A0A087YKP5_POEFO Loading...

Unk zinc finger

AlphaFold DB , UniProt , Accession A0A087YKP5, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 814 aa.

						>A0A087YKP5_POEFO|A0A087YKP5
MSKTNSQPASSSAATTATGGPSSSSSSSPAGGSTSPATVLNVQPEKPQHYTYLKEFRTEQCPLFVQHKCTQHRPFSCFHWHFLNQRRRRPIRRRDGTFNYSPDVYCTKYDEGTGTCPEGDECPFLHRTAGDTERRYHLRYYKTGSCIHETDAKGHCSKNGSHCAFAHGSHDLRSPVYDIREVQVLDSQGGSGAAEGGGSGDAQSGQAASTALIEKILSEEPRWQDNNYVLTHYKTELCKKPPRLCRQGYACPYYHNSKDRRRSPHKHKYRALPCPAVKQGEEWGDPSKCEGAEGCQYCHTRTEQQFHPEIYKSTKCNDMQQCGSCPRGPFCAFAHVEKPFAAEESIFPSPGSPPPPRLPDPLPGHDVSQSPGGHGMGLGSASDHFSPSAVSCVAEQGLLGSVLSLCEGASGGGDPLSPWAGERGYGRAPGFEREDQAKHRGFALEHRSREFASTQSKQDLLVFLPVGSPLSLSSSIPSSLAATPPSPAALGPPGSGISSGMNANALPFYPTSETVESVVESALDDLDLNDFGVSALERSMESSSALPSVGVMLGGSQIQSSAPVNIPGSFSSSAPFSSPSPSPPVRPQASPFFSSHPSQPSLSESPFLGPSHSTLGLNGMSTNIWEHFPSGQGSPGTPPALLPSGPCAETARLKQELEDAHRALKQWGHSWRHTAQSWAAVKADAEESRANAARFAVEAERAREAEEEAQRQISLVQEALESLRSGDNPHLALHQLQLLHRLPLESVLSLQAQLCSCLHAVEQVVYRKQRQCCVTCGEQGSASLPCGHGLQCESCSSSTECPLCPEQTAEQQLS
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	30.5	Very low	31.8	Very low	239 Å²	239	142.3 Å²	142.3	100%	1.177	83%	0.833	S	S	*	*				0	124.3	0	-59.1	165.1	93.3	0	0	106
2	S	33.3	Very low	31.6	Very low	115 Å²	115	139.9 Å²	139.9	80%	0.804	83%	0.83	S	S	*	*			cis	-147.8	168.8	-2.6	-73.2	0	0	0	0	110
3	K	34.9	Very low	31.3	Very low	207 Å²	207	137 Å²	137	90%	0.9	83%	0.831	S	S	*	*			trans	-75.1	149.3	-175.6	-61.9	175.7	179.5	176.7	0	112.6
4	T	32.2	Very low	31.2	Very low	143 Å²	143	133.4 Å²	133.4	88%	0.877	82%	0.822	S	S	*	*			trans	-131.8	128.2	153	48.3	0	0	0	0	109.7
5	N	28.6	Very low	31	Very low	155 Å²	155	132.9 Å²	132.9	83%	0.829	82%	0.819	S	S	*	*			trans	-151.3	140.1	165.3	-179.7	33.4	0	0	0	107.1
6	S	28	Very low	30.8	Very low	108 Å²	108	133.4 Å²	133.4	76%	0.755	82%	0.822	S	S	*	*			trans	-147.4	118.3	-174.4	-57	0	0	0	0	111.1
7	Q	30.4	Very low	30.8	Very low	174 Å²	174	130.7 Å²	130.7	81%	0.813	82%	0.816	S	S	*	*			trans	-80.4	173.5	149.8	-61.3	-170.6	-71.6	0	0	108.8
8	P	43.9	Very low	30.6	Very low	126 Å²	126	132 Å²	132	82%	0.818	82%	0.823	S	S	*	*				-138.1	170.4	93.3	39.9	-29.4	0	0	0	114.4
9	A	28.5	Very low	30.5	Very low	82 Å²	82	129.4 Å²	129.4	68%	0.678	83%	0.825	S	S	*	*			trans	-90.7	-176.1	159.8	0	0	0	0	0	108.7
10	S	31.4	Very low	30.3	Very low	105 Å²	105	126.7 Å²	126.7	73%	0.734	82%	0.822	S	S	*	*			cis	-164.6	-178.2	28.7	-60.5	0	0	0	0	111.1
11	S	28.4	Very low	31.2	Very low	111 Å²	111	126.6 Å²	126.6	78%	0.776	82%	0.822	S	S	*	*			trans	81.4	154.4	149.3	82.9	0	0	0	0	119
12	S	29.2	Very low	31	Very low	114 Å²	114	120.3 Å²	120.3	80%	0.797	80%	0.801	S	S	*	*			cis	-169.8	162.7	-28.2	-98.7	0	0	0	0	111.6
13	A	28.1	Very low	30.9	Very low	102 Å²	102	120.3 Å²	120.3	84%	0.843	80%	0.801	S	S	*	*			trans	77	149.6	157.3	0	0	0	0	0	120
14	A	29	Very low	30.6	Very low	86 Å²	86	115.9 Å²	115.9	71%	0.711	80%	0.797	S	S	*	*			trans	-105.8	-172.8	173	0	0	0	0	0	109
15	T	29.3	Very low	30.4	Very low	126 Å²	126	114.6 Å²	114.6	77%	0.773	79%	0.793	S	S	*	*			cis	-164.8	-178	19.8	-20.2	0	0	0	0	109.7
16	T	27.7	Very low	30.4	Very low	142 Å²	142	112.7 Å²	112.7	87%	0.871	79%	0.792	S	S	*	*			trans	108.2	155.6	157.5	72	0	0	0	0	116.6
17	A	29.7	Very low	30.5	Very low	87 Å²	87	113.3 Å²	113.3	72%	0.719	80%	0.797	S	S	*	*			trans	-143.1	159.2	-166.3	0	0	0	0	0	110.3
18	T	28.4	Very low	30.4	Very low	154 Å²	154	110.5 Å²	110.5	95%	0.945	80%	0.796	S	S	*	*			trans	171.7	154.6	137.8	28.2	0	0	0	0	109.9
19	G	27.2	Very low	30.4	Very low	83 Å²	83	111 Å²	111	86%	0.856	80%	0.799	S	S	*	*			trans	117.3	111.3	166.3	0	0	0	0	0	116.8
20	G	27.3	Very low	30.5	Very low	74 Å²	74	112.1 Å²	112.1	76%	0.763	81%	0.808	S	S	*	*			trans	-133.5	-152	147.9	0	0	0	0	0	106.9
21	P	50	Low	30.3	Very low	125 Å²	125	111.1 Å²	111.1	81%	0.812	82%	0.815	S	S	*	*			cis	-128.5	172.3	-23.8	40.9	-27.3	0	0	0	112.5
22	S	26.2	Very low	30.2	Very low	108 Å²	108	109.5 Å²	109.5	76%	0.755	82%	0.816	S	S	*	*			trans	178.6	134.6	156	-77.6	0	0	0	0	107.5
23	S	29.7	Very low	30.4	Very low	114 Å²	114	109.8 Å²	109.8	80%	0.797	82%	0.818	S	S	*	*				51.7	132.8	65.7	69.5	0	0	0	0	113.6
24	S	29.1	Very low	30.5	Very low	115 Å²	115	111.2 Å²	111.2	80%	0.804	82%	0.816	S	S	*	*			cis	-145.2	-179.8	-6.2	59.4	0	0	0	0	107.4
25	S	28.3	Very low	30.4	Very low	116 Å²	116	112.4 Å²	112.4	81%	0.811	82%	0.819	S	S	*	*				-173.9	176.7	53.4	51.8	0	0	0	0	111.2
26	S	28.6	Very low	30.6	Very low	115 Å²	115	112.3 Å²	112.3	80%	0.804	82%	0.821	S	S	*	*			trans	-104	158.4	-170.7	51.2	0	0	0	0	115.3
27	S	29.2	Very low	30.7	Very low	121 Å²	121	109.8 Å²	109.8	85%	0.846	82%	0.815	S	S	*	*			trans	-163.6	141.2	145.2	43.8	0	0	0	0	111.5
28	S	30.1	Very low	30.9	Very low	115 Å²	115	111.8 Å²	111.8	80%	0.804	82%	0.818	S	S	*	*			trans	-122.9	155.3	170.3	-52.8	0	0	0	0	109
29	P	43.8	Very low	31.2	Very low	135 Å²	135	110.8 Å²	110.8	88%	0.877	81%	0.811	S	S	*	*			trans	-120.7	174.7	137.9	35.4	-28.3	0	0	0	111.5
30	A	30	Very low	31.6	Very low	106 Å²	106	113.4 Å²	113.4	88%	0.876	81%	0.805	S	S	*	*			trans	-115.2	170.7	-166.7	0	0	0	0	0	113.6
31	G	27	Very low	32	Very low	85 Å²	85	116 Å²	116	88%	0.876	80%	0.801	S	S	*	*			trans	103	96.2	159	0	0	0	0	0	115.6
32	G	25.3	Very low	31.8	Very low	77 Å²	77	116 Å²	116	79%	0.794	80%	0.798	S	S	*	*			trans	177.4	84	173.2	0	0	0	0	0	112
33	S	33.6	Very low	33	Very low	120 Å²	120	117.2 Å²	117.2	84%	0.839	79%	0.792	S	S	*	*			trans	-89.3	108.2	-178.5	-169.2	0	0	0	0	111.6
34	T	30.1	Very low	35.1	Very low	132 Å²	132	116.9 Å²	116.9	81%	0.81	79%	0.787	S	S	*	*			trans	-137.7	106.4	163.4	55.4	0	0	0	0	108.9
35	S	28.2	Very low	37.7	Very low	111 Å²	111	114.6 Å²	114.6	78%	0.776	76%	0.764	S	S	*	*	P	Polyproline II helix	trans	-63.3	135.1	-177.7	-52.7	0	0	0	0	111.9	A37	S35-A37 PolarHBondContact O-N 2.93Å
36	P	34.1	Very low	40.6	Very low	124 Å²	124	113 Å²	113	81%	0.805	74%	0.743	S	S	*	*	P	Polyproline II helix	trans	-68.6	131.3	166	29.7	-32.5	0	0	0	109.3
37	A	29.6	Very low	43.6	Very low	89 Å²	89	112.8 Å²	112.8	74%	0.736	74%	0.738	S	S	*	*	P	Polyproline II helix	trans	-65.4	152.9	179.3	0	0	0	0	0	112.3	S35 V39	S35-A37 PolarHBondContact O-N 2.93Å; A37-V39 PolarHBondContact O-N 3.12Å
38	T	34	Very low	46.5	Very low	128 Å²	128	114.1 Å²	114.1	79%	0.785	73%	0.731	S	S	*	*			trans	-46.7	100.1	-173.2	-50.4	0	0	0	0	114.1	L40	T38-L40 HydrophobicContact CG2-CD2 4.36Å; T38-L40 PolarHBondContact O-N 3.28Å
39	V	33.9	Very low	49.6	Very low	133 Å²	133	108.9 Å²	108.9	81%	0.806	69%	0.694	S	S	*	*			trans	-76.8	102.8	163.9	-179.4	0	0	0	0	107.6	A37	A37-V39 PolarHBondContact O-N 3.12Å
40	L	36.3	Very low	52.1	Low	139 Å²	139	107.8 Å²	107.8	73%	0.728	67%	0.673	S	S	*	*			trans	-53.8	141.3	173.9	-67.7	172.3	0	0	0	110.7	T38 V42	T38-L40 HydrophobicContact CG2-CD2 4.36Å; T38-L40 PolarHBondContact O-N 3.28Å; L40-V42 PolarHBondContact O-N 3.28Å
41	N	34.8	Very low	55.2	Low	127 Å²	127	105.3 Å²	105.3	68%	0.679	65%	0.647	S	S	*	*			trans	-65.2	90	-173.2	-174.5	19.5	0	0	0	112.4	Q43	N41-Q43 PolarHBondContact O-N 3.3Å
42	V	45.8	Very low	58.5	Low	125 Å²	125	102.9 Å²	102.9	76%	0.758	61%	0.612	S	S	*	*			trans	-76.6	93.4	175.4	-177	0	0	0	0	109.3	L40	L40-V42 PolarHBondContact O-N 3.28Å
43	Q	52	Low	62	Low	134 Å²	134	99.6 Å²	99.6	63%	0.626	58%	0.576	S	S	*	*	P	Polyproline II helix	trans	-50.3	128.9	164.4	-73.9	-72.1	-8.1	0	0	109.7	N41 E45	N41-Q43 PolarHBondContact O-N 3.3Å; Q43-E45 PolarHBondContact O-N 3.03Å
44	P	73.1	Confident	65	Low	107 Å²	107	97.3 Å²	97.3	70%	0.695	55%	0.551	S	S	*	*	P	Polyproline II helix	trans	-64.3	135.4	-173.5	24.2	-33.1	0	0	0	111.8	K46	P44-K46 PolarHBondContact O-N 2.94Å
45	E	84.6	Confident	68.1	Low	67 Å²	67	94.2 Å²	94.2	31%	0.313	53%	0.527	S	S	.	.	P	Polyproline II helix	trans	-56.7	128.9	179.5	-172	71	-94.3	0	0	110.9	Q43 H49 Y50 L53 R173	Q43-E45 PolarHBondContact O-N 3.03Å; E45-H49 HydrophobicContact CG-CB 4.45Å; E45-Y50 HydrophobicContact CG-CD2 4.43Å; E45-L53 HydrophobicContact CG-CD1 4.27Å; E45-L53 WeakPolarHBondContact OE2-CD1 3.38Å; E45-R173 VanDerWaalsContact OE1-CD 3.24Å; E45-R173 WeakPolarHBondContact OE1-CD 3.37Å; E45-R173 IonicContact OE1-CZ 3.85Å; E45-R173 IonicContact OE1-NE 3.32Å; E45-R173 PolarHBondContact OE1-NE 3.29Å; E45-R173 IonicContact OE2-CZ 2.74Å; E45-R173 IonicContact OE2-NE 2.73Å; E45-R173 PolarHBondContact OE2-NE 3.2Å; E45-R173 IonicContact OE2-NH2 3.16Å; E45-R173 PolarHBondContact OE2-NH2 3.08Å
46	K	89.1	Confident	71.4	Confident	84 Å²	84	89.2 Å²	89.2	37%	0.365	49%	0.491	S	S	.	.	P	Polyproline II helix	trans	-60.5	134.9	-176.8	-68	166.8	-174.3	167.9	0	109.2	P44 Q48 H49 Y50 H170 L172	P44-K46 PolarHBondContact O-N 2.94Å; K46-Q48 VanDerWaalsContact C-N 3.29Å; K46-Q48 PolarHBondContact O-N 3.18Å; K46-Q48 VanDerWaalsContact O-N 3.11Å; K46-H49 HydrophobicContact CB-CB 4.2Å; K46-H49 WeakPolarHBondContact O-CA 3.46Å; K46-H49 WeakPolarHBondContact O-CB 3.37Å; K46-H49 PolarHBondContact O-N 3.03Å; K46-Y50 PolarHBondContact O-N 3.03Å; K46-H170 PolarHBondContact NZ-O 2.83Å; K46-L172 PolarHBondContact NZ-O 2.66Å
47	P	90.4	Very high	74.4	Confident	109 Å²	109	84.2 Å²	84.2	71%	0.708	46%	0.457	S	S	*	.	H	α-helix	trans	-52.8	-42.3	-171.4	-31	35.7	0	0	0	114.5	Y50 T51	P47-Y50 PolarHBondContact O-N 3.18Å; P47-T51 PolarHBondContact O-N 3.15Å; P47-T51 PolarHBondContact O-OG1 3.1Å
48	Q	90.9	Very high	77.6	Confident	149 Å²	149	80.5 Å²	80.5	70%	0.696	43%	0.425	S	S	*	.	H	α-helix	trans	-64.3	-43.5	175.7	-62.8	-176.3	4.7	0	0	112.4	K46 Y50 T51 Y52	K46-Q48 VanDerWaalsContact C-N 3.29Å; K46-Q48 PolarHBondContact O-N 3.18Å; K46-Q48 VanDerWaalsContact O-N 3.11Å; Q48-Y50 VanDerWaalsContact C-N 3.33Å; Q48-Y50 PolarHBondContact O-N 3.06Å; Q48-T51 PolarHBondContact O-N 3.16Å; Q48-Y52 WeakPolarHBondContact O-CD2 3.38Å; Q48-Y52 PolarHBondContact O-N 3.28Å; Q48-Y52 VanDerWaalsContact O-N 3.1Å
49	H	95.2	Very high	80.6	Confident	6 Å²	6	79.9 Å²	79.9	3%	0.028	41%	0.413	C	S	.	.	H	α-helix	trans	-63.1	-41.5	178	-67.5	-178.4	0	0	0	110.9	E45 K46 Y52 L53 Y141 D171	E45-H49 HydrophobicContact CG-CB 4.45Å; K46-H49 HydrophobicContact CB-CB 4.2Å; K46-H49 WeakPolarHBondContact O-CA 3.46Å; K46-H49 WeakPolarHBondContact O-CB 3.37Å; K46-H49 PolarHBondContact O-N 3.03Å; H49-Y52 PolarHBondContact O-N 2.9Å; H49-L53 WeakPolarHBondContact O-CB 3.34Å; H49-L53 WeakPolarHBondContact O-CD1 3.47Å; H49-L53 VanDerWaalsContact O-CG 3.25Å; H49-L53 WeakPolarHBondContact O-CG 3.16Å; H49-L53 PolarHBondContact O-N 3.02Å; H49-Y141 HydrophobicContact CB-CE1 3.92Å; H49-Y141 AromaticContact CD2-CE1 3.98Å; H49-Y141 AromaticContact CG-CE1 3.98Å; H49-D171 IonicContact CD2-OD1 2.87Å; H49-D171 PolarHBondContact CE1-O 2.97Å; H49-D171 IonicContact CE1-OD1 2.83Å; H49-D171 IonicContact NE2-OD1 2.74Å; H49-D171 PolarHBondContact NE2-OD1 3.27Å
50	Y	95.1	Very high	83.6	Confident	112 Å²	112	77.8 Å²	77.8	44%	0.439	40%	0.395	S	S	.	.	H	α-helix	trans	-59.3	-45.6	174.3	-177.6	-108	0	0	0	112.3	E45 K46 P47 Q48 Y52 L53 K54	E45-Y50 HydrophobicContact CG-CD2 4.43Å; K46-Y50 PolarHBondContact O-N 3.03Å; P47-Y50 PolarHBondContact O-N 3.18Å; Q48-Y50 VanDerWaalsContact C-N 3.33Å; Q48-Y50 PolarHBondContact O-N 3.06Å; Y50-Y52 PolarHBondContact O-N 3Å; Y50-L53 PolarHBondContact O-N 3.18Å; Y50-K54 HydrophobicContact CE1-CD 3.87Å; Y50-K54 WeakPolarHBondContact O-CB 3.4Å; Y50-K54 PolarHBondContact O-N 3Å
51	T	96.1	Very high	86.5	Confident	54 Å²	54	71.3 Å²	71.3	33%	0.331	36%	0.361	S	S	.	.	H	α-helix	trans	-59.2	-47	176	-58.5	0	0	0	0	112	P47 Q48 K54 E55 F78	P47-T51 PolarHBondContact O-N 3.15Å; P47-T51 PolarHBondContact O-OG1 3.1Å; Q48-T51 PolarHBondContact O-N 3.16Å; T51-K54 PolarHBondContact O-N 3.39Å; T51-E55 WeakPolarHBondContact O-CB 3.47Å; T51-E55 PolarHBondContact O-N 3.18Å; T51-F78 HydrophobicContact CG2-CZ 3.97Å
52	Y	97.1	Very high	89.4	Confident	34 Å²	34	68.9 Å²	68.9	13%	0.133	35%	0.352	C	S	.	.	H	α-helix	trans	-63.1	-44.6	176.4	-85.6	-80.7	0	0	0	112.5	Q48 H49 Y50 K54 F56 F78 R87 Y136 Y141 S161 H162	Q48-Y52 WeakPolarHBondContact O-CD2 3.38Å; Q48-Y52 PolarHBondContact O-N 3.28Å; Q48-Y52 VanDerWaalsContact O-N 3.1Å; H49-Y52 PolarHBondContact O-N 2.9Å; Y50-Y52 PolarHBondContact O-N 3Å; Y52-K54 VanDerWaalsContact C-N 3.34Å; Y52-K54 PolarHBondContact O-N 3.5Å; Y52-F56 HydrophobicContact CD1-CB 3.84Å; Y52-F56 AromaticContact CD1-CD2 3.78Å; Y52-F56 HydrophobicContact CD1-CD2 3.78Å; Y52-F56 AromaticContact CD1-CG 3.9Å; Y52-F56 HydrophobicContact CD1-CG 3.9Å; Y52-F56 AromaticContact CE1-CD2 3.77Å; Y52-F56 HydrophobicContact CE1-CD2 3.77Å; Y52-F56 HydrophobicContact CE1-CE2 4.24Å; Y52-F56 HydrophobicContact CE1-CG 4.35Å; Y52-F56 WeakPolarHBondContact O-CB 3.11Å; Y52-F56 PolarHBondContact O-N 2.86Å; Y52-F78 AromaticContact CD1-CE2 3.82Å; Y52-F78 HydrophobicContact CD1-CE2 3.82Å; Y52-F78 HydrophobicContact CE1-CD2 4.18Å; Y52-F78 AromaticContact CE1-CE2 3.72Å; Y52-F78 HydrophobicContact CE1-CE2 3.72Å; Y52-F78 HydrophobicContact CG-CE2 4.31Å; Y52-R87 PolarHBondContact O-NH1 2.86Å; Y52-Y136 HydrophobicContact CD1-CD1 4.26Å; Y52-Y136 AromaticContact CD1-CE1 3.81Å; Y52-Y136 HydrophobicContact CD1-CE1 3.81Å; Y52-Y136 HydrophobicContact CE1-CE1 4.39Å; Y52-Y141 VanDerWaalsContact CB-OH 3.32Å; Y52-Y141 WeakPolarHBondContact CB-OH 3.18Å; Y52-Y141 VanDerWaalsContact CD2-OH 3.27Å; Y52-Y141 WeakPolarHBondContact CD2-OH 3.37Å; Y52-Y141 HydrophobicContact CG-CE2 4.38Å; Y52-Y141 AromaticContact CG-CZ 3.95Å; Y52-Y141 VanDerWaalsContact CG-OH 3.27Å; Y52-S161 PolarHBondContact OH-O 2.81Å; Y52-H162 HydrophobicContact CE1-CB 4.25Å; Y52-H162 AromaticContact CE1-ND1 3.54Å; Y52-H162 AromaticContact CZ-ND1 3.65Å; Y52-H162 PolarHBondContact OH-ND1 3.22Å
53	L	97	Very high	91.7	Very high	7 Å²	7	67.1 Å²	67.1	4%	0.037	34%	0.338	C	S	.	.	H	α-helix	trans	-62.7	-39.4	177.6	-74.5	164.4	0	0	0	112.4	E45 H49 Y50 R87 L138 Y141	E45-L53 HydrophobicContact CG-CD1 4.27Å; E45-L53 WeakPolarHBondContact OE2-CD1 3.38Å; H49-L53 WeakPolarHBondContact O-CB 3.34Å; H49-L53 WeakPolarHBondContact O-CD1 3.47Å; H49-L53 VanDerWaalsContact O-CG 3.25Å; H49-L53 WeakPolarHBondContact O-CG 3.16Å; H49-L53 PolarHBondContact O-N 3.02Å; Y50-L53 PolarHBondContact O-N 3.18Å; L53-R87 PolarHBondContact O-NH1 3.29Å; L53-R87 PolarHBondContact O-NH2 3.41Å; L53-L138 HydrophobicContact CD1-CD2 4.16Å; L53-L138 HydrophobicContact CD2-CD2 4.05Å; L53-Y141 HydrophobicContact CD1-CD1 4.24Å; L53-Y141 HydrophobicContact CD2-CD1 3.96Å; L53-Y141 HydrophobicContact CD2-CG 4.02Å; L53-Y141 HydrophobicContact CG-CD1 3.83Å; L53-Y141 HydrophobicContact CG-CE1 4.45Å; L53-Y141 HydrophobicContact CG-CG 4.35Å
54	K	96.5	Very high	93.8	Very high	72 Å²	72	62.9 Å²	62.9	31%	0.313	32%	0.317	S	S	.	.	H	α-helix	trans	-80.7	-41.7	-176.6	-177.7	-166	165	-151.6	0	113.2	Y50 T51 Y52 T58	Y50-K54 HydrophobicContact CE1-CD 3.87Å; Y50-K54 WeakPolarHBondContact O-CB 3.4Å; Y50-K54 PolarHBondContact O-N 3Å; T51-K54 PolarHBondContact O-N 3.39Å; Y52-K54 VanDerWaalsContact C-N 3.34Å; Y52-K54 PolarHBondContact O-N 3.5Å; K54-T58 WeakPolarHBondContact O-CG2 3.5Å
55	E	96.9	Very high	94.7	Very high	67 Å²	67	61.6 Å²	61.6	31%	0.313	31%	0.308	S	S	.	.	H	α-helix	trans	-127.5	-16.8	-158.3	-59.3	172.6	-179.5	0	0	114.7	T51 R57 T58 F78	T51-E55 WeakPolarHBondContact O-CB 3.47Å; T51-E55 PolarHBondContact O-N 3.18Å; E55-R57 PolarHBondContact O-N 3.38Å; E55-R57 VanDerWaalsContact O-N 3.1Å; E55-T58 PolarHBondContact O-N 3.27Å; E55-T58 PolarHBondContact O-OG1 2.76Å; E55-F78 VanDerWaalsContact C-CE1 3.49Å; E55-F78 HydrophobicContact CB-CE1 3.75Å; E55-F78 HydrophobicContact CB-CZ 4.21Å; E55-F78 WeakPolarHBondContact O-CE1 3.39Å
56	F	97.6	Very high	95.2	Very high	6 Å²	6	62.9 Å²	62.9	3%	0.026	31%	0.314	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.8	120.1	-178.1	-177	-100.5	0	0	0	111	Y52 T58 F78 R87 T132 Y136 H162	Y52-F56 HydrophobicContact CD1-CB 3.84Å; Y52-F56 AromaticContact CD1-CD2 3.78Å; Y52-F56 HydrophobicContact CD1-CD2 3.78Å; Y52-F56 AromaticContact CD1-CG 3.9Å; Y52-F56 HydrophobicContact CD1-CG 3.9Å; Y52-F56 AromaticContact CE1-CD2 3.77Å; Y52-F56 HydrophobicContact CE1-CD2 3.77Å; Y52-F56 HydrophobicContact CE1-CE2 4.24Å; Y52-F56 HydrophobicContact CE1-CG 4.35Å; Y52-F56 WeakPolarHBondContact O-CB 3.11Å; Y52-F56 PolarHBondContact O-N 2.86Å; F56-T58 PolarHBondContact O-N 3Å; F56-T58 VanDerWaalsContact O-N 3.15Å; F56-F78 HydrophobicContact CB-CE1 4.4Å; F56-F78 HydrophobicContact CB-CE2 4.11Å; F56-F78 HydrophobicContact CB-CZ 3.91Å; F56-F78 AromaticContact CD2-CD2 3.64Å; F56-F78 HydrophobicContact CD2-CD2 3.64Å; F56-F78 AromaticContact CD2-CE2 3.74Å; F56-F78 HydrophobicContact CD2-CE2 3.74Å; F56-F78 HydrophobicContact CD2-CG 4.1Å; F56-F78 HydrophobicContact CD2-CZ 4.3Å; F56-F78 HydrophobicContact CE2-CD2 4.31Å; F56-F78 HydrophobicContact CG-CE2 4.43Å; F56-R87 WeakPolarHBondContact O-CD 3.41Å; F56-R87 PolarHBondContact O-NH1 2.85Å; F56-T132 HydrophobicContact CE1-CG2 4.22Å; F56-Y136 HydrophobicContact CB-CD1 4.39Å; F56-Y136 AromaticContact CD1-CD1 3.8Å; F56-Y136 HydrophobicContact CD1-CD1 3.8Å; F56-Y136 AromaticContact CD1-CD2 3.94Å; F56-Y136 HydrophobicContact CD1-CD2 3.94Å; F56-Y136 AromaticContact CD1-CE1 3.53Å; F56-Y136 HydrophobicContact CD1-CE1 3.53Å; F56-Y136 AromaticContact CD1-CE2 3.7Å; F56-Y136 HydrophobicContact CD1-CE2 3.7Å; F56-Y136 AromaticContact CD1-CG 3.98Å; F56-Y136 HydrophobicContact CD1-CG 3.98Å; F56-Y136 AromaticContact CD1-CZ 3.45Å; F56-Y136 VanDerWaalsContact CD1-CZ 3.45Å; F56-Y136 HydrophobicContact CD2-CE1 4.49Å; F56-Y136 HydrophobicContact CE1-CD1 4.42Å; F56-Y136 HydrophobicContact CE1-CD2 4.08Å; F56-Y136 AromaticContact CE1-CE1 3.79Å; F56-Y136 HydrophobicContact CE1-CE1 3.79Å; F56-Y136 AromaticContact CE1-CE2 3.41Å; F56-Y136 HydrophobicContact CE1-CE2 3.41Å; F56-Y136 VanDerWaalsContact CE1-CE2 3.41Å; F56-Y136 AromaticContact CE1-CZ 3.21Å; F56-Y136 WeakPolarHBondContact CE1-OH 3.42Å; F56-Y136 HydrophobicContact CG-CD1 4.21Å; F56-Y136 AromaticContact CG-CE1 3.92Å; F56-Y136 HydrophobicContact CG-CE1 3.92Å; F56-Y136 HydrophobicContact CZ-CE1 4.37Å; F56-Y136 HydrophobicContact CZ-CE2 4.34Å; F56-Y136 AromaticContact CZ-CZ 3.8Å; F56-Y136 VanDerWaalsContact CZ-OH 3.3Å; F56-Y136 WeakPolarHBondContact CZ-OH 3.39Å; F56-H162 HydrophobicContact CE2-CB 4.07Å; F56-H162 AromaticContact CE2-CD2 3.8Å; F56-H162 AromaticContact CE2-CG 3.73Å; F56-H162 HydrophobicContact CZ-CB 4.23Å
57	R	96.4	Very high	95.3	Very high	19 Å²	19	67.3 Å²	67.3	7%	0.072	34%	0.335	C	S	.	.	T	Hydrogen-bonded Turn	trans	54.1	22.9	-177.6	-62.3	-69.7	175.5	92.9	-0.9	115.3	E55 F75 C77 F78 H79 W80 R86 R87	E55-R57 PolarHBondContact O-N 3.38Å; E55-R57 VanDerWaalsContact O-N 3.1Å; R57-F75 PolarHBondContact NH2-O 3.44Å; R57-F75 VanDerWaalsContact NH2-O 3.1Å; R57-C77 VanDerWaalsContact CZ-O 3.25Å; R57-C77 PolarHBondContact NE-O 3.39Å; R57-C77 PolarHBondContact NH2-O 3.46Å; R57-F78 WeakPolarHBondContact CA-O 3.39Å; R57-F78 PolarHBondContact N-O 2.92Å; R57-H79 VanDerWaalsContact CD-C 3.47Å; R57-H79 VanDerWaalsContact CD-O 3.31Å; R57-H79 WeakPolarHBondContact CD-O 3.48Å; R57-H79 PolarHBondContact NE-O 3.06Å; R57-W80 VanDerWaalsContact O-CD1 3.29Å; R57-R86 WeakPolarHBondContact O-CA 3.36Å; R57-R87 HydrophobicContact CB-CB 4.13Å; R57-R87 PolarHBondContact O-N 3.25Å
58	T	97.1	Very high	95.5	Very high	12 Å²	12	68.5 Å²	68.5	7%	0.074	33%	0.329	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.4	-43.2	172.3	68.6	0	0	0	0	112	K54 E55 F56 W80 R87 R89	K54-T58 WeakPolarHBondContact O-CG2 3.5Å; E55-T58 PolarHBondContact O-N 3.27Å; E55-T58 PolarHBondContact O-OG1 2.76Å; F56-T58 PolarHBondContact O-N 3Å; F56-T58 VanDerWaalsContact O-N 3.15Å; T58-W80 VanDerWaalsContact O-CD1 3.24Å; T58-W80 PolarHBondContact O-NE1 3.41Å; T58-R87 WeakPolarHBondContact CA-O 3.41Å; T58-R89 HydrophobicContact CG2-CB 4.43Å
59	E	96.9	Very high	95.6	Very high	114 Å²	114	61.7 Å²	61.7	53%	0.533	30%	0.298	S	S	.	.	S	Bend	trans	-97.4	149	-177.5	-50.9	-40	121.4	0	0	113.2	H79 W80	E59-H79 WeakPolarHBondContact O-CA 3.36Å; E59-H79 VanDerWaalsContact O-CB 3.31Å; E59-H79 WeakPolarHBondContact O-CB 3.42Å; E59-W80 PolarHBondContact O-N 3.11Å
60	Q	96.5	Very high	95.5	Very high	90 Å²	90	67.3 Å²	67.3	42%	0.421	33%	0.333	S	S	.	.	B	Isolated β-bridge	trans	-72.1	144	175.8	-163.7	175.5	28.3	0	0	110.7	P62 V65 W80	Q60-P62 VanDerWaalsContact O-CD 3.23Å; Q60-P62 WeakPolarHBondContact O-CD 3.39Å; Q60-V65 HydrophobicContact CG-CG1 4.36Å; Q60-W80 WeakPolarHBondContact CA-O 3.41Å; Q60-W80 HydrophobicContact CB-CD2 4.07Å; Q60-W80 HydrophobicContact CB-CE3 4.28Å; Q60-W80 HydrophobicContact CB-CH2 3.86Å; Q60-W80 HydrophobicContact CB-CZ2 3.61Å; Q60-W80 HydrophobicContact CB-CZ3 4.19Å; Q60-W80 HydrophobicContact CG-CD2 4.14Å; Q60-W80 HydrophobicContact CG-CE3 3.86Å; Q60-W80 HydrophobicContact CG-CH2 3.75Å; Q60-W80 HydrophobicContact CG-CZ2 4.03Å; Q60-W80 HydrophobicContact CG-CZ3 3.66Å
61	C	96.8	Very high	95.1	Very high	3 Å²	3	66.3 Å²	66.3	2%	0.02	33%	0.332	C	S	.	.			trans	-73.5	112.8	178.5	-175.8	0	0	0	0	111.6	L63 F64 V65 C77 H79 W80 H81	C61-L63 PolarHBondContact O-N 3.05Å; C61-F64 HydrophobicContact CB-CB 3.68Å; C61-F64 PolarHBondContact O-N 3.08Å; C61-F64 PolarHBondContact SG-N 3.31Å; C61-V65 PolarHBondContact O-N 3.19Å; C61-C77 VanDerWaalsContact SG-SG 3.67Å; C61-H79 HydrophobicContact CB-CB 3.66Å; C61-W80 PolarHBondContact N-O 3.39Å; C61-H81 WeakPolarHBondContact CB-CD2 3.45Å; C61-H81 WeakPolarHBondContact CB-NE2 3.44Å
62	P	96.1	Very high	94.3	Very high	76 Å²	76	67 Å²	67	49%	0.494	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.2	-17.1	-178.8	29.9	-36.3	0	0	0	112.9	Q60 V65 Q66	Q60-P62 VanDerWaalsContact O-CD 3.23Å; Q60-P62 WeakPolarHBondContact O-CD 3.39Å; P62-V65 WeakPolarHBondContact O-CG2 3.38Å; P62-Q66 WeakPolarHBondContact O-CG 3.27Å; P62-Q66 PolarHBondContact O-NE2 3.16Å
63	L	95	Very high	93.4	Very high	87 Å²	87	74.7 Å²	74.7	46%	0.455	36%	0.36	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84	-26.4	172.6	-60.5	179.5	0	0	0	112.4	C61 Q66 H67 K68 C69	C61-L63 PolarHBondContact O-N 3.05Å; L63-Q66 PolarHBondContact O-N 2.84Å; L63-H67 PolarHBondContact O-N 3.45Å; L63-K68 HydrophobicContact CB-CB 4.41Å; L63-K68 HydrophobicContact CD2-CB 4.49Å; L63-K68 WeakPolarHBondContact O-CA 3.49Å; L63-K68 PolarHBondContact O-N 2.83Å; L63-C69 HydrophobicContact CB-CB 4Å; L63-C69 PolarHBondContact O-N 3.13Å; L63-C69 VanDerWaalsContact O-N 3.13Å
64	F	94.7	Very high	92.3	Very high	45 Å²	45	79.4 Å²	79.4	20%	0.197	39%	0.392	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.5	-43.4	179.8	179.9	-103.6	0	0	0	111.4	C61 Q66 H67 C69 H72 H81 F82	C61-F64 HydrophobicContact CB-CB 3.68Å; C61-F64 PolarHBondContact O-N 3.08Å; C61-F64 PolarHBondContact SG-N 3.31Å; F64-Q66 PolarHBondContact O-N 2.84Å; F64-Q66 VanDerWaalsContact O-N 3.12Å; F64-H67 WeakPolarHBondContact O-CA 3.38Å; F64-H67 PolarHBondContact O-N 2.87Å; F64-C69 HydrophobicContact CB-CB 4.04Å; F64-H72 HydrophobicContact CD2-CB 4.39Å; F64-H81 HydrophobicContact CD1-CB 3.63Å; F64-H81 AromaticContact CD1-CG 3.96Å; F64-H81 HydrophobicContact CD2-CB 3.9Å; F64-H81 AromaticContact CD2-CE1 3.9Å; F64-H81 AromaticContact CD2-CG 3.54Å; F64-H81 AromaticContact CD2-ND1 3.47Å; F64-H81 WeakPolarHBondContact CD2-ND1 3.41Å; F64-H81 HydrophobicContact CE1-CB 3.7Å; F64-H81 WeakPolarHBondContact CE1-O 3.32Å; F64-H81 HydrophobicContact CE2-CB 3.98Å; F64-H81 AromaticContact CE2-ND1 3.89Å; F64-H81 HydrophobicContact CG-CB 3.74Å; F64-H81 AromaticContact CG-CD2 3.67Å; F64-H81 AromaticContact CG-CG 3.51Å; F64-H81 AromaticContact CG-ND1 3.93Å; F64-H81 HydrophobicContact CZ-CB 3.88Å; F64-F82 HydrophobicContact CE1-CE1 4.3Å; F64-F82 HydrophobicContact CE1-CZ 4.39Å; F64-F82 AromaticContact CZ-CE1 3.99Å; F64-F82 HydrophobicContact CZ-CE1 3.99Å; F64-F82 HydrophobicContact CZ-CE2 4.18Å; F64-F82 AromaticContact CZ-CZ 3.68Å; F64-F82 HydrophobicContact CZ-CZ 3.68Å
65	V	93.7	Very high	91.4	Very high	81 Å²	81	81.3 Å²	81.3	49%	0.491	40%	0.4	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.7	-12.8	173.7	-59.5	0	0	0	0	113.5	Q60 C61 P62	Q60-V65 HydrophobicContact CG-CG1 4.36Å; C61-V65 PolarHBondContact O-N 3.19Å; P62-V65 WeakPolarHBondContact O-CG2 3.38Å
66	Q	94.4	Very high	91	Very high	94 Å²	94	80.4 Å²	80.4	44%	0.439	40%	0.401	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.4	3.9	171.2	-65.6	179.8	53.8	0	0	113.3	P62 L63 F64 K68	P62-Q66 WeakPolarHBondContact O-CG 3.27Å; P62-Q66 PolarHBondContact O-NE2 3.16Å; L63-Q66 PolarHBondContact O-N 2.84Å; F64-Q66 PolarHBondContact O-N 2.84Å; F64-Q66 VanDerWaalsContact O-N 3.12Å; Q66-K68 HydrophobicContact CB-CB 4.42Å; Q66-K68 HydrophobicContact CB-CD 3.9Å; Q66-K68 HydrophobicContact CB-CG 4.15Å; Q66-K68 PolarHBondContact O-N 3.12Å
67	H	91.7	Very high	90.9	Very high	177 Å²	177	80.3 Å²	80.3	82%	0.819	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.9	20.5	-171.2	-57.2	-88.9	0	0	0	115.3	L63 F64	L63-H67 PolarHBondContact O-N 3.45Å; F64-H67 WeakPolarHBondContact O-CA 3.38Å; F64-H67 PolarHBondContact O-N 2.87Å
68	K	94.1	Very high	90.8	Very high	133 Å²	133	81.2 Å²	81.2	58%	0.578	41%	0.406	S	S	*	.			trans	-100.6	-4.8	-178.3	-67.8	168.7	-167.1	170	0	114.3	L63 Q66 T70	L63-K68 HydrophobicContact CB-CB 4.41Å; L63-K68 HydrophobicContact CD2-CB 4.49Å; L63-K68 WeakPolarHBondContact O-CA 3.49Å; L63-K68 PolarHBondContact O-N 2.83Å; Q66-K68 HydrophobicContact CB-CB 4.42Å; Q66-K68 HydrophobicContact CB-CD 3.9Å; Q66-K68 HydrophobicContact CB-CG 4.15Å; Q66-K68 PolarHBondContact O-N 3.12Å; K68-T70 PolarHBondContact O-N 3.19Å; K68-T70 VanDerWaalsContact O-N 3.15Å
69	C	93.8	Very high	90.8	Very high	7 Å²	7	83.7 Å²	83.7	5%	0.047	42%	0.416	C	S	.	.			trans	-73.1	107.2	-178.5	-173.5	0	0	0	0	111.7	L63 F64 Q71 H72 H81	L63-C69 HydrophobicContact CB-CB 4Å; L63-C69 PolarHBondContact O-N 3.13Å; L63-C69 VanDerWaalsContact O-N 3.13Å; F64-C69 HydrophobicContact CB-CB 4.04Å; C69-Q71 VanDerWaalsContact C-N 3.29Å; C69-Q71 PolarHBondContact O-N 3.14Å; C69-H72 PolarHBondContact O-ND1 3.37Å; C69-H81 PolarHBondContact SG-CE1 3.05Å; C69-H81 PolarHBondContact SG-NE2 2.82Å
70	T	91.8	Very high	90.8	Very high	124 Å²	124	79.7 Å²	79.7	76%	0.761	40%	0.396	S	S	*	.	G	3₁₀ helix	trans	-70.3	-24.4	174.1	52.1	0	0	0	0	113	K68 H72	K68-T70 PolarHBondContact O-N 3.19Å; K68-T70 VanDerWaalsContact O-N 3.15Å; T70-H72 PolarHBondContact O-N 3.24Å
71	Q	86.7	Confident	90.7	Very high	90 Å²	90	75.7 Å²	75.7	42%	0.421	38%	0.378	S	S	.	.	G	3₁₀ helix	trans	-85.9	21.8	-178	-61.1	177.1	-23.4	0	0	114	C69 P74 S76 C77	C69-Q71 VanDerWaalsContact C-N 3.29Å; C69-Q71 PolarHBondContact O-N 3.14Å; Q71-P74 CarbonylContact C-O 3.59Å; Q71-P74 VanDerWaalsContact O-O 3.07Å; Q71-S76 PolarHBondContact O-N 3.36Å; Q71-C77 HydrophobicContact CB-CB 3.78Å; Q71-C77 WeakPolarHBondContact O-CB 3.42Å; Q71-C77 PolarHBondContact O-N 2.9Å
72	H	79.5	Confident	90.6	Very high	70 Å²	70	80.8 Å²	80.8	32%	0.324	40%	0.4	S	S	.	.	G	3₁₀ helix	trans	-87.3	-27.7	176.4	82.4	-87.8	0	0	0	112.9	F64 C69 T70 P74 F75 H81	F64-H72 HydrophobicContact CD2-CB 4.39Å; C69-H72 PolarHBondContact O-ND1 3.37Å; T70-H72 PolarHBondContact O-N 3.24Å; H72-P74 CarbonylContact C-O 3.32Å; H72-F75 WeakPolarHBondContact O-CD1 3.44Å; H72-F75 WeakPolarHBondContact O-CE1 3.41Å; H72-F75 WeakPolarHBondContact O-CG 3.22Å; H72-H81 VanDerWaalsContact CB-CE1 3.46Å; H72-H81 WeakPolarHBondContact CB-CE1 3.47Å
73	R	78.1	Confident	90.5	Very high	194 Å²	194	80.5 Å²	80.5	73%	0.732	39%	0.394	S	S	*	.	S	Bend	trans	-143.1	109.6	175.5	-81.9	174.6	177.8	164.4	-2.7	109.2
74	P	73.3	Confident	90.5	Very high	107 Å²	107	78.3 Å²	78.3	70%	0.695	38%	0.382	S	S	*	.	S	Bend	cis	-59.9	160.4	-7.2	28.3	-36.1	0	0	0	112.4	Q71 H72 S76	Q71-P74 CarbonylContact C-O 3.59Å; Q71-P74 VanDerWaalsContact O-O 3.07Å; H72-P74 CarbonylContact C-O 3.32Å; P74-S76 PolarHBondContact O-N 2.85Å; P74-S76 PolarHBondContact O-OG 3.02Å
75	F	78.1	Confident	90.5	Very high	112 Å²	112	76.9 Å²	76.9	49%	0.491	38%	0.376	S	S	.	.			trans	-74.4	53.2	-175	-74.4	-79.3	0	0	0	113.9	R57 H72	R57-F75 PolarHBondContact NH2-O 3.44Å; R57-F75 VanDerWaalsContact NH2-O 3.1Å; H72-F75 WeakPolarHBondContact O-CD1 3.44Å; H72-F75 WeakPolarHBondContact O-CE1 3.41Å; H72-F75 WeakPolarHBondContact O-CG 3.22Å
76	S	89.8	Confident	90.6	Very high	48 Å²	48	76.5 Å²	76.5	34%	0.336	37%	0.366	S	S	.	.			trans	-90.6	11	-177.6	57	0	0	0	0	114.5	Q71 P74 H162	Q71-S76 PolarHBondContact O-N 3.36Å; P74-S76 PolarHBondContact O-N 2.85Å; P74-S76 PolarHBondContact O-OG 3.02Å; S76-H162 PolarHBondContact O-NE2 3.14Å
77	C	94	Very high	90.8	Very high	4 Å²	4	72 Å²	72	3%	0.027	35%	0.345	C	S	.	.			trans	-73.7	137.6	175.7	-160	0	0	0	0	111.2	R57 C61 Q71 H79 H81	R57-C77 VanDerWaalsContact CZ-O 3.25Å; R57-C77 PolarHBondContact NE-O 3.39Å; R57-C77 PolarHBondContact NH2-O 3.46Å; C61-C77 VanDerWaalsContact SG-SG 3.67Å; Q71-C77 HydrophobicContact CB-CB 3.78Å; Q71-C77 WeakPolarHBondContact O-CB 3.42Å; Q71-C77 PolarHBondContact O-N 2.9Å; C77-H79 VanDerWaalsContact C-N 3.3Å; C77-H81 WeakPolarHBondContact CB-NE2 3.37Å
78	F	95.8	Very high	91.1	Very high	38 Å²	38	64 Å²	64	17%	0.167	31%	0.307	C	S	.	.	S	Bend	trans	-69.2	-29.3	175.9	-169.2	-91.1	0	0	0	112.5	T51 Y52 E55 F56 R57	T51-F78 HydrophobicContact CG2-CZ 3.97Å; Y52-F78 AromaticContact CD1-CE2 3.82Å; Y52-F78 HydrophobicContact CD1-CE2 3.82Å; Y52-F78 HydrophobicContact CE1-CD2 4.18Å; Y52-F78 AromaticContact CE1-CE2 3.72Å; Y52-F78 HydrophobicContact CE1-CE2 3.72Å; Y52-F78 HydrophobicContact CG-CE2 4.31Å; E55-F78 VanDerWaalsContact C-CE1 3.49Å; E55-F78 HydrophobicContact CB-CE1 3.75Å; E55-F78 HydrophobicContact CB-CZ 4.21Å; E55-F78 WeakPolarHBondContact O-CE1 3.39Å; F56-F78 HydrophobicContact CB-CE1 4.4Å; F56-F78 HydrophobicContact CB-CE2 4.11Å; F56-F78 HydrophobicContact CB-CZ 3.91Å; F56-F78 AromaticContact CD2-CD2 3.64Å; F56-F78 HydrophobicContact CD2-CD2 3.64Å; F56-F78 AromaticContact CD2-CE2 3.74Å; F56-F78 HydrophobicContact CD2-CE2 3.74Å; F56-F78 HydrophobicContact CD2-CG 4.1Å; F56-F78 HydrophobicContact CD2-CZ 4.3Å; F56-F78 HydrophobicContact CE2-CD2 4.31Å; F56-F78 HydrophobicContact CG-CE2 4.43Å; R57-F78 WeakPolarHBondContact CA-O 3.39Å; R57-F78 PolarHBondContact N-O 2.92Å
79	H	96.5	Very high	91.2	Very high	63 Å²	63	62.6 Å²	62.6	29%	0.292	30%	0.299	S	S	.	.	S	Bend	trans	-93.9	159.8	179.8	-61.5	-70.1	0	0	0	112.1	R57 E59 C61 C77	R57-H79 VanDerWaalsContact CD-C 3.47Å; R57-H79 VanDerWaalsContact CD-O 3.31Å; R57-H79 WeakPolarHBondContact CD-O 3.48Å; R57-H79 PolarHBondContact NE-O 3.06Å; E59-H79 WeakPolarHBondContact O-CA 3.36Å; E59-H79 VanDerWaalsContact O-CB 3.31Å; E59-H79 WeakPolarHBondContact O-CB 3.42Å; C61-H79 HydrophobicContact CB-CB 3.66Å; C77-H79 VanDerWaalsContact C-N 3.3Å
80	W	95.9	Very high	91.3	Very high	30 Å²	30	62.4 Å²	62.4	11%	0.114	30%	0.298	C	S	.	.	B	Isolated β-bridge	trans	-84.9	147.6	178.9	64.1	-97.5	0	0	0	112.3	R57 T58 E59 Q60 C61 L83 Q85 R86	R57-W80 VanDerWaalsContact O-CD1 3.29Å; T58-W80 VanDerWaalsContact O-CD1 3.24Å; T58-W80 PolarHBondContact O-NE1 3.41Å; E59-W80 PolarHBondContact O-N 3.11Å; Q60-W80 WeakPolarHBondContact CA-O 3.41Å; Q60-W80 HydrophobicContact CB-CD2 4.07Å; Q60-W80 HydrophobicContact CB-CE3 4.28Å; Q60-W80 HydrophobicContact CB-CH2 3.86Å; Q60-W80 HydrophobicContact CB-CZ2 3.61Å; Q60-W80 HydrophobicContact CB-CZ3 4.19Å; Q60-W80 HydrophobicContact CG-CD2 4.14Å; Q60-W80 HydrophobicContact CG-CE3 3.86Å; Q60-W80 HydrophobicContact CG-CH2 3.75Å; Q60-W80 HydrophobicContact CG-CZ2 4.03Å; Q60-W80 HydrophobicContact CG-CZ3 3.66Å; C61-W80 PolarHBondContact N-O 3.39Å; W80-L83 HydrophobicContact CH2-CD1 4.05Å; W80-L83 HydrophobicContact CZ2-CD1 4.37Å; W80-L83 HydrophobicContact CZ3-CD1 4.39Å; W80-Q85 HydrophobicContact CB-CB 3.94Å; W80-R86 HydrophobicContact CB-CB 4.47Å; W80-R86 HydrophobicContact CD2-CB 3.88Å; W80-R86 HydrophobicContact CD2-CG 4.42Å; W80-R86 HydrophobicContact CG-CB 3.82Å; W80-R86 HydrophobicContact CG-CG 4.36Å; W80-R86 HydrophobicContact CZ2-CG 4.48Å
81	H	94.8	Very high	91.4	Very high	6 Å²	6	60.1 Å²	60.1	3%	0.028	28%	0.28	C	S	.	.	S	Bend	trans	-106.3	-46.3	179.8	-66.6	176.7	0	0	0	111.6	C61 F64 C69 H72 C77	C61-H81 WeakPolarHBondContact CB-CD2 3.45Å; C61-H81 WeakPolarHBondContact CB-NE2 3.44Å; F64-H81 HydrophobicContact CD1-CB 3.63Å; F64-H81 AromaticContact CD1-CG 3.96Å; F64-H81 HydrophobicContact CD2-CB 3.9Å; F64-H81 AromaticContact CD2-CE1 3.9Å; F64-H81 AromaticContact CD2-CG 3.54Å; F64-H81 AromaticContact CD2-ND1 3.47Å; F64-H81 WeakPolarHBondContact CD2-ND1 3.41Å; F64-H81 HydrophobicContact CE1-CB 3.7Å; F64-H81 WeakPolarHBondContact CE1-O 3.32Å; F64-H81 HydrophobicContact CE2-CB 3.98Å; F64-H81 AromaticContact CE2-ND1 3.89Å; F64-H81 HydrophobicContact CG-CB 3.74Å; F64-H81 AromaticContact CG-CD2 3.67Å; F64-H81 AromaticContact CG-CG 3.51Å; F64-H81 AromaticContact CG-ND1 3.93Å; F64-H81 HydrophobicContact CZ-CB 3.88Å; C69-H81 PolarHBondContact SG-CE1 3.05Å; C69-H81 PolarHBondContact SG-NE2 2.82Å; H72-H81 VanDerWaalsContact CB-CE1 3.46Å; H72-H81 WeakPolarHBondContact CB-CE1 3.47Å; C77-H81 WeakPolarHBondContact CB-NE2 3.37Å
82	F	94.4	Very high	91.8	Very high	110 Å²	110	61.5 Å²	61.5	48%	0.482	28%	0.281	S	S	.	.	S	Bend	trans	-110.7	152	174.5	-55.1	-75.6	0	0	0	110.1	F64 N84 Q85	F64-F82 HydrophobicContact CE1-CE1 4.3Å; F64-F82 HydrophobicContact CE1-CZ 4.39Å; F64-F82 AromaticContact CZ-CE1 3.99Å; F64-F82 HydrophobicContact CZ-CE1 3.99Å; F64-F82 HydrophobicContact CZ-CE2 4.18Å; F64-F82 AromaticContact CZ-CZ 3.68Å; F64-F82 HydrophobicContact CZ-CZ 3.68Å; F82-N84 VanDerWaalsContact C-N 3.29Å; F82-N84 PolarHBondContact O-N 3.3Å; F82-Q85 HydrophobicContact CB-CG 4.37Å; F82-Q85 WeakPolarHBondContact O-CA 3.28Å; F82-Q85 VanDerWaalsContact O-CB 3.28Å; F82-Q85 WeakPolarHBondContact O-CB 3.4Å; F82-Q85 PolarHBondContact O-N 3.35Å
83	L	94.6	Very high	92.5	Very high	71 Å²	71	63.4 Å²	63.4	37%	0.372	29%	0.285	S	S	.	.	G	3₁₀ helix	trans	-63.2	-33	-172.1	-173.3	65.5	0	0	0	112.7	W80 Q85 R86 T115	W80-L83 HydrophobicContact CH2-CD1 4.05Å; W80-L83 HydrophobicContact CZ2-CD1 4.37Å; W80-L83 HydrophobicContact CZ3-CD1 4.39Å; L83-Q85 PolarHBondContact O-N 3.05Å; L83-Q85 VanDerWaalsContact O-N 3.15Å; L83-R86 HydrophobicContact CD1-CB 4.26Å; L83-R86 WeakPolarHBondContact O-CB 3.48Å; L83-R86 PolarHBondContact O-N 2.95Å; L83-T115 HydrophobicContact CD2-CG2 3.76Å
84	N	94	Very high	93.2	Very high	40 Å²	40	66.6 Å²	66.6	21%	0.214	30%	0.297	C	S	.	.	G	3₁₀ helix	trans	-66.2	-12.8	173.1	69.8	-5.9	0	0	0	114.4	F82 E111 G112 G114 T128 A129	F82-N84 VanDerWaalsContact C-N 3.29Å; F82-N84 PolarHBondContact O-N 3.3Å; N84-E111 WeakPolarHBondContact CB-O 3.46Å; N84-E111 PolarHBondContact ND2-O 3.33Å; N84-G112 PolarHBondContact ND2-O 2.94Å; N84-G114 VanDerWaalsContact CA-CA 3.49Å; N84-T128 CarbonylContact O-C 3.58Å; N84-T128 WeakPolarHBondContact O-CA 3.37Å; N84-A129 WeakPolarHBondContact O-CB 3.5Å; N84-A129 PolarHBondContact O-N 3.49Å
85	Q	95.3	Very high	94	Very high	16 Å²	16	66 Å²	66	8%	0.075	29%	0.288	C	S	.	.	G	3₁₀ helix	trans	-88.5	-11.5	170.8	-54.1	179.9	-17.5	0	0	113.3	W80 F82 L83 A129	W80-Q85 HydrophobicContact CB-CB 3.94Å; F82-Q85 HydrophobicContact CB-CG 4.37Å; F82-Q85 WeakPolarHBondContact O-CA 3.28Å; F82-Q85 VanDerWaalsContact O-CB 3.28Å; F82-Q85 WeakPolarHBondContact O-CB 3.4Å; F82-Q85 PolarHBondContact O-N 3.35Å; L83-Q85 PolarHBondContact O-N 3.05Å; L83-Q85 VanDerWaalsContact O-N 3.15Å; Q85-A129 HydrophobicContact CB-CB 4.42Å; Q85-A129 HydrophobicContact CG-CB 3.9Å
86	R	96.9	Very high	94.4	Very high	73 Å²	73	61 Å²	61	28%	0.275	27%	0.269	S	S	.	.			trans	-69.1	130.8	178.9	179.3	177.5	176	-95.6	1	110	R57 W80 L83 D120 T128	R57-R86 WeakPolarHBondContact O-CA 3.36Å; W80-R86 HydrophobicContact CB-CB 4.47Å; W80-R86 HydrophobicContact CD2-CB 3.88Å; W80-R86 HydrophobicContact CD2-CG 4.42Å; W80-R86 HydrophobicContact CG-CB 3.82Å; W80-R86 HydrophobicContact CG-CG 4.36Å; W80-R86 HydrophobicContact CZ2-CG 4.48Å; L83-R86 HydrophobicContact CD1-CB 4.26Å; L83-R86 WeakPolarHBondContact O-CB 3.48Å; L83-R86 PolarHBondContact O-N 2.95Å; R86-D120 IonicContact CZ-OD1 2.65Å; R86-D120 IonicContact CZ-OD2 2.75Å; R86-D120 IonicContact NH1-OD1 3.93Å; R86-D120 PolarHBondContact NH1-OD1 2.93Å; R86-D120 IonicContact NH1-OD2 3.62Å; R86-D120 IonicContact NH2-OD1 2.99Å; R86-D120 PolarHBondContact NH2-OD1 3.16Å; R86-D120 IonicContact NH2-OD2 3.68Å; R86-D120 PolarHBondContact NH2-OD2 2.97Å; R86-T128 WeakPolarHBondContact O-CG2 3.3Å
87	R	97.2	Very high	94.6	Very high	0 Å²	0	60 Å²	60	0%	0	26%	0.26	C	S	.	.			trans	-109.4	133.2	175.3	152.8	175.8	176.6	-88.8	2.2	109.3	Y52 L53 F56 R57 T58 T132 E133 Y136	Y52-R87 PolarHBondContact O-NH1 2.86Å; L53-R87 PolarHBondContact O-NH1 3.29Å; L53-R87 PolarHBondContact O-NH2 3.41Å; F56-R87 WeakPolarHBondContact O-CD 3.41Å; F56-R87 PolarHBondContact O-NH1 2.85Å; R57-R87 HydrophobicContact CB-CB 4.13Å; R57-R87 PolarHBondContact O-N 3.25Å; T58-R87 WeakPolarHBondContact CA-O 3.41Å; R87-T132 WeakPolarHBondContact CD-O 3.48Å; R87-E133 HydrophobicContact CB-CG 4.19Å; R87-E133 HydrophobicContact CG-CG 4.08Å; R87-Y136 PolarHBondContact NH2-O 3.11Å
88	R	97.7	Very high	94.7	Very high	7 Å²	7	60.2 Å²	60.2	3%	0.026	26%	0.261	C	S	.	.	P	Polyproline II helix	trans	-72.7	149.4	166.6	-63.6	172.3	-60.4	154.3	0	110.5	Y100 D120 C122 F124 H126 E133	R88-Y100 HydrophobicContact CB-CE1 4.11Å; R88-Y100 PolarHBondContact O-OH 3.17Å; R88-D120 WeakPolarHBondContact CD-OD1 3.44Å; R88-D120 WeakPolarHBondContact CG-OD1 3.34Å; R88-D120 PolarHBondContact NH1-O 3.09Å; R88-C122 PolarHBondContact NH1-O 2.9Å; R88-F124 PolarHBondContact NH2-O 3.29Å; R88-H126 VanDerWaalsContact CZ-CE1 3.46Å; R88-H126 PolarHBondContact NE-ND1 2.89Å; R88-E133 VanDerWaalsContact CB-OE1 3.32Å; R88-E133 WeakPolarHBondContact CB-OE1 3.5Å; R88-E133 VanDerWaalsContact CG-OE1 3.28Å; R88-E133 WeakPolarHBondContact CG-OE1 3.3Å; R88-E133 IonicContact CZ-OE1 2.73Å; R88-E133 IonicContact CZ-OE2 2.65Å; R88-E133 PolarHBondContact N-OE1 3.17Å; R88-E133 IonicContact NE-OE1 3.95Å; R88-E133 PolarHBondContact NE-OE1 3.03Å; R88-E133 IonicContact NE-OE2 3.02Å; R88-E133 PolarHBondContact NE-OE2 3Å; R88-E133 IonicContact NH2-OE1 3.4Å; R88-E133 IonicContact NH2-OE2 2.96Å; R88-E133 PolarHBondContact NH2-OE2 2.91Å
89	R	97	Very high	94.7	Very high	104 Å²	104	59.6 Å²	59.6	39%	0.392	26%	0.26	S	S	.	.	P	Polyproline II helix	trans	-73.3	127.8	176.3	-177.1	-179.3	172.1	-167.4	1.3	109.8	T58 I91 N99	T58-R89 HydrophobicContact CG2-CB 4.43Å; R89-I91 HydrophobicContact CG-CG1 4.18Å; R89-N99 PolarHBondContact O-ND2 3.09Å
90	P	95.9	Very high	94.7	Very high	4 Å²	4	56.7 Å²	56.7	3%	0.026	25%	0.246	C	C	.	.	P	Polyproline II helix	trans	-72.4	130.5	170.2	31.4	-35.6	0	0	0	110	Y100 H137 L138	P90-Y100 HydrophobicContact CB-CE1 4.25Å; P90-H137 VanDerWaalsContact CB-CD2 3.44Å; P90-H137 WeakPolarHBondContact CB-CD2 3.4Å; P90-L138 HydrophobicContact CB-CD1 4.18Å; P90-L138 HydrophobicContact CB-CG 4Å; P90-L138 HydrophobicContact CG-CG 4.06Å
91	I	94.7	Very high	94.6	Very high	76 Å²	76	56.6 Å²	56.6	39%	0.39	25%	0.25	S	C	.	.			trans	-134.7	121	-176.7	-61.1	172.7	0	0	0	107.8	R89 F98 N99	R89-I91 HydrophobicContact CG-CG1 4.18Å; I91-F98 WeakPolarHBondContact O-CA 3.28Å; I91-N99 HydrophobicContact CB-CB 4.33Å; I91-N99 PolarHBondContact N-OD1 3.32Å; I91-N99 PolarHBondContact O-N 3.39Å; I91-N99 PolarHBondContact O-OD1 3.49Å
92	R	94.9	Very high	94.6	Very high	119 Å²	119	56.5 Å²	56.5	45%	0.449	25%	0.25	S	C	.	.	B	Isolated β-bridge	trans	-79.7	118.9	162.6	-169.2	172.2	-178.4	-135.9	4	108	G96 T97 F98 L138 Y177	R92-G96 PolarHBondContact NE-O 3.18Å; R92-G96 VanDerWaalsContact NE-O 3.1Å; R92-T97 CarbonylContact C-O 3.53Å; R92-T97 WeakPolarHBondContact CA-O 3.42Å; R92-F98 HydrophobicContact CB-CD1 4.1Å; R92-F98 HydrophobicContact CB-CE1 3.98Å; R92-F98 HydrophobicContact CG-CE1 4.37Å; R92-L138 HydrophobicContact CB-CD1 4.37Å; R92-Y177 PolarHBondContact NE-O 3.04Å
93	R	93.3	Very high	94.5	Very high	109 Å²	109	53.4 Å²	53.4	41%	0.411	24%	0.239	S	C	.	.			trans	-73.1	168.1	178.7	-68.5	177.5	170.2	-170.5	-2.2	110.2	D95 G96 T97 E121	R93-D95 WeakPolarHBondContact CB-OD1 3.35Å; R93-D95 WeakPolarHBondContact CB-OD2 3.48Å; R93-D95 PolarHBondContact O-N 3.48Å; R93-G96 WeakPolarHBondContact O-CA 3.37Å; R93-G96 PolarHBondContact O-N 3.07Å; R93-T97 PolarHBondContact N-O 3.08Å; R93-E121 IonicContact NH2-OE2 3.86Å; R93-E121 PolarHBondContact NH2-OE2 3.25Å
94	R	92.6	Very high	94.4	Very high	261 Å²	261	53.7 Å²	53.7	99%	0.985	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.3	-25.3	-178.9	-75.3	-172.2	-72	177.8	-2.9	113.4	G96	R94-G96 PolarHBondContact O-N 3.45Å
95	D	89.8	Confident	94.5	Very high	94 Å²	94	54.3 Å²	54.3	50%	0.503	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.9	-7.6	169	51.6	55	0	0	0	113.8	R93 T97	R93-D95 WeakPolarHBondContact CB-OD1 3.35Å; R93-D95 WeakPolarHBondContact CB-OD2 3.48Å; R93-D95 PolarHBondContact O-N 3.48Å; D95-T97 WeakPolarHBondContact OD1-CA 3.48Å; D95-T97 VanDerWaalsContact OD1-CB 3.25Å; D95-T97 WeakPolarHBondContact OD1-CB 3.43Å; D95-T97 WeakPolarHBondContact OD1-CG2 3.37Å; D95-T97 PolarHBondContact OD1-N 3.04Å; D95-T97 PolarHBondContact OD1-OG1 3.14Å
96	G	87.3	Confident	94.5	Very high	8 Å²	8	54.2 Å²	54.2	8%	0.082	24%	0.243	C	C	.	.	S	Bend	trans	87	-2.8	179.9	0	0	0	0	0	115.5	R92 R93 R94 I179	R92-G96 PolarHBondContact NE-O 3.18Å; R92-G96 VanDerWaalsContact NE-O 3.1Å; R93-G96 WeakPolarHBondContact O-CA 3.37Å; R93-G96 PolarHBondContact O-N 3.07Å; R94-G96 PolarHBondContact O-N 3.45Å; G96-I179 PolarHBondContact O-N 3.19Å
97	T	93.6	Very high	94.5	Very high	26 Å²	26	57.4 Å²	57.4	16%	0.16	27%	0.271	C	S	.	.			trans	-80.8	162.5	173.4	69.2	0	0	0	0	112.3	R92 R93 D95 D178 I179	R92-T97 CarbonylContact C-O 3.53Å; R92-T97 WeakPolarHBondContact CA-O 3.42Å; R93-T97 PolarHBondContact N-O 3.08Å; D95-T97 WeakPolarHBondContact OD1-CA 3.48Å; D95-T97 VanDerWaalsContact OD1-CB 3.25Å; D95-T97 WeakPolarHBondContact OD1-CB 3.43Å; D95-T97 WeakPolarHBondContact OD1-CG2 3.37Å; D95-T97 PolarHBondContact OD1-N 3.04Å; D95-T97 PolarHBondContact OD1-OG1 3.14Å; T97-D178 VanDerWaalsContact CA-OD2 3.3Å; T97-D178 WeakPolarHBondContact CA-OD2 3.45Å; T97-I179 HydrophobicContact CG2-CG2 3.7Å
98	F	96	Very high	94.4	Very high	9 Å²	9	62.9 Å²	62.9	4%	0.039	30%	0.295	C	S	.	.	B	Isolated β-bridge	trans	-87.8	149.9	167.1	-63.9	-63.5	0	0	0	113.3	I91 R92 Y100 P102 H137 L138 V176 D178	I91-F98 WeakPolarHBondContact O-CA 3.28Å; R92-F98 HydrophobicContact CB-CD1 4.1Å; R92-F98 HydrophobicContact CB-CE1 3.98Å; R92-F98 HydrophobicContact CG-CE1 4.37Å; F98-Y100 VanDerWaalsContact C-N 3.29Å; F98-Y100 WeakPolarHBondContact CB-O 3.24Å; F98-Y100 PolarHBondContact O-N 3.12Å; F98-P102 HydrophobicContact CD2-CG 4.24Å; F98-P102 HydrophobicContact CE2-CG 4.36Å; F98-H137 AromaticContact CD1-CE1 3.63Å; F98-H137 AromaticContact CD2-CE1 3.69Å; F98-H137 AromaticContact CE1-CE1 3.77Å; F98-H137 AromaticContact CE2-CE1 3.8Å; F98-H137 AromaticContact CG-CE1 3.6Å; F98-H137 AromaticContact CZ-CE1 3.85Å; F98-L138 HydrophobicContact CD1-CD1 4.26Å; F98-L138 HydrophobicContact CE1-CB 3.86Å; F98-L138 HydrophobicContact CE1-CD1 3.88Å; F98-L138 HydrophobicContact CZ-CB 4.37Å; F98-V176 HydrophobicContact CE1-CG1 4.11Å; F98-V176 HydrophobicContact CZ-CB 4.28Å; F98-V176 HydrophobicContact CZ-CG1 3.99Å; F98-V176 WeakPolarHBondContact CZ-O 3.49Å; F98-D178 HydrophobicContact CD2-CB 3.73Å; F98-D178 HydrophobicContact CE2-CB 3.81Å; F98-D178 PolarHBondContact N-OD2 3.03Å
99	N	95.6	Very high	94.3	Very high	26 Å²	26	63.6 Å²	63.6	14%	0.139	30%	0.298	C	S	.	.	S	Bend	trans	-64.2	-30.4	172.2	64.4	-37.2	0	0	0	113.6	R89 I91	R89-N99 PolarHBondContact O-ND2 3.09Å; I91-N99 HydrophobicContact CB-CB 4.33Å; I91-N99 PolarHBondContact N-OD1 3.32Å; I91-N99 PolarHBondContact O-N 3.39Å; I91-N99 PolarHBondContact O-OD1 3.49Å
100	Y	96.9	Very high	94.2	Very high	1 Å²	1	62.1 Å²	62.1	0%	0.004	30%	0.298	C	S	.	.	S	Bend	trans	-138.4	151.2	165.8	65.3	-94.4	0	0	0	110.4	R88 P90 F98 P123 L125 E133 H137	R88-Y100 HydrophobicContact CB-CE1 4.11Å; R88-Y100 PolarHBondContact O-OH 3.17Å; P90-Y100 HydrophobicContact CB-CE1 4.25Å; F98-Y100 VanDerWaalsContact C-N 3.29Å; F98-Y100 WeakPolarHBondContact CB-O 3.24Å; F98-Y100 PolarHBondContact O-N 3.12Å; Y100-P123 CarbonylContact C-O 3.58Å; Y100-P123 WeakPolarHBondContact CA-O 3.34Å; Y100-L125 HydrophobicContact CD2-CD1 4.09Å; Y100-L125 HydrophobicContact CE2-CD1 3.73Å; Y100-E133 HydrophobicContact CE2-CB 3.99Å; Y100-E133 PolarHBondContact OH-O 3.47Å; Y100-H137 AromaticContact CE2-CD2 3.53Å; Y100-H137 AromaticContact CZ-CD2 3.71Å
101	S	94.3	Very high	94.1	Very high	28 Å²	28	66.4 Å²	66.4	20%	0.196	32%	0.318	C	S	.	.			trans	-63.5	136	-179	-178.3	0	0	0	0	111.7	D103 V104 P123 L125	S101-D103 PolarHBondContact O-N 3.13Å; S101-D103 PolarHBondContact OG-N 3.31Å; S101-V104 PolarHBondContact OG-N 3.43Å; S101-P123 PolarHBondContact N-O 3.27Å; S101-L125 WeakPolarHBondContact O-CB 3.31Å
102	P	93.8	Very high	94	Very high	4 Å²	4	65.4 Å²	65.4	3%	0.026	33%	0.326	C	S	.	.	S	Bend	trans	-65.1	-17.8	165.4	21.3	-28.6	0	0	0	113.7	F98 R139 Y140 R243	F98-P102 HydrophobicContact CD2-CG 4.24Å; F98-P102 HydrophobicContact CE2-CG 4.36Å; P102-R139 HydrophobicContact CB-CB 3.95Å; P102-R139 HydrophobicContact CB-CG 4.02Å; P102-R139 HydrophobicContact CG-CB 4.25Å; P102-R139 HydrophobicContact CG-CG 4.11Å; P102-Y140 HydrophobicContact CB-CD2 4.34Å; P102-Y140 HydrophobicContact CB-CE2 3.85Å; P102-R243 PolarHBondContact O-NH1 3.36Å
103	D	92.3	Very high	93.9	Very high	46 Å²	46	63.3 Å²	63.3	25%	0.246	33%	0.327	C	S	.	.	S	Bend	trans	-129.5	-18.7	-154.4	-66.2	-35.5	0	0	0	116.2	S101 Y140 R243	S101-D103 PolarHBondContact O-N 3.13Å; S101-D103 PolarHBondContact OG-N 3.31Å; D103-Y140 WeakPolarHBondContact OD1-CE2 3.41Å; D103-Y140 PolarHBondContact OD1-OH 3.2Å; D103-R243 VanDerWaalsContact C-CZ 3.5Å; D103-R243 PolarHBondContact O-NE 2.91Å; D103-R243 VanDerWaalsContact O-NE 3.12Å; D103-R243 PolarHBondContact O-NH2 3.41Å; D103-R243 WeakPolarHBondContact OD1-CD 3.39Å; D103-R243 IonicContact OD1-NE 3.27Å; D103-R243 IonicContact OD1-NH1 3.71Å
104	V	93.9	Very high	93.9	Very high	76 Å²	76	58.6 Å²	58.6	46%	0.461	31%	0.312	S	S	.	.			trans	-109	115.1	176	-176.4	0	0	0	0	109.4	S101 F124 L125	S101-V104 PolarHBondContact OG-N 3.43Å; V104-F124 HydrophobicContact CB-CD1 3.97Å; V104-F124 HydrophobicContact CG1-CD1 3.56Å; V104-F124 HydrophobicContact CG1-CE1 3.92Å; V104-L125 VanDerWaalsContact O-CB 3.3Å; V104-L125 WeakPolarHBondContact O-CB 3.3Å; V104-L125 PolarHBondContact O-N 3.21Å
105	Y	95.4	Very high	94.1	Very high	53 Å²	53	49.5 Å²	49.5	21%	0.208	29%	0.286	C	S	.	.	B	Isolated β-bridge	trans	-73.3	141.3	175.3	-75.8	-71.4	0	0	0	111.2	L125 R127 D131 R134	Y105-L125 CarbonylContact C-O 3.57Å; Y105-L125 WeakPolarHBondContact CA-O 3.47Å; Y105-L125 HydrophobicContact CD1-CB 4.06Å; Y105-L125 HydrophobicContact CD1-CD2 3.56Å; Y105-L125 HydrophobicContact CD1-CG 3.7Å; Y105-L125 HydrophobicContact CE1-CD2 3.24Å; Y105-L125 HydrophobicContact CE1-CG 3.67Å; Y105-L125 HydrophobicContact CE2-CD2 4.35Å; Y105-L125 HydrophobicContact CG-CD2 4.22Å; Y105-R127 HydrophobicContact CD1-CB 4.17Å; Y105-R127 HydrophobicContact CE1-CB 4.11Å; Y105-R127 HydrophobicContact CE1-CG 4.13Å; Y105-D131 WeakPolarHBondContact CE1-OD1 3.31Å; Y105-D131 VanDerWaalsContact OH-CG 3.27Å; Y105-D131 PolarHBondContact OH-OD1 2.66Å; Y105-D131 PolarHBondContact OH-OD2 2.88Å; Y105-R134 WeakPolarHBondContact OH-CD 3.47Å; Y105-R134 PolarHBondContact OH-NH1 3.38Å
106	C	95.9	Very high	94.4	Very high	14 Å²	14	46 Å²	46	10%	0.095	27%	0.268	C	S	.	.			trans	-70.2	131.4	171.1	-170.4	0	0	0	0	110.2	K108 F124 L125	C106-K108 PolarHBondContact SG-N 3.43Å; C106-K108 VanDerWaalsContact SG-N 3.37Å; C106-F124 HydrophobicContact CB-CB 3.7Å; C106-L125 PolarHBondContact N-O 2.87Å
107	T	95.6	Very high	94.8	Very high	140 Å²	140	50.9 Å²	50.9	86%	0.859	30%	0.298	S	S	*	.	S	Bend	trans	-85.8	-8.7	173.8	51.4	0	0	0	0	113.5
108	K	95.1	Very high	94.8	Very high	116 Å²	116	52.6 Å²	52.6	50%	0.504	30%	0.304	S	S	.	.	S	Bend	trans	-104.4	1.2	-177.9	-51	177.5	-171.2	169.3	0	113.7	C106 P117 E118	C106-K108 PolarHBondContact SG-N 3.43Å; C106-K108 VanDerWaalsContact SG-N 3.37Å; K108-P117 HydrophobicContact CB-CG 4.41Å; K108-P117 WeakPolarHBondContact O-CD 3.49Å; K108-E118 WeakPolarHBondContact CD-OE1 3.42Å; K108-E118 WeakPolarHBondContact CE-OE1 3.41Å; K108-E118 IonicContact NZ-OE1 2.8Å; K108-E118 PolarHBondContact NZ-OE1 2.89Å
109	Y	96.4	Very high	94.7	Very high	21 Å²	21	53.7 Å²	53.7	8%	0.082	32%	0.318	C	S	.	.			trans	-85.5	122.4	176.8	175	-96	0	0	0	109.8	E111 G114 T115 C116 H126 R127	Y109-E111 HydrophobicContact CD1-CG 4Å; Y109-E111 HydrophobicContact CE1-CB 4.44Å; Y109-E111 HydrophobicContact CE1-CG 4.04Å; Y109-G114 WeakPolarHBondContact CE2-O 3.49Å; Y109-G114 WeakPolarHBondContact OH-CA 3.42Å; Y109-T115 WeakPolarHBondContact CA-O 3.33Å; Y109-T115 WeakPolarHBondContact CD2-O 3.41Å; Y109-C116 HydrophobicContact CD2-CB 4.14Å; Y109-H126 HydrophobicContact CD1-CB 4.05Å; Y109-H126 HydrophobicContact CD2-CB 3.52Å; Y109-H126 AromaticContact CD2-CD2 3.69Å; Y109-H126 AromaticContact CD2-CG 3.32Å; Y109-H126 AromaticContact CD2-ND1 3.58Å; Y109-H126 HydrophobicContact CE1-CB 4.18Å; Y109-H126 HydrophobicContact CE2-CB 3.67Å; Y109-H126 AromaticContact CE2-CG 3.81Å; Y109-H126 AromaticContact CE2-ND1 3.88Å; Y109-H126 HydrophobicContact CG-CB 3.71Å; Y109-H126 AromaticContact CG-CD2 3.85Å; Y109-H126 AromaticContact CG-CG 3.76Å; Y109-R127 WeakPolarHBondContact CE1-O 3.29Å
110	D	94.8	Very high	94.7	Very high	73 Å²	73	56 Å²	56	39%	0.39	33%	0.331	S	S	.	.	B	Isolated β-bridge	trans	-84.8	114	173.5	171.1	26.1	0	0	0	110.3	G112 T113 G114 T115	D110-G112 PolarHBondContact O-N 3.49Å; D110-G112 WeakPolarHBondContact OD1-CA 3.19Å; D110-G112 PolarHBondContact OD1-N 3.41Å; D110-T113 WeakPolarHBondContact OD2-CB 3.29Å; D110-T113 WeakPolarHBondContact OD2-CG2 3.49Å; D110-T113 PolarHBondContact OD2-N 3.29Å; D110-T113 PolarHBondContact OD2-OG1 2.74Å; D110-G114 WeakPolarHBondContact O-CA 3.25Å; D110-G114 PolarHBondContact O-N 2.95Å; D110-T115 PolarHBondContact N-O 2.84Å; D110-T115 PolarHBondContact O-N 3.23Å
111	E	93.9	Very high	94.6	Very high	95 Å²	95	62.6 Å²	62.6	44%	0.444	36%	0.362	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.1	-20.6	178.3	-55.4	-175.3	-160.1	0	0	112.6	N84 Y109 R127	N84-E111 WeakPolarHBondContact CB-O 3.46Å; N84-E111 PolarHBondContact ND2-O 3.33Å; Y109-E111 HydrophobicContact CD1-CG 4Å; Y109-E111 HydrophobicContact CE1-CB 4.44Å; Y109-E111 HydrophobicContact CE1-CG 4.04Å; E111-R127 HydrophobicContact CG-CB 4.25Å; E111-R127 WeakPolarHBondContact OE1-CD 3.39Å; E111-R127 IonicContact OE1-CZ 3.48Å; E111-R127 IonicContact OE1-NE 3.38Å; E111-R127 PolarHBondContact OE1-NE 3.35Å; E111-R127 IonicContact OE1-NH2 3.86Å; E111-R127 WeakPolarHBondContact OE2-CD 3.33Å; E111-R127 IonicContact OE2-NE 3.68Å
112	G	92.2	Very high	94.8	Very high	55 Å²	55	61.3 Å²	61.3	57%	0.567	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.4	-63.4	176.1	0	0	0	0	0	112.6	N84 D110	N84-G112 PolarHBondContact ND2-O 2.94Å; D110-G112 PolarHBondContact O-N 3.49Å; D110-G112 WeakPolarHBondContact OD1-CA 3.19Å; D110-G112 PolarHBondContact OD1-N 3.41Å
113	T	93.6	Very high	94.8	Very high	75 Å²	75	64.2 Å²	64.2	46%	0.46	37%	0.371	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.6	-26.8	177.9	61.3	0	0	0	0	113.5	D110 T115	D110-T113 WeakPolarHBondContact OD2-CB 3.29Å; D110-T113 WeakPolarHBondContact OD2-CG2 3.49Å; D110-T113 PolarHBondContact OD2-N 3.29Å; D110-T113 PolarHBondContact OD2-OG1 2.74Å; T113-T115 PolarHBondContact OG1-N 3.21Å; T113-T115 PolarHBondContact OG1-OG1 2.82Å
114	G	93.6	Very high	95.1	Very high	10 Å²	10	66 Å²	66	10%	0.103	38%	0.377	C	S	.	.	T	Hydrogen-bonded Turn	trans	82.7	22.8	-172.7	0	0	0	0	0	114.5	N84 Y109 D110	N84-G114 VanDerWaalsContact CA-CA 3.49Å; Y109-G114 WeakPolarHBondContact CE2-O 3.49Å; Y109-G114 WeakPolarHBondContact OH-CA 3.42Å; D110-G114 WeakPolarHBondContact O-CA 3.25Å; D110-G114 PolarHBondContact O-N 2.95Å
115	T	95.5	Very high	95.3	Very high	70 Å²	70	62.3 Å²	62.3	43%	0.429	36%	0.355	S	S	.	.	B	Isolated β-bridge	trans	-107.9	157.1	-175.2	64	0	0	0	0	112.6	L83 Y109 D110 T113	L83-T115 HydrophobicContact CD2-CG2 3.76Å; Y109-T115 WeakPolarHBondContact CA-O 3.33Å; Y109-T115 WeakPolarHBondContact CD2-O 3.41Å; D110-T115 PolarHBondContact N-O 2.84Å; D110-T115 PolarHBondContact O-N 3.23Å; T113-T115 PolarHBondContact OG1-N 3.21Å; T113-T115 PolarHBondContact OG1-OG1 2.82Å
116	C	96.6	Very high	95.4	Very high	19 Å²	19	60.1 Å²	60.1	13%	0.128	35%	0.347	C	S	.	.			trans	-141.1	137.1	172.2	-180	0	0	0	0	108.3	Y109 E118 G119 H126	Y109-C116 HydrophobicContact CD2-CB 4.14Å; C116-E118 PolarHBondContact O-N 3.48Å; C116-G119 PolarHBondContact O-N 3.47Å; C116-H126 WeakPolarHBondContact CB-NE2 3.48Å; C116-H126 PolarHBondContact SG-NE2 2.81Å; C116-H126 VanDerWaalsContact SG-NE2 3.41Å
117	P	96.1	Very high	95.4	Very high	112 Å²	112	64.4 Å²	64.4	73%	0.727	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.1	-27.1	175.6	-26.3	35.1	0	0	0	114.3	K108	K108-P117 HydrophobicContact CB-CG 4.41Å; K108-P117 WeakPolarHBondContact O-CD 3.49Å
118	E	94.2	Very high	95.4	Very high	61 Å²	61	57.9 Å²	57.9	29%	0.285	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.5	0.8	177.6	-68.9	164.3	-144.3	0	0	113	K108 C116 D120 E121 C122 P123	K108-E118 WeakPolarHBondContact CD-OE1 3.42Å; K108-E118 WeakPolarHBondContact CE-OE1 3.41Å; K108-E118 IonicContact NZ-OE1 2.8Å; K108-E118 PolarHBondContact NZ-OE1 2.89Å; C116-E118 PolarHBondContact O-N 3.48Å; E118-D120 PolarHBondContact O-N 2.86Å; E118-E121 PolarHBondContact O-N 2.91Å; E118-C122 HydrophobicContact CB-CB 3.6Å; E118-C122 PolarHBondContact O-N 3.31Å; E118-C122 PolarHBondContact OE2-SG 2.78Å; E118-P123 WeakPolarHBondContact OE2-CD 3.46Å
119	G	94	Very high	95.3	Very high	32 Å²	32	54.4 Å²	54.4	33%	0.33	31%	0.314	S	S	.	.	G	3₁₀ helix	trans	55.1	-132.1	174	0	0	0	0	0	113.5	C116 H126	C116-G119 PolarHBondContact O-N 3.47Å; G119-H126 PolarHBondContact O-CE1 3.37Å
120	D	94.3	Very high	95	Very high	76 Å²	76	55.6 Å²	55.6	41%	0.406	33%	0.332	S	S	.	.	G	3₁₀ helix	trans	-77.7	-28.1	-179.7	-77.1	-12.2	0	0	0	113.8	R86 R88 E118 C122	R86-D120 IonicContact CZ-OD1 2.65Å; R86-D120 IonicContact CZ-OD2 2.75Å; R86-D120 IonicContact NH1-OD1 3.93Å; R86-D120 PolarHBondContact NH1-OD1 2.93Å; R86-D120 IonicContact NH1-OD2 3.62Å; R86-D120 IonicContact NH2-OD1 2.99Å; R86-D120 PolarHBondContact NH2-OD1 3.16Å; R86-D120 IonicContact NH2-OD2 3.68Å; R86-D120 PolarHBondContact NH2-OD2 2.97Å; R88-D120 WeakPolarHBondContact CD-OD1 3.44Å; R88-D120 WeakPolarHBondContact CG-OD1 3.34Å; R88-D120 PolarHBondContact NH1-O 3.09Å; E118-D120 PolarHBondContact O-N 2.86Å; D120-C122 VanDerWaalsContact C-N 3.25Å; D120-C122 PolarHBondContact O-N 3.48Å
121	E	95.9	Very high	95	Very high	139 Å²	139	53.7 Å²	53.7	65%	0.65	32%	0.322	S	S	*	.	G	3₁₀ helix	trans	-79.1	-1.3	-178.8	-66.8	-57.4	129.2	0	0	114	R93 E118 P123	R93-E121 IonicContact NH2-OE2 3.86Å; R93-E121 PolarHBondContact NH2-OE2 3.25Å; E118-E121 PolarHBondContact O-N 2.91Å; E121-P123 WeakPolarHBondContact O-CD 3.34Å; E121-P123 VanDerWaalsContact O-N 3.17Å
122	C	96.8	Very high	95.1	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	30%	0.302	C	S	.	.			trans	-55.2	118.3	175.1	-172.4	0	0	0	0	111.1	R88 E118 D120 F124 H126	R88-C122 PolarHBondContact NH1-O 2.9Å; E118-C122 HydrophobicContact CB-CB 3.6Å; E118-C122 PolarHBondContact O-N 3.31Å; E118-C122 PolarHBondContact OE2-SG 2.78Å; D120-C122 VanDerWaalsContact C-N 3.25Å; D120-C122 PolarHBondContact O-N 3.48Å; C122-F124 PolarHBondContact O-N 2.98Å; C122-H126 WeakPolarHBondContact CB-NE2 3.44Å
123	P	95.7	Very high	95.4	Very high	65 Å²	65	46.8 Å²	46.8	42%	0.422	28%	0.275	S	S	.	.	S	Bend	trans	-75	3	-175.5	31.8	-36	0	0	0	113.2	Y100 S101 E118 E121	Y100-P123 CarbonylContact C-O 3.58Å; Y100-P123 WeakPolarHBondContact CA-O 3.34Å; S101-P123 PolarHBondContact N-O 3.27Å; E118-P123 WeakPolarHBondContact OE2-CD 3.46Å; E121-P123 WeakPolarHBondContact O-CD 3.34Å; E121-P123 VanDerWaalsContact O-N 3.17Å
124	F	97.3	Very high	95.5	Very high	83 Å²	83	45.3 Å²	45.3	36%	0.364	26%	0.261	S	S	.	.	S	Bend	trans	-111.9	156	-177.7	-54.4	-66.2	0	0	0	111.6	R88 V104 C106 C122	R88-F124 PolarHBondContact NH2-O 3.29Å; V104-F124 HydrophobicContact CB-CD1 3.97Å; V104-F124 HydrophobicContact CG1-CD1 3.56Å; V104-F124 HydrophobicContact CG1-CE1 3.92Å; C106-F124 HydrophobicContact CB-CB 3.7Å; C122-F124 PolarHBondContact O-N 2.98Å
125	L	97.6	Very high	95.6	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	27%	0.27	C	S	.	.	B	Isolated β-bridge	trans	-72.9	128.1	-178	179.5	66.1	0	0	0	111.7	Y100 S101 V104 Y105 C106 E133 R134	Y100-L125 HydrophobicContact CD2-CD1 4.09Å; Y100-L125 HydrophobicContact CE2-CD1 3.73Å; S101-L125 WeakPolarHBondContact O-CB 3.31Å; V104-L125 VanDerWaalsContact O-CB 3.3Å; V104-L125 WeakPolarHBondContact O-CB 3.3Å; V104-L125 PolarHBondContact O-N 3.21Å; Y105-L125 CarbonylContact C-O 3.57Å; Y105-L125 WeakPolarHBondContact CA-O 3.47Å; Y105-L125 HydrophobicContact CD1-CB 4.06Å; Y105-L125 HydrophobicContact CD1-CD2 3.56Å; Y105-L125 HydrophobicContact CD1-CG 3.7Å; Y105-L125 HydrophobicContact CE1-CD2 3.24Å; Y105-L125 HydrophobicContact CE1-CG 3.67Å; Y105-L125 HydrophobicContact CE2-CD2 4.35Å; Y105-L125 HydrophobicContact CG-CD2 4.22Å; C106-L125 PolarHBondContact N-O 2.87Å; L125-E133 HydrophobicContact CD1-CB 3.52Å; L125-R134 HydrophobicContact CD1-CB 3.96Å; L125-R134 HydrophobicContact CD2-CB 3.84Å; L125-R134 HydrophobicContact CD2-CG 3.98Å; L125-R134 HydrophobicContact CG-CB 4.46Å
126	H	97.7	Very high	95.7	Very high	7 Å²	7	45.5 Å²	45.5	3%	0.032	25%	0.251	C	S	.	.			trans	-87.7	133.5	173.6	-63	161.6	0	0	0	111	R88 Y109 C116 G119 C122 T128 E133	R88-H126 VanDerWaalsContact CZ-CE1 3.46Å; R88-H126 PolarHBondContact NE-ND1 2.89Å; Y109-H126 HydrophobicContact CD1-CB 4.05Å; Y109-H126 HydrophobicContact CD2-CB 3.52Å; Y109-H126 AromaticContact CD2-CD2 3.69Å; Y109-H126 AromaticContact CD2-CG 3.32Å; Y109-H126 AromaticContact CD2-ND1 3.58Å; Y109-H126 HydrophobicContact CE1-CB 4.18Å; Y109-H126 HydrophobicContact CE2-CB 3.67Å; Y109-H126 AromaticContact CE2-CG 3.81Å; Y109-H126 AromaticContact CE2-ND1 3.88Å; Y109-H126 HydrophobicContact CG-CB 3.71Å; Y109-H126 AromaticContact CG-CD2 3.85Å; Y109-H126 AromaticContact CG-CG 3.76Å; C116-H126 WeakPolarHBondContact CB-NE2 3.48Å; C116-H126 PolarHBondContact SG-NE2 2.81Å; C116-H126 VanDerWaalsContact SG-NE2 3.41Å; G119-H126 PolarHBondContact O-CE1 3.37Å; C122-H126 WeakPolarHBondContact CB-NE2 3.44Å; H126-T128 HydrophobicContact CB-CG2 4.11Å; H126-T128 PolarHBondContact O-N 3.09Å; H126-T128 PolarHBondContact O-OG1 2.69Å; H126-E133 WeakPolarHBondContact CB-OE2 3.29Å; H126-E133 IonicContact CG-OE2 2.8Å; H126-E133 PolarHBondContact N-OE2 3.36Å; H126-E133 IonicContact ND1-OE1 2.79Å
127	R	95.8	Very high	95.8	Very high	104 Å²	104	44.6 Å²	44.6	39%	0.392	25%	0.245	S	C	.	.			trans	-80.7	63.2	174.4	-156.6	-161.9	-38.4	-70.8	-7.9	111.2	Y105 Y109 E111	Y105-R127 HydrophobicContact CD1-CB 4.17Å; Y105-R127 HydrophobicContact CE1-CB 4.11Å; Y105-R127 HydrophobicContact CE1-CG 4.13Å; Y109-R127 WeakPolarHBondContact CE1-O 3.29Å; E111-R127 HydrophobicContact CG-CB 4.25Å; E111-R127 WeakPolarHBondContact OE1-CD 3.39Å; E111-R127 IonicContact OE1-CZ 3.48Å; E111-R127 IonicContact OE1-NE 3.38Å; E111-R127 PolarHBondContact OE1-NE 3.35Å; E111-R127 IonicContact OE1-NH2 3.86Å; E111-R127 WeakPolarHBondContact OE2-CD 3.33Å; E111-R127 IonicContact OE2-NE 3.68Å
128	T	95.9	Very high	95.8	Very high	2 Å²	2	40.5 Å²	40.5	1%	0.012	22%	0.217	C	C	.	.			trans	-53.1	157.3	170.6	45	0	0	0	0	112	N84 R86 H126 G130 D131 T132 E133	N84-T128 CarbonylContact O-C 3.58Å; N84-T128 WeakPolarHBondContact O-CA 3.37Å; R86-T128 WeakPolarHBondContact O-CG2 3.3Å; H126-T128 HydrophobicContact CB-CG2 4.11Å; H126-T128 PolarHBondContact O-N 3.09Å; H126-T128 PolarHBondContact O-OG1 2.69Å; T128-G130 PolarHBondContact O-N 3.28Å; T128-D131 WeakPolarHBondContact O-CA 3.45Å; T128-D131 PolarHBondContact O-N 3.45Å; T128-T132 PolarHBondContact OG1-N 2.99Å; T128-T132 VanDerWaalsContact OG1-N 3.16Å; T128-T132 PolarHBondContact OG1-OG1 3.02Å; T128-T132 VanDerWaalsContact OG1-OG1 3.09Å; T128-E133 HydrophobicContact CG2-CG 3.91Å; T128-E133 PolarHBondContact OG1-N 2.88Å
129	A	92.7	Very high	95.8	Very high	44 Å²	44	38.7 Å²	38.7	36%	0.364	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.5	106.8	-175	0	0	0	0	0	111.6	N84 Q85	N84-A129 WeakPolarHBondContact O-CB 3.5Å; N84-A129 PolarHBondContact O-N 3.49Å; Q85-A129 HydrophobicContact CB-CB 4.42Å; Q85-A129 HydrophobicContact CG-CB 3.9Å
130	G	90.7	Very high	95.9	Very high	45 Å²	45	39 Å²	39	46%	0.464	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	79.9	29.1	-172	0	0	0	0	0	114.6	T128 T132 R135	T128-G130 PolarHBondContact O-N 3.28Å; G130-T132 VanDerWaalsContact C-N 3.27Å; G130-T132 PolarHBondContact O-N 3.2Å; G130-R135 PolarHBondContact O-NE 2.97Å; G130-R135 PolarHBondContact O-NH2 3.3Å
131	D	95.1	Very high	96	Very high	34 Å²	34	35.6 Å²	35.6	18%	0.182	18%	0.18	C	C	.	.	S	Bend	trans	54.1	38.9	169.7	-165.5	45.7	0	0	0	113.1	Y105 T128 R134 R135	Y105-D131 WeakPolarHBondContact CE1-OD1 3.31Å; Y105-D131 VanDerWaalsContact OH-CG 3.27Å; Y105-D131 PolarHBondContact OH-OD1 2.66Å; Y105-D131 PolarHBondContact OH-OD2 2.88Å; T128-D131 WeakPolarHBondContact O-CA 3.45Å; T128-D131 PolarHBondContact O-N 3.45Å; D131-R134 PolarHBondContact O-N 3.24Å; D131-R134 WeakPolarHBondContact OD2-CD 3.3Å; D131-R135 WeakPolarHBondContact O-CG 3.01Å; D131-R135 PolarHBondContact O-N 3.27Å
132	T	95.9	Very high	96	Very high	4 Å²	4	29.6 Å²	29.6	3%	0.025	15%	0.152	C	C	.	.	H	α-helix	trans	-72.5	-35.3	-167.2	53.1	0	0	0	0	112.6	F56 R87 T128 G130 R134 Y136	F56-T132 HydrophobicContact CE1-CG2 4.22Å; R87-T132 WeakPolarHBondContact CD-O 3.48Å; T128-T132 PolarHBondContact OG1-N 2.99Å; T128-T132 VanDerWaalsContact OG1-N 3.16Å; T128-T132 PolarHBondContact OG1-OG1 3.02Å; T128-T132 VanDerWaalsContact OG1-OG1 3.09Å; G130-T132 VanDerWaalsContact C-N 3.27Å; G130-T132 PolarHBondContact O-N 3.2Å; T132-R134 PolarHBondContact O-N 3.22Å; T132-Y136 HydrophobicContact CG2-CD2 4.48Å; T132-Y136 HydrophobicContact CG2-CE2 4.18Å; T132-Y136 WeakPolarHBondContact O-CB 3.42Å; T132-Y136 WeakPolarHBondContact O-CD2 3.38Å; T132-Y136 PolarHBondContact O-N 2.98Å
133	E	97.8	Very high	95.8	Very high	1 Å²	1	30.6 Å²	30.6	1%	0.005	16%	0.158	C	C	.	.	H	α-helix	trans	-56.2	-31.7	173.2	-73.7	-163.1	169.7	0	0	113.1	R87 R88 Y100 L125 H126 T128	R87-E133 HydrophobicContact CB-CG 4.19Å; R87-E133 HydrophobicContact CG-CG 4.08Å; R88-E133 VanDerWaalsContact CB-OE1 3.32Å; R88-E133 WeakPolarHBondContact CB-OE1 3.5Å; R88-E133 VanDerWaalsContact CG-OE1 3.28Å; R88-E133 WeakPolarHBondContact CG-OE1 3.3Å; R88-E133 IonicContact CZ-OE1 2.73Å; R88-E133 IonicContact CZ-OE2 2.65Å; R88-E133 PolarHBondContact N-OE1 3.17Å; R88-E133 IonicContact NE-OE1 3.95Å; R88-E133 PolarHBondContact NE-OE1 3.03Å; R88-E133 IonicContact NE-OE2 3.02Å; R88-E133 PolarHBondContact NE-OE2 3Å; R88-E133 IonicContact NH2-OE1 3.4Å; R88-E133 IonicContact NH2-OE2 2.96Å; R88-E133 PolarHBondContact NH2-OE2 2.91Å; Y100-E133 HydrophobicContact CE2-CB 3.99Å; Y100-E133 PolarHBondContact OH-O 3.47Å; L125-E133 HydrophobicContact CD1-CB 3.52Å; H126-E133 WeakPolarHBondContact CB-OE2 3.29Å; H126-E133 IonicContact CG-OE2 2.8Å; H126-E133 PolarHBondContact N-OE2 3.36Å; H126-E133 IonicContact ND1-OE1 2.79Å; T128-E133 HydrophobicContact CG2-CG 3.91Å; T128-E133 PolarHBondContact OG1-N 2.88Å
134	R	96.9	Very high	95.5	Very high	43 Å²	43	28.9 Å²	28.9	16%	0.162	15%	0.152	C	C	.	.	H	α-helix	trans	-88.4	-52.1	179.4	-167.9	-174.3	168.9	-170	-9	112.4	Y105 L125 D131 T132 Y136 H137 Y140 R243	Y105-R134 WeakPolarHBondContact OH-CD 3.47Å; Y105-R134 PolarHBondContact OH-NH1 3.38Å; L125-R134 HydrophobicContact CD1-CB 3.96Å; L125-R134 HydrophobicContact CD2-CB 3.84Å; L125-R134 HydrophobicContact CD2-CG 3.98Å; L125-R134 HydrophobicContact CG-CB 4.46Å; D131-R134 PolarHBondContact O-N 3.24Å; D131-R134 WeakPolarHBondContact OD2-CD 3.3Å; T132-R134 PolarHBondContact O-N 3.22Å; R134-Y136 PolarHBondContact O-N 2.88Å; R134-Y136 VanDerWaalsContact O-N 3.17Å; R134-H137 VanDerWaalsContact O-CB 3.24Å; R134-H137 WeakPolarHBondContact O-CB 3.4Å; R134-H137 PolarHBondContact O-N 3.43Å; R134-Y140 HydrophobicContact CG-CD2 3.98Å; R134-Y140 HydrophobicContact CG-CE2 4.2Å; R134-R243 VanDerWaalsContact CD-NH1 3.3Å
135	R	96.1	Very high	95.1	Very high	79 Å²	79	28.6 Å²	28.6	30%	0.298	16%	0.16	S	C	.	.	H	α-helix	trans	-59.7	-29.6	-177.5	-70.3	-162	-67.3	157.6	-2	112	G130 D131 A164	G130-R135 PolarHBondContact O-NE 2.97Å; G130-R135 PolarHBondContact O-NH2 3.3Å; D131-R135 WeakPolarHBondContact O-CG 3.01Å; D131-R135 PolarHBondContact O-N 3.27Å; R135-A164 HydrophobicContact CB-CB 3.93Å; R135-A164 WeakPolarHBondContact O-CB 3.41Å
136	Y	97.5	Very high	94.7	Very high	5 Å²	5	29.7 Å²	29.7	2%	0.02	17%	0.168	C	C	.	.	T	Hydrogen-bonded Turn	trans	-108.9	26.4	176.5	-56.6	-103.6	0	0	0	112	Y52 F56 R87 T132 R134 Y141 H162 A164	Y52-Y136 HydrophobicContact CD1-CD1 4.26Å; Y52-Y136 AromaticContact CD1-CE1 3.81Å; Y52-Y136 HydrophobicContact CD1-CE1 3.81Å; Y52-Y136 HydrophobicContact CE1-CE1 4.39Å; F56-Y136 HydrophobicContact CB-CD1 4.39Å; F56-Y136 AromaticContact CD1-CD1 3.8Å; F56-Y136 HydrophobicContact CD1-CD1 3.8Å; F56-Y136 AromaticContact CD1-CD2 3.94Å; F56-Y136 HydrophobicContact CD1-CD2 3.94Å; F56-Y136 AromaticContact CD1-CE1 3.53Å; F56-Y136 HydrophobicContact CD1-CE1 3.53Å; F56-Y136 AromaticContact CD1-CE2 3.7Å; F56-Y136 HydrophobicContact CD1-CE2 3.7Å; F56-Y136 AromaticContact CD1-CG 3.98Å; F56-Y136 HydrophobicContact CD1-CG 3.98Å; F56-Y136 AromaticContact CD1-CZ 3.45Å; F56-Y136 VanDerWaalsContact CD1-CZ 3.45Å; F56-Y136 HydrophobicContact CD2-CE1 4.49Å; F56-Y136 HydrophobicContact CE1-CD1 4.42Å; F56-Y136 HydrophobicContact CE1-CD2 4.08Å; F56-Y136 AromaticContact CE1-CE1 3.79Å; F56-Y136 HydrophobicContact CE1-CE1 3.79Å; F56-Y136 AromaticContact CE1-CE2 3.41Å; F56-Y136 HydrophobicContact CE1-CE2 3.41Å; F56-Y136 VanDerWaalsContact CE1-CE2 3.41Å; F56-Y136 AromaticContact CE1-CZ 3.21Å; F56-Y136 WeakPolarHBondContact CE1-OH 3.42Å; F56-Y136 HydrophobicContact CG-CD1 4.21Å; F56-Y136 AromaticContact CG-CE1 3.92Å; F56-Y136 HydrophobicContact CG-CE1 3.92Å; F56-Y136 HydrophobicContact CZ-CE1 4.37Å; F56-Y136 HydrophobicContact CZ-CE2 4.34Å; F56-Y136 AromaticContact CZ-CZ 3.8Å; F56-Y136 VanDerWaalsContact CZ-OH 3.3Å; F56-Y136 WeakPolarHBondContact CZ-OH 3.39Å; R87-Y136 PolarHBondContact NH2-O 3.11Å; T132-Y136 HydrophobicContact CG2-CD2 4.48Å; T132-Y136 HydrophobicContact CG2-CE2 4.18Å; T132-Y136 WeakPolarHBondContact O-CB 3.42Å; T132-Y136 WeakPolarHBondContact O-CD2 3.38Å; T132-Y136 PolarHBondContact O-N 2.98Å; R134-Y136 PolarHBondContact O-N 2.88Å; R134-Y136 VanDerWaalsContact O-N 3.17Å; Y136-Y141 AromaticContact CD1-CD2 3.52Å; Y136-Y141 HydrophobicContact CD1-CD2 3.52Å; Y136-Y141 AromaticContact CD1-CE2 3.46Å; Y136-Y141 HydrophobicContact CD1-CE2 3.46Å; Y136-Y141 VanDerWaalsContact CD1-CE2 3.46Å; Y136-Y141 HydrophobicContact CE1-CD2 4.22Å; Y136-Y141 AromaticContact CE1-CE2 3.79Å; Y136-Y141 HydrophobicContact CE1-CE2 3.79Å; Y136-Y141 HydrophobicContact CG-CD2 4.09Å; Y136-Y141 HydrophobicContact CG-CE2 4.45Å; Y136-H162 PolarHBondContact OH-O 3.42Å; Y136-A164 HydrophobicContact CE1-CB 4.42Å; Y136-A164 HydrophobicContact CE2-CB 4.35Å
137	H	97.8	Very high	94.2	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	20%	0.196	C	C	.	.	S	Bend	trans	-74.6	151.1	173.1	-161.8	-99.3	0	0	0	111.3	P90 F98 Y100 R134 R139 Y140 Y141	P90-H137 VanDerWaalsContact CB-CD2 3.44Å; P90-H137 WeakPolarHBondContact CB-CD2 3.4Å; F98-H137 AromaticContact CD1-CE1 3.63Å; F98-H137 AromaticContact CD2-CE1 3.69Å; F98-H137 AromaticContact CE1-CE1 3.77Å; F98-H137 AromaticContact CE2-CE1 3.8Å; F98-H137 AromaticContact CG-CE1 3.6Å; F98-H137 AromaticContact CZ-CE1 3.85Å; Y100-H137 AromaticContact CE2-CD2 3.53Å; Y100-H137 AromaticContact CZ-CD2 3.71Å; R134-H137 VanDerWaalsContact O-CB 3.24Å; R134-H137 WeakPolarHBondContact O-CB 3.4Å; R134-H137 PolarHBondContact O-N 3.43Å; H137-R139 VanDerWaalsContact ND1-CB 3.27Å; H137-R139 WeakPolarHBondContact ND1-CB 3.44Å; H137-R139 PolarHBondContact ND1-N 3.21Å; H137-R139 VanDerWaalsContact ND1-N 3.19Å; H137-R139 PolarHBondContact O-N 2.97Å; H137-Y140 HydrophobicContact CB-CD2 4.37Å; H137-Y140 PolarHBondContact O-N 2.88Å; H137-Y141 WeakPolarHBondContact O-CB 3.39Å; H137-Y141 PolarHBondContact O-N 3Å
138	L	95.9	Very high	93.8	Very high	26 Å²	26	32.4 Å²	32.4	14%	0.136	19%	0.187	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.9	-26.5	174.5	-71.9	167.4	0	0	0	113.3	L53 P90 R92 F98 R173 V176	L53-L138 HydrophobicContact CD1-CD2 4.16Å; L53-L138 HydrophobicContact CD2-CD2 4.05Å; P90-L138 HydrophobicContact CB-CD1 4.18Å; P90-L138 HydrophobicContact CB-CG 4Å; P90-L138 HydrophobicContact CG-CG 4.06Å; R92-L138 HydrophobicContact CB-CD1 4.37Å; F98-L138 HydrophobicContact CD1-CD1 4.26Å; F98-L138 HydrophobicContact CE1-CB 3.86Å; F98-L138 HydrophobicContact CE1-CD1 3.88Å; F98-L138 HydrophobicContact CZ-CB 4.37Å; L138-R173 PolarHBondContact O-NH1 3.37Å; L138-V176 HydrophobicContact CB-CB 4.03Å; L138-V176 HydrophobicContact CB-CG2 4.24Å; L138-V176 PolarHBondContact O-N 3.34Å; L138-V176 VanDerWaalsContact O-N 3.13Å
139	R	94.4	Very high	93.3	Very high	24 Å²	24	37.8 Å²	37.8	9%	0.091	21%	0.213	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.7	-18.1	179.5	-176.2	59.4	-177.6	70	3.2	115.2	P102 H137 P175 V176 E181	P102-R139 HydrophobicContact CB-CB 3.95Å; P102-R139 HydrophobicContact CB-CG 4.02Å; P102-R139 HydrophobicContact CG-CB 4.25Å; P102-R139 HydrophobicContact CG-CG 4.11Å; H137-R139 VanDerWaalsContact ND1-CB 3.27Å; H137-R139 WeakPolarHBondContact ND1-CB 3.44Å; H137-R139 PolarHBondContact ND1-N 3.21Å; H137-R139 VanDerWaalsContact ND1-N 3.19Å; H137-R139 PolarHBondContact O-N 2.97Å; R139-P175 WeakPolarHBondContact O-CB 3.41Å; R139-V176 VanDerWaalsContact CA-O 3.28Å; R139-V176 WeakPolarHBondContact CA-O 3.24Å; R139-V176 WeakPolarHBondContact CD-O 3.43Å; R139-E181 IonicContact CZ-OE1 3.26Å; R139-E181 VanDerWaalsContact CZ-OE1 3.27Å; R139-E181 IonicContact CZ-OE2 2.92Å; R139-E181 IonicContact NE-OE1 3.34Å; R139-E181 PolarHBondContact NE-OE1 3.48Å; R139-E181 IonicContact NE-OE2 3.48Å; R139-E181 PolarHBondContact NE-OE2 3.4Å; R139-E181 IonicContact NH2-OE1 3.8Å; R139-E181 PolarHBondContact NH2-OE1 3.45Å
140	Y	95.6	Very high	93.2	Very high	39 Å²	39	39 Å²	39	15%	0.153	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	-137.3	-28.3	-166.7	-70	-54.2	0	0	0	115.9	P102 D103 R134 H137 K142 T143 R243	P102-Y140 HydrophobicContact CB-CD2 4.34Å; P102-Y140 HydrophobicContact CB-CE2 3.85Å; D103-Y140 WeakPolarHBondContact OD1-CE2 3.41Å; D103-Y140 PolarHBondContact OD1-OH 3.2Å; R134-Y140 HydrophobicContact CG-CD2 3.98Å; R134-Y140 HydrophobicContact CG-CE2 4.2Å; H137-Y140 HydrophobicContact CB-CD2 4.37Å; H137-Y140 PolarHBondContact O-N 2.88Å; Y140-K142 PolarHBondContact O-N 2.82Å; Y140-T143 WeakPolarHBondContact CA-OG1 3.29Å; Y140-T143 PolarHBondContact O-N 3.23Å; Y140-T143 PolarHBondContact O-OG1 3.11Å; Y140-T143 VanDerWaalsContact O-OG1 3.11Å; Y140-R243 WeakPolarHBondContact OH-CA 3.2Å; Y140-R243 WeakPolarHBondContact OH-CB 3.42Å; Y140-R243 PolarHBondContact OH-O 2.9Å
141	Y	97.2	Very high	93.1	Very high	3 Å²	3	40 Å²	40	1%	0.012	21%	0.21	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.7	122.3	-179	-176.9	-105	0	0	0	110.7	H49 Y52 L53 Y136 H137 T143 A164 R173	H49-Y141 HydrophobicContact CB-CE1 3.92Å; H49-Y141 AromaticContact CD2-CE1 3.98Å; H49-Y141 AromaticContact CG-CE1 3.98Å; Y52-Y141 VanDerWaalsContact CB-OH 3.32Å; Y52-Y141 WeakPolarHBondContact CB-OH 3.18Å; Y52-Y141 VanDerWaalsContact CD2-OH 3.27Å; Y52-Y141 WeakPolarHBondContact CD2-OH 3.37Å; Y52-Y141 HydrophobicContact CG-CE2 4.38Å; Y52-Y141 AromaticContact CG-CZ 3.95Å; Y52-Y141 VanDerWaalsContact CG-OH 3.27Å; L53-Y141 HydrophobicContact CD1-CD1 4.24Å; L53-Y141 HydrophobicContact CD2-CD1 3.96Å; L53-Y141 HydrophobicContact CD2-CG 4.02Å; L53-Y141 HydrophobicContact CG-CD1 3.83Å; L53-Y141 HydrophobicContact CG-CE1 4.45Å; L53-Y141 HydrophobicContact CG-CG 4.35Å; Y136-Y141 AromaticContact CD1-CD2 3.52Å; Y136-Y141 HydrophobicContact CD1-CD2 3.52Å; Y136-Y141 AromaticContact CD1-CE2 3.46Å; Y136-Y141 HydrophobicContact CD1-CE2 3.46Å; Y136-Y141 VanDerWaalsContact CD1-CE2 3.46Å; Y136-Y141 HydrophobicContact CE1-CD2 4.22Å; Y136-Y141 AromaticContact CE1-CE2 3.79Å; Y136-Y141 HydrophobicContact CE1-CE2 3.79Å; Y136-Y141 HydrophobicContact CG-CD2 4.09Å; Y136-Y141 HydrophobicContact CG-CE2 4.45Å; H137-Y141 WeakPolarHBondContact O-CB 3.39Å; H137-Y141 PolarHBondContact O-N 3Å; Y141-T143 WeakPolarHBondContact O-CG2 3.44Å; Y141-T143 PolarHBondContact O-N 2.57Å; Y141-T143 VanDerWaalsContact O-N 3.15Å; Y141-A164 HydrophobicContact CD2-CB 4.23Å; Y141-A164 HydrophobicContact CE2-CB 4.48Å; Y141-R173 WeakPolarHBondContact O-CD 3.38Å; Y141-R173 PolarHBondContact O-NH1 2.89Å
142	K	95.7	Very high	92.7	Very high	13 Å²	13	43.9 Å²	43.9	6%	0.057	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	59.2	16.1	-179.6	-60.6	-71	-172.3	176.6	0	115.4	Y140 G144 C163 A164 F165 A166 D171 R173	Y140-K142 PolarHBondContact O-N 2.82Å; K142-G144 VanDerWaalsContact C-N 3.29Å; K142-G144 PolarHBondContact O-N 2.98Å; K142-C163 VanDerWaalsContact CE-O 3.27Å; K142-C163 WeakPolarHBondContact CE-O 3.35Å; K142-C163 PolarHBondContact NZ-O 3.24Å; K142-A164 WeakPolarHBondContact CA-O 3.28Å; K142-A164 PolarHBondContact N-O 2.75Å; K142-F165 WeakPolarHBondContact CD-O 3.42Å; K142-F165 PolarHBondContact NZ-O 2.78Å; K142-A166 HydrophobicContact CD-CB 4.34Å; K142-D171 WeakPolarHBondContact CD-OD1 3.45Å; K142-D171 VanDerWaalsContact CE-OD1 3.32Å; K142-D171 WeakPolarHBondContact CE-OD1 3.37Å; K142-D171 WeakPolarHBondContact CE-OD2 3.43Å; K142-D171 IonicContact NZ-OD1 3.79Å; K142-D171 PolarHBondContact NZ-OD1 2.89Å; K142-D171 IonicContact NZ-OD2 3.59Å; K142-D171 PolarHBondContact NZ-OD2 2.88Å; K142-R173 HydrophobicContact CB-CB 3.7Å; K142-R173 PolarHBondContact O-N 3.41Å
143	T	93.4	Very high	92.2	Very high	22 Å²	22	51.7 Å²	51.7	14%	0.135	28%	0.281	C	S	.	.	S	Bend	trans	-87.4	9.2	-177.5	73.5	0	0	0	0	114.9	Y140 Y141 R173 P175	Y140-T143 WeakPolarHBondContact CA-OG1 3.29Å; Y140-T143 PolarHBondContact O-N 3.23Å; Y140-T143 PolarHBondContact O-OG1 3.11Å; Y140-T143 VanDerWaalsContact O-OG1 3.11Å; Y141-T143 WeakPolarHBondContact O-CG2 3.44Å; Y141-T143 PolarHBondContact O-N 2.57Å; Y141-T143 VanDerWaalsContact O-N 3.15Å; T143-R173 VanDerWaalsContact CA-O 3.31Å; T143-R173 WeakPolarHBondContact CA-O 3.41Å; T143-P175 HydrophobicContact CG2-CB 3.83Å
144	G	88.9	Confident	91.4	Very high	28 Å²	28	54.1 Å²	54.1	29%	0.289	31%	0.306	S	S	.	.	S	Bend	trans	-161.8	148.3	178.2	0	0	0	0	0	111	K142 A166	K142-G144 VanDerWaalsContact C-N 3.29Å; K142-G144 PolarHBondContact O-N 2.98Å; G144-A166 PolarHBondContact O-N 3.24Å
145	S	88.4	Confident	91	Very high	77 Å²	77	55.3 Å²	55.3	54%	0.538	31%	0.313	S	S	.	.	B	Isolated β-bridge	trans	-67.4	148.9	-177.2	-51.2	0	0	0	0	112.3	A166	S145-A166 CarbonylContact C-O 3.55Å; S145-A166 WeakPolarHBondContact CA-O 3.43Å
146	C	89.6	Confident	90.8	Very high	24 Å²	24	51.8 Å²	51.8	16%	0.162	30%	0.301	C	S	.	.			trans	-75.2	140.7	173.3	-158.4	0	0	0	0	111.1	H148 F165 A166 H167	C146-H148 VanDerWaalsContact C-N 3.29Å; C146-F165 HydrophobicContact CB-CB 3.7Å; C146-A166 PolarHBondContact N-O 2.8Å; C146-H167 VanDerWaalsContact CB-CE1 3.46Å; C146-H167 WeakPolarHBondContact CB-CE1 3.2Å; C146-H167 VanDerWaalsContact CB-NE2 3.31Å; C146-H167 WeakPolarHBondContact CB-NE2 3.4Å
147	I	87.1	Confident	90.5	Very high	120 Å²	120	55.7 Å²	55.7	62%	0.615	33%	0.329	S	S	*	.	S	Bend	trans	-84.3	-3.1	172	64.7	167.4	0	0	0	113.3
148	H	86.3	Confident	90	Very high	47 Å²	47	62.8 Å²	62.8	22%	0.218	36%	0.359	C	S	.	.	S	Bend	trans	-109.9	137.5	-178.5	-63.1	-52.2	0	0	0	109.6	C146 C156 K158 H167	C146-H148 VanDerWaalsContact C-N 3.29Å; H148-C156 VanDerWaalsContact CB-SG 3.6Å; H148-K158 HydrophobicContact CB-CB 4.48Å; H148-K158 WeakPolarHBondContact NE2-CD 3.38Å; H148-H167 PolarHBondContact O-CE1 3.42Å
149	E	85.7	Confident	89.7	Confident	116 Å²	116	64.1 Å²	64.1	54%	0.542	37%	0.367	S	S	.	.	P	Polyproline II helix	trans	-62.7	161.6	-178.7	-58.2	-165.2	164	0	0	112.7	S157	E149-S157 PolarHBondContact O-N 3.49Å; E149-S157 PolarHBondContact O-OG 3.39Å
150	T	90.6	Very high	89.5	Confident	68 Å²	68	64.4 Å²	64.4	42%	0.417	38%	0.378	S	S	.	.	B	Isolated β-bridge	trans	-102.5	132	-177.4	-43.6	0	0	0	0	109	G154 H155 H167	T150-G154 VanDerWaalsContact CG2-CA 3.46Å; T150-H155 CarbonylContact C-O 3.51Å; T150-H155 VanDerWaalsContact CA-O 3.27Å; T150-H155 WeakPolarHBondContact CA-O 3.24Å; T150-H167 HydrophobicContact CG2-CB 4.37Å; T150-H167 PolarHBondContact OG1-ND1 3.02Å
151	D	88.9	Confident	89.2	Confident	67 Å²	67	65.2 Å²	65.2	36%	0.358	39%	0.389	S	S	.	.	P	Polyproline II helix	trans	-67.6	168.6	173.1	80	-5.5	0	0	0	111.5	K153 G154 H155	D151-K153 PolarHBondContact O-N 2.93Å; D151-K153 VanDerWaalsContact OD1-C 3.3Å; D151-K153 VanDerWaalsContact OD1-CA 3.29Å; D151-K153 WeakPolarHBondContact OD1-CA 3.08Å; D151-K153 WeakPolarHBondContact OD1-CB 3.28Å; D151-K153 PolarHBondContact OD1-N 3.34Å; D151-G154 PolarHBondContact O-N 2.95Å; D151-G154 PolarHBondContact OD1-N 3.45Å; D151-H155 PolarHBondContact N-O 2.89Å; D151-H155 WeakPolarHBondContact OD1-CB 3.27Å; D151-H155 IonicContact OD1-CG 2.9Å; D151-H155 PolarHBondContact OD1-N 3.04Å; D151-H155 IonicContact OD1-ND1 2.7Å; D151-H155 IonicContact OD2-ND1 3.95Å
152	A	86.8	Confident	89.1	Confident	116 Å²	116	66.5 Å²	66.5	96%	0.959	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.2	4.5	176.9	0	0	0	0	0	114.6
153	K	84.8	Confident	89	Confident	167 Å²	167	66 Å²	66	73%	0.726	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	-114.5	1.1	176.6	-59.4	174.6	-179.8	174.4	0	112.6	D151	D151-K153 PolarHBondContact O-N 2.93Å; D151-K153 VanDerWaalsContact OD1-C 3.3Å; D151-K153 VanDerWaalsContact OD1-CA 3.29Å; D151-K153 WeakPolarHBondContact OD1-CA 3.08Å; D151-K153 WeakPolarHBondContact OD1-CB 3.28Å; D151-K153 PolarHBondContact OD1-N 3.34Å
154	G	82.7	Confident	89.1	Confident	52 Å²	52	65.1 Å²	65.1	54%	0.536	39%	0.388	S	S	.	.	S	Bend	trans	89.8	13.7	-179.9	0	0	0	0	0	115.1	T150 D151	T150-G154 VanDerWaalsContact CG2-CA 3.46Å; D151-G154 PolarHBondContact O-N 2.95Å; D151-G154 PolarHBondContact OD1-N 3.45Å
155	H	88.8	Confident	89.4	Confident	69 Å²	69	67.8 Å²	67.8	32%	0.319	39%	0.392	S	S	.	.			trans	-107.2	153.2	-176.2	-52.3	129.6	0	0	0	113.2	T150 D151 S157 S161	T150-H155 CarbonylContact C-O 3.51Å; T150-H155 VanDerWaalsContact CA-O 3.27Å; T150-H155 WeakPolarHBondContact CA-O 3.24Å; D151-H155 PolarHBondContact N-O 2.89Å; D151-H155 WeakPolarHBondContact OD1-CB 3.27Å; D151-H155 IonicContact OD1-CG 2.9Å; D151-H155 PolarHBondContact OD1-N 3.04Å; D151-H155 IonicContact OD1-ND1 2.7Å; D151-H155 IonicContact OD2-ND1 3.95Å; H155-S157 PolarHBondContact O-N 3.02Å; H155-S161 VanDerWaalsContact CD2-CA 3.47Å; H155-S161 WeakPolarHBondContact CD2-CA 3.32Å; H155-S161 WeakPolarHBondContact CD2-CB 3.39Å
156	C	91.6	Very high	89.6	Confident	5 Å²	5	64.1 Å²	64.1	3%	0.034	37%	0.366	C	S	.	.	B	Isolated β-bridge	trans	-67.3	129.6	174.8	-178.4	0	0	0	0	111.8	H148 K158 N159 G160 C163 H167	H148-C156 VanDerWaalsContact CB-SG 3.6Å; C156-K158 PolarHBondContact O-N 3.1Å; C156-K158 VanDerWaalsContact O-N 3.1Å; C156-K158 PolarHBondContact SG-N 3.12Å; C156-N159 HydrophobicContact CB-CB 3.98Å; C156-N159 PolarHBondContact O-N 3.11Å; C156-N159 PolarHBondContact SG-N 3.38Å; C156-G160 WeakPolarHBondContact CB-O 3.24Å; C156-G160 PolarHBondContact N-O 2.9Å; C156-G160 VanDerWaalsContact O-CA 3.28Å; C156-G160 WeakPolarHBondContact O-CA 3.24Å; C156-G160 PolarHBondContact O-N 3.47Å; C156-C163 HydrophobicContact CB-CB 3.51Å; C156-H167 VanDerWaalsContact CB-CE1 3.48Å; C156-H167 WeakPolarHBondContact CB-CE1 3.18Å; C156-H167 WeakPolarHBondContact CB-NE2 3.42Å
157	S	90.3	Very high	89.6	Confident	87 Å²	87	64.2 Å²	64.2	61%	0.608	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56	-28.6	176.4	60.4	0	0	0	0	114.2	E149 H155	E149-S157 PolarHBondContact O-N 3.49Å; E149-S157 PolarHBondContact O-OG 3.39Å; H155-S157 PolarHBondContact O-N 3.02Å
158	K	88.6	Confident	89.5	Confident	148 Å²	148	60.1 Å²	60.1	64%	0.643	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.8	-39.8	178.3	-170.9	179.7	-176.6	174.9	0	114.6	H148 C156	H148-K158 HydrophobicContact CB-CB 4.48Å; H148-K158 WeakPolarHBondContact NE2-CD 3.38Å; C156-K158 PolarHBondContact O-N 3.1Å; C156-K158 VanDerWaalsContact O-N 3.1Å; C156-K158 PolarHBondContact SG-N 3.12Å
159	N	88.3	Confident	89.3	Confident	54 Å²	54	62.9 Å²	62.9	29%	0.289	38%	0.376	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108	-1.4	-170.1	-62.2	-44.7	0	0	0	113.8	C156 C163	C156-N159 HydrophobicContact CB-CB 3.98Å; C156-N159 PolarHBondContact O-N 3.11Å; C156-N159 PolarHBondContact SG-N 3.38Å; N159-C163 HydrophobicContact CB-CB 3.95Å; N159-C163 PolarHBondContact ND2-SG 3.11Å
160	G	89.8	Confident	89.3	Confident	31 Å²	31	64.2 Å²	64.2	32%	0.32	38%	0.382	S	S	.	.	B	Isolated β-bridge	trans	63.1	-154.2	-175.7	0	0	0	0	0	113.7	C156 H162 C163	C156-G160 WeakPolarHBondContact CB-O 3.24Å; C156-G160 PolarHBondContact N-O 2.9Å; C156-G160 VanDerWaalsContact O-CA 3.28Å; C156-G160 WeakPolarHBondContact O-CA 3.24Å; C156-G160 PolarHBondContact O-N 3.47Å; G160-H162 PolarHBondContact O-N 3.45Å; G160-C163 PolarHBondContact O-N 2.88Å
161	S	90.6	Very high	89.3	Confident	56 Å²	56	61.9 Å²	61.9	39%	0.392	37%	0.367	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-22.7	179.5	54.5	0	0	0	0	114	Y52 H155 C163	Y52-S161 PolarHBondContact OH-O 2.81Å; H155-S161 VanDerWaalsContact CD2-CA 3.47Å; H155-S161 WeakPolarHBondContact CD2-CA 3.32Å; H155-S161 WeakPolarHBondContact CD2-CB 3.39Å; S161-C163 VanDerWaalsContact C-N 3.27Å; S161-C163 PolarHBondContact O-N 3.47Å
162	H	93.9	Very high	89.4	Confident	29 Å²	29	61.5 Å²	61.5	13%	0.134	36%	0.364	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.7	22.7	-179.5	-53.9	-33.2	0	0	0	112.9	Y52 F56 S76 Y136 G160 A164	Y52-H162 HydrophobicContact CE1-CB 4.25Å; Y52-H162 AromaticContact CE1-ND1 3.54Å; Y52-H162 AromaticContact CZ-ND1 3.65Å; Y52-H162 PolarHBondContact OH-ND1 3.22Å; F56-H162 HydrophobicContact CE2-CB 4.07Å; F56-H162 AromaticContact CE2-CD2 3.8Å; F56-H162 AromaticContact CE2-CG 3.73Å; F56-H162 HydrophobicContact CZ-CB 4.23Å; S76-H162 PolarHBondContact O-NE2 3.14Å; Y136-H162 PolarHBondContact OH-O 3.42Å; G160-H162 PolarHBondContact O-N 3.45Å; H162-A164 PolarHBondContact O-N 3.23Å; H162-A164 VanDerWaalsContact O-N 3.15Å
163	C	94.3	Very high	89.6	Confident	3 Å²	3	57 Å²	57	2%	0.02	32%	0.323	C	S	.	.			trans	-64.8	121	179.5	-164.7	0	0	0	0	111.5	K142 C156 N159 G160 S161 F165 H167	K142-C163 VanDerWaalsContact CE-O 3.27Å; K142-C163 WeakPolarHBondContact CE-O 3.35Å; K142-C163 PolarHBondContact NZ-O 3.24Å; C156-C163 HydrophobicContact CB-CB 3.51Å; N159-C163 HydrophobicContact CB-CB 3.95Å; N159-C163 PolarHBondContact ND2-SG 3.11Å; G160-C163 PolarHBondContact O-N 2.88Å; S161-C163 VanDerWaalsContact C-N 3.27Å; S161-C163 PolarHBondContact O-N 3.47Å; C163-F165 PolarHBondContact O-N 3.4Å; C163-H167 PolarHBondContact SG-NE2 2.85Å
164	A	95.6	Very high	89.7	Confident	3 Å²	3	52.3 Å²	52.3	3%	0.025	31%	0.311	C	S	.	.	S	Bend	trans	-73.8	-11.6	179.1	0	0	0	0	0	114.2	R135 Y136 Y141 K142 H162	R135-A164 HydrophobicContact CB-CB 3.93Å; R135-A164 WeakPolarHBondContact O-CB 3.41Å; Y136-A164 HydrophobicContact CE1-CB 4.42Å; Y136-A164 HydrophobicContact CE2-CB 4.35Å; Y141-A164 HydrophobicContact CD2-CB 4.23Å; Y141-A164 HydrophobicContact CE2-CB 4.48Å; K142-A164 WeakPolarHBondContact CA-O 3.28Å; K142-A164 PolarHBondContact N-O 2.75Å; H162-A164 PolarHBondContact O-N 3.23Å; H162-A164 VanDerWaalsContact O-N 3.15Å
165	F	95.6	Very high	90	Very high	84 Å²	84	50.8 Å²	50.8	37%	0.368	29%	0.291	S	S	.	.	S	Bend	trans	-95.2	159.3	174	-64	-89	0	0	0	110.9	K142 C146 C163 H167	K142-F165 WeakPolarHBondContact CD-O 3.42Å; K142-F165 PolarHBondContact NZ-O 2.78Å; C146-F165 HydrophobicContact CB-CB 3.7Å; C163-F165 PolarHBondContact O-N 3.4Å; F165-H167 PolarHBondContact O-CD2 2.93Å
166	A	92.5	Very high	90.2	Very high	1 Å²	1	49.3 Å²	49.3	1%	0.008	29%	0.287	C	S	.	.	B	Isolated β-bridge	trans	-84.1	131.5	-174.8	0	0	0	0	0	113.1	K142 G144 S145 C146 G168 D171 L172	K142-A166 HydrophobicContact CD-CB 4.34Å; G144-A166 PolarHBondContact O-N 3.24Å; S145-A166 CarbonylContact C-O 3.55Å; S145-A166 WeakPolarHBondContact CA-O 3.43Å; C146-A166 PolarHBondContact N-O 2.8Å; A166-G168 VanDerWaalsContact C-N 3.34Å; A166-G168 PolarHBondContact O-N 2.92Å; A166-D171 VanDerWaalsContact CA-OD2 3.27Å; A166-D171 WeakPolarHBondContact CA-OD2 3.33Å; A166-D171 HydrophobicContact CB-CB 4.27Å; A166-D171 WeakPolarHBondContact CB-O 3.43Å; A166-L172 HydrophobicContact CB-CB 4.37Å; A166-L172 HydrophobicContact CB-CD2 3.52Å; A166-L172 HydrophobicContact CB-CG 3.77Å
167	H	89.9	Confident	90.1	Very high	26 Å²	26	52.4 Å²	52.4	12%	0.12	30%	0.299	C	S	.	.	S	Bend	trans	-96.3	55.4	178.1	-76.3	-92.7	0	0	0	112	C146 H148 T150 C156 C163 F165 H170 D171	C146-H167 VanDerWaalsContact CB-CE1 3.46Å; C146-H167 WeakPolarHBondContact CB-CE1 3.2Å; C146-H167 VanDerWaalsContact CB-NE2 3.31Å; C146-H167 WeakPolarHBondContact CB-NE2 3.4Å; H148-H167 PolarHBondContact O-CE1 3.42Å; T150-H167 HydrophobicContact CG2-CB 4.37Å; T150-H167 PolarHBondContact OG1-ND1 3.02Å; C156-H167 VanDerWaalsContact CB-CE1 3.48Å; C156-H167 WeakPolarHBondContact CB-CE1 3.18Å; C156-H167 WeakPolarHBondContact CB-NE2 3.42Å; C163-H167 PolarHBondContact SG-NE2 2.85Å; F165-H167 PolarHBondContact O-CD2 2.93Å; H167-H170 PolarHBondContact O-CE1 3.34Å; H167-H170 VanDerWaalsContact O-CE1 3.3Å; H167-D171 PolarHBondContact N-OD2 3.12Å
168	G	84.2	Confident	90.1	Very high	33 Å²	33	48.7 Å²	48.7	34%	0.34	27%	0.272	S	S	.	.	S	Bend	trans	117.9	171	-178.4	0	0	0	0	0	112.9	A166 H170 D171 L172	A166-G168 VanDerWaalsContact C-N 3.34Å; A166-G168 PolarHBondContact O-N 2.92Å; G168-H170 VanDerWaalsContact C-N 3.31Å; G168-H170 PolarHBondContact O-N 3.1Å; G168-D171 PolarHBondContact O-N 2.63Å; G168-D171 VanDerWaalsContact O-N 3.1Å; G168-L172 PolarHBondContact O-N 2.73Å
169	S	82.9	Confident	89.9	Confident	105 Å²	105	44 Å²	44	73%	0.734	25%	0.254	S	S	*	.	G	3₁₀ helix	trans	-60.8	-37.1	-177.4	50.7	0	0	0	0	113.3	D171 L172	S169-D171 PolarHBondContact O-N 3.43Å; S169-L172 PolarHBondContact O-N 3.08Å; S169-L172 VanDerWaalsContact O-N 3.16Å
170	H	85	Confident	89.7	Confident	144 Å²	144	48.2 Å²	48.2	67%	0.667	27%	0.265	S	S	*	.	G	3₁₀ helix	trans	-63.4	-23	176.8	71.2	-90.6	0	0	0	113.3	K46 H167 G168	K46-H170 PolarHBondContact NZ-O 2.83Å; H167-H170 PolarHBondContact O-CE1 3.34Å; H167-H170 VanDerWaalsContact O-CE1 3.3Å; G168-H170 VanDerWaalsContact C-N 3.31Å; G168-H170 PolarHBondContact O-N 3.1Å
171	D	90.9	Very high	89.3	Confident	20 Å²	20	48.8 Å²	48.8	11%	0.107	26%	0.26	C	S	.	.	G	3₁₀ helix	trans	-101.7	-1.1	179	-172.9	34.8	0	0	0	112.4	H49 K142 A166 H167 G168 S169	H49-D171 IonicContact CD2-OD1 2.87Å; H49-D171 PolarHBondContact CE1-O 2.97Å; H49-D171 IonicContact CE1-OD1 2.83Å; H49-D171 IonicContact NE2-OD1 2.74Å; H49-D171 PolarHBondContact NE2-OD1 3.27Å; K142-D171 WeakPolarHBondContact CD-OD1 3.45Å; K142-D171 VanDerWaalsContact CE-OD1 3.32Å; K142-D171 WeakPolarHBondContact CE-OD1 3.37Å; K142-D171 WeakPolarHBondContact CE-OD2 3.43Å; K142-D171 IonicContact NZ-OD1 3.79Å; K142-D171 PolarHBondContact NZ-OD1 2.89Å; K142-D171 IonicContact NZ-OD2 3.59Å; K142-D171 PolarHBondContact NZ-OD2 2.88Å; A166-D171 VanDerWaalsContact CA-OD2 3.27Å; A166-D171 WeakPolarHBondContact CA-OD2 3.33Å; A166-D171 HydrophobicContact CB-CB 4.27Å; A166-D171 WeakPolarHBondContact CB-O 3.43Å; H167-D171 PolarHBondContact N-OD2 3.12Å; G168-D171 PolarHBondContact O-N 2.63Å; G168-D171 VanDerWaalsContact O-N 3.1Å; S169-D171 PolarHBondContact O-N 3.43Å
172	L	90.3	Very high	88.7	Confident	58 Å²	58	48.1 Å²	48.1	30%	0.304	25%	0.253	S	S	.	.			trans	-70.7	154.8	171	-79.2	171.4	0	0	0	111.8	K46 A166 G168 S169	K46-L172 PolarHBondContact NZ-O 2.66Å; A166-L172 HydrophobicContact CB-CB 4.37Å; A166-L172 HydrophobicContact CB-CD2 3.52Å; A166-L172 HydrophobicContact CB-CG 3.77Å; G168-L172 PolarHBondContact O-N 2.73Å; S169-L172 PolarHBondContact O-N 3.08Å; S169-L172 VanDerWaalsContact O-N 3.16Å
173	R	91.3	Very high	87.9	Confident	23 Å²	23	51.8 Å²	51.8	9%	0.087	27%	0.27	C	S	.	.			trans	-145.1	140.7	-176.5	179.4	178.6	171.2	-79.8	-11.9	110.1	E45 L138 Y141 K142 T143	E45-R173 VanDerWaalsContact OE1-CD 3.24Å; E45-R173 WeakPolarHBondContact OE1-CD 3.37Å; E45-R173 IonicContact OE1-CZ 3.85Å; E45-R173 IonicContact OE1-NE 3.32Å; E45-R173 PolarHBondContact OE1-NE 3.29Å; E45-R173 IonicContact OE2-CZ 2.74Å; E45-R173 IonicContact OE2-NE 2.73Å; E45-R173 PolarHBondContact OE2-NE 3.2Å; E45-R173 IonicContact OE2-NH2 3.16Å; E45-R173 PolarHBondContact OE2-NH2 3.08Å; L138-R173 PolarHBondContact O-NH1 3.37Å; Y141-R173 WeakPolarHBondContact O-CD 3.38Å; Y141-R173 PolarHBondContact O-NH1 2.89Å; K142-R173 HydrophobicContact CB-CB 3.7Å; K142-R173 PolarHBondContact O-N 3.41Å; T143-R173 VanDerWaalsContact CA-O 3.31Å; T143-R173 WeakPolarHBondContact CA-O 3.41Å
174	S	86.6	Confident	86.9	Confident	67 Å²	67	56.3 Å²	56.3	47%	0.469	30%	0.298	S	S	.	.	P	Polyproline II helix	trans	-73.2	139.2	176.6	-58.7	0	0	0	0	111.3	S204	S174-S204 PolarHBondContact OG-OG 2.9Å
175	P	89.7	Confident	85.6	Confident	20 Å²	20	60.9 Å²	60.9	13%	0.13	32%	0.321	C	S	.	.	P	Polyproline II helix	trans	-65.8	138.9	174.8	27.8	-34.6	0	0	0	111.1	R139 T143 Y177	R139-P175 WeakPolarHBondContact O-CB 3.41Å; T143-P175 HydrophobicContact CG2-CB 3.83Å; P175-Y177 HydrophobicContact CB-CE2 4.22Å; P175-Y177 HydrophobicContact CG-CE2 3.67Å; P175-Y177 WeakPolarHBondContact CG-OH 3.36Å
176	V	92.1	Very high	84.1	Confident	38 Å²	38	62.2 Å²	62.2	23%	0.23	33%	0.332	C	S	.	.	P	Polyproline II helix	trans	-89.2	130.7	165	-174.8	0	0	0	0	107.9	F98 L138 R139	F98-V176 HydrophobicContact CE1-CG1 4.11Å; F98-V176 HydrophobicContact CZ-CB 4.28Å; F98-V176 HydrophobicContact CZ-CG1 3.99Å; F98-V176 WeakPolarHBondContact CZ-O 3.49Å; L138-V176 HydrophobicContact CB-CB 4.03Å; L138-V176 HydrophobicContact CB-CG2 4.24Å; L138-V176 PolarHBondContact O-N 3.34Å; L138-V176 VanDerWaalsContact O-N 3.13Å; R139-V176 VanDerWaalsContact CA-O 3.28Å; R139-V176 WeakPolarHBondContact CA-O 3.24Å; R139-V176 WeakPolarHBondContact CD-O 3.43Å
177	Y	89.8	Confident	82.1	Confident	71 Å²	71	66.9 Å²	66.9	28%	0.278	37%	0.365	S	S	.	.	P	Polyproline II helix	trans	-100.6	154.2	-179.8	-63.3	-86.2	0	0	0	111.8	R92 P175 E181 V182	R92-Y177 PolarHBondContact NE-O 3.04Å; P175-Y177 HydrophobicContact CB-CE2 4.22Å; P175-Y177 HydrophobicContact CG-CE2 3.67Å; P175-Y177 WeakPolarHBondContact CG-OH 3.36Å; Y177-E181 HydrophobicContact CD1-CG 4.25Å; Y177-E181 WeakPolarHBondContact CD1-OE2 3.22Å; Y177-V182 HydrophobicContact CG-CG2 4.44Å
178	D	89.8	Confident	80.2	Confident	9 Å²	9	73 Å²	73	5%	0.048	39%	0.393	C	S	.	.	P	Polyproline II helix	trans	-75.9	144	167.1	-168.6	-75	0	0	0	108.9	T97 F98 R180 E181 V182	T97-D178 VanDerWaalsContact CA-OD2 3.3Å; T97-D178 WeakPolarHBondContact CA-OD2 3.45Å; F98-D178 HydrophobicContact CD2-CB 3.73Å; F98-D178 HydrophobicContact CE2-CB 3.81Å; F98-D178 PolarHBondContact N-OD2 3.03Å; D178-R180 PolarHBondContact O-N 3.03Å; D178-R180 VanDerWaalsContact O-N 3.11Å; D178-R180 WeakPolarHBondContact OD1-CB 3.43Å; D178-R180 IonicContact OD1-CZ 3.65Å; D178-R180 PolarHBondContact OD1-N 3.12Å; D178-R180 IonicContact OD1-NE 3.71Å; D178-R180 PolarHBondContact OD1-NE 3.17Å; D178-R180 IonicContact OD1-NH2 2.75Å; D178-R180 PolarHBondContact OD1-NH2 2.94Å; D178-R180 IonicContact OD2-CZ 3.95Å; D178-R180 IonicContact OD2-NE 3.4Å; D178-R180 IonicContact OD2-NH2 3.53Å; D178-R180 PolarHBondContact OD2-NH2 3.38Å; D178-E181 HydrophobicContact CB-CB 4.28Å; D178-E181 WeakPolarHBondContact O-CA 3.27Å; D178-E181 WeakPolarHBondContact O-CB 3.49Å; D178-E181 PolarHBondContact O-N 3.25Å; D178-V182 PolarHBondContact O-N 3.11Å
179	I	85.8	Confident	78.2	Confident	50 Å²	50	74.3 Å²	74.3	26%	0.256	41%	0.407	S	S	.	.	H	α-helix	trans	-54.4	-32.5	178.5	-171	58.7	0	0	0	113	G96 T97 V182 Q183	G96-I179 PolarHBondContact O-N 3.19Å; T97-I179 HydrophobicContact CG2-CG2 3.7Å; I179-V182 PolarHBondContact O-N 3.45Å; I179-Q183 WeakPolarHBondContact O-CB 3.41Å; I179-Q183 VanDerWaalsContact O-CG 3.31Å; I179-Q183 WeakPolarHBondContact O-CG 3.5Å; I179-Q183 PolarHBondContact O-N 3.34Å
180	R	84.4	Confident	76	Confident	141 Å²	141	72.7 Å²	72.7	53%	0.532	41%	0.407	S	S	.	.	H	α-helix	trans	-71.2	-33.1	176.6	-64.3	165.1	-70.8	-169.7	-1.8	112.4	D178 V184	D178-R180 PolarHBondContact O-N 3.03Å; D178-R180 VanDerWaalsContact O-N 3.11Å; D178-R180 WeakPolarHBondContact OD1-CB 3.43Å; D178-R180 IonicContact OD1-CZ 3.65Å; D178-R180 PolarHBondContact OD1-N 3.12Å; D178-R180 IonicContact OD1-NE 3.71Å; D178-R180 PolarHBondContact OD1-NE 3.17Å; D178-R180 IonicContact OD1-NH2 2.75Å; D178-R180 PolarHBondContact OD1-NH2 2.94Å; D178-R180 IonicContact OD2-CZ 3.95Å; D178-R180 IonicContact OD2-NE 3.4Å; D178-R180 IonicContact OD2-NH2 3.53Å; D178-R180 PolarHBondContact OD2-NH2 3.38Å; R180-V184 WeakPolarHBondContact O-CG2 3.47Å; R180-V184 PolarHBondContact O-N 2.98Å
181	E	81.1	Confident	73.6	Confident	44 Å²	44	71.4 Å²	71.4	21%	0.206	41%	0.414	C	S	.	.	H	α-helix	trans	-70.3	-40.9	175.3	-163.9	-177	173.5	0	0	110.3	R139 Y177 D178 V184 L185	R139-E181 IonicContact CZ-OE1 3.26Å; R139-E181 VanDerWaalsContact CZ-OE1 3.27Å; R139-E181 IonicContact CZ-OE2 2.92Å; R139-E181 IonicContact NE-OE1 3.34Å; R139-E181 PolarHBondContact NE-OE1 3.48Å; R139-E181 IonicContact NE-OE2 3.48Å; R139-E181 PolarHBondContact NE-OE2 3.4Å; R139-E181 IonicContact NH2-OE1 3.8Å; R139-E181 PolarHBondContact NH2-OE1 3.45Å; Y177-E181 HydrophobicContact CD1-CG 4.25Å; Y177-E181 WeakPolarHBondContact CD1-OE2 3.22Å; D178-E181 HydrophobicContact CB-CB 4.28Å; D178-E181 WeakPolarHBondContact O-CA 3.27Å; D178-E181 WeakPolarHBondContact O-CB 3.49Å; D178-E181 PolarHBondContact O-N 3.25Å; E181-V184 PolarHBondContact O-N 2.91Å; E181-L185 WeakPolarHBondContact O-CD1 3.37Å; E181-L185 WeakPolarHBondContact O-CG 3.28Å; E181-L185 PolarHBondContact O-N 2.91Å; E181-L185 VanDerWaalsContact O-N 3.1Å
182	V	77.4	Confident	70.7	Confident	41 Å²	41	74 Å²	74	25%	0.248	45%	0.445	C	S	.	.	H	α-helix	trans	-62.1	-51	174.1	178.4	0	0	0	0	111.2	Y177 D178 I179 V184 L185 D186	Y177-V182 HydrophobicContact CG-CG2 4.44Å; D178-V182 PolarHBondContact O-N 3.11Å; I179-V182 PolarHBondContact O-N 3.45Å; V182-V184 VanDerWaalsContact C-N 3.27Å; V182-V184 PolarHBondContact O-N 2.81Å; V182-L185 WeakPolarHBondContact O-CB 3.34Å; V182-L185 PolarHBondContact O-N 3.29Å; V182-D186 WeakPolarHBondContact CG1-OD2 3.45Å; V182-D186 VanDerWaalsContact O-CG 3.3Å; V182-D186 PolarHBondContact O-N 2.84Å
183	Q	77.4	Confident	68	Low	106 Å²	106	76.6 Å²	76.6	50%	0.495	48%	0.476	S	S	.	.	H	α-helix	trans	-59.4	-35.2	180	-75.5	171.5	-18.8	0	0	113.3	I179 S187	I179-Q183 WeakPolarHBondContact O-CB 3.41Å; I179-Q183 VanDerWaalsContact O-CG 3.31Å; I179-Q183 WeakPolarHBondContact O-CG 3.5Å; I179-Q183 PolarHBondContact O-N 3.34Å; Q183-S187 VanDerWaalsContact O-CB 3.24Å; Q183-S187 WeakPolarHBondContact O-CB 3.41Å; Q183-S187 PolarHBondContact O-N 3Å; Q183-S187 PolarHBondContact O-OG 3.06Å
184	V	73.1	Confident	65.4	Low	99 Å²	99	79.8 Å²	79.8	60%	0.6	51%	0.507	S	S	*	.	H	α-helix	trans	-72	-36	174.9	170.1	0	0	0	0	111.9	R180 E181 V182 Q188	R180-V184 WeakPolarHBondContact O-CG2 3.47Å; R180-V184 PolarHBondContact O-N 2.98Å; E181-V184 PolarHBondContact O-N 2.91Å; V182-V184 VanDerWaalsContact C-N 3.27Å; V182-V184 PolarHBondContact O-N 2.81Å; V184-Q188 WeakPolarHBondContact O-CB 3.3Å; V184-Q188 PolarHBondContact O-N 3.42Å
185	L	67.9	Low	63.1	Low	99 Å²	99	85.9 Å²	85.9	52%	0.518	53%	0.528	S	S	.	.	H	α-helix	trans	-64.4	-49.1	173.3	-73.9	160.9	0	0	0	111.1	E181 V182 Q188 G189	E181-L185 WeakPolarHBondContact O-CD1 3.37Å; E181-L185 WeakPolarHBondContact O-CG 3.28Å; E181-L185 PolarHBondContact O-N 2.91Å; E181-L185 VanDerWaalsContact O-N 3.1Å; V182-L185 WeakPolarHBondContact O-CB 3.34Å; V182-L185 PolarHBondContact O-N 3.29Å; L185-Q188 PolarHBondContact O-N 3.17Å; L185-G189 PolarHBondContact O-N 2.65Å
186	D	63.4	Low	60.2	Low	111 Å²	111	88.9 Å²	88.9	59%	0.594	56%	0.562	S	S	*	*	H	α-helix	trans	-63.3	-43.5	-179.9	-61.3	-20.5	0	0	0	111.4	V182 Q188 G189	V182-D186 WeakPolarHBondContact CG1-OD2 3.45Å; V182-D186 VanDerWaalsContact O-CG 3.3Å; V182-D186 PolarHBondContact O-N 2.84Å; D186-Q188 PolarHBondContact O-N 3.23Å; D186-G189 PolarHBondContact O-N 3.04Å; D186-G189 VanDerWaalsContact O-N 3.17Å
187	S	51.8	Low	57.3	Low	99 Å²	99	91.3 Å²	91.3	69%	0.692	60%	0.596	S	S	*	*	H	α-helix	trans	-64.2	-24.3	178.3	-58.8	0	0	0	0	113.4	Q183	Q183-S187 VanDerWaalsContact O-CB 3.24Å; Q183-S187 WeakPolarHBondContact O-CB 3.41Å; Q183-S187 PolarHBondContact O-N 3Å; Q183-S187 PolarHBondContact O-OG 3.06Å
188	Q	49.3	Very low	54.3	Low	154 Å²	154	91.7 Å²	91.7	72%	0.72	62%	0.621	S	S	*	*	H	α-helix	trans	-89.5	-11.4	179.3	-156.3	71.8	87.3	0	0	113.1	V184 L185 D186	V184-Q188 WeakPolarHBondContact O-CB 3.3Å; V184-Q188 PolarHBondContact O-N 3.42Å; L185-Q188 PolarHBondContact O-N 3.17Å; D186-Q188 PolarHBondContact O-N 3.23Å
189	G	42.8	Very low	51.8	Low	61 Å²	61	97.5 Å²	97.5	63%	0.629	66%	0.662	S	S	*	*	S	Bend	trans	-97.6	3.5	175.8	0	0	0	0	0	114.8	L185 D186 S191	L185-G189 PolarHBondContact O-N 2.65Å; D186-G189 PolarHBondContact O-N 3.04Å; D186-G189 VanDerWaalsContact O-N 3.17Å; G189-S191 VanDerWaalsContact C-N 3.29Å; G189-S191 PolarHBondContact O-N 3.4Å
190	G	35.8	Very low	49	Very low	72 Å²	72	98.5 Å²	98.5	74%	0.742	69%	0.685	S	S	*	*			trans	-75.6	51.1	-167.2	0	0	0	0	0	117.3
191	S	35.3	Very low	47	Very low	116 Å²	116	99.3 Å²	99.3	81%	0.811	70%	0.7	S	S	*	*	S	Bend	trans	-154.1	79.2	172	65.4	0	0	0	0	114.7	G189	G189-S191 VanDerWaalsContact C-N 3.29Å; G189-S191 PolarHBondContact O-N 3.4Å
192	G	30.8	Very low	44.9	Very low	74 Å²	74	101.3 Å²	101.3	76%	0.763	72%	0.724	S	S	*	*	S	Bend	trans	127.7	135	157.4	0	0	0	0	0	116.8
193	A	31.9	Very low	43.1	Very low	114 Å²	114	104.7 Å²	104.7	94%	0.942	74%	0.737	S	S	*	*			trans	72.3	132.6	172.4	0	0	0	0	0	118.4
194	A	37.8	Very low	41.6	Very low	90 Å²	90	103.5 Å²	103.5	74%	0.744	74%	0.741	S	S	*	*			trans	-138.2	170.6	171.2	0	0	0	0	0	108.7
195	E	37.8	Very low	40.3	Very low	194 Å²	194	101.5 Å²	101.5	91%	0.907	74%	0.74	S	S	*	*			trans	64.3	114.5	177.2	-59	-64	88.4	0	0	116.4
196	G	29.4	Very low	39.4	Very low	83 Å²	83	100.7 Å²	100.7	86%	0.856	73%	0.733	S	S	*	*			trans	168.8	48.8	-179	0	0	0	0	0	114.4	G198	G196-G198 PolarHBondContact O-N 3.46Å
197	G	30.9	Very low	39.1	Very low	90 Å²	90	98.1 Å²	98.1	93%	0.928	73%	0.728	S	S	*	*			trans	-73.6	123.2	-173.4	0	0	0	0	0	114.6
198	G	26.9	Very low	39.4	Very low	78 Å²	78	94.9 Å²	94.9	80%	0.804	71%	0.707	S	S	*	*			trans	-149.4	118	170.8	0	0	0	0	0	111.5	G196	G196-G198 PolarHBondContact O-N 3.46Å
199	S	35.9	Very low	40.2	Very low	131 Å²	131	88.1 Å²	88.1	92%	0.916	68%	0.677	S	S	*	*			trans	-90	132.4	-170	55.1	0	0	0	0	114.1
200	G	27.6	Very low	41.8	Very low	72 Å²	72	87.5 Å²	87.5	74%	0.742	66%	0.661	S	S	*	*			trans	-164.5	108.4	169.7	0	0	0	0	0	113.1	A202	G200-A202 PolarHBondContact O-N 2.83Å
201	D	42	Very low	43.7	Very low	157 Å²	157	86.5 Å²	86.5	84%	0.84	65%	0.646	S	S	*	*			trans	-73.8	115.4	-179.5	-99.8	-55.4	0	0	0	112.7
202	A	37.7	Very low	45.7	Very low	86 Å²	86	82.7 Å²	82.7	71%	0.711	62%	0.616	S	S	*	*			trans	-169.7	-16.2	159.6	0	0	0	0	0	116.7	G200	G200-A202 PolarHBondContact O-N 2.83Å
203	Q	38.8	Very low	48.2	Very low	112 Å²	112	79.4 Å²	79.4	52%	0.523	58%	0.581	S	S	.	*			trans	-120	14.2	-145.4	-83.5	174.5	-14.8	0	0	119.8	G205 Q206 A207	Q203-G205 PolarHBondContact O-N 3.2Å; Q203-Q206 HydrophobicContact CG-CB 4.47Å; Q203-Q206 PolarHBondContact O-N 3.06Å; Q203-A207 PolarHBondContact O-N 3.03Å
204	S	45.9	Very low	50.7	Low	82 Å²	82	79.2 Å²	79.2	57%	0.573	56%	0.56	S	S	*	*	H	α-helix	trans	-54.4	-28.9	-177.3	-176.4	0	0	0	0	115.2	S174	S174-S204 PolarHBondContact OG-OG 2.9Å
205	G	47	Very low	52.8	Low	57 Å²	57	80 Å²	80	59%	0.588	55%	0.547	S	S	*	.	H	α-helix	trans	-79.4	-39.8	174.3	0	0	0	0	0	114.4	Q203 S209	Q203-G205 PolarHBondContact O-N 3.2Å; G205-S209 PolarHBondContact O-OG 3.13Å
206	Q	49.3	Very low	55	Low	81 Å²	81	71.4 Å²	71.4	38%	0.379	51%	0.507	S	S	.	.	H	α-helix	trans	-78.2	-42.1	-176.1	-78.5	165.3	-107.3	0	0	112.2	Q203 A208 S209 T210 P326	Q203-Q206 HydrophobicContact CG-CB 4.47Å; Q203-Q206 PolarHBondContact O-N 3.06Å; Q206-A208 PolarHBondContact O-N 2.67Å; Q206-S209 WeakPolarHBondContact CA-OG 3.39Å; Q206-S209 PolarHBondContact O-N 2.74Å; Q206-S209 PolarHBondContact O-OG 3.02Å; Q206-T210 PolarHBondContact O-N 3.11Å; Q206-T210 PolarHBondContact O-OG1 2.82Å; Q206-T210 VanDerWaalsContact O-OG1 3.04Å; Q206-P326 HydrophobicContact CB-CB 4.14Å; Q206-P326 HydrophobicContact CG-CB 3.8Å; Q206-P326 HydrophobicContact CG-CG 4.22Å
207	A	57.1	Low	57.7	Low	57 Å²	57	69.1 Å²	69.1	47%	0.471	48%	0.475	S	S	.	.	H	α-helix	trans	-56	-40.2	177.3	0	0	0	0	0	111.8	Q203 S209 T210 A211	Q203-A207 PolarHBondContact O-N 3.03Å; A207-S209 VanDerWaalsContact C-N 3.34Å; A207-S209 PolarHBondContact O-N 2.97Å; A207-T210 PolarHBondContact O-N 2.96Å; A207-A211 WeakPolarHBondContact O-CB 3.42Å; A207-A211 PolarHBondContact O-N 3.02Å
208	A	58.1	Low	60.2	Low	32 Å²	32	69.8 Å²	69.8	26%	0.264	47%	0.466	S	S	.	.	H	α-helix	trans	-77	-13.8	179.5	0	0	0	0	0	114.8	Q206	Q206-A208 PolarHBondContact O-N 2.67Å
209	S	65.2	Low	62.9	Low	12 Å²	12	71 Å²	71	8%	0.084	45%	0.45	C	S	.	.	H	α-helix	trans	-86.6	-38.9	165.4	42	0	0	0	0	111.7	G205 Q206 A207 L212 I213 Y249	G205-S209 PolarHBondContact O-OG 3.13Å; Q206-S209 WeakPolarHBondContact CA-OG 3.39Å; Q206-S209 PolarHBondContact O-N 2.74Å; Q206-S209 PolarHBondContact O-OG 3.02Å; A207-S209 VanDerWaalsContact C-N 3.34Å; A207-S209 PolarHBondContact O-N 2.97Å; S209-L212 PolarHBondContact O-N 2.9Å; S209-I213 WeakPolarHBondContact O-CG1 3.44Å; S209-I213 PolarHBondContact O-N 3.25Å; S209-Y249 PolarHBondContact OG-OH 2.98Å
210	T	76.2	Confident	65.3	Low	48 Å²	48	67.4 Å²	67.4	29%	0.294	42%	0.419	S	S	.	.	H	α-helix	trans	-62.4	-49.2	176.1	-48.6	0	0	0	0	110.8	Q206 A207 L212 I213 E214	Q206-T210 PolarHBondContact O-N 3.11Å; Q206-T210 PolarHBondContact O-OG1 2.82Å; Q206-T210 VanDerWaalsContact O-OG1 3.04Å; A207-T210 PolarHBondContact O-N 2.96Å; T210-L212 PolarHBondContact O-N 3.06Å; T210-I213 CarbonylContact O-C 3.55Å; T210-I213 WeakPolarHBondContact O-CA 2.9Å; T210-I213 WeakPolarHBondContact O-CB 3.41Å; T210-I213 PolarHBondContact O-N 3.34Å; T210-E214 HydrophobicContact CG2-CG 4.43Å; T210-E214 WeakPolarHBondContact CG2-OE1 3.34Å; T210-E214 WeakPolarHBondContact O-CG 3.46Å; T210-E214 PolarHBondContact O-N 3.16Å
211	A	76.2	Confident	68.3	Low	51 Å²	51	68.2 Å²	68.2	42%	0.421	41%	0.411	S	S	.	.	H	α-helix	trans	-61.6	-28.2	177.1	0	0	0	0	0	113.9	A207 E214 K215	A207-A211 WeakPolarHBondContact O-CB 3.42Å; A207-A211 PolarHBondContact O-N 3.02Å; A211-E214 WeakPolarHBondContact CA-OE2 3.31Å; A211-K215 WeakPolarHBondContact O-CB 3.43Å; A211-K215 PolarHBondContact O-N 3.37Å; A211-K215 VanDerWaalsContact O-N 3.08Å
212	L	77.4	Confident	70.6	Confident	36 Å²	36	67 Å²	67	19%	0.188	40%	0.395	C	S	.	.	H	α-helix	trans	-74.1	-38.3	172.6	179.1	59.6	0	0	0	111.6	S209 T210 I216 R246 A250	S209-L212 PolarHBondContact O-N 2.9Å; T210-L212 PolarHBondContact O-N 3.06Å; L212-I216 HydrophobicContact CD1-CD1 4.11Å; L212-I216 HydrophobicContact CD1-CG1 4.49Å; L212-I216 HydrophobicContact CG-CD1 4.03Å; L212-I216 WeakPolarHBondContact O-CD1 3.46Å; L212-I216 VanDerWaalsContact O-CG1 3.24Å; L212-I216 WeakPolarHBondContact O-CG1 3.24Å; L212-I216 PolarHBondContact O-N 2.77Å; L212-R246 HydrophobicContact CD2-CB 3.95Å; L212-A250 HydrophobicContact CD2-CB 4.13Å
213	I	82.2	Confident	73.1	Confident	5 Å²	5	63.1 Å²	63.1	3%	0.026	36%	0.362	C	S	.	.	H	α-helix	trans	-65.3	-48.9	174.5	-70.1	166.1	0	0	0	109.9	S209 T210 K215 I216 L217 Y249 A250 P329 F330	S209-I213 WeakPolarHBondContact O-CG1 3.44Å; S209-I213 PolarHBondContact O-N 3.25Å; T210-I213 CarbonylContact O-C 3.55Å; T210-I213 WeakPolarHBondContact O-CA 2.9Å; T210-I213 WeakPolarHBondContact O-CB 3.41Å; T210-I213 PolarHBondContact O-N 3.34Å; I213-K215 PolarHBondContact O-N 3.44Å; I213-I216 PolarHBondContact O-N 3.16Å; I213-L217 HydrophobicContact CG2-CD1 3.8Å; I213-L217 HydrophobicContact CG2-CG 4.4Å; I213-L217 VanDerWaalsContact O-CG 3.3Å; I213-L217 WeakPolarHBondContact O-CG 3.5Å; I213-L217 PolarHBondContact O-N 3.25Å; I213-Y249 HydrophobicContact CD1-CE2 4.48Å; I213-A250 HydrophobicContact CD1-CB 4.13Å; I213-A250 HydrophobicContact CG1-CB 3.91Å; I213-P329 HydrophobicContact CG2-CG 4.45Å; I213-F330 HydrophobicContact CD1-CD2 4.32Å; I213-F330 HydrophobicContact CG1-CD2 3.98Å; I213-F330 HydrophobicContact CG1-CE2 4.08Å; I213-F330 HydrophobicContact CG2-CE2 4.46Å
214	E	84.6	Confident	75.6	Confident	109 Å²	109	63.3 Å²	63.3	51%	0.509	36%	0.363	S	S	.	.	H	α-helix	trans	-53.9	-49.6	175.1	-71.8	163.4	176	0	0	111.2	T210 A211 I216 L217 S218	T210-E214 HydrophobicContact CG2-CG 4.43Å; T210-E214 WeakPolarHBondContact CG2-OE1 3.34Å; T210-E214 WeakPolarHBondContact O-CG 3.46Å; T210-E214 PolarHBondContact O-N 3.16Å; A211-E214 WeakPolarHBondContact CA-OE2 3.31Å; E214-I216 VanDerWaalsContact C-N 3.32Å; E214-I216 PolarHBondContact O-N 3.03Å; E214-L217 CarbonylContact O-C 3.4Å; E214-L217 WeakPolarHBondContact O-CB 3.44Å; E214-L217 PolarHBondContact O-N 2.92Å; E214-L217 VanDerWaalsContact O-N 3.08Å; E214-S218 PolarHBondContact O-N 3.38Å; E214-S218 PolarHBondContact O-OG 2.89Å
215	K	83	Confident	77.7	Confident	108 Å²	108	63.2 Å²	63.2	47%	0.47	36%	0.356	S	S	.	.	H	α-helix	trans	-60	-38.1	175.2	178.8	162.1	-178.2	157.3	0	113.2	A211 I213 L217 S218 E219	A211-K215 WeakPolarHBondContact O-CB 3.43Å; A211-K215 PolarHBondContact O-N 3.37Å; A211-K215 VanDerWaalsContact O-N 3.08Å; I213-K215 PolarHBondContact O-N 3.44Å; K215-L217 VanDerWaalsContact C-N 3.32Å; K215-S218 PolarHBondContact O-N 3.47Å; K215-E219 WeakPolarHBondContact CE-OE1 3.31Å; K215-E219 HydrophobicContact CG-CG 4.4Å; K215-E219 WeakPolarHBondContact O-CB 3.25Å; K215-E219 VanDerWaalsContact O-CG 3.31Å; K215-E219 WeakPolarHBondContact O-CG 3.4Å; K215-E219 PolarHBondContact O-N 2.81Å
216	I	83.6	Confident	79.7	Confident	12 Å²	12	63.4 Å²	63.4	6%	0.062	34%	0.343	C	S	.	.	H	α-helix	trans	-68.1	-33.6	176.1	-72.2	163.1	0	0	0	111.3	L212 I213 E214 E219 E220 W223 A250 P252 F330	L212-I216 HydrophobicContact CD1-CD1 4.11Å; L212-I216 HydrophobicContact CD1-CG1 4.49Å; L212-I216 HydrophobicContact CG-CD1 4.03Å; L212-I216 WeakPolarHBondContact O-CD1 3.46Å; L212-I216 VanDerWaalsContact O-CG1 3.24Å; L212-I216 WeakPolarHBondContact O-CG1 3.24Å; L212-I216 PolarHBondContact O-N 2.77Å; I213-I216 PolarHBondContact O-N 3.16Å; E214-I216 VanDerWaalsContact C-N 3.32Å; E214-I216 PolarHBondContact O-N 3.03Å; I216-E219 PolarHBondContact O-N 3.44Å; I216-E220 PolarHBondContact O-N 3.43Å; I216-W223 HydrophobicContact CG2-CG 4.18Å; I216-A250 VanDerWaalsContact CD1-O 3.24Å; I216-A250 WeakPolarHBondContact CD1-O 3.32Å; I216-P252 HydrophobicContact CG2-CG 4.28Å; I216-F330 HydrophobicContact CG2-CZ 4.09Å
217	L	85.1	Confident	81.7	Confident	35 Å²	35	64.3 Å²	64.3	18%	0.183	35%	0.351	C	S	.	.	H	α-helix	trans	-73.8	-30.5	175.1	-63.9	166.1	0	0	0	112.2	I213 E214 K215 P221 W223 Q224 P329	I213-L217 HydrophobicContact CG2-CD1 3.8Å; I213-L217 HydrophobicContact CG2-CG 4.4Å; I213-L217 VanDerWaalsContact O-CG 3.3Å; I213-L217 WeakPolarHBondContact O-CG 3.5Å; I213-L217 PolarHBondContact O-N 3.25Å; E214-L217 CarbonylContact O-C 3.4Å; E214-L217 WeakPolarHBondContact O-CB 3.44Å; E214-L217 PolarHBondContact O-N 2.92Å; E214-L217 VanDerWaalsContact O-N 3.08Å; K215-L217 VanDerWaalsContact C-N 3.32Å; L217-P221 VanDerWaalsContact O-CA 3.29Å; L217-P221 WeakPolarHBondContact O-CA 3.45Å; L217-P221 WeakPolarHBondContact O-CG 2.99Å; L217-W223 HydrophobicContact CD2-CB 3.79Å; L217-Q224 HydrophobicContact CD2-CB 3.98Å; L217-P329 HydrophobicContact CD1-CG 4.13Å; L217-P329 HydrophobicContact CD2-CG 4Å
218	S	83.4	Confident	83.3	Confident	104 Å²	104	63.3 Å²	63.3	73%	0.727	34%	0.335	S	S	*	.	H	α-helix	trans	-72.4	-35.8	168.6	-50.6	0	0	0	0	112.9	E214 K215	E214-S218 PolarHBondContact O-N 3.38Å; E214-S218 PolarHBondContact O-OG 2.89Å; K215-S218 PolarHBondContact O-N 3.47Å
219	E	84.3	Confident	85	Confident	103 Å²	103	61.8 Å²	61.8	48%	0.481	32%	0.323	S	S	.	.	H	α-helix	trans	-72.4	-35.2	175.9	-75.8	174.4	-167.7	0	0	112.5	K215 I216 K240	K215-E219 WeakPolarHBondContact CE-OE1 3.31Å; K215-E219 HydrophobicContact CG-CG 4.4Å; K215-E219 WeakPolarHBondContact O-CB 3.25Å; K215-E219 VanDerWaalsContact O-CG 3.31Å; K215-E219 WeakPolarHBondContact O-CG 3.4Å; K215-E219 PolarHBondContact O-N 2.81Å; I216-E219 PolarHBondContact O-N 3.44Å; E219-K240 IonicContact OE1-NZ 3.32Å; E219-K240 PolarHBondContact OE1-NZ 3.23Å; E219-K240 IonicContact OE2-NZ 3.44Å; E219-K240 PolarHBondContact OE2-NZ 2.98Å
220	E	87.6	Confident	86.3	Confident	56 Å²	56	62.7 Å²	62.7	26%	0.262	33%	0.326	S	S	.	.			trans	-153.9	84.9	-172.1	176.1	72.5	-91.7	0	0	110.1	I216 R222 W223	I216-E220 PolarHBondContact O-N 3.43Å; E220-R222 PolarHBondContact O-N 3.09Å; E220-R222 IonicContact OE1-CZ 2.79Å; E220-R222 IonicContact OE1-NE 3.34Å; E220-R222 PolarHBondContact OE1-NE 3.32Å; E220-R222 IonicContact OE1-NH2 2.72Å; E220-R222 PolarHBondContact OE1-NH2 2.72Å; E220-R222 VanDerWaalsContact OE1-NH2 3.12Å; E220-R222 IonicContact OE2-CZ 2.73Å; E220-R222 IonicContact OE2-NE 3.91Å; E220-R222 IonicContact OE2-NH2 3.73Å; E220-R222 PolarHBondContact OE2-NH2 3Å; E220-W223 VanDerWaalsContact CG-CD1 3.41Å; E220-W223 HydrophobicContact CG-CG 4.43Å; E220-W223 PolarHBondContact O-N 2.73Å
221	P	88.9	Confident	86.9	Confident	89 Å²	89	61.5 Å²	61.5	58%	0.578	32%	0.319	S	S	*	.	G	3₁₀ helix	trans	-59.4	-20.4	-173.4	-27.6	35.1	0	0	0	115.4	L217 W223 Q224	L217-P221 VanDerWaalsContact O-CA 3.29Å; L217-P221 WeakPolarHBondContact O-CA 3.45Å; L217-P221 WeakPolarHBondContact O-CG 2.99Å; P221-W223 PolarHBondContact O-N 2.96Å; P221-W223 VanDerWaalsContact O-N 3.12Å; P221-Q224 VanDerWaalsContact O-CB 3.3Å; P221-Q224 WeakPolarHBondContact O-CB 3.39Å; P221-Q224 PolarHBondContact O-N 3Å
222	R	90.5	Very high	87.7	Confident	132 Å²	132	62.1 Å²	62.1	50%	0.498	31%	0.313	S	S	.	.	G	3₁₀ helix	trans	-58.3	-23.7	177.1	-65.8	-175	-66.4	165.2	0.6	113.2	E220 Q224 D225 Y228	E220-R222 PolarHBondContact O-N 3.09Å; E220-R222 IonicContact OE1-CZ 2.79Å; E220-R222 IonicContact OE1-NE 3.34Å; E220-R222 PolarHBondContact OE1-NE 3.32Å; E220-R222 IonicContact OE1-NH2 2.72Å; E220-R222 PolarHBondContact OE1-NH2 2.72Å; E220-R222 VanDerWaalsContact OE1-NH2 3.12Å; E220-R222 IonicContact OE2-CZ 2.73Å; E220-R222 IonicContact OE2-NE 3.91Å; E220-R222 IonicContact OE2-NH2 3.73Å; E220-R222 PolarHBondContact OE2-NH2 3Å; R222-Q224 PolarHBondContact O-N 3.04Å; R222-Q224 VanDerWaalsContact O-N 3.16Å; R222-D225 PolarHBondContact O-N 3.11Å; R222-D225 VanDerWaalsContact O-N 3.11Å; R222-Y228 HydrophobicContact CB-CD1 3.82Å; R222-Y228 HydrophobicContact CB-CD2 4.11Å; R222-Y228 HydrophobicContact CB-CE1 3.97Å; R222-Y228 HydrophobicContact CB-CE2 4.25Å; R222-Y228 HydrophobicContact CB-CG 3.91Å; R222-Y228 WeakPolarHBondContact O-CB 3.42Å; R222-Y228 WeakPolarHBondContact O-CD1 3.2Å
223	W	91.1	Very high	88.5	Confident	4 Å²	4	60.8 Å²	60.8	2%	0.015	31%	0.305	C	S	.	.	G	3₁₀ helix	trans	-67.1	-7.7	173.7	-70.3	117.4	0	0	0	114.7	I216 L217 E220 P221 Y228 V229 H232 P252 Y253 P329 F330	I216-W223 HydrophobicContact CG2-CG 4.18Å; L217-W223 HydrophobicContact CD2-CB 3.79Å; E220-W223 VanDerWaalsContact CG-CD1 3.41Å; E220-W223 HydrophobicContact CG-CG 4.43Å; E220-W223 PolarHBondContact O-N 2.73Å; P221-W223 PolarHBondContact O-N 2.96Å; P221-W223 VanDerWaalsContact O-N 3.12Å; W223-Y228 HydrophobicContact CD2-CD1 4.1Å; W223-Y228 AromaticContact CD2-CE1 3.8Å; W223-Y228 HydrophobicContact CD2-CE1 3.8Å; W223-Y228 AromaticContact CE2-CE1 3.85Å; W223-Y228 AromaticContact CE3-CD1 3.78Å; W223-Y228 HydrophobicContact CE3-CD1 3.78Å; W223-Y228 AromaticContact CE3-CE1 3.78Å; W223-Y228 HydrophobicContact CE3-CE1 3.78Å; W223-Y228 HydrophobicContact CG-CE1 4.49Å; W223-Y228 AromaticContact CH2-CE1 3.92Å; W223-Y228 HydrophobicContact CH2-CE1 3.92Å; W223-Y228 AromaticContact CZ2-CE1 3.92Å; W223-Y228 HydrophobicContact CZ2-CE1 3.92Å; W223-Y228 HydrophobicContact CZ3-CD1 4.04Å; W223-Y228 AromaticContact CZ3-CE1 3.84Å; W223-Y228 HydrophobicContact CZ3-CE1 3.84Å; W223-V229 HydrophobicContact CE3-CG2 4.04Å; W223-V229 VanDerWaalsContact O-CG2 3.24Å; W223-V229 WeakPolarHBondContact O-CG2 3.45Å; W223-H232 HydrophobicContact CH2-CB 3.5Å; W223-H232 HydrophobicContact CZ2-CB 4.49Å; W223-H232 HydrophobicContact CZ3-CB 3.83Å; W223-P252 HydrophobicContact CD2-CB 3.9Å; W223-P252 HydrophobicContact CD2-CG 4.05Å; W223-P252 HydrophobicContact CE3-CB 3.85Å; W223-P252 HydrophobicContact CH2-CB 3.58Å; W223-P252 HydrophobicContact CH2-CG 4.24Å; W223-P252 HydrophobicContact CZ2-CB 3.62Å; W223-P252 HydrophobicContact CZ2-CG 3.75Å; W223-P252 HydrophobicContact CZ3-CB 3.69Å; W223-Y253 HydrophobicContact CZ2-CE1 4.46Å; W223-P329 WeakPolarHBondContact O-CB 3.37Å; W223-P329 WeakPolarHBondContact O-CG 3.27Å; W223-F330 HydrophobicContact CB-CE1 3.86Å; W223-F330 HydrophobicContact CB-CZ 3.96Å; W223-F330 HydrophobicContact CD2-CE1 4.02Å; W223-F330 HydrophobicContact CD2-CZ 4.31Å; W223-F330 AromaticContact CE3-CE1 3.79Å; W223-F330 HydrophobicContact CE3-CE1 3.79Å; W223-F330 HydrophobicContact CE3-CZ 4.5Å; W223-F330 HydrophobicContact CG-CE1 4.08Å; W223-F330 HydrophobicContact CG-CZ 4.09Å
224	Q	90.1	Very high	89	Confident	117 Å²	117	60.6 Å²	60.6	55%	0.547	31%	0.305	S	S	.	.	G	3₁₀ helix	trans	-76.8	-27.5	170.5	-169	60.7	14.9	0	0	112.4	L217 P221 R222	L217-Q224 HydrophobicContact CD2-CB 3.98Å; P221-Q224 VanDerWaalsContact O-CB 3.3Å; P221-Q224 WeakPolarHBondContact O-CB 3.39Å; P221-Q224 PolarHBondContact O-N 3Å; R222-Q224 PolarHBondContact O-N 3.04Å; R222-Q224 VanDerWaalsContact O-N 3.16Å
225	D	90	Very high	89.5	Confident	80 Å²	80	56.7 Å²	56.7	43%	0.428	29%	0.288	S	S	.	.	S	Bend	trans	-75.9	127.8	178.8	167.4	36.3	0	0	0	111.6	R222 N227 Y228 V229	R222-D225 PolarHBondContact O-N 3.11Å; R222-D225 VanDerWaalsContact O-N 3.11Å; D225-N227 VanDerWaalsContact C-N 3.29Å; D225-N227 PolarHBondContact O-N 3.2Å; D225-N227 PolarHBondContact OD1-N 3.08Å; D225-N227 WeakPolarHBondContact OD2-CB 3.42Å; D225-N227 PolarHBondContact OD2-N 3.01Å; D225-Y228 PolarHBondContact O-N 2.95Å; D225-Y228 WeakPolarHBondContact OD2-CB 3.42Å; D225-Y228 PolarHBondContact OD2-N 2.85Å; D225-V229 WeakPolarHBondContact O-CB 3.24Å; D225-V229 VanDerWaalsContact O-CG2 3.22Å; D225-V229 WeakPolarHBondContact O-CG2 3.39Å; D225-V229 PolarHBondContact O-N 3.49Å
226	N	90.4	Very high	89.9	Confident	60 Å²	60	56 Å²	56	32%	0.321	29%	0.287	S	S	.	.	H	α-helix	trans	-62.5	-32.8	177.2	-64	-79.5	0	0	0	112.3	L230 Y311 K312	N226-L230 VanDerWaalsContact O-CB 3.31Å; N226-L230 WeakPolarHBondContact O-CB 3.45Å; N226-L230 PolarHBondContact O-N 3.34Å; N226-Y311 HydrophobicContact CB-CE1 4.11Å; N226-Y311 VanDerWaalsContact O-CE1 3.31Å; N226-Y311 WeakPolarHBondContact O-CE1 3.47Å; N226-K312 WeakPolarHBondContact OD1-CE 3.44Å; N226-K312 PolarHBondContact OD1-NZ 3.07Å
227	N	90	Very high	90.3	Very high	101 Å²	101	60.1 Å²	60.1	54%	0.54	31%	0.308	S	S	.	.	H	α-helix	trans	-75.5	-42.9	179.8	-165.2	-3.8	0	0	0	111.6	D225 V229 L230 T231	D225-N227 VanDerWaalsContact C-N 3.29Å; D225-N227 PolarHBondContact O-N 3.2Å; D225-N227 PolarHBondContact OD1-N 3.08Å; D225-N227 WeakPolarHBondContact OD2-CB 3.42Å; D225-N227 PolarHBondContact OD2-N 3.01Å; N227-V229 PolarHBondContact O-N 3.19Å; N227-L230 PolarHBondContact O-N 3.07Å; N227-T231 WeakPolarHBondContact O-CB 3.09Å; N227-T231 PolarHBondContact O-N 3.36Å; N227-T231 PolarHBondContact O-OG1 3.4Å
228	Y	92.1	Very high	90.5	Very high	36 Å²	36	59.3 Å²	59.3	14%	0.141	31%	0.305	C	S	.	.	H	α-helix	trans	-59.9	-44.3	170.8	-170.9	-93.6	0	0	0	112	R222 W223 D225 T231 H232	R222-Y228 HydrophobicContact CB-CD1 3.82Å; R222-Y228 HydrophobicContact CB-CD2 4.11Å; R222-Y228 HydrophobicContact CB-CE1 3.97Å; R222-Y228 HydrophobicContact CB-CE2 4.25Å; R222-Y228 HydrophobicContact CB-CG 3.91Å; R222-Y228 WeakPolarHBondContact O-CB 3.42Å; R222-Y228 WeakPolarHBondContact O-CD1 3.2Å; W223-Y228 HydrophobicContact CD2-CD1 4.1Å; W223-Y228 AromaticContact CD2-CE1 3.8Å; W223-Y228 HydrophobicContact CD2-CE1 3.8Å; W223-Y228 AromaticContact CE2-CE1 3.85Å; W223-Y228 AromaticContact CE3-CD1 3.78Å; W223-Y228 HydrophobicContact CE3-CD1 3.78Å; W223-Y228 AromaticContact CE3-CE1 3.78Å; W223-Y228 HydrophobicContact CE3-CE1 3.78Å; W223-Y228 HydrophobicContact CG-CE1 4.49Å; W223-Y228 AromaticContact CH2-CE1 3.92Å; W223-Y228 HydrophobicContact CH2-CE1 3.92Å; W223-Y228 AromaticContact CZ2-CE1 3.92Å; W223-Y228 HydrophobicContact CZ2-CE1 3.92Å; W223-Y228 HydrophobicContact CZ3-CD1 4.04Å; W223-Y228 AromaticContact CZ3-CE1 3.84Å; W223-Y228 HydrophobicContact CZ3-CE1 3.84Å; D225-Y228 PolarHBondContact O-N 2.95Å; D225-Y228 WeakPolarHBondContact OD2-CB 3.42Å; D225-Y228 PolarHBondContact OD2-N 2.85Å; Y228-T231 PolarHBondContact O-N 3.14Å; Y228-H232 AromaticContact CD2-CE1 3.51Å; Y228-H232 AromaticContact CD2-ND1 3.31Å; Y228-H232 VanDerWaalsContact CD2-ND1 3.31Å; Y228-H232 WeakPolarHBondContact CD2-ND1 3.49Å; Y228-H232 HydrophobicContact CE1-CB 4.16Å; Y228-H232 AromaticContact CE1-ND1 3.91Å; Y228-H232 AromaticContact CE2-CE1 3.24Å; Y228-H232 WeakPolarHBondContact CE2-CE1 3.31Å; Y228-H232 AromaticContact CE2-CG 3.9Å; Y228-H232 AromaticContact CE2-ND1 3.18Å; Y228-H232 WeakPolarHBondContact CE2-ND1 3.31Å; Y228-H232 AromaticContact CE2-NE2 3.96Å; Y228-H232 AromaticContact CG-ND1 3.72Å; Y228-H232 AromaticContact CZ-CE1 3.89Å; Y228-H232 AromaticContact CZ-CG 3.75Å; Y228-H232 AromaticContact CZ-ND1 3.48Å; Y228-H232 PolarHBondContact O-N 3.38Å; Y228-H232 PolarHBondContact O-ND1 2.95Å; Y228-H232 VanDerWaalsContact O-ND1 3.08Å
229	V	93.1	Very high	90.7	Very high	0 Å²	0	62.5 Å²	62.5	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-59	-49.8	172.1	170.4	0	0	0	0	110.7	W223 D225 N227 T231 H232 Y233 F306 Y311 F330	W223-V229 HydrophobicContact CE3-CG2 4.04Å; W223-V229 VanDerWaalsContact O-CG2 3.24Å; W223-V229 WeakPolarHBondContact O-CG2 3.45Å; D225-V229 WeakPolarHBondContact O-CB 3.24Å; D225-V229 VanDerWaalsContact O-CG2 3.22Å; D225-V229 WeakPolarHBondContact O-CG2 3.39Å; D225-V229 PolarHBondContact O-N 3.49Å; N227-V229 PolarHBondContact O-N 3.19Å; V229-T231 PolarHBondContact O-N 3.31Å; V229-H232 PolarHBondContact O-N 3.43Å; V229-Y233 HydrophobicContact CG1-CG 4.37Å; V229-Y233 WeakPolarHBondContact O-CB 3.45Å; V229-Y233 PolarHBondContact O-N 3.28Å; V229-F306 HydrophobicContact CG1-CD1 4.32Å; V229-F306 HydrophobicContact CG1-CE1 4Å; V229-Y311 HydrophobicContact CG1-CE2 4.23Å; V229-Y311 WeakPolarHBondContact CG1-OH 3.27Å; V229-F330 HydrophobicContact CG1-CD1 4.42Å; V229-F330 HydrophobicContact CG2-CD1 4.16Å; V229-F330 HydrophobicContact CG2-CE1 4.22Å
230	L	91.6	Very high	90.5	Very high	30 Å²	30	61.2 Å²	61.2	16%	0.157	30%	0.299	C	S	.	.	H	α-helix	trans	-57.7	-34.8	176.7	-178.4	61.3	0	0	0	111.8	N226 N227 R261 F306 P308 Y311	N226-L230 VanDerWaalsContact O-CB 3.31Å; N226-L230 WeakPolarHBondContact O-CB 3.45Å; N226-L230 PolarHBondContact O-N 3.34Å; N227-L230 PolarHBondContact O-N 3.07Å; L230-R261 PolarHBondContact O-NH1 3.49Å; L230-R261 PolarHBondContact O-NH2 2.92Å; L230-F306 WeakPolarHBondContact CD1-O 3.13Å; L230-P308 HydrophobicContact CD1-CG 4.36Å; L230-P308 HydrophobicContact CD2-CB 4.37Å; L230-P308 HydrophobicContact CD2-CG 4.47Å; L230-Y311 HydrophobicContact CB-CD1 4.02Å; L230-Y311 HydrophobicContact CB-CE1 4Å; L230-Y311 HydrophobicContact CD1-CD1 3.91Å; L230-Y311 HydrophobicContact CD1-CG 3.96Å; L230-Y311 HydrophobicContact CD2-CD1 4.29Å; L230-Y311 HydrophobicContact CG-CD1 4.29Å
231	T	90.2	Very high	89.7	Confident	23 Å²	23	61.6 Å²	61.6	14%	0.141	31%	0.306	C	S	.	.	H	α-helix	trans	-78.6	-42.5	-178.4	-62	0	0	0	0	113.5	N227 Y228 V229 S263 H265	N227-T231 WeakPolarHBondContact O-CB 3.09Å; N227-T231 PolarHBondContact O-N 3.36Å; N227-T231 PolarHBondContact O-OG1 3.4Å; Y228-T231 PolarHBondContact O-N 3.14Å; V229-T231 PolarHBondContact O-N 3.31Å; T231-S263 PolarHBondContact O-OG 3.25Å; T231-H265 PolarHBondContact OG1-CE1 3.41Å
232	H	91.5	Very high	88.3	Confident	65 Å²	65	61.4 Å²	61.4	30%	0.301	31%	0.305	S	S	.	.	H	α-helix	trans	-112.8	-15.2	-165.9	-57.9	92.8	0	0	0	115.1	W223 Y228 V229 K234 T235	W223-H232 HydrophobicContact CH2-CB 3.5Å; W223-H232 HydrophobicContact CZ2-CB 4.49Å; W223-H232 HydrophobicContact CZ3-CB 3.83Å; Y228-H232 AromaticContact CD2-CE1 3.51Å; Y228-H232 AromaticContact CD2-ND1 3.31Å; Y228-H232 VanDerWaalsContact CD2-ND1 3.31Å; Y228-H232 WeakPolarHBondContact CD2-ND1 3.49Å; Y228-H232 HydrophobicContact CE1-CB 4.16Å; Y228-H232 AromaticContact CE1-ND1 3.91Å; Y228-H232 AromaticContact CE2-CE1 3.24Å; Y228-H232 WeakPolarHBondContact CE2-CE1 3.31Å; Y228-H232 AromaticContact CE2-CG 3.9Å; Y228-H232 AromaticContact CE2-ND1 3.18Å; Y228-H232 WeakPolarHBondContact CE2-ND1 3.31Å; Y228-H232 AromaticContact CE2-NE2 3.96Å; Y228-H232 AromaticContact CG-ND1 3.72Å; Y228-H232 AromaticContact CZ-CE1 3.89Å; Y228-H232 AromaticContact CZ-CG 3.75Å; Y228-H232 AromaticContact CZ-ND1 3.48Å; Y228-H232 PolarHBondContact O-N 3.38Å; Y228-H232 PolarHBondContact O-ND1 2.95Å; Y228-H232 VanDerWaalsContact O-ND1 3.08Å; V229-H232 PolarHBondContact O-N 3.43Å; H232-K234 PolarHBondContact O-N 2.82Å; H232-K234 VanDerWaalsContact O-N 3.12Å; H232-T235 PolarHBondContact O-N 3.48Å; H232-T235 PolarHBondContact O-OG1 2.75Å
233	Y	94.5	Very high	86.7	Confident	7 Å²	7	57.2 Å²	57.2	3%	0.027	29%	0.289	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.6	120.6	-176.2	-176	-98.6	0	0	0	111.5	V229 T235 Y249 P252 R261 T302 F306 F330	V229-Y233 HydrophobicContact CG1-CG 4.37Å; V229-Y233 WeakPolarHBondContact O-CB 3.45Å; V229-Y233 PolarHBondContact O-N 3.28Å; Y233-T235 VanDerWaalsContact C-N 3.26Å; Y233-T235 PolarHBondContact O-N 2.84Å; Y233-Y249 WeakPolarHBondContact OH-CA 3.37Å; Y233-Y249 PolarHBondContact OH-O 3.16Å; Y233-P252 HydrophobicContact CD2-CB 3.92Å; Y233-P252 HydrophobicContact CE2-CB 4.38Å; Y233-R261 WeakPolarHBondContact O-CD 3.39Å; Y233-R261 PolarHBondContact O-NH1 2.79Å; Y233-R261 VanDerWaalsContact O-NH1 3.09Å; Y233-T302 HydrophobicContact CD1-CG2 4.27Å; Y233-T302 HydrophobicContact CE1-CG2 4.07Å; Y233-F306 AromaticContact CD1-CD1 3.63Å; Y233-F306 HydrophobicContact CD1-CD1 3.63Å; Y233-F306 AromaticContact CD1-CD2 3.9Å; Y233-F306 HydrophobicContact CD1-CD2 3.9Å; Y233-F306 AromaticContact CD1-CE1 3.46Å; Y233-F306 HydrophobicContact CD1-CE1 3.46Å; Y233-F306 VanDerWaalsContact CD1-CE1 3.46Å; Y233-F306 AromaticContact CD1-CE2 3.78Å; Y233-F306 HydrophobicContact CD1-CE2 3.78Å; Y233-F306 AromaticContact CD1-CG 3.85Å; Y233-F306 HydrophobicContact CD1-CG 3.85Å; Y233-F306 AromaticContact CD1-CZ 3.55Å; Y233-F306 HydrophobicContact CD1-CZ 3.55Å; Y233-F306 HydrophobicContact CE1-CD1 4.17Å; Y233-F306 AromaticContact CE1-CD2 3.85Å; Y233-F306 HydrophobicContact CE1-CD2 3.85Å; Y233-F306 AromaticContact CE1-CE1 3.65Å; Y233-F306 HydrophobicContact CE1-CE1 3.65Å; Y233-F306 AromaticContact CE1-CE2 3.31Å; Y233-F306 HydrophobicContact CE1-CE2 3.31Å; Y233-F306 HydrophobicContact CE1-CG 4.26Å; Y233-F306 AromaticContact CE1-CZ 3.19Å; Y233-F306 HydrophobicContact CE1-CZ 3.19Å; Y233-F306 HydrophobicContact CG-CD1 4.21Å; Y233-F306 AromaticContact CG-CE1 3.95Å; Y233-F306 HydrophobicContact CG-CE1 3.95Å; Y233-F306 HydrophobicContact CG-CZ 4.34Å; Y233-F306 AromaticContact CZ-CZ 3.76Å; Y233-F330 HydrophobicContact CD2-CB 4.43Å; Y233-F330 AromaticContact CD2-CD1 3.78Å; Y233-F330 HydrophobicContact CD2-CD1 3.78Å; Y233-F330 HydrophobicContact CD2-CE1 4.33Å; Y233-F330 HydrophobicContact CD2-CG 4.18Å; Y233-F330 HydrophobicContact CE2-CB 3.74Å; Y233-F330 AromaticContact CE2-CD1 3.83Å; Y233-F330 HydrophobicContact CE2-CD1 3.83Å; Y233-F330 HydrophobicContact CE2-CD2 4.39Å; Y233-F330 AromaticContact CE2-CG 3.73Å; Y233-F330 HydrophobicContact CE2-CG 3.73Å
234	K	94.1	Very high	85.5	Confident	2 Å²	2	62.8 Å²	62.8	1%	0.009	32%	0.319	C	S	.	.	T	Hydrogen-bonded Turn	trans	58	27.4	179.8	-67.4	179.5	175.1	-73.2	0	115.3	H232 G248 C251 P252 Y253 Y254 D259 R261 T302	H232-K234 PolarHBondContact O-N 2.82Å; H232-K234 VanDerWaalsContact O-N 3.12Å; K234-G248 WeakPolarHBondContact CE-O 3.47Å; K234-G248 PolarHBondContact NZ-O 3.14Å; K234-C251 WeakPolarHBondContact CE-O 3.28Å; K234-C251 PolarHBondContact NZ-O 3.04Å; K234-C251 VanDerWaalsContact NZ-O 3.16Å; K234-P252 WeakPolarHBondContact CA-O 3.32Å; K234-P252 PolarHBondContact N-O 2.88Å; K234-Y253 PolarHBondContact NZ-O 3.15Å; K234-Y254 WeakPolarHBondContact O-CD1 3.42Å; K234-D259 WeakPolarHBondContact CD-OD1 3.5Å; K234-D259 VanDerWaalsContact CE-OD1 3.27Å; K234-D259 WeakPolarHBondContact CE-OD1 3.16Å; K234-D259 IonicContact NZ-OD1 3.96Å; K234-D259 PolarHBondContact NZ-OD1 2.8Å; K234-D259 IonicContact NZ-OD2 3.69Å; K234-D259 PolarHBondContact NZ-OD2 3.24Å; K234-D259 VanDerWaalsContact NZ-OD2 3.15Å; K234-R261 HydrophobicContact CB-CB 4.24Å; K234-R261 PolarHBondContact O-N 2.78Å; K234-T302 HydrophobicContact CB-CG2 3.89Å; K234-T302 HydrophobicContact CD-CG2 3.66Å; K234-T302 HydrophobicContact CG-CG2 4.33Å
235	T	93.8	Very high	84.9	Confident	27 Å²	27	57.8 Å²	57.8	17%	0.166	30%	0.296	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.8	-23.2	175	66.1	0	0	0	0	114	H232 Y233 Y254 R261	H232-T235 PolarHBondContact O-N 3.48Å; H232-T235 PolarHBondContact O-OG1 2.75Å; Y233-T235 VanDerWaalsContact C-N 3.26Å; Y233-T235 PolarHBondContact O-N 2.84Å; T235-Y254 WeakPolarHBondContact O-CE1 3.48Å; T235-R261 VanDerWaalsContact CA-O 3.31Å; T235-R261 WeakPolarHBondContact CA-O 3.3Å; T235-R261 HydrophobicContact CG2-CG 4.49Å
236	E	92.9	Very high	83.8	Confident	93 Å²	93	58.3 Å²	58.3	44%	0.435	29%	0.292	S	S	.	.	S	Bend	trans	-112.7	150.7	175.8	-70.9	-167.4	-167.9	0	0	113.1	K239 Y253 Y254	E236-K239 IonicContact OE2-NZ 2.67Å; E236-K239 PolarHBondContact OE2-NZ 3.12Å; E236-Y253 HydrophobicContact CB-CD1 3.98Å; E236-Y253 HydrophobicContact CB-CE1 4.36Å; E236-Y253 WeakPolarHBondContact O-CA 3.33Å; E236-Y253 WeakPolarHBondContact O-CB 3.37Å; E236-Y254 WeakPolarHBondContact O-CD1 3.39Å; E236-Y254 PolarHBondContact O-N 3.42Å
237	L	90.8	Very high	82.9	Confident	99 Å²	99	60.4 Å²	60.4	52%	0.518	30%	0.3	S	S	.	.	B	Isolated β-bridge	trans	-69.9	137.1	176.4	-179.3	69.3	0	0	0	110.7	K239 Y254	L237-K239 PolarHBondContact O-N 2.83Å; L237-K239 VanDerWaalsContact O-N 3.16Å; L237-Y254 HydrophobicContact CB-CE1 4.3Å; L237-Y254 HydrophobicContact CB-CE2 4.06Å; L237-Y254 HydrophobicContact CD1-CD2 3.95Å; L237-Y254 HydrophobicContact CD1-CE2 3.65Å; L237-Y254 HydrophobicContact CG-CE2 4.46Å; L237-Y254 VanDerWaalsContact N-CE1 3.32Å
238	C	90.5	Very high	82.4	Confident	18 Å²	18	57.1 Å²	57.1	12%	0.122	29%	0.29	C	S	.	.			trans	-66.4	116.1	-179.1	-164	0	0	0	0	112.2	C245 C251 Y253 Y254 H255	C238-C245 VanDerWaalsContact SG-SG 3.61Å; C238-C251 VanDerWaalsContact SG-SG 3.63Å; C238-Y253 VanDerWaalsContact CA-CB 3.48Å; C238-Y254 PolarHBondContact N-O 3.3Å; C238-H255 VanDerWaalsContact CB-NE2 3.34Å; C238-H255 WeakPolarHBondContact CB-NE2 3.45Å
239	K	86.8	Confident	82	Confident	170 Å²	170	59.4 Å²	59.4	74%	0.739	30%	0.299	S	S	*	.			trans	-76.8	-21.7	176.1	-60.9	168.3	-169.7	158.2	0	112.4	E236 L237	E236-K239 IonicContact OE2-NZ 2.67Å; E236-K239 PolarHBondContact OE2-NZ 3.12Å; L237-K239 PolarHBondContact O-N 2.83Å; L237-K239 VanDerWaalsContact O-N 3.16Å
240	K	80.7	Confident	81.7	Confident	77 Å²	77	59.7 Å²	59.7	34%	0.335	30%	0.301	S	S	.	.	S	Bend	trans	-72.4	125.3	174.2	-64	-173.5	-178.9	-175.8	0	108.5	E219 C245	E219-K240 IonicContact OE1-NZ 3.32Å; E219-K240 PolarHBondContact OE1-NZ 3.23Å; E219-K240 IonicContact OE2-NZ 3.44Å; E219-K240 PolarHBondContact OE2-NZ 2.98Å; K240-C245 HydrophobicContact CB-CB 4.09Å
241	P	69.9	Low	81.6	Confident	64 Å²	64	58.5 Å²	58.5	42%	0.416	30%	0.295	S	S	.	.			trans	-63.5	152.6	-171.3	25	-34.8	0	0	0	111.6	R243 L244 C245	P241-R243 PolarHBondContact O-N 2.93Å; P241-L244 HydrophobicContact CG-CB 4.44Å; P241-L244 HydrophobicContact CG-CD1 3.97Å; P241-L244 HydrophobicContact CG-CG 4.25Å; P241-L244 PolarHBondContact O-N 2.85Å; P241-C245 PolarHBondContact O-N 3.24Å; P241-C245 VanDerWaalsContact O-N 3.14Å
242	P	59.8	Low	81.7	Confident	84 Å²	84	57.4 Å²	57.4	55%	0.545	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.8	6.8	-178.1	-25.1	35	0	0	0	116.8
243	R	56.6	Low	81.7	Confident	44 Å²	44	57.3 Å²	57.3	17%	0.166	29%	0.286	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88	-42.6	170.6	-48.1	-121.8	-166.3	-142.1	6.1	111	P102 D103 R134 Y140 P241	P102-R243 PolarHBondContact O-NH1 3.36Å; D103-R243 VanDerWaalsContact C-CZ 3.5Å; D103-R243 PolarHBondContact O-NE 2.91Å; D103-R243 VanDerWaalsContact O-NE 3.12Å; D103-R243 PolarHBondContact O-NH2 3.41Å; D103-R243 WeakPolarHBondContact OD1-CD 3.39Å; D103-R243 IonicContact OD1-NE 3.27Å; D103-R243 IonicContact OD1-NH1 3.71Å; R134-R243 VanDerWaalsContact CD-NH1 3.3Å; Y140-R243 WeakPolarHBondContact OH-CA 3.2Å; Y140-R243 WeakPolarHBondContact OH-CB 3.42Å; Y140-R243 PolarHBondContact OH-O 2.9Å; P241-R243 PolarHBondContact O-N 2.93Å
244	L	67.3	Low	81.6	Confident	122 Å²	122	59 Å²	59	64%	0.639	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.3	-28.5	-171	-63	176.5	0	0	0	112.4	P241	P241-L244 HydrophobicContact CG-CB 4.44Å; P241-L244 HydrophobicContact CG-CD1 3.97Å; P241-L244 HydrophobicContact CG-CG 4.25Å; P241-L244 PolarHBondContact O-N 2.85Å
245	C	75.8	Confident	81.3	Confident	11 Å²	11	60.5 Å²	60.5	7%	0.074	30%	0.299	C	S	.	.	S	Bend	trans	-84.8	118.7	175.8	-166.5	0	0	0	0	111.5	C238 K240 P241 Q247 C251 H255	C238-C245 VanDerWaalsContact SG-SG 3.61Å; K240-C245 HydrophobicContact CB-CB 4.09Å; P241-C245 PolarHBondContact O-N 3.24Å; P241-C245 VanDerWaalsContact O-N 3.14Å; C245-Q247 PolarHBondContact O-N 2.58Å; C245-C251 PolarHBondContact SG-SG 3.49Å; C245-H255 PolarHBondContact SG-NE2 2.92Å
246	R	68	Low	80.9	Confident	92 Å²	92	61.8 Å²	61.8	35%	0.347	31%	0.305	S	S	.	.			trans	-74.4	93.1	165.6	-87.2	-173.7	148.3	132.5	-5.2	109.5	L212 G248	L212-R246 HydrophobicContact CD2-CB 3.95Å; R246-G248 PolarHBondContact O-N 2.74Å
247	Q	70.6	Confident	80.6	Confident	104 Å²	104	59.6 Å²	59.6	49%	0.486	30%	0.3	S	S	.	.			trans	-50.2	119.2	176.2	-59.4	178.8	-32.8	0	0	110.8	C245 H255	C245-Q247 PolarHBondContact O-N 2.58Å; Q247-H255 HydrophobicContact CG-CB 4.43Å
248	G	79.1	Confident	80.4	Confident	31 Å²	31	58.5 Å²	58.5	32%	0.32	29%	0.292	S	S	.	.	S	Bend	trans	157.5	-157.4	-174.6	0	0	0	0	0	112.5	K234 R246	K234-G248 WeakPolarHBondContact CE-O 3.47Å; K234-G248 PolarHBondContact NZ-O 3.14Å; R246-G248 PolarHBondContact O-N 2.74Å
249	Y	83.8	Confident	80.4	Confident	85 Å²	85	58.8 Å²	58.8	33%	0.333	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.7	-23.7	180	61	-100.3	0	0	0	114	S209 I213 Y233 C251 P326 R327 F330	S209-Y249 PolarHBondContact OG-OH 2.98Å; I213-Y249 HydrophobicContact CD1-CE2 4.48Å; Y233-Y249 WeakPolarHBondContact OH-CA 3.37Å; Y233-Y249 PolarHBondContact OH-O 3.16Å; Y249-C251 PolarHBondContact O-N 3.19Å; Y249-P326 WeakPolarHBondContact CE2-O 3.34Å; Y249-R327 HydrophobicContact CD2-CB 4.08Å; Y249-R327 HydrophobicContact CD2-CG 3.78Å; Y249-R327 HydrophobicContact CE2-CB 4.3Å; Y249-R327 HydrophobicContact CE2-CG 3.84Å; Y249-R327 HydrophobicContact CG-CG 4.16Å; Y249-F330 WeakPolarHBondContact O-CD2 3.18Å
250	A	87.1	Confident	80.6	Confident	6 Å²	6	53.9 Å²	53.9	5%	0.05	27%	0.269	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.7	-7.9	-179.8	0	0	0	0	0	113.3	L212 I213 I216	L212-A250 HydrophobicContact CD2-CB 4.13Å; I213-A250 HydrophobicContact CD1-CB 4.13Å; I213-A250 HydrophobicContact CG1-CB 3.91Å; I216-A250 VanDerWaalsContact CD1-O 3.24Å; I216-A250 WeakPolarHBondContact CD1-O 3.32Å
251	C	90.3	Very high	81.2	Confident	4 Å²	4	50.2 Å²	50.2	3%	0.027	25%	0.253	C	S	.	.	S	Bend	trans	-110.7	122.8	174.2	177.5	0	0	0	0	109.9	K234 C238 C245 Y249 Y253 H255	K234-C251 WeakPolarHBondContact CE-O 3.28Å; K234-C251 PolarHBondContact NZ-O 3.04Å; K234-C251 VanDerWaalsContact NZ-O 3.16Å; C238-C251 VanDerWaalsContact SG-SG 3.63Å; C245-C251 PolarHBondContact SG-SG 3.49Å; Y249-C251 PolarHBondContact O-N 3.19Å; C251-Y253 PolarHBondContact O-N 3.02Å; C251-Y253 PolarHBondContact SG-N 3.04Å; C251-Y253 VanDerWaalsContact SG-N 3.44Å; C251-H255 VanDerWaalsContact SG-CE1 3.58Å
252	P	92.1	Very high	82.3	Confident	1 Å²	1	47.4 Å²	47.4	1%	0.006	23%	0.234	C	C	.	.	S	Bend	trans	-74.8	1.1	179.8	31.5	-36.1	0	0	0	114.1	I216 W223 Y233 K234 F330	I216-P252 HydrophobicContact CG2-CG 4.28Å; W223-P252 HydrophobicContact CD2-CB 3.9Å; W223-P252 HydrophobicContact CD2-CG 4.05Å; W223-P252 HydrophobicContact CE3-CB 3.85Å; W223-P252 HydrophobicContact CH2-CB 3.58Å; W223-P252 HydrophobicContact CH2-CG 4.24Å; W223-P252 HydrophobicContact CZ2-CB 3.62Å; W223-P252 HydrophobicContact CZ2-CG 3.75Å; W223-P252 HydrophobicContact CZ3-CB 3.69Å; Y233-P252 HydrophobicContact CD2-CB 3.92Å; Y233-P252 HydrophobicContact CE2-CB 4.38Å; K234-P252 WeakPolarHBondContact CA-O 3.32Å; K234-P252 PolarHBondContact N-O 2.88Å; P252-F330 HydrophobicContact CB-CE1 3.92Å; P252-F330 HydrophobicContact CB-CE2 4.49Å; P252-F330 HydrophobicContact CB-CZ 3.85Å; P252-F330 HydrophobicContact CG-CE1 4.48Å; P252-F330 HydrophobicContact CG-CE2 4.5Å; P252-F330 HydrophobicContact CG-CZ 3.94Å
253	Y	92.1	Very high	83.7	Confident	63 Å²	63	44.4 Å²	44.4	25%	0.247	22%	0.215	C	C	.	.	S	Bend	trans	-106.4	156.9	176.8	-55.6	-72.5	0	0	0	111.4	W223 K234 E236 C238 C251 H255	W223-Y253 HydrophobicContact CZ2-CE1 4.46Å; K234-Y253 PolarHBondContact NZ-O 3.15Å; E236-Y253 HydrophobicContact CB-CD1 3.98Å; E236-Y253 HydrophobicContact CB-CE1 4.36Å; E236-Y253 WeakPolarHBondContact O-CA 3.33Å; E236-Y253 WeakPolarHBondContact O-CB 3.37Å; C238-Y253 VanDerWaalsContact CA-CB 3.48Å; C251-Y253 PolarHBondContact O-N 3.02Å; C251-Y253 PolarHBondContact SG-N 3.04Å; C251-Y253 VanDerWaalsContact SG-N 3.44Å; Y253-H255 PolarHBondContact O-CE1 2.74Å; Y253-H255 PolarHBondContact O-ND1 2.73Å
254	Y	91.6	Very high	85	Confident	42 Å²	42	43.4 Å²	43.4	17%	0.165	21%	0.214	C	C	.	.	B	Isolated β-bridge	trans	-89.9	156.5	177.5	76.7	-101.8	0	0	0	112.9	K234 T235 E236 L237 C238 D259 R260	K234-Y254 WeakPolarHBondContact O-CD1 3.42Å; T235-Y254 WeakPolarHBondContact O-CE1 3.48Å; E236-Y254 WeakPolarHBondContact O-CD1 3.39Å; E236-Y254 PolarHBondContact O-N 3.42Å; L237-Y254 HydrophobicContact CB-CE1 4.3Å; L237-Y254 HydrophobicContact CB-CE2 4.06Å; L237-Y254 HydrophobicContact CD1-CD2 3.95Å; L237-Y254 HydrophobicContact CD1-CE2 3.65Å; L237-Y254 HydrophobicContact CG-CE2 4.46Å; L237-Y254 VanDerWaalsContact N-CE1 3.32Å; C238-Y254 PolarHBondContact N-O 3.3Å; Y254-D259 VanDerWaalsContact CA-OD2 3.28Å; Y254-D259 WeakPolarHBondContact CA-OD2 3.48Å; Y254-R260 HydrophobicContact CD1-CB 4.21Å; Y254-R260 HydrophobicContact CD1-CG 4.19Å; Y254-R260 HydrophobicContact CD2-CB 3.92Å; Y254-R260 HydrophobicContact CE1-CB 4.47Å; Y254-R260 HydrophobicContact CE1-CG 4.08Å; Y254-R260 HydrophobicContact CE2-CB 4.23Å; Y254-R260 HydrophobicContact CE2-CG 4.42Å; Y254-R260 HydrophobicContact CG-CB 3.93Å; Y254-R260 HydrophobicContact CG-CG 4.41Å; Y254-R260 PolarHBondContact OH-NH1 3.44Å
255	H	87.7	Confident	85.8	Confident	33 Å²	33	44.1 Å²	44.1	15%	0.153	21%	0.214	C	C	.	.			trans	-124.4	-12.9	-177.5	-53.4	81	0	0	0	114.7	C238 C245 Q247 C251 Y253 D259	C238-H255 VanDerWaalsContact CB-NE2 3.34Å; C238-H255 WeakPolarHBondContact CB-NE2 3.45Å; C245-H255 PolarHBondContact SG-NE2 2.92Å; Q247-H255 HydrophobicContact CG-CB 4.43Å; C251-H255 VanDerWaalsContact SG-CE1 3.58Å; Y253-H255 PolarHBondContact O-CE1 2.74Å; Y253-H255 PolarHBondContact O-ND1 2.73Å; H255-D259 IonicContact CE1-OD2 3.24Å; H255-D259 IonicContact CG-OD2 3.22Å; H255-D259 PolarHBondContact N-OD2 3.18Å; H255-D259 IonicContact ND1-OD2 3.85Å; H255-D259 PolarHBondContact ND1-OD2 3.08Å
256	N	85.6	Confident	86.3	Confident	54 Å²	54	52 Å²	52	29%	0.289	25%	0.246	S	C	.	.	S	Bend	trans	-161.4	172.8	-178	62.1	77.8	0	0	0	110.4	K258 D259 R260	N256-K258 VanDerWaalsContact C-N 3.32Å; N256-K258 PolarHBondContact O-N 2.89Å; N256-K258 WeakPolarHBondContact OD1-CA 3.42Å; N256-K258 WeakPolarHBondContact OD1-CB 3.34Å; N256-K258 PolarHBondContact OD1-N 2.83Å; N256-D259 PolarHBondContact O-N 3.21Å; N256-D259 VanDerWaalsContact O-N 3.15Å; N256-D259 PolarHBondContact OD1-N 2.87Å; N256-R260 PolarHBondContact O-N 3.16Å
257	S	86.6	Confident	87.3	Confident	47 Å²	47	50.3 Å²	50.3	33%	0.329	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.1	-39.6	-179.3	56.7	0	0	0	0	113.5	D259 D285 T300	S257-D259 VanDerWaalsContact C-N 3.33Å; S257-D259 PolarHBondContact O-N 3.15Å; S257-D285 WeakPolarHBondContact CB-OD1 3.48Å; S257-D285 PolarHBondContact OG-OD1 3.11Å; S257-T300 WeakPolarHBondContact O-CG2 3.33Å
258	K	87.2	Confident	88.2	Confident	77 Å²	77	54.9 Å²	54.9	34%	0.335	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.2	-17.7	179.5	-56.1	-160.7	-177.1	-153.4	0	114.2	N256 E282 W283 G284 T300	N256-K258 VanDerWaalsContact C-N 3.32Å; N256-K258 PolarHBondContact O-N 2.89Å; N256-K258 WeakPolarHBondContact OD1-CA 3.42Å; N256-K258 WeakPolarHBondContact OD1-CB 3.34Å; N256-K258 PolarHBondContact OD1-N 2.83Å; K258-E282 IonicContact NZ-OE1 3.17Å; K258-W283 PolarHBondContact NZ-O 3.28Å; K258-G284 WeakPolarHBondContact CD-O 3.42Å; K258-G284 WeakPolarHBondContact CE-O 3.45Å; K258-G284 PolarHBondContact NZ-O 2.81Å; K258-G284 VanDerWaalsContact NZ-O 3.08Å; K258-T300 WeakPolarHBondContact O-CB 3.41Å; K258-T300 WeakPolarHBondContact O-CG2 3.19Å
259	D	89	Confident	88.9	Confident	24 Å²	24	54 Å²	54	13%	0.128	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.7	-19.8	177.5	-170.4	40.6	0	0	0	112	K234 Y254 H255 N256 S257	K234-D259 WeakPolarHBondContact CD-OD1 3.5Å; K234-D259 VanDerWaalsContact CE-OD1 3.27Å; K234-D259 WeakPolarHBondContact CE-OD1 3.16Å; K234-D259 IonicContact NZ-OD1 3.96Å; K234-D259 PolarHBondContact NZ-OD1 2.8Å; K234-D259 IonicContact NZ-OD2 3.69Å; K234-D259 PolarHBondContact NZ-OD2 3.24Å; K234-D259 VanDerWaalsContact NZ-OD2 3.15Å; Y254-D259 VanDerWaalsContact CA-OD2 3.28Å; Y254-D259 WeakPolarHBondContact CA-OD2 3.48Å; H255-D259 IonicContact CE1-OD2 3.24Å; H255-D259 IonicContact CG-OD2 3.22Å; H255-D259 PolarHBondContact N-OD2 3.18Å; H255-D259 IonicContact ND1-OD2 3.85Å; H255-D259 PolarHBondContact ND1-OD2 3.08Å; N256-D259 PolarHBondContact O-N 3.21Å; N256-D259 VanDerWaalsContact O-N 3.15Å; N256-D259 PolarHBondContact OD1-N 2.87Å; S257-D259 VanDerWaalsContact C-N 3.33Å; S257-D259 PolarHBondContact O-N 3.15Å
260	R	91.8	Very high	89.3	Confident	67 Å²	67	56.4 Å²	56.4	25%	0.253	26%	0.256	S	S	.	.			trans	-61.4	144	177.3	176.4	-179.5	166.9	81.1	0.3	111.4	Y254 N256 E293 T300	Y254-R260 HydrophobicContact CD1-CB 4.21Å; Y254-R260 HydrophobicContact CD1-CG 4.19Å; Y254-R260 HydrophobicContact CD2-CB 3.92Å; Y254-R260 HydrophobicContact CE1-CB 4.47Å; Y254-R260 HydrophobicContact CE1-CG 4.08Å; Y254-R260 HydrophobicContact CE2-CB 4.23Å; Y254-R260 HydrophobicContact CE2-CG 4.42Å; Y254-R260 HydrophobicContact CG-CB 3.93Å; Y254-R260 HydrophobicContact CG-CG 4.41Å; Y254-R260 PolarHBondContact OH-NH1 3.44Å; N256-R260 PolarHBondContact O-N 3.16Å; R260-E293 IonicContact CZ-OE1 3.33Å; R260-E293 IonicContact CZ-OE2 3.59Å; R260-E293 IonicContact NE-OE1 2.71Å; R260-E293 PolarHBondContact NE-OE1 3.33Å; R260-E293 IonicContact NH2-OE1 2.92Å; R260-E293 PolarHBondContact NH2-OE1 3.37Å; R260-E293 IonicContact NH2-OE2 3.61Å; R260-E293 PolarHBondContact NH2-OE2 3.22Å; R260-T300 WeakPolarHBondContact O-CG2 3.45Å; R260-T300 PolarHBondContact O-OG1 3.42Å
261	R	93.9	Very high	89.6	Confident	0 Å²	0	56.7 Å²	56.7	0%	0	26%	0.259	C	S	.	.			trans	-129.8	124.1	169.1	163.3	164	179.2	-85.1	-1.8	110.2	L230 Y233 K234 T235 S263 T302 E303 F306	L230-R261 PolarHBondContact O-NH1 3.49Å; L230-R261 PolarHBondContact O-NH2 2.92Å; Y233-R261 WeakPolarHBondContact O-CD 3.39Å; Y233-R261 PolarHBondContact O-NH1 2.79Å; Y233-R261 VanDerWaalsContact O-NH1 3.09Å; K234-R261 HydrophobicContact CB-CB 4.24Å; K234-R261 PolarHBondContact O-N 2.78Å; T235-R261 VanDerWaalsContact CA-O 3.31Å; T235-R261 WeakPolarHBondContact CA-O 3.3Å; T235-R261 HydrophobicContact CG2-CG 4.49Å; R261-S263 PolarHBondContact O-N 2.89Å; R261-T302 HydrophobicContact CB-CG2 3.9Å; R261-E303 HydrophobicContact CB-CG 3.97Å; R261-E303 HydrophobicContact CG-CG 3.95Å; R261-F306 VanDerWaalsContact CZ-O 3.27Å; R261-F306 PolarHBondContact NE-O 2.94Å; R261-F306 VanDerWaalsContact NE-O 3.14Å; R261-F306 PolarHBondContact NH2-O 3.21Å
262	R	93.1	Very high	89.8	Confident	5 Å²	5	61.4 Å²	61.4	2%	0.019	28%	0.283	C	S	.	.			trans	-63.3	132.3	168.1	-72.5	171	-66.5	157.5	2.5	109.2	H267 Y269 E293 C295 Y297 E303	R262-H267 HydrophobicContact CB-CB 4.07Å; R262-Y269 HydrophobicContact CB-CD1 4.49Å; R262-Y269 HydrophobicContact CB-CE1 3.98Å; R262-Y269 WeakPolarHBondContact O-CE1 3.28Å; R262-Y269 PolarHBondContact O-OH 3.15Å; R262-E293 VanDerWaalsContact CD-OE2 3.3Å; R262-E293 WeakPolarHBondContact CD-OE2 3.42Å; R262-E293 WeakPolarHBondContact CG-OE2 3.44Å; R262-E293 PolarHBondContact NH1-O 3.24Å; R262-C295 PolarHBondContact NH1-O 3.03Å; R262-Y297 PolarHBondContact NH2-O 2.77Å; R262-E303 VanDerWaalsContact CB-OE1 3.32Å; R262-E303 WeakPolarHBondContact CB-OE1 3.34Å; R262-E303 VanDerWaalsContact CG-OE1 3.31Å; R262-E303 WeakPolarHBondContact CG-OE1 3.42Å; R262-E303 IonicContact CZ-OE1 3.47Å; R262-E303 IonicContact CZ-OE2 3.56Å; R262-E303 PolarHBondContact N-OE1 3Å; R262-E303 IonicContact NE-OE1 2.72Å; R262-E303 PolarHBondContact NE-OE1 3.21Å; R262-E303 IonicContact NE-OE2 3.68Å; R262-E303 IonicContact NH2-OE1 2.77Å; R262-E303 IonicContact NH2-OE2 2.76Å; R262-E303 PolarHBondContact NH2-OE2 2.86Å
263	S	88.6	Confident	89.8	Confident	20 Å²	20	63 Å²	63	14%	0.14	29%	0.294	C	S	.	.			trans	-67.3	127.9	176.8	-176.2	0	0	0	0	109.6	T231 R261 H265 K266 H267	T231-S263 PolarHBondContact O-OG 3.25Å; R261-S263 PolarHBondContact O-N 2.89Å; S263-H265 PolarHBondContact O-N 3.47Å; S263-K266 PolarHBondContact O-N 3.46Å; S263-H267 PolarHBondContact O-N 2.89Å
264	P	84.5	Confident	89.9	Confident	23 Å²	23	60.2 Å²	60.2	15%	0.149	28%	0.283	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.3	-22.2	-176.5	27.1	-35.9	0	0	0	112.9	K266 H267 P308	P264-K266 VanDerWaalsContact C-N 3.29Å; P264-K266 PolarHBondContact O-N 2.98Å; P264-H267 WeakPolarHBondContact CA-O 3.11Å; P264-P308 HydrophobicContact CB-CG 4.15Å; P264-P308 HydrophobicContact CG-CG 4.37Å
265	H	83.6	Confident	89.9	Confident	137 Å²	137	63 Å²	63	63%	0.634	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.8	-24.2	173.5	-70.5	87.5	0	0	0	113.3	T231 S263	T231-H265 PolarHBondContact OG1-CE1 3.41Å; S263-H265 PolarHBondContact O-N 3.47Å
266	K	86.4	Confident	89.9	Confident	176 Å²	176	63.4 Å²	63.4	77%	0.765	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.7	-28.1	-179.6	-63.4	-173.1	179.4	-177.4	0	113.1	S263 P264	S263-K266 PolarHBondContact O-N 3.46Å; P264-K266 VanDerWaalsContact C-N 3.29Å; P264-K266 PolarHBondContact O-N 2.98Å
267	H	88.7	Confident	90.1	Very high	57 Å²	57	61 Å²	61	26%	0.264	30%	0.303	S	S	.	.			trans	-131.2	116.7	-178.7	-53.7	85.7	0	0	0	109.7	R262 S263 P264 Y269 E293	R262-H267 HydrophobicContact CB-CB 4.07Å; S263-H267 PolarHBondContact O-N 2.89Å; P264-H267 WeakPolarHBondContact CA-O 3.11Å; H267-Y269 HydrophobicContact CB-CD1 4.27Å; H267-Y269 VanDerWaalsContact O-CD1 3.25Å; H267-Y269 WeakPolarHBondContact O-CD1 3.31Å; H267-Y269 PolarHBondContact O-N 3.26Å; H267-E293 PolarHBondContact CD2-O 3.45Å; H267-E293 IonicContact CE1-OE2 3.18Å; H267-E293 IonicContact NE2-OE2 3.69Å
268	K	89.1	Confident	90.2	Very high	201 Å²	201	60.4 Å²	60.4	87%	0.874	29%	0.294	S	S	*	.			trans	-85.6	106	175.1	-66.1	-172.2	178.8	-175.7	0	109.8
269	Y	93.6	Very high	90.1	Very high	11 Å²	11	63.5 Å²	63.5	4%	0.043	31%	0.31	C	S	.	.			trans	-126.9	163.2	173.6	60.4	-88.7	0	0	0	110.5	R262 H267 Q296 E303 H307	R262-Y269 HydrophobicContact CB-CD1 4.49Å; R262-Y269 HydrophobicContact CB-CE1 3.98Å; R262-Y269 WeakPolarHBondContact O-CE1 3.28Å; R262-Y269 PolarHBondContact O-OH 3.15Å; H267-Y269 HydrophobicContact CB-CD1 4.27Å; H267-Y269 VanDerWaalsContact O-CD1 3.25Å; H267-Y269 WeakPolarHBondContact O-CD1 3.31Å; H267-Y269 PolarHBondContact O-N 3.26Å; Y269-Q296 CarbonylContact C-O 3.47Å; Y269-Q296 WeakPolarHBondContact CA-O 3.45Å; Y269-E303 HydrophobicContact CE2-CB 3.81Å; Y269-E303 HydrophobicContact CE2-CG 4.27Å; Y269-H307 AromaticContact CD2-CD2 3.8Å; Y269-H307 AromaticContact CD2-NE2 3.99Å; Y269-H307 AromaticContact CE2-CD2 3.61Å; Y269-H307 PolarHBondContact O-NE2 3.35Å
270	R	93.5	Very high	89.9	Confident	136 Å²	136	65.4 Å²	65.4	51%	0.513	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	157.5	179.7	-57	179.2	-172.5	-136	2.4	111.2	L272 Q296 C298 H307	R270-L272 PolarHBondContact O-N 3.33Å; R270-Q296 PolarHBondContact N-O 3.24Å; R270-C298 PolarHBondContact O-SG 3.45Å; R270-H307 VanDerWaalsContact C-NE2 3.33Å; R270-H307 WeakPolarHBondContact CA-NE2 3.48Å; R270-H307 PolarHBondContact N-NE2 2.96Å
271	A	92.6	Very high	89.4	Confident	12 Å²	12	69.1 Å²	69.1	10%	0.099	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60	-14.5	174.7	0	0	0	0	0	115.3	Q304 H307 E309 I310	A271-Q304 PolarHBondContact O-NE2 3.34Å; A271-H307 HydrophobicContact CB-CB 4.26Å; A271-H307 PolarHBondContact N-CD2 2.88Å; A271-E309 WeakPolarHBondContact CB-OE2 3.18Å; A271-I310 HydrophobicContact CB-CD1 3.91Å; A271-I310 HydrophobicContact CB-CG1 3.58Å
272	L	93.9	Very high	89	Confident	103 Å²	103	73.9 Å²	73.9	54%	0.539	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74	136.8	179.8	-65.3	175.6	0	0	0	111.7	R270 Y297 C298	R270-L272 PolarHBondContact O-N 3.33Å; L272-Y297 HydrophobicContact CB-CD1 3.88Å; L272-Y297 HydrophobicContact CB-CE1 4.2Å; L272-Y297 HydrophobicContact CD1-CE1 4.39Å; L272-C298 PolarHBondContact O-N 3.23Å
273	P	93.4	Very high	88.8	Confident	35 Å²	35	75 Å²	75	23%	0.227	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.8	146.5	173.2	-20.5	34	0	0	0	112.5	K278 W283	P273-K278 HydrophobicContact CB-CB 3.72Å; P273-K278 HydrophobicContact CB-CD 3.88Å; P273-K278 HydrophobicContact CB-CG 4.39Å; P273-K278 HydrophobicContact CG-CD 3.89Å; P273-W283 HydrophobicContact CB-CH2 3.7Å; P273-W283 HydrophobicContact CB-CZ2 4.19Å; P273-W283 HydrophobicContact CB-CZ3 4.24Å; P273-W283 HydrophobicContact CG-CH2 3.97Å; P273-W283 HydrophobicContact CG-CZ2 4.08Å
274	C	94	Very high	88.7	Confident	5 Å²	5	74.7 Å²	74.7	3%	0.034	38%	0.382	C	S	.	.	P	Polyproline II helix	trans	-73	124.2	172.4	-179.1	0	0	0	0	110	A276 V277 K278 C289 C298 H299	C274-A276 PolarHBondContact O-N 3.07Å; C274-V277 HydrophobicContact CB-CB 4.24Å; C274-V277 HydrophobicContact CB-CG2 4.08Å; C274-V277 PolarHBondContact O-N 3.39Å; C274-K278 PolarHBondContact O-N 2.89Å; C274-C289 VanDerWaalsContact SG-SG 3.61Å; C274-C298 WeakPolarHBondContact CB-O 3.38Å; C274-C298 PolarHBondContact N-O 3.42Å; C274-H299 WeakPolarHBondContact CB-CD2 3.48Å
275	P	90.4	Very high	88.8	Confident	101 Å²	101	76.4 Å²	76.4	66%	0.656	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.1	-19.7	-176.9	26.8	-35	0	0	0	113.7	V277	P275-V277 VanDerWaalsContact C-N 3.29Å
276	A	88.2	Confident	89	Confident	41 Å²	41	70.9 Å²	70.9	34%	0.339	37%	0.366	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.1	-19.6	171.4	0	0	0	0	0	113	C274 C289	C274-A276 PolarHBondContact O-N 3.07Å; A276-C289 HydrophobicContact CB-CB 4.31Å
277	V	89.8	Confident	89	Confident	2 Å²	2	67.4 Å²	67.4	1%	0.012	37%	0.365	C	S	.	.	T	Hydrogen-bonded Turn	trans	-113.1	-41.4	-174.2	-170	0	0	0	0	112.6	C274 P275 G284 C289 H299	C274-V277 HydrophobicContact CB-CB 4.24Å; C274-V277 HydrophobicContact CB-CG2 4.08Å; C274-V277 PolarHBondContact O-N 3.39Å; P275-V277 VanDerWaalsContact C-N 3.29Å; V277-G284 VanDerWaalsContact O-CA 3.31Å; V277-G284 WeakPolarHBondContact O-CA 3.49Å; V277-G284 PolarHBondContact O-N 2.74Å; V277-C289 HydrophobicContact CG2-CB 3.74Å; V277-H299 VanDerWaalsContact CG1-O 3.31Å; V277-H299 WeakPolarHBondContact CG1-O 3.44Å
278	K	89.6	Confident	88.8	Confident	36 Å²	36	71.7 Å²	71.7	16%	0.157	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	120.9	171.6	-161.1	-160.6	-174.3	-138.3	0	110	P273 C274 G280 E281 E282 W283	P273-K278 HydrophobicContact CB-CB 3.72Å; P273-K278 HydrophobicContact CB-CD 3.88Å; P273-K278 HydrophobicContact CB-CG 4.39Å; P273-K278 HydrophobicContact CG-CD 3.89Å; C274-K278 PolarHBondContact O-N 2.89Å; K278-G280 WeakPolarHBondContact CD-O 3.45Å; K278-G280 WeakPolarHBondContact CE-O 3.49Å; K278-G280 PolarHBondContact NZ-O 3Å; K278-E281 WeakPolarHBondContact CE-O 3.43Å; K278-E281 IonicContact NZ-OE1 3.15Å; K278-E281 PolarHBondContact NZ-OE1 2.86Å; K278-E281 IonicContact NZ-OE2 3.73Å; K278-E281 PolarHBondContact NZ-OE2 3.03Å; K278-E282 WeakPolarHBondContact CA-O 3.27Å; K278-E282 VanDerWaalsContact CG-O 3.31Å; K278-E282 WeakPolarHBondContact CG-O 3.34Å; K278-W283 HydrophobicContact CB-CD2 4.28Å; K278-W283 HydrophobicContact CB-CE3 4.19Å; K278-W283 HydrophobicContact CB-CZ3 4.38Å; K278-W283 HydrophobicContact CD-CD2 4.49Å; K278-W283 HydrophobicContact CD-CZ2 4.11Å; K278-W283 HydrophobicContact CG-CD2 4.08Å; K278-W283 HydrophobicContact CG-CE3 4.5Å; K278-W283 HydrophobicContact CG-CG 4.29Å
279	Q	83.6	Confident	88.8	Confident	142 Å²	142	62.8 Å²	62.8	66%	0.664	35%	0.345	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-119.6	109.7	177.6	-65.3	-175.9	0.7	0	0	108.7	E281 E282	Q279-E281 PolarHBondContact O-N 2.95Å; Q279-E282 PolarHBondContact N-O 3.37Å; Q279-E282 VanDerWaalsContact N-O 3.07Å; Q279-E282 PolarHBondContact O-N 3.28Å
280	G	84.8	Confident	88.5	Confident	64 Å²	64	71.8 Å²	71.8	66%	0.66	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.5	-117.6	-166.9	0	0	0	0	0	110.8	K278	K278-G280 WeakPolarHBondContact CD-O 3.45Å; K278-G280 WeakPolarHBondContact CE-O 3.49Å; K278-G280 PolarHBondContact NZ-O 3Å
281	E	81.6	Confident	88.1	Confident	145 Å²	145	67.2 Å²	67.2	68%	0.678	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.8	-19.1	175.6	-71.4	-50.5	130.2	0	0	115.4	K278 Q279	K278-E281 WeakPolarHBondContact CE-O 3.43Å; K278-E281 IonicContact NZ-OE1 3.15Å; K278-E281 PolarHBondContact NZ-OE1 2.86Å; K278-E281 IonicContact NZ-OE2 3.73Å; K278-E281 PolarHBondContact NZ-OE2 3.03Å; Q279-E281 PolarHBondContact O-N 2.95Å
282	E	87.2	Confident	87.8	Confident	100 Å²	100	69 Å²	69	47%	0.467	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	133.5	179.7	-156.3	-157.3	152.6	0	0	110.8	K258 K278 Q279	K258-E282 IonicContact NZ-OE1 3.17Å; K278-E282 WeakPolarHBondContact CA-O 3.27Å; K278-E282 VanDerWaalsContact CG-O 3.31Å; K278-E282 WeakPolarHBondContact CG-O 3.34Å; Q279-E282 PolarHBondContact N-O 3.37Å; Q279-E282 VanDerWaalsContact N-O 3.07Å; Q279-E282 PolarHBondContact O-N 3.28Å
283	W	88.3	Confident	87.6	Confident	27 Å²	27	67.9 Å²	67.9	10%	0.102	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	111.4	165.4	-73	82.5	0	0	0	109.2	K258 P273 K278 C298 H299 T300 R301 Q304	K258-W283 PolarHBondContact NZ-O 3.28Å; P273-W283 HydrophobicContact CB-CH2 3.7Å; P273-W283 HydrophobicContact CB-CZ2 4.19Å; P273-W283 HydrophobicContact CB-CZ3 4.24Å; P273-W283 HydrophobicContact CG-CH2 3.97Å; P273-W283 HydrophobicContact CG-CZ2 4.08Å; K278-W283 HydrophobicContact CB-CD2 4.28Å; K278-W283 HydrophobicContact CB-CE3 4.19Å; K278-W283 HydrophobicContact CB-CZ3 4.38Å; K278-W283 HydrophobicContact CD-CD2 4.49Å; K278-W283 HydrophobicContact CD-CZ2 4.11Å; K278-W283 HydrophobicContact CG-CD2 4.08Å; K278-W283 HydrophobicContact CG-CE3 4.5Å; K278-W283 HydrophobicContact CG-CG 4.29Å; W283-C298 HydrophobicContact CH2-CB 4.1Å; W283-C298 HydrophobicContact CZ3-CB 4.49Å; W283-H299 VanDerWaalsContact CZ3-C 3.47Å; W283-T300 WeakPolarHBondContact CH2-O 3.38Å; W283-R301 HydrophobicContact CD2-CB 4.36Å; W283-R301 HydrophobicContact CG-CB 4.46Å; W283-R301 HydrophobicContact CZ2-CB 4.45Å; W283-Q304 HydrophobicContact CH2-CB 4.32Å; W283-Q304 HydrophobicContact CZ2-CB 4.37Å
284	G	86	Confident	87.4	Confident	15 Å²	15	69.4 Å²	69.4	16%	0.155	41%	0.412	C	S	.	.			trans	-69.5	-145.9	175.8	0	0	0	0	0	113.5	K258 V277	K258-G284 WeakPolarHBondContact CD-O 3.42Å; K258-G284 WeakPolarHBondContact CE-O 3.45Å; K258-G284 PolarHBondContact NZ-O 2.81Å; K258-G284 VanDerWaalsContact NZ-O 3.08Å; V277-G284 VanDerWaalsContact O-CA 3.31Å; V277-G284 WeakPolarHBondContact O-CA 3.49Å; V277-G284 PolarHBondContact O-N 2.74Å
285	D	86.2	Confident	87.3	Confident	59 Å²	59	69.9 Å²	69.9	32%	0.316	42%	0.416	S	S	.	.			trans	-111.7	124.6	179.8	-166	8.5	0	0	0	109.3	S257 S287 K288	S257-D285 WeakPolarHBondContact CB-OD1 3.48Å; S257-D285 PolarHBondContact OG-OD1 3.11Å; D285-S287 PolarHBondContact O-N 3.32Å; D285-K288 WeakPolarHBondContact O-CB 3.44Å; D285-K288 PolarHBondContact O-N 2.96Å
286	P	87.3	Confident	87.5	Confident	20 Å²	20	70.3 Å²	70.3	13%	0.13	41%	0.409	C	S	.	.	G	3₁₀ helix	trans	-49.7	-32.2	-179.1	-34.1	38.2	0	0	0	115.2	K288 C289 H299 T300	P286-K288 PolarHBondContact O-N 3.38Å; P286-C289 PolarHBondContact O-N 3.37Å; P286-H299 HydrophobicContact CB-CB 3.95Å; P286-H299 HydrophobicContact CG-CB 4.05Å; P286-T300 HydrophobicContact CG-CG2 3.88Å
287	S	87.1	Confident	87.8	Confident	104 Å²	104	72.6 Å²	72.6	73%	0.727	41%	0.409	S	S	*	.	G	3₁₀ helix	trans	-63.5	-7.7	177.2	-59	0	0	0	0	114.8	D285	D285-S287 PolarHBondContact O-N 3.32Å
288	K	84.3	Confident	88	Confident	146 Å²	146	72.5 Å²	72.5	64%	0.635	41%	0.408	S	S	*	.	G	3₁₀ helix	trans	-81.2	-10.4	171.4	-65	-174.5	177.7	-173.5	0	114	D285 P286	D285-K288 WeakPolarHBondContact O-CB 3.44Å; D285-K288 PolarHBondContact O-N 2.96Å; P286-K288 PolarHBondContact O-N 3.38Å
289	C	89	Confident	88.2	Confident	14 Å²	14	71.1 Å²	71.1	10%	0.095	40%	0.403	C	S	.	.			trans	-92.6	118.4	175.3	-174.9	0	0	0	0	110.8	C274 A276 V277 P286 G291 A292 C295 H299	C274-C289 VanDerWaalsContact SG-SG 3.61Å; A276-C289 HydrophobicContact CB-CB 4.31Å; V277-C289 HydrophobicContact CG2-CB 3.74Å; P286-C289 PolarHBondContact O-N 3.37Å; C289-G291 PolarHBondContact O-N 3.25Å; C289-A292 WeakPolarHBondContact O-CA 3.37Å; C289-A292 PolarHBondContact O-N 2.79Å; C289-C295 VanDerWaalsContact SG-SG 3.67Å; C289-H299 VanDerWaalsContact CB-CE1 3.45Å; C289-H299 WeakPolarHBondContact CB-CE1 3.38Å; C289-H299 WeakPolarHBondContact CB-NE2 3.39Å; C289-H299 PolarHBondContact SG-NE2 3.37Å; C289-H299 VanDerWaalsContact SG-NE2 3.43Å
290	E	88.4	Confident	88.7	Confident	200 Å²	200	64.5 Å²	64.5	94%	0.935	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59	-29.9	176.6	-59.8	177.9	155.6	0	0	112.8	A292	E290-A292 PolarHBondContact O-N 3.04Å
291	G	84.3	Confident	89.1	Confident	40 Å²	40	68 Å²	68	41%	0.412	37%	0.366	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.4	-11.4	173.8	0	0	0	0	0	114.7	C289 E293 G294 C295	C289-G291 PolarHBondContact O-N 3.25Å; G291-E293 PolarHBondContact O-N 2.69Å; G291-G294 CarbonylContact O-C 3.34Å; G291-G294 WeakPolarHBondContact O-CA 3.37Å; G291-G294 PolarHBondContact O-N 2.83Å; G291-C295 PolarHBondContact O-N 2.95Å
292	A	87.1	Confident	89.6	Confident	51 Å²	51	62 Å²	62	42%	0.421	34%	0.338	S	S	.	.	G	3₁₀ helix	trans	41.6	-121.2	174.5	0	0	0	0	0	113.7	C289 E290 G294 H299	C289-A292 WeakPolarHBondContact O-CA 3.37Å; C289-A292 PolarHBondContact O-N 2.79Å; E290-A292 PolarHBondContact O-N 3.04Å; A292-G294 VanDerWaalsContact C-N 3.35Å; A292-H299 PolarHBondContact O-CE1 3.17Å; A292-H299 PolarHBondContact O-ND1 2.78Å
293	E	88.4	Confident	90	Very high	78 Å²	78	57.3 Å²	57.3	36%	0.364	32%	0.317	S	S	.	.	G	3₁₀ helix	trans	-69.1	-31.3	-179.6	-63.9	-68.1	140.1	0	0	112.8	R260 R262 H267 G291 C295	R260-E293 IonicContact CZ-OE1 3.33Å; R260-E293 IonicContact CZ-OE2 3.59Å; R260-E293 IonicContact NE-OE1 2.71Å; R260-E293 PolarHBondContact NE-OE1 3.33Å; R260-E293 IonicContact NH2-OE1 2.92Å; R260-E293 PolarHBondContact NH2-OE1 3.37Å; R260-E293 IonicContact NH2-OE2 3.61Å; R260-E293 PolarHBondContact NH2-OE2 3.22Å; R262-E293 VanDerWaalsContact CD-OE2 3.3Å; R262-E293 WeakPolarHBondContact CD-OE2 3.42Å; R262-E293 WeakPolarHBondContact CG-OE2 3.44Å; R262-E293 PolarHBondContact NH1-O 3.24Å; H267-E293 PolarHBondContact CD2-O 3.45Å; H267-E293 IonicContact CE1-OE2 3.18Å; H267-E293 IonicContact NE2-OE2 3.69Å; G291-E293 PolarHBondContact O-N 2.69Å; E293-C295 VanDerWaalsContact C-N 3.32Å; E293-C295 PolarHBondContact O-N 3.15Å
294	G	89.4	Confident	90.3	Very high	68 Å²	68	58.6 Å²	58.6	70%	0.701	32%	0.324	S	S	*	.	G	3₁₀ helix	trans	-81.2	-0.7	180	0	0	0	0	0	115.2	G291 A292 Q296	G291-G294 CarbonylContact O-C 3.34Å; G291-G294 WeakPolarHBondContact O-CA 3.37Å; G291-G294 PolarHBondContact O-N 2.83Å; A292-G294 VanDerWaalsContact C-N 3.35Å; G294-Q296 PolarHBondContact O-N 2.85Å
295	C	92.8	Very high	90.7	Very high	15 Å²	15	61 Å²	61	10%	0.101	33%	0.331	C	S	.	.			trans	-67.4	127.1	179.5	-175.1	0	0	0	0	111.8	R262 C289 G291 E293 Y297 H299	R262-C295 PolarHBondContact NH1-O 3.03Å; C289-C295 VanDerWaalsContact SG-SG 3.67Å; G291-C295 PolarHBondContact O-N 2.95Å; E293-C295 VanDerWaalsContact C-N 3.32Å; E293-C295 PolarHBondContact O-N 3.15Å; C295-Y297 PolarHBondContact O-N 3.37Å; C295-H299 VanDerWaalsContact CB-CE1 3.43Å; C295-H299 WeakPolarHBondContact CB-CE1 3.39Å; C295-H299 VanDerWaalsContact CB-NE2 3.32Å; C295-H299 WeakPolarHBondContact CB-NE2 3.24Å; C295-H299 PolarHBondContact SG-NE2 3.32Å
296	Q	93.8	Very high	91.1	Very high	110 Å²	110	58.5 Å²	58.5	51%	0.514	32%	0.317	S	S	.	.	S	Bend	trans	-73.1	12.4	-177.6	-59.9	-174.3	12.8	0	0	114.9	Y269 R270 G294	Y269-Q296 CarbonylContact C-O 3.47Å; Y269-Q296 WeakPolarHBondContact CA-O 3.45Å; R270-Q296 PolarHBondContact N-O 3.24Å; G294-Q296 PolarHBondContact O-N 2.85Å
297	Y	94.2	Very high	91.5	Very high	88 Å²	88	58.5 Å²	58.5	35%	0.345	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	154.4	-174.8	-65.2	-88	0	0	0	111.1	R262 L272 C295 H299	R262-Y297 PolarHBondContact NH2-O 2.77Å; L272-Y297 HydrophobicContact CB-CD1 3.88Å; L272-Y297 HydrophobicContact CB-CE1 4.2Å; L272-Y297 HydrophobicContact CD1-CE1 4.39Å; C295-Y297 PolarHBondContact O-N 3.37Å; Y297-H299 PolarHBondContact O-CD2 2.89Å; Y297-H299 PolarHBondContact O-N 2.96Å
298	C	94.9	Very high	91.8	Very high	0 Å²	0	56.6 Å²	56.6	0%	0	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.8	131.1	177.9	-69.8	0	0	0	0	111.6	R270 L272 C274 W283 E303 Q304	R270-C298 PolarHBondContact O-SG 3.45Å; L272-C298 PolarHBondContact O-N 3.23Å; C274-C298 WeakPolarHBondContact CB-O 3.38Å; C274-C298 PolarHBondContact N-O 3.42Å; W283-C298 HydrophobicContact CH2-CB 4.1Å; W283-C298 HydrophobicContact CZ3-CB 4.49Å; C298-E303 HydrophobicContact CB-CB 4.06Å; C298-Q304 HydrophobicContact CB-CB 4.17Å
299	H	93.9	Very high	92.1	Very high	7 Å²	7	55.7 Å²	55.7	3%	0.032	30%	0.299	C	S	.	.			trans	-101.4	-18.1	177.7	-76.7	-174.2	0	0	0	113.2	C274 V277 W283 P286 C289 A292 C295 Y297 E303	C274-H299 WeakPolarHBondContact CB-CD2 3.48Å; V277-H299 VanDerWaalsContact CG1-O 3.31Å; V277-H299 WeakPolarHBondContact CG1-O 3.44Å; W283-H299 VanDerWaalsContact CZ3-C 3.47Å; P286-H299 HydrophobicContact CB-CB 3.95Å; P286-H299 HydrophobicContact CG-CB 4.05Å; C289-H299 VanDerWaalsContact CB-CE1 3.45Å; C289-H299 WeakPolarHBondContact CB-CE1 3.38Å; C289-H299 WeakPolarHBondContact CB-NE2 3.39Å; C289-H299 PolarHBondContact SG-NE2 3.37Å; C289-H299 VanDerWaalsContact SG-NE2 3.43Å; A292-H299 PolarHBondContact O-CE1 3.17Å; A292-H299 PolarHBondContact O-ND1 2.78Å; C295-H299 VanDerWaalsContact CB-CE1 3.43Å; C295-H299 WeakPolarHBondContact CB-CE1 3.39Å; C295-H299 VanDerWaalsContact CB-NE2 3.32Å; C295-H299 WeakPolarHBondContact CB-NE2 3.24Å; C295-H299 PolarHBondContact SG-NE2 3.32Å; Y297-H299 PolarHBondContact O-CD2 2.89Å; Y297-H299 PolarHBondContact O-N 2.96Å; H299-E303 PolarHBondContact N-OE2 2.63Å
300	T	93.6	Very high	92.3	Very high	4 Å²	4	58.1 Å²	58.1	3%	0.025	31%	0.31	C	S	.	.	S	Bend	trans	-131.9	157.8	174.5	69.3	0	0	0	0	112.1	S257 K258 R260 W283 P286 T302 E303 Q304	S257-T300 WeakPolarHBondContact O-CG2 3.33Å; K258-T300 WeakPolarHBondContact O-CB 3.41Å; K258-T300 WeakPolarHBondContact O-CG2 3.19Å; R260-T300 WeakPolarHBondContact O-CG2 3.45Å; R260-T300 PolarHBondContact O-OG1 3.42Å; W283-T300 WeakPolarHBondContact CH2-O 3.38Å; P286-T300 HydrophobicContact CG-CG2 3.88Å; T300-T302 PolarHBondContact O-N 3.02Å; T300-T302 PolarHBondContact OG1-N 2.72Å; T300-E303 WeakPolarHBondContact O-CB 3.46Å; T300-E303 PolarHBondContact O-N 3.42Å; T300-E303 VanDerWaalsContact O-N 3.09Å; T300-E303 WeakPolarHBondContact OG1-CG 3.18Å; T300-E303 PolarHBondContact OG1-N 3.17Å; T300-Q304 PolarHBondContact O-N 3.31Å
301	R	93.1	Very high	92.6	Very high	138 Å²	138	49.6 Å²	49.6	52%	0.521	27%	0.269	S	S	.	.	H	α-helix	trans	-56.1	-35	170.1	-173.1	-178.7	-70.3	-180	-3.4	111	W283 Q304 Q305	W283-R301 HydrophobicContact CD2-CB 4.36Å; W283-R301 HydrophobicContact CG-CB 4.46Å; W283-R301 HydrophobicContact CZ2-CB 4.45Å; R301-Q304 PolarHBondContact O-N 2.7Å; R301-Q305 HydrophobicContact CG-CG 4.22Å; R301-Q305 WeakPolarHBondContact O-CB 3.19Å; R301-Q305 WeakPolarHBondContact O-CG 3.43Å; R301-Q305 PolarHBondContact O-N 3.17Å
302	T	93.4	Very high	93	Very high	17 Å²	17	49.7 Å²	49.7	10%	0.104	26%	0.259	C	S	.	.	H	α-helix	trans	-62.9	-44.9	174.5	-48.4	0	0	0	0	112.2	Y233 K234 R261 T300 Q304 F306	Y233-T302 HydrophobicContact CD1-CG2 4.27Å; Y233-T302 HydrophobicContact CE1-CG2 4.07Å; K234-T302 HydrophobicContact CB-CG2 3.89Å; K234-T302 HydrophobicContact CD-CG2 3.66Å; K234-T302 HydrophobicContact CG-CG2 4.33Å; R261-T302 HydrophobicContact CB-CG2 3.9Å; T300-T302 PolarHBondContact O-N 3.02Å; T300-T302 PolarHBondContact OG1-N 2.72Å; T302-Q304 VanDerWaalsContact C-N 3.28Å; T302-Q304 PolarHBondContact O-N 2.87Å; T302-F306 HydrophobicContact CG2-CD2 4.21Å; T302-F306 WeakPolarHBondContact O-CB 3.38Å; T302-F306 PolarHBondContact O-N 3.27Å
303	E	95.1	Very high	93.3	Very high	3 Å²	3	51.1 Å²	51.1	1%	0.014	27%	0.265	C	S	.	.	H	α-helix	trans	-59.7	-38.4	176.1	-77	-175.8	172.2	0	0	112.6	R261 R262 Y269 C298 H299 T300 F306 H307	R261-E303 HydrophobicContact CB-CG 3.97Å; R261-E303 HydrophobicContact CG-CG 3.95Å; R262-E303 VanDerWaalsContact CB-OE1 3.32Å; R262-E303 WeakPolarHBondContact CB-OE1 3.34Å; R262-E303 VanDerWaalsContact CG-OE1 3.31Å; R262-E303 WeakPolarHBondContact CG-OE1 3.42Å; R262-E303 IonicContact CZ-OE1 3.47Å; R262-E303 IonicContact CZ-OE2 3.56Å; R262-E303 PolarHBondContact N-OE1 3Å; R262-E303 IonicContact NE-OE1 2.72Å; R262-E303 PolarHBondContact NE-OE1 3.21Å; R262-E303 IonicContact NE-OE2 3.68Å; R262-E303 IonicContact NH2-OE1 2.77Å; R262-E303 IonicContact NH2-OE2 2.76Å; R262-E303 PolarHBondContact NH2-OE2 2.86Å; Y269-E303 HydrophobicContact CE2-CB 3.81Å; Y269-E303 HydrophobicContact CE2-CG 4.27Å; C298-E303 HydrophobicContact CB-CB 4.06Å; H299-E303 PolarHBondContact N-OE2 2.63Å; T300-E303 WeakPolarHBondContact O-CB 3.46Å; T300-E303 PolarHBondContact O-N 3.42Å; T300-E303 VanDerWaalsContact O-N 3.09Å; T300-E303 WeakPolarHBondContact OG1-CG 3.18Å; T300-E303 PolarHBondContact OG1-N 3.17Å; E303-F306 CarbonylContact O-C 3.44Å; E303-H307 WeakPolarHBondContact O-CB 3.38Å; E303-H307 PolarHBondContact O-N 2.94Å; E303-H307 VanDerWaalsContact O-N 3.11Å
304	Q	94.4	Very high	93.4	Very high	53 Å²	53	51.3 Å²	51.3	25%	0.248	27%	0.272	C	S	.	.	H	α-helix	trans	-73.3	-50.6	177.1	177.1	168.4	65.6	0	0	112.6	A271 W283 C298 T300 R301 T302 F306 H307 I310	A271-Q304 PolarHBondContact O-NE2 3.34Å; W283-Q304 HydrophobicContact CH2-CB 4.32Å; W283-Q304 HydrophobicContact CZ2-CB 4.37Å; C298-Q304 HydrophobicContact CB-CB 4.17Å; T300-Q304 PolarHBondContact O-N 3.31Å; R301-Q304 PolarHBondContact O-N 2.7Å; T302-Q304 VanDerWaalsContact C-N 3.28Å; T302-Q304 PolarHBondContact O-N 2.87Å; Q304-F306 PolarHBondContact O-N 3.07Å; Q304-H307 WeakPolarHBondContact O-CB 3.03Å; Q304-H307 PolarHBondContact O-N 2.85Å; Q304-H307 VanDerWaalsContact O-N 3.11Å; Q304-I310 WeakPolarHBondContact O-CB 3.48Å; Q304-I310 WeakPolarHBondContact O-CG2 3.5Å
305	Q	93.9	Very high	93.5	Very high	65 Å²	65	54.5 Å²	54.5	30%	0.304	27%	0.267	S	S	.	.	H	α-helix	trans	-65.8	-27.4	-177.3	-71.9	-171.9	-72.5	0	0	113.2	R301 A332	R301-Q305 HydrophobicContact CG-CG 4.22Å; R301-Q305 WeakPolarHBondContact O-CB 3.19Å; R301-Q305 WeakPolarHBondContact O-CG 3.43Å; R301-Q305 PolarHBondContact O-N 3.17Å; Q305-A332 HydrophobicContact CB-CB 3.94Å
306	F	94.9	Very high	93.5	Very high	7 Å²	7	53.9 Å²	53.9	3%	0.031	26%	0.262	C	S	.	.	T	Hydrogen-bonded Turn	trans	-110.9	29.8	175.1	-63	-104.5	0	0	0	110.7	V229 L230 Y233 R261 T302 E303 Q304 Y311 F330 A332	V229-F306 HydrophobicContact CG1-CD1 4.32Å; V229-F306 HydrophobicContact CG1-CE1 4Å; L230-F306 WeakPolarHBondContact CD1-O 3.13Å; Y233-F306 AromaticContact CD1-CD1 3.63Å; Y233-F306 HydrophobicContact CD1-CD1 3.63Å; Y233-F306 AromaticContact CD1-CD2 3.9Å; Y233-F306 HydrophobicContact CD1-CD2 3.9Å; Y233-F306 AromaticContact CD1-CE1 3.46Å; Y233-F306 HydrophobicContact CD1-CE1 3.46Å; Y233-F306 VanDerWaalsContact CD1-CE1 3.46Å; Y233-F306 AromaticContact CD1-CE2 3.78Å; Y233-F306 HydrophobicContact CD1-CE2 3.78Å; Y233-F306 AromaticContact CD1-CG 3.85Å; Y233-F306 HydrophobicContact CD1-CG 3.85Å; Y233-F306 AromaticContact CD1-CZ 3.55Å; Y233-F306 HydrophobicContact CD1-CZ 3.55Å; Y233-F306 HydrophobicContact CE1-CD1 4.17Å; Y233-F306 AromaticContact CE1-CD2 3.85Å; Y233-F306 HydrophobicContact CE1-CD2 3.85Å; Y233-F306 AromaticContact CE1-CE1 3.65Å; Y233-F306 HydrophobicContact CE1-CE1 3.65Å; Y233-F306 AromaticContact CE1-CE2 3.31Å; Y233-F306 HydrophobicContact CE1-CE2 3.31Å; Y233-F306 HydrophobicContact CE1-CG 4.26Å; Y233-F306 AromaticContact CE1-CZ 3.19Å; Y233-F306 HydrophobicContact CE1-CZ 3.19Å; Y233-F306 HydrophobicContact CG-CD1 4.21Å; Y233-F306 AromaticContact CG-CE1 3.95Å; Y233-F306 HydrophobicContact CG-CE1 3.95Å; Y233-F306 HydrophobicContact CG-CZ 4.34Å; Y233-F306 AromaticContact CZ-CZ 3.76Å; R261-F306 VanDerWaalsContact CZ-O 3.27Å; R261-F306 PolarHBondContact NE-O 2.94Å; R261-F306 VanDerWaalsContact NE-O 3.14Å; R261-F306 PolarHBondContact NH2-O 3.21Å; T302-F306 HydrophobicContact CG2-CD2 4.21Å; T302-F306 WeakPolarHBondContact O-CB 3.38Å; T302-F306 PolarHBondContact O-N 3.27Å; E303-F306 CarbonylContact O-C 3.44Å; Q304-F306 PolarHBondContact O-N 3.07Å; F306-Y311 AromaticContact CD1-CD2 3.56Å; F306-Y311 HydrophobicContact CD1-CD2 3.56Å; F306-Y311 AromaticContact CD1-CE2 3.46Å; F306-Y311 HydrophobicContact CD1-CE2 3.46Å; F306-Y311 VanDerWaalsContact CD1-CE2 3.46Å; F306-Y311 HydrophobicContact CE1-CD2 4.01Å; F306-Y311 AromaticContact CE1-CE2 3.54Å; F306-Y311 HydrophobicContact CE1-CE2 3.54Å; F306-Y311 HydrophobicContact CG-CD2 4.19Å; F306-Y311 HydrophobicContact CG-CE2 4.48Å; F306-F330 WeakPolarHBondContact CZ-O 3.27Å; F306-A332 HydrophobicContact CD2-CB 4.35Å; F306-A332 HydrophobicContact CE1-CB 4.49Å; F306-A332 HydrophobicContact CE2-CB 3.87Å; F306-A332 HydrophobicContact CZ-CB 3.95Å
307	H	95.1	Very high	93.4	Very high	20 Å²	20	52.9 Å²	52.9	9%	0.093	26%	0.26	C	S	.	.	S	Bend	trans	-73.7	140.7	166.1	-169	-86	0	0	0	109.1	Y269 R270 A271 E303 Q304 E309 I310 Y311	Y269-H307 AromaticContact CD2-CD2 3.8Å; Y269-H307 AromaticContact CD2-NE2 3.99Å; Y269-H307 AromaticContact CE2-CD2 3.61Å; Y269-H307 PolarHBondContact O-NE2 3.35Å; R270-H307 VanDerWaalsContact C-NE2 3.33Å; R270-H307 WeakPolarHBondContact CA-NE2 3.48Å; R270-H307 PolarHBondContact N-NE2 2.96Å; A271-H307 HydrophobicContact CB-CB 4.26Å; A271-H307 PolarHBondContact N-CD2 2.88Å; E303-H307 WeakPolarHBondContact O-CB 3.38Å; E303-H307 PolarHBondContact O-N 2.94Å; E303-H307 VanDerWaalsContact O-N 3.11Å; Q304-H307 WeakPolarHBondContact O-CB 3.03Å; Q304-H307 PolarHBondContact O-N 2.85Å; Q304-H307 VanDerWaalsContact O-N 3.11Å; H307-E309 WeakPolarHBondContact CE1-CG 3.48Å; H307-E309 IonicContact CE1-OE1 3.39Å; H307-E309 PolarHBondContact CE1-OE1 3.39Å; H307-E309 IonicContact CE1-OE2 3.73Å; H307-E309 PolarHBondContact CE1-OE2 2.83Å; H307-E309 WeakPolarHBondContact ND1-CB 3.17Å; H307-E309 PolarHBondContact ND1-N 2.77Å; H307-E309 VanDerWaalsContact ND1-N 3.14Å; H307-E309 IonicContact ND1-OE2 2.69Å; H307-E309 PolarHBondContact ND1-OE2 2.79Å; H307-E309 PolarHBondContact O-N 3.29Å; H307-E309 VanDerWaalsContact O-N 3.1Å; H307-I310 HydrophobicContact CB-CB 4.2Å; H307-I310 HydrophobicContact CB-CG1 4.03Å; H307-I310 PolarHBondContact O-N 3.17Å; H307-Y311 WeakPolarHBondContact O-CB 3.45Å; H307-Y311 PolarHBondContact O-N 3.42Å
308	P	93.4	Very high	93	Very high	65 Å²	65	51 Å²	51	42%	0.422	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.4	-30.3	179.8	-29.3	36.6	0	0	0	115.1	L230 P264 I310	L230-P308 HydrophobicContact CD1-CG 4.36Å; L230-P308 HydrophobicContact CD2-CB 4.37Å; L230-P308 HydrophobicContact CD2-CG 4.47Å; P264-P308 HydrophobicContact CB-CG 4.15Å; P264-P308 HydrophobicContact CG-CG 4.37Å; P308-I310 VanDerWaalsContact C-N 3.34Å
309	E	91.3	Very high	92.7	Very high	127 Å²	127	53 Å²	53	59%	0.593	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.2	-14.5	178.1	-60.1	165.5	164.2	0	0	113.5	A271 H307	A271-E309 WeakPolarHBondContact CB-OE2 3.18Å; H307-E309 WeakPolarHBondContact CE1-CG 3.48Å; H307-E309 IonicContact CE1-OE1 3.39Å; H307-E309 PolarHBondContact CE1-OE1 3.39Å; H307-E309 IonicContact CE1-OE2 3.73Å; H307-E309 PolarHBondContact CE1-OE2 2.83Å; H307-E309 WeakPolarHBondContact ND1-CB 3.17Å; H307-E309 PolarHBondContact ND1-N 2.77Å; H307-E309 VanDerWaalsContact ND1-N 3.14Å; H307-E309 IonicContact ND1-OE2 2.69Å; H307-E309 PolarHBondContact ND1-OE2 2.79Å; H307-E309 PolarHBondContact O-N 3.29Å; H307-E309 VanDerWaalsContact O-N 3.1Å
310	I	93.8	Very high	92.4	Very high	64 Å²	64	58.2 Å²	58.2	33%	0.328	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-117.8	-33.1	-170	-56.2	-61.2	0	0	0	112.2	A271 Q304 H307 P308 K312 S313	A271-I310 HydrophobicContact CB-CD1 3.91Å; A271-I310 HydrophobicContact CB-CG1 3.58Å; Q304-I310 WeakPolarHBondContact O-CB 3.48Å; Q304-I310 WeakPolarHBondContact O-CG2 3.5Å; H307-I310 HydrophobicContact CB-CB 4.2Å; H307-I310 HydrophobicContact CB-CG1 4.03Å; H307-I310 PolarHBondContact O-N 3.17Å; P308-I310 VanDerWaalsContact C-N 3.34Å; I310-K312 PolarHBondContact O-N 2.87Å; I310-S313 PolarHBondContact O-N 3.19Å; I310-S313 VanDerWaalsContact O-N 3.14Å; I310-S313 PolarHBondContact O-OG 2.9Å
311	Y	94.5	Very high	91.8	Very high	21 Å²	21	64.8 Å²	64.8	8%	0.082	32%	0.321	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.8	124.6	-179.3	-176.5	-114.9	0	0	0	110.4	N226 V229 L230 F306 H307 S313	N226-Y311 HydrophobicContact CB-CE1 4.11Å; N226-Y311 VanDerWaalsContact O-CE1 3.31Å; N226-Y311 WeakPolarHBondContact O-CE1 3.47Å; V229-Y311 HydrophobicContact CG1-CE2 4.23Å; V229-Y311 WeakPolarHBondContact CG1-OH 3.27Å; L230-Y311 HydrophobicContact CB-CD1 4.02Å; L230-Y311 HydrophobicContact CB-CE1 4Å; L230-Y311 HydrophobicContact CD1-CD1 3.91Å; L230-Y311 HydrophobicContact CD1-CG 3.96Å; L230-Y311 HydrophobicContact CD2-CD1 4.29Å; L230-Y311 HydrophobicContact CG-CD1 4.29Å; F306-Y311 AromaticContact CD1-CD2 3.56Å; F306-Y311 HydrophobicContact CD1-CD2 3.56Å; F306-Y311 AromaticContact CD1-CE2 3.46Å; F306-Y311 HydrophobicContact CD1-CE2 3.46Å; F306-Y311 VanDerWaalsContact CD1-CE2 3.46Å; F306-Y311 HydrophobicContact CE1-CD2 4.01Å; F306-Y311 AromaticContact CE1-CE2 3.54Å; F306-Y311 HydrophobicContact CE1-CE2 3.54Å; F306-Y311 HydrophobicContact CG-CD2 4.19Å; F306-Y311 HydrophobicContact CG-CE2 4.48Å; H307-Y311 WeakPolarHBondContact O-CB 3.45Å; H307-Y311 PolarHBondContact O-N 3.42Å; Y311-S313 PolarHBondContact O-N 2.93Å; Y311-S313 VanDerWaalsContact O-N 3.07Å
312	K	92.8	Very high	91.3	Very high	43 Å²	43	62.5 Å²	62.5	19%	0.187	33%	0.325	C	S	.	.	T	Hydrogen-bonded Turn	trans	61.2	4	-176.4	-48	-73.7	169.3	155.6	0	115.6	N226 I310 T314 P329 C331 A332 F333 A334	N226-K312 WeakPolarHBondContact OD1-CE 3.44Å; N226-K312 PolarHBondContact OD1-NZ 3.07Å; I310-K312 PolarHBondContact O-N 2.87Å; K312-T314 PolarHBondContact O-N 3.27Å; K312-P329 PolarHBondContact NZ-O 3.48Å; K312-C331 WeakPolarHBondContact CE-O 3.5Å; K312-C331 PolarHBondContact NZ-O 3.11Å; K312-A332 PolarHBondContact N-O 3.16Å; K312-F333 WeakPolarHBondContact CD-O 3.5Å; K312-A334 HydrophobicContact CB-CB 4.31Å; K312-A334 VanDerWaalsContact O-CB 3.3Å; K312-A334 WeakPolarHBondContact O-CB 3.32Å
313	S	91.6	Very high	90.8	Very high	80 Å²	80	64.8 Å²	64.8	56%	0.559	35%	0.352	S	S	*	.	S	Bend	trans	-65.5	-24.7	-179	73.9	0	0	0	0	113.9	I310 Y311	I310-S313 PolarHBondContact O-N 3.19Å; I310-S313 VanDerWaalsContact O-N 3.14Å; I310-S313 PolarHBondContact O-OG 2.9Å; Y311-S313 PolarHBondContact O-N 2.93Å; Y311-S313 VanDerWaalsContact O-N 3.07Å
314	T	92.1	Very high	90.3	Very high	82 Å²	82	67.7 Å²	67.7	50%	0.503	37%	0.373	S	S	.	.	S	Bend	trans	-117.8	138.9	-178.2	-59.8	0	0	0	0	110.9	K312 F333 A334	K312-T314 PolarHBondContact O-N 3.27Å; T314-F333 HydrophobicContact CG2-CD1 4.18Å; T314-F333 HydrophobicContact CG2-CE1 4.38Å; T314-F333 CarbonylContact O-C 3.59Å; T314-F333 WeakPolarHBondContact O-CA 3.27Å; T314-F333 WeakPolarHBondContact O-CB 3.5Å; T314-A334 PolarHBondContact O-N 3.28Å
315	K	91.4	Very high	89.9	Confident	136 Å²	136	65.9 Å²	65.9	59%	0.591	37%	0.366	S	S	*	.	B	Isolated β-bridge	trans	-66.6	141.8	179.8	-64.1	-176.3	-179.7	-178.5	0	111.8	N317	K315-N317 PolarHBondContact O-N 3.33Å
316	C	92.6	Very high	89.5	Confident	1 Å²	1	63.6 Å²	63.6	1%	0.007	36%	0.357	C	S	.	.			trans	-79.5	114.4	-178.1	-176.5	0	0	0	0	111.6	D318 M319 Q320 R327 F333 A334 H335	C316-D318 PolarHBondContact O-N 3.28Å; C316-M319 HydrophobicContact CB-CB 3.91Å; C316-M319 PolarHBondContact O-N 2.84Å; C316-Q320 WeakPolarHBondContact O-CG 3.48Å; C316-Q320 PolarHBondContact O-N 2.91Å; C316-R327 PolarHBondContact SG-NH2 2.7Å; C316-F333 HydrophobicContact CB-CB 3.62Å; C316-A334 WeakPolarHBondContact CB-O 3.46Å; C316-A334 PolarHBondContact N-O 3.24Å; C316-H335 VanDerWaalsContact CB-CD2 3.5Å; C316-H335 WeakPolarHBondContact CB-CD2 3.31Å
317	N	90.6	Very high	89.2	Confident	89 Å²	89	65.6 Å²	65.6	48%	0.476	36%	0.364	S	S	.	.	H	α-helix	trans	-61.3	-41	-179.1	-178.7	-113.5	0	0	0	112.9	K315 M319 Q320 Q321	K315-N317 PolarHBondContact O-N 3.33Å; N317-M319 VanDerWaalsContact C-N 3.31Å; N317-M319 PolarHBondContact O-N 3.33Å; N317-Q320 PolarHBondContact O-N 3.49Å; N317-Q320 VanDerWaalsContact O-N 3.15Å; N317-Q321 PolarHBondContact ND2-NE2 3.12Å; N317-Q321 VanDerWaalsContact ND2-NE2 3.16Å; N317-Q321 WeakPolarHBondContact O-CG 3.2Å; N317-Q321 PolarHBondContact O-N 3.35Å; N317-Q321 PolarHBondContact OD1-OE1 3Å
318	D	87.6	Confident	88.9	Confident	48 Å²	48	65.7 Å²	65.7	26%	0.257	37%	0.37	S	S	.	.	H	α-helix	trans	-56.4	-46.2	176	-41.4	-135.8	0	0	0	111	C316 Q320 Q321 C322 S324 C325 R327	C316-D318 PolarHBondContact O-N 3.28Å; D318-Q320 PolarHBondContact O-N 3.45Å; D318-Q321 PolarHBondContact O-N 3.39Å; D318-C322 WeakPolarHBondContact O-CB 3.21Å; D318-C322 PolarHBondContact O-N 3.1Å; D318-S324 CarbonylContact C-O 3.54Å; D318-C325 HydrophobicContact CB-CB 4.36Å; D318-R327 VanDerWaalsContact CG-NH1 3.29Å; D318-R327 IonicContact OD1-CZ 2.84Å; D318-R327 IonicContact OD1-NH1 2.72Å; D318-R327 PolarHBondContact OD1-NH1 3.09Å; D318-R327 IonicContact OD1-NH2 3.57Å; D318-R327 IonicContact OD2-CZ 3.58Å; D318-R327 IonicContact OD2-NH1 3.67Å; D318-R327 PolarHBondContact OD2-NH1 2.68Å; D318-R327 VanDerWaalsContact OD2-NH1 3.17Å; D318-R327 IonicContact OD2-NH2 3.64Å; D318-R327 PolarHBondContact OD2-NH2 2.88Å
319	M	87.1	Confident	88.7	Confident	43 Å²	43	63.1 Å²	63.1	21%	0.212	35%	0.354	C	S	.	.	H	α-helix	trans	-66.8	-37.2	179.1	-174.2	59.4	74.3	0	0	111.9	C316 N317 G323 C325 H335	C316-M319 HydrophobicContact CB-CB 3.91Å; C316-M319 PolarHBondContact O-N 2.84Å; N317-M319 VanDerWaalsContact C-N 3.31Å; N317-M319 PolarHBondContact O-N 3.33Å; M319-G323 WeakPolarHBondContact O-CA 3.3Å; M319-G323 PolarHBondContact O-N 3.21Å; M319-G323 VanDerWaalsContact O-N 3.14Å; M319-C325 HydrophobicContact CE-CB 3.94Å; M319-H335 HydrophobicContact CE-CB 3.98Å; M319-H335 HydrophobicContact CG-CB 4.13Å
320	Q	87.3	Confident	88.8	Confident	117 Å²	117	57.2 Å²	57.2	55%	0.547	33%	0.326	S	S	.	.	H	α-helix	trans	-71	-30.4	177.7	-70	178.1	-72.2	0	0	113.5	C316 N317 D318	C316-Q320 WeakPolarHBondContact O-CG 3.48Å; C316-Q320 PolarHBondContact O-N 2.91Å; N317-Q320 PolarHBondContact O-N 3.49Å; N317-Q320 VanDerWaalsContact O-N 3.15Å; D318-Q320 PolarHBondContact O-N 3.45Å
321	Q	82	Confident	88.8	Confident	141 Å²	141	54.2 Å²	54.2	66%	0.659	31%	0.31	S	S	*	.	H	α-helix	trans	-95	-34.5	-177.5	-69.3	-177.6	-9.3	0	0	113.4	N317 D318	N317-Q321 PolarHBondContact ND2-NE2 3.12Å; N317-Q321 VanDerWaalsContact ND2-NE2 3.16Å; N317-Q321 WeakPolarHBondContact O-CG 3.2Å; N317-Q321 PolarHBondContact O-N 3.35Å; N317-Q321 PolarHBondContact OD1-OE1 3Å; D318-Q321 PolarHBondContact O-N 3.39Å
322	C	82.8	Confident	88.8	Confident	90 Å²	90	53.7 Å²	53.7	61%	0.608	31%	0.31	S	S	*	.	H	α-helix	trans	-119.8	3.9	-170.1	-57.5	0	0	0	0	114.1	D318 S324	D318-C322 WeakPolarHBondContact O-CB 3.21Å; D318-C322 PolarHBondContact O-N 3.1Å; C322-S324 PolarHBondContact O-N 2.87Å; C322-S324 PolarHBondContact O-OG 3.18Å; C322-S324 VanDerWaalsContact O-OG 3.07Å
323	G	81.8	Confident	88.9	Confident	66 Å²	66	55.1 Å²	55.1	68%	0.68	32%	0.317	S	S	*	.	S	Bend	trans	61.3	8.7	-178.5	0	0	0	0	0	114.8	M319	M319-G323 WeakPolarHBondContact O-CA 3.3Å; M319-G323 PolarHBondContact O-N 3.21Å; M319-G323 VanDerWaalsContact O-N 3.14Å
324	S	84.8	Confident	88.9	Confident	63 Å²	63	52.6 Å²	52.6	44%	0.441	30%	0.301	S	S	.	.			trans	-155.8	156.6	-174	57.6	0	0	0	0	109.3	D318 C322	D318-S324 CarbonylContact C-O 3.54Å; C322-S324 PolarHBondContact O-N 2.87Å; C322-S324 PolarHBondContact O-OG 3.18Å; C322-S324 VanDerWaalsContact O-OG 3.07Å
325	C	87.2	Confident	88.7	Confident	15 Å²	15	51 Å²	51	10%	0.101	29%	0.287	C	S	.	.			trans	-138.2	122.7	179.8	175.5	0	0	0	0	110.1	D318 M319 R327 G328 C331 H335	D318-C325 HydrophobicContact CB-CB 4.36Å; M319-C325 HydrophobicContact CE-CB 3.94Å; C325-R327 PolarHBondContact O-N 3.37Å; C325-G328 PolarHBondContact O-N 3.16Å; C325-G328 VanDerWaalsContact O-N 3.08Å; C325-C331 VanDerWaalsContact SG-SG 3.67Å; C325-H335 VanDerWaalsContact CB-CE1 3.49Å; C325-H335 WeakPolarHBondContact CB-CE1 3.37Å; C325-H335 VanDerWaalsContact CB-NE2 3.28Å; C325-H335 WeakPolarHBondContact CB-NE2 3.43Å; C325-H335 PolarHBondContact SG-NE2 3.15Å
326	P	85.3	Confident	87.8	Confident	18 Å²	18	49.2 Å²	49.2	12%	0.117	29%	0.288	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.9	-7.6	-175.4	29.9	-37.2	0	0	0	113.8	Q206 Y249	Q206-P326 HydrophobicContact CB-CB 4.14Å; Q206-P326 HydrophobicContact CG-CB 3.8Å; Q206-P326 HydrophobicContact CG-CG 4.22Å; Y249-P326 WeakPolarHBondContact CE2-O 3.34Å
327	R	88.8	Confident	86	Confident	49 Å²	49	56.9 Å²	56.9	19%	0.185	32%	0.324	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.8	-8.2	177.1	-57	-180	-66.7	-84.7	3	113.1	Y249 C316 D318 C325 F330 C331	Y249-R327 HydrophobicContact CD2-CB 4.08Å; Y249-R327 HydrophobicContact CD2-CG 3.78Å; Y249-R327 HydrophobicContact CE2-CB 4.3Å; Y249-R327 HydrophobicContact CE2-CG 3.84Å; Y249-R327 HydrophobicContact CG-CG 4.16Å; C316-R327 PolarHBondContact SG-NH2 2.7Å; D318-R327 VanDerWaalsContact CG-NH1 3.29Å; D318-R327 IonicContact OD1-CZ 2.84Å; D318-R327 IonicContact OD1-NH1 2.72Å; D318-R327 PolarHBondContact OD1-NH1 3.09Å; D318-R327 IonicContact OD1-NH2 3.57Å; D318-R327 IonicContact OD2-CZ 3.58Å; D318-R327 IonicContact OD2-NH1 3.67Å; D318-R327 PolarHBondContact OD2-NH1 2.68Å; D318-R327 VanDerWaalsContact OD2-NH1 3.17Å; D318-R327 IonicContact OD2-NH2 3.64Å; D318-R327 PolarHBondContact OD2-NH2 2.88Å; C325-R327 PolarHBondContact O-N 3.37Å; R327-F330 CarbonylContact O-C 3.54Å; R327-F330 WeakPolarHBondContact O-CA 3.43Å; R327-F330 WeakPolarHBondContact O-CB 3.32Å; R327-F330 PolarHBondContact O-N 2.91Å; R327-F330 VanDerWaalsContact O-N 3.15Å; R327-C331 HydrophobicContact CB-CB 3.86Å; R327-C331 PolarHBondContact NE-SG 3.22Å; R327-C331 VanDerWaalsContact NE-SG 3.38Å; R327-C331 PolarHBondContact NH2-SG 2.9Å; R327-C331 VanDerWaalsContact NH2-SG 3.37Å; R327-C331 PolarHBondContact O-N 2.81Å
328	G	88.6	Confident	83.4	Confident	21 Å²	21	61.4 Å²	61.4	22%	0.216	34%	0.339	C	S	.	.	G	3₁₀ helix	trans	53	-141.2	177.4	0	0	0	0	0	113.3	C325 F330 C331 H335	C325-G328 PolarHBondContact O-N 3.16Å; C325-G328 VanDerWaalsContact O-N 3.08Å; G328-F330 PolarHBondContact O-N 2.92Å; G328-C331 VanDerWaalsContact O-CB 3.27Å; G328-C331 WeakPolarHBondContact O-CB 3.32Å; G328-C331 PolarHBondContact O-N 3.29Å; G328-C331 VanDerWaalsContact O-N 3.11Å; G328-H335 PolarHBondContact O-CE1 3.07Å
329	P	89.8	Confident	80.8	Confident	12 Å²	12	64.6 Å²	64.6	8%	0.078	36%	0.362	C	S	.	.	G	3₁₀ helix	trans	-64.4	-27.1	176.5	26.4	-32.9	0	0	0	112.8	I213 L217 W223 K312 C331	I213-P329 HydrophobicContact CG2-CG 4.45Å; L217-P329 HydrophobicContact CD1-CG 4.13Å; L217-P329 HydrophobicContact CD2-CG 4Å; W223-P329 WeakPolarHBondContact O-CB 3.37Å; W223-P329 WeakPolarHBondContact O-CG 3.27Å; K312-P329 PolarHBondContact NZ-O 3.48Å; P329-C331 PolarHBondContact O-N 3.41Å
330	F	93.4	Very high	78.1	Confident	3 Å²	3	72.5 Å²	72.5	1%	0.013	40%	0.396	C	S	.	.	G	3₁₀ helix	trans	-71.4	8.8	172.8	-48.7	-37.9	0	0	0	113.9	I213 I216 W223 V229 Y233 Y249 P252 F306 R327 G328 A332	I213-F330 HydrophobicContact CD1-CD2 4.32Å; I213-F330 HydrophobicContact CG1-CD2 3.98Å; I213-F330 HydrophobicContact CG1-CE2 4.08Å; I213-F330 HydrophobicContact CG2-CE2 4.46Å; I216-F330 HydrophobicContact CG2-CZ 4.09Å; W223-F330 HydrophobicContact CB-CE1 3.86Å; W223-F330 HydrophobicContact CB-CZ 3.96Å; W223-F330 HydrophobicContact CD2-CE1 4.02Å; W223-F330 HydrophobicContact CD2-CZ 4.31Å; W223-F330 AromaticContact CE3-CE1 3.79Å; W223-F330 HydrophobicContact CE3-CE1 3.79Å; W223-F330 HydrophobicContact CE3-CZ 4.5Å; W223-F330 HydrophobicContact CG-CE1 4.08Å; W223-F330 HydrophobicContact CG-CZ 4.09Å; V229-F330 HydrophobicContact CG1-CD1 4.42Å; V229-F330 HydrophobicContact CG2-CD1 4.16Å; V229-F330 HydrophobicContact CG2-CE1 4.22Å; Y233-F330 HydrophobicContact CD2-CB 4.43Å; Y233-F330 AromaticContact CD2-CD1 3.78Å; Y233-F330 HydrophobicContact CD2-CD1 3.78Å; Y233-F330 HydrophobicContact CD2-CE1 4.33Å; Y233-F330 HydrophobicContact CD2-CG 4.18Å; Y233-F330 HydrophobicContact CE2-CB 3.74Å; Y233-F330 AromaticContact CE2-CD1 3.83Å; Y233-F330 HydrophobicContact CE2-CD1 3.83Å; Y233-F330 HydrophobicContact CE2-CD2 4.39Å; Y233-F330 AromaticContact CE2-CG 3.73Å; Y233-F330 HydrophobicContact CE2-CG 3.73Å; Y249-F330 WeakPolarHBondContact O-CD2 3.18Å; P252-F330 HydrophobicContact CB-CE1 3.92Å; P252-F330 HydrophobicContact CB-CE2 4.49Å; P252-F330 HydrophobicContact CB-CZ 3.85Å; P252-F330 HydrophobicContact CG-CE1 4.48Å; P252-F330 HydrophobicContact CG-CE2 4.5Å; P252-F330 HydrophobicContact CG-CZ 3.94Å; F306-F330 WeakPolarHBondContact CZ-O 3.27Å; R327-F330 CarbonylContact O-C 3.54Å; R327-F330 WeakPolarHBondContact O-CA 3.43Å; R327-F330 WeakPolarHBondContact O-CB 3.32Å; R327-F330 PolarHBondContact O-N 2.91Å; R327-F330 VanDerWaalsContact O-N 3.15Å; G328-F330 PolarHBondContact O-N 2.92Å; F330-A332 PolarHBondContact O-N 2.88Å
331	C	93.2	Very high	75.3	Confident	0 Å²	0	71.2 Å²	71.2	0%	0	41%	0.405	C	S	.	.			trans	-72.1	122	165.2	-167.4	0	0	0	0	110.7	K312 C325 R327 G328 P329 F333 H335	K312-C331 WeakPolarHBondContact CE-O 3.5Å; K312-C331 PolarHBondContact NZ-O 3.11Å; C325-C331 VanDerWaalsContact SG-SG 3.67Å; R327-C331 HydrophobicContact CB-CB 3.86Å; R327-C331 PolarHBondContact NE-SG 3.22Å; R327-C331 VanDerWaalsContact NE-SG 3.38Å; R327-C331 PolarHBondContact NH2-SG 2.9Å; R327-C331 VanDerWaalsContact NH2-SG 3.37Å; R327-C331 PolarHBondContact O-N 2.81Å; G328-C331 VanDerWaalsContact O-CB 3.27Å; G328-C331 WeakPolarHBondContact O-CB 3.32Å; G328-C331 PolarHBondContact O-N 3.29Å; G328-C331 VanDerWaalsContact O-N 3.11Å; P329-C331 PolarHBondContact O-N 3.41Å; C331-F333 PolarHBondContact O-N 2.8Å; C331-H335 VanDerWaalsContact CB-NE2 3.27Å; C331-H335 WeakPolarHBondContact CB-NE2 3.48Å; C331-H335 PolarHBondContact SG-NE2 2.77Å
332	A	93.7	Very high	72.8	Confident	10 Å²	10	69 Å²	69	8%	0.083	41%	0.411	C	S	.	.	S	Bend	trans	-68.1	-11.7	173.9	0	0	0	0	0	114.3	Q305 F306 K312 F330	Q305-A332 HydrophobicContact CB-CB 3.94Å; F306-A332 HydrophobicContact CD2-CB 4.35Å; F306-A332 HydrophobicContact CE1-CB 4.49Å; F306-A332 HydrophobicContact CE2-CB 3.87Å; F306-A332 HydrophobicContact CZ-CB 3.95Å; K312-A332 PolarHBondContact N-O 3.16Å; F330-A332 PolarHBondContact O-N 2.88Å
333	F	94.6	Very high	70.3	Confident	73 Å²	73	74 Å²	74	32%	0.32	43%	0.426	S	S	.	.	S	Bend	trans	-102.7	150.3	-178	-60.6	-79.7	0	0	0	111.2	K312 T314 C316 C331 H335	K312-F333 WeakPolarHBondContact CD-O 3.5Å; T314-F333 HydrophobicContact CG2-CD1 4.18Å; T314-F333 HydrophobicContact CG2-CE1 4.38Å; T314-F333 CarbonylContact O-C 3.59Å; T314-F333 WeakPolarHBondContact O-CA 3.27Å; T314-F333 WeakPolarHBondContact O-CB 3.5Å; C316-F333 HydrophobicContact CB-CB 3.62Å; C331-F333 PolarHBondContact O-N 2.8Å; F333-H335 PolarHBondContact O-N 3.1Å
334	A	91.5	Very high	67.9	Low	27 Å²	27	79 Å²	79	22%	0.223	43%	0.431	C	S	.	.	B	Isolated β-bridge	trans	-63.7	128.2	178.7	0	0	0	0	0	111.4	K312 T314 C316	K312-A334 HydrophobicContact CB-CB 4.31Å; K312-A334 VanDerWaalsContact O-CB 3.3Å; K312-A334 WeakPolarHBondContact O-CB 3.32Å; T314-A334 PolarHBondContact O-N 3.28Å; C316-A334 WeakPolarHBondContact CB-O 3.46Å; C316-A334 PolarHBondContact N-O 3.24Å
335	H	89.7	Confident	65.3	Low	48 Å²	48	80.7 Å²	80.7	22%	0.222	44%	0.443	C	S	.	.	P	Polyproline II helix	trans	-88.7	141.4	161.2	-62.6	168.5	0	0	0	107.5	C316 M319 C325 G328 C331 F333 E337	C316-H335 VanDerWaalsContact CB-CD2 3.5Å; C316-H335 WeakPolarHBondContact CB-CD2 3.31Å; M319-H335 HydrophobicContact CE-CB 3.98Å; M319-H335 HydrophobicContact CG-CB 4.13Å; C325-H335 VanDerWaalsContact CB-CE1 3.49Å; C325-H335 WeakPolarHBondContact CB-CE1 3.37Å; C325-H335 VanDerWaalsContact CB-NE2 3.28Å; C325-H335 WeakPolarHBondContact CB-NE2 3.43Å; C325-H335 PolarHBondContact SG-NE2 3.15Å; G328-H335 PolarHBondContact O-CE1 3.07Å; C331-H335 VanDerWaalsContact CB-NE2 3.27Å; C331-H335 WeakPolarHBondContact CB-NE2 3.48Å; C331-H335 PolarHBondContact SG-NE2 2.77Å; F333-H335 PolarHBondContact O-N 3.1Å; H335-E337 PolarHBondContact O-N 3.36Å
336	V	71.8	Confident	62.4	Low	99 Å²	99	87.1 Å²	87.1	60%	0.6	48%	0.475	S	S	*	.	P	Polyproline II helix	trans	-76.8	116.2	168.5	-179	0	0	0	0	106.2	K338	V336-K338 PolarHBondContact O-N 2.82Å; V336-K338 VanDerWaalsContact O-N 3.17Å
337	E	54	Low	59.8	Low	162 Å²	162	94.9 Å²	94.9	76%	0.757	51%	0.507	S	S	*	.			trans	-66	115.5	172.2	-68.7	-176.8	159.2	0	0	108.5	H335 P339	H335-E337 PolarHBondContact O-N 3.36Å; E337-P339 WeakPolarHBondContact O-CD 3.43Å
338	K	35.8	Very low	57.1	Low	184 Å²	184	98.5 Å²	98.5	80%	0.8	54%	0.537	S	S	*	.			trans	-75.3	119	159.5	-172.8	178.6	-177.4	-174.8	0	105.3	V336 F340	V336-K338 PolarHBondContact O-N 2.82Å; V336-K338 VanDerWaalsContact O-N 3.17Å; K338-F340 PolarHBondContact O-N 3.27Å
339	P	34.4	Very low	54.1	Low	115 Å²	115	103 Å²	103	75%	0.747	57%	0.565	S	S	*	*			trans	-55.6	129.3	176.9	-24.9	34.7	0	0	0	109.4	E337 A341	E337-P339 WeakPolarHBondContact O-CD 3.43Å; P339-A341 PolarHBondContact O-N 3.07Å
340	F	30.5	Very low	51.6	Low	210 Å²	210	108.8 Å²	108.8	92%	0.921	60%	0.603	S	S	*	*			trans	-70.8	89	169.7	-79.5	-92.7	0	0	0	108	K338 A342	K338-F340 PolarHBondContact O-N 3.27Å; F340-A342 PolarHBondContact O-N 2.84Å
341	A	27.7	Very low	48.6	Very low	90 Å²	90	111.9 Å²	111.9	74%	0.744	64%	0.635	S	S	*	*			trans	-59.2	116	152.6	0	0	0	0	0	106.5	P339 E343	P339-A341 PolarHBondContact O-N 3.07Å; A341-E343 PolarHBondContact O-N 3.26Å
342	A	28.7	Very low	45.5	Very low	94 Å²	94	117.7 Å²	117.7	78%	0.777	68%	0.676	S	S	*	*			trans	-64.5	122.1	168.7	0	0	0	0	0	107.6	F340 E344	F340-A342 PolarHBondContact O-N 2.84Å; A342-E344 VanDerWaalsContact C-N 3.3Å; A342-E344 PolarHBondContact O-N 2.95Å
343	E	31.4	Very low	42.7	Very low	196 Å²	196	122.8 Å²	122.8	92%	0.916	71%	0.708	S	S	*	*			trans	-70.2	95.3	164.2	-87.4	-165.2	141.6	0	0	108	A341 S345	A341-E343 PolarHBondContact O-N 3.26Å; E343-S345 PolarHBondContact O-N 3.1Å
344	E	30.1	Very low	39.9	Very low	171 Å²	171	125 Å²	125	80%	0.799	73%	0.729	S	S	*	*			trans	-66.1	116	167.7	-169.5	167.6	-162.4	0	0	108.2	A342 I346	A342-E344 VanDerWaalsContact C-N 3.3Å; A342-E344 PolarHBondContact O-N 2.95Å; E344-I346 PolarHBondContact O-N 3.39Å
345	S	30.2	Very low	37.3	Very low	97 Å²	97	129.2 Å²	129.2	68%	0.678	76%	0.755	S	S	*	*			trans	-77.4	83.3	-163.6	58.8	0	0	0	0	112.6	E343 F347	E343-S345 PolarHBondContact O-N 3.1Å; S345-F347 PolarHBondContact O-N 3.47Å
346	I	27.6	Very low	34.7	Very low	151 Å²	151	133.1 Å²	133.1	77%	0.774	79%	0.785	S	S	*	*			trans	-79.9	98.9	175.2	-58	177.9	0	0	0	110	E344	E344-I346 PolarHBondContact O-N 3.39Å
347	F	30.3	Very low	32.8	Very low	181 Å²	181	139.5 Å²	139.5	79%	0.794	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-69	126.3	168.2	-77.5	-95.1	0	0	0	110.9	S345	S345-F347 PolarHBondContact O-N 3.47Å
348	P	31.6	Very low	31.8	Very low	124 Å²	124	139.6 Å²	139.6	81%	0.805	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-82.4	121	173.2	31.3	-32	0	0	0	111.5
349	S	27.1	Very low	32	Very low	115 Å²	115	136.1 Å²	136.1	80%	0.804	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-95.3	145.5	164	-72.4	0	0	0	0	110.4
350	P	36.7	Very low	32	Very low	135 Å²	135	137.6 Å²	137.6	88%	0.877	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-86.4	138.6	-165.4	32.7	-35.8	0	0	0	114.5
351	G	29.4	Very low	32.1	Very low	68 Å²	68	133.6 Å²	133.6	70%	0.701	80%	0.796	S	S	*	*			trans	179.4	112.2	168.6	0	0	0	0	0	116.6
352	S	29.3	Very low	32.2	Very low	122 Å²	122	137 Å²	137	85%	0.853	80%	0.8	S	S	*	*			trans	74	171.8	157.3	-44.4	0	0	0	0	116.1
353	P	34.2	Very low	32.8	Very low	116 Å²	116	138.7 Å²	138.7	75%	0.753	80%	0.803	S	S	*	*				-122	166.1	-106.9	20.2	4.3	0	0	0	115.5
354	P	35.4	Very low	32.5	Very low	119 Å²	119	133.1 Å²	133.1	77%	0.773	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-86	146.3	-173	33.5	-35.9	0	0	0	115
355	P	37.2	Very low	32.6	Very low	117 Å²	117	133.4 Å²	133.4	76%	0.76	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-76	164.4	166.5	32.5	-34.3	0	0	0	112.7
356	P	34.6	Very low	32.4	Very low	130 Å²	130	136.2 Å²	136.2	84%	0.844	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-82.7	157.3	-163	32.1	-37	0	0	0	115.9
357	R	33.3	Very low	32.5	Very low	232 Å²	232	134 Å²	134	88%	0.875	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-89.7	164	166.4	-60	-172.9	-177	-159.5	3.6	111.8
358	L	31.4	Very low	32.4	Very low	165 Å²	165	129.5 Å²	129.5	86%	0.864	79%	0.792	S	S	*	*			trans	167.8	155.9	134.7	-90.1	171.2	0	0	0	108.6
359	P	41.1	Very low	32.1	Very low	110 Å²	110	132.1 Å²	132.1	71%	0.714	79%	0.793	S	S	*	*			cis	-129.6	173.9	-45.7	33.2	-15.8	0	0	0	113.5
360	D	33.3	Very low	32.1	Very low	147 Å²	147	131.8 Å²	131.8	79%	0.786	79%	0.791	S	S	*	*			trans	-65.2	163.6	168.6	-57.7	-83.9	0	0	0	113.4
361	P	32.6	Very low	32.6	Very low	126 Å²	126	131 Å²	131	82%	0.818	79%	0.786	S	S	*	*				-139.8	146.2	116.6	37.1	-25.7	0	0	0	116.4
362	L	29.9	Very low	32.5	Very low	161 Å²	161	132 Å²	132	84%	0.843	80%	0.796	S	S	*	*			trans	-123.7	171.6	159.4	-69.5	175	0	0	0	107.7
363	P	42.7	Very low	32.3	Very low	129 Å²	129	129 Å²	129	84%	0.838	78%	0.784	S	S	*	*			cis	-122.1	177.6	-19.8	33.8	-16.7	0	0	0	112.4
364	G	25.3	Very low	32.1	Very low	80 Å²	80	133.3 Å²	133.3	83%	0.825	79%	0.793	S	S	*	*			trans	-158.1	135.6	171.8	0	0	0	0	0	112.8
365	H	31.3	Very low	31.7	Very low	176 Å²	176	130.6 Å²	130.6	82%	0.815	79%	0.788	S	S	*	*			trans	-111.7	135.4	-176.5	-156.2	-96.5	0	0	0	108.5
366	D	26.6	Very low	31.4	Very low	156 Å²	156	134.7 Å²	134.7	83%	0.834	80%	0.799	S	S	*	*			trans	-165.5	-179.9	135	-129.9	-45.1	0	0	0	113.5
367	V	28.8	Very low	31.1	Very low	106 Å²	106	131.5 Å²	131.5	64%	0.642	79%	0.789	S	S	*	*			trans	-127.4	157	-152.9	156.4	0	0	0	0	114
368	S	27.6	Very low	30.9	Very low	86 Å²	86	129.5 Å²	129.5	60%	0.601	80%	0.795	S	S	*	*			trans	99.9	133.8	149.9	-99.1	0	0	0	0	122.6
369	Q	27.2	Very low	30.6	Very low	178 Å²	178	124.8 Å²	124.8	83%	0.832	79%	0.786	S	S	*	*			trans	87.7	153.5	137.2	-73.6	164.2	65.8	0	0	121.5
370	S	26	Very low	30.2	Very low	109 Å²	109	125.9 Å²	125.9	76%	0.762	80%	0.797	S	S	*	*			trans	-152	-164.1	-170.5	-32.8	0	0	0	0	106.3
371	P	47.3	Very low	30	Very low	119 Å²	119	123.3 Å²	123.3	77%	0.773	80%	0.796	S	S	*	*			cis	-133.2	149.2	-31.6	32.9	-15.5	0	0	0	114.7
372	G	26.6	Very low	30	Very low	88 Å²	88	121.6 Å²	121.6	91%	0.907	79%	0.787	S	S	*	*			trans	68.2	162.1	136.3	0	0	0	0	0	122.9
373	G	26.8	Very low	29.9	Very low	58 Å²	58	119.9 Å²	119.9	60%	0.598	78%	0.778	S	S	*	*			trans	146.2	102.2	159.6	0	0	0	0	0	118.3
374	H	29.5	Very low	29.3	Very low	207 Å²	207	120.9 Å²	120.9	96%	0.958	77%	0.772	S	S	*	*			trans	63.8	159.7	154.4	-40.3	-76.3	0	0	0	118.3
375	G	27	Very low	29.3	Very low	63 Å²	63	126 Å²	126	65%	0.649	77%	0.772	S	S	*	*			cis	163.9	135	-13.6	0	0	0	0	0	113.7
376	M	30.2	Very low	29	Very low	203 Å²	203	122.6 Å²	122.6	100%	1	77%	0.768	S	S	*	*			trans	68.9	156.3	178.7	-38.5	-51.6	-179.9	0	0	116.4
377	G	27.7	Very low	29.9	Very low	62 Å²	62	120.4 Å²	120.4	64%	0.639	76%	0.762	S	S	*	*			cis	168.6	153.1	-11	0	0	0	0	0	114.1
378	L	30.5	Very low	29.9	Very low	190 Å²	190	120.7 Å²	120.7	100%	0.995	77%	0.769	S	S	*	*			trans	66.8	156.1	176	-71.8	75.6	0	0	0	117.5
379	G	25.1	Very low	29.8	Very low	66 Å²	66	120.8 Å²	120.8	68%	0.68	77%	0.774	S	S	*	*			cis	165.3	157.6	-10.1	0	0	0	0	0	114.9
380	S	31.2	Very low	29.7	Very low	134 Å²	134	119.1 Å²	119.1	94%	0.937	78%	0.776	S	S	*	*			trans	67.8	159.9	172.6	-64.2	0	0	0	0	118.8
381	A	30.9	Very low	29.6	Very low	92 Å²	92	118.2 Å²	118.2	76%	0.76	77%	0.77	S	S	*	*			cis	-176.2	177.8	-29.5	0	0	0	0	0	107.2
382	S	31.2	Very low	28.4	Very low	91 Å²	91	117.8 Å²	117.8	64%	0.636	77%	0.768	S	S	*	*			cis	-164.6	176.7	-3.8	-149.2	0	0	0	0	110.2
383	D	29.3	Very low	28.3	Very low	124 Å²	124	119.7 Å²	119.7	66%	0.663	76%	0.762	S	S	*	*			trans	68.3	154.8	146.4	-58.9	-12.3	0	0	0	120
384	H	30	Very low	28.3	Very low	150 Å²	150	121.1 Å²	121.1	69%	0.694	77%	0.768	S	S	*	*			cis	-167.4	168.5	-4.6	-118.8	-3.2	0	0	0	114.1
385	F	24.6	Very low	28.1	Very low	189 Å²	189	118.5 Å²	118.5	83%	0.829	76%	0.756	S	S	*	*			trans	71.7	158.2	153.8	-91.5	-81.6	0	0	0	124.3
386	S	25.3	Very low	28.1	Very low	104 Å²	104	123.3 Å²	123.3	73%	0.727	76%	0.762	S	S	*	*			trans	-134.3	-166.1	179.1	-45.1	0	0	0	0	108.5
387	P	45.7	Very low	27.9	Very low	109 Å²	109	117 Å²	117	71%	0.708	75%	0.749	S	S	*	*			cis	-143.5	-169.7	-2.2	45.1	-25.4	0	0	0	116.9
388	S	27.2	Very low	27.9	Very low	113 Å²	113	121.6 Å²	121.6	79%	0.79	76%	0.758	S	S	*	*			trans	66	132.6	146	-62.3	0	0	0	0	123.5
389	A	26.9	Very low	27.7	Very low	87 Å²	87	120.4 Å²	120.4	72%	0.719	75%	0.752	S	S	*	*				153.2	134.3	106.5	0	0	0	0	0	115.9
390	V	25.2	Very low	27.6	Very low	144 Å²	144	121.2 Å²	121.2	87%	0.873	76%	0.761	S	S	*	*			trans	50.6	143	132.5	179.3	0	0	0	0	120.7
391	S	23.9	Very low	27.4	Very low	89 Å²	89	120.8 Å²	120.8	62%	0.622	76%	0.758	S	S	*	*			cis	178.5	147.3	-22.6	179	0	0	0	0	109.7
392	C	22.5	Very low	27.1	Very low	110 Å²	110	122.3 Å²	122.3	74%	0.743	76%	0.757	S	S	*	*			trans	52.7	171.5	154.8	65.4	0	0	0	0	119.7
393	V	23.9	Very low	27	Very low	129 Å²	129	125.6 Å²	125.6	78%	0.782	77%	0.767	S	S	*	*			cis	-149	163	-0.5	-141.2	0	0	0	0	109.8
394	A	26.1	Very low	26.8	Very low	88 Å²	88	124.7 Å²	124.7	73%	0.727	77%	0.77	S	S	*	*			trans	63.7	157.3	142.3	0	0	0	0	0	121.4
395	E	25.6	Very low	26.5	Very low	152 Å²	152	124.5 Å²	124.5	71%	0.71	77%	0.773	S	S	*	*			cis	-162.4	152.4	-22.8	-99.7	-123.6	100.7	0	0	110.8
396	Q	27.3	Very low	26.5	Very low	163 Å²	163	120.3 Å²	120.3	76%	0.762	77%	0.766	S	S	*	*			trans	48.5	133.4	149.5	-63.4	178.7	28.9	0	0	125.1
397	G	25.2	Very low	26.5	Very low	71 Å²	71	124.7 Å²	124.7	73%	0.732	78%	0.775	S	S	*	*			trans	93.4	152	144.1	0	0	0	0	0	118
398	L	27.3	Very low	25.6	Very low	158 Å²	158	123 Å²	123	83%	0.827	78%	0.778	S	S	*	*			cis	176.1	144.3	-28.1	-117.3	171.8	0	0	0	106.9
399	L	27.6	Very low	25.5	Very low	165 Å²	165	122.3 Å²	122.3	86%	0.864	78%	0.779	S	S	*	*			trans	73.3	117.2	167.5	-55.1	-178.8	0	0	0	119.8
400	G	23.6	Very low	25.4	Very low	84 Å²	84	124 Å²	124	87%	0.866	79%	0.786	S	S	*	*			trans	-82.8	-171.8	-174.7	0	0	0	0	0	118.4
401	S	25.6	Very low	25.3	Very low	125 Å²	125	121 Å²	121	87%	0.874	78%	0.784	S	S	*	*			trans	-156.3	-179.8	162.8	-164.9	0	0	0	0	110.1
402	V	25.3	Very low	25.2	Very low	123 Å²	123	121 Å²	121	75%	0.745	80%	0.798	S	S	*	*			trans	-139.8	142.6	-154.5	168.2	0	0	0	0	113.7
403	L	29	Very low	25.4	Very low	161 Å²	161	119 Å²	119	84%	0.843	80%	0.795	S	S	*	*			trans	66.9	124.8	166.4	-73.8	164.7	0	0	0	120.9
404	S	24.7	Very low	25.4	Very low	104 Å²	104	120.7 Å²	120.7	73%	0.727	80%	0.8	S	S	*	*				149.7	117	106.4	-168.5	0	0	0	0	117.2
405	L	23.9	Very low	25.8	Very low	146 Å²	146	122.3 Å²	122.3	76%	0.764	80%	0.803	S	S	*	*			trans	30.9	124.2	148.4	-78.4	74.3	0	0	0	124.9
406	C	24.8	Very low	26.1	Very low	101 Å²	101	123.2 Å²	123.2	68%	0.682	81%	0.812	S	S	*	*				84.5	128.5	125	-66.5	0	0	0	0	125.1
407	E	25.5	Very low	26	Very low	196 Å²	196	121 Å²	121	92%	0.916	81%	0.814	S	S	*	*			trans	60.6	132.9	148.6	-62.4	177.2	103.3	0	0	121
408	G	25.8	Very low	26.3	Very low	74 Å²	74	122.5 Å²	122.5	76%	0.763	81%	0.811	S	S	*	*			cis	178.9	163.5	-5.8	0	0	0	0	0	115.8
409	A	26.1	Very low	26.3	Very low	98 Å²	98	127.1 Å²	127.1	81%	0.81	82%	0.818	S	S	*	*			trans	54	108.5	162	0	0	0	0	0	121.8
410	S	24.4	Very low	26.5	Very low	124 Å²	124	124.4 Å²	124.4	87%	0.867	82%	0.82	S	S	*	*				166.9	130.1	111	-74.6	0	0	0	0	115.3
411	G	22.7	Very low	26.6	Very low	81 Å²	81	123.9 Å²	123.9	84%	0.835	81%	0.814	S	S	*	*			trans	86.7	131.8	149	0	0	0	0	0	119.1
412	G	23.4	Very low	27.1	Very low	88 Å²	88	127.2 Å²	127.2	91%	0.907	82%	0.815	S	S	*	*			trans	77.2	158.5	179.8	0	0	0	0	0	113.6
413	G	24.9	Very low	27.2	Very low	67 Å²	67	131.9 Å²	131.9	69%	0.691	82%	0.82	S	S	*	*			cis	146.5	130.1	0.8	0	0	0	0	0	109.6
414	D	24.3	Very low	27.5	Very low	165 Å²	165	127.9 Å²	127.9	88%	0.882	82%	0.818	S	S	*	*			trans	61.8	169.8	-177.7	-63.5	-43.9	0	0	0	116.3
415	P	35.4	Very low	27.7	Very low	122 Å²	122	133.8 Å²	133.8	79%	0.792	83%	0.826	S	S	*	*			cis	-121.2	157.4	-11.1	19.8	2.4	0	0	0	115
416	L	30.6	Very low	28.2	Very low	171 Å²	171	130.5 Å²	130.5	90%	0.895	83%	0.827	S	S	*	*			trans	-87.6	130.7	162.8	-75.3	164.9	0	0	0	111
417	S	25.1	Very low	28.8	Very low	117 Å²	117	134.6 Å²	134.6	82%	0.818	83%	0.828	S	S	*	*			trans	179.5	159.8	158	-89.5	0	0	0	0	112.4
418	P	32.3	Very low	29	Very low	103 Å²	103	129.1 Å²	129.1	67%	0.669	82%	0.816	S	S	*	*	S	Bend	cis	-126.3	-164.8	-29.1	27.2	-5	0	0	0	111.3
419	W	28.1	Very low	29.2	Very low	254 Å²	254	132.3 Å²	132.3	96%	0.962	82%	0.824	S	S	*	*			trans	72.3	26.3	176	-59.3	89.1	0	0	0	118
420	A	31.6	Very low	29.8	Very low	109 Å²	109	131.5 Å²	131.5	90%	0.901	83%	0.825	S	S	*	*			trans	-88.4	104.2	141.7	0	0	0	0	0	108
421	G	26	Very low	30.3	Very low	72 Å²	72	132.2 Å²	132.2	74%	0.742	81%	0.813	S	S	*	*			trans	-159.7	130.6	-178.6	0	0	0	0	0	111.6	R423	G421-R423 PolarHBondContact O-N 2.88Å
422	E	34.7	Very low	31.1	Very low	195 Å²	195	136.4 Å²	136.4	91%	0.911	81%	0.811	S	S	*	*			trans	-69.7	126.4	-170	-63.5	-177.7	108.3	0	0	113.2
423	R	27.8	Very low	31.5	Very low	221 Å²	221	143.6 Å²	143.6	83%	0.834	81%	0.811	S	S	*	*			trans	-153.2	106.1	149.7	-152.5	161.4	-64.8	-121.4	-1.7	110.5	G421 Y425	G421-R423 PolarHBondContact O-N 2.88Å; R423-Y425 PolarHBondContact O-N 3.23Å
424	G	34.5	Very low	31.9	Very low	78 Å²	78	148.4 Å²	148.4	80%	0.804	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-66.7	126.6	172.7	0	0	0	0	0	110.5
425	Y	30	Very low	32	Very low	228 Å²	228	148 Å²	148	89%	0.894	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-72.5	135.5	176.7	-68.6	-85.1	0	0	0	111.1	R423	R423-Y425 PolarHBondContact O-N 3.23Å
426	G	34.5	Very low	31.8	Very low	77 Å²	77	150.3 Å²	150.3	79%	0.794	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-63.1	149	-179.7	0	0	0	0	0	113.1
427	R	36.9	Very low	31.6	Very low	186 Å²	186	146.3 Å²	146.3	70%	0.702	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-76.7	142.7	176	-63.9	178.1	-178	-98.4	-4.3	110.3
428	A	29.2	Very low	31.9	Very low	81 Å²	81	150.2 Å²	150.2	67%	0.669	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-65.9	146.8	169.9	0	0	0	0	0	111.1	G430	A428-G430 PolarHBondContact O-N 3.22Å
429	P	30.4	Very low	31.6	Very low	141 Å²	141	154.8 Å²	154.8	92%	0.916	82%	0.819	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57.4	131.2	176.1	-26	35.3	0	0	0	112.6
430	G	40.1	Very low	31.6	Very low	82 Å²	82	154.5 Å²	154.5	85%	0.845	82%	0.818	S	S	*	*	T	Hydrogen-bonded Turn	trans	126.1	4.8	178.2	0	0	0	0	0	116.5	A428 E432	A428-G430 PolarHBondContact O-N 3.22Å; G430-E432 PolarHBondContact O-N 3.28Å
431	F	34.4	Very low	31.3	Very low	138 Å²	138	152.4 Å²	152.4	61%	0.605	81%	0.807	S	S	*	*			trans	-82.9	-3	-172.8	-177.3	-106.5	0	0	0	116.1
432	E	38.7	Very low	31.3	Very low	170 Å²	170	159.2 Å²	159.2	79%	0.794	82%	0.817	S	S	*	*			trans	-115.5	103.8	-165.9	-63.6	-169.7	142.6	0	0	115.1	G430	G430-E432 PolarHBondContact O-N 3.28Å
433	R	32.8	Very low	30.8	Very low	239 Å²	239	154.9 Å²	154.9	90%	0.902	81%	0.814	S	S	*	*			trans	156.4	136.8	145.6	-89	174.4	-158.4	115.2	1	109.4
434	E	31.6	Very low	30.8	Very low	168 Å²	168	152.1 Å²	152.1	79%	0.785	82%	0.815	S	S	*	*			cis	-156.4	127	-24.3	175.4	154.5	74.7	0	0	106.2
435	D	27.9	Very low	30.3	Very low	156 Å²	156	157.5 Å²	157.5	83%	0.834	82%	0.819	S	S	*	*			trans	-113.1	100.6	-178.5	-164.7	-12.8	0	0	0	110.3
436	Q	30	Very low	30.1	Very low	170 Å²	170	154.9 Å²	154.9	79%	0.794	82%	0.815	S	S	*	*			trans	-136.9	49.3	178.6	-155.2	-179	114.4	0	0	112.4
437	A	26.7	Very low	29.7	Very low	88 Å²	88	162.1 Å²	162.1	73%	0.727	82%	0.818	S	S	*	*			trans	-118.9	50.9	179.5	0	0	0	0	0	114.3
438	K	31.6	Very low	29.1	Very low	198 Å²	198	158.2 Å²	158.2	86%	0.861	82%	0.819	S	S	*	*			trans	30.5	101	157.5	-67.6	176.8	-179.7	171.6	0	118	R440	K438-R440 PolarHBondContact O-N 3.21Å
439	H	26.7	Very low	28.9	Very low	199 Å²	199	164.2 Å²	164.2	92%	0.921	83%	0.825	S	S	*	*			trans	-65.2	118.2	159.7	-124.5	-104.1	0	0	0	111.7
440	R	26.9	Very low	28.6	Very low	248 Å²	248	163.3 Å²	163.3	94%	0.936	81%	0.808	S	S	*	*			trans	-159.6	128.3	145.8	-115	-175.3	-168.8	-92.2	0.5	110.2	K438	K438-R440 PolarHBondContact O-N 3.21Å
441	G	25.8	Very low	28	Very low	65 Å²	65	168 Å²	168	67%	0.67	81%	0.806	S	S	*	*			trans	-92.6	148.8	-178.5	0	0	0	0	0	113.9
442	F	27	Very low	27.6	Very low	216 Å²	216	165.8 Å²	165.8	95%	0.947	81%	0.813	S	S	*	*			trans	24.9	124.5	152	-65.8	-84.5	0	0	0	121.2
443	A	23.4	Very low	26.9	Very low	104 Å²	104	162.5 Å²	162.5	86%	0.86	81%	0.809	S	S	*	*			trans	-135.5	149.2	136.7	0	0	0	0	0	108.6
444	L	27.6	Very low	26.6	Very low	163 Å²	163	157 Å²	157	85%	0.853	80%	0.802	S	S	*	*			trans	-98.7	130.4	-180	171.4	70.6	0	0	0	110
445	E	24.5	Very low	26.4	Very low	190 Å²	190	157.3 Å²	157.3	89%	0.888	80%	0.803	S	S	*	*			trans	-147.6	163.5	156.5	-92.9	-116.7	102.9	0	0	109.8
446	H	26.4	Very low	26.2	Very low	174 Å²	174	154.7 Å²	154.7	81%	0.806	80%	0.797	S	S	*	*			trans	-130.8	135.2	-159.2	171.6	-92	0	0	0	110.8
447	R	25.8	Very low	26.1	Very low	228 Å²	228	154.4 Å²	154.4	86%	0.86	79%	0.793	S	S	*	*			trans	150.7	118.7	147.9	-178	176	-155.7	163.3	3.4	114.6
448	S	24.1	Very low	26.3	Very low	105 Å²	105	158.6 Å²	158.6	73%	0.734	80%	0.798	S	S	*	*			trans	32.5	132.1	141	-153.9	0	0	0	0	119.7
449	R	25.3	Very low	25.9	Very low	207 Å²	207	157.1 Å²	157.1	78%	0.781	80%	0.799	S	S	*	*				176.8	129.9	73	-174.3	175.6	-172.8	179.7	1.8	115
450	E	24.1	Very low	26	Very low	122 Å²	122	154.8 Å²	154.8	57%	0.57	79%	0.793	S	S	*	*			trans	32	157.2	144.5	-46.5	175	116.3	0	0	126.1
451	F	26.3	Very low	25.9	Very low	181 Å²	181	150.7 Å²	150.7	79%	0.794	79%	0.788	S	S	*	*			trans	70.8	119.7	164	-70.1	-79.6	0	0	0	117.9
452	A	25.9	Very low	25.9	Very low	91 Å²	91	152.7 Å²	152.7	75%	0.752	79%	0.787	S	S	*	*				91.9	153.3	60.7	0	0	0	0	0	112.6
453	S	24.3	Very low	25.8	Very low	101 Å²	101	151.7 Å²	151.7	71%	0.706	78%	0.783	S	S	*	*			cis	-168.9	-178.4	-14.8	177.2	0	0	0	0	108
454	T	26.3	Very low	25.9	Very low	123 Å²	123	154 Å²	154	76%	0.755	78%	0.78	S	S	*	*			trans	69.8	159.1	166.2	71.5	0	0	0	0	117.3
455	Q	27.4	Very low	26.1	Very low	174 Å²	174	152.1 Å²	152.1	81%	0.813	78%	0.778	S	S	*	*			cis	-173.3	174.5	-23.7	170.7	167.4	-28.7	0	0	110.2
456	S	24.9	Very low	26.3	Very low	101 Å²	101	149.7 Å²	149.7	71%	0.706	78%	0.775	S	S	*	*			trans	98.6	114	169.2	-153.1	0	0	0	0	114.2
457	K	27.7	Very low	26.2	Very low	165 Å²	165	144.1 Å²	144.1	72%	0.717	77%	0.765	S	S	*	*				60.4	103.4	67.6	-71.8	-170.2	174.9	-172	0	111.7
458	Q	29.8	Very low	26.2	Very low	176 Å²	176	139.2 Å²	139.2	82%	0.822	77%	0.766	S	S	*	*				78.2	116.9	83.6	-83.6	-176.9	-31.7	0	0	112.4
459	D	24.4	Very low	27	Very low	166 Å²	166	139.2 Å²	139.2	89%	0.888	76%	0.763	S	S	*	*				-153.5	167.5	125.2	-140.2	-23	0	0	0	112.2
460	L	27.3	Very low	27.1	Very low	150 Å²	150	137 Å²	137	79%	0.785	77%	0.766	S	S	*	*			trans	-121.2	133.1	179.2	-92.8	162.5	0	0	0	109.9
461	L	26.4	Very low	27.3	Very low	162 Å²	162	135.5 Å²	135.5	85%	0.848	77%	0.769	S	S	*	*			trans	-142	143.4	163.3	-109.4	169.9	0	0	0	111.6
462	V	24.6	Very low	27.3	Very low	107 Å²	107	134.7 Å²	134.7	65%	0.648	77%	0.772	S	S	*	*			trans	-121.8	133.1	-168.6	173.2	0	0	0	0	109.5
463	F	24.8	Very low	27.4	Very low	196 Å²	196	135.8 Å²	135.8	86%	0.86	77%	0.774	S	S	*	*			trans	-138.2	139.6	159.4	-84.9	-79.5	0	0	0	110.7
464	L	26.8	Very low	27.5	Very low	151 Å²	151	136.2 Å²	136.2	79%	0.791	78%	0.777	S	S	*	*			trans	-98	167.3	171	-64.1	169.5	0	0	0	109.1
465	P	31.1	Very low	27.7	Very low	125 Å²	125	136.2 Å²	136.2	81%	0.812	78%	0.782	S	S	*	*				-141.8	163.7	97.2	37.6	-24.3	0	0	0	116.8
466	V	27.8	Very low	28.1	Very low	138 Å²	138	134.8 Å²	134.8	84%	0.836	78%	0.779	S	S	*	*			trans	-44.2	152.1	160.3	-175.1	0	0	0	0	112.7
467	G	25	Very low	28.3	Very low	57 Å²	57	135.9 Å²	135.9	59%	0.588	78%	0.784	S	S	*	*			cis	146.9	114.7	-8.3	0	0	0	0	0	115
468	S	25.8	Very low	28.3	Very low	126 Å²	126	133.3 Å²	133.3	88%	0.881	79%	0.786	S	S	*	*			trans	72.2	169.3	157.4	-52.4	0	0	0	0	117.2
469	P	40.7	Very low	28.3	Very low	104 Å²	104	130.7 Å²	130.7	68%	0.675	79%	0.788	S	S	*	*			cis	-141.3	166.6	7.7	47.3	-30.8	0	0	0	118.9
470	L	28.7	Very low	28.5	Very low	162 Å²	162	131.4 Å²	131.4	85%	0.848	79%	0.79	S	S	*	*			trans	66	156.9	157.4	-50.2	-159.5	0	0	0	120
471	S	27.6	Very low	28.7	Very low	89 Å²	89	129 Å²	129	62%	0.622	79%	0.792	S	S	*	*			cis	-172.9	173.1	-30.9	-92.6	0	0	0	0	110.5
472	L	26.3	Very low	28.8	Very low	165 Å²	165	126 Å²	126	86%	0.864	79%	0.791	S	S	*	*			trans	75.7	146.3	165	-48.6	-176	0	0	0	116.1
473	S	26.9	Very low	29.1	Very low	113 Å²	113	127.2 Å²	127.2	79%	0.79	80%	0.799	S	S	*	*			cis	-155.6	165.2	-10.9	34.4	0	0	0	0	112.2
474	S	27	Very low	29.4	Very low	110 Å²	110	123.6 Å²	123.6	77%	0.769	80%	0.795	S	S	*	*			trans	-80.5	162.9	-178.2	51.8	0	0	0	0	114.9
475	S	30.7	Very low	30	Very low	124 Å²	124	122.3 Å²	122.3	87%	0.867	80%	0.795	S	S	*	*			trans	-153.3	154	149	-83.3	0	0	0	0	112.1
476	I	35.4	Very low	30	Very low	144 Å²	144	121.7 Å²	121.7	74%	0.738	79%	0.794	S	S	*	*			trans	-119.8	139.5	-173.9	-62.8	170.8	0	0	0	108.3	S478	I476-S478 PolarHBondContact O-N 3.44Å
477	P	30.3	Very low	30.7	Very low	124 Å²	124	121 Å²	121	81%	0.805	79%	0.792	S	S	*	*			trans	-79.3	111.7	168.4	31.6	-31.4	0	0	0	110.5
478	S	27.9	Very low	30.8	Very low	111 Å²	111	123 Å²	123	78%	0.776	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-95.8	128.7	167.3	-67.6	0	0	0	0	110	I476	I476-S478 PolarHBondContact O-N 3.44Å
479	S	29.3	Very low	30.8	Very low	121 Å²	121	121.2 Å²	121.2	85%	0.846	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-84.4	137	171.4	-56.4	0	0	0	0	110.6
480	L	28.6	Very low	30.3	Very low	180 Å²	180	124.7 Å²	124.7	94%	0.942	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-101.6	125.3	161.9	-69.1	174.7	0	0	0	108.6
481	A	30.1	Very low	30.2	Very low	99 Å²	99	120.5 Å²	120.5	82%	0.818	80%	0.804	S	S	*	*			trans	-114.7	140.7	169.8	0	0	0	0	0	108.5
482	A	28.4	Very low	31	Very low	101 Å²	101	122.2 Å²	122.2	84%	0.835	81%	0.813	S	S	*	*			trans	-107.2	133.5	-179.3	0	0	0	0	0	110.9
483	T	31.1	Very low	32	Very low	132 Å²	132	120.5 Å²	120.5	81%	0.81	81%	0.812	S	S	*	*			trans	-148.3	122.4	172	42.6	0	0	0	0	110.5
484	P	32.7	Very low	32	Very low	120 Å²	120	118.2 Å²	118.2	78%	0.779	81%	0.806	S	S	*	*			trans	-89.4	-164.9	163.6	42.6	-36.7	0	0	0	109.1
485	P	38.4	Very low	32.1	Very low	123 Å²	123	119.4 Å²	119.4	80%	0.799	82%	0.815	S	S	*	*				-113	169.4	-102.3	23	-1.8	0	0	0	115
486	S	31.8	Very low	32	Very low	112 Å²	112	116.8 Å²	116.8	78%	0.783	81%	0.808	S	S	*	*			trans	-63.3	169.7	173.6	-41.4	0	0	0	0	113.4
487	P	42.9	Very low	31.8	Very low	123 Å²	123	118.5 Å²	118.5	80%	0.799	82%	0.816	S	S	*	*				-147.3	179.3	99.2	40.1	-25.4	0	0	0	116.2
488	A	25.8	Very low	31.8	Very low	100 Å²	100	118.4 Å²	118.4	83%	0.826	82%	0.818	S	S	*	*			trans	78.5	153.9	165.3	0	0	0	0	0	119.2
489	A	27	Very low	32	Very low	89 Å²	89	119.2 Å²	119.2	74%	0.736	82%	0.824	S	S	*	*				-173.1	170.3	-67.1	0	0	0	0	0	111.1
490	L	29.1	Very low	32	Very low	176 Å²	176	116.7 Å²	116.7	92%	0.921	82%	0.817	S	S	*	*			trans	67.1	117.6	163.5	-53.9	179.8	0	0	0	119.9
491	G	27.7	Very low	32.3	Very low	74 Å²	74	117 Å²	117	76%	0.763	82%	0.816	S	S	*	*				118.7	118.9	124.4	0	0	0	0	0	119.4
492	P	43.8	Very low	32.5	Very low	125 Å²	125	119.5 Å²	119.5	81%	0.812	82%	0.816	S	S	*	*			trans	-97.3	-166.9	164.5	42.4	-35.4	0	0	0	110.6
493	P	46.3	Very low	32.6	Very low	129 Å²	129	118.8 Å²	118.8	84%	0.838	81%	0.81	S	S	*	*			cis	-127.4	-171.9	-0.4	43	-25.9	0	0	0	113
494	G	27.3	Very low	32.6	Very low	65 Å²	65	120.5 Å²	120.5	67%	0.67	81%	0.814	S	S	*	*			cis	167.9	179.8	-5.6	0	0	0	0	0	111.7
495	S	30	Very low	32.5	Very low	136 Å²	136	119.7 Å²	119.7	95%	0.951	82%	0.817	S	S	*	*			trans	66	142.7	-179.5	-56.2	0	0	0	0	116.8
496	G	27.2	Very low	32.3	Very low	69 Å²	69	121.3 Å²	121.3	71%	0.711	82%	0.819	S	S	*	*			cis	137.8	102.1	-12.6	0	0	0	0	0	114.8
497	I	32.9	Very low	32.5	Very low	180 Å²	180	121 Å²	121	92%	0.923	81%	0.814	S	S	*	*			trans	-159.9	158.4	155.4	31.5	171.7	0	0	0	109.7
498	S	30	Very low	31.9	Very low	121 Å²	121	125.2 Å²	125.2	85%	0.846	82%	0.82	S	S	*	*			trans	-129.5	179.6	-166.6	-56.4	0	0	0	0	113.4
499	S	31.2	Very low	32.1	Very low	129 Å²	129	128.9 Å²	128.9	90%	0.902	81%	0.814	S	S	*	*			trans	95.7	133.1	166.5	-156	0	0	0	0	116.1
500	G	29.8	Very low	32.4	Very low	68 Å²	68	130.6 Å²	130.6	70%	0.701	82%	0.817	S	S	*	*			cis	174.3	157.4	-5.4	0	0	0	0	0	113.4
501	M	34.1	Very low	32.6	Very low	185 Å²	185	127.4 Å²	127.4	91%	0.911	81%	0.806	S	S	*	*			trans	-137.1	142.4	173.1	-69.2	178.5	67.6	0	0	109.8
502	N	34.9	Very low	32.9	Very low	152 Å²	152	129.3 Å²	129.3	81%	0.813	81%	0.807	S	S	*	*			trans	-80.1	132.2	171.6	42.7	4.5	0	0	0	109.8
503	A	31.1	Very low	32.2	Very low	86 Å²	86	132.3 Å²	132.3	71%	0.711	81%	0.81	S	S	*	*				78.1	84.1	51.5	0	0	0	0	0	113.1
504	N	30.3	Very low	31.6	Very low	168 Å²	168	132.1 Å²	132.1	90%	0.898	81%	0.807	S	S	*	*			trans	-162.6	147.3	151.3	-103	-42.8	0	0	0	110.6
505	A	29.8	Very low	31.8	Very low	103 Å²	103	136.2 Å²	136.2	85%	0.851	82%	0.819	S	S	*	*			trans	69.1	147.8	-176	0	0	0	0	0	117.2
506	L	35.9	Very low	31.8	Very low	158 Å²	158	138.4 Å²	138.4	83%	0.827	81%	0.814	S	S	*	*			trans	-126.6	151.9	-168.2	-68.6	167	0	0	0	111.8
507	P	36.2	Very low	32.1	Very low	106 Å²	106	139.5 Å²	139.5	69%	0.688	81%	0.81	S	S	*	*			trans	-80.5	133.7	166.7	32.6	-31.8	0	0	0	111.5
508	F	30.1	Very low	32	Very low	210 Å²	210	138.4 Å²	138.4	92%	0.921	81%	0.812	S	S	*	*			trans	-85	115.1	167	-92.5	-103.9	0	0	0	109.8
509	Y	29.9	Very low	32.2	Very low	177 Å²	177	137.1 Å²	137.1	69%	0.694	80%	0.799	S	S	*	*			trans	-85.6	160.7	175.2	-107.1	-64.5	0	0	0	110.5	T511	Y509-T511 HydrophobicContact CD1-CG2 4.17Å; Y509-T511 HydrophobicContact CE1-CG2 3.71Å; Y509-T511 WeakPolarHBondContact CE1-OG1 3.44Å
510	P	33.8	Very low	32.1	Very low	125 Å²	125	139.3 Å²	139.3	81%	0.812	80%	0.795	S	S	*	*				-138.8	156.6	67.8	37.2	-19.9	0	0	0	117.1
511	T	33.3	Very low	32.1	Very low	110 Å²	110	141 Å²	141	68%	0.675	80%	0.796	S	S	*	*			trans	-119.3	121.6	164.8	41	0	0	0	0	109.4	Y509	Y509-T511 HydrophobicContact CD1-CG2 4.17Å; Y509-T511 HydrophobicContact CE1-CG2 3.71Å; Y509-T511 WeakPolarHBondContact CE1-OG1 3.44Å
512	S	33.5	Very low	31.9	Very low	113 Å²	113	137.3 Å²	137.3	79%	0.79	80%	0.795	S	S	*	*			trans	-176.1	148.7	171.9	-108.9	0	0	0	0	106.4
513	E	28.7	Very low	31.6	Very low	188 Å²	188	137 Å²	137	88%	0.879	79%	0.792	S	S	*	*			cis	-133.4	171	9.8	-64.8	-168.9	127.1	0	0	113.2
514	T	33.5	Very low	31.7	Very low	126 Å²	126	139.3 Å²	139.3	77%	0.773	79%	0.793	S	S	*	*			trans	-93.5	148.4	170.3	47.9	0	0	0	0	112.3
515	V	31.2	Very low	31.8	Very low	151 Å²	151	138.4 Å²	138.4	92%	0.915	79%	0.788	S	S	*	*			trans	-141.5	144.7	141.8	-80	0	0	0	0	109.9
516	E	30.5	Very low	32.2	Very low	181 Å²	181	140.6 Å²	140.6	85%	0.846	78%	0.784	S	S	*	*			trans	-110.4	171.2	-178.3	-62	174.1	111.1	0	0	111.3
517	S	34.4	Very low	32.1	Very low	92 Å²	92	139.6 Å²	139.6	64%	0.643	78%	0.78	S	S	*	*			trans	59	102.3	148.8	177.2	0	0	0	0	119.4
518	V	30.3	Very low	32.3	Very low	158 Å²	158	142.2 Å²	142.2	96%	0.958	79%	0.787	S	S	*	*				-120.7	140.5	122.7	-180	0	0	0	0	107.3
519	V	32.9	Very low	32.6	Very low	93 Å²	93	137.6 Å²	137.6	56%	0.564	77%	0.772	S	S	*	*			trans	-126	129.3	-157.7	159.6	0	0	0	0	111.6
520	E	29.9	Very low	32.8	Very low	175 Å²	175	136.4 Å²	136.4	82%	0.818	78%	0.778	S	S	*	*			trans	54.6	170.4	153.7	-67.6	176	131.4	0	0	121.8
521	S	30.8	Very low	32.8	Very low	105 Å²	105	138.4 Å²	138.4	73%	0.734	77%	0.774	S	S	*	*			trans	74.9	75.1	154.6	-59	0	0	0	0	119.3
522	A	29.9	Very low	32.8	Very low	106 Å²	106	136.5 Å²	136.5	88%	0.876	78%	0.776	S	S	*	*				-117.5	128.4	119.4	0	0	0	0	0	107.2
523	L	28.1	Very low	32.7	Very low	146 Å²	146	138 Å²	138	76%	0.764	78%	0.78	S	S	*	*			trans	-92.2	177.9	-173.3	-79.9	175.4	0	0	0	112.5
524	D	32.8	Very low	32.9	Very low	135 Å²	135	134.9 Å²	134.9	72%	0.722	78%	0.779	S	S	*	*			trans	-4.1	131.9	158.2	-59.3	-95	0	0	0	118.2
525	D	32.4	Very low	32.8	Very low	149 Å²	149	133.8 Å²	133.8	80%	0.797	78%	0.783	S	S	*	*			trans	-146.7	109.6	132.7	-114.1	-29.4	0	0	0	111.6
526	L	37	Very low	32.7	Very low	148 Å²	148	134.2 Å²	134.2	78%	0.775	78%	0.779	S	S	*	*			trans	71.5	105.4	152.6	-48.7	-178	0	0	0	120.9
527	D	35.6	Very low	32.7	Very low	137 Å²	137	132.7 Å²	132.7	73%	0.733	77%	0.772	S	S	*	*			trans	-69.4	139.8	147.9	167.7	34.6	0	0	0	111	N529	D527-N529 PolarHBondContact OD1-N 3.16Å; D527-N529 VanDerWaalsContact OD1-N 3.15Å
528	L	38.6	Very low	32.7	Very low	161 Å²	161	137.1 Å²	137.1	84%	0.843	77%	0.774	S	S	*	*			trans	-143	86.7	160.1	-85.9	-175.7	0	0	0	111.4	D530	L528-D530 PolarHBondContact O-N 3.43Å
529	N	37.4	Very low	32.5	Very low	114 Å²	114	133.8 Å²	133.8	61%	0.61	76%	0.758	S	S	*	*			trans	-62.6	90.3	160.2	179.3	39.6	0	0	0	111.6	D527 F531	D527-N529 PolarHBondContact OD1-N 3.16Å; D527-N529 VanDerWaalsContact OD1-N 3.15Å; N529-F531 WeakPolarHBondContact O-CD2 3.33Å; N529-F531 WeakPolarHBondContact O-CE2 3.45Å
530	D	34.9	Very low	32.2	Very low	151 Å²	151	137.5 Å²	137.5	81%	0.807	77%	0.772	S	S	*	*			trans	-90.9	144.1	171.8	-165	19.9	0	0	0	112.4	L528	L528-D530 PolarHBondContact O-N 3.43Å
531	F	32.2	Very low	32.2	Very low	168 Å²	168	137.5 Å²	137.5	74%	0.737	77%	0.772	S	S	*	*			trans	-101.1	157.4	-168.2	-68.9	-116.8	0	0	0	110.3	N529	N529-F531 WeakPolarHBondContact O-CD2 3.33Å; N529-F531 WeakPolarHBondContact O-CE2 3.45Å
532	G	33.7	Very low	32	Very low	69 Å²	69	136.9 Å²	136.9	71%	0.711	77%	0.767	S	S	*	*			cis	177.1	-165.2	3.5	0	0	0	0	0	110.8
533	V	32.5	Very low	32	Very low	145 Å²	145	136.8 Å²	136.8	88%	0.879	76%	0.76	S	S	*	*			trans	-87.5	124.8	-173.1	-179.3	0	0	0	0	112.6
534	S	31.4	Very low	32	Very low	122 Å²	122	135.3 Å²	135.3	85%	0.853	76%	0.762	S	S	*	*			trans	179.6	104.1	145.1	-84.4	0	0	0	0	114.1
535	A	32.4	Very low	31.8	Very low	103 Å²	103	133.7 Å²	133.7	85%	0.851	77%	0.768	S	S	*	*			trans	-161.7	88.3	159.1	0	0	0	0	0	113.1
536	L	27.8	Very low	31.7	Very low	160 Å²	160	134.6 Å²	134.6	84%	0.838	77%	0.772	S	S	*	*			trans	46.1	102.3	154.5	-168.4	63.3	0	0	0	120.4
537	E	32.4	Very low	32	Very low	149 Å²	149	133.5 Å²	133.5	70%	0.696	77%	0.773	S	S	*	*			trans	-96.4	120.1	141.9	175	-153.2	-131.3	0	0	109
538	R	33.2	Very low	31.7	Very low	185 Å²	185	131.9 Å²	131.9	70%	0.698	77%	0.772	S	S	*	*			trans	175.4	152.8	142.4	-102.2	157.6	-165.4	68.5	2.1	115.7
539	S	26.7	Very low	31.3	Very low	89 Å²	89	131.1 Å²	131.1	62%	0.622	77%	0.774	S	S	*	*			trans	84.1	117	147.2	-73.3	0	0	0	0	122.7
540	M	26.9	Very low	30.8	Very low	171 Å²	171	128.9 Å²	128.9	84%	0.842	78%	0.778	S	S	*	*				78	107.5	128.9	-64	160.6	176.7	0	0	118
541	E	28.9	Very low	30.6	Very low	175 Å²	175	127.9 Å²	127.9	82%	0.818	78%	0.777	S	S	*	*				71.5	131.1	66.1	-162.5	67.1	-93.2	0	0	114.2
542	S	26.7	Very low	30.5	Very low	92 Å²	92	127.4 Å²	127.4	64%	0.643	78%	0.779	S	S	*	*			trans	68.4	106.1	164.7	-75.3	0	0	0	0	122.5
543	S	30	Very low	30.3	Very low	103 Å²	103	132 Å²	132	72%	0.72	79%	0.787	S	S	*	*				97.1	129.2	112.8	-60.7	0	0	0	0	123.4
544	S	28.3	Very low	30.1	Very low	116 Å²	116	128.9 Å²	128.9	81%	0.811	78%	0.783	S	S	*	*			trans	57.5	112.5	142.3	61.1	0	0	0	0	122
545	A	28.3	Very low	29.9	Very low	101 Å²	101	127 Å²	127	84%	0.835	78%	0.784	S	S	*	*				175.7	144.8	106	0	0	0	0	0	113.9
546	L	30.2	Very low	29.9	Very low	168 Å²	168	127.8 Å²	127.8	88%	0.88	78%	0.783	S	S	*	*			trans	-95.1	150.7	158	-74.7	170.1	0	0	0	108.2
547	P	43	Very low	30	Very low	125 Å²	125	128.7 Å²	128.7	81%	0.812	78%	0.783	S	S	*	*				-142	-175.7	69.8	20.2	5.6	0	0	0	113.8
548	S	29.6	Very low	30.1	Very low	102 Å²	102	128.3 Å²	128.3	71%	0.713	78%	0.784	S	S	*	*			cis	-173.9	168.1	-27.2	-178.2	0	0	0	0	108.8
549	V	30.8	Very low	29.9	Very low	145 Å²	145	128.9 Å²	128.9	88%	0.879	80%	0.795	S	S	*	*			trans	71.9	136.6	171.9	-168.9	0	0	0	0	115.3
550	G	27.2	Very low	30.1	Very low	67 Å²	67	130.5 Å²	130.5	69%	0.691	81%	0.806	S	S	*	*			cis	-164.7	-162.9	7.4	0	0	0	0	0	116.1
551	V	29.6	Very low	30.3	Very low	131 Å²	131	128 Å²	128	79%	0.794	81%	0.805	S	S	*	*			trans	-97.2	149.1	-156.1	-176.1	0	0	0	0	114.4
552	M	29.9	Very low	30.5	Very low	157 Å²	157	124 Å²	124	77%	0.773	80%	0.802	S	S	*	*			trans	154.8	122.1	137.9	-79.9	-56.8	164.6	0	0	108.2
553	L	30.5	Very low	31.6	Very low	166 Å²	166	125.2 Å²	125.2	87%	0.869	81%	0.808	S	S	*	*				68	108.4	57.3	-158.1	94.3	0	0	0	113.1
554	G	28.1	Very low	31.6	Very low	79 Å²	79	125.9 Å²	125.9	81%	0.814	81%	0.807	S	S	*	*			trans	167.9	128.5	174.2	0	0	0	0	0	115
555	G	28.2	Very low	31.4	Very low	83 Å²	83	127.7 Å²	127.7	86%	0.856	81%	0.808	S	S	*	*			trans	-78.2	-178.4	-175	0	0	0	0	0	117.1
556	S	32	Very low	31.6	Very low	119 Å²	119	130.2 Å²	130.2	83%	0.832	81%	0.806	S	S	*	*			trans	-53.3	145.4	-179.4	-36.9	0	0	0	0	114.8
557	Q	29.7	Very low	31.8	Very low	180 Å²	180	128.4 Å²	128.4	84%	0.841	80%	0.804	S	S	*	*				-165.4	166.9	110.8	-114.6	179.5	-13	0	0	116.1
558	I	34.2	Very low	31.2	Very low	140 Å²	140	125.3 Å²	125.3	72%	0.718	80%	0.795	S	S	*	*			trans	-45	153.9	178	60.2	-169.2	0	0	0	117.6
559	Q	28.1	Very low	31.2	Very low	198 Å²	198	125.4 Å²	125.4	93%	0.925	80%	0.796	S	S	*	*				-153.9	149.7	129.8	-117.6	169	72.8	0	0	111.6
560	S	32.7	Very low	31.1	Very low	122 Å²	122	127.4 Å²	127.4	85%	0.853	79%	0.793	S	S	*	*			trans	-158.3	131.1	-179.5	176.9	0	0	0	0	110.1
561	S	30.8	Very low	31.2	Very low	119 Å²	119	129.9 Å²	129.9	83%	0.832	80%	0.799	S	S	*	*			trans	-163	149.8	172.2	47.2	0	0	0	0	112.4
562	A	32.7	Very low	31.2	Very low	92 Å²	92	128.7 Å²	128.7	76%	0.76	80%	0.797	S	S	*	*			trans	-143	-159	175.4	0	0	0	0	0	106.9
563	P	48.8	Very low	31.1	Very low	116 Å²	116	126.5 Å²	126.5	75%	0.753	80%	0.797	S	S	*	*			cis	-118	-142.9	-22.8	23.1	2.9	0	0	0	109.4
564	V	30.3	Very low	31.1	Very low	118 Å²	118	123.2 Å²	123.2	72%	0.715	79%	0.794	S	S	*	*			cis	-158.4	155	4.2	-130.1	0	0	0	0	108.8
565	N	25.8	Very low	32.2	Very low	154 Å²	154	124.1 Å²	124.1	82%	0.824	79%	0.786	S	S	*	*				179.8	147	129.6	-105.5	-57.3	0	0	0	115.2
566	I	31.2	Very low	32.1	Very low	154 Å²	154	129.5 Å²	129.5	79%	0.79	79%	0.786	S	S	*	*			trans	-158.1	131.7	178.1	-70	-174.5	0	0	0	106.1
567	P	35.8	Very low	32	Very low	130 Å²	130	128.8 Å²	128.8	84%	0.844	78%	0.781	S	S	*	*				-154.4	-178.1	79.3	37.7	-15.1	0	0	0	116.2
568	G	29	Very low	31.9	Very low	60 Å²	60	126 Å²	126	62%	0.619	78%	0.781	S	S	*	*			cis	159.9	164.6	-11.7	0	0	0	0	0	115.5
569	S	29.6	Very low	32.6	Very low	104 Å²	104	125.4 Å²	125.4	73%	0.727	79%	0.787	S	S	*	*			trans	76.2	157.4	164.5	-49.6	0	0	0	0	118.9
570	F	28.3	Very low	32.5	Very low	187 Å²	187	121.8 Å²	121.8	82%	0.82	78%	0.783	S	S	*	*			cis	-149.2	153.1	20.8	-62.7	-96.4	0	0	0	115.5
571	S	30.6	Very low	33.2	Very low	118 Å²	118	122.1 Å²	122.1	83%	0.825	78%	0.782	S	S	*	*			trans	59	151.2	142.3	-67	0	0	0	0	122.2
572	S	29.6	Very low	33.2	Very low	107 Å²	107	122.1 Å²	122.1	75%	0.748	78%	0.782	S	S	*	*			cis	-167.2	150.1	-14.4	-171.3	0	0	0	0	107.1
573	S	28.2	Very low	33.5	Very low	111 Å²	111	123.8 Å²	123.8	78%	0.776	79%	0.785	S	S	*	*				176.1	155	66.6	47.4	0	0	0	0	111.6
574	A	30.5	Very low	33.5	Very low	97 Å²	97	124 Å²	124	80%	0.802	79%	0.787	S	S	*	*			trans	-162	140.9	176	0	0	0	0	0	113.9
575	P	49.8	Very low	33.4	Very low	98 Å²	98	125.6 Å²	125.6	64%	0.636	80%	0.796	S	S	*	*				-136.5	-179.8	129.8	34.3	-17.2	0	0	0	110.8
576	F	27.6	Very low	33.6	Very low	195 Å²	195	129.2 Å²	129.2	86%	0.855	80%	0.798	S	S	*	*			cis	-135.8	-157.4	13.9	-64.4	-91	0	0	0	110.6
577	S	28.9	Very low	34.2	Very low	104 Å²	104	126.7 Å²	126.7	73%	0.727	79%	0.792	S	S	*	*				-163.1	147.7	-86.1	-73.9	0	0	0	0	111.4
578	S	28.6	Very low	33.9	Very low	123 Å²	123	129 Å²	129	86%	0.86	79%	0.792	S	S	*	*			trans	-143.8	141.5	170.9	-63.5	0	0	0	0	110.4
579	P	49.1	Very low	33.8	Very low	127 Å²	127	129.5 Å²	129.5	83%	0.825	79%	0.79	S	S	*	*			trans	-113.7	149.1	-178.7	38.1	-30.1	0	0	0	115.4
580	S	25.5	Very low	33.7	Very low	121 Å²	121	129.6 Å²	129.6	85%	0.846	79%	0.79	S	S	*	*			trans	-145.7	139.1	153.7	-74.5	0	0	0	0	108.2
581	P	47.6	Very low	34.6	Very low	129 Å²	129	125.3 Å²	125.3	84%	0.838	78%	0.782	S	S	*	*			trans	-99.1	150.6	-166.1	36.7	-34.9	0	0	0	114.5
582	S	29.6	Very low	34.5	Very low	120 Å²	120	127.9 Å²	127.9	84%	0.839	78%	0.778	S	S	*	*			trans	-154.4	134.9	155.6	-87.3	0	0	0	0	109.7
583	P	39.5	Very low	34.5	Very low	126 Å²	126	131.1 Å²	131.1	82%	0.818	78%	0.779	S	S	*	*			trans	-89.8	168.3	-175.8	35.3	-35.4	0	0	0	114.5
584	P	48.7	Very low	34.4	Very low	122 Å²	122	130.9 Å²	130.9	79%	0.792	78%	0.778	S	S	*	*			trans	-115.6	179.9	-162.6	43.2	-34.8	0	0	0	115.1
585	V	29.1	Very low	34.2	Very low	150 Å²	150	131.8 Å²	131.8	91%	0.909	78%	0.778	S	S	*	*			trans	-165.7	172.6	131.2	137.4	0	0	0	0	110.2
586	R	30.1	Very low	33.1	Very low	230 Å²	230	135.8 Å²	135.8	87%	0.868	79%	0.788	S	S	*	*			trans	-121.9	-168.1	-157.8	-148.4	-170.2	-178.1	174.2	0.8	112.3
587	P	43.6	Very low	33.5	Very low	101 Å²	101	131.9 Å²	131.9	66%	0.656	78%	0.782	S	S	*	*				-103	-176.3	-112.7	42.8	-28.7	0	0	0	115.2
588	Q	29.4	Very low	33.4	Very low	179 Å²	179	132.2 Å²	132.2	84%	0.836	79%	0.785	S	S	*	*			trans	-172.9	163.2	131.6	-97.8	-59.4	-12.3	0	0	112.9
589	A	25.9	Very low	33.5	Very low	71 Å²	71	134.7 Å²	134.7	59%	0.587	78%	0.783	S	S	*	*			trans	-30.6	127.5	-176.2	0	0	0	0	0	123.4
590	S	27.8	Very low	32.9	Very low	105 Å²	105	133.9 Å²	133.9	73%	0.734	78%	0.777	S	S	*	*				18.9	166.4	107.7	62.3	0	0	0	0	122.4
591	P	47.6	Very low	32.8	Very low	98 Å²	98	132.2 Å²	132.2	64%	0.636	77%	0.765	S	S	*	*			cis	-143.9	-176.8	-18.9	34.1	-12.3	0	0	0	117
592	F	28.9	Very low	31.7	Very low	171 Å²	171	133.8 Å²	133.8	75%	0.75	77%	0.766	S	S	*	*			trans	63.6	157.3	153.4	-75.6	-60	0	0	0	119
593	F	29.2	Very low	31.6	Very low	175 Å²	175	132.6 Å²	132.6	77%	0.768	76%	0.758	S	S	*	*			cis	-138.2	172	2.8	-110.3	-62.6	0	0	0	111.4
594	S	25.2	Very low	30.9	Very low	107 Å²	107	135.4 Å²	135.4	75%	0.748	76%	0.76	S	S	*	*			trans	-57.9	161.8	172.3	-37.5	0	0	0	0	113.3
595	S	25.9	Very low	29.9	Very low	116 Å²	116	134.6 Å²	134.6	81%	0.811	76%	0.757	S	S	*	*				-173	157.4	68.5	49	0	0	0	0	116.1
596	H	27.1	Very low	30.5	Very low	181 Å²	181	132.8 Å²	132.8	84%	0.838	75%	0.749	S	S	*	*			trans	-73.6	166.6	158	-81.5	-75.7	0	0	0	110.4
597	P	36.3	Very low	30.6	Very low	113 Å²	113	131.8 Å²	131.8	73%	0.734	75%	0.751	S	S	*	*			cis	-154	-157.1	44.3	41.5	-16.6	0	0	0	117.3
598	S	25.9	Very low	30.2	Very low	112 Å²	112	135.2 Å²	135.2	78%	0.783	76%	0.763	S	S	*	*			trans	95.9	101.1	158.3	-50.3	0	0	0	0	119.4
599	Q	32.6	Very low	30.2	Very low	175 Å²	175	129.7 Å²	129.7	82%	0.818	75%	0.753	S	S	*	*			trans	-62.5	162.6	138.7	-79.8	-79.5	-31.1	0	0	109.3
600	P	36.1	Very low	31	Very low	110 Å²	110	131.9 Å²	131.9	71%	0.714	76%	0.762	S	S	*	*			cis	-156.5	179.1	45.9	45.7	-24.6	0	0	0	119.6
601	S	23.4	Very low	31.2	Very low	85 Å²	85	131.6 Å²	131.6	59%	0.594	76%	0.76	S	S	*	*			trans	52.4	118	132.2	176.4	0	0	0	0	122.1
602	L	24.6	Very low	30.4	Very low	162 Å²	162	135 Å²	135	85%	0.848	77%	0.767	S	S	*	*			trans	66.4	153.8	152.3	-62.4	171.7	0	0	0	115.7
603	S	26.2	Very low	30.5	Very low	95 Å²	95	133 Å²	133	66%	0.664	77%	0.774	S	S	*	*			cis	-160	179	-7.3	37.3	0	0	0	0	109.9
604	E	25.1	Very low	30.7	Very low	186 Å²	186	130.5 Å²	130.5	87%	0.869	77%	0.773	S	S	*	*			trans	75.3	117.2	159.8	-47.4	-147.9	122.6	0	0	120.3
605	S	28.6	Very low	31.5	Very low	105 Å²	105	134.2 Å²	134.2	73%	0.734	78%	0.784	S	S	*	*			trans	-75.4	158.9	145.4	56.9	0	0	0	0	110
606	P	41.4	Very low	31.6	Very low	112 Å²	112	131.8 Å²	131.8	73%	0.727	78%	0.777	S	S	*	*			cis	-150.1	158.7	37.7	41.3	-20.6	0	0	0	119.8
607	F	32.6	Very low	31.9	Very low	209 Å²	209	130.8 Å²	130.8	92%	0.917	78%	0.777	S	S	*	*			trans	27.8	94.7	131.3	-143.1	-84.6	0	0	0	119.7
608	L	35.2	Very low	31.7	Very low	173 Å²	173	133 Å²	133	91%	0.906	78%	0.783	S	S	*	*			trans	-144	138.2	149.2	-81.9	-174.9	0	0	0	112.2
609	G	29.2	Very low	31.9	Very low	62 Å²	62	130.9 Å²	130.9	64%	0.639	78%	0.778	S	S	*	*			trans	-138.4	-168.8	149.3	0	0	0	0	0	107.2
610	P	43.3	Very low	31.8	Very low	117 Å²	117	131.8 Å²	131.8	76%	0.76	79%	0.785	S	S	*	*			cis	-108.8	-179.6	-7.4	33.2	-14.8	0	0	0	110.6
611	S	30.5	Very low	31.5	Very low	100 Å²	100	131.9 Å²	131.9	70%	0.699	79%	0.788	S	S	*	*				177.4	149.2	82.1	-66.3	0	0	0	0	113.6
612	H	31.1	Very low	32.2	Very low	169 Å²	169	133.6 Å²	133.6	78%	0.782	80%	0.795	S	S	*	*			trans	-10.5	136.6	158.8	-53	-87.3	0	0	0	119.9
613	S	31.1	Very low	32.8	Very low	128 Å²	128	132.8 Å²	132.8	90%	0.895	79%	0.792	S	S	*	*			trans	-137	129.1	145.7	-76.2	0	0	0	0	108.5
614	T	33.1	Very low	33.5	Very low	123 Å²	123	136.1 Å²	136.1	76%	0.755	80%	0.801	S	S	*	*			trans	-121.4	113.8	-170.4	49.1	0	0	0	0	112.2
615	L	41.8	Very low	34.2	Very low	185 Å²	185	139.1 Å²	139.1	97%	0.969	80%	0.804	S	S	*	*			trans	-129.9	150.2	156	-64.5	175.1	0	0	0	106.9
616	G	29.6	Very low	34.7	Very low	66 Å²	66	141.9 Å²	141.9	68%	0.68	81%	0.805	S	S	*	*			cis	159.9	73.3	-1.2	0	0	0	0	0	112
617	L	33.5	Very low	34.3	Very low	159 Å²	159	144.7 Å²	144.7	83%	0.832	81%	0.809	S	S	*	*			trans	56.8	100.8	167.9	-57	175.2	0	0	0	117.3
618	N	32.1	Very low	34.4	Very low	161 Å²	161	144.9 Å²	144.9	86%	0.861	81%	0.809	S	S	*	*				173.4	146.6	105	-82.1	-33.1	0	0	0	110.2
619	G	28.3	Very low	34.6	Very low	66 Å²	66	142 Å²	142	68%	0.68	80%	0.801	S	S	*	*			cis	127.3	49.1	1.3	0	0	0	0	0	113.8
620	M	30.5	Very low	34.8	Very low	195 Å²	195	145 Å²	145	96%	0.961	81%	0.812	S	S	*	*			trans	-144.7	129.6	168.1	-105.3	152.7	-175.3	0	0	111.1
621	S	31.3	Very low	34.3	Very low	111 Å²	111	142.8 Å²	142.8	78%	0.776	81%	0.811	S	S	*	*			trans	-83.9	-179.1	-177.6	-56.5	0	0	0	0	112.1
622	T	38.3	Very low	34.4	Very low	122 Å²	122	148 Å²	148	75%	0.748	82%	0.824	S	S	*	*	S	Bend	trans	-39	138.9	158.8	49.9	0	0	0	0	113.7
623	N	36.8	Very low	34.4	Very low	145 Å²	145	143.4 Å²	143.4	78%	0.775	82%	0.822	S	S	*	*			trans	131.8	96.4	153.2	-66.6	-5.4	0	0	0	112.8
624	I	40.5	Very low	34.4	Very low	165 Å²	165	143.3 Å²	143.3	85%	0.846	82%	0.821	S	S	*	*			trans	-138.4	50.6	166.1	-42.7	179.2	0	0	0	109.7
625	W	38.9	Very low	35.1	Very low	249 Å²	249	143.9 Å²	143.9	94%	0.943	83%	0.827	S	S	*	*	S	Bend	trans	-144.4	21.2	172	-117.9	82.2	0	0	0	114.4
626	E	38.9	Very low	34.6	Very low	163 Å²	163	138.6 Å²	138.6	76%	0.762	82%	0.817	S	S	*	*	S	Bend	trans	-129.8	150.9	164	-68.6	-165.1	118.1	0	0	110.2
627	H	34.9	Very low	34.9	Very low	171 Å²	171	142 Å²	142	79%	0.792	83%	0.825	S	S	*	*			trans	69.6	75	174.9	-49.9	-56.5	0	0	0	118.7
628	F	33.1	Very low	36	Very low	213 Å²	213	140 Å²	140	93%	0.934	82%	0.821	S	S	*	*			trans	-102.3	129.6	133.9	-98.8	-81.7	0	0	0	109.2
629	P	39.1	Very low	36.9	Very low	111 Å²	111	138.5 Å²	138.5	72%	0.721	82%	0.821	S	S	*	*			trans	-90	138.9	177.3	33.5	-32.6	0	0	0	113.4
630	S	34.9	Very low	37.6	Very low	126 Å²	126	139.7 Å²	139.7	88%	0.881	82%	0.824	S	S	*	*			trans	29.4	112	148.5	-55	0	0	0	0	120.7
631	G	31.1	Very low	38	Very low	71 Å²	71	138.6 Å²	138.6	73%	0.732	82%	0.821	S	S	*	*			trans	171.4	86.7	158.1	0	0	0	0	0	118
632	Q	34.2	Very low	38.4	Very low	210 Å²	210	140.6 Å²	140.6	98%	0.981	82%	0.823	S	S	*	*			trans	62.1	130.9	165.7	-49.7	-178.1	22.8	0	0	117.5
633	G	29.8	Very low	39.1	Very low	72 Å²	72	140.9 Å²	140.9	74%	0.742	83%	0.826	S	S	*	*			cis	159.8	105.1	-12.1	0	0	0	0	0	114.5
634	S	31.4	Very low	39.3	Very low	125 Å²	125	139.7 Å²	139.7	87%	0.874	83%	0.83	S	S	*	*			trans	-167.3	154.7	151.1	-85.6	0	0	0	0	110.8
635	P	47.8	Very low	39.6	Very low	135 Å²	135	135.1 Å²	135.1	88%	0.877	82%	0.823	S	S	*	*			trans	-104.4	152.3	-157.1	38.1	-34.2	0	0	0	115.9
636	G	32.1	Very low	40.1	Very low	74 Å²	74	129.5 Å²	129.5	76%	0.763	82%	0.819	S	S	*	*			trans	-166.4	106.4	170.3	0	0	0	0	0	111.4
637	T	35.7	Very low	41.2	Very low	138 Å²	138	125.5 Å²	125.5	85%	0.847	81%	0.808	S	S	*	*			trans	-47	143.3	-172.3	35.6	0	0	0	0	117.5
638	P	56.8	Low	42.9	Very low	116 Å²	116	121.1 Å²	121.1	75%	0.753	80%	0.801	S	S	*	*			trans	-85.6	176.5	171.2	38.6	-37.2	0	0	0	112.6
639	P	50.2	Low	45.1	Very low	131 Å²	131	116.5 Å²	116.5	85%	0.851	78%	0.782	S	S	*	*				-125.3	156.4	122.8	36.8	-32.5	0	0	0	112.7
640	A	42.6	Very low	47.1	Very low	90 Å²	90	114.1 Å²	114.1	74%	0.744	77%	0.765	S	S	*	*			trans	-103.3	160.1	175.2	0	0	0	0	0	111.6
641	L	38.8	Very low	49.4	Very low	173 Å²	173	111 Å²	111	91%	0.906	75%	0.747	S	S	*	*			trans	-159.6	163.7	139.3	-100.6	-176.8	0	0	0	109.8
642	L	41.5	Very low	52.2	Low	153 Å²	153	113 Å²	113	80%	0.801	73%	0.733	S	S	*	*			trans	-108.2	-151.6	-164.7	-60.3	169	0	0	0	113.1
643	P	52.2	Low	55	Low	127 Å²	127	107.3 Å²	107.3	83%	0.825	71%	0.708	S	S	*	*				-103.3	136.4	-121.8	31.3	-13.5	0	0	0	113.5
644	S	41.2	Very low	57.9	Low	121 Å²	121	110.3 Å²	110.3	85%	0.846	70%	0.701	S	S	*	*			trans	-129.7	117.8	-175	-68.1	0	0	0	0	113.7
645	G	45.9	Very low	60.8	Low	68 Å²	68	108.9 Å²	108.9	70%	0.701	68%	0.681	S	S	*	*			trans	52.5	137.8	144.5	0	0	0	0	0	121.2	C647	G645-C647 PolarHBondContact O-N 3.42Å
646	P	50.8	Low	63	Low	132 Å²	132	106.9 Å²	106.9	86%	0.857	66%	0.66	S	S	*	*			trans	-70.9	94.2	175.8	30.4	-35.2	0	0	0	112.8	A648	P646-A648 VanDerWaalsContact C-N 3.34Å; P646-A648 PolarHBondContact O-N 3.31Å
647	C	62.1	Low	66	Low	79 Å²	79	108.2 Å²	108.2	53%	0.534	65%	0.649	S	S	.	*			trans	48.4	39.9	132.3	-106.5	0	0	0	0	117.9	G645 E649 T650 A651	G645-C647 PolarHBondContact O-N 3.42Å; C647-E649 PolarHBondContact O-N 2.55Å; C647-T650 PolarHBondContact O-N 2.83Å; C647-T650 PolarHBondContact SG-OG1 3.47Å; C647-A651 PolarHBondContact O-N 2.82Å
648	A	69.8	Low	68.8	Low	78 Å²	78	106.5 Å²	106.5	65%	0.645	63%	0.631	S	S	*	*	H	α-helix	trans	-56.6	-37.5	177.9	0	0	0	0	0	112.8	P646 A651 R652	P646-A648 VanDerWaalsContact C-N 3.34Å; P646-A648 PolarHBondContact O-N 3.31Å; A648-A651 PolarHBondContact O-N 2.8Å; A648-R652 WeakPolarHBondContact O-CB 3.35Å; A648-R652 PolarHBondContact O-N 2.71Å
649	E	78.3	Confident	70.6	Confident	116 Å²	116	104.4 Å²	104.4	54%	0.542	61%	0.614	S	S	.	*	H	α-helix	trans	-62.4	-46.8	173	-172.2	117.8	-109.8	0	0	112.1	C647 A651 R652 L653	C647-E649 PolarHBondContact O-N 2.55Å; E649-A651 VanDerWaalsContact C-N 3.32Å; E649-A651 PolarHBondContact O-N 3.43Å; E649-R652 WeakPolarHBondContact O-CB 3.14Å; E649-R652 PolarHBondContact O-N 2.88Å; E649-R652 IonicContact OE1-CZ 3.54Å; E649-R652 IonicContact OE1-NH1 2.77Å; E649-R652 PolarHBondContact OE1-NH1 2.78Å; E649-R652 IonicContact OE1-NH2 2.71Å; E649-R652 PolarHBondContact OE1-NH2 3.09Å; E649-L653 HydrophobicContact CG-CD1 4.15Å; E649-L653 WeakPolarHBondContact O-CB 3.47Å; E649-L653 WeakPolarHBondContact O-CG 3.41Å; E649-L653 PolarHBondContact O-N 3.16Å
650	T	82.2	Confident	72.8	Confident	61 Å²	61	100.9 Å²	100.9	37%	0.374	60%	0.595	S	S	.	*	H	α-helix	trans	-67.3	-32.1	177.5	-55.6	0	0	0	0	112.3	C647 K654	C647-T650 PolarHBondContact O-N 2.83Å; C647-T650 PolarHBondContact SG-OG1 3.47Å; T650-K654 WeakPolarHBondContact O-CB 3.28Å; T650-K654 VanDerWaalsContact O-CG 3.27Å; T650-K654 WeakPolarHBondContact O-CG 3.49Å; T650-K654 PolarHBondContact O-N 3.25Å
651	A	83.6	Confident	75.3	Confident	60 Å²	60	101.2 Å²	101.2	50%	0.496	58%	0.581	S	S	.	*	H	α-helix	trans	-67.2	-43.7	171.1	0	0	0	0	0	111.1	C647 A648 E649 K654 Q655	C647-A651 PolarHBondContact O-N 2.82Å; A648-A651 PolarHBondContact O-N 2.8Å; E649-A651 VanDerWaalsContact C-N 3.32Å; E649-A651 PolarHBondContact O-N 3.43Å; A651-K654 PolarHBondContact O-N 2.95Å; A651-Q655 PolarHBondContact O-N 2.74Å
652	R	89.8	Confident	78	Confident	115 Å²	115	97.4 Å²	97.4	43%	0.434	56%	0.555	S	S	.	*	H	α-helix	trans	-61.2	-47.5	175.1	-160.2	-167	68.4	-119.4	-5.3	111.8	A648 E649 K654 Q655 E656	A648-R652 WeakPolarHBondContact O-CB 3.35Å; A648-R652 PolarHBondContact O-N 2.71Å; E649-R652 WeakPolarHBondContact O-CB 3.14Å; E649-R652 PolarHBondContact O-N 2.88Å; E649-R652 IonicContact OE1-CZ 3.54Å; E649-R652 IonicContact OE1-NH1 2.77Å; E649-R652 PolarHBondContact OE1-NH1 2.78Å; E649-R652 IonicContact OE1-NH2 2.71Å; E649-R652 PolarHBondContact OE1-NH2 3.09Å; R652-K654 VanDerWaalsContact C-N 3.33Å; R652-K654 PolarHBondContact O-N 2.97Å; R652-Q655 WeakPolarHBondContact O-CB 3.47Å; R652-Q655 PolarHBondContact O-N 3.15Å; R652-Q655 VanDerWaalsContact O-N 3.15Å; R652-E656 WeakPolarHBondContact CD-OE1 3.31Å; R652-E656 VanDerWaalsContact CG-OE1 3.31Å; R652-E656 WeakPolarHBondContact CG-OE1 3.31Å; R652-E656 IonicContact CZ-OE1 2.79Å; R652-E656 IonicContact NE-OE1 2.78Å; R652-E656 PolarHBondContact NE-OE1 2.82Å; R652-E656 IonicContact NH2-OE1 3.21Å; R652-E656 WeakPolarHBondContact O-CB 3.23Å; R652-E656 VanDerWaalsContact O-CG 3.31Å; R652-E656 WeakPolarHBondContact O-CG 3.45Å; R652-E656 PolarHBondContact O-N 3.21Å
653	L	92.1	Very high	80.6	Confident	89 Å²	89	92.5 Å²	92.5	47%	0.466	54%	0.536	S	S	.	.	H	α-helix	trans	-63.4	-34.5	177.1	-71.6	167.7	0	0	0	112.9	E649 L657	E649-L653 HydrophobicContact CG-CD1 4.15Å; E649-L653 WeakPolarHBondContact O-CB 3.47Å; E649-L653 WeakPolarHBondContact O-CG 3.41Å; E649-L653 PolarHBondContact O-N 3.16Å; L653-L657 VanDerWaalsContact O-CB 3.28Å; L653-L657 WeakPolarHBondContact O-CB 3.36Å; L653-L657 PolarHBondContact O-N 3.17Å
654	K	90.6	Very high	82.7	Confident	135 Å²	135	91.8 Å²	91.8	59%	0.587	53%	0.525	S	S	*	.	H	α-helix	trans	-66.8	-43.6	171.6	-77.6	174.2	178.9	-175.9	0	111.8	T650 A651 R652 L657 E658	T650-K654 WeakPolarHBondContact O-CB 3.28Å; T650-K654 VanDerWaalsContact O-CG 3.27Å; T650-K654 WeakPolarHBondContact O-CG 3.49Å; T650-K654 PolarHBondContact O-N 3.25Å; A651-K654 PolarHBondContact O-N 2.95Å; R652-K654 VanDerWaalsContact C-N 3.33Å; R652-K654 PolarHBondContact O-N 2.97Å; K654-L657 PolarHBondContact O-N 2.73Å; K654-E658 PolarHBondContact O-N 3.1Å
655	Q	93.3	Very high	85.3	Confident	96 Å²	96	93 Å²	93	45%	0.449	52%	0.515	S	S	.	.	H	α-helix	trans	-61.2	-48.4	175.1	179.4	65.1	42.1	0	0	111.3	A651 R652 L657 E658 D659	A651-Q655 PolarHBondContact O-N 2.74Å; R652-Q655 WeakPolarHBondContact O-CB 3.47Å; R652-Q655 PolarHBondContact O-N 3.15Å; R652-Q655 VanDerWaalsContact O-N 3.15Å; Q655-L657 VanDerWaalsContact C-N 3.32Å; Q655-L657 PolarHBondContact O-N 2.83Å; Q655-E658 PolarHBondContact O-N 2.82Å; Q655-E658 VanDerWaalsContact O-N 3.16Å; Q655-D659 PolarHBondContact NE2-OD2 3.05Å; Q655-D659 PolarHBondContact O-N 3.24Å
656	E	94	Very high	87.6	Confident	93 Å²	93	96.3 Å²	96.3	44%	0.435	51%	0.512	S	S	.	.	H	α-helix	trans	-56.8	-43	174.9	-71.6	168.1	-150.9	0	0	111.7	R652 D659 A660	R652-E656 WeakPolarHBondContact CD-OE1 3.31Å; R652-E656 VanDerWaalsContact CG-OE1 3.31Å; R652-E656 WeakPolarHBondContact CG-OE1 3.31Å; R652-E656 IonicContact CZ-OE1 2.79Å; R652-E656 IonicContact NE-OE1 2.78Å; R652-E656 PolarHBondContact NE-OE1 2.82Å; R652-E656 IonicContact NH2-OE1 3.21Å; R652-E656 WeakPolarHBondContact O-CB 3.23Å; R652-E656 VanDerWaalsContact O-CG 3.31Å; R652-E656 WeakPolarHBondContact O-CG 3.45Å; R652-E656 PolarHBondContact O-N 3.21Å; E656-D659 PolarHBondContact O-N 2.74Å; E656-A660 WeakPolarHBondContact O-CB 3.37Å; E656-A660 PolarHBondContact O-N 3.15Å
657	L	94.6	Very high	89.7	Confident	102 Å²	102	98.3 Å²	98.3	53%	0.534	50%	0.503	S	S	.	.	H	α-helix	trans	-66.3	-39.3	175.9	-179.5	62.4	0	0	0	112.5	L653 K654 Q655 H661	L653-L657 VanDerWaalsContact O-CB 3.28Å; L653-L657 WeakPolarHBondContact O-CB 3.36Å; L653-L657 PolarHBondContact O-N 3.17Å; K654-L657 PolarHBondContact O-N 2.73Å; Q655-L657 VanDerWaalsContact C-N 3.32Å; Q655-L657 PolarHBondContact O-N 2.83Å; L657-H661 PolarHBondContact O-N 3.15Å; L657-H661 PolarHBondContact O-ND1 3.22Å
658	E	95.1	Very high	91.4	Very high	102 Å²	102	95.7 Å²	95.7	48%	0.477	49%	0.489	S	S	.	.	H	α-helix	trans	-67.7	-39.4	174	-76	-169	-162.2	0	0	112.4	K654 Q655 H661 R662	K654-E658 PolarHBondContact O-N 3.1Å; Q655-E658 PolarHBondContact O-N 2.82Å; Q655-E658 VanDerWaalsContact O-N 3.16Å; E658-H661 CarbonylContact O-C 3.58Å; E658-H661 PolarHBondContact O-N 2.88Å; E658-R662 VanDerWaalsContact CB-NH2 3.3Å; E658-R662 WeakPolarHBondContact O-CG 3.44Å; E658-R662 PolarHBondContact O-N 2.85Å; E658-R662 IonicContact OE2-CZ 3.63Å; E658-R662 IonicContact OE2-NH1 3.11Å; E658-R662 PolarHBondContact OE2-NH1 3.48Å; E658-R662 IonicContact OE2-NH2 3.87Å; E658-R662 PolarHBondContact OE2-NH2 2.98Å
659	D	95.1	Very high	92.6	Very high	72 Å²	72	97.6 Å²	97.6	39%	0.385	49%	0.485	S	S	.	.	H	α-helix	trans	-67.2	-37.5	176.3	-74.7	-38.7	0	0	0	111.6	Q655 E656 H661 R662 A663	Q655-D659 PolarHBondContact NE2-OD2 3.05Å; Q655-D659 PolarHBondContact O-N 3.24Å; E656-D659 PolarHBondContact O-N 2.74Å; D659-H661 VanDerWaalsContact C-N 3.35Å; D659-H661 PolarHBondContact O-N 2.97Å; D659-R662 VanDerWaalsContact CG-NH2 3.33Å; D659-R662 PolarHBondContact O-N 3.46Å; D659-R662 IonicContact OD1-CZ 2.8Å; D659-R662 IonicContact OD1-NE 3.97Å; D659-R662 PolarHBondContact OD1-NE 3.05Å; D659-R662 IonicContact OD1-NH2 3.88Å; D659-R662 PolarHBondContact OD1-NH2 3.2Å; D659-R662 IonicContact OD2-NH2 3.79Å; D659-A663 WeakPolarHBondContact O-CB 3.3Å; D659-A663 PolarHBondContact O-N 3.36Å
660	A	94.8	Very high	93.5	Very high	56 Å²	56	95.4 Å²	95.4	46%	0.463	48%	0.482	S	S	.	.	H	α-helix	trans	-60.3	-42.1	169	0	0	0	0	0	112.1	E656 A663 L664	E656-A660 WeakPolarHBondContact O-CB 3.37Å; E656-A660 PolarHBondContact O-N 3.15Å; A660-A663 PolarHBondContact O-N 3.34Å; A660-L664 WeakPolarHBondContact O-CB 3.44Å; A660-L664 PolarHBondContact O-N 2.94Å
661	H	95.3	Very high	94.1	Very high	97 Å²	97	100.2 Å²	100.2	45%	0.449	49%	0.493	S	S	.	.	H	α-helix	trans	-67.6	-35	174	-75.5	109.9	0	0	0	113.2	L657 E658 D659 K665	L657-H661 PolarHBondContact O-N 3.15Å; L657-H661 PolarHBondContact O-ND1 3.22Å; E658-H661 CarbonylContact O-C 3.58Å; E658-H661 PolarHBondContact O-N 2.88Å; D659-H661 VanDerWaalsContact C-N 3.35Å; D659-H661 PolarHBondContact O-N 2.97Å; H661-K665 VanDerWaalsContact O-CG 3.32Å; H661-K665 WeakPolarHBondContact O-CG 3.31Å; H661-K665 PolarHBondContact O-N 2.8Å; H661-K665 VanDerWaalsContact O-N 3.1Å
662	R	96.3	Very high	94.7	Very high	93 Å²	93	104 Å²	104	35%	0.351	50%	0.495	S	S	.	.	H	α-helix	trans	-65.1	-47.1	173.2	-76	-177.4	-84.5	-92	2.2	110.5	E658 D659 K665 Q666	E658-R662 VanDerWaalsContact CB-NH2 3.3Å; E658-R662 WeakPolarHBondContact O-CG 3.44Å; E658-R662 PolarHBondContact O-N 2.85Å; E658-R662 IonicContact OE2-CZ 3.63Å; E658-R662 IonicContact OE2-NH1 3.11Å; E658-R662 PolarHBondContact OE2-NH1 3.48Å; E658-R662 IonicContact OE2-NH2 3.87Å; E658-R662 PolarHBondContact OE2-NH2 2.98Å; D659-R662 VanDerWaalsContact CG-NH2 3.33Å; D659-R662 PolarHBondContact O-N 3.46Å; D659-R662 IonicContact OD1-CZ 2.8Å; D659-R662 IonicContact OD1-NE 3.97Å; D659-R662 PolarHBondContact OD1-NE 3.05Å; D659-R662 IonicContact OD1-NH2 3.88Å; D659-R662 PolarHBondContact OD1-NH2 3.2Å; D659-R662 IonicContact OD2-NH2 3.79Å; R662-K665 PolarHBondContact O-N 2.89Å; R662-Q666 WeakPolarHBondContact O-CG 3.32Å; R662-Q666 PolarHBondContact O-N 2.98Å
663	A	95.3	Very high	94.9	Very high	50 Å²	50	104.3 Å²	104.3	41%	0.413	50%	0.501	S	S	.	.	H	α-helix	trans	-61.6	-44.4	176.1	0	0	0	0	0	112.4	D659 A660 K665 Q666 W667	D659-A663 WeakPolarHBondContact O-CB 3.3Å; D659-A663 PolarHBondContact O-N 3.36Å; A660-A663 PolarHBondContact O-N 3.34Å; A663-K665 VanDerWaalsContact C-N 3.35Å; A663-K665 PolarHBondContact O-N 3.15Å; A663-Q666 PolarHBondContact O-N 3.29Å; A663-W667 WeakPolarHBondContact O-CB 3.22Å; A663-W667 PolarHBondContact O-N 3.49Å
664	L	95.9	Very high	95	Very high	112 Å²	112	102.3 Å²	102.3	59%	0.586	49%	0.493	S	S	*	.	H	α-helix	trans	-62.2	-40.3	177.3	-176.7	62.7	0	0	0	112.1	A660 W667 G668	A660-L664 WeakPolarHBondContact O-CB 3.44Å; A660-L664 PolarHBondContact O-N 2.94Å; L664-W667 PolarHBondContact O-N 3.14Å; L664-G668 PolarHBondContact O-N 2.68Å
665	K	95.9	Very high	95.3	Very high	146 Å²	146	98.4 Å²	98.4	64%	0.635	49%	0.486	S	S	*	.	H	α-helix	trans	-62.5	-49.4	172.8	-74.5	172.1	-178.6	177.4	0	111.1	H661 R662 A663 W667 G668 H669	H661-K665 VanDerWaalsContact O-CG 3.32Å; H661-K665 WeakPolarHBondContact O-CG 3.31Å; H661-K665 PolarHBondContact O-N 2.8Å; H661-K665 VanDerWaalsContact O-N 3.1Å; R662-K665 PolarHBondContact O-N 2.89Å; A663-K665 VanDerWaalsContact C-N 3.35Å; A663-K665 PolarHBondContact O-N 3.15Å; K665-W667 VanDerWaalsContact C-N 3.32Å; K665-W667 PolarHBondContact O-N 2.8Å; K665-G668 CarbonylContact O-C 3.57Å; K665-G668 PolarHBondContact O-N 3.32Å; K665-G668 VanDerWaalsContact O-N 3.16Å; K665-H669 PolarHBondContact O-CD2 3.33Å; K665-H669 PolarHBondContact O-N 2.88Å
666	Q	94.8	Very high	95.3	Very high	139 Å²	139	100.4 Å²	100.4	65%	0.65	50%	0.495	S	S	*	.	H	α-helix	trans	-57	-44.2	177.1	-73	172.4	-3.1	0	0	112	R662 A663 H669 S670	R662-Q666 WeakPolarHBondContact O-CG 3.32Å; R662-Q666 PolarHBondContact O-N 2.98Å; A663-Q666 PolarHBondContact O-N 3.29Å; Q666-H669 PolarHBondContact O-N 3.2Å; Q666-H669 VanDerWaalsContact O-N 3.14Å; Q666-S670 PolarHBondContact O-N 3.3Å
667	W	95.4	Very high	95.3	Very high	173 Å²	173	98.5 Å²	98.5	66%	0.655	49%	0.492	S	S	*	.	H	α-helix	trans	-61.8	-44	175.7	-165.4	74.3	0	0	0	111.7	A663 L664 K665 H669 S670 W671	A663-W667 WeakPolarHBondContact O-CB 3.22Å; A663-W667 PolarHBondContact O-N 3.49Å; L664-W667 PolarHBondContact O-N 3.14Å; K665-W667 VanDerWaalsContact C-N 3.32Å; K665-W667 PolarHBondContact O-N 2.8Å; W667-H669 VanDerWaalsContact C-N 3.29Å; W667-H669 PolarHBondContact O-N 2.83Å; W667-S670 PolarHBondContact O-N 2.89Å; W667-W671 WeakPolarHBondContact O-CB 3.44Å; W667-W671 PolarHBondContact O-N 3.09Å
668	G	97.3	Very high	95.1	Very high	24 Å²	24	102.4 Å²	102.4	25%	0.247	50%	0.5	C	S	.	.	H	α-helix	trans	-64.3	-25.7	173.1	0	0	0	0	0	114.7	L664 K665 R672	L664-G668 PolarHBondContact O-N 2.68Å; K665-G668 CarbonylContact O-C 3.57Å; K665-G668 PolarHBondContact O-N 3.32Å; K665-G668 VanDerWaalsContact O-N 3.16Å; G668-R672 WeakPolarHBondContact O-CG 3.34Å; G668-R672 PolarHBondContact O-N 3.11Å; G668-R672 PolarHBondContact O-NE 3.46Å
669	H	95.6	Very high	95.2	Very high	119 Å²	119	100.4 Å²	100.4	55%	0.551	50%	0.5	S	S	*	.	H	α-helix	trans	-76.8	-46.3	169.3	-78.1	-78.8	0	0	0	111.7	K665 Q666 W667 W671 R672 H673	K665-H669 PolarHBondContact O-CD2 3.33Å; K665-H669 PolarHBondContact O-N 2.88Å; Q666-H669 PolarHBondContact O-N 3.2Å; Q666-H669 VanDerWaalsContact O-N 3.14Å; W667-H669 VanDerWaalsContact C-N 3.29Å; W667-H669 PolarHBondContact O-N 2.83Å; H669-W671 VanDerWaalsContact C-N 3.34Å; H669-W671 PolarHBondContact O-N 3.38Å; H669-R672 PolarHBondContact CE1-NH2 3.03Å; H669-R672 VanDerWaalsContact CE1-NH2 3.33Å; H669-R672 PolarHBondContact ND1-NH2 3.26Å; H669-R672 PolarHBondContact NE2-NH2 3.14Å; H669-R672 PolarHBondContact O-N 3.11Å; H669-H673 PolarHBondContact O-N 2.79Å
670	S	95.9	Very high	95.2	Very high	69 Å²	69	99.3 Å²	99.3	48%	0.483	50%	0.502	S	S	.	.	H	α-helix	trans	-58.2	-43.3	176.6	-176.3	0	0	0	0	112.4	Q666 W667 H673 T674	Q666-S670 PolarHBondContact O-N 3.3Å; W667-S670 PolarHBondContact O-N 2.89Å; S670-H673 PolarHBondContact O-N 2.72Å; S670-T674 WeakPolarHBondContact O-CB 3.38Å; S670-T674 PolarHBondContact O-N 3.02Å; S670-T674 PolarHBondContact O-OG1 3.1Å
671	W	94.6	Very high	95.2	Very high	162 Å²	162	100.7 Å²	100.7	61%	0.614	50%	0.504	S	S	*	.	H	α-helix	trans	-64.1	-40.9	176.9	-170.3	-114.1	0	0	0	112.7	W667 H669 T674 A675	W667-W671 WeakPolarHBondContact O-CB 3.44Å; W667-W671 PolarHBondContact O-N 3.09Å; H669-W671 VanDerWaalsContact C-N 3.34Å; H669-W671 PolarHBondContact O-N 3.38Å; W671-T674 PolarHBondContact O-N 3.37Å; W671-A675 WeakPolarHBondContact O-CB 3.41Å; W671-A675 PolarHBondContact O-N 3.3Å
672	R	96.5	Very high	95.2	Very high	139 Å²	139	101.8 Å²	101.8	53%	0.525	51%	0.508	S	S	.	.	H	α-helix	trans	-67.1	-42.3	176.2	-78.7	178	-70.5	-179.6	1.8	112.4	G668 H669 A675 Q676	G668-R672 WeakPolarHBondContact O-CG 3.34Å; G668-R672 PolarHBondContact O-N 3.11Å; G668-R672 PolarHBondContact O-NE 3.46Å; H669-R672 PolarHBondContact CE1-NH2 3.03Å; H669-R672 VanDerWaalsContact CE1-NH2 3.33Å; H669-R672 PolarHBondContact ND1-NH2 3.26Å; H669-R672 PolarHBondContact NE2-NH2 3.14Å; H669-R672 PolarHBondContact O-N 3.11Å; R672-A675 PolarHBondContact O-N 3.07Å; R672-Q676 WeakPolarHBondContact O-CG 3.48Å; R672-Q676 PolarHBondContact O-N 3.44Å
673	H	94.8	Very high	95.2	Very high	122 Å²	122	99.7 Å²	99.7	57%	0.565	51%	0.511	S	S	*	.	H	α-helix	trans	-59.7	-47.5	173.1	-178.5	-81.1	0	0	0	110.9	H669 S670 A675 Q676 S677	H669-H673 PolarHBondContact O-N 2.79Å; S670-H673 PolarHBondContact O-N 2.72Å; H673-A675 PolarHBondContact O-N 3.29Å; H673-Q676 WeakPolarHBondContact O-CB 3.37Å; H673-Q676 PolarHBondContact O-N 3.3Å; H673-S677 PolarHBondContact O-N 3.47Å; H673-S677 PolarHBondContact O-OG 3.45Å; H673-S677 VanDerWaalsContact O-OG 3.08Å
674	T	94.5	Very high	94.9	Very high	48 Å²	48	101.9 Å²	101.9	29%	0.294	52%	0.515	S	S	.	.	H	α-helix	trans	-59	-45.5	177.5	-58.4	0	0	0	0	111.6	S670 W671 Q676 S677 W678	S670-T674 WeakPolarHBondContact O-CB 3.38Å; S670-T674 PolarHBondContact O-N 3.02Å; S670-T674 PolarHBondContact O-OG1 3.1Å; W671-T674 PolarHBondContact O-N 3.37Å; T674-Q676 VanDerWaalsContact C-N 3.35Å; T674-Q676 PolarHBondContact O-N 3.14Å; T674-S677 PolarHBondContact O-N 2.93Å; T674-W678 VanDerWaalsContact O-CD1 3.22Å; T674-W678 PolarHBondContact O-N 3.03Å
675	A	95.6	Very high	94.7	Very high	53 Å²	53	98.8 Å²	98.8	44%	0.438	51%	0.506	S	S	.	.	H	α-helix	trans	-63.4	-36.9	176.6	0	0	0	0	0	112.9	W671 R672 H673 W678 A679	W671-A675 WeakPolarHBondContact O-CB 3.41Å; W671-A675 PolarHBondContact O-N 3.3Å; R672-A675 PolarHBondContact O-N 3.07Å; H673-A675 PolarHBondContact O-N 3.29Å; A675-W678 PolarHBondContact O-N 2.95Å; A675-A679 WeakPolarHBondContact O-CB 3.48Å; A675-A679 PolarHBondContact O-N 3.37Å
676	Q	94.9	Very high	94.6	Very high	137 Å²	137	95.8 Å²	95.8	64%	0.64	49%	0.494	S	S	*	.	H	α-helix	trans	-66.7	-42.6	173.5	-73.4	169.9	-22.2	0	0	111.8	R672 H673 T674 W678 A679 A680	R672-Q676 WeakPolarHBondContact O-CG 3.48Å; R672-Q676 PolarHBondContact O-N 3.44Å; H673-Q676 WeakPolarHBondContact O-CB 3.37Å; H673-Q676 PolarHBondContact O-N 3.3Å; T674-Q676 VanDerWaalsContact C-N 3.35Å; T674-Q676 PolarHBondContact O-N 3.14Å; Q676-W678 PolarHBondContact O-N 3.34Å; Q676-A679 PolarHBondContact O-N 3.41Å; Q676-A680 PolarHBondContact O-N 3.28Å
677	S	93.6	Very high	94.6	Very high	54 Å²	54	95.1 Å²	95.1	38%	0.378	49%	0.491	S	S	.	.	H	α-helix	trans	-60.8	-42.4	173.7	-52.5	0	0	0	0	112	H673 T674 A680 V681	H673-S677 PolarHBondContact O-N 3.47Å; H673-S677 PolarHBondContact O-OG 3.45Å; H673-S677 VanDerWaalsContact O-OG 3.08Å; T674-S677 PolarHBondContact O-N 2.93Å; S677-A680 PolarHBondContact O-N 3.03Å; S677-V681 WeakPolarHBondContact O-CG2 3.46Å; S677-V681 PolarHBondContact O-N 3.46Å
678	W	90.4	Very high	94.3	Very high	183 Å²	183	90.5 Å²	90.5	69%	0.693	49%	0.485	S	S	*	.	H	α-helix	trans	-64.3	-36.7	174.3	-84.6	107.8	0	0	0	113.1	T674 A675 Q676 K682	T674-W678 VanDerWaalsContact O-CD1 3.22Å; T674-W678 PolarHBondContact O-N 3.03Å; A675-W678 PolarHBondContact O-N 2.95Å; Q676-W678 PolarHBondContact O-N 3.34Å; W678-K682 WeakPolarHBondContact O-CB 3.37Å; W678-K682 PolarHBondContact O-N 2.91Å
679	A	96.9	Very high	94.1	Very high	60 Å²	60	96.9 Å²	96.9	50%	0.496	50%	0.502	S	S	.	.	H	α-helix	trans	-65.8	-41.5	176	0	0	0	0	0	112.1	A675 Q676 K682 A683	A675-A679 WeakPolarHBondContact O-CB 3.48Å; A675-A679 PolarHBondContact O-N 3.37Å; Q676-A679 PolarHBondContact O-N 3.41Å; A679-K682 PolarHBondContact O-N 2.97Å; A679-A683 PolarHBondContact O-N 2.92Å
680	A	95.4	Very high	94.1	Very high	50 Å²	50	93.8 Å²	93.8	41%	0.413	50%	0.497	S	S	.	.	H	α-helix	trans	-62.6	-52.9	174.3	0	0	0	0	0	111.6	Q676 S677 K682 A683 D684	Q676-A680 PolarHBondContact O-N 3.28Å; S677-A680 PolarHBondContact O-N 3.03Å; A680-K682 PolarHBondContact O-N 3.2Å; A680-K682 VanDerWaalsContact O-N 3.17Å; A680-A683 WeakPolarHBondContact O-CA 3.48Å; A680-A683 WeakPolarHBondContact O-CB 3.25Å; A680-A683 PolarHBondContact O-N 3.03Å; A680-D684 PolarHBondContact O-N 2.91Å
681	V	94.6	Very high	93.9	Very high	85 Å²	85	93.1 Å²	93.1	52%	0.515	49%	0.488	S	S	.	.	H	α-helix	trans	-58.9	-32.4	178	172.4	0	0	0	0	112.2	S677 A685	S677-V681 WeakPolarHBondContact O-CG2 3.46Å; S677-V681 PolarHBondContact O-N 3.46Å; V681-A685 VanDerWaalsContact O-CB 3.28Å; V681-A685 WeakPolarHBondContact O-CB 3.47Å; V681-A685 PolarHBondContact O-N 2.73Å; V681-A685 VanDerWaalsContact O-N 3.09Å
682	K	94.9	Very high	93.7	Very high	119 Å²	119	88.3 Å²	88.3	52%	0.517	48%	0.482	S	S	.	.	H	α-helix	trans	-67.7	-41.4	172.7	-177.6	179.7	177.9	-75.1	0	112.3	W678 A679 A680 A685 E686	W678-K682 WeakPolarHBondContact O-CB 3.37Å; W678-K682 PolarHBondContact O-N 2.91Å; A679-K682 PolarHBondContact O-N 2.97Å; A680-K682 PolarHBondContact O-N 3.2Å; A680-K682 VanDerWaalsContact O-N 3.17Å; K682-A685 CarbonylContact O-C 3.56Å; K682-A685 PolarHBondContact O-N 2.77Å; K682-E686 WeakPolarHBondContact CE-OE1 3.41Å; K682-E686 IonicContact NZ-OE1 2.7Å; K682-E686 PolarHBondContact NZ-OE1 3.41Å; K682-E686 IonicContact NZ-OE2 2.76Å; K682-E686 PolarHBondContact NZ-OE2 2.84Å; K682-E686 WeakPolarHBondContact O-CG 2.93Å; K682-E686 PolarHBondContact O-N 3.1Å
683	A	95.3	Very high	93.6	Very high	50 Å²	50	84.5 Å²	84.5	41%	0.413	48%	0.481	S	S	.	.	H	α-helix	trans	-65.8	-45.3	177	0	0	0	0	0	111.3	A679 A680 A685 E686 E687	A679-A683 PolarHBondContact O-N 2.92Å; A680-A683 WeakPolarHBondContact O-CA 3.48Å; A680-A683 WeakPolarHBondContact O-CB 3.25Å; A680-A683 PolarHBondContact O-N 3.03Å; A683-A685 PolarHBondContact O-N 2.88Å; A683-E686 CarbonylContact O-C 3.58Å; A683-E686 WeakPolarHBondContact O-CA 3.43Å; A683-E686 WeakPolarHBondContact O-CB 3.18Å; A683-E686 PolarHBondContact O-N 2.69Å; A683-E687 PolarHBondContact O-N 3.04Å
684	D	90.8	Very high	93.7	Very high	96 Å²	96	85.9 Å²	85.9	51%	0.513	48%	0.481	S	S	.	.	H	α-helix	trans	-58.6	-38.4	175.1	-60.1	-10.8	0	0	0	111.3	A680 E686 S688	A680-D684 PolarHBondContact O-N 2.91Å; D684-E686 VanDerWaalsContact C-N 3.3Å; D684-E686 PolarHBondContact O-N 3.26Å; D684-S688 WeakPolarHBondContact O-CB 3.47Å; D684-S688 PolarHBondContact O-N 3.17Å; D684-S688 PolarHBondContact O-OG 3.32Å
685	A	91.6	Very high	93.6	Very high	47 Å²	47	90 Å²	90	39%	0.388	50%	0.495	S	S	.	.	H	α-helix	trans	-76.6	-10.8	174.6	0	0	0	0	0	114.2	V681 K682 A683 R689	V681-A685 VanDerWaalsContact O-CB 3.28Å; V681-A685 WeakPolarHBondContact O-CB 3.47Å; V681-A685 PolarHBondContact O-N 2.73Å; V681-A685 VanDerWaalsContact O-N 3.09Å; K682-A685 CarbonylContact O-C 3.56Å; K682-A685 PolarHBondContact O-N 2.77Å; A683-A685 PolarHBondContact O-N 2.88Å; A685-R689 WeakPolarHBondContact O-CG 3.47Å; A685-R689 PolarHBondContact O-NE 3.06Å
686	E	93.7	Very high	93.5	Very high	83 Å²	83	90.3 Å²	90.3	39%	0.388	50%	0.498	S	S	.	.	H	α-helix	trans	-88.7	-44.9	170.2	-82.8	168.3	175.6	0	0	110.4	K682 A683 D684 R689 A690	K682-E686 WeakPolarHBondContact CE-OE1 3.41Å; K682-E686 IonicContact NZ-OE1 2.7Å; K682-E686 PolarHBondContact NZ-OE1 3.41Å; K682-E686 IonicContact NZ-OE2 2.76Å; K682-E686 PolarHBondContact NZ-OE2 2.84Å; K682-E686 WeakPolarHBondContact O-CG 2.93Å; K682-E686 PolarHBondContact O-N 3.1Å; A683-E686 CarbonylContact O-C 3.58Å; A683-E686 WeakPolarHBondContact O-CA 3.43Å; A683-E686 WeakPolarHBondContact O-CB 3.18Å; A683-E686 PolarHBondContact O-N 2.69Å; D684-E686 VanDerWaalsContact C-N 3.3Å; D684-E686 PolarHBondContact O-N 3.26Å; E686-R689 PolarHBondContact O-N 3.43Å; E686-R689 IonicContact OE1-NH2 2.81Å; E686-R689 PolarHBondContact OE1-NH2 3.5Å; E686-A690 PolarHBondContact O-N 3.48Å; E686-A690 VanDerWaalsContact O-N 3.08Å
687	E	93.9	Very high	93.6	Very high	125 Å²	125	87.5 Å²	87.5	58%	0.584	49%	0.49	S	S	*	.	H	α-helix	trans	-62.8	-44.8	172.5	-167.5	-174.4	152.7	0	0	111.9	A683 R689 A690 N691	A683-E687 PolarHBondContact O-N 3.04Å; E687-R689 PolarHBondContact O-N 3.35Å; E687-A690 WeakPolarHBondContact O-CB 3.37Å; E687-A690 PolarHBondContact O-N 2.87Å; E687-N691 PolarHBondContact O-N 3.33Å
688	S	89.1	Confident	93.6	Very high	76 Å²	76	89 Å²	89	53%	0.531	49%	0.491	S	S	.	.	H	α-helix	trans	-58.2	-34.3	176.8	-62.4	0	0	0	0	112.5	D684 A692	D684-S688 WeakPolarHBondContact O-CB 3.47Å; D684-S688 PolarHBondContact O-N 3.17Å; D684-S688 PolarHBondContact O-OG 3.32Å; S688-A692 WeakPolarHBondContact O-CB 3.46Å; S688-A692 PolarHBondContact O-N 2.73Å
689	R	93	Very high	93.8	Very high	157 Å²	157	82.4 Å²	82.4	59%	0.592	48%	0.475	S	S	*	.	H	α-helix	trans	-72.8	-38.9	174.5	-79.7	-175.9	-73.5	146.8	-14.8	112.4	A685 E686 E687 A692 A693	A685-R689 WeakPolarHBondContact O-CG 3.47Å; A685-R689 PolarHBondContact O-NE 3.06Å; E686-R689 PolarHBondContact O-N 3.43Å; E686-R689 IonicContact OE1-NH2 2.81Å; E686-R689 PolarHBondContact OE1-NH2 3.5Å; E687-R689 PolarHBondContact O-N 3.35Å; R689-A692 PolarHBondContact O-N 2.75Å; R689-A693 WeakPolarHBondContact O-CB 3.43Å; R689-A693 PolarHBondContact O-N 3.06Å
690	A	95.2	Very high	93.7	Very high	55 Å²	55	83.7 Å²	83.7	46%	0.455	47%	0.471	S	S	.	.	H	α-helix	trans	-63.6	-43	174.5	0	0	0	0	0	111.5	E686 E687 A693 R694	E686-A690 PolarHBondContact O-N 3.48Å; E686-A690 VanDerWaalsContact O-N 3.08Å; E687-A690 WeakPolarHBondContact O-CB 3.37Å; E687-A690 PolarHBondContact O-N 2.87Å; A690-A693 PolarHBondContact O-N 3.48Å; A690-R694 PolarHBondContact O-N 3.41Å
691	N	92.7	Very high	93.7	Very high	55 Å²	55	88.8 Å²	88.8	29%	0.294	48%	0.48	S	S	.	.	H	α-helix	trans	-65.9	-42.3	176.5	-70.9	-28.8	0	0	0	111.9	E687 A693 R694 F695	E687-N691 PolarHBondContact O-N 3.33Å; N691-A693 VanDerWaalsContact C-N 3.33Å; N691-A693 PolarHBondContact O-N 2.79Å; N691-R694 WeakPolarHBondContact O-CB 3.44Å; N691-R694 PolarHBondContact O-N 3.33Å; N691-F695 HydrophobicContact CB-CE2 4.39Å; N691-F695 WeakPolarHBondContact O-CD2 3.42Å; N691-F695 PolarHBondContact O-N 3.29Å
692	A	90.8	Very high	93.7	Very high	60 Å²	60	87.7 Å²	87.7	50%	0.496	48%	0.479	S	S	.	.	H	α-helix	trans	-60.5	-39.4	173	0	0	0	0	0	112.8	S688 R689 F695 A696	S688-A692 WeakPolarHBondContact O-CB 3.46Å; S688-A692 PolarHBondContact O-N 2.73Å; R689-A692 PolarHBondContact O-N 2.75Å; A692-F695 PolarHBondContact O-N 2.96Å; A692-A696 PolarHBondContact O-N 3.5Å
693	A	94.8	Very high	93.7	Very high	59 Å²	59	87.8 Å²	87.8	49%	0.488	48%	0.476	S	S	.	.	H	α-helix	trans	-65.5	-36.3	175.5	0	0	0	0	0	112.5	R689 A690 N691 A696 V697	R689-A693 WeakPolarHBondContact O-CB 3.43Å; R689-A693 PolarHBondContact O-N 3.06Å; A690-A693 PolarHBondContact O-N 3.48Å; N691-A693 VanDerWaalsContact C-N 3.33Å; N691-A693 PolarHBondContact O-N 2.79Å; A693-A696 PolarHBondContact O-N 3.1Å; A693-V697 PolarHBondContact O-N 3.31Å
694	R	95.6	Very high	93.8	Very high	151 Å²	151	91 Å²	91	57%	0.57	48%	0.483	S	S	*	.	H	α-helix	trans	-64.1	-49.6	173	-73.8	-176	56.5	-168.2	-10.1	112.3	A690 N691 A696 V697 E698	A690-R694 PolarHBondContact O-N 3.41Å; N691-R694 WeakPolarHBondContact O-CB 3.44Å; N691-R694 PolarHBondContact O-N 3.33Å; R694-A696 PolarHBondContact O-N 3.06Å; R694-V697 PolarHBondContact O-N 1.82Å; R694-E698 IonicContact NE-OE1 3.01Å; R694-E698 IonicContact NH2-OE1 2.75Å; R694-E698 PolarHBondContact NH2-OE1 2.65Å; R694-E698 WeakPolarHBondContact O-CG 3.46Å; R694-E698 PolarHBondContact O-N 2.88Å
695	F	92.6	Very high	94	Very high	134 Å²	134	89.3 Å²	89.3	59%	0.588	48%	0.482	S	S	*	.	H	α-helix	trans	-62.4	-30.7	178.2	-65.4	-51	0	0	0	112.6	N691 A692 E698 A699	N691-F695 HydrophobicContact CB-CE2 4.39Å; N691-F695 WeakPolarHBondContact O-CD2 3.42Å; N691-F695 PolarHBondContact O-N 3.29Å; A692-F695 PolarHBondContact O-N 2.96Å; F695-E698 WeakPolarHBondContact CD1-OE2 3.4Å; F695-E698 PolarHBondContact O-N 3.21Å; F695-A699 VanDerWaalsContact O-CB 3.24Å; F695-A699 WeakPolarHBondContact O-CB 3.41Å; F695-A699 PolarHBondContact O-N 2.99Å
696	A	93.8	Very high	94.2	Very high	60 Å²	60	92.5 Å²	92.5	50%	0.496	49%	0.489	S	S	.	.	H	α-helix	trans	-64.4	-40	172.4	0	0	0	0	0	112.9	A692 A693 R694 E700	A692-A696 PolarHBondContact O-N 3.5Å; A693-A696 PolarHBondContact O-N 3.1Å; R694-A696 PolarHBondContact O-N 3.06Å; A696-E700 PolarHBondContact O-N 2.81Å; A696-E700 VanDerWaalsContact O-N 3.1Å
697	V	96.8	Very high	94.4	Very high	79 Å²	79	94.1 Å²	94.1	48%	0.479	50%	0.497	S	S	.	.	H	α-helix	trans	-70.9	-38.6	175.4	174.2	0	0	0	0	111.6	A693 R694 A699 E700 R701	A693-V697 PolarHBondContact O-N 3.31Å; R694-V697 PolarHBondContact O-N 1.82Å; V697-A699 VanDerWaalsContact C-N 3.33Å; V697-E700 PolarHBondContact O-N 2.89Å; V697-R701 PolarHBondContact O-N 3.01Å
698	E	94.6	Very high	94.5	Very high	84 Å²	84	91.7 Å²	91.7	39%	0.393	49%	0.485	S	S	.	.	H	α-helix	trans	-66.3	-35.9	175.9	-68.8	165.9	-165.3	0	0	111.1	R694 F695 A702	R694-E698 IonicContact NE-OE1 3.01Å; R694-E698 IonicContact NH2-OE1 2.75Å; R694-E698 PolarHBondContact NH2-OE1 2.65Å; R694-E698 WeakPolarHBondContact O-CG 3.46Å; R694-E698 PolarHBondContact O-N 2.88Å; F695-E698 WeakPolarHBondContact CD1-OE2 3.4Å; F695-E698 PolarHBondContact O-N 3.21Å; E698-A702 PolarHBondContact O-N 3.47Å
699	A	93.7	Very high	94.8	Very high	45 Å²	45	90.1 Å²	90.1	37%	0.372	48%	0.477	S	S	.	.	H	α-helix	trans	-72.1	-29.7	174.3	0	0	0	0	0	114.3	F695 V697 A702 R703	F695-A699 VanDerWaalsContact O-CB 3.24Å; F695-A699 WeakPolarHBondContact O-CB 3.41Å; F695-A699 PolarHBondContact O-N 2.99Å; V697-A699 VanDerWaalsContact C-N 3.33Å; A699-A702 PolarHBondContact O-N 2.81Å; A699-R703 PolarHBondContact O-N 3.04Å
700	E	94.7	Very high	94.9	Very high	87 Å²	87	87.4 Å²	87.4	41%	0.407	47%	0.471	S	S	.	.	H	α-helix	trans	-66.6	-47.2	173.3	-161.5	69.5	-93.8	0	0	110.7	A696 V697 A702 R703 E704	A696-E700 PolarHBondContact O-N 2.81Å; A696-E700 VanDerWaalsContact O-N 3.1Å; V697-E700 PolarHBondContact O-N 2.89Å; E700-A702 PolarHBondContact O-N 3.19Å; E700-R703 WeakPolarHBondContact O-CA 3.46Å; E700-R703 WeakPolarHBondContact O-CB 3.32Å; E700-R703 PolarHBondContact O-N 3.41Å; E700-R703 IonicContact OE1-CZ 3.17Å; E700-R703 IonicContact OE1-NE 3.64Å; E700-R703 PolarHBondContact OE1-NE 3.3Å; E700-R703 IonicContact OE1-NH2 3.75Å; E700-R703 PolarHBondContact OE1-NH2 2.88Å; E700-R703 IonicContact OE2-CZ 2.78Å; E700-R703 IonicContact OE2-NH2 3.83Å; E700-R703 PolarHBondContact OE2-NH2 3.4Å; E700-E704 PolarHBondContact O-N 2.95Å
701	R	96.5	Very high	95	Very high	158 Å²	158	90.9 Å²	90.9	60%	0.596	47%	0.472	S	S	*	.	H	α-helix	trans	-59.7	-32.2	175.5	-67.5	173.6	-178.3	169.2	0.4	113.1	V697 A705	V697-R701 PolarHBondContact O-N 3.01Å; R701-A705 WeakPolarHBondContact O-CB 3.47Å; R701-A705 PolarHBondContact O-N 3.44Å
702	A	93.4	Very high	95.1	Very high	61 Å²	61	93.3 Å²	93.3	50%	0.504	48%	0.482	S	S	.	.	H	α-helix	trans	-66.8	-37.1	173.7	0	0	0	0	0	112.1	E698 A699 E700 E706	E698-A702 PolarHBondContact O-N 3.47Å; A699-A702 PolarHBondContact O-N 2.81Å; E700-A702 PolarHBondContact O-N 3.19Å; A702-E706 PolarHBondContact O-N 3.03Å
703	R	95.5	Very high	95.3	Very high	121 Å²	121	94.8 Å²	94.8	46%	0.457	48%	0.481	S	S	.	.	H	α-helix	trans	-67.9	-45.8	171.9	-72	-167.1	-73.5	-99.4	8.4	112.2	A699 E700 A705 E706 E707	A699-R703 PolarHBondContact O-N 3.04Å; E700-R703 WeakPolarHBondContact O-CA 3.46Å; E700-R703 WeakPolarHBondContact O-CB 3.32Å; E700-R703 PolarHBondContact O-N 3.41Å; E700-R703 IonicContact OE1-CZ 3.17Å; E700-R703 IonicContact OE1-NE 3.64Å; E700-R703 PolarHBondContact OE1-NE 3.3Å; E700-R703 IonicContact OE1-NH2 3.75Å; E700-R703 PolarHBondContact OE1-NH2 2.88Å; E700-R703 IonicContact OE2-CZ 2.78Å; E700-R703 IonicContact OE2-NH2 3.83Å; E700-R703 PolarHBondContact OE2-NH2 3.4Å; R703-A705 PolarHBondContact O-N 3Å; R703-E706 PolarHBondContact O-N 3.48Å; R703-E707 PolarHBondContact O-N 3.19Å
704	E	96.4	Very high	95.3	Very high	118 Å²	118	95.3 Å²	95.3	55%	0.551	48%	0.48	S	S	*	.	H	α-helix	trans	-55.9	-40.2	176.5	-66.6	172.6	154.6	0	0	111.4	E700 E708	E700-E704 PolarHBondContact O-N 2.95Å; E704-E708 WeakPolarHBondContact O-CB 3.11Å; E704-E708 PolarHBondContact O-N 3.5Å; E704-E708 VanDerWaalsContact O-N 3.09Å
705	A	96.3	Very high	95.3	Very high	60 Å²	60	93.6 Å²	93.6	50%	0.496	48%	0.482	S	S	.	.	H	α-helix	trans	-71.2	-34.7	174.6	0	0	0	0	0	113.6	R701 R703 A709	R701-A705 WeakPolarHBondContact O-CB 3.47Å; R701-A705 PolarHBondContact O-N 3.44Å; R703-A705 PolarHBondContact O-N 3Å; A705-A709 WeakPolarHBondContact O-CB 3.38Å; A705-A709 PolarHBondContact O-N 2.8Å
706	E	96	Very high	95.2	Very high	114 Å²	114	91.4 Å²	91.4	53%	0.533	48%	0.48	S	S	.	.	H	α-helix	trans	-66.9	-44.4	173.9	-163.1	-171.8	152.5	0	0	111.2	A702 R703 E708 A709 Q710	A702-E706 PolarHBondContact O-N 3.03Å; R703-E706 PolarHBondContact O-N 3.48Å; E706-E708 VanDerWaalsContact C-N 3.32Å; E706-E708 PolarHBondContact O-N 3.01Å; E706-A709 PolarHBondContact O-N 3.05Å; E706-Q710 WeakPolarHBondContact O-CB 3.48Å; E706-Q710 VanDerWaalsContact O-CG 3.28Å; E706-Q710 WeakPolarHBondContact O-CG 3.23Å; E706-Q710 PolarHBondContact O-N 3.06Å; E706-Q710 PolarHBondContact OE1-NE2 2.87Å
707	E	97.1	Very high	95	Very high	117 Å²	117	93.7 Å²	93.7	55%	0.547	48%	0.48	S	S	.	.	H	α-helix	trans	-64.3	-34.8	176.4	-70.3	-177.9	-173.1	0	0	112.4	R703 R711	R703-E707 PolarHBondContact O-N 3.19Å; E707-R711 WeakPolarHBondContact O-CG 3.35Å; E707-R711 PolarHBondContact O-N 3.28Å; E707-R711 PolarHBondContact O-NE 3.45Å
708	E	96.5	Very high	94.7	Very high	75 Å²	75	96.3 Å²	96.3	35%	0.35	49%	0.487	S	S	.	.	H	α-helix	trans	-64.7	-48.6	170.3	-178.2	60.3	-125.3	0	0	111.9	E704 E706 Q710 R711 Q712	E704-E708 WeakPolarHBondContact O-CB 3.11Å; E704-E708 PolarHBondContact O-N 3.5Å; E704-E708 VanDerWaalsContact O-N 3.09Å; E706-E708 VanDerWaalsContact C-N 3.32Å; E706-E708 PolarHBondContact O-N 3.01Å; E708-Q710 VanDerWaalsContact C-N 3.35Å; E708-Q710 PolarHBondContact O-N 3.44Å; E708-R711 PolarHBondContact O-N 3.09Å; E708-R711 IonicContact OE1-NH1 3.12Å; E708-R711 PolarHBondContact OE1-NH1 3.43Å; E708-R711 IonicContact OE2-CZ 2.63Å; E708-R711 IonicContact OE2-NH1 3.34Å; E708-R711 PolarHBondContact OE2-NH1 3.4Å; E708-R711 IonicContact OE2-NH2 3.51Å; E708-R711 PolarHBondContact OE2-NH2 3.2Å; E708-Q712 WeakPolarHBondContact O-CG 3.43Å; E708-Q712 PolarHBondContact O-N 2.83Å; E708-Q712 PolarHBondContact OE1-NE2 3.43Å
709	A	94.8	Very high	94.1	Very high	43 Å²	43	94.7 Å²	94.7	36%	0.355	49%	0.488	S	S	.	.	H	α-helix	trans	-62.3	-40.3	177.1	0	0	0	0	0	112.3	A705 E706 Q712 I713	A705-A709 WeakPolarHBondContact O-CB 3.38Å; A705-A709 PolarHBondContact O-N 2.8Å; E706-A709 PolarHBondContact O-N 3.05Å; A709-Q712 PolarHBondContact O-N 3.06Å; A709-I713 VanDerWaalsContact O-CG1 3.29Å; A709-I713 WeakPolarHBondContact O-CG1 3.28Å; A709-I713 PolarHBondContact O-N 3.1Å
710	Q	94.9	Very high	93.5	Very high	100 Å²	100	97.4 Å²	97.4	47%	0.467	50%	0.496	S	S	.	.	H	α-helix	trans	-62.2	-43.7	175	-72.9	178	19.1	0	0	111.5	E706 E708 Q712 I713 S714	E706-Q710 WeakPolarHBondContact O-CB 3.48Å; E706-Q710 VanDerWaalsContact O-CG 3.28Å; E706-Q710 WeakPolarHBondContact O-CG 3.23Å; E706-Q710 PolarHBondContact O-N 3.06Å; E706-Q710 PolarHBondContact OE1-NE2 2.87Å; E708-Q710 VanDerWaalsContact C-N 3.35Å; E708-Q710 PolarHBondContact O-N 3.44Å; Q710-Q712 VanDerWaalsContact C-N 3.34Å; Q710-Q712 PolarHBondContact O-N 3.03Å; Q710-I713 PolarHBondContact O-N 2.95Å; Q710-S714 PolarHBondContact O-N 3.43Å; Q710-S714 PolarHBondContact O-OG 3Å
711	R	97.3	Very high	92.8	Very high	127 Å²	127	99.4 Å²	99.4	48%	0.479	51%	0.505	S	S	.	.	H	α-helix	trans	-61.4	-40.2	174.3	-77.8	-177.5	-74.9	102.9	-6.2	112.5	E707 E708 S714 L715	E707-R711 WeakPolarHBondContact O-CG 3.35Å; E707-R711 PolarHBondContact O-N 3.28Å; E707-R711 PolarHBondContact O-NE 3.45Å; E708-R711 PolarHBondContact O-N 3.09Å; E708-R711 IonicContact OE1-NH1 3.12Å; E708-R711 PolarHBondContact OE1-NH1 3.43Å; E708-R711 IonicContact OE2-CZ 2.63Å; E708-R711 IonicContact OE2-NH1 3.34Å; E708-R711 PolarHBondContact OE2-NH1 3.4Å; E708-R711 IonicContact OE2-NH2 3.51Å; E708-R711 PolarHBondContact OE2-NH2 3.2Å; R711-S714 PolarHBondContact O-N 3.3Å; R711-L715 WeakPolarHBondContact O-CG 2.94Å; R711-L715 PolarHBondContact O-N 2.8Å; R711-L715 VanDerWaalsContact O-N 3.11Å
712	Q	95.4	Very high	91.8	Very high	106 Å²	106	95.5 Å²	95.5	50%	0.495	50%	0.502	S	S	.	.	H	α-helix	trans	-66.2	-39.8	175.5	-68.6	175.4	20.5	0	0	112.2	E708 A709 Q710 L715 V716	E708-Q712 WeakPolarHBondContact O-CG 3.43Å; E708-Q712 PolarHBondContact O-N 2.83Å; E708-Q712 PolarHBondContact OE1-NE2 3.43Å; A709-Q712 PolarHBondContact O-N 3.06Å; Q710-Q712 VanDerWaalsContact C-N 3.34Å; Q710-Q712 PolarHBondContact O-N 3.03Å; Q712-L715 PolarHBondContact O-N 2.78Å; Q712-V716 WeakPolarHBondContact O-CG2 3.49Å; Q712-V716 PolarHBondContact O-N 3.43Å; Q712-V716 VanDerWaalsContact O-N 3.11Å
713	I	94.6	Very high	90.9	Very high	92 Å²	92	99 Å²	99	47%	0.472	51%	0.512	S	S	.	.	H	α-helix	trans	-61.5	-44.5	173.6	-70.5	164	0	0	0	110.9	A709 Q710 L715 V716 Q717	A709-I713 VanDerWaalsContact O-CG1 3.29Å; A709-I713 WeakPolarHBondContact O-CG1 3.28Å; A709-I713 PolarHBondContact O-N 3.1Å; Q710-I713 PolarHBondContact O-N 2.95Å; I713-L715 PolarHBondContact O-N 3.08Å; I713-V716 PolarHBondContact O-N 2.7Å; I713-Q717 HydrophobicContact CG2-CG 4.33Å; I713-Q717 WeakPolarHBondContact O-CG 3.31Å; I713-Q717 PolarHBondContact O-N 2.75Å
714	S	94.4	Very high	89.6	Confident	69 Å²	69	101.7 Å²	101.7	48%	0.483	52%	0.522	S	S	.	.	H	α-helix	trans	-60.8	-42.7	177.4	-60.5	0	0	0	0	112.8	Q710 R711 V716 Q717 E718	Q710-S714 PolarHBondContact O-N 3.43Å; Q710-S714 PolarHBondContact O-OG 3Å; R711-S714 PolarHBondContact O-N 3.3Å; S714-V716 VanDerWaalsContact C-N 3.33Å; S714-V716 PolarHBondContact O-N 3.47Å; S714-Q717 PolarHBondContact O-N 3.47Å; S714-E718 PolarHBondContact O-N 2.87Å
715	L	95.3	Very high	88.1	Confident	116 Å²	116	99.4 Å²	99.4	61%	0.607	52%	0.519	S	S	*	.	H	α-helix	trans	-62.9	-38.3	176.1	-70.7	168.1	0	0	0	112.4	R711 Q712 I713 A719	R711-L715 WeakPolarHBondContact O-CG 2.94Å; R711-L715 PolarHBondContact O-N 2.8Å; R711-L715 VanDerWaalsContact O-N 3.11Å; Q712-L715 PolarHBondContact O-N 2.78Å; I713-L715 PolarHBondContact O-N 3.08Å; L715-A719 WeakPolarHBondContact O-CB 3.31Å; L715-A719 PolarHBondContact O-N 3.02Å; L715-A719 VanDerWaalsContact O-N 3.11Å
716	V	92.3	Very high	86.2	Confident	88 Å²	88	98 Å²	98	53%	0.533	51%	0.51	S	S	.	.	H	α-helix	trans	-70.7	-35.7	175.1	173.3	0	0	0	0	111.5	Q712 I713 S714 A719 L720	Q712-V716 WeakPolarHBondContact O-CG2 3.49Å; Q712-V716 PolarHBondContact O-N 3.43Å; Q712-V716 VanDerWaalsContact O-N 3.11Å; I713-V716 PolarHBondContact O-N 2.7Å; S714-V716 VanDerWaalsContact C-N 3.33Å; S714-V716 PolarHBondContact O-N 3.47Å; V716-A719 PolarHBondContact O-N 3.03Å; V716-L720 HydrophobicContact CG1-CD1 4.1Å; V716-L720 VanDerWaalsContact O-CG 3.29Å; V716-L720 WeakPolarHBondContact O-CG 3.32Å; V716-L720 PolarHBondContact O-N 2.9Å
717	Q	89.1	Confident	83.9	Confident	107 Å²	107	99.6 Å²	99.6	50%	0.5	52%	0.522	S	S	.	.	H	α-helix	trans	-65.1	-47	174.3	-74.7	172.4	-11.8	0	0	111.6	I713 S714 A719 L720 E721	I713-Q717 HydrophobicContact CG2-CG 4.33Å; I713-Q717 WeakPolarHBondContact O-CG 3.31Å; I713-Q717 PolarHBondContact O-N 2.75Å; S714-Q717 PolarHBondContact O-N 3.47Å; Q717-A719 VanDerWaalsContact C-N 3.31Å; Q717-A719 PolarHBondContact O-N 3.07Å; Q717-L720 PolarHBondContact O-N 2.84Å; Q717-L720 VanDerWaalsContact O-N 3.12Å; Q717-E721 WeakPolarHBondContact O-CG 3.45Å; Q717-E721 PolarHBondContact O-N 2.88Å
718	E	89.1	Confident	81.5	Confident	134 Å²	134	98.7 Å²	98.7	63%	0.626	52%	0.521	S	S	*	.	H	α-helix	trans	-57.8	-42.6	175.2	-174	-179.8	176.4	0	0	111.6	S714 E721 S722	S714-E718 PolarHBondContact O-N 2.87Å; E718-E721 PolarHBondContact O-N 3.26Å; E718-S722 VanDerWaalsContact O-CB 3.29Å; E718-S722 WeakPolarHBondContact O-CB 3.43Å; E718-S722 PolarHBondContact O-N 2.85Å
719	A	82.3	Confident	79.4	Confident	51 Å²	51	100.6 Å²	100.6	42%	0.421	54%	0.54	S	S	.	.	H	α-helix	trans	-62.2	-43.1	174.5	0	0	0	0	0	112.7	L715 V716 Q717 S722 L723	L715-A719 WeakPolarHBondContact O-CB 3.31Å; L715-A719 PolarHBondContact O-N 3.02Å; L715-A719 VanDerWaalsContact O-N 3.11Å; V716-A719 PolarHBondContact O-N 3.03Å; Q717-A719 VanDerWaalsContact C-N 3.31Å; Q717-A719 PolarHBondContact O-N 3.07Å; A719-S722 WeakPolarHBondContact O-CB 3.39Å; A719-S722 PolarHBondContact O-N 2.75Å; A719-L723 WeakPolarHBondContact O-CD1 3.48Å; A719-L723 PolarHBondContact O-N 3.01Å
720	L	81.1	Confident	77.1	Confident	101 Å²	101	105.9 Å²	105.9	53%	0.529	56%	0.557	S	S	.	*	H	α-helix	trans	-68.5	-35.3	178	-72.8	170.3	0	0	0	112.9	V716 Q717 R724	V716-L720 HydrophobicContact CG1-CD1 4.1Å; V716-L720 VanDerWaalsContact O-CG 3.29Å; V716-L720 WeakPolarHBondContact O-CG 3.32Å; V716-L720 PolarHBondContact O-N 2.9Å; Q717-L720 PolarHBondContact O-N 2.84Å; Q717-L720 VanDerWaalsContact O-N 3.12Å; L720-R724 WeakPolarHBondContact O-CB 3.45Å; L720-R724 PolarHBondContact O-N 3.21Å
721	E	80.9	Confident	75	Confident	129 Å²	129	103.8 Å²	103.8	60%	0.603	55%	0.549	S	S	*	.	H	α-helix	trans	-72	-37.5	174.6	-70.5	-172.5	168.4	0	0	111.8	Q717 E718 R724 S725	Q717-E721 WeakPolarHBondContact O-CG 3.45Å; Q717-E721 PolarHBondContact O-N 2.88Å; E718-E721 PolarHBondContact O-N 3.26Å; E721-R724 PolarHBondContact O-N 3.22Å; E721-S725 PolarHBondContact O-N 2.89Å
722	S	75.9	Confident	72.7	Confident	77 Å²	77	100.6 Å²	100.6	54%	0.538	55%	0.549	S	S	.	.	H	α-helix	trans	-57.3	-48.6	170	-176.1	0	0	0	0	111.4	E718 A719 R724 S725	E718-S722 VanDerWaalsContact O-CB 3.29Å; E718-S722 WeakPolarHBondContact O-CB 3.43Å; E718-S722 PolarHBondContact O-N 2.85Å; A719-S722 WeakPolarHBondContact O-CB 3.39Å; A719-S722 PolarHBondContact O-N 2.75Å; S722-R724 PolarHBondContact O-N 3.27Å; S722-S725 PolarHBondContact O-N 3.04Å; S722-S725 PolarHBondContact O-OG 3.08Å
723	L	73.1	Confident	70.4	Confident	134 Å²	134	100.7 Å²	100.7	70%	0.702	55%	0.553	S	S	*	*	H	α-helix	trans	-59	-45.1	172.9	-93.3	75.8	0	0	0	112.3	A719 S725 G726	A719-L723 WeakPolarHBondContact O-CD1 3.48Å; A719-L723 PolarHBondContact O-N 3.01Å; L723-S725 VanDerWaalsContact C-N 3.28Å; L723-S725 PolarHBondContact O-N 2.88Å; L723-G726 PolarHBondContact O-N 3.49Å; L723-G726 VanDerWaalsContact O-N 3.09Å
724	R	69.7	Low	68.3	Low	177 Å²	177	100.5 Å²	100.5	67%	0.668	55%	0.55	S	S	*	.	H	α-helix	trans	-66.1	-26.4	-179.8	-168.2	-177.9	-64.7	161.9	2.4	113.3	L720 E721 S722 G726	L720-R724 WeakPolarHBondContact O-CB 3.45Å; L720-R724 PolarHBondContact O-N 3.21Å; E721-R724 PolarHBondContact O-N 3.22Å; S722-R724 PolarHBondContact O-N 3.27Å; R724-G726 PolarHBondContact O-N 2.7Å
725	S	63.2	Low	66.3	Low	71 Å²	71	102.8 Å²	102.8	50%	0.497	55%	0.553	S	S	.	*	T	Hydrogen-bonded Turn	trans	-66.5	-14	173.9	79.6	0	0	0	0	113.4	E721 S722 L723 D727 N728	E721-S725 PolarHBondContact O-N 2.89Å; S722-S725 PolarHBondContact O-N 3.04Å; S722-S725 PolarHBondContact O-OG 3.08Å; L723-S725 VanDerWaalsContact C-N 3.28Å; L723-S725 PolarHBondContact O-N 2.88Å; S725-D727 VanDerWaalsContact C-N 3.28Å; S725-D727 PolarHBondContact O-N 3.5Å; S725-N728 PolarHBondContact O-ND2 3.42Å
726	G	56.6	Low	64.3	Low	30 Å²	30	102.6 Å²	102.6	31%	0.309	55%	0.552	S	S	.	*	T	Hydrogen-bonded Turn	trans	-63.8	-22.9	-179.2	0	0	0	0	0	115.6	L723 R724 N728	L723-G726 PolarHBondContact O-N 3.49Å; L723-G726 VanDerWaalsContact O-N 3.09Å; R724-G726 PolarHBondContact O-N 2.7Å; G726-N728 PolarHBondContact O-N 3.15Å
727	D	48.1	Very low	62.6	Low	147 Å²	147	104.2 Å²	104.2	79%	0.786	55%	0.554	S	S	*	*			trans	-75.2	34	-174.9	-69.3	-36.5	0	0	0	114.4	S725	S725-D727 VanDerWaalsContact C-N 3.28Å; S725-D727 PolarHBondContact O-N 3.5Å
728	N	47.3	Very low	61.1	Low	98 Å²	98	102.7 Å²	102.7	52%	0.524	55%	0.549	S	S	.	.			trans	-96.5	121.4	171.3	-82.6	-84.7	0	0	0	110.1	S725 G726 H730 L731	S725-N728 PolarHBondContact O-ND2 3.42Å; G726-N728 PolarHBondContact O-N 3.15Å; N728-H730 PolarHBondContact O-N 3.17Å; N728-L731 HydrophobicContact CB-CB 4.17Å; N728-L731 VanDerWaalsContact O-CB 3.28Å; N728-L731 WeakPolarHBondContact O-CB 3.27Å; N728-L731 PolarHBondContact O-N 3.05Å
729	P	52.5	Low	59.6	Low	115 Å²	115	99.7 Å²	99.7	75%	0.747	54%	0.536	S	S	*	.	H	α-helix	trans	-62.9	-19.9	177.3	25.1	-33.8	0	0	0	113	L731	P729-L731 VanDerWaalsContact C-N 3.31Å
730	H	46.5	Very low	58.6	Low	154 Å²	154	105.3 Å²	105.3	71%	0.713	55%	0.554	S	S	*	*	H	α-helix	trans	-70.3	-24.5	171.4	-128.5	-82.9	0	0	0	113.3	N728 H734	N728-H730 PolarHBondContact O-N 3.17Å; H730-H734 PolarHBondContact O-N 3.36Å
731	L	50.5	Low	57.7	Low	57 Å²	57	111.1 Å²	111.1	30%	0.298	57%	0.568	S	S	.	*	H	α-helix	trans	-76.7	-32.3	180	-165.8	69.5	0	0	0	112	N728 P729 L733 H734 Q735	N728-L731 HydrophobicContact CB-CB 4.17Å; N728-L731 VanDerWaalsContact O-CB 3.28Å; N728-L731 WeakPolarHBondContact O-CB 3.27Å; N728-L731 PolarHBondContact O-N 3.05Å; P729-L731 VanDerWaalsContact C-N 3.31Å; L731-L733 VanDerWaalsContact C-N 3.34Å; L731-L733 PolarHBondContact O-N 3.31Å; L731-H734 HydrophobicContact CD1-CB 4.48Å; L731-H734 CarbonylContact O-C 3.36Å; L731-H734 PolarHBondContact O-N 3.13Å; L731-H734 VanDerWaalsContact O-N 3.08Å; L731-Q735 HydrophobicContact CG-CG 4.45Å; L731-Q735 WeakPolarHBondContact O-CG 3.45Å; L731-Q735 PolarHBondContact O-N 2.81Å
732	A	49.4	Very low	57	Low	59 Å²	59	108.8 Å²	108.8	49%	0.488	56%	0.56	S	S	.	*	H	α-helix	trans	-60.8	-42.3	174.3	0	0	0	0	0	112.1	L736	A732-L736 PolarHBondContact O-N 2.87Å
733	L	46.1	Very low	56.8	Low	108 Å²	108	109.1 Å²	109.1	57%	0.565	56%	0.56	S	S	*	*	H	α-helix	trans	-67	-36.2	171.5	-87.1	163.4	0	0	0	112.3	L731 Q737	L731-L733 VanDerWaalsContact C-N 3.34Å; L731-L733 PolarHBondContact O-N 3.31Å; L733-Q737 WeakPolarHBondContact O-CG 3.31Å; L733-Q737 PolarHBondContact O-N 3.12Å
734	H	50.7	Low	56.8	Low	88 Å²	88	109 Å²	109	41%	0.407	56%	0.559	S	S	.	*	H	α-helix	trans	-71.8	-36.3	178.9	-161.9	53.3	0	0	0	113	H730 L731 L736 Q737 L738	H730-H734 PolarHBondContact O-N 3.36Å; L731-H734 HydrophobicContact CD1-CB 4.48Å; L731-H734 CarbonylContact O-C 3.36Å; L731-H734 PolarHBondContact O-N 3.13Å; L731-H734 VanDerWaalsContact O-N 3.08Å; H734-L736 PolarHBondContact O-N 2.82Å; H734-Q737 CarbonylContact O-C 3.55Å; H734-Q737 WeakPolarHBondContact O-CA 3.29Å; H734-Q737 WeakPolarHBondContact O-CB 3.49Å; H734-Q737 PolarHBondContact O-N 3.24Å; H734-Q737 VanDerWaalsContact O-N 3.09Å; H734-L738 WeakPolarHBondContact O-CB 3.36Å; H734-L738 WeakPolarHBondContact O-CG 3.35Å; H734-L738 PolarHBondContact O-N 3.15Å
735	Q	52.3	Low	56.8	Low	117 Å²	117	108.2 Å²	108.2	55%	0.547	56%	0.563	S	S	.	*	H	α-helix	trans	-61.1	-43.2	175.9	-79	175.7	-18.8	0	0	111.8	L731 Q737 L738 L739	L731-Q735 HydrophobicContact CG-CG 4.45Å; L731-Q735 WeakPolarHBondContact O-CG 3.45Å; L731-Q735 PolarHBondContact O-N 2.81Å; Q735-Q737 PolarHBondContact O-N 2.96Å; Q735-L738 PolarHBondContact O-N 3.48Å; Q735-L738 VanDerWaalsContact O-N 3.17Å; Q735-L739 PolarHBondContact O-N 3.45Å; Q735-L739 VanDerWaalsContact O-N 3.12Å
736	L	54	Low	56.9	Low	113 Å²	113	107.4 Å²	107.4	59%	0.592	56%	0.557	S	S	*	*	H	α-helix	trans	-61.8	-31.2	173.8	-73.1	166.2	0	0	0	112.9	A732 H734 L739 H740	A732-L736 PolarHBondContact O-N 2.87Å; H734-L736 PolarHBondContact O-N 2.82Å; L736-L739 HydrophobicContact CD2-CD1 4.38Å; L736-H740 PolarHBondContact O-ND1 3.2Å
737	Q	55.6	Low	57.8	Low	122 Å²	122	108.2 Å²	108.2	57%	0.57	56%	0.556	S	S	*	*	H	α-helix	trans	-79.8	-31.7	175.1	-67.1	170	-8.3	0	0	112.6	L733 H734 Q735 H740	L733-Q737 WeakPolarHBondContact O-CG 3.31Å; L733-Q737 PolarHBondContact O-N 3.12Å; H734-Q737 CarbonylContact O-C 3.55Å; H734-Q737 WeakPolarHBondContact O-CA 3.29Å; H734-Q737 WeakPolarHBondContact O-CB 3.49Å; H734-Q737 PolarHBondContact O-N 3.24Å; H734-Q737 VanDerWaalsContact O-N 3.09Å; Q735-Q737 PolarHBondContact O-N 2.96Å; Q737-H740 PolarHBondContact O-N 2.92Å
738	L	57.8	Low	59	Low	75 Å²	75	105.5 Å²	105.5	39%	0.393	54%	0.542	S	S	.	.	H	α-helix	trans	-71.4	-29.5	177.5	-77.5	169.4	0	0	0	113.2	H734 Q735 H740 R741 L742	H734-L738 WeakPolarHBondContact O-CB 3.36Å; H734-L738 WeakPolarHBondContact O-CG 3.35Å; H734-L738 PolarHBondContact O-N 3.15Å; Q735-L738 PolarHBondContact O-N 3.48Å; Q735-L738 VanDerWaalsContact O-N 3.17Å; L738-H740 PolarHBondContact O-N 2.85Å; L738-H740 VanDerWaalsContact O-N 3.13Å; L738-R741 PolarHBondContact O-N 3.3Å; L738-L742 PolarHBondContact O-N 3.23Å
739	L	57.7	Low	60.3	Low	70 Å²	70	104 Å²	104	37%	0.366	54%	0.539	S	S	.	.	G	3₁₀ helix	trans	-52.4	-34.7	173.7	-72.9	172.5	0	0	0	112.6	Q735 L736 R741 L742 L750	Q735-L739 PolarHBondContact O-N 3.45Å; Q735-L739 VanDerWaalsContact O-N 3.12Å; L736-L739 HydrophobicContact CD2-CD1 4.38Å; L739-R741 PolarHBondContact O-N 2.92Å; L739-L742 HydrophobicContact CD2-CD1 4.29Å; L739-L750 HydrophobicContact CD2-CD2 3.69Å
740	H	60.8	Low	61.5	Low	169 Å²	169	101.5 Å²	101.5	78%	0.782	52%	0.519	S	S	*	.	G	3₁₀ helix	trans	-75.9	-2.6	177.5	-69.9	87.8	0	0	0	114.5	L736 Q737 L738	L736-H740 PolarHBondContact O-ND1 3.2Å; Q737-H740 PolarHBondContact O-N 2.92Å; L738-H740 PolarHBondContact O-N 2.85Å; L738-H740 VanDerWaalsContact O-N 3.13Å
741	R	63.8	Low	63.1	Low	223 Å²	223	99.6 Å²	99.6	84%	0.842	51%	0.51	S	S	*	.	G	3₁₀ helix	trans	-117.6	-1.9	178.5	-67.8	-166	173.6	-146.7	-0.8	114	L738 L739	L738-R741 PolarHBondContact O-N 3.3Å; L739-R741 PolarHBondContact O-N 2.92Å
742	L	64.5	Low	64.5	Low	81 Å²	81	99.6 Å²	99.6	42%	0.424	52%	0.518	S	S	.	.	S	Bend	trans	-77.7	147.2	173.8	-68.6	175.8	0	0	0	111	L738 L739 V747	L738-L742 PolarHBondContact O-N 3.23Å; L739-L742 HydrophobicContact CD2-CD1 4.29Å; L742-V747 HydrophobicContact CB-CG2 3.69Å; L742-V747 HydrophobicContact CD1-CG2 4.5Å
743	P	72.9	Confident	65.7	Low	83 Å²	83	102.3 Å²	102.3	54%	0.539	52%	0.521	S	S	.	.			trans	-57.2	145.1	168.1	-22.9	33.8	0	0	0	111.3	E745 S746 V747	P743-E745 PolarHBondContact O-N 3.33Å; P743-E745 VanDerWaalsContact O-N 3.16Å; P743-S746 WeakPolarHBondContact O-CA 3.13Å; P743-S746 WeakPolarHBondContact O-CB 3.48Å; P743-S746 PolarHBondContact O-N 2.86Å; P743-V747 PolarHBondContact O-N 3.09Å; P743-V747 VanDerWaalsContact O-N 3.09Å
744	L	72.4	Confident	67.4	Low	132 Å²	132	102 Å²	102	69%	0.691	52%	0.519	S	S	*	.	H	α-helix	trans	-54.6	-38.5	-177.3	179.8	61.3	0	0	0	112.7	S746 V747 L748	L744-S746 PolarHBondContact O-N 3.29Å; L744-V747 PolarHBondContact O-N 3.39Å; L744-L748 HydrophobicContact CD1-CD1 4.33Å; L744-L748 HydrophobicContact CD1-CG 4.28Å; L744-L748 HydrophobicContact CG-CD1 3.99Å; L744-L748 HydrophobicContact CG-CG 4.4Å; L744-L748 WeakPolarHBondContact O-CB 3.22Å; L744-L748 VanDerWaalsContact O-CG 3.3Å; L744-L748 WeakPolarHBondContact O-CG 3.47Å; L744-L748 PolarHBondContact O-N 2.89Å
745	E	70.7	Confident	68.9	Low	161 Å²	161	101.1 Å²	101.1	75%	0.752	52%	0.522	S	S	*	.	H	α-helix	trans	-60	-42	175.2	-175.6	176.1	-168.7	0	0	112.6	P743 L748 S749	P743-E745 PolarHBondContact O-N 3.33Å; P743-E745 VanDerWaalsContact O-N 3.16Å; E745-L748 PolarHBondContact O-N 2.92Å; E745-S749 WeakPolarHBondContact O-CB 3.38Å; E745-S749 PolarHBondContact O-N 2.93Å
746	S	65.1	Low	70.4	Confident	53 Å²	53	99.3 Å²	99.3	37%	0.371	52%	0.522	S	S	.	.	H	α-helix	trans	-67.1	-37.5	176	-47.8	0	0	0	0	111.9	P743 L744 L750	P743-S746 WeakPolarHBondContact O-CA 3.13Å; P743-S746 WeakPolarHBondContact O-CB 3.48Å; P743-S746 PolarHBondContact O-N 2.86Å; L744-S746 PolarHBondContact O-N 3.29Å; S746-L750 WeakPolarHBondContact O-CB 3.48Å; S746-L750 PolarHBondContact O-N 3.07Å
747	V	75.7	Confident	71.6	Confident	47 Å²	47	97.7 Å²	97.7	29%	0.285	52%	0.52	S	S	.	.	H	α-helix	trans	-68.1	-41.6	175.9	-179.7	0	0	0	0	111.3	L742 P743 L744 L750 Q751	L742-V747 HydrophobicContact CB-CG2 3.69Å; L742-V747 HydrophobicContact CD1-CG2 4.5Å; P743-V747 PolarHBondContact O-N 3.09Å; P743-V747 VanDerWaalsContact O-N 3.09Å; L744-V747 PolarHBondContact O-N 3.39Å; V747-L750 PolarHBondContact O-N 3.02Å; V747-Q751 WeakPolarHBondContact O-CB 3.4Å; V747-Q751 PolarHBondContact O-N 3.17Å
748	L	73.6	Confident	73	Confident	91 Å²	91	97.1 Å²	97.1	48%	0.476	52%	0.52	S	S	.	.	H	α-helix	trans	-66.4	-39.3	175.7	-71.1	169.5	0	0	0	112.1	L744 E745 Q751 A752	L744-L748 HydrophobicContact CD1-CD1 4.33Å; L744-L748 HydrophobicContact CD1-CG 4.28Å; L744-L748 HydrophobicContact CG-CD1 3.99Å; L744-L748 HydrophobicContact CG-CG 4.4Å; L744-L748 WeakPolarHBondContact O-CB 3.22Å; L744-L748 VanDerWaalsContact O-CG 3.3Å; L744-L748 WeakPolarHBondContact O-CG 3.47Å; L744-L748 PolarHBondContact O-N 2.89Å; E745-L748 PolarHBondContact O-N 2.92Å; L748-Q751 PolarHBondContact O-N 2.92Å; L748-A752 PolarHBondContact O-N 2.95Å
749	S	74	Confident	74.3	Confident	67 Å²	67	98.5 Å²	98.5	47%	0.469	52%	0.524	S	S	.	.	H	α-helix	trans	-62.4	-46.6	173.4	-173.9	0	0	0	0	111.5	E745 Q751 A752 Q753	E745-S749 WeakPolarHBondContact O-CB 3.38Å; E745-S749 PolarHBondContact O-N 2.93Å; S749-Q751 VanDerWaalsContact C-N 3.33Å; S749-Q751 PolarHBondContact O-N 2.71Å; S749-A752 PolarHBondContact O-N 3.47Å; S749-Q753 WeakPolarHBondContact O-CG 3.48Å; S749-Q753 PolarHBondContact O-N 3.03Å
750	L	77	Confident	75.4	Confident	61 Å²	61	97.6 Å²	97.6	32%	0.319	53%	0.527	S	S	.	.	H	α-helix	trans	-61.7	-40.1	175.4	-172	69.5	0	0	0	111.8	L739 S746 V747 Q753 L754	L739-L750 HydrophobicContact CD2-CD2 3.69Å; S746-L750 WeakPolarHBondContact O-CB 3.48Å; S746-L750 PolarHBondContact O-N 3.07Å; V747-L750 PolarHBondContact O-N 3.02Å; L750-Q753 PolarHBondContact O-N 3.42Å; L750-L754 HydrophobicContact CG-CD1 4.11Å; L750-L754 WeakPolarHBondContact O-CB 3.41Å; L750-L754 VanDerWaalsContact O-CG 3.28Å; L750-L754 WeakPolarHBondContact O-CG 3.39Å; L750-L754 PolarHBondContact O-N 2.97Å
751	Q	81.5	Confident	76.5	Confident	114 Å²	114	93.8 Å²	93.8	53%	0.533	52%	0.516	S	S	.	.	H	α-helix	trans	-60.8	-46	174	-174	-177.9	14.2	0	0	111.4	V747 L748 S749 Q753 L754 C755	V747-Q751 WeakPolarHBondContact O-CB 3.4Å; V747-Q751 PolarHBondContact O-N 3.17Å; L748-Q751 PolarHBondContact O-N 2.92Å; S749-Q751 VanDerWaalsContact C-N 3.33Å; S749-Q751 PolarHBondContact O-N 2.71Å; Q751-Q753 PolarHBondContact O-N 3.39Å; Q751-L754 PolarHBondContact O-N 3.03Å; Q751-C755 WeakPolarHBondContact O-CB 3.39Å; Q751-C755 PolarHBondContact O-N 2.98Å; Q751-C755 PolarHBondContact O-SG 2.92Å
752	A	77.9	Confident	77.6	Confident	57 Å²	57	89 Å²	89	47%	0.471	50%	0.503	S	S	.	.	H	α-helix	trans	-63.7	-39.6	177.7	0	0	0	0	0	112.4	L748 S749 S756	L748-A752 PolarHBondContact O-N 2.95Å; S749-A752 PolarHBondContact O-N 3.47Å; A752-S756 WeakPolarHBondContact O-CB 3.28Å; A752-S756 PolarHBondContact O-N 2.76Å; A752-S756 PolarHBondContact O-OG 3.48Å
753	Q	75.7	Confident	78.5	Confident	117 Å²	117	89 Å²	89	55%	0.547	50%	0.501	S	S	.	.	H	α-helix	trans	-63.5	-47.7	172.8	-73.4	-177	-39.3	0	0	111.7	S749 L750 Q751 C755 S756 C757	S749-Q753 WeakPolarHBondContact O-CG 3.48Å; S749-Q753 PolarHBondContact O-N 3.03Å; L750-Q753 PolarHBondContact O-N 3.42Å; Q751-Q753 PolarHBondContact O-N 3.39Å; Q753-C755 PolarHBondContact O-N 3.22Å; Q753-S756 WeakPolarHBondContact O-CB 3.46Å; Q753-S756 PolarHBondContact O-N 2.88Å; Q753-S756 VanDerWaalsContact O-N 3.11Å; Q753-C757 PolarHBondContact O-N 3.37Å; Q753-C757 PolarHBondContact O-SG 3.18Å
754	L	81.8	Confident	79.1	Confident	100 Å²	100	89.3 Å²	89.3	52%	0.524	50%	0.501	S	S	.	.	H	α-helix	trans	-62.3	-43.3	178.8	-73.2	169.7	0	0	0	112.2	L750 Q751 S756 C757 L758	L750-L754 HydrophobicContact CG-CD1 4.11Å; L750-L754 WeakPolarHBondContact O-CB 3.41Å; L750-L754 VanDerWaalsContact O-CG 3.28Å; L750-L754 WeakPolarHBondContact O-CG 3.39Å; L750-L754 PolarHBondContact O-N 2.97Å; Q751-L754 PolarHBondContact O-N 3.03Å; L754-S756 VanDerWaalsContact C-N 3.29Å; L754-S756 PolarHBondContact O-N 3.43Å; L754-C757 PolarHBondContact O-N 3.28Å; L754-L758 WeakPolarHBondContact O-CB 3.46Å; L754-L758 WeakPolarHBondContact O-CG 3.32Å; L754-L758 PolarHBondContact O-N 2.96Å
755	C	82	Confident	79.6	Confident	71 Å²	71	86.2 Å²	86.2	48%	0.48	49%	0.487	S	S	.	.	H	α-helix	trans	-60	-39.4	172.5	-69.6	0	0	0	0	112.2	Q751 Q753 H759	Q751-C755 WeakPolarHBondContact O-CB 3.39Å; Q751-C755 PolarHBondContact O-N 2.98Å; Q751-C755 PolarHBondContact O-SG 2.92Å; Q753-C755 PolarHBondContact O-N 3.22Å; C755-H759 WeakPolarHBondContact O-CB 3.42Å; C755-H759 PolarHBondContact O-N 3.08Å
756	S	83.2	Confident	80.2	Confident	78 Å²	78	84.6 Å²	84.6	55%	0.545	48%	0.475	S	S	.	.	H	α-helix	trans	-67.4	-40.3	177.1	-57.2	0	0	0	0	112.1	A752 Q753 L754 A760	A752-S756 WeakPolarHBondContact O-CB 3.28Å; A752-S756 PolarHBondContact O-N 2.76Å; A752-S756 PolarHBondContact O-OG 3.48Å; Q753-S756 WeakPolarHBondContact O-CB 3.46Å; Q753-S756 PolarHBondContact O-N 2.88Å; Q753-S756 VanDerWaalsContact O-N 3.11Å; L754-S756 VanDerWaalsContact C-N 3.29Å; L754-S756 PolarHBondContact O-N 3.43Å; S756-A760 PolarHBondContact O-N 2.85Å
757	C	80.1	Confident	81	Confident	80 Å²	80	89.3 Å²	89.3	54%	0.541	49%	0.485	S	S	.	.	H	α-helix	trans	-67	-42.4	175.2	-67.7	0	0	0	0	112.1	Q753 L754 A760 V761	Q753-C757 PolarHBondContact O-N 3.37Å; Q753-C757 PolarHBondContact O-SG 3.18Å; L754-C757 PolarHBondContact O-N 3.28Å; C757-A760 PolarHBondContact O-N 3.46Å; C757-V761 WeakPolarHBondContact O-CG2 3.33Å; C757-V761 PolarHBondContact O-N 2.89Å
758	L	85.2	Confident	81.4	Confident	109 Å²	109	92.7 Å²	92.7	57%	0.571	50%	0.495	S	S	*	.	H	α-helix	trans	-60.1	-48.7	174.7	-74.7	168.4	0	0	0	111	L754 A760 V761 E762	L754-L758 WeakPolarHBondContact O-CB 3.46Å; L754-L758 WeakPolarHBondContact O-CG 3.32Å; L754-L758 PolarHBondContact O-N 2.96Å; L758-A760 VanDerWaalsContact C-N 3.28Å; L758-A760 PolarHBondContact O-N 3.42Å; L758-V761 CarbonylContact O-C 3.38Å; L758-V761 WeakPolarHBondContact O-CA 3.33Å; L758-V761 WeakPolarHBondContact O-CB 3.49Å; L758-V761 PolarHBondContact O-N 2.98Å; L758-E762 WeakPolarHBondContact O-CG 3.38Å; L758-E762 PolarHBondContact O-N 3.42Å
759	H	84	Confident	81.7	Confident	104 Å²	104	91.2 Å²	91.2	48%	0.481	49%	0.486	S	S	.	.	H	α-helix	trans	-60.8	-34.5	176.5	-179.2	-131.7	0	0	0	112.9	C755 E762 Q763	C755-H759 WeakPolarHBondContact O-CB 3.42Å; C755-H759 PolarHBondContact O-N 3.08Å; H759-E762 IonicContact CD2-OE2 2.68Å; H759-Q763 PolarHBondContact CE1-NE2 3.22Å; H759-Q763 PolarHBondContact NE2-NE2 3.4Å; H759-Q763 WeakPolarHBondContact O-CG 3.48Å; H759-Q763 PolarHBondContact O-N 2.88Å
760	A	80.9	Confident	82.1	Confident	52 Å²	52	95.4 Å²	95.4	43%	0.43	49%	0.492	S	S	.	.	H	α-helix	trans	-67.4	-40.5	172.3	0	0	0	0	0	112.4	S756 C757 L758 Q763 V764	S756-A760 PolarHBondContact O-N 2.85Å; C757-A760 PolarHBondContact O-N 3.46Å; L758-A760 VanDerWaalsContact C-N 3.28Å; L758-A760 PolarHBondContact O-N 3.42Å; A760-Q763 PolarHBondContact O-N 3.24Å; A760-V764 WeakPolarHBondContact O-CG2 3.37Å; A760-V764 PolarHBondContact O-N 3.49Å; A760-V764 VanDerWaalsContact O-N 3.11Å
761	V	83.6	Confident	82.4	Confident	89 Å²	89	97.9 Å²	97.9	54%	0.539	50%	0.502	S	S	.	.	H	α-helix	trans	-64.8	-44.2	174	171.2	0	0	0	0	111	C757 L758 Q763 V764 V765	C757-V761 WeakPolarHBondContact O-CG2 3.33Å; C757-V761 PolarHBondContact O-N 2.89Å; L758-V761 CarbonylContact O-C 3.38Å; L758-V761 WeakPolarHBondContact O-CA 3.33Å; L758-V761 WeakPolarHBondContact O-CB 3.49Å; L758-V761 PolarHBondContact O-N 2.98Å; V761-Q763 VanDerWaalsContact C-N 3.32Å; V761-Q763 PolarHBondContact O-N 3.14Å; V761-V764 PolarHBondContact O-N 3.33Å; V761-V765 HydrophobicContact CG1-CG2 4.28Å; V761-V765 WeakPolarHBondContact O-CG2 3.41Å; V761-V765 PolarHBondContact O-N 2.84Å
762	E	86.8	Confident	82.5	Confident	122 Å²	122	93.2 Å²	93.2	57%	0.57	48%	0.482	S	S	*	.	H	α-helix	trans	-56.9	-43.2	174.7	-72.4	172.1	164.8	0	0	111.7	L758 H759 V764 V765 Y766	L758-E762 WeakPolarHBondContact O-CG 3.38Å; L758-E762 PolarHBondContact O-N 3.42Å; H759-E762 IonicContact CD2-OE2 2.68Å; E762-V764 VanDerWaalsContact C-N 3.35Å; E762-V764 PolarHBondContact O-N 3.36Å; E762-V765 PolarHBondContact O-N 3.34Å; E762-Y766 VanDerWaalsContact O-CB 3.27Å; E762-Y766 WeakPolarHBondContact O-CB 3.37Å; E762-Y766 PolarHBondContact O-N 3.49Å
763	Q	84.3	Confident	82.9	Confident	81 Å²	81	90.6 Å²	90.6	38%	0.379	46%	0.46	S	S	.	.	H	α-helix	trans	-63.4	-37.3	174.2	-74.4	-177.1	36	0	0	113.1	H759 A760 V761 R767	H759-Q763 PolarHBondContact CE1-NE2 3.22Å; H759-Q763 PolarHBondContact NE2-NE2 3.4Å; H759-Q763 WeakPolarHBondContact O-CG 3.48Å; H759-Q763 PolarHBondContact O-N 2.88Å; A760-Q763 PolarHBondContact O-N 3.24Å; V761-Q763 VanDerWaalsContact C-N 3.32Å; V761-Q763 PolarHBondContact O-N 3.14Å; Q763-R767 WeakPolarHBondContact O-CB 3.44Å; Q763-R767 WeakPolarHBondContact O-CG 3.37Å; Q763-R767 PolarHBondContact O-N 3.4Å
764	V	84.8	Confident	83.2	Confident	89 Å²	89	86.9 Å²	86.9	54%	0.539	45%	0.445	S	S	.	.	H	α-helix	trans	-68.7	-43.4	175.6	171.9	0	0	0	0	111	A760 V761 E762 R767 K768	A760-V764 WeakPolarHBondContact O-CG2 3.37Å; A760-V764 PolarHBondContact O-N 3.49Å; A760-V764 VanDerWaalsContact O-N 3.11Å; V761-V764 PolarHBondContact O-N 3.33Å; E762-V764 VanDerWaalsContact C-N 3.35Å; E762-V764 PolarHBondContact O-N 3.36Å; V764-R767 PolarHBondContact O-N 3.43Å; V764-K768 WeakPolarHBondContact O-CB 3.35Å; V764-K768 WeakPolarHBondContact O-CG 3.41Å; V764-K768 PolarHBondContact O-N 3.23Å
765	V	83.7	Confident	83.1	Confident	67 Å²	67	85.4 Å²	85.4	41%	0.406	44%	0.44	S	S	.	.	H	α-helix	trans	-60.3	-47.8	175.2	170.7	0	0	0	0	110.8	V761 E762 R767 K768 Q769	V761-V765 HydrophobicContact CG1-CG2 4.28Å; V761-V765 WeakPolarHBondContact O-CG2 3.41Å; V761-V765 PolarHBondContact O-N 2.84Å; E762-V765 PolarHBondContact O-N 3.34Å; V765-R767 PolarHBondContact O-N 2.93Å; V765-K768 PolarHBondContact O-N 2.96Å; V765-K768 VanDerWaalsContact O-N 3.16Å; V765-Q769 HydrophobicContact CG1-CG 4.36Å; V765-Q769 WeakPolarHBondContact O-CG 3.4Å; V765-Q769 PolarHBondContact O-N 3.16Å
766	Y	83.3	Confident	83.1	Confident	128 Å²	128	84.8 Å²	84.8	50%	0.502	44%	0.436	S	S	.	.	H	α-helix	trans	-62	-40.6	178.2	-179.2	-103.1	0	0	0	112.9	E762 R770	E762-Y766 VanDerWaalsContact O-CB 3.27Å; E762-Y766 WeakPolarHBondContact O-CB 3.37Å; E762-Y766 PolarHBondContact O-N 3.49Å; Y766-R770 WeakPolarHBondContact O-CG 3.31Å; Y766-R770 PolarHBondContact O-N 3.34Å; Y766-R770 PolarHBondContact OH-NE 3.13Å; Y766-R770 VanDerWaalsContact OH-NE 3.08Å; Y766-R770 PolarHBondContact OH-NH2 3.47Å; Y766-R770 VanDerWaalsContact OH-NH2 3.13Å
767	R	82.9	Confident	82.9	Confident	151 Å²	151	83.3 Å²	83.3	57%	0.57	43%	0.433	S	S	*	.	H	α-helix	trans	-63.4	-45.4	172.3	-73.4	173	-167.1	-149.6	7	111.1	Q763 V764 V765 R770 Q771	Q763-R767 WeakPolarHBondContact O-CB 3.44Å; Q763-R767 WeakPolarHBondContact O-CG 3.37Å; Q763-R767 PolarHBondContact O-N 3.4Å; V764-R767 PolarHBondContact O-N 3.43Å; V765-R767 PolarHBondContact O-N 2.93Å; R767-R770 PolarHBondContact O-N 2.96Å; R767-Q771 WeakPolarHBondContact O-CB 3.43Å; R767-Q771 WeakPolarHBondContact O-CG 3.36Å; R767-Q771 PolarHBondContact O-N 2.88Å
768	K	82.6	Confident	83	Confident	118 Å²	118	85.1 Å²	85.1	51%	0.513	43%	0.433	S	S	.	.	H	α-helix	trans	-63.1	-47	179.3	-80	-70	-173	177.3	0	112.5	V764 V765 R770 Q771 C772	V764-K768 WeakPolarHBondContact O-CB 3.35Å; V764-K768 WeakPolarHBondContact O-CG 3.41Å; V764-K768 PolarHBondContact O-N 3.23Å; V765-K768 PolarHBondContact O-N 2.96Å; V765-K768 VanDerWaalsContact O-N 3.16Å; K768-R770 PolarHBondContact O-N 2.81Å; K768-R770 VanDerWaalsContact O-N 3.14Å; K768-Q771 PolarHBondContact O-N 3.45Å; K768-Q771 VanDerWaalsContact O-N 3.12Å; K768-C772 HydrophobicContact CD-CB 4.37Å; K768-C772 VanDerWaalsContact CD-SG 3.57Å; K768-C772 WeakPolarHBondContact O-CB 3.48Å; K768-C772 PolarHBondContact O-N 2.83Å
769	Q	81.3	Confident	82.9	Confident	60 Å²	60	87 Å²	87	28%	0.28	44%	0.439	S	S	.	.	H	α-helix	trans	-56.1	-30	175.7	-75.1	169.5	-20.2	0	0	113	V765 G789 L790 L803	V765-Q769 HydrophobicContact CG1-CG 4.36Å; V765-Q769 WeakPolarHBondContact O-CG 3.4Å; V765-Q769 PolarHBondContact O-N 3.16Å; Q769-G789 CarbonylContact O-C 3.58Å; Q769-G789 WeakPolarHBondContact O-CA 3.32Å; Q769-L790 PolarHBondContact O-N 3.05Å; Q769-L803 HydrophobicContact CG-CD1 4.36Å
770	R	81.7	Confident	82.9	Confident	155 Å²	155	82.7 Å²	82.7	59%	0.585	42%	0.423	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.7	1.8	-179	-70.8	-178.9	170.4	-91.4	5.9	115.4	Y766 R767 K768 L790	Y766-R770 WeakPolarHBondContact O-CG 3.31Å; Y766-R770 PolarHBondContact O-N 3.34Å; Y766-R770 PolarHBondContact OH-NE 3.13Å; Y766-R770 VanDerWaalsContact OH-NE 3.08Å; Y766-R770 PolarHBondContact OH-NH2 3.47Å; Y766-R770 VanDerWaalsContact OH-NH2 3.13Å; R767-R770 PolarHBondContact O-N 2.96Å; K768-R770 PolarHBondContact O-N 2.81Å; K768-R770 VanDerWaalsContact O-N 3.14Å; R770-L790 WeakPolarHBondContact O-CD1 3.27Å
771	Q	82.9	Confident	82.8	Confident	113 Å²	113	83.9 Å²	83.9	53%	0.528	43%	0.428	S	S	.	.	T	Hydrogen-bonded Turn	trans	-132.6	-26.9	-177.4	-68.5	-179.9	-21.4	0	0	113	R767 K768 Q779 G780	R767-Q771 WeakPolarHBondContact O-CB 3.43Å; R767-Q771 WeakPolarHBondContact O-CG 3.36Å; R767-Q771 PolarHBondContact O-N 2.88Å; K768-Q771 PolarHBondContact O-N 3.45Å; K768-Q771 VanDerWaalsContact O-N 3.12Å; Q771-Q779 PolarHBondContact O-NE2 2.76Å; Q771-G780 PolarHBondContact O-N 2.85Å
772	C	85	Confident	82.6	Confident	17 Å²	17	82 Å²	82	12%	0.115	42%	0.421	C	S	.	.	B	Isolated β-bridge	trans	-112.7	149.8	-177.2	-67.9	0	0	0	0	111.7	K768 V774 G777 E778	K768-C772 HydrophobicContact CD-CB 4.37Å; K768-C772 VanDerWaalsContact CD-SG 3.57Å; K768-C772 WeakPolarHBondContact O-CB 3.48Å; K768-C772 PolarHBondContact O-N 2.83Å; C772-V774 PolarHBondContact O-N 3.2Å; C772-G777 WeakPolarHBondContact CB-O 3.41Å; C772-G777 PolarHBondContact SG-O 2.77Å; C772-E778 CarbonylContact C-O 3.58Å; C772-E778 WeakPolarHBondContact CA-O 3.43Å
773	C	84.9	Confident	82.3	Confident	2 Å²	2	80.2 Å²	80.2	1%	0.014	42%	0.423	C	S	.	.	B	Isolated β-bridge	trans	-62.3	123.9	164.9	177.3	0	0	0	0	109.6	T775 C776 G777 E778 L790 C792	C773-T775 PolarHBondContact O-N 2.76Å; C773-C776 VanDerWaalsContact CB-SG 3.57Å; C773-C776 PolarHBondContact O-N 3.47Å; C773-G777 WeakPolarHBondContact O-CA 3.31Å; C773-G777 PolarHBondContact O-N 2.82Å; C773-E778 PolarHBondContact N-O 3.23Å; C773-L790 CarbonylContact C-O 3.57Å; C773-L790 WeakPolarHBondContact CA-O 3.36Å; C773-C792 HydrophobicContact CB-CB 3.96Å; C773-C792 PolarHBondContact SG-N 3.48Å; C773-C792 VanDerWaalsContact SG-N 3.38Å
774	V	82.8	Confident	81.9	Confident	38 Å²	38	76.7 Å²	76.7	23%	0.23	41%	0.406	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66	-18.1	-178.6	-61	0	0	0	0	113.7	C772 L784 L790 P802 L803	C772-V774 PolarHBondContact O-N 3.2Å; V774-L784 HydrophobicContact CG2-CD1 3.57Å; V774-L790 PolarHBondContact N-O 3.1Å; V774-P802 HydrophobicContact CB-CG 4.44Å; V774-P802 HydrophobicContact CG2-CG 4.08Å; V774-L803 HydrophobicContact CG1-CD1 4.14Å
775	T	79.1	Confident	81.4	Confident	70 Å²	70	78.9 Å²	78.9	43%	0.429	42%	0.423	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.7	-35.8	-177.9	-42	0	0	0	0	113.3	C773	C773-T775 PolarHBondContact O-N 2.76Å
776	C	81.6	Confident	81.1	Confident	58 Å²	58	78.1 Å²	78.1	39%	0.392	42%	0.42	S	S	.	.	T	Hydrogen-bonded Turn	trans	-126.9	-10.6	-174.2	66.6	0	0	0	0	115.5	C773 E778 C792	C773-C776 VanDerWaalsContact CB-SG 3.57Å; C773-C776 PolarHBondContact O-N 3.47Å; C776-E778 VanDerWaalsContact C-N 3.25Å; C776-E778 HydrophobicContact CB-CG 4.48Å; C776-E778 PolarHBondContact O-N 2.76Å; C776-E778 PolarHBondContact SG-OE2 3.39Å; C776-E778 VanDerWaalsContact SG-OE2 3.39Å; C776-C792 VanDerWaalsContact SG-SG 3.65Å
777	G	79.8	Confident	80.7	Confident	46 Å²	46	74.7 Å²	74.7	47%	0.474	42%	0.423	S	S	.	.	S	Bend	trans	79.6	-9	-179.6	0	0	0	0	0	116.2	C772 C773	C772-G777 WeakPolarHBondContact CB-O 3.41Å; C772-G777 PolarHBondContact SG-O 2.77Å; C773-G777 WeakPolarHBondContact O-CA 3.31Å; C773-G777 PolarHBondContact O-N 2.82Å
778	E	82.1	Confident	80.5	Confident	118 Å²	118	71.2 Å²	71.2	55%	0.551	41%	0.413	S	S	*	.	S	Bend	trans	-67.7	177.6	173.3	-58.1	-179.2	130.5	0	0	112.1	C772 C773 C776 G780	C772-E778 CarbonylContact C-O 3.58Å; C772-E778 WeakPolarHBondContact CA-O 3.43Å; C773-E778 PolarHBondContact N-O 3.23Å; C776-E778 VanDerWaalsContact C-N 3.25Å; C776-E778 HydrophobicContact CB-CG 4.48Å; C776-E778 PolarHBondContact O-N 2.76Å; C776-E778 PolarHBondContact SG-OE2 3.39Å; C776-E778 VanDerWaalsContact SG-OE2 3.39Å; E778-G780 PolarHBondContact O-N 3.39Å
779	Q	83.9	Confident	80.5	Confident	149 Å²	149	65.9 Å²	65.9	70%	0.696	39%	0.392	S	S	*	.	B	Isolated β-bridge	trans	-59.9	124	179.5	-161.8	83.2	83.1	0	0	111.5	Q771 C792	Q771-Q779 PolarHBondContact O-NE2 2.76Å; Q779-C792 WeakPolarHBondContact O-CB 3.44Å
780	G	82.4	Confident	80.7	Confident	13 Å²	13	64.7 Å²	64.7	13%	0.134	39%	0.387	C	S	.	.			trans	-85.6	141.8	175.5	0	0	0	0	0	112	Q771 E778	Q771-G780 PolarHBondContact O-N 2.85Å; E778-G780 PolarHBondContact O-N 3.39Å
781	S	78.4	Confident	80.8	Confident	78 Å²	78	58 Å²	58	55%	0.545	36%	0.362	S	S	.	.			trans	-121.7	-33.8	-178.6	56.4	0	0	0	0	113.8	Q791	S781-Q791 PolarHBondContact N-O 2.78Å
782	A	80.2	Confident	80.9	Confident	48 Å²	48	53 Å²	53	40%	0.397	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	144	178.2	0	0	0	0	0	111.6	L790 Q791	A782-L790 CarbonylContact O-C 3.44Å; A782-L790 WeakPolarHBondContact O-CA 3.42Å; A782-L790 WeakPolarHBondContact O-CB 3.28Å; A782-Q791 PolarHBondContact N-O 2.7Å; A782-Q791 PolarHBondContact O-N 2.91Å
783	S	80.8	Confident	80.6	Confident	86 Å²	86	59.8 Å²	59.8	60%	0.601	37%	0.37	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.6	135	171.3	-176.5	0	0	0	0	110.6
784	L	76.6	Confident	80.3	Confident	6 Å²	6	64.4 Å²	64.4	3%	0.031	40%	0.403	C	S	.	.			trans	-67.5	147	169	-69.9	174.9	0	0	0	110.9	V774 C786 G787 G789 Q791 C801	V774-L784 HydrophobicContact CG2-CD1 3.57Å; L784-C786 PolarHBondContact O-N 2.97Å; L784-G787 PolarHBondContact O-N 3.34Å; L784-G789 WeakPolarHBondContact CB-O 3.49Å; L784-G789 PolarHBondContact N-O 3.16Å; L784-Q791 HydrophobicContact CD2-CB 4.04Å; L784-Q791 HydrophobicContact CD2-CG 4.49Å; L784-Q791 HydrophobicContact CG-CB 4.38Å; L784-C801 HydrophobicContact CD1-CB 3.93Å; L784-C801 VanDerWaalsContact CD1-SG 3.59Å
785	P	73	Confident	80.1	Confident	136 Å²	136	63.6 Å²	63.6	88%	0.883	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.1	-25.6	-179.4	-25.2	34.9	0	0	0	114.6	G787	P785-G787 VanDerWaalsContact C-N 3.33Å
786	C	78.9	Confident	79.7	Confident	50 Å²	50	63.8 Å²	63.8	34%	0.338	40%	0.402	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.3	-7.7	175.9	61	0	0	0	0	114.3	L784 H788 C801	L784-C786 PolarHBondContact O-N 2.97Å; C786-H788 PolarHBondContact O-N 2.82Å; C786-H788 VanDerWaalsContact O-N 3.15Å; C786-C801 VanDerWaalsContact SG-SG 3.63Å
787	G	73.9	Confident	78.9	Confident	56 Å²	56	66.3 Å²	66.3	58%	0.577	42%	0.421	S	S	*	.	S	Bend	trans	71.8	-3.2	-178.7	0	0	0	0	0	116.3	L784 P785 G789	L784-G787 PolarHBondContact O-N 3.34Å; P785-G787 VanDerWaalsContact C-N 3.33Å; G787-G789 PolarHBondContact O-N 2.89Å
788	H	79.3	Confident	78.2	Confident	78 Å²	78	66.4 Å²	66.4	36%	0.361	41%	0.414	S	S	.	.	S	Bend	trans	-70.3	-7.3	-178.1	-61.4	153.1	0	0	0	114.9	C786 L803 C804	C786-H788 PolarHBondContact O-N 2.82Å; C786-H788 VanDerWaalsContact O-N 3.15Å; H788-L803 HydrophobicContact CB-CB 4.04Å; H788-L803 HydrophobicContact CB-CD1 4.37Å; H788-C804 PolarHBondContact ND1-SG 3.26Å
789	G	82.8	Confident	77.3	Confident	6 Å²	6	66.9 Å²	66.9	6%	0.062	43%	0.425	C	S	.	.			trans	164.5	-170.1	170.4	0	0	0	0	0	113.8	Q769 L784 G787	Q769-G789 CarbonylContact O-C 3.58Å; Q769-G789 WeakPolarHBondContact O-CA 3.32Å; L784-G789 WeakPolarHBondContact CB-O 3.49Å; L784-G789 PolarHBondContact N-O 3.16Å; G787-G789 PolarHBondContact O-N 2.89Å
790	L	85.1	Confident	76.4	Confident	36 Å²	36	67.6 Å²	67.6	19%	0.188	43%	0.429	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	167.6	177	-55.8	-173.8	0	0	0	112.8	Q769 R770 C773 V774 A782	Q769-L790 PolarHBondContact O-N 3.05Å; R770-L790 WeakPolarHBondContact O-CD1 3.27Å; C773-L790 CarbonylContact C-O 3.57Å; C773-L790 WeakPolarHBondContact CA-O 3.36Å; V774-L790 PolarHBondContact N-O 3.1Å; A782-L790 CarbonylContact O-C 3.44Å; A782-L790 WeakPolarHBondContact O-CA 3.42Å; A782-L790 WeakPolarHBondContact O-CB 3.28Å
791	Q	83.7	Confident	75.9	Confident	13 Å²	13	67.8 Å²	67.8	6%	0.061	43%	0.428	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	149.1	171.9	-160.1	167.7	45.1	0	0	109.6	S781 A782 L784 C795 S798	S781-Q791 PolarHBondContact N-O 2.78Å; A782-Q791 PolarHBondContact N-O 2.7Å; A782-Q791 PolarHBondContact O-N 2.91Å; L784-Q791 HydrophobicContact CD2-CB 4.04Å; L784-Q791 HydrophobicContact CD2-CG 4.49Å; L784-Q791 HydrophobicContact CG-CB 4.38Å; Q791-C795 VanDerWaalsContact CD-O 3.29Å; Q791-C795 HydrophobicContact CG-CB 3.63Å; Q791-C795 PolarHBondContact NE2-O 3.15Å; Q791-S798 PolarHBondContact NE2-O 2.97Å
792	C	84.2	Confident	75.7	Confident	10 Å²	10	68 Å²	68	7%	0.068	43%	0.428	C	S	.	.			trans	-91.2	162.9	172.7	67.4	0	0	0	0	111	C773 C776 Q779 S794 C795 S796	C773-C792 HydrophobicContact CB-CB 3.96Å; C773-C792 PolarHBondContact SG-N 3.48Å; C773-C792 VanDerWaalsContact SG-N 3.38Å; C776-C792 VanDerWaalsContact SG-SG 3.65Å; Q779-C792 WeakPolarHBondContact O-CB 3.44Å; C792-S794 VanDerWaalsContact C-N 3.29Å; C792-S794 PolarHBondContact O-N 2.79Å; C792-C795 PolarHBondContact O-N 2.84Å; C792-C795 VanDerWaalsContact SG-SG 3.64Å; C792-S796 PolarHBondContact O-N 3.39Å; C792-S796 VanDerWaalsContact O-N 3.1Å
793	E	80.2	Confident	75.2	Confident	158 Å²	158	69.7 Å²	69.7	74%	0.738	43%	0.429	S	S	*	.	G	3₁₀ helix	trans	-56.1	-42.1	-177.4	-60	-175.1	162.4	0	0	112.2	C795 S796	E793-C795 VanDerWaalsContact C-N 3.26Å; E793-C795 PolarHBondContact O-N 2.78Å; E793-S796 WeakPolarHBondContact O-CB 3.36Å; E793-S796 PolarHBondContact O-N 3.06Å; E793-S796 VanDerWaalsContact O-N 3.16Å; E793-S796 PolarHBondContact O-OG 3.34Å
794	S	78.3	Confident	75	Confident	100 Å²	100	68 Å²	68	70%	0.699	42%	0.417	S	S	*	.	G	3₁₀ helix	trans	-58.2	-33.3	176.4	-46.7	0	0	0	0	114	C792	C792-S794 VanDerWaalsContact C-N 3.29Å; C792-S794 PolarHBondContact O-N 2.79Å
795	C	78.5	Confident	74.4	Confident	21 Å²	21	73.3 Å²	73.3	14%	0.142	45%	0.452	C	S	.	.	G	3₁₀ helix	trans	-94.9	-7.2	-179.7	-66.7	0	0	0	0	113.4	Q791 C792 E793 S797 S798	Q791-C795 VanDerWaalsContact CD-O 3.29Å; Q791-C795 HydrophobicContact CG-CB 3.63Å; Q791-C795 PolarHBondContact NE2-O 3.15Å; C792-C795 PolarHBondContact O-N 2.84Å; C792-C795 VanDerWaalsContact SG-SG 3.64Å; E793-C795 VanDerWaalsContact C-N 3.26Å; E793-C795 PolarHBondContact O-N 2.78Å; C795-S797 PolarHBondContact O-N 2.93Å; C795-S798 PolarHBondContact O-N 3.42Å; C795-S798 PolarHBondContact O-OG 3.44Å
796	S	69.9	Low	73.5	Confident	73 Å²	73	75.8 Å²	75.8	51%	0.51	45%	0.451	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-9.7	-175.5	66.9	0	0	0	0	115.3	C792 E793	C792-S796 PolarHBondContact O-N 3.39Å; C792-S796 VanDerWaalsContact O-N 3.1Å; E793-S796 WeakPolarHBondContact O-CB 3.36Å; E793-S796 PolarHBondContact O-N 3.06Å; E793-S796 VanDerWaalsContact O-N 3.16Å; E793-S796 PolarHBondContact O-OG 3.34Å
797	S	65.9	Low	72.1	Confident	111 Å²	111	82.6 Å²	82.6	78%	0.776	48%	0.478	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.3	-18	173.9	54.2	0	0	0	0	114.3	C795	C795-S797 PolarHBondContact O-N 2.93Å
798	S	63.8	Low	70.4	Confident	48 Å²	48	86.1 Å²	86.1	34%	0.336	49%	0.489	S	S	.	.			trans	-104.7	105.1	172.8	53.4	0	0	0	0	111.1	Q791 C795 E800	Q791-S798 PolarHBondContact NE2-O 2.97Å; C795-S798 PolarHBondContact O-N 3.42Å; C795-S798 PolarHBondContact O-OG 3.44Å; S798-E800 PolarHBondContact O-N 3.19Å
799	T	62.7	Low	68.6	Low	128 Å²	128	87.3 Å²	87.3	79%	0.785	51%	0.512	S	S	*	.			trans	-77.4	-1.6	-178.4	49.8	0	0	0	0	114.5
800	E	66.2	Low	66.7	Low	165 Å²	165	95.2 Å²	95.2	77%	0.771	55%	0.547	S	S	*	.			trans	-85	127.6	-179.1	-69.1	172.8	164.3	0	0	111	S798	S798-E800 PolarHBondContact O-N 3.19Å
801	C	72.6	Confident	64.5	Low	17 Å²	17	102.9 Å²	102.9	12%	0.115	58%	0.582	C	S	.	*			trans	-93.4	120.5	178.1	-177.1	0	0	0	0	110.2	L784 C786 L803 C804	L784-C801 HydrophobicContact CD1-CB 3.93Å; L784-C801 VanDerWaalsContact CD1-SG 3.59Å; C786-C801 VanDerWaalsContact SG-SG 3.63Å; C801-L803 PolarHBondContact O-N 2.88Å; C801-C804 HydrophobicContact CB-CB 4.29Å; C801-C804 PolarHBondContact O-N 3.06Å
802	P	72.4	Confident	62.3	Low	83 Å²	83	111.7 Å²	111.7	54%	0.539	62%	0.624	S	S	.	*	T	Hydrogen-bonded Turn	trans	-69.3	1.3	179.4	30.4	-36.9	0	0	0	114.1	V774	V774-P802 HydrophobicContact CB-CG 4.44Å; V774-P802 HydrophobicContact CG2-CG 4.08Å
803	L	70.3	Confident	60.1	Low	83 Å²	83	119.3 Å²	119.3	44%	0.435	66%	0.663	S	S	.	*	T	Hydrogen-bonded Turn	trans	-110.4	-0.8	175.8	-56.6	178	0	0	0	112.7	Q769 V774 H788 C801	Q769-L803 HydrophobicContact CG-CD1 4.36Å; V774-L803 HydrophobicContact CG1-CD1 4.14Å; H788-L803 HydrophobicContact CB-CB 4.04Å; H788-L803 HydrophobicContact CB-CD1 4.37Å; C801-L803 PolarHBondContact O-N 2.88Å
804	C	77.4	Confident	57.9	Low	50 Å²	50	121.4 Å²	121.4	34%	0.338	70%	0.695	S	S	.	*	S	Bend	trans	-84.6	135.7	168.1	-74.2	0	0	0	0	109.9	H788 C801	H788-C804 PolarHBondContact ND1-SG 3.26Å; C801-C804 HydrophobicContact CB-CB 4.29Å; C801-C804 PolarHBondContact O-N 3.06Å
805	P	63.7	Low	56.9	Low	118 Å²	118	122.5 Å²	122.5	77%	0.766	70%	0.695	S	S	*	*	P	Polyproline II helix	trans	-63.7	138.9	159.7	29.5	-32.8	0	0	0	109
806	E	54.6	Low	55.8	Low	187 Å²	187	127.8 Å²	127.8	87%	0.874	72%	0.724	S	S	*	*	P	Polyproline II helix	trans	-65.4	149.1	-173.6	-63	-167.8	152.7	0	0	112.9	T808	E806-T808 PolarHBondContact O-N 2.89Å
807	Q	48.9	Very low	55	Low	193 Å²	193	130.9 Å²	130.9	90%	0.902	74%	0.736	S	S	*	*			trans	-80.5	103.9	175.5	-66.6	-173.1	10.7	0	0	110.2	A809	Q807-A809 PolarHBondContact O-N 3.21Å; Q807-A809 VanDerWaalsContact O-N 3.12Å
808	T	39	Very low	54.3	Low	131 Å²	131	132.1 Å²	132.1	80%	0.804	73%	0.733	S	S	*	*			trans	-60.4	113.3	174.3	-41.9	0	0	0	0	110.7	E806 E810	E806-T808 PolarHBondContact O-N 2.89Å; T808-E810 VanDerWaalsContact C-N 3.28Å; T808-E810 PolarHBondContact O-N 2.89Å
809	A	41.2	Very low	53.8	Low	102 Å²	102	137.3 Å²	137.3	84%	0.843	76%	0.758	S	S	*	*			trans	-81.3	57.9	-170.6	0	0	0	0	0	114.4	Q807	Q807-A809 PolarHBondContact O-N 3.21Å; Q807-A809 VanDerWaalsContact O-N 3.12Å
810	E	42.6	Very low	53.2	Low	172 Å²	172	137.9 Å²	137.9	80%	0.804	76%	0.756	S	S	*	*			trans	-136.8	93.4	171.8	-73.7	-160.2	118.2	0	0	112.7	T808	T808-E810 VanDerWaalsContact C-N 3.28Å; T808-E810 PolarHBondContact O-N 2.89Å
811	Q	38.2	Very low	52.2	Low	197 Å²	197	136 Å²	136	92%	0.921	76%	0.755	S	S	*	*			trans	176.5	91.3	137.1	-98.6	169.6	28.8	0	0	112.5
812	Q	36.9	Very low	50.7	Low	199 Å²	199	145.2 Å²	145.2	93%	0.93	80%	0.804	S	S	*	*			trans	-143.8	83	153.7	-89.7	-159.8	-20.7	0	0	109.7
813	L	39.6	Very low	48.9	Very low	170 Å²	170	150.3 Å²	150.3	89%	0.89	83%	0.826	S	S	*	*			trans	-162.3	54.5	167.1	-120.3	176.1	0	0	0	113.6
814	S	33.9	Very low	46.9	Very low	202 Å²	202	156.5 Å²	156.5	100%	1.413	86%	0.862	S	S	*	*			trans	-169.5	0	156.2	-78	0	0	0	0	109.8

Retrieved 814 of 814 residues in 1284.9 ms (Link to these results)

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