.47 2jch h GLU 659 CO 0.16 1.02 -0.75 -0.80 -1.00 0.00 0.00 179.01 177.64 2jch s ASN 660 N -6.92 0.51 -0.01 1.42 0.01 -1.26 -4.34 114.94 104.35 2jch s ASN 660 Ca -0.02 -0.07 0.08 0.00 -0.71 0.00 0.00 52.86 52.13 2jch s ASN 660 Cb 0.09 -0.10 -0.02 0.00 0.41 0.00 0.00 41.25 41.63 2jch s ASN 660 CO 0.84 0.03 -0.24 -0.04 -1.51 0.00 0.00 177.10 176.17 2jch s MET 661 N 0.10 2.10 0.04 -0.60 -1.94 -1.01 -1.08 119.30 116.91 2jch s MET 661 Ca -0.01 -0.94 0.07 0.00 -1.71 0.00 0.00 55.69 53.10 2jch s MET 661 Cb -0.04 -2.08 -0.02 0.00 2.01 0.00 0.00 34.83 34.70 2jch s MET 661 CO -0.00 0.56 -0.20 -1.58 -0.01 0.00 0.00 175.02 173.79 2jch s TRP 662 N -0.68 1.73 -0.11 -0.03 0.52 0.17 -2.24 118.94 118.29 2jch s TRP 662 Ca 0.11 -0.37 -0.04 0.00 0.02 0.00 0.00 56.10 55.82 2jch s TRP 662 Cb -0.10 -1.03 0.05 0.00 -1.15 0.00 0.00 33.47 31.24 2jch s TRP 662 CO 0.00 0.08 0.10 -1.17 0.02 0.00 0.00 176.95 175.98 2jch s LEU 663 N -1.16 0.17 -0.16 2.99 2.96 -0.79 -1.43 118.68 121.26 2jch s LEU 663 Ca 0.07 -0.18 -0.03 0.00 -0.22 0.00 0.00 54.13 53.77 2jch s LEU 663 Cb -0.09 -0.08 -0.02 0.00 0.50 0.00 0.00 46.19 46.50 2jch s LEU 663 CO 0.02 -0.29 -0.06 -0.04 -1.32 0.00 0.00 176.35 174.66 2jch s MET 664 N 2.19 3.57 -0.04 1.98 -1.94 -0.17 -2.01 119.30 122.88 2jch s MET 664 Ca 0.04 -0.57 0.03 0.00 -1.71 0.00 0.00 55.69 53.48 2jch s MET 664 Cb -0.14 -2.87 0.00 0.00 2.01 0.00 0.00 34.83 33.83 2jch s MET 664 CO -0.06 0.17 -0.12 -0.51 -0.01 0.00 0.00 175.02 174.49 2jch s LEU 665 N 0.52 1.79 -0.01 -0.03 1.43 -0.85 -0.58 118.68 120.96 2jch s LEU 665 Ca -0.04 -0.26 0.01 0.00 -1.03 0.00 0.00 54.13 52.81 2jch s LEU 665 Cb -0.15 -0.73 0.01 0.00 0.03 0.00 0.00 46.19 45.35 2jch s LEU 665 CO 0.03 0.08 -0.01 -0.44 0.23 0.00 0.00 176.35 176.24 2jch s SER 666 N 0.25 0.26 0.51 2.29 0.01 -0.22 -0.08 113.70 116.72 2jch s SER 666 Ca -0.06 -0.03 0.02 0.00 1.31 0.00 0.00 55.95 57.19 2jch s SER 666 Cb -0.11 -0.06 0.02 0.00 0.21 0.00 0.00 66.02 66.08 2jch s SER 666 CO 0.02 -0.00 0.73 0.42 0.41 0.00 0.00 173.24 174.81 2jch s THR 667 N 0.19 3.07 0.52 1.44 -4.23 -1.05 -0.46 115.64 115.12 2jch s THR 667 Ca -0.02 -0.65 0.27 0.00 -1.18 0.00 0.00 61.69 60.11 2jch s THR 667 Cb -0.04 -3.14 0.44 0.00 1.34 0.00 0.00 72.50 71.10 2jch s THR 667 CO -0.01 -0.09 1.93 -0.65 -0.54 0.00 0.00 174.62 175.26 2jch h PRO 668 N 0.21 0.06 0.05 3.99 0.11 -1.80 -3.16 132.00 131.46 2jch h PRO 668 Ca -0.43 -0.00 -0.13 0.00 0.11 0.00 0.00 66.00 65.54 2jch h PRO 668 Cb 1.28 -0.01 -0.00 0.00 0.11 0.00 0.00 31.00 32.38 2jch h PRO 668 CO 0.53 0.04 -0.65 0.00 -0.21 0.00 0.00 178.00 177.71 2jch h ARG 669 N 0.07 0.11 -5.58 1.05 3.08 -1.89 -3.45 114.38 107.77 2jch h ARG 669 Ca 0.37 -0.19 -0.59 0.00 0.07 0.00 0.00 59.98 59.63 2jch h ARG 669 Cb 1.36 0.07 -0.13 0.00 0.08 0.00 0.00 29.97 31.35 2jch h ARG 669 CO -0.03 1.09 -0.61 -0.51 -1.07 0.00 0.00 179.97 178.84 2jch s LEU 670 N -7.96 2.69 -0.11 3.04 1.43 -1.20 -1.03 118.68 115.54 2jch s LEU 670 Ca -0.20 -1.35 -0.04 0.00 -1.03 0.00 0.00 54.13 51.51 2jch s LEU 670 Cb 0.01 -0.78 0.06 0.00 0.03 0.00 0.00 46.19 45.51 2jch s LEU 670 CO 0.72 -0.46 0.23 -0.89 0.23 0.00 0.00 176.35 176.18 2jch s THR 671 N -2.85 -0.31 -0.18 5.49 2.01 -0.99 -2.51 115.64 116.30 2jch s THR 671 Ca 0.35 0.27 -0.01 0.00 0.31 0.00 0.00 61.69 62.61 2jch s THR 671 Cb 0.09 -0.39 -0.00 0.00 0.01 0.00 0.00 72.50 72.21 2jch s THR 671 CO 0.17 0.11 -0.12 -0.22 -0.69 0.00 0.00 174.62 173.88 2jch s LEU 672 N 2.16 2.60 0.17 4.42 2.96 0.88 -2.23 118.68 129.63 2jch s LEU 672 Ca -0.00 -0.46 -0.09 0.00 -0.22 0.00 0.00 54.13 53.35 2jch s LEU 672 Cb -0.12 -1.62 -0.06 0.00 0.50 0.00 0.00 46.19 44.89 2jch s LEU 672 CO -0.08 0.03 0.48 -0.83 -1.32 0.00 0.00 176.35 174.63 2jch s GLY 673 N 1.14 2.31 -0.10 7.98 0.00 -0.79 -2.00 107.32 115.85 2jch s GLY 673 Ca 0.01 -0.35 -0.06 0.00 0.00 0.00 0.00 44.72 44.33 2jch s GLY 673 CO -0.04 -0.19 0.25 -0.32 0.00 0.00 0.00 173.10 172.80 2jch s GLY 674 N -2.17 -0.15 -0.03 0.20 0.00 -0.85 -2.89 107.32 101.43 2jch s GLY 674 Ca 0.42 0.95 0.07 0.00 0.00 0.00 0.00 44.72 46.16 2jch s GLY 674 CO 0.21 1.15 -0.24 0.86 0.00 0.00 0.00 173.10 175.08 2jch s TRP 675 N 1.07 2.24 0.24 1.90 -0.00 -0.97 -1.89 118.94 121.54 2jch s TRP 675 Ca -0.08 -0.51 0.12 0.00 -0.00 0.00 0.00 56.10 55.62 2jch s TRP 675 Cb -0.09 -1.46 -0.05 0.00 -0.00 0.00 0.00 33.47 31.88 2jch s TRP 675 CO -0.07 -0.10 -0.20 0.96 -0.00 0.00 0.00 176.95 177.53 2jch s ILE 676 N -0.41 2.49 -3.49 5.86 -4.36 -0.95 -1.94 121.20 118.40 2jch s ILE 676 Ca 0.05 -2.23 0.00 0.00 -0.26 0.00 0.00 60.65 58.21 2jch s ILE 676 Cb -0.11 -2.26 0.00 0.00 1.25 0.00 0.00 42.46 41.34 2jch s ILE 676 CO 0.01 -0.28 0.00 0.61 0.24 0.00 0.00 174.94 175.51 2jch n GLY 677 N -0.27 -1.70 3.68 6.27 0.00 -1.12 -2.40 105.19 109.66 2jch n GLY 677 Ca -0.08 -1.14 -0.35 0.00 0.00 0.00 0.00 46.02 44.44 2jch n GLY 677 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2jch s HIS 678 N -2.66 3.20 0.43 1.61 3.76 -1.26 0.39 115.29 120.75 2jch s HIS 678 Ca 0.00 0.18 0.14 0.00 -0.15 0.00 0.00 55.06 55.23 2jch s HIS 678 Cb 0.00 -1.83 1.01 0.00 1.11 0.00 0.00 32.58 32.87 2jch s HIS 678 CO 0.00 0.44 1.97 -0.44 -0.85 0.00 0.00 174.74 175.85 2jch h ASP 679 N 5.36 0.39 -0.38 1.40 3.32 -1.97 -2.22 116.42 122.32 2jch h ASP 679 Ca -0.49 0.01 -0.14 0.00 0.02 0.00 0.00 57.03 56.44 2jch h ASP 679 Cb 1.19 -0.07 -0.08 0.00 0.22 0.00 0.00 39.33 40.59 2jch h ASP 679 CO 0.56 0.23 0.17 -0.90 -1.72 0.00 0.00 179.24 177.59 2jch n ASP 680 N -4.47 3.30 -3.20 6.45 5.75 -1.26 -4.97 116.55 118.15 2jch n ASP 680 Ca 0.11 -2.62 -0.23 0.00 -0.01 0.00 0.00 54.79 52.04 2jch n ASP 680 Cb 0.39 -0.63 0.01 0.00 -1.03 0.00 0.00 41.12 39.87 2jch n ASP 680 CO 0.00 0.00 0.00 0.59 -0.11 0.00 0.00 177.20 177.68 2jch n ASN 681 N -0.03 -3.69 -4.12 -1.12 4.13 -0.84 -4.99 115.26 104.61 2jch n ASN 681 Ca 0.22 -0.47 -0.09 0.00 1.68 0.00 0.00 54.58 55.92 2jch n ASN 681 Cb 0.90 -1.16 -0.10 0.00 -1.54 0.00 0.00 39.78 37.88 2jch n ASN 681 CO 0.00 0.00 0.00 -1.38 0.28 0.00 0.00 177.26 176.16 2jch s HIS 682 N -2.02 0.66 0.40 3.10 -3.43 -1.26 -5.07 115.29 107.66 2jch s HIS 682 Ca 0.12 -0.98 -0.23 0.00 -0.80 0.00 0.00 55.06 53.17 2jch s HIS 682 Cb -0.01 -0.43 -0.13 0.00 -1.43 0.00 0.00 32.58 30.57 2jch s HIS 682 CO 0.65 -0.28 0.55 0.43 -2.00 0.00 0.00 174.74 174.09 2jch n SER 683 N 0.13 -0.85 -4.95 7.38 7.64 -1.26 -4.60 113.62 117.10 2jch n SER 683 Ca -0.14 0.94 -0.20 0.00 1.01 0.00 0.00 58.87 60.48 2jch n SER 683 Cb 0.61 -1.10 0.04 0.00 -1.01 0.00 0.00 64.21 62.74 2jch n SER 683 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 2jch s LEU 684 N 1.88 3.33 0.98 -3.43 1.43 0.04 -4.92 118.68 117.98 2jch s LEU 684 Ca 0.63 -0.28 -0.12 0.00 -1.03 0.00 0.00 54.13 53.33 2jch s LEU 684 Cb -0.63 -2.54 0.13 0.00 0.03 0.00 0.00 46.19 43.17 2jch s LEU 684 CO 0.58 -1.15 0.79 -1.54 0.23 0.00 0.00 176.35 175.26 2jch n SER 685 N -2.25 -0.97 -0.20 2.29 3.41 -1.26 -4.87 113.62 109.76 2jch n SER 685 Ca 0.10 0.27 -0.06 0.00 -0.26 0.00 0.00 58.87 58.92 2jch n SER 685 Cb 0.60 -1.32 0.04 0.00 -0.26 0.00 0.00 64.21 63.27 2jch n SER 685 CO 0.00 0.00 0.00 -0.61 -0.16 0.00 0.00 175.04 174.27 2jch h GLN 686 N -1.90 0.74 -0.78 4.33 4.15 -1.97 -3.14 115.11 116.53 2jch h GLN 686 Ca -0.46 -0.04 -0.22 0.00 0.77 0.00 0.00 58.65 58.69 2jch h GLN 686 Cb 1.29 -0.17 -0.13 0.00 0.21 0.00 0.00 27.48 28.68 2jch h GLN 686 CO 0.39 0.49 0.28 1.04 -1.93 0.00 0.00 178.83 179.11 2jch n GLN 687 N -4.70 3.59 -0.35 1.69 1.13 -1.26 -4.61 117.38 112.86 2jch n GLN 687 Ca 0.04 -2.94 -0.01 0.00 -1.94 0.00 0.00 57.00 52.15 2jch n GLN 687 Cb 0.04 -2.19 0.12 0.00 0.11 0.00 0.00 30.24 28.32 2jch n GLN 687 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 2jch h ALA 688 N 2.63 1.25 0.00 -1.58 0.00 -1.92 -2.29 119.26 117.34 2jch h ALA 688 Ca 0.27 -0.05 -0.08 0.00 0.00 0.00 0.00 54.91 55.05 2jch h ALA 688 Cb 2.31 -0.35 -0.01 0.00 0.00 0.00 0.00 17.79 19.73 2jch h ALA 688 CO 0.74 0.54 -0.49 0.78 0.00 0.00 0.00 179.25 180.82 2jch h GLY 689 N 1.24 0.00 -0.70 0.00 0.00 -1.86 0.13 103.07 101.87 2jch h GLY 689 Ca 0.37 0.00 0.16 0.00 0.00 0.00 0.00 47.33 47.86 2jch h GLY 689 CO -0.11 0.00 -0.23 -1.82 0.00 0.00 0.00 176.54 174.38 2jch h TYR 690 N -1.00 -0.53 0.00 5.60 3.20 -1.74 -3.22 116.97 119.28 2jch h TYR 690 Ca -0.12 0.08 0.00 0.00 3.14 0.00 0.00 58.73 61.82 2jch h TYR 690 Cb 0.98 0.36 0.00 0.00 1.54 0.00 0.00 36.73 39.61 2jch h TYR 690 CO 0.15 -0.37 -0.75 0.45 -1.64 0.00 0.00 178.16 176.00 2jch n SER 691 N -5.54 0.07 0.17 -2.11 2.88 -0.92 -1.35 113.62 106.82 2jch n SER 691 Ca 0.12 0.02 -0.14 0.00 -1.33 0.00 0.00 58.87 57.54 2jch n SER 691 Cb 0.42 -0.02 -0.08 0.00 -0.75 0.00 0.00 64.21 63.79 2jch n SER 691 CO 0.00 0.00 0.00 0.78 -1.23 0.00 0.00 175.04 174.59 2jch h ASN 692 N 0.00 -0.36 -0.52 -3.46 4.21 -1.16 -1.89 115.58 112.40 2jch h ASN 692 Ca 0.00 -0.15 -0.06 0.00 1.21 0.00 0.00 56.30 57.30 2jch h ASN 692 Cb 0.75 0.09 -0.02 0.00 -1.12 0.00 0.00 38.32 38.02 2jch h ASN 692 CO 0.00 -0.03 0.07 -1.13 -1.29 0.00 0.00 177.43 175.05 2jch h ASN 693 N -0.72 0.83 -1.01 5.81 -1.24 -0.88 -1.63 115.58 116.75 2jch h ASN 693 Ca -0.04 -0.27 0.14 0.00 0.71 0.00 0.00 56.30 56.84 2jch h ASN 693 Cb 0.49 -0.22 -0.09 0.00 0.73 0.00 0.00 38.32 39.23 2jch h ASN 693 CO 0.07 0.89 0.63 0.28 -1.29 0.00 0.00 177.43 178.01 2jch h SER 694 N 0.74 0.90 0.33 1.15 0.02 -1.62 0.14 113.55 115.21 2jch h SER 694 Ca 0.16 0.06 -0.33 0.00 -0.84 0.00 0.00 61.79 60.84 2jch h SER 694 Cb 0.42 -0.12 0.02 0.00 0.14 0.00 0.00 62.40 62.86 2jch h SER 694 CO 0.01 0.44 -1.53 -1.13 -1.14 0.00 0.00 176.83 173.48 2jch h ASN 695 N 0.94 0.65 0.43 3.07 -1.24 -1.02 -2.76 115.58 115.65 2jch h ASN 695 Ca 0.52 -0.79 -0.02 0.00 0.71 0.00 0.00 56.30 56.72 2jch h ASN 695 Cb 0.59 -0.21 0.00 0.00 0.73 0.00 0.00 38.32 39.43 2jch h ASN 695 CO -0.30 1.64 -0.21 0.22 -1.29 0.00 0.00 177.43 177.50 2jch h TYR 696 N 0.11 -0.53 -0.63 0.67 3.20 -1.15 -1.79 116.97 116.85 2jch h TYR 696 Ca -0.26 -0.01 0.17 0.00 3.14 0.00 0.00 58.73 61.77 2jch h TYR 696 Cb 2.10 0.18 -0.03 0.00 1.54 0.00 0.00 36.73 40.52 2jch h TYR 696 CO 0.10 -0.33 0.45 0.52 -1.64 0.00 0.00 178.16 177.26 2jch h MET 697 N -0.58 0.05 0.07 1.82 2.86 -0.77 0.19 114.93 118.58 2jch h MET 697 Ca -0.06 -0.00 -0.26 0.00 -2.06 0.00 0.00 59.70 57.32 2jch h MET 697 Cb 0.44 -0.01 -0.01 0.00 0.06 0.00 0.00 31.60 32.08 2jch h MET 697 CO 0.10 0.04 -1.25 0.00 1.06 0.00 0.00 176.91 176.85 2jch h ALA 698 N 1.69 0.28 -0.09 6.32 0.00 -1.26 0.59 119.26 126.78 2jch h ALA 698 Ca 0.30 -0.99 -0.13 0.00 0.00 0.00 0.00 54.91 54.09 2jch h ALA 698 Cb 1.13 0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.95 2jch h ALA 698 CO -0.02 1.16 -0.53 0.45 0.00 0.00 0.00 179.25 180.31 2jch h HIS 699 N 0.04 0.33 -0.02 0.00 -0.00 -0.22 -2.83 115.15 112.45 2jch h HIS 699 Ca -0.12 -0.11 -0.00 0.00 -0.00 0.00 0.00 60.37 60.13 2jch h HIS 699 Cb 1.91 -0.06 -0.00 0.00 -0.00 0.00 0.00 27.41 29.26 2jch h HIS 699 CO 0.04 0.74 -0.00 1.25 -0.00 0.00 0.00 177.93 179.95 2jch h LEU 700 N 0.21 0.03 -1.25 2.43 5.85 -0.30 -2.35 115.31 119.93 2jch h LEU 700 Ca 0.01 -0.35 0.17 0.00 0.84 0.00 0.00 57.88 58.54 2jch h LEU 700 Cb 1.00 -0.01 -0.08 0.00 0.37 0.00 0.00 40.66 41.94 2jch h LEU 700 CO 0.08 0.37 0.60 0.58 -0.34 0.00 0.00 178.44 179.73 2jch h VAL 701 N -0.31 0.77 0.04 1.05 2.07 -0.90 -1.24 116.25 117.73 2jch h VAL 701 Ca 0.00 -0.23 -0.00 0.00 0.82 0.00 0.00 66.70 67.29 2jch h VAL 701 Cb 0.36 0.05 0.00 0.00 -1.52 0.00 0.00 31.29 30.18 2jch h VAL 701 CO 0.00 0.12 -0.02 -1.13 0.02 0.00 0.00 177.57 176.56 2jch h ASN 702 N 0.66 -0.05 -0.70 0.57 -1.24 -1.38 -2.65 115.58 110.80 2jch h ASN 702 Ca 0.49 -0.26 0.16 0.00 0.71 0.00 0.00 56.30 57.40 2jch h ASN 702 Cb 0.86 0.01 -0.13 0.00 0.73 0.00 0.00 38.32 39.79 2jch h ASN 702 CO -0.25 0.57 -0.11 0.00 -1.29 0.00 0.00 177.43 176.35 2jch n ALA 703 N -2.72 0.23 -0.31 1.57 0.00 -0.90 -0.42 120.51 117.97 2jch n ALA 703 Ca -0.03 0.76 -0.02 0.00 0.00 0.00 0.00 53.44 54.14 2jch n ALA 703 Cb 0.15 -0.49 0.13 0.00 0.00 0.00 0.00 19.45 19.24 2jch n ALA 703 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.50 178.32 2jch h ILE 704 N 0.00 1.24 -0.14 0.00 2.04 -1.13 -2.89 117.51 116.63 2jch h ILE 704 Ca 0.37 -0.56 -0.20 0.00 1.00 0.00 0.00 64.86 65.47 2jch h ILE 704 Cb 0.64 0.03 0.00 0.00 -0.74 0.00 0.00 36.82 36.75 2jch h ILE 704 CO -0.70 0.26 -0.72 -0.61 0.00 0.00 0.00 178.15 176.39 2jch h GLN 705 N 1.21 0.64 -0.00 2.37 -0.00 -0.59 -2.69 115.11 116.05 2jch h GLN 705 Ca 0.31 -0.50 0.00 0.00 -0.00 0.00 0.00 58.65 58.46 2jch h GLN 705 Cb -0.03 0.10 -0.00 0.00 0.00 0.00 0.00 27.48 27.55 2jch h GLN 705 CO -0.06 1.12 0.01 1.96 0.00 0.00 0.00 178.83 181.87 2jch h GLN 706 N 0.45 0.00 -0.00 1.69 1.08 -0.53 -2.51 115.11 115.29 2jch h GLN 706 Ca -0.03 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.17 2jch h GLN 706 Cb 1.31 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.74 2jch h GLN 706 CO 0.14 0.00 -0.54 0.00 -0.95 0.00 0.00 178.83 177.48 2jch n ALA 707 N -2.13 3.52 -3.26 3.87 0.00 -1.16 -4.75 120.51 116.60 2jch n ALA 707 Ca -0.03 -0.35 -0.06 0.00 0.00 0.00 0.00 53.44 53.00 2jch n ALA 707 Cb 0.09 -0.44 -0.04 0.00 0.00 0.00 0.00 19.45 19.06 2jch n ALA 707 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 2jch s SER 708 N -2.09 -0.45 0.55 0.00 0.15 -0.98 -4.71 113.70 106.18 2jch s SER 708 Ca 0.05 -1.14 0.25 0.00 0.70 0.00 0.00 55.95 55.81 2jch s SER 708 Cb 0.09 1.39 1.56 0.00 -1.71 0.00 0.00 66.02 67.36 2jch s SER 708 CO 0.48 -0.20 2.17 -0.65 1.20 0.00 0.00 173.24 176.23 2jch h PRO 709 N 6.96 0.00 -0.21 5.44 0.11 -1.77 -2.98 132.00 139.55 2jch h PRO 709 Ca 0.05 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.16 2jch h PRO 709 Cb 1.13 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.24 2jch h PRO 709 CO 0.14 0.05 0.00 0.43 -0.21 0.00 0.00 178.00 178.41 2jch n SER 710 N -3.95 2.66 -0.06 -2.05 7.64 -1.26 -4.73 113.62 111.86 2jch n SER 710 Ca -0.03 -1.78 0.01 0.00 1.01 0.00 0.00 58.87 58.08 2jch n SER 710 Cb 0.14 -0.13 0.30 0.00 -1.01 0.00 0.00 64.21 63.51 2jch n SER 710 CO 0.00 0.00 0.00 -0.29 -3.01 0.00 0.00 175.04 171.74 2jch h ILE 711 N 2.77 1.18 0.00 0.44 6.09 -1.89 -3.01 117.51 123.08 2jch h ILE 711 Ca 0.00 -0.56 -0.07 0.00 -1.37 0.00 0.00 64.86 62.86 2jch h ILE 711 Cb 0.69 0.63 -0.01 0.00 0.47 0.00 0.00 36.82 38.61 2jch h ILE 711 CO 0.00 0.22 -0.32 -0.50 -3.07 0.00 0.00 178.15 174.48 2jch h TRP 712 N 0.66 0.00 0.00 2.19 4.06 -1.85 -3.43 115.95 117.59 2jch h TRP 712 Ca 0.16 0.00 0.00 0.00 2.06 0.00 0.00 58.89 61.11 2jch h TRP 712 Cb 0.15 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 28.31 2jch h TRP 712 CO 0.01 0.32 0.00 0.41 -3.56 0.00 0.00 178.44 175.61 2jch n GLY 713 N 0.04 -2.12 0.15 1.49 0.00 -1.14 -4.20 105.19 99.41 2jch n GLY 713 Ca -0.01 -1.49 0.02 0.00 0.00 0.00 0.00 46.02 44.54 2jch n GLY 713 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2jch n ASN 714 N -2.15 1.16 -4.66 1.61 3.02 -1.26 -4.84 115.26 108.13 2jch n ASN 714 Ca 0.00 -1.08 -0.30 0.00 -0.03 0.00 0.00 54.58 53.17 2jch n ASN 714 Cb 0.00 0.19 0.17 0.00 -0.61 0.00 0.00 39.78 39.52 2jch n ASN 714 CO 0.00 0.00 0.00 -1.61 -2.62 0.00 0.00 177.26 173.03 2jch s GLU 715 N -0.57 0.81 -0.04 3.52 8.01 -1.26 -4.85 118.70 124.31 2jch s GLU 715 Ca 0.05 1.07 0.05 0.00 0.01 0.00 0.00 54.97 56.15 2jch s GLU 715 Cb 0.04 -1.74 -0.02 0.00 -4.31 0.00 0.00 34.13 28.09 2jch s GLU 715 CO 0.08 -2.62 -0.18 1.03 0.01 0.00 0.00 175.26 173.59 2jch s ARG 716 N -4.75 2.40 0.34 1.61 1.81 -1.26 -4.30 118.95 114.81 2jch s ARG 716 Ca 0.65 -0.76 -0.27 0.00 -1.72 0.00 0.00 55.73 53.63 2jch s ARG 716 Cb -0.21 -2.29 -0.09 0.00 -0.45 0.00 0.00 34.95 31.91 2jch s ARG 716 CO 0.59 0.60 1.10 -0.06 -0.68 0.00 0.00 175.30 176.85 2jch s PHE 717 N -0.69 3.38 -0.09 -0.53 0.08 -1.26 -4.98 117.98 113.89 2jch s PHE 717 Ca 0.11 1.65 -0.08 0.00 0.12 0.00 0.00 56.93 58.73 2jch s PHE 717 Cb -0.10 -3.26 0.03 0.00 -0.57 0.00 0.00 43.02 39.11 2jch s PHE 717 CO 0.00 -0.73 0.23 0.00 -0.10 0.00 0.00 175.22 174.62 2jch s ALA 718 N -1.36 -0.57 0.17 5.36 0.00 -1.26 -5.04 121.76 119.06 2jch s ALA 718 Ca 0.51 0.70 -0.32 0.00 0.00 0.00 0.00 51.96 52.84 2jch s ALA 718 Cb -0.29 -0.41 -0.16 0.00 0.00 0.00 0.00 23.12 22.26 2jch s ALA 718 CO 0.37 -0.12 1.02 1.28 0.00 0.00 0.00 175.76 178.30 2jch n LEU 719 N 3.14 0.87 -4.77 0.00 4.32 -1.26 -4.88 117.00 114.41 2jch n LEU 719 Ca -0.14 1.15 -0.40 0.00 -0.02 0.00 0.00 56.01 56.60 2jch n LEU 719 Cb 0.58 -1.14 -0.03 0.00 -1.62 0.00 0.00 43.42 41.21 2jch n LEU 719 CO 0.18 -1.69 0.88 -0.62 -1.22 0.00 0.00 177.39 174.92 2jch s ASP 720 N -0.25 6.78 0.58 -1.43 2.15 -1.26 -4.92 116.67 118.32 2jch s ASP 720 Ca 0.72 2.45 0.32 0.00 0.43 0.00 0.00 52.55 56.48 2jch s ASP 720 Cb -0.90 -2.63 1.39 0.00 -0.30 0.00 0.00 42.92 40.48 2jch s ASP 720 CO 0.54 -0.50 1.70 -0.65 -0.17 0.00 0.00 175.17 176.09 2jch h PRO 721 N 3.18 0.00 0.00 4.34 0.11 -1.97 -0.38 132.00 137.28 2jch h PRO 721 Ca -0.48 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.63 2jch h PRO 721 Cb 1.23 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.34 2jch h PRO 721 CO 0.65 0.00 0.00 -1.13 -0.21 0.00 0.00 178.00 177.31 2jch n SER 722 N -3.76 0.15 -4.77 -2.05 3.41 -1.26 -4.85 113.62 100.49 2jch n SER 722 Ca 0.20 0.51 -0.41 0.00 -0.26 0.00 0.00 58.87 58.91 2jch n SER 722 Cb 1.16 -0.55 -0.01 0.00 -0.26 0.00 0.00 64.21 64.55 2jch n SER 722 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 2jch s VAL 723 N -3.02 2.05 -0.37 -3.33 1.01 -0.16 -4.92 120.40 111.66 2jch s VAL 723 Ca 0.13 0.05 -0.13 0.00 0.00 0.00 0.00 61.98 62.02 2jch s VAL 723 Cb 0.17 -3.03 0.00 0.00 0.00 0.00 0.00 36.38 33.53 2jch s VAL 723 CO 0.53 0.01 0.26 -0.69 0.00 0.00 0.00 175.10 175.21 2jch s VAL 724 N -0.71 5.18 -0.13 2.92 1.01 -0.89 -4.95 120.40 122.83 2jch s VAL 724 Ca 0.57 -0.46 -0.26 0.00 0.00 0.00 0.00 61.98 61.83 2jch s VAL 724 Cb -0.47 -3.77 -0.02 0.00 0.00 0.00 0.00 36.38 32.12 2jch s VAL 724 CO 0.58 -0.15 0.83 -0.54 0.00 0.00 0.00 175.10 175.81 2jch s LYS 725 N 1.69 4.36 0.19 2.72 1.02 -1.26 -0.90 119.74 127.55 2jch s LYS 725 Ca 0.05 1.05 0.09 0.00 0.02 0.00 0.00 55.97 57.17 2jch s LYS 725 Cb -0.18 -3.53 -0.04 0.00 -0.52 0.00 0.00 37.83 33.55 2jch s LYS 725 CO 0.10 -0.21 -0.07 -1.12 -0.92 0.00 0.00 175.35 173.13 2jch s SER 726 N 1.06 4.38 -0.46 2.83 0.01 0.32 -4.90 113.70 116.94 2jch s SER 726 Ca 0.40 -0.55 -0.16 0.00 1.31 0.00 0.00 55.95 56.95 2jch s SER 726 Cb -0.17 -0.79 0.06 0.00 0.21 0.00 0.00 66.02 65.33 2jch s SER 726 CO 0.16 0.09 0.39 -0.70 0.41 0.00 0.00 173.24 173.59 2jch s GLU 727 N -2.95 2.99 0.33 12.44 2.12 -1.26 -0.74 118.70 131.63 2jch s GLU 727 Ca 0.26 -1.27 0.10 0.00 0.36 0.00 0.00 54.97 54.42 2jch s GLU 727 Cb -0.09 -4.10 -0.06 0.00 0.26 0.00 0.00 34.13 30.14 2jch s GLU 727 CO 0.16 -0.99 -0.09 0.14 -0.54 0.00 0.00 175.26 173.95 2jch s VAL 728 N 1.70 2.37 0.13 3.70 -7.23 -0.43 -4.58 120.40 116.06 2jch s VAL 728 Ca 0.05 -2.18 -0.30 0.00 -1.81 0.00 0.00 61.98 57.73 2jch s VAL 728 Cb -0.23 -2.63 -0.07 0.00 0.56 0.00 0.00 36.38 34.01 2jch s VAL 728 CO 0.08 -0.23 1.13 -0.76 -0.31 0.00 0.00 175.10 175.00 2jch s LEU 729 N -3.62 4.44 0.48 1.32 1.43 0.02 -1.28 118.68 121.47 2jch s LEU 729 Ca 0.33 2.04 0.33 0.00 -1.03 0.00 0.00 54.13 55.79 2jch s LEU 729 Cb 0.01 -3.59 1.45 0.00 0.03 0.00 0.00 46.19 44.08 2jch s LEU 729 CO 0.17 -0.31 1.71 0.11 0.23 0.00 0.00 176.35 178.25 2jch h LYS 730 N 5.81 0.11 0.00 1.70 1.57 -1.64 0.34 116.57 124.46 2jch h LYS 730 Ca -0.43 -0.01 -0.19 0.00 -1.87 0.00 0.00 60.65 58.15 2jch h LYS 730 Cb 1.21 -0.02 -0.03 0.00 0.08 0.00 0.00 32.23 33.47 2jch h LYS 730 CO 0.76 0.07 -1.35 0.66 -0.57 0.00 0.00 179.45 179.02 2jch h SER 731 N 0.11 0.00 0.00 0.86 4.64 -1.91 -3.38 113.55 113.88 2jch h SER 731 Ca 0.70 0.00 -0.14 0.00 -0.47 0.00 0.00 61.79 61.89 2jch h SER 731 Cb 2.43 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 64.50 2jch h SER 731 CO -0.19 0.70 -1.51 0.35 -0.87 0.00 0.00 176.83 175.32 2jch n THR 732 N -3.00 0.51 -0.49 2.95 -2.24 -1.12 -4.99 114.28 105.90 2jch n THR 732 Ca -0.09 -0.32 0.00 0.00 -2.27 0.00 0.00 64.05 61.37 2jch n THR 732 Cb 0.89 -0.80 0.00 0.00 -2.10 0.00 0.00 70.33 68.32 2jch n THR 732 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2jch n GLY 733 N 2.54 1.90 3.81 3.38 0.00 0.12 -4.24 105.19 112.69 2jch n GLY 733 Ca -0.12 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.67 2jch n GLY 733 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2jch s GLN 734 N -0.03 2.42 0.65 1.61 -0.21 -1.26 -4.50 119.66 118.34 2jch s GLN 734 Ca 0.00 -1.63 -0.18 0.00 0.02 0.00 0.00 55.36 53.58 2jch s GLN 734 Cb 0.00 -2.22 -0.01 0.00 1.00 0.00 0.00 33.01 31.78 2jch s GLN 734 CO 0.00 -0.10 1.27 0.15 -2.12 0.00 0.00 175.29 174.50 2jch s LYS 735 N -4.00 2.55 0.84 2.91 1.02 -0.57 -0.80 119.74 121.69 2jch s LYS 735 Ca 0.44 2.00 -0.12 0.00 0.02 0.00 0.00 55.97 58.31 2jch s LYS 735 Cb -0.01 -1.85 0.09 0.00 -0.52 0.00 0.00 37.83 35.54 2jch s LYS 735 CO 0.25 -1.58 1.13 -2.14 -0.92 0.00 0.00 175.35 172.09 2jch s PRO 736 N -3.43 1.75 0.00 -1.68 0.02 -1.26 -2.36 135.00 128.04 2jch s PRO 736 Ca 0.81 0.40 0.00 0.00 0.02 0.00 0.00 61.00 62.23 2jch s PRO 736 Cb -0.36 -1.90 0.00 0.00 0.02 0.00 0.00 34.50 32.26 2jch s PRO 736 CO 0.39 -1.80 0.00 0.41 -0.33 0.00 0.00 177.00 175.67 2jch n GLY 737 N -2.40 -1.78 3.80 0.52 0.00 -1.14 -4.70 105.19 99.49 2jch n GLY 737 Ca 0.07 -1.25 -0.37 0.00 0.00 0.00 0.00 46.02 44.46 2jch n GLY 737 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2jch s LYS 738 N -1.99 4.02 -0.00 1.61 1.02 -1.26 0.96 119.74 124.10 2jch s LYS 738 Ca 0.00 0.29 0.01 0.00 0.02 0.00 0.00 55.97 56.29 2jch s LYS 738 Cb 0.00 -3.30 -0.00 0.00 -0.52 0.00 0.00 37.83 34.01 2jch s LYS 738 CO 0.00 0.51 -0.02 0.08 -0.92 0.00 0.00 175.35 175.00 2jch s VAL 739 N -0.43 0.13 -0.99 3.17 1.01 0.73 -4.89 120.40 119.13 2jch s VAL 739 Ca 0.22 -0.07 -0.23 0.00 0.00 0.00 0.00 61.98 61.89 2jch s VAL 739 Cb -0.15 -0.12 -0.01 0.00 0.00 0.00 0.00 36.38 36.10 2jch s VAL 739 CO 0.10 0.04 1.74 -0.94 0.00 0.00 0.00 175.10 176.04 2jch s SER 740 N -0.03 5.75 -0.76 3.32 1.04 -1.26 0.24 113.70 122.00 2jch s SER 740 Ca 0.01 -1.13 -0.25 0.00 0.48 0.00 0.00 55.95 55.05 2jch s SER 740 Cb -0.01 -2.57 0.05 0.00 0.10 0.00 0.00 66.02 63.59 2jch s SER 740 CO -0.00 -2.21 1.21 -0.69 0.98 0.00 0.00 173.24 172.53 2jch s VAL 741 N 7.87 3.95 -1.11 5.02 1.01 -1.26 -3.70 120.40 132.17 2jch s VAL 741 Ca 0.60 -0.01 -0.26 0.00 0.00 0.00 0.00 61.98 62.30 2jch s VAL 741 Cb -0.03 -4.87 0.04 0.00 0.00 0.00 0.00 36.38 31.52 2jch s VAL 741 CO -0.03 -1.75 0.66 -1.84 0.00 0.00 0.00 175.10 172.14 2jch n GLU 742 N 8.75 -0.55 -2.18 2.72 0.28 -1.26 -4.33 120.64 124.07 2jch n GLU 742 Ca 0.05 0.24 0.00 0.00 -0.16 0.00 0.00 57.16 57.29 2jch n GLU 742 Cb 0.48 -2.37 0.00 0.00 1.43 0.00 0.00 31.44 30.98 2jch n GLU 742 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 2jch n GLY 743 N -1.99 -3.47 0.00 -1.84 0.00 -1.24 -5.01 105.19 91.64 2jch n GLY 743 Ca -0.17 0.04 0.00 0.00 0.00 0.00 0.00 46.02 45.89 2jch n GLY 743 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2jch n LYS 744 N 1.91 0.00 0.00 1.61 5.02 -1.26 -5.07 118.16 120.36 2jch n LYS 744 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.29 2jch n LYS 744 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.01 2jch n LYS 744 CO 0.00 0.00 0.00 -1.91 -0.52 0.00 0.00 177.40 174.97 2jch n GLU 745 N 0.00 0.00 -3.03 1.97 4.07 -1.26 -4.27 120.64 118.12 2jch n GLU 745 Ca 0.00 0.00 -0.34 0.00 -0.06 0.00 0.00 57.16 56.76 2jch n GLU 745 Cb 0.00 0.00 -0.06 0.00 -0.06 0.00 0.00 31.44 31.32 2jch n GLU 745 CO 0.00 0.00 0.00 0.08 -0.06 0.00 0.00 177.13 177.15 2jch s VAL 746 N 0.00 4.54 -0.53 6.31 1.01 0.14 -4.85 120.40 127.01 2jch s VAL 746 Ca 0.00 1.25 -0.18 0.00 0.00 0.00 0.00 61.98 63.05 2jch s VAL 746 Cb 0.00 -3.73 0.09 0.00 0.00 0.00 0.00 36.38 32.74 2jch s VAL 746 CO 0.00 -0.06 0.58 -0.70 0.00 0.00 0.00 175.10 174.92 2jch s GLU 747 N -2.62 3.04 -0.24 2.72 2.56 -1.26 -0.19 118.70 122.72 2jch s GLU 747 Ca 0.52 -1.27 -0.14 0.00 0.00 0.00 0.00 54.97 54.08 2jch s GLU 747 Cb -0.13 -4.19 -0.04 0.00 2.00 0.00 0.00 34.13 31.77 2jch s GLU 747 CO 0.18 -1.30 0.34 0.08 -0.56 0.00 0.00 175.26 174.00 2jch s VAL 748 N 2.26 5.22 0.17 3.70 1.01 0.27 -4.98 120.40 128.05 2jch s VAL 748 Ca 0.09 0.55 -0.01 0.00 0.00 0.00 0.00 61.98 62.61 2jch s VAL 748 Cb -0.24 -3.67 -0.04 0.00 0.00 0.00 0.00 36.38 32.43 2jch s VAL 748 CO 0.07 0.23 0.10 0.28 0.00 0.00 0.00 175.10 175.78 2jch s THR 749 N 1.61 0.05 -2.92 3.92 -1.32 -1.26 -2.87 115.64 112.86 2jch s THR 749 Ca 0.15 -1.94 0.00 0.00 -1.21 0.00 0.00 61.69 58.69 2jch s THR 749 Cb -0.15 -2.29 0.00 0.00 -1.51 0.00 0.00 72.50 68.55 2jch s THR 749 CO 0.08 -0.21 0.00 0.61 -2.21 0.00 0.00 174.62 172.89 2jch n GLY 750 N -0.19 0.78 3.76 6.08 0.00 -1.26 -5.06 105.19 109.31 2jch n GLY 750 Ca -0.01 -2.09 -0.38 0.00 0.00 0.00 0.00 46.02 43.54 2jch n GLY 750 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2jch s SER 751 N -2.49 5.98 0.41 1.61 1.04 -1.26 -4.91 113.70 114.08 2jch s SER 751 Ca 0.00 2.47 0.07 0.00 0.48 0.00 0.00 55.95 58.98 2jch s SER 751 Cb 0.00 -2.62 -0.06 0.00 0.10 0.00 0.00 66.02 63.44 2jch s SER 751 CO 0.00 -1.06 0.12 0.42 0.98 0.00 0.00 173.24 173.70 2jch s THR 752 N -1.44 2.23 -0.06 2.02 -4.23 -1.26 -1.79 115.64 111.12 2jch s THR 752 Ca 0.64 -1.81 -0.18 0.00 -1.18 0.00 0.00 61.69 59.16 2jch s THR 752 Cb -0.33 -2.99 0.04 0.00 1.34 0.00 0.00 72.50 70.56 2jch s THR 752 CO 0.40 -0.01 0.42 0.54 -0.54 0.00 0.00 174.62 175.43 2jch s VAL 753 N -2.63 0.03 0.20 2.29 0.11 -0.40 -4.74 120.40 115.26 2jch s VAL 753 Ca 0.39 -0.26 -0.30 0.00 -2.93 0.00 0.00 61.98 58.88 2jch s VAL 753 Cb 0.06 -0.69 -0.08 0.00 -1.53 0.00 0.00 36.38 34.13 2jch s VAL 753 CO 0.21 -0.14 1.11 -0.89 -3.33 0.00 0.00 175.10 172.05 2jch s THR 754 N -0.92 3.75 -0.07 5.04 2.01 -1.26 -1.32 115.64 122.87 2jch s THR 754 Ca -0.10 1.57 0.01 0.00 0.31 0.00 0.00 61.69 63.48 2jch s THR 754 Cb -0.04 -4.00 0.02 0.00 0.01 0.00 0.00 72.50 68.49 2jch s THR 754 CO 0.05 0.29 -0.10 -0.55 -0.69 0.00 0.00 174.62 173.62 2jch s SER 755 N -0.28 1.74 -0.07 3.53 0.15 0.08 -4.79 113.70 114.06 2jch s SER 755 Ca 0.48 -0.27 -0.13 0.00 0.70 0.00 0.00 55.95 56.73 2jch s SER 755 Cb -0.30 -0.77 -0.05 0.00 -1.71 0.00 0.00 66.02 63.19 2jch s SER 755 CO 0.36 -0.01 0.33 -0.31 1.20 0.00 0.00 173.24 174.81 2jch s TYR 756 N 0.93 3.63 0.05 3.44 2.02 -1.26 -0.52 117.35 125.64 2jch s TYR 756 Ca -0.10 0.80 0.04 0.00 -0.37 0.00 0.00 57.07 57.44 2jch s TYR 756 Cb -0.15 -2.24 -0.02 0.00 -0.40 0.00 0.00 41.96 39.15 2jch s TYR 756 CO 0.01 0.54 -0.11 -1.58 -1.57 0.00 0.00 175.55 172.84 2jch s TRP 757 N -0.62 0.99 -0.31 2.71 0.52 -0.08 0.27 118.94 122.43 2jch s TRP 757 Ca 0.20 -0.41 0.16 0.00 0.02 0.00 0.00 56.10 56.07 2jch s TRP 757 Cb -0.15 -0.58 0.61 0.00 -1.15 0.00 0.00 33.47 32.20 2jch s TRP 757 CO 0.09 0.00 1.52 0.00 0.02 0.00 0.00 176.95 178.58 2jch n ALA 758 N 1.65 3.20 -1.79 0.98 0.00 -1.26 -2.10 120.51 121.19 2jch n ALA 758 Ca -0.20 -2.09 0.00 0.00 0.00 0.00 0.00 53.44 51.15 2jch n ALA 758 Cb 0.55 -0.83 0.00 0.00 0.00 0.00 0.00 19.45 19.17 2jch n ALA 758 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.50 177.77 2jch n ASN 759 N -0.03 0.00 -0.11 0.00 0.23 -1.26 -4.76 115.26 109.34 2jch n ASN 759 Ca 0.23 0.00 -0.21 0.00 -0.53 0.00 0.00 54.58 54.06 2jch n ASN 759 Cb 0.95 0.00 -0.12 0.00 -2.08 0.00 0.00 39.78 38.53 2jch n ASN 759 CO 0.00 0.00 0.00 2.29 -0.93 0.00 0.00 177.26 178.62 2jch n LYS 760 N 0.00 0.65 -0.31 -3.83 0.00 -1.26 -4.70 118.16 108.71 2jch n LYS 760 Ca 0.00 0.22 0.10 0.00 -0.00 0.00 0.00 58.31 58.63 2jch n LYS 760 Cb 0.00 -1.56 0.27 0.00 -0.00 0.00 0.00 35.03 33.74 2jch n LYS 760 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.40 176.27 2jch n SER 761 N -3.58 3.66 0.00 -5.58 3.41 -1.26 -5.03 113.62 105.24 2jch n SER 761 Ca -0.45 -1.99 0.00 0.00 -0.26 0.00 0.00 58.87 56.17 2jch n SER 761 Cb 0.96 -0.41 0.00 0.00 -0.26 0.00 0.00 64.21 64.50 2jch n SER 761 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2jch n GLY 762 N 1.36 1.88 3.77 5.00 0.00 -1.26 -4.85 105.19 111.08 2jch n GLY 762 Ca 0.21 -0.50 -0.38 0.00 0.00 0.00 0.00 46.02 45.35 2jch n GLY 762 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2jch s ALA 763 N -1.99 3.30 1.07 4.61 0.00 -1.26 -4.96 121.76 122.52 2jch s ALA 763 Ca 0.00 0.52 -0.06 0.00 0.00 0.00 0.00 51.96 52.42 2jch s ALA 763 Cb 0.00 -3.15 0.09 0.00 0.00 0.00 0.00 23.12 20.06 2jch s ALA 763 CO 0.00 0.21 0.34 -0.35 0.00 0.00 0.00 175.76 175.96 2jch n PRO 764 N 1.06 -1.52 -2.77 0.00 -0.04 -1.26 -4.68 135.00 125.80 2jch n PRO 764 Ca -0.01 -0.54 -0.30 0.00 -0.04 0.00 0.00 63.50 62.61 2jch n PRO 764 Cb 0.49 -0.48 -0.03 0.00 -0.04 0.00 0.00 33.50 33.43 2jch n PRO 764 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2jch s ALA 765 N -3.10 3.31 0.10 0.55 0.00 -1.26 -1.51 121.76 119.84 2jch s ALA 765 Ca 0.21 -0.15 -0.31 0.00 0.00 0.00 0.00 51.96 51.71 2jch s ALA 765 Cb -0.02 -2.76 -0.09 0.00 0.00 0.00 0.00 23.12 20.25 2jch s ALA 765 CO 0.16 -0.06 1.62 0.99 0.00 0.00 0.00 175.76 178.48 2jch s THR 766 N -2.43 2.92 0.54 0.00 2.01 -1.00 -4.68 115.64 113.00 2jch s THR 766 Ca 0.52 0.48 0.05 0.00 0.31 0.00 0.00 61.69 63.05 2jch s THR 766 Cb -0.10 -3.31 0.05 0.00 0.01 0.00 0.00 72.50 69.14 2jch s THR 766 CO 0.32 0.01 0.39 -1.54 -0.69 0.00 0.00 174.62 173.11 2jch n SER 767 N 5.08 2.76 0.01 3.53 3.41 -1.26 -4.78 113.62 122.38 2jch n SER 767 Ca 0.15 -2.87 -0.18 0.00 -0.26 0.00 0.00 58.87 55.70 2jch n SER 767 Cb 0.40 -0.02 -0.11 0.00 -0.26 0.00 0.00 64.21 64.22 2jch n SER 767 CO 0.00 0.00 0.00 0.22 -0.16 0.00 0.00 175.04 175.10 2jch h TYR 768 N 0.69 0.78 -0.66 7.33 5.03 -1.94 -3.28 116.97 124.92 2jch h TYR 768 Ca -0.35 -0.42 -0.70 0.00 2.58 0.00 0.00 58.73 59.85 2jch h TYR 768 Cb 1.25 -0.09 -0.08 0.00 1.55 0.00 0.00 36.73 39.36 2jch h TYR 768 CO 0.00 1.24 2.48 0.54 -1.32 0.00 0.00 178.16 181.10 2jch n ARG 769 N -4.08 3.11 0.08 1.82 1.74 -1.26 -4.83 116.66 113.24 2jch n ARG 769 Ca -0.10 -3.09 -0.20 0.00 -0.77 0.00 0.00 57.85 53.68 2jch n ARG 769 Cb 0.75 -3.37 -0.15 0.00 -1.02 0.00 0.00 32.46 28.67 2jch n ARG 769 CO 0.00 0.00 0.00 0.27 -1.52 0.00 0.00 177.63 176.38 2jch h PHE 770 N 6.90 0.64 -4.19 -1.55 -0.00 -1.91 -3.47 116.94 113.36 2jch h PHE 770 Ca 0.48 -0.47 -0.50 0.00 -0.00 0.00 0.00 57.97 57.48 2jch h PHE 770 Cb 0.78 -0.03 0.15 0.00 -0.00 0.00 0.00 35.95 36.85 2jch h PHE 770 CO 1.41 1.52 0.27 0.00 -0.00 0.00 0.00 178.31 181.51 2jch s ALA 771 N -2.60 1.78 -0.28 12.09 0.00 -1.26 -4.74 121.76 126.75 2jch s ALA 771 Ca -0.11 0.22 -0.29 0.00 0.00 0.00 0.00 51.96 51.77 2jch s ALA 771 Cb 0.06 -3.28 0.01 0.00 0.00 0.00 0.00 23.12 19.90 2jch s ALA 771 CO 0.87 -2.22 1.18 0.42 0.00 0.00 0.00 175.76 176.02 2jch s ILE 772 N -2.84 4.35 0.00 0.00 -1.09 -0.83 -4.92 121.20 115.87 2jch s ILE 772 Ca 0.63 1.56 0.00 0.00 -2.23 0.00 0.00 60.65 60.61 2jch s ILE 772 Cb -0.19 -4.25 0.00 0.00 -1.58 0.00 0.00 42.46 36.44 2jch s ILE 772 CO 0.57 -0.41 0.00 0.61 -1.23 0.00 0.00 174.94 174.48 2jch n GLY 773 N 3.96 -2.37 0.00 6.18 0.00 -1.26 0.30 105.19 112.01 2jch n GLY 773 Ca 0.13 -1.57 0.00 0.00 0.00 0.00 0.00 46.02 44.58 2jch n GLY 773 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2jch n GLY 774 N -0.59 2.94 3.93 -0.02 0.00 -1.26 -4.53 105.19 105.67 2jch n GLY 774 Ca 0.00 -1.65 -0.25 0.00 0.00 0.00 0.00 46.02 44.12 2jch n GLY 774 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2jch s SER 775 N 0.00 6.32 0.28 1.61 1.04 -1.26 -4.95 113.70 116.73 2jch s SER 775 Ca 0.00 0.54 0.01 0.00 0.48 0.00 0.00 55.95 56.98 2jch s SER 775 Cb 0.00 -2.07 0.65 0.00 0.10 0.00 0.00 66.02 64.70 2jch s SER 775 CO 0.00 -0.30 1.67 0.44 0.98 0.00 0.00 173.24 176.03 2jch h ASP 776 N 0.87 0.09 -0.39 7.02 3.32 -1.99 0.57 116.42 125.91 2jch h ASP 776 Ca -0.49 0.17 0.08 0.00 0.02 0.00 0.00 57.03 56.81 2jch h ASP 776 Cb 1.21 0.21 -0.07 0.00 0.22 0.00 0.00 39.33 40.90 2jch h ASP 776 CO 0.62 -0.08 -0.10 0.00 -1.72 0.00 0.00 179.24 177.96 2jch h ALA 777 N 1.72 0.25 -0.29 3.45 0.00 -1.99 -0.08 119.26 122.33 2jch h ALA 777 Ca 0.52 0.15 0.07 0.00 0.00 0.00 0.00 54.91 55.64 2jch h ALA 777 Cb 0.99 0.30 -0.07 0.00 0.00 0.00 0.00 17.79 19.01 2jch h ALA 777 CO -0.58 -0.46 -0.17 -0.44 0.00 0.00 0.00 179.25 177.61 2jch h ASP 778 N -0.00 -0.55 0.94 0.00 3.32 -1.31 -1.89 116.42 116.92 2jch h ASP 778 Ca 0.19 0.12 -0.02 0.00 0.02 0.00 0.00 57.03 57.34 2jch h ASP 778 Cb 0.29 0.29 -0.00 0.00 0.22 0.00 0.00 39.33 40.12 2jch h ASP 778 CO -0.40 -0.20 -0.10 1.88 -1.72 0.00 0.00 179.24 178.70 2jch h TYR 779 N -0.14 0.00 0.09 4.55 0.05 -0.78 0.52 116.97 121.26 2jch h TYR 779 Ca 0.15 0.00 -0.00 0.00 0.05 0.00 0.00 58.73 58.93 2jch h TYR 779 Cb 0.37 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.11 2jch h TYR 779 CO -0.36 0.10 -0.04 -0.56 -1.05 0.00 0.00 178.16 176.25 2jch h GLN 780 N 0.00 -0.12 0.10 4.88 3.07 -0.59 -0.71 115.11 121.73 2jch h GLN 780 Ca -0.00 0.01 -0.00 0.00 0.09 0.00 0.00 58.65 58.74 2jch h GLN 780 Cb 0.59 0.03 0.00 0.00 0.08 0.00 0.00 27.48 28.18 2jch h GLN 780 CO 0.01 0.15 -0.05 -0.97 0.09 0.00 0.00 178.83 178.07 2jch h ASN 781 N -0.39 -0.11 -0.02 0.06 -0.73 -0.98 -2.72 115.58 110.69 2jch h ASN 781 Ca -0.01 -0.31 0.02 0.00 1.87 0.00 0.00 56.30 57.87 2jch h ASN 781 Cb 0.33 0.03 -0.04 0.00 0.27 0.00 0.00 38.32 38.90 2jch h ASN 781 CO 0.02 0.26 -0.40 0.00 -0.37 0.00 0.00 177.43 176.93 2jch h ALA 782 N 0.35 -0.83 -0.23 1.57 0.00 -0.03 -3.04 119.26 117.05 2jch h ALA 782 Ca -0.01 -0.06 0.07 0.00 0.00 0.00 0.00 54.91 54.90 2jch h ALA 782 Cb 0.41 0.86 -0.01 0.00 0.00 0.00 0.00 17.79 19.05 2jch h ALA 782 CO 0.02 -0.96 0.18 -1.49 0.00 0.00 0.00 179.25 177.01 2jch h TRP 783 N -0.49 0.00 -0.41 0.00 4.06 -1.16 -2.54 115.95 115.41 2jch h TRP 783 Ca 0.01 0.00 -0.01 0.00 2.06 0.00 0.00 58.89 60.96 2jch h TRP 783 Cb 0.54 0.00 -0.00 0.00 -1.00 0.00 0.00 29.16 28.69 2jch h TRP 783 CO -0.49 0.00 0.01 -1.13 -3.56 0.00 0.00 178.44 173.26 2jch n SER 784 N -4.27 4.33 0.00 -3.49 3.41 -1.03 -1.10 113.62 111.47 2jch n SER 784 Ca 0.03 -2.66 0.00 0.00 -0.26 0.00 0.00 58.87 55.97 2jch n SER 784 Cb 0.33 -0.63 0.00 0.00 -0.26 0.00 0.00 64.21 63.64 2jch n SER 784 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 2jch n SER 785 N 0.42 3.84 -0.28 4.04 3.41 -0.99 -4.37 113.62 119.70 2jch n SER 785 Ca 0.20 0.00 -0.05 0.00 -0.26 0.00 0.00 58.87 58.75 2jch n SER 785 Cb 0.93 0.67 0.06 0.00 -0.26 0.00 0.00 64.21 65.61 2jch n SER 785 CO 0.00 0.00 0.00 0.40 -0.16 0.00 0.00 175.04 175.28 2jch h ILE 786 N 0.00 1.24 0.23 -1.33 2.04 -1.37 -3.30 117.51 115.02 2jch h ILE 786 Ca 0.00 -0.68 -0.01 0.00 1.00 0.00 0.00 64.86 65.17 2jch h ILE 786 Cb 0.19 0.27 0.00 0.00 -0.74 0.00 0.00 36.82 36.55 2jch h ILE 786 CO 0.00 0.29 -0.11 0.58 0.00 0.00 0.00 178.15 178.91 2jch h VAL 787 N 1.08 0.78 0.00 1.67 2.07 -1.38 -2.98 116.25 117.50 2jch h VAL 787 Ca 0.27 -0.86 0.00 0.00 0.82 0.00 0.00 66.70 66.93 2jch h VAL 787 Cb 0.11 1.22 0.00 0.00 -1.52 0.00 0.00 31.29 31.10 2jch h VAL 787 CO -0.03 0.17 0.00 0.61 0.02 0.00 0.00 177.57 178.33 2jch n GLY 788 N 0.13 0.00 0.00 2.17 0.00 -1.24 -5.09 105.19 101.16 2jch n GLY 788 Ca -0.09 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.93 2jch n GLY 788 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76