# 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 R C C 139.32 5.80 17.30 24.50 117.85 -160.71 -99.57 132.29 99.47 0.52 0.00 99.55 0.06 0.01 0.00 0.00 0.00 0.35 0.02 1 I C C 90.79 9.29 14.19 24.52 115.07 -146.90 -97.27 125.45 63.50 36.35 0.14 65.26 0.73 0.20 0.07 0.05 0.00 20.97 12.72 2 L C C 45.07 16.22 10.25 26.14 118.10 -137.25 -93.84 136.61 81.79 18.10 0.12 74.90 6.10 0.39 0.04 0.08 0.00 16.70 1.79 3 P C C 76.10 3.93 18.63 22.77 117.53 -111.10 -69.58 159.09 91.01 8.89 0.10 74.06 14.71 1.03 0.01 0.10 0.00 9.79 0.30 4 E C C 115.01 8.12 15.37 24.76 114.58 -87.24 -70.28 140.57 74.10 25.71 0.19 63.78 7.18 0.83 0.03 0.19 0.00 27.52 0.47 5 V E E 42.02 15.29 13.25 28.92 123.51 -160.12 -119.94 135.65 18.58 81.35 0.07 16.98 1.17 0.08 0.02 0.04 0.00 81.25 0.45 6 K E E 124.46 5.20 20.34 26.93 116.86 -140.72 -100.50 127.93 6.45 93.52 0.03 6.05 0.27 0.03 0.01 0.01 0.00 93.50 0.13 7 V E E 19.65 21.34 13.18 34.10 127.41 -173.87 -124.61 142.13 3.76 96.22 0.02 3.49 0.17 0.01 0.00 0.00 0.00 96.26 0.06 8 E E E 104.57 6.18 23.25 30.67 125.22 -161.36 -120.36 141.05 3.93 96.04 0.03 3.51 0.22 0.03 0.01 0.01 0.00 96.08 0.14 9 G E E 11.01 18.27 15.38 33.50 141.22 162.74 -156.39 168.66 14.17 85.76 0.07 12.37 1.42 0.15 0.02 0.04 0.00 85.62 0.39 10 E E E 96.17 5.42 23.00 28.62 123.81 -101.96 -104.95 147.97 36.75 62.99 0.25 33.44 2.32 0.40 0.10 0.18 0.00 57.80 5.76 11 L C T 78.58 13.32 14.34 27.80 109.42 -87.81 -59.49 134.20 96.87 2.23 0.90 0.49 3.14 94.08 0.04 0.65 0.00 1.36 0.23 12 G C T 51.10 3.24 19.68 23.49 95.48 20.15 86.37 -5.22 98.74 0.58 0.69 0.37 3.70 94.88 0.02 0.58 0.00 0.39 0.05 13 G C S 24.18 9.10 17.17 27.33 130.60 104.22 -99.31 172.56 95.74 3.94 0.32 25.09 70.21 0.96 0.03 0.27 0.00 2.86 0.58 14 S C C 50.85 10.33 19.93 30.81 129.77 -108.39 -123.92 154.30 83.48 16.51 0.01 83.12 0.72 0.03 0.00 0.00 0.00 15.80 0.32 15 V E E 13.42 22.28 16.00 38.23 127.50 -159.43 -129.40 140.35 1.22 98.77 0.00 1.15 0.03 0.00 0.00 0.00 0.00 98.73 0.09 16 T E E 58.01 9.58 24.56 34.52 120.54 -156.59 -116.64 128.89 0.23 99.77 0.00 0.21 0.00 0.00 0.00 0.00 0.00 99.78 0.00 17 I E E 9.57 23.77 17.31 41.26 120.58 -167.79 -115.55 128.68 1.37 98.63 0.00 1.30 0.03 0.00 0.00 0.00 0.00 98.63 0.04 18 K E E 99.14 7.96 25.28 33.78 116.92 -155.25 -103.85 126.67 23.98 76.01 0.01 21.65 1.13 0.06 0.00 0.01 0.00 76.94 0.21 19 C C C 7.13 23.78 15.60 39.43 120.53 -171.56 -120.02 129.41 55.84 44.14 0.02 52.06 2.55 0.10 0.00 0.02 0.00 44.76 0.51 20 P C C 59.52 7.45 24.41 32.15 111.60 -130.37 -76.08 137.12 58.10 41.80 0.10 51.55 5.92 0.29 0.04 0.08 0.00 35.10 7.01 21 L C C 26.87 20.87 12.90 32.94 120.35 -157.53 -108.85 133.39 88.01 11.41 0.59 78.92 8.03 1.04 0.17 0.45 0.00 7.62 3.79 22 P C C 66.78 6.59 17.80 25.24 111.83 -116.15 -70.49 149.84 94.29 3.16 2.55 44.49 28.28 21.24 0.26 2.81 0.00 2.22 0.69 23 E C C 125.41 4.89 14.92 21.24 109.72 -90.50 -74.85 118.21 93.23 2.96 3.81 39.91 29.25 23.88 0.48 3.75 0.00 1.70 1.02 24 M C C 97.18 8.32 12.87 22.34 114.38 136.76 -96.37 133.00 93.49 3.19 3.32 62.00 20.32 10.71 0.57 3.23 0.00 1.84 1.33 25 H C C 126.19 5.62 15.40 22.10 101.68 -34.76 -80.64 35.30 95.24 3.63 1.13 68.37 18.77 7.98 0.19 1.17 0.00 2.58 0.94 26 V C C 60.01 10.06 15.88 26.99 124.50 109.38 -113.13 146.83 91.77 7.82 0.42 49.02 39.92 3.07 0.06 0.38 0.00 6.86 0.68 27 R C C 80.98 13.16 18.76 31.95 114.32 -109.88 -83.30 131.24 59.09 40.65 0.25 50.75 5.51 0.85 0.04 0.22 0.00 41.92 0.71 28 I E E 22.54 19.79 19.76 39.19 123.28 -164.58 -115.60 136.70 16.30 83.67 0.02 14.99 0.77 0.04 0.00 0.01 0.00 83.80 0.38 29 Y E E 24.04 19.52 25.15 43.95 129.01 -166.36 -124.04 143.79 2.14 97.85 0.00 1.95 0.08 0.00 0.00 0.00 0.00 97.91 0.06 30 L E E 5.02 24.10 24.80 48.53 121.24 -150.66 -109.11 136.29 0.82 99.18 0.00 0.73 0.03 0.00 0.00 0.00 0.00 99.22 0.02 31 C E E 5.02 22.85 25.11 47.34 133.24 -172.99 -130.92 149.67 1.03 98.97 0.00 0.90 0.04 0.00 0.00 0.00 0.00 99.01 0.04 32 R E E 35.80 18.85 24.77 42.55 124.36 -152.21 -117.75 137.04 2.08 97.89 0.03 1.74 0.17 0.03 0.01 0.01 0.00 97.93 0.11 33 E E E 50.85 15.21 19.40 34.64 117.26 -140.96 -95.67 132.63 12.93 86.89 0.18 11.48 1.12 0.20 0.06 0.11 0.00 86.18 0.85 34 M C C 58.93 11.40 15.27 27.84 114.62 -128.07 -82.09 142.67 65.21 33.67 1.12 51.34 10.08 2.96 0.26 0.89 0.00 32.76 1.71 35 A C T 75.46 5.38 13.30 20.29 108.95 -98.29 -64.97 136.05 91.21 3.40 5.40 7.41 25.45 58.23 0.36 5.30 0.00 2.44 0.79 36 G C T 67.71 0.47 14.24 12.62 97.48 18.12 78.76 -7.31 93.44 0.60 5.96 4.61 18.15 69.90 0.35 6.36 0.00 0.36 0.27 37 S C T 64.86 5.68 11.54 18.53 108.25 56.15 -101.47 -1.36 93.75 1.06 5.19 10.70 25.09 57.12 0.34 5.71 0.00 0.63 0.40 38 G C S 46.86 5.95 14.76 21.91 99.81 -133.18 77.12 2.28 93.80 4.93 1.27 33.40 36.96 23.62 0.13 1.39 0.00 3.68 0.83 39 T C C 72.33 6.07 19.28 26.35 119.71 106.26 -90.66 144.45 71.94 27.79 0.27 57.70 12.53 1.19 0.06 0.27 0.00 26.14 2.12 40 C E E 23.28 21.57 13.77 34.74 121.75 -143.02 -105.30 139.82 28.18 71.76 0.06 25.26 1.98 0.16 0.01 0.04 0.00 71.72 0.81 41 G E E 21.36 11.21 24.53 35.85 130.54 -165.56 -119.25 160.74 3.99 95.99 0.03 3.40 0.45 0.04 0.01 0.01 0.00 95.87 0.22 42 T E E 33.64 19.08 21.17 39.16 115.27 -104.89 -81.70 134.96 2.13 97.86 0.02 1.99 0.08 0.01 0.01 0.00 0.00 97.73 0.18 43 V E E 14.52 21.63 23.37 44.05 99.86 -169.15 -92.35 -30.81 9.11 90.86 0.03 3.83 5.03 0.13 0.01 0.02 0.00 90.92 0.07 44 V E E 11.39 21.59 23.68 44.54 133.64 11.00 -144.16 140.96 2.72 97.25 0.03 1.80 0.72 0.05 0.01 0.01 0.00 97.14 0.27 45 S E E 19.07 19.10 20.39 38.55 135.91 169.80 -139.27 156.84 21.36 78.56 0.09 18.87 1.66 0.21 0.03 0.05 0.00 78.50 0.68 46 T C S 49.01 14.53 19.80 34.09 99.07 -149.54 -94.37 -3.93 81.72 17.89 0.40 26.65 43.53 10.73 0.05 0.40 0.00 17.77 0.87 47 T C S 66.96 8.19 20.40 28.88 104.88 63.07 -96.85 29.90 94.09 5.36 0.56 11.90 61.02 21.14 0.06 0.53 0.00 4.68 0.67 48 N C S 98.18 8.48 19.12 27.98 96.12 -102.97 34.53 21.72 92.47 6.82 0.71 19.51 55.93 17.02 0.08 0.72 0.00 5.78 0.95 49 F C C 76.38 11.37 19.54 31.16 117.62 100.91 -107.11 132.85 66.41 33.00 0.58 44.95 18.14 3.48 0.19 0.55 0.00 26.32 6.37 50 I C C 38.42 19.94 12.73 31.87 120.27 -142.52 -102.40 133.54 54.58 45.06 0.36 48.11 4.73 0.43 0.23 0.19 0.00 26.33 19.98 51 K C C 76.11 9.22 16.33 26.64 118.09 -144.14 -86.74 149.52 95.89 3.92 0.19 94.80 1.31 0.14 0.07 0.08 0.00 2.87 0.73 52 A H G 85.72 2.64 15.46 19.59 91.47 -114.10 -58.23 -35.00 15.89 0.14 83.96 0.79 1.25 12.80 1.23 83.82 0.00 0.10 0.01 53 E H G 129.05 3.08 17.14 21.16 90.47 61.41 -68.21 -20.11 15.38 0.09 84.52 0.44 0.84 13.38 1.06 84.20 0.00 0.07 0.01 54 Y H G 19.89 20.79 10.47 31.20 98.05 44.88 -103.48 2.65 16.84 0.31 82.85 1.63 1.93 11.91 1.26 83.00 0.00 0.21 0.06 55 K C T 119.96 7.57 15.13 25.00 110.46 123.69 -61.63 130.46 94.61 1.76 3.63 2.75 3.07 89.22 0.77 2.26 0.00 0.88 1.06 56 G C T 58.82 1.89 19.67 21.41 92.98 14.02 80.72 -1.82 96.23 0.37 3.40 0.88 3.67 92.06 0.34 2.68 0.00 0.24 0.12 57 R C T 61.23 15.10 17.55 32.77 98.38 91.75 -95.81 -22.19 94.24 2.08 3.68 7.44 26.91 59.98 0.42 3.14 0.00 1.79 0.32 58 V E E 3.33 26.03 13.32 40.21 130.06 42.06 -129.61 144.84 14.56 85.21 0.23 11.41 3.12 0.41 0.08 0.17 0.00 81.50 3.30 59 T E E 54.98 7.17 27.34 35.27 129.30 -173.06 -130.62 143.53 4.93 95.04 0.03 4.65 0.24 0.03 0.01 0.02 0.00 94.90 0.15 60 L E E 20.44 24.13 14.76 38.61 121.43 -153.95 -113.66 130.67 4.11 95.88 0.01 3.95 0.15 0.01 0.00 0.01 0.00 95.80 0.07 61 K E E 100.57 5.75 24.80 31.06 123.52 -172.30 -123.23 133.24 1.98 98.01 0.01 1.79 0.10 0.01 0.00 0.00 0.00 98.04 0.06 62 Q E E 78.28 14.53 15.52 29.83 113.78 -133.37 -85.11 127.91 5.83 94.14 0.03 4.95 0.52 0.05 0.00 0.02 0.00 94.31 0.15 63 Y E E 52.79 10.79 14.83 27.67 110.40 -168.14 -116.41 97.70 32.69 67.18 0.13 31.13 1.35 0.17 0.04 0.09 0.00 66.13 1.10 64 P C T 78.30 7.13 13.36 22.43 93.79 -171.81 -64.56 -32.31 68.21 1.00 30.79 2.15 5.15 55.97 0.48 35.30 0.00 0.74 0.20 65 R C T 187.31 0.78 15.22 14.81 92.68 52.82 -67.88 -34.09 68.59 1.27 30.14 1.29 4.36 59.59 0.46 33.14 0.00 0.87 0.29 66 K C T 108.70 5.14 15.03 21.25 97.17 34.76 -95.60 -2.18 73.11 0.18 26.71 1.23 5.27 62.26 0.32 30.74 0.00 0.10 0.08 67 N C T 66.15 11.46 16.40 28.96 94.55 -127.51 57.93 40.71 99.58 0.14 0.28 2.29 4.54 92.81 0.03 0.23 0.00 0.10 0.02 68 L E E 29.16 13.87 20.70 35.54 132.73 120.96 -130.62 151.05 6.32 93.67 0.01 5.34 0.59 0.05 0.00 0.01 0.00 92.51 1.51 69 F E E 5.07 24.76 19.04 44.54 122.04 -143.91 -114.16 135.21 1.48 98.52 0.00 1.38 0.03 0.00 0.00 0.00 0.00 98.54 0.05 70 L E E 32.29 12.47 27.17 40.61 118.93 -155.30 -110.83 129.40 1.66 98.34 0.00 1.46 0.05 0.00 0.00 0.00 0.00 98.48 0.01 71 V E E 2.11 26.45 19.17 46.78 119.76 -166.07 -114.42 126.58 0.14 99.86 0.00 0.13 0.00 0.00 0.00 0.00 0.00 99.86 0.00 72 E E E 60.48 10.05 27.60 38.47 115.96 -157.00 -104.91 124.42 0.06 99.94 0.00 0.05 0.00 0.00 0.00 0.00 0.00 99.94 0.00 73 V E E 4.50 25.10 16.84 42.73 118.48 -168.17 -114.94 124.29 3.50 96.50 0.00 3.64 0.02 0.00 0.00 0.00 0.00 95.99 0.34 74 T C C 51.69 8.09 23.50 31.87 126.17 -169.48 -115.17 155.69 95.05 4.92 0.03 58.17 34.02 1.98 0.00 0.05 0.00 5.63 0.15 75 Q C S 113.98 3.80 24.30 28.35 94.46 9.38 57.90 51.40 99.03 0.95 0.02 6.78 89.99 2.36 0.00 0.02 0.00 0.77 0.08 76 L C C 10.15 25.10 9.99 35.04 115.00 -144.49 -70.06 137.27 99.58 0.41 0.01 98.87 0.81 0.01 0.00 0.00 0.00 0.13 0.17 77 T C C 57.40 4.80 24.13 28.69 133.45 -174.53 -126.30 164.87 99.59 0.32 0.09 99.38 0.25 0.01 0.01 0.03 0.00 0.05 0.27 78 E H G 118.50 8.71 15.70 25.56 91.09 -98.85 -59.56 -31.47 3.31 0.02 96.66 0.19 0.22 2.13 0.28 97.16 0.00 0.02 0.00 79 S H G 81.77 2.42 20.96 23.56 89.47 62.39 -70.76 -15.37 3.12 0.04 96.85 0.14 0.20 2.09 0.19 97.35 0.00 0.03 0.00 80 D H G 8.04 23.08 13.59 37.14 92.43 66.91 -81.73 -7.47 5.24 0.08 94.68 1.28 0.60 1.76 0.38 95.90 0.00 0.07 0.00 81 S C C 42.69 13.89 18.87 32.92 116.37 114.17 -68.89 141.83 99.33 0.65 0.02 97.61 1.77 0.05 0.00 0.01 0.00 0.51 0.04 82 G E E 18.87 6.12 23.40 31.83 139.71 66.08 141.40 -167.75 2.67 97.33 0.00 2.26 0.30 0.01 0.00 0.00 0.00 97.12 0.30 83 V E E 54.80 11.31 23.98 35.83 118.34 -40.30 -99.16 134.60 0.39 99.61 0.00 0.34 0.02 0.00 0.00 0.00 0.00 99.63 0.01 84 Y E E 7.55 25.02 18.93 44.24 128.07 -170.01 -121.10 143.44 0.48 99.52 0.00 0.41 0.02 0.00 0.00 0.00 0.00 99.56 0.01 85 A E E 18.00 16.67 28.26 44.76 123.07 -150.61 -111.57 139.60 1.19 98.80 0.00 1.08 0.04 0.00 0.00 0.00 0.00 98.84 0.04 86 C E E 1.62 26.86 23.81 50.58 130.68 -171.55 -125.87 146.95 4.19 95.78 0.02 3.71 0.20 0.03 0.01 0.01 0.00 95.82 0.22 87 G E E 4.55 20.60 27.61 47.29 132.53 -159.33 -125.91 158.10 6.74 93.19 0.08 5.77 0.59 0.09 0.02 0.04 0.00 92.95 0.53 88 A E E 7.94 23.00 23.30 45.56 129.77 -155.69 -128.03 144.70 19.92 79.74 0.35 16.90 2.56 0.59 0.11 0.22 0.00 78.32 1.29 89 G E E 11.93 15.69 22.14 37.45 132.30 63.23 118.35 -178.20 47.72 51.19 1.09 34.83 11.52 2.88 0.21 0.91 0.00 47.98 1.66 90 M C C 92.54 9.84 18.98 28.95 103.09 -96.10 -90.19 -9.06 65.74 30.34 3.92 32.21 26.56 9.26 0.76 3.18 0.03 24.96 3.04 91 N C S 80.45 6.80 17.18 24.59 118.23 31.98 -115.46 156.86 73.53 15.35 11.12 21.78 30.06 24.17 1.88 8.28 0.08 10.39 3.37 92 T C T 89.16 6.88 14.61 22.42 98.64 -85.09 -74.54 -19.13 82.05 1.54 16.41 9.52 22.84 50.11 2.25 13.57 0.01 0.88 0.82 93 D C T 100.43 5.04 16.35 21.66 101.12 42.44 -91.02 5.09 82.38 2.76 14.86 10.74 24.14 48.21 2.09 12.02 0.02 1.68 1.10 94 R C T 111.03 9.62 16.43 26.51 109.49 70.08 -97.77 90.86 70.15 20.42 9.42 23.14 23.39 26.05 1.98 6.77 0.15 13.75 4.77 95 G C C 21.89 14.86 16.89 31.36 117.49 17.78 -77.31 164.54 69.01 28.48 2.52 41.10 15.63 12.93 0.50 2.15 0.01 25.15 2.54 96 K C E 64.37 13.88 20.33 34.04 115.08 -122.66 -99.51 132.80 51.56 47.77 0.67 42.76 6.29 1.82 0.17 0.54 0.00 46.26 2.17 97 T E E 45.53 18.07 18.41 35.14 131.55 -165.20 -127.22 147.48 25.25 74.65 0.10 22.21 2.20 0.27 0.03 0.07 0.00 74.22 1.00 98 Q E E 39.55 15.75 20.31 36.13 129.76 -170.29 -131.02 143.28 11.26 88.72 0.03 10.00 0.70 0.07 0.00 0.01 0.00 89.08 0.13 99 K E E 99.53 10.89 21.96 33.02 120.86 -139.98 -102.02 136.34 5.41 94.58 0.00 4.94 0.16 0.01 0.00 0.00 0.00 94.86 0.03 100 V E E 9.41 22.51 16.29 39.00 126.32 -170.74 -124.36 136.65 1.05 98.95 0.00 0.98 0.02 0.00 0.00 0.00 0.00 98.98 0.01 101 T E E 59.70 7.12 25.79 33.43 116.36 -147.12 -102.51 127.05 0.51 99.49 0.00 0.45 0.01 0.00 0.00 0.00 0.00 99.53 0.01 102 L E E 4.71 25.83 14.28 41.01 119.82 -163.90 -110.38 130.67 0.92 99.08 0.00 0.83 0.02 0.00 0.00 0.00 0.00 99.14 0.01 103 N E E 72.44 5.83 26.24 32.38 118.10 -160.91 -109.50 129.40 0.82 99.18 0.00 0.72 0.02 0.00 0.00 0.00 0.00 99.24 0.01 104 V E E 18.02 22.15 12.62 34.46 117.66 -155.26 -103.34 127.74 3.33 96.66 0.01 3.06 0.16 0.01 0.00 0.00 0.00 96.58 0.18 105 H E E 92.80 5.90 17.82 24.70 124.57 -168.65 -113.14 149.27 26.35 73.61 0.04 25.74 0.54 0.09 0.01 0.02 0.00 72.76 0.84 106 S C C 77.81 5.02 15.77 22.07 109.99 -100.36 -73.04 133.55 99.45 0.55 0.00 99.35 0.18 0.04 0.00 0.00 0.00 0.41 0.02