# 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 V C C 33.46 20.12 15.85 35.05 122.26 -162.46 -111.74 132.97 99.00 0.98 0.02 99.11 0.06 0.02 0.01 0.00 0.00 0.78 0.02 1 Q E E 91.72 7.15 21.64 29.54 121.98 -160.99 -113.98 133.36 44.51 54.44 1.05 43.01 0.85 0.52 0.51 0.42 0.00 52.46 2.22 2 L E E 50.96 18.54 13.67 31.39 118.22 -147.19 -99.11 129.31 32.50 65.27 2.23 28.35 2.58 1.05 0.94 1.13 0.00 64.46 1.48 3 L E E 68.79 9.98 19.20 29.90 120.06 -164.11 -109.41 133.63 29.59 67.97 2.44 24.98 3.36 1.31 1.02 1.27 0.00 66.65 1.41 4 E E E 98.64 11.15 17.49 28.91 117.30 -130.79 -94.40 133.18 38.55 57.59 3.86 29.66 6.53 3.16 1.20 2.56 0.01 55.43 1.46 5 S C C 47.22 13.33 15.86 28.91 113.49 -174.28 -104.72 118.54 62.02 33.32 4.66 38.90 14.18 9.75 1.11 3.53 0.00 31.03 1.49 6 G C S 43.60 7.76 18.83 26.84 107.61 -102.45 85.73 2.57 77.58 19.63 2.79 26.74 30.15 21.34 0.43 2.33 0.00 17.82 1.19 7 G C S 33.51 12.27 17.25 29.02 117.71 79.20 -94.95 173.28 79.92 18.27 1.80 29.95 33.60 16.61 0.19 1.74 0.00 16.86 1.05 8 G C E 29.22 10.15 19.37 29.70 123.20 -111.76 118.51 -173.36 55.28 44.32 0.39 35.91 17.19 2.75 0.05 0.42 0.00 42.73 0.95 9 L E E 78.54 12.01 20.23 31.96 119.44 -53.36 -100.01 135.43 19.87 79.98 0.15 16.31 3.47 0.40 0.04 0.13 0.00 78.29 1.36 10 V E E 22.39 19.53 15.25 34.64 124.54 -167.70 -120.31 136.04 8.42 91.52 0.06 7.35 0.76 0.04 0.05 0.02 0.00 79.99 11.80 11 Q C C 91.99 6.08 22.89 29.24 120.52 -131.39 -86.35 148.80 89.75 10.22 0.03 89.62 0.53 0.06 0.01 0.01 0.00 9.23 0.53 12 P C T 70.19 12.23 14.77 27.26 109.81 -86.12 -59.15 137.71 99.08 0.72 0.20 0.41 2.49 96.37 0.01 0.15 0.00 0.50 0.06 13 G C T 51.72 3.11 19.31 22.96 96.40 21.83 87.21 -4.95 99.35 0.50 0.15 0.54 3.06 95.86 0.00 0.13 0.00 0.38 0.03 14 G C C 24.04 9.08 15.99 26.46 128.43 115.41 -91.84 172.48 89.56 10.39 0.05 72.42 17.08 0.24 0.01 0.05 0.00 9.52 0.67 15 S E E 57.49 8.67 20.36 30.08 131.81 -126.27 -129.08 153.16 37.11 62.87 0.01 36.81 0.55 0.02 0.00 0.01 0.00 61.78 0.82 16 L E E 16.02 22.91 15.55 38.31 126.08 -160.31 -123.95 138.76 1.63 98.37 0.00 1.54 0.04 0.00 0.00 0.00 0.00 98.34 0.08 17 S E E 54.94 8.38 25.29 34.19 120.99 -156.11 -114.22 129.91 0.71 99.29 0.00 0.66 0.02 0.00 0.00 0.00 0.00 99.30 0.02 18 L E E 8.58 25.20 16.69 42.10 124.13 -170.60 -119.47 135.37 2.71 97.29 0.00 2.47 0.11 0.01 0.00 0.00 0.00 97.35 0.07 19 S E E 43.66 9.61 26.72 36.78 129.13 -168.96 -122.91 147.97 11.65 88.31 0.04 10.31 0.75 0.07 0.01 0.02 0.00 88.69 0.15 20 C E E 7.99 24.47 17.28 41.69 134.35 170.09 -140.45 148.83 16.14 83.73 0.13 14.66 1.05 0.13 0.04 0.07 0.00 83.57 0.48 21 A E E 39.72 9.91 26.97 37.44 123.80 -154.22 -114.63 139.44 13.03 86.74 0.23 11.81 1.03 0.21 0.11 0.13 0.00 83.80 2.91 22 A E E 8.27 24.39 15.14 39.43 125.29 -171.30 -123.62 134.96 42.34 56.98 0.68 39.43 2.21 0.55 0.18 0.54 0.00 54.30 2.79 23 S C E 61.47 6.47 21.62 28.71 124.43 -160.45 -112.19 146.54 61.81 37.33 0.86 22.54 18.34 23.14 0.08 0.88 0.00 33.64 1.39 24 G C S 51.62 2.93 21.41 24.58 96.49 16.98 81.02 3.25 78.28 21.10 0.62 18.32 33.34 26.90 0.04 0.73 0.00 19.73 0.95 25 F C C 40.78 21.00 10.99 30.91 118.42 140.27 -88.12 136.31 77.41 22.05 0.55 66.87 8.11 1.77 0.13 0.54 0.00 18.31 4.28 26 T C C 80.75 4.96 21.81 27.25 110.23 -168.41 -109.90 54.93 83.22 16.03 0.75 66.92 11.87 3.74 0.17 0.73 0.00 11.78 4.78 27 F C C 62.09 16.85 13.64 29.70 118.74 107.43 -103.66 134.65 83.18 13.50 3.31 43.31 26.67 13.87 0.58 2.99 0.00 8.54 4.04 28 S C S 74.69 4.92 19.17 24.71 97.18 -146.09 -80.12 -16.35 88.74 7.84 3.41 18.25 40.86 30.05 0.31 3.35 0.00 5.89 1.28 29 S C S 57.36 7.42 20.31 28.05 105.63 38.08 -111.11 6.90 83.02 13.53 3.45 22.54 33.72 26.98 0.30 3.40 0.00 11.91 1.15 30 F C C 29.46 20.33 16.28 35.99 129.52 86.31 -120.11 149.52 58.08 40.80 1.11 43.06 12.69 2.05 0.20 1.02 0.00 39.65 1.34 31 A E E 22.15 13.30 26.10 39.93 125.88 -144.82 -120.00 145.12 18.38 81.54 0.08 16.79 1.17 0.17 0.01 0.06 0.00 81.37 0.41 32 M E E 4.24 26.44 20.59 47.41 126.06 -162.54 -123.80 140.86 2.53 97.46 0.00 2.32 0.13 0.01 0.00 0.00 0.00 97.46 0.08 33 S E E 15.30 16.71 28.02 44.56 132.36 -175.04 -131.87 150.13 0.74 99.26 0.00 0.66 0.02 0.00 0.00 0.00 0.00 99.30 0.01 34 W E E 8.38 24.52 22.70 47.04 126.04 -155.82 -120.12 138.78 0.69 99.31 0.00 0.59 0.02 0.00 0.00 0.00 0.00 99.37 0.00 35 V E E 16.15 17.80 24.44 42.09 128.67 -170.81 -127.48 142.15 0.46 99.54 0.00 0.40 0.01 0.00 0.00 0.00 0.00 99.58 0.01 36 R E E 50.79 16.15 21.65 37.46 122.98 -160.10 -115.59 134.76 0.92 99.07 0.00 0.84 0.02 0.00 0.00 0.00 0.00 99.11 0.03 37 Q E E 67.96 11.77 18.24 30.63 113.53 -132.42 -90.77 124.49 5.35 94.64 0.01 4.68 0.34 0.03 0.00 0.01 0.00 94.82 0.13 38 A E E 26.62 11.68 12.57 25.83 118.38 -152.31 -95.23 141.64 36.31 63.64 0.05 32.91 2.05 0.19 0.01 0.05 0.00 64.32 0.47 39 P C T 90.93 4.28 12.57 18.34 105.41 -100.05 -62.07 145.45 94.98 0.72 4.30 0.68 5.12 87.88 0.05 5.73 0.00 0.44 0.10 40 V C T 136.38 0.70 12.85 12.42 97.54 19.68 -55.34 -7.19 95.80 0.09 4.12 0.51 4.12 89.76 0.04 5.50 0.00 0.04 0.02 41 K C T 134.67 3.00 12.04 16.16 103.40 40.24 -105.00 -5.07 96.07 0.74 3.19 1.88 8.45 84.49 0.06 4.47 0.00 0.51 0.14 42 G E E 28.44 4.62 15.98 22.22 125.50 -126.84 88.52 -166.44 27.26 72.63 0.11 18.44 6.90 2.18 0.02 0.13 0.00 71.52 0.81 43 L E E 54.20 15.86 13.46 29.21 115.71 -19.73 -79.55 136.09 11.66 88.32 0.01 10.07 0.70 0.06 0.00 0.02 0.00 89.07 0.08 44 E E E 71.10 10.32 21.50 32.36 127.50 -171.16 -126.73 140.99 1.30 98.70 0.00 1.10 0.06 0.00 0.00 0.00 0.00 98.82 0.01 45 W E E 84.94 16.06 20.00 35.62 110.93 -113.23 -73.25 127.42 0.43 99.57 0.00 0.41 0.01 0.00 0.00 0.00 0.00 99.58 0.01 46 V E E 11.01 20.85 21.33 42.35 101.76 176.10 -99.26 -30.67 4.40 95.60 0.00 2.50 1.41 0.04 0.00 0.00 0.00 96.04 0.01 47 S E E 5.43 20.52 22.88 43.49 143.31 -6.15 -159.26 155.60 0.99 99.01 0.00 0.69 0.11 0.01 0.00 0.00 0.00 99.19 0.00 48 M E E 41.21 17.90 23.77 40.79 132.13 -161.41 -136.71 144.29 0.46 99.54 0.00 0.38 0.02 0.00 0.00 0.00 0.00 99.59 0.01 49 I E E 19.29 18.37 20.34 38.95 121.81 -159.48 -118.02 129.91 1.24 98.76 0.00 1.04 0.08 0.00 0.00 0.00 0.00 98.73 0.14 50 S E E 27.73 11.41 19.60 31.99 120.14 -141.17 -86.56 150.72 27.78 72.15 0.08 24.64 2.01 0.25 0.01 0.06 0.00 72.48 0.55 51 A C T 54.41 12.82 15.13 28.08 94.44 -117.36 -67.95 -19.69 94.14 2.39 3.47 5.13 18.03 70.30 0.15 4.02 0.00 1.94 0.43 52 G C T 51.28 3.03 16.44 20.13 97.13 62.52 -83.68 -1.61 94.07 1.05 4.87 2.68 16.02 74.58 0.21 5.46 0.00 0.67 0.39 53 G C T 48.22 5.34 14.07 20.58 102.12 -91.46 90.86 4.05 93.72 1.13 5.15 8.84 31.89 51.84 0.23 6.11 0.00 0.67 0.41 54 G C C 46.24 4.88 15.02 21.11 104.98 115.59 -83.54 -17.28 96.51 2.30 1.19 36.27 33.44 26.74 0.12 1.35 0.00 1.60 0.48 55 N C C 94.63 5.02 17.50 23.48 122.81 27.64 -109.42 146.16 78.10 21.67 0.23 62.55 13.68 1.26 0.03 0.26 0.00 21.23 0.99 56 T E E 55.78 16.15 13.57 29.11 125.53 -151.51 -117.44 141.47 26.66 73.30 0.05 24.02 1.86 0.16 0.01 0.04 0.00 72.75 1.15 57 Y E E 86.57 10.59 20.99 32.08 127.51 -171.62 -128.87 141.95 5.43 94.55 0.01 4.51 0.87 0.04 0.01 0.01 0.00 93.73 0.83 58 Y E E 86.12 16.21 17.44 32.85 127.70 -156.52 -118.23 143.84 12.85 87.11 0.04 11.97 0.76 0.05 0.02 0.02 0.00 84.07 3.10 59 A C C 13.84 18.11 13.04 31.63 113.58 -109.83 -69.37 142.25 91.05 8.74 0.21 88.95 1.94 0.26 0.06 0.13 0.00 8.08 0.59 60 D C G 116.16 1.92 18.43 20.78 92.47 -122.13 -61.19 -32.59 53.52 0.51 45.97 1.98 6.33 43.44 2.02 45.69 0.00 0.30 0.23 61 S C T 61.67 7.08 17.43 25.60 90.66 62.36 -69.88 -18.83 53.30 0.23 46.47 0.73 3.73 47.69 1.61 45.99 0.00 0.12 0.11 62 V C G 9.49 22.25 10.80 33.12 98.69 42.84 -103.47 -0.86 54.03 1.37 44.60 2.78 6.08 43.48 2.39 43.83 0.02 0.85 0.58 63 K C T 124.46 6.79 14.72 24.08 111.25 123.08 -60.56 130.90 93.14 2.88 3.98 2.94 4.31 86.49 1.00 2.29 0.00 1.48 1.49 64 G C T 62.96 1.15 18.33 18.30 93.32 13.84 80.77 -2.38 95.86 0.44 3.71 0.80 3.73 91.96 0.37 2.72 0.00 0.29 0.13 65 R C T 87.94 12.12 16.94 29.37 100.19 81.04 -99.10 -20.20 95.12 1.39 3.49 5.83 19.69 69.62 0.37 3.01 0.00 1.26 0.22 66 F E E 9.89 23.99 12.31 36.53 135.99 36.42 -137.21 152.10 18.45 81.45 0.10 14.11 4.44 0.35 0.03 0.07 0.00 78.55 2.45 67 T E E 65.64 5.95 26.35 32.89 125.33 -160.15 -122.96 141.86 3.48 96.51 0.01 3.24 0.15 0.01 0.00 0.00 0.00 96.40 0.20 68 I E E 23.30 24.11 14.28 38.04 122.97 -159.70 -119.71 131.30 2.93 97.05 0.01 2.83 0.08 0.01 0.00 0.00 0.00 96.96 0.12 69 S E E 48.29 6.64 25.18 32.28 132.97 172.66 -133.83 153.28 7.11 92.86 0.03 6.58 0.38 0.05 0.01 0.01 0.00 92.69 0.27 70 R E E 89.13 18.04 14.02 30.95 124.06 -150.26 -117.10 138.99 26.42 73.39 0.20 23.52 2.67 0.39 0.05 0.15 0.00 71.75 1.47 71 D C C 56.16 8.61 15.91 25.91 110.94 -144.58 -99.82 112.23 79.63 19.98 0.38 74.92 3.27 0.81 0.09 0.30 0.00 19.13 1.49 72 N C T 108.27 6.22 13.68 21.78 93.89 -152.60 -74.21 -15.36 93.08 1.59 5.33 8.04 30.39 54.16 0.31 5.58 0.00 1.12 0.40 73 S C T 85.38 1.69 16.51 17.71 94.61 61.51 -82.09 -15.39 91.15 2.55 6.30 5.05 29.69 56.10 0.38 6.35 0.00 1.72 0.72 74 K C S 91.85 9.56 16.00 25.83 107.99 43.87 -105.30 42.73 93.62 1.09 5.29 8.32 43.88 41.00 0.34 5.44 0.00 0.63 0.40 75 S C T 38.68 14.34 17.05 31.40 99.27 -134.90 -87.02 27.37 97.88 1.41 0.71 16.13 39.74 41.95 0.06 0.80 0.00 1.11 0.22 76 T E E 29.87 12.68 21.88 35.59 131.59 103.05 -126.16 149.05 39.07 60.85 0.08 30.66 7.55 0.39 0.02 0.08 0.00 57.00 4.31 77 L E E 5.57 24.54 18.96 44.01 122.91 -156.82 -116.63 135.85 13.38 86.61 0.01 12.60 0.43 0.03 0.00 0.01 0.00 85.98 0.95 78 Y E E 51.52 13.16 26.76 40.39 122.00 -158.01 -113.43 133.43 5.62 94.38 0.00 4.93 0.36 0.01 0.00 0.00 0.00 94.62 0.07 79 L E E 3.52 26.03 20.03 46.79 119.93 -164.01 -111.55 128.89 0.68 99.32 0.00 0.68 0.01 0.00 0.00 0.00 0.00 99.29 0.01 80 Q E E 59.68 11.23 27.08 38.70 119.48 -161.84 -112.87 127.84 0.35 99.65 0.00 0.36 0.00 0.00 0.00 0.00 0.00 99.60 0.03 81 M E E 10.59 24.04 16.40 40.60 120.12 -168.57 -115.13 131.28 19.31 80.68 0.01 19.58 0.16 0.01 0.00 0.00 0.00 79.35 0.89 82 S C S 54.18 7.07 22.58 29.88 108.92 -153.53 -85.41 -24.24 95.67 4.28 0.06 41.77 49.73 3.61 0.00 0.10 0.00 4.57 0.23 83 S C S 57.51 5.87 24.22 30.01 111.16 7.48 -140.71 95.88 98.60 1.35 0.04 18.08 77.19 3.44 0.00 0.06 0.00 0.99 0.24 84 L C C 19.04 23.95 12.48 36.22 112.55 -140.05 -76.47 127.60 98.66 1.33 0.01 97.65 1.24 0.03 0.00 0.00 0.00 0.55 0.53 85 T C C 54.03 5.80 24.66 30.56 134.92 173.56 -129.70 165.82 96.75 3.21 0.04 95.13 1.54 0.01 0.01 0.01 0.00 0.56 2.74 86 A H G 48.15 14.75 16.24 30.87 90.69 -97.98 -59.80 -32.39 4.23 0.03 95.74 0.25 0.31 2.81 0.46 96.14 0.00 0.02 0.00 87 E H G 114.73 5.52 22.41 28.87 90.19 63.14 -70.42 -17.42 3.52 0.04 96.44 0.16 0.23 2.46 0.45 96.67 0.00 0.03 0.00 88 D H G 11.05 21.98 17.54 39.88 93.87 61.63 -86.72 -2.09 4.45 0.05 95.50 0.72 0.53 1.96 0.56 96.18 0.00 0.04 0.00 89 T C C 29.53 17.68 22.42 39.85 116.02 105.74 -81.85 134.94 90.41 8.51 1.08 84.96 5.38 0.53 0.22 0.78 0.00 7.36 0.78 90 A E E 8.94 20.72 23.52 43.31 141.86 160.91 -151.16 168.34 10.61 89.32 0.07 9.72 1.03 0.11 0.03 0.04 0.00 88.18 0.89 91 V E E 27.19 17.31 26.52 43.40 118.50 -108.61 -104.03 131.90 1.39 98.60 0.01 1.34 0.06 0.01 0.00 0.00 0.00 98.53 0.05 92 Y E E 7.63 25.14 22.67 47.58 123.55 -162.25 -113.16 137.38 0.63 99.36 0.00 0.60 0.03 0.00 0.00 0.00 0.00 99.35 0.02 93 Y E E 22.02 19.99 27.92 46.95 132.04 -172.71 -129.62 150.02 1.53 98.45 0.02 1.34 0.09 0.01 0.01 0.01 0.00 98.50 0.04 94 C E E 3.65 24.88 24.59 49.03 127.58 -157.96 -122.36 142.70 10.65 89.16 0.20 9.02 1.05 0.19 0.05 0.08 0.00 89.35 0.24 95 A E E 8.00 20.37 24.87 44.70 127.70 -155.57 -120.23 145.57 19.24 80.11 0.65 16.74 2.19 0.57 0.25 0.36 0.00 78.82 1.08 96 K E E 49.45 16.75 22.25 38.34 125.36 -155.65 -115.10 141.25 33.40 65.49 1.12 27.13 5.78 1.50 0.46 0.75 0.00 60.84 3.53 97 S C C 27.51 13.92 17.27 31.69 119.14 -134.57 -96.45 148.93 61.14 36.93 1.93 47.74 10.17 2.98 0.62 1.43 0.00 34.20 2.86 98 D C C 90.46 6.63 16.60 24.17 103.02 -136.03 -83.50 1.59 77.59 12.64 9.76 43.35 19.39 15.88 2.18 7.43 0.02 9.56 2.20 99 S C T 73.37 4.92 13.91 20.05 102.97 84.64 -84.94 8.38 78.78 4.20 17.02 20.22 22.82 37.01 3.24 12.57 0.03 2.47 1.65 100 S C T 73.16 5.11 13.21 19.57 103.76 53.80 -87.28 18.55 79.40 2.96 17.63 17.11 22.83 40.37 3.44 13.17 0.03 1.61 1.44 101 G C C 44.37 5.63 14.40 21.18 106.21 -83.71 80.92 8.31 82.35 6.45 11.20 32.09 26.66 24.68 2.62 8.01 0.02 3.63 2.27 102 F C C 94.36 10.99 11.47 23.05 112.80 130.93 -91.83 128.03 75.58 14.25 10.17 45.61 16.84 13.51 3.58 6.51 0.04 9.12 4.78 103 Q C C 105.85 6.15 14.93 22.39 113.83 -161.02 -98.77 124.95 73.14 16.07 10.79 42.58 15.89 15.43 3.87 6.73 0.06 10.61 4.83 104 Y C C 123.15 9.21 12.90 22.93 111.30 -133.92 -94.08 120.98 76.30 10.53 13.17 30.13 18.73 29.15 4.35 7.84 0.08 6.48 3.23 105 G C T 44.30 5.68 15.85 22.44 107.26 14.14 82.78 -63.77 81.85 4.95 13.20 24.57 22.97 35.67 3.58 8.55 0.02 2.91 1.73 106 R C C 127.32 7.46 16.22 24.44 111.19 22.23 -97.53 101.65 75.77 7.69 16.55 28.56 23.09 25.97 4.43 10.80 0.06 4.62 2.47 107 R C C 90.30 13.81 15.91 29.47 116.09 -140.45 -99.30 130.24 66.24 18.83 14.94 35.10 17.32 15.87 4.64 9.57 0.09 13.43 3.99 108 E C C 61.84 14.42 18.92 33.19 116.19 -152.09 -98.76 127.91 59.76 28.02 12.22 40.12 11.59 9.18 4.27 7.72 0.04 23.32 3.75 109 F C C 67.54 15.40 20.17 35.03 117.96 -156.08 -103.74 128.05 51.79 40.07 8.15 35.39 9.45 7.30 3.68 4.95 0.07 31.83 7.33 110 W C C 60.66 18.40 19.15 36.36 112.45 -161.35 -99.58 109.71 58.93 35.50 5.57 35.37 11.43 13.08 2.42 3.31 0.09 26.35 7.94 111 G C C 21.02 15.15 20.73 34.70 117.88 -126.41 80.06 -162.82 80.12 16.65 3.23 39.85 21.22 20.11 0.74 2.47 0.01 12.94 2.67 112 Q C S 90.45 10.76 22.04 32.29 102.24 -39.39 -82.59 29.53 82.69 14.04 3.28 26.62 32.26 24.92 0.58 2.62 0.01 10.43 2.54 113 G C C 20.49 15.09 20.13 34.38 114.60 -88.42 93.42 -160.97 79.29 19.58 1.13 32.53 30.25 16.74 0.12 1.16 0.00 18.02 1.18 114 T E E 25.30 19.10 20.03 38.31 118.37 -94.93 -100.02 134.06 43.81 56.04 0.15 37.26 5.09 0.57 0.03 0.14 0.00 56.10 0.82 115 L E E 66.95 12.01 24.22 36.08 116.82 -140.24 -97.83 127.93 5.50 94.48 0.01 5.02 0.37 0.03 0.00 0.01 0.00 94.30 0.28 116 V E E 12.45 23.38 16.91 40.17 121.70 -166.09 -113.42 131.23 2.28 97.72 0.00 2.21 0.07 0.01 0.00 0.00 0.00 97.61 0.10 117 T E E 58.97 8.27 24.34 32.89 119.85 -159.33 -107.80 132.00 4.90 95.09 0.01 4.74 0.16 0.02 0.00 0.00 0.00 94.75 0.33 118 V E E 24.29 21.15 13.06 33.45 118.71 -159.10 -108.06 128.62 33.90 66.05 0.05 33.17 0.48 0.09 0.01 0.03 0.00 65.10 1.12 119 S C C 55.23 7.36 20.35 27.92 121.16 -162.37 -102.95 154.37 99.64 0.36 0.00 99.65 0.06 0.01 0.00 0.00 0.00 0.28 0.01