# AA SS3 SS8 ASA HSEa-u HSEa-d CN13 theta tau phi psi P(3-C) P(3-E) P(3-H) P(8-C) P(8-S) P(8-T) P(8-H) P(8-G) P(8-I) P(8-E) P(8-B) 0 E C C 114.14 5.42 20.52 26.64 117.58 -138.14 -95.04 134.63 99.58 0.42 0.00 99.55 0.09 0.01 0.00 0.00 0.00 0.34 0.01 1 I C C 41.79 19.02 12.29 30.66 117.47 -144.92 -99.79 129.46 57.39 42.54 0.07 56.67 0.46 0.12 0.01 0.04 0.00 42.15 0.54 2 V E E 65.34 7.26 20.69 28.91 119.70 -165.58 -114.52 129.81 12.94 86.97 0.08 11.95 0.84 0.14 0.03 0.05 0.00 86.38 0.60 3 M E E 44.00 19.23 13.85 32.60 118.74 -154.86 -104.32 129.23 7.55 92.40 0.05 7.02 0.47 0.08 0.02 0.03 0.00 91.98 0.41 4 T E E 65.18 7.73 20.74 29.17 124.25 -170.88 -120.74 138.69 13.10 86.79 0.11 11.59 1.18 0.23 0.03 0.07 0.00 86.04 0.86 5 Q E E 72.60 13.77 15.60 29.37 126.20 -160.84 -122.38 139.39 40.69 59.13 0.17 31.44 8.65 0.80 0.03 0.16 0.00 57.90 1.01 6 S C C 54.98 9.09 17.22 27.16 122.53 -136.38 -100.79 147.05 78.29 21.55 0.16 51.43 24.89 1.24 0.02 0.16 0.00 21.52 0.74 7 P C C 67.25 7.68 17.44 26.03 113.89 -9.58 -68.33 150.51 87.97 11.64 0.38 50.03 32.77 4.16 0.03 0.43 0.00 12.15 0.43 8 A C E 50.00 13.07 15.47 28.56 98.80 -145.47 -82.52 -19.99 57.36 42.12 0.52 37.81 16.67 2.68 0.05 0.55 0.00 41.58 0.65 9 T E E 73.32 7.23 20.07 28.40 130.01 26.55 -132.11 141.19 16.49 83.36 0.15 14.41 1.60 0.29 0.02 0.13 0.00 83.16 0.38 10 L E E 28.49 19.66 14.68 33.98 128.00 -173.15 -131.57 140.37 2.87 97.13 0.01 2.61 0.17 0.01 0.00 0.00 0.00 97.08 0.13 11 S E E 64.88 6.35 23.38 30.81 122.46 -157.09 -115.04 134.69 2.33 97.66 0.00 2.13 0.13 0.01 0.00 0.00 0.00 97.67 0.07 12 L E E 17.35 20.82 13.57 34.18 133.73 173.21 -137.74 152.50 13.57 86.42 0.01 12.96 0.51 0.02 0.00 0.01 0.00 85.50 1.00 13 S C C 52.92 4.64 23.27 27.58 121.85 -120.20 -84.78 157.11 94.20 5.77 0.03 93.32 1.11 0.09 0.01 0.02 0.00 5.05 0.41 14 P C T 61.90 13.42 14.24 27.86 109.62 -81.36 -59.63 135.70 99.33 0.31 0.36 0.25 2.60 96.68 0.02 0.23 0.00 0.16 0.06 15 G C T 47.93 3.84 19.34 23.86 95.73 22.77 88.45 -6.34 99.43 0.24 0.33 0.45 3.00 96.12 0.02 0.24 0.00 0.16 0.02 16 E C C 81.33 8.55 17.29 27.00 121.70 120.36 -83.47 149.12 92.23 7.52 0.25 74.14 17.55 0.53 0.04 0.22 0.00 6.81 0.71 17 R E E 126.61 8.93 18.83 28.99 124.24 -137.13 -109.73 141.32 47.29 52.68 0.04 46.41 0.81 0.07 0.01 0.02 0.00 51.74 0.94 18 A E E 9.63 21.22 15.50 36.65 131.39 -172.08 -131.96 149.92 2.01 97.99 0.00 1.89 0.06 0.00 0.00 0.00 0.00 97.97 0.08 19 T E E 63.61 8.78 24.93 34.20 121.63 -144.46 -114.32 132.44 0.69 99.31 0.00 0.62 0.02 0.00 0.00 0.00 0.00 99.34 0.01 20 L E E 5.10 25.52 17.28 43.31 122.69 -168.26 -116.22 133.78 2.09 97.91 0.00 1.83 0.11 0.01 0.00 0.00 0.00 98.03 0.03 21 S E E 31.83 10.68 26.96 38.24 125.62 -164.32 -115.52 142.94 6.42 93.58 0.01 5.69 0.29 0.01 0.00 0.00 0.00 93.94 0.07 22 C E E 3.85 25.74 17.38 43.61 130.53 -175.00 -132.97 145.93 7.31 92.68 0.01 6.70 0.30 0.01 0.00 0.01 0.00 92.80 0.19 23 R E E 103.26 7.73 27.08 35.59 122.01 -159.70 -116.38 132.89 5.35 94.63 0.02 4.94 0.27 0.02 0.01 0.01 0.00 93.78 0.98 24 T E E 12.29 23.35 13.94 36.89 123.70 -166.80 -109.12 141.48 40.63 59.12 0.25 38.94 1.34 0.24 0.07 0.17 0.00 57.24 2.00 25 S C S 59.68 6.31 20.90 27.53 101.88 -148.77 -85.97 -16.45 85.95 13.45 0.60 38.35 42.06 5.49 0.06 0.66 0.00 12.67 0.71 26 Q C S 109.74 5.38 18.92 24.90 115.04 21.18 -106.55 115.83 91.28 7.67 1.05 18.41 62.19 10.77 0.10 1.00 0.00 6.61 0.92 27 S C C 54.48 10.29 16.42 27.20 116.58 64.92 -102.19 139.56 91.55 6.56 1.88 60.45 22.07 8.86 0.25 2.08 0.00 4.78 1.51 28 V C C 67.46 11.70 17.74 29.45 104.25 -128.90 -91.96 9.12 88.45 8.97 2.58 42.89 30.08 15.82 0.37 2.57 0.00 5.79 2.48 29 S C C 33.14 14.17 18.32 32.50 120.99 87.76 -99.71 145.93 88.29 9.35 2.36 49.47 25.09 13.69 0.26 2.56 0.00 7.52 1.42 30 S C S 42.08 13.22 21.01 33.96 104.22 -156.05 -97.90 -8.21 86.01 13.11 0.88 30.11 50.83 4.37 0.08 0.81 0.00 13.12 0.67 31 Y E E 61.91 13.47 24.66 38.24 129.51 34.54 -129.29 143.78 28.64 70.93 0.43 23.12 4.62 0.90 0.06 0.38 0.00 70.25 0.69 32 V E E 2.63 26.52 20.29 47.40 126.07 -165.41 -124.09 136.96 3.78 96.21 0.01 3.44 0.21 0.01 0.00 0.00 0.00 96.21 0.12 33 A E E 10.37 18.01 27.78 45.58 128.62 -168.49 -124.67 144.56 0.69 99.31 0.00 0.64 0.02 0.00 0.00 0.00 0.00 99.33 0.01 34 W E E 8.00 24.55 23.17 47.56 122.95 -155.69 -112.63 138.46 0.54 99.46 0.00 0.48 0.02 0.00 0.00 0.00 0.00 99.48 0.01 35 Y E E 23.09 17.54 23.59 41.09 132.54 -174.34 -131.93 150.37 0.96 99.04 0.00 0.84 0.04 0.00 0.00 0.00 0.00 99.06 0.06 36 Q E E 39.83 14.16 21.52 36.15 120.32 -142.00 -109.04 132.98 6.18 93.81 0.01 5.22 0.71 0.04 0.00 0.01 0.00 93.80 0.23 37 Q E E 55.65 13.92 15.55 29.96 117.67 -147.73 -99.82 131.51 46.90 53.08 0.03 41.00 4.49 0.15 0.01 0.03 0.00 53.20 1.11 38 K C C 91.54 6.74 14.83 23.00 122.56 -157.40 -104.73 149.99 97.95 2.03 0.02 94.58 3.48 0.16 0.00 0.01 0.00 1.40 0.36 39 P C T 98.09 4.12 11.48 17.25 108.14 -92.14 -60.16 137.09 99.66 0.10 0.24 0.50 4.63 94.52 0.01 0.24 0.00 0.07 0.02 40 E C T 170.53 0.52 12.87 11.93 95.50 15.03 71.60 7.43 99.65 0.08 0.26 0.58 4.24 94.80 0.00 0.30 0.00 0.06 0.02 41 Q C S 88.55 5.71 9.97 17.72 129.00 94.20 -113.35 158.53 94.54 4.97 0.49 24.69 68.81 1.43 0.06 0.45 0.00 1.87 2.69 42 T C C 96.40 2.21 17.17 19.42 115.77 -97.93 -70.75 146.36 97.70 2.26 0.04 86.14 11.39 0.30 0.01 0.04 0.00 1.83 0.31 43 P C C 43.60 17.99 11.42 28.74 114.94 -101.65 -65.56 144.67 89.98 9.99 0.04 87.66 2.13 0.17 0.00 0.03 0.00 9.72 0.28 44 R E E 99.89 8.79 21.40 30.81 124.32 -159.35 -119.89 138.01 8.77 91.16 0.06 7.81 0.78 0.09 0.03 0.03 0.00 90.29 0.97 45 L E E 53.75 16.81 18.45 34.78 110.84 -116.42 -76.46 126.16 1.56 98.42 0.01 1.41 0.08 0.01 0.00 0.00 0.00 98.39 0.10 46 L E E 21.29 18.74 21.42 39.95 101.27 176.12 -95.85 -33.79 5.25 94.72 0.03 2.87 2.17 0.08 0.01 0.01 0.00 94.82 0.04 47 I E E 17.76 19.54 22.39 41.54 135.08 7.14 -145.25 142.58 1.59 98.39 0.02 1.23 0.18 0.02 0.01 0.00 0.00 98.51 0.05 48 Y E E 49.01 18.93 20.21 38.11 128.84 -173.57 -133.64 136.67 6.79 93.09 0.12 5.82 0.69 0.11 0.05 0.05 0.00 92.91 0.37 49 D E E 35.67 12.26 21.15 34.03 115.06 -168.57 -114.98 114.56 39.93 59.05 1.03 32.65 6.23 1.41 0.39 0.64 0.00 57.28 1.40 50 A C T 43.50 14.22 15.92 30.26 93.77 -153.32 -66.15 -21.48 71.66 5.32 23.02 11.39 14.88 46.23 4.39 17.79 0.05 3.88 1.39 51 S C T 78.42 3.09 19.03 22.39 95.71 57.87 -78.39 -21.85 72.36 1.60 26.04 8.25 13.56 50.65 5.71 19.92 0.04 0.96 0.92 52 S C T 49.34 9.62 14.95 25.33 105.01 43.04 -105.41 35.98 64.49 6.89 28.62 20.38 18.78 27.59 7.32 19.12 0.13 4.06 2.63 53 R C C 117.34 12.45 14.06 26.37 97.36 162.02 -68.17 -0.09 64.13 15.92 19.95 31.93 12.63 20.55 9.87 9.67 0.17 10.90 4.26 54 A C C 62.71 8.73 16.17 25.47 99.81 74.57 -78.13 -10.66 62.44 18.83 18.73 27.28 14.23 22.72 7.73 10.24 0.37 12.69 4.73 55 T C T 83.30 6.11 17.43 24.36 107.12 69.66 -93.62 40.21 68.80 16.36 14.84 20.19 17.48 32.87 5.58 8.34 0.27 11.73 3.54 56 G C C 40.24 7.58 19.21 27.14 104.52 -48.66 91.52 5.94 83.61 12.12 4.27 30.35 24.86 29.90 0.90 3.16 0.02 8.80 2.03 57 I C C 24.49 22.53 10.84 32.29 116.00 126.68 -88.93 131.40 84.51 15.07 0.43 64.10 20.06 0.85 0.20 0.27 0.00 9.61 4.91 58 P C C 46.49 8.78 17.08 27.50 114.61 -110.28 -65.58 149.57 87.07 10.69 2.23 82.20 3.23 1.64 0.66 1.54 0.00 8.48 2.26 59 D C G 117.45 2.82 16.87 21.10 92.24 -112.20 -61.73 -27.90 51.96 2.33 45.71 5.89 9.58 36.30 2.49 43.59 0.01 1.69 0.44 60 R C G 128.02 7.16 18.58 26.55 92.65 63.73 -77.81 -10.65 48.28 5.72 46.00 5.40 8.90 34.58 2.83 42.77 0.03 4.86 0.64 61 F H E 21.47 22.60 13.19 35.11 106.55 64.26 -99.39 19.07 28.43 34.40 37.17 14.09 8.40 9.85 3.69 30.71 0.03 31.67 1.54 62 S E E 50.11 10.88 21.67 32.91 128.77 114.41 -119.71 150.35 29.01 69.17 1.82 21.87 5.72 1.96 0.90 1.03 0.01 61.94 6.58 63 G E E 23.00 15.60 17.62 32.69 140.85 164.26 -158.88 168.66 24.97 74.51 0.51 20.55 4.05 1.15 0.20 0.34 0.00 71.47 2.24 64 G E E 38.97 6.72 21.20 29.29 137.29 -145.58 -154.66 171.13 36.62 63.05 0.33 30.22 5.55 1.20 0.09 0.27 0.00 61.04 1.63 65 G C E 29.65 12.08 16.18 28.65 139.43 149.35 145.22 172.82 55.84 43.73 0.43 38.05 15.73 3.30 0.07 0.47 0.00 40.24 2.14 66 S C S 73.93 4.13 21.19 25.94 112.88 -101.56 -111.58 103.64 67.62 30.95 1.43 25.28 31.76 12.61 0.19 1.48 0.01 24.61 4.07 67 G C S 30.94 11.53 18.94 30.11 105.84 -53.02 66.42 -97.72 96.55 2.11 1.34 4.76 55.34 36.59 0.05 1.38 0.00 1.52 0.35 68 T C S 57.99 13.73 17.49 31.03 98.91 -7.82 -99.22 -2.52 95.68 3.23 1.09 5.14 56.48 34.21 0.05 1.09 0.00 2.65 0.38 69 D E E 60.79 8.88 22.69 32.69 118.39 83.64 -107.56 130.04 42.90 56.63 0.48 26.05 15.53 2.87 0.09 0.52 0.00 50.64 4.30 70 F E E 8.40 24.69 16.38 41.35 128.67 -174.79 -127.60 141.88 23.27 76.71 0.02 21.57 1.00 0.07 0.00 0.02 0.00 76.49 0.85 71 T E E 36.88 10.73 27.41 39.09 124.31 -164.25 -120.15 136.33 9.10 90.90 0.00 8.12 0.55 0.01 0.00 0.00 0.00 91.08 0.24 72 L E E 3.12 26.21 19.02 46.11 120.93 -162.12 -115.91 129.52 0.81 99.19 0.00 0.87 0.01 0.00 0.00 0.00 0.00 99.10 0.01 73 T E E 42.92 9.94 27.23 37.94 120.42 -164.37 -115.71 129.21 0.26 99.74 0.00 0.29 0.00 0.00 0.00 0.00 0.00 99.69 0.02 74 I E E 8.18 23.98 15.87 40.39 116.52 -164.41 -110.34 122.25 3.59 96.41 0.00 3.73 0.04 0.00 0.00 0.00 0.00 95.67 0.56 75 S C C 52.50 6.61 22.65 29.51 114.59 -166.69 -102.97 149.93 92.43 7.51 0.06 50.15 36.22 4.82 0.00 0.11 0.00 8.39 0.30 76 S C S 65.90 4.30 23.99 28.22 105.72 9.79 57.23 80.02 98.92 1.06 0.02 11.33 82.29 5.29 0.00 0.03 0.00 0.97 0.09 77 L C C 18.97 23.90 10.45 33.63 113.62 -147.33 -77.58 132.40 99.14 0.85 0.01 97.71 1.60 0.02 0.00 0.00 0.00 0.31 0.34 78 E C C 88.05 4.30 24.18 28.22 128.95 -174.02 -123.94 153.69 99.87 0.12 0.01 99.48 0.42 0.00 0.00 0.00 0.00 0.02 0.07 79 P H G 67.42 13.67 14.74 28.47 91.02 -108.92 -58.18 -31.84 3.30 0.01 96.69 0.15 0.18 2.11 0.24 97.31 0.00 0.01 0.00 80 E H G 125.53 3.82 21.30 25.89 90.16 62.55 -70.22 -16.38 2.77 0.02 97.21 0.08 0.14 1.88 0.15 97.73 0.00 0.02 0.00 81 D H G 19.13 19.31 16.93 36.54 94.41 61.93 -88.40 -2.76 3.64 0.04 96.32 0.41 0.34 1.65 0.22 97.35 0.00 0.03 0.00 82 F C C 40.13 18.64 19.91 38.36 115.68 102.21 -81.31 134.02 89.05 10.30 0.65 85.37 3.73 0.17 0.05 0.59 0.00 9.79 0.31 83 A E E 12.53 17.73 23.49 40.66 142.09 161.74 -151.88 171.87 5.74 94.25 0.01 5.25 0.38 0.02 0.00 0.01 0.00 94.01 0.33 84 V E E 29.28 16.14 25.35 41.29 119.24 -109.21 -106.35 131.18 0.61 99.39 0.00 0.55 0.02 0.00 0.00 0.00 0.00 99.41 0.01 85 Y E E 7.63 24.71 21.32 45.95 123.83 -166.21 -114.96 136.80 0.27 99.73 0.00 0.23 0.01 0.00 0.00 0.00 0.00 99.75 0.00 86 Y E E 27.77 17.45 26.90 43.90 128.53 -169.07 -123.59 144.85 0.78 99.22 0.00 0.67 0.03 0.00 0.00 0.00 0.00 99.28 0.02 87 C E E 3.11 25.00 21.50 46.67 125.06 -163.45 -119.65 140.39 3.91 96.05 0.04 3.32 0.32 0.04 0.01 0.02 0.00 96.19 0.10 88 Q E E 33.38 14.64 25.42 40.07 126.89 -168.81 -122.28 141.61 4.49 95.40 0.11 3.97 0.31 0.06 0.03 0.05 0.00 95.35 0.22 89 Q E E 32.66 17.75 18.47 36.07 119.59 -147.20 -103.14 136.28 13.43 86.30 0.27 10.87 2.14 0.49 0.06 0.18 0.00 85.78 0.48 90 Y E E 91.77 10.28 17.58 28.73 115.88 -154.67 -103.72 125.21 40.46 59.06 0.48 31.91 6.88 1.66 0.08 0.43 0.00 57.90 1.15 91 S C C 49.26 8.40 12.58 22.22 125.18 162.88 -124.92 164.14 76.92 21.97 1.11 33.49 26.51 17.37 0.12 1.14 0.00 20.12 1.24 92 N C S 133.65 1.39 14.72 15.98 98.07 -57.59 -76.91 0.63 96.76 2.25 0.98 17.34 49.04 30.38 0.07 1.09 0.00 1.71 0.36 93 W C S 132.14 5.60 11.51 19.02 123.78 62.44 -115.26 143.35 93.25 6.05 0.70 19.40 63.06 10.83 0.06 0.73 0.00 5.08 0.83 94 P C C 83.82 4.34 16.99 22.03 114.27 -82.08 -68.71 149.63 77.60 22.02 0.38 54.29 18.75 3.21 0.05 0.39 0.00 22.56 0.76 95 W E E 78.25 17.61 12.16 29.03 115.27 -113.08 -82.83 135.09 46.10 53.73 0.17 41.09 2.81 0.56 0.03 0.14 0.00 54.79 0.60 96 T E E 55.01 9.34 21.62 31.52 126.10 -169.52 -122.33 140.48 10.40 89.54 0.07 9.39 0.72 0.12 0.02 0.04 0.00 87.84 1.86 97 F E E 57.91 18.94 16.22 34.19 119.77 -141.77 -100.84 135.01 13.68 86.21 0.11 11.83 1.38 0.25 0.04 0.07 0.00 83.92 2.51 98 G C C 19.39 13.05 17.90 31.25 123.17 -141.18 -82.43 178.43 61.35 38.47 0.18 46.51 11.73 1.71 0.02 0.18 0.00 39.15 0.69 99 Q C C 120.16 4.56 22.59 27.46 103.39 -73.83 -77.20 54.83 72.07 27.75 0.18 55.46 13.22 1.66 0.02 0.20 0.00 28.92 0.52 100 G C C 16.45 18.71 15.90 33.36 128.81 -126.65 -80.56 171.97 63.72 36.19 0.10 56.39 4.44 0.43 0.01 0.09 0.00 38.21 0.43 101 T E E 29.98 15.47 19.70 35.47 128.58 -115.52 -123.60 145.55 7.93 92.06 0.01 7.30 0.35 0.02 0.00 0.00 0.00 92.06 0.26 102 K E E 103.03 9.42 22.98 32.79 119.56 -137.08 -99.88 134.82 1.12 98.88 0.00 0.96 0.06 0.00 0.00 0.00 0.00 98.95 0.03 103 V E E 10.82 22.91 14.48 37.46 121.63 -164.89 -116.14 132.22 1.10 98.90 0.00 1.03 0.02 0.00 0.00 0.00 0.00 98.92 0.02 104 E E E 95.05 5.62 23.65 29.64 117.70 -153.25 -104.42 129.75 2.38 97.61 0.01 2.31 0.07 0.01 0.00 0.00 0.00 97.50 0.11 105 I E E 26.76 20.75 10.98 31.02 115.61 -154.94 -99.20 126.63 20.76 79.20 0.04 21.05 0.23 0.04 0.01 0.01 0.00 77.91 0.74 106 K C C 128.41 3.97 19.83 24.58 115.07 -155.30 -98.89 130.32 99.50 0.50 0.00 99.55 0.05 0.01 0.00 0.00 0.00 0.38 0.01