A0A087XB12_POEFO Loading...

NEDD4-binding protein 1

AlphaFold DB , UniProt , Accession A0A087XB12, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 979 aa.

						>A0A087XB12_POEFO|A0A087XB12
MSTTRPLLGMRRITELACPEQPGNRLPASAGRQQAEAPTVDEFTVLEDKEEELKCARPRVEQVFKVTFTIIGLLDHTGQPHGSKTSRQIWLQLRGNRDDVSKAKEYVRGLCDPELQKEEHYPTDMHCIFAGARGLFLDRLIRDTSAEVLVPEPGRLWLVGRAEPVVMAQSRVQQFVALFQEKKSLPSDRESAVKRAFKSFVEERDDKYTMELLLLPSALKEELLGLVHSPTSTNTLALVNQALLPSMAEVDQDRSQSSTPVTELSNRILDTSFEEKGVSAAASVCAGGKAGLGPEAVLLNGTRPSHKRRSSESETRDTKRQYSLERKEESPERTARERPRDREVRGAGSSCRSKTPSASCTLSSSSSCYSGKANTVAGPITQESGEAVPDDGEAVSPETNLRCLVNFFRTMGYQQEVVERVVKATGQTEDTFLILEKIVEETKRCEQDCKVGDRERRMNSVRPADTLCSSSSSSSSSSSSSASSMTSRFREKELGDSGRSKENIKPSQRGGSSNGLGHRRKCSGSETSTQQAITIKRSSSAQGGAGNYEVITIDDDDNIIPTSAKTADGRMSRIMTMPHPDPTQSGSRTDYLARGGGGVTQRDYLSRCGTQTLGGPVKVESVTALRSTAQWLSNASLASTPSSAQPINRTAASAYQTISHVNFQGGVARTPPANDPPAPPVTGLARFHQSLRTQFTLNLPNERGNPDLRHIIIDGSNVAMAHGLHRFFSCRGIALAVEMFWRRGHREITVFVPQWRQKRDRLATEQHFLNQLEDLRLLSFTPSREVCGQRISSHDDRFLLHLAEKTDGIIVTNDNLRDFVDTSDTWRRIIQERLLQFTFVEDHFMIPDDPLGKDGPHLDDFLRKDNRRVSPPLFHPPDFRASSQQQQQPVNVQTLRNPASLTAHPTAHWPHSGPPEWHPPRRSPSPSPAPPPQRSPGETSELKRKLYDIFPDQKQRIDRILSDNPYMRDLNALSGLLLG
					

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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	32.9	Very low	35.5	Very low	232 Å²	232	152.2 Å²	152.2	100%	1.143	81%	0.814	S	S	*	*				0	80.9	0	-63.2	178.6	176.7	0	0	105.7
2	S	32.4	Very low	35.2	Very low	108 Å²	108	157 Å²	157	76%	0.755	81%	0.812	S	S	*	*			cis	77	127.4	47.4	-41.5	0	0	0	0	111.1
3	T	36.3	Very low	35.5	Very low	122 Å²	122	155.8 Å²	155.8	75%	0.748	81%	0.805	S	S	*	*			cis	-167.7	143.1	1.5	3.6	0	0	0	0	113
4	T	41.3	Very low	35.1	Very low	134 Å²	134	154.8 Å²	154.8	82%	0.822	81%	0.81	S	S	*	*			trans	71.7	155.1	143.7	-37.2	0	0	0	0	122
5	R	38.3	Very low	35.2	Very low	205 Å²	205	155.4 Å²	155.4	77%	0.774	81%	0.807	S	S	*	*			trans	-91.2	164.3	172.7	-63.1	175.7	169.1	178.8	-5.2	112.7
6	P	50.6	Low	35.3	Very low	123 Å²	123	155.8 Å²	155.8	80%	0.799	81%	0.81	S	S	*	*				-134.7	179.1	93.8	15	8.1	0	0	0	113
7	L	34.2	Very low	34.9	Very low	130 Å²	130	151.8 Å²	151.8	68%	0.681	80%	0.804	S	S	*	*			cis	106.7	90.9	-0.6	-61	171.8	0	0	0	120.5
8	L	36.1	Very low	34.2	Very low	179 Å²	179	150.4 Å²	150.4	94%	0.937	81%	0.808	S	S	*	*			trans	59.1	135	141.1	-78.2	170.2	0	0	0	125.7
9	G	28.3	Very low	35	Very low	69 Å²	69	148.4 Å²	148.4	71%	0.711	80%	0.803	S	S	*	*			trans	114.7	164.2	148.4	0	0	0	0	0	117.6
10	M	27.5	Very low	34.8	Very low	156 Å²	156	150.6 Å²	150.6	77%	0.768	81%	0.808	S	S	*	*			cis	-175	117.8	-39.9	-127.2	-179.5	68.3	0	0	112
11	R	32.9	Very low	34.5	Very low	216 Å²	216	152 Å²	152	82%	0.815	81%	0.81	S	S	*	*			trans	65.3	170.1	166.4	-54	177.8	170.4	170.7	-4.5	115.6
12	R	32.3	Very low	35.4	Very low	210 Å²	210	146.9 Å²	146.9	79%	0.792	79%	0.794	S	S	*	*			cis	-161.8	146.2	10.1	-148.7	-178.4	-162	168.1	2.4	113.9
13	I	37.9	Very low	35.3	Very low	141 Å²	141	145.3 Å²	145.3	72%	0.723	79%	0.794	S	S	*	*			trans	8.3	136.8	147.8	-55.4	162.9	0	0	0	122.4
14	T	30.4	Very low	35	Very low	142 Å²	142	147.3 Å²	147.3	87%	0.871	80%	0.801	S	S	*	*			trans	-158.2	171.6	131.3	-21.1	0	0	0	0	112.7
15	E	36.8	Very low	34.5	Very low	164 Å²	164	152.8 Å²	152.8	77%	0.766	81%	0.806	S	S	*	*			trans	-127.9	177.4	-168	-54.5	176.1	110.1	0	0	116
16	L	36.5	Very low	34.2	Very low	162 Å²	162	150.8 Å²	150.8	85%	0.848	81%	0.81	S	S	*	*			trans	124.4	138.9	132.9	-85.6	165.1	0	0	0	123.1
17	A	28.5	Very low	34.3	Very low	87 Å²	87	150.5 Å²	150.5	72%	0.719	81%	0.808	S	S	*	*			trans	84.4	109.7	145	0	0	0	0	0	125.3
18	C	22.8	Very low	34	Very low	128 Å²	128	148.8 Å²	148.8	87%	0.865	81%	0.813	S	S	*	*				33.2	170.6	123.3	-69.7	0	0	0	0	124.4
19	P	49.4	Very low	33.9	Very low	112 Å²	112	145.7 Å²	145.7	73%	0.727	81%	0.806	S	S	*	*			cis	-140.7	167.2	8.7	41	-21.2	0	0	0	120.8
20	E	30.6	Very low	34.3	Very low	192 Å²	192	147.2 Å²	147.2	90%	0.897	81%	0.812	S	S	*	*			trans	69.8	170.7	141.8	-73.6	-170	110.4	0	0	127.4
21	Q	29.2	Very low	34.6	Very low	179 Å²	179	143.7 Å²	143.7	84%	0.836	82%	0.816	S	S	*	*			trans	-120.2	-166	-156.1	-57.6	-168.5	-10.6	0	0	113.4
22	P	50.2	Low	34.9	Very low	126 Å²	126	145.4 Å²	145.4	82%	0.818	82%	0.822	S	S	*	*			cis	-133	-167.3	-4.4	44	-24.9	0	0	0	114.5
23	G	31.4	Very low	35.4	Very low	74 Å²	74	143.3 Å²	143.3	76%	0.763	82%	0.822	S	S	*	*			cis	159.9	-173.7	-9.5	0	0	0	0	0	114.3
24	N	30.5	Very low	35.7	Very low	165 Å²	165	145.9 Å²	145.9	88%	0.882	83%	0.831	S	S	*	*			trans	64.7	83.4	165.9	-96.5	-6.9	0	0	0	122.8
25	R	29.3	Very low	36.4	Very low	248 Å²	248	143.9 Å²	143.9	94%	0.936	83%	0.828	S	S	*	*				177.5	159	110.3	-98.3	-176	174.8	-174.8	-0.7	112.8
26	L	32.4	Very low	37.5	Very low	164 Å²	164	143.2 Å²	143.2	86%	0.859	83%	0.825	S	S	*	*			trans	-99.5	175.5	-172.3	-66.7	167.6	0	0	0	112.4
27	P	54	Low	39.3	Very low	117 Å²	117	139.3 Å²	139.3	76%	0.76	82%	0.816	S	S	*	*			cis	-138.7	162.6	-47.8	38.7	-23.7	0	0	0	114
28	A	28	Very low	41.8	Very low	93 Å²	93	138.3 Å²	138.3	77%	0.769	80%	0.802	S	S	*	*			trans	-160.8	133.6	159.3	0	0	0	0	0	116.2
29	S	33.6	Very low	45	Very low	114 Å²	114	134.3 Å²	134.3	80%	0.797	77%	0.774	S	S	*	*			trans	53.7	118	148.6	61.8	0	0	0	0	123.7
30	A	37	Very low	47.1	Very low	102 Å²	102	132.2 Å²	132.2	84%	0.843	76%	0.759	S	S	*	*			trans	62	98.9	132.8	0	0	0	0	0	120.5
31	G	33.2	Very low	50.1	Low	82 Å²	82	125.3 Å²	125.3	85%	0.845	73%	0.728	S	S	*	*	P	Polyproline II helix	trans	-77.3	137.6	160.1	0	0	0	0	0	112.6
32	R	39.5	Very low	53.2	Low	251 Å²	251	121.2 Å²	121.2	95%	0.947	71%	0.709	S	S	*	*	P	Polyproline II helix	trans	-81.1	126.8	166.4	-82.2	178.6	165.3	174.2	-5.5	109.7
33	Q	42.4	Very low	55.2	Low	167 Å²	167	115.7 Å²	115.7	78%	0.78	67%	0.672	S	S	*	*	P	Polyproline II helix	trans	-70.5	142.6	161.3	-70.1	175	-39.3	0	0	109.3
34	Q	43.7	Very low	58	Low	195 Å²	195	114.4 Å²	114.4	91%	0.911	65%	0.65	S	S	*	*	P	Polyproline II helix	trans	-74.2	136.1	169.9	-73.8	176.5	-35.9	0	0	109.2
35	A	46.3	Very low	60.8	Low	100 Å²	100	106.9 Å²	106.9	83%	0.826	61%	0.61	S	S	*	*	P	Polyproline II helix	trans	-79.4	125.1	172.5	0	0	0	0	0	109.7
36	E	58.7	Low	63.6	Low	150 Å²	150	97.9 Å²	97.9	70%	0.701	58%	0.58	S	S	*	*	P	Polyproline II helix	trans	-63.2	143.2	171.5	-163	176.4	174	0	0	109.5	R97	E36-R97 IonicContact OE1-NH1 3.54Å; E36-R97 PolarHBondContact OE1-NH1 3.39Å
37	A	74.3	Confident	66.2	Low	80 Å²	80	92.7 Å²	92.7	66%	0.661	55%	0.551	S	S	*	*	P	Polyproline II helix	trans	-69.8	134.8	-178.4	0	0	0	0	0	110.4	T39	A37-T39 PolarHBondContact O-N 3.46Å
38	P	81.1	Confident	67.7	Low	65 Å²	65	93 Å²	93	42%	0.422	55%	0.547	S	S	.	.	P	Polyproline II helix	trans	-62.5	123.5	-179.7	25.6	-34.2	0	0	0	109.9	R94 G95	P38-R94 HydrophobicContact CB-CG 4.26Å; P38-G95 CarbonylContact C-O 3.5Å; P38-G95 WeakPolarHBondContact CA-O 3.47Å
39	T	90.6	Very high	70.6	Confident	44 Å²	44	90.6 Å²	90.6	27%	0.27	52%	0.519	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.3	140.5	177.7	-60.5	0	0	0	0	109.5	A37 R94 G95 R97	A37-T39 PolarHBondContact O-N 3.46Å; T39-R94 VanDerWaalsContact O-CA 3.28Å; T39-R94 WeakPolarHBondContact O-CA 3.34Å; T39-G95 PolarHBondContact N-O 2.94Å; T39-G95 PolarHBondContact O-N 2.95Å; T39-R97 HydrophobicContact CG2-CB 4.3Å; T39-R97 HydrophobicContact CG2-CG 4.48Å; T39-R97 WeakPolarHBondContact OG1-CB 3.31Å
40	V	92.8	Very high	73.2	Confident	69 Å²	69	87.6 Å²	87.6	42%	0.418	49%	0.492	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	132.6	171.9	-177.6	0	0	0	0	107.2	E42 Q92 L93 R94	V40-E42 HydrophobicContact CG1-CG 4.3Å; V40-Q92 HydrophobicContact CG1-CG 3.6Å; V40-L93 WeakPolarHBondContact CA-O 3.4Å; V40-R94 HydrophobicContact CG2-CB 4.28Å; V40-R94 HydrophobicContact CG2-CG 3.86Å
41	D	94.4	Very high	75.6	Confident	47 Å²	47	88.4 Å²	88.4	25%	0.251	48%	0.479	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	137	173.3	-166.1	-13.5	0	0	0	109.4	Q92 L93 V100 K104	D41-Q92 WeakPolarHBondContact O-CA 3.26Å; D41-L93 PolarHBondContact N-O 3.41Å; D41-L93 PolarHBondContact O-N 3.2Å; D41-V100 HydrophobicContact CB-CG1 3.44Å; D41-V100 VanDerWaalsContact CB-CG1 3.44Å; D41-K104 IonicContact OD1-NZ 3.95Å; D41-K104 PolarHBondContact OD1-NZ 3.07Å; D41-K104 WeakPolarHBondContact OD2-CD 3.22Å; D41-K104 WeakPolarHBondContact OD2-CE 3.49Å; D41-K104 IonicContact OD2-NZ 2.7Å; D41-K104 PolarHBondContact OD2-NZ 3.24Å
42	E	93.8	Very high	78.2	Confident	93 Å²	93	89 Å²	89	44%	0.435	46%	0.459	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	135.9	-174.2	-64.8	-175	158.4	0	0	110.1	V40 W90 L91 Q92	V40-E42 HydrophobicContact CG1-CG 4.3Å; E42-W90 HydrophobicContact CB-CE3 3.99Å; E42-W90 HydrophobicContact CB-CZ3 3.86Å; E42-L91 VanDerWaalsContact CA-O 3.28Å; E42-L91 WeakPolarHBondContact CA-O 3.27Å; E42-Q92 HydrophobicContact CG-CB 4.07Å; E42-Q92 HydrophobicContact CG-CG 3.93Å; E42-Q92 PolarHBondContact OE1-NE2 2.77Å
43	F	92.6	Very high	80.7	Confident	9 Å²	9	77 Å²	77	4%	0.039	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.6	160.3	-179.5	64.2	-73.3	0	0	0	111.4	V45 L91 L93 K104 V107 R108	F43-V45 HydrophobicContact CD2-CG1 4.17Å; F43-V45 HydrophobicContact CE2-CG1 3.94Å; F43-L91 HydrophobicContact CD1-CB 4.35Å; F43-L91 HydrophobicContact CD2-CD1 4.45Å; F43-L91 HydrophobicContact CE1-CB 4.02Å; F43-L91 HydrophobicContact CE1-CD1 4.48Å; F43-L91 HydrophobicContact CE2-CB 4.49Å; F43-L91 HydrophobicContact CE2-CD1 3.74Å; F43-L91 HydrophobicContact CZ-CB 4.12Å; F43-L91 HydrophobicContact CZ-CD1 3.76Å; F43-L91 PolarHBondContact N-O 3.32Å; F43-L91 PolarHBondContact O-N 3.01Å; F43-L93 HydrophobicContact CE1-CD1 3.72Å; F43-L93 HydrophobicContact CE1-CG 4.22Å; F43-L93 HydrophobicContact CZ-CD1 4.21Å; F43-K104 HydrophobicContact CD1-CD 3.84Å; F43-K104 HydrophobicContact CD1-CG 3.89Å; F43-K104 HydrophobicContact CD2-CG 4.5Å; F43-K104 HydrophobicContact CE1-CB 4.25Å; F43-K104 HydrophobicContact CE1-CD 4.16Å; F43-K104 HydrophobicContact CE1-CG 3.78Å; F43-K104 HydrophobicContact CE2-CG 4.36Å; F43-K104 HydrophobicContact CG-CD 4.28Å; F43-K104 HydrophobicContact CG-CG 4.27Å; F43-K104 HydrophobicContact CZ-CB 4.49Å; F43-K104 HydrophobicContact CZ-CG 4Å; F43-V107 HydrophobicContact CE2-CG1 3.96Å; F43-V107 HydrophobicContact CZ-CB 4.09Å; F43-V107 HydrophobicContact CZ-CG1 3.68Å; F43-R108 HydrophobicContact CD2-CG 4.41Å; F43-R108 HydrophobicContact CE2-CG 4.08Å
44	T	90.6	Very high	83	Confident	48 Å²	48	73.3 Å²	73.3	29%	0.294	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	154	177.3	55	0	0	0	0	113	Q88 I89 W90	T44-Q88 HydrophobicContact CG2-CB 4.39Å; T44-Q88 PolarHBondContact OG1-OE1 2.95Å; T44-I89 VanDerWaalsContact CA-O 3.3Å; T44-I89 WeakPolarHBondContact CA-O 3.33Å; T44-W90 HydrophobicContact CG2-CD2 3.61Å; T44-W90 VanDerWaalsContact CG2-CE2 3.46Å; T44-W90 HydrophobicContact CG2-CE3 4.08Å; T44-W90 HydrophobicContact CG2-CG 3.98Å; T44-W90 HydrophobicContact CG2-CH2 4.3Å; T44-W90 HydrophobicContact CG2-CZ2 3.84Å; T44-W90 HydrophobicContact CG2-CZ3 4.4Å
45	V	89.5	Confident	85.2	Confident	7 Å²	7	69.2 Å²	69.2	4%	0.042	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	173.4	167.4	-58.6	0	0	0	0	108.8	F43 L53 Q88 I89 L91 C111	F43-V45 HydrophobicContact CD2-CG1 4.17Å; F43-V45 HydrophobicContact CE2-CG1 3.94Å; V45-L53 HydrophobicContact CG2-CD1 3.75Å; V45-Q88 CarbonylContact O-C 3.58Å; V45-Q88 WeakPolarHBondContact O-CA 3.41Å; V45-Q88 WeakPolarHBondContact O-CB 3.05Å; V45-I89 HydrophobicContact CG2-CD1 3.83Å; V45-I89 HydrophobicContact CG2-CG1 3.51Å; V45-I89 PolarHBondContact N-O 2.65Å; V45-I89 VanDerWaalsContact N-O 3.13Å; V45-I89 PolarHBondContact O-N 3.39Å; V45-L91 HydrophobicContact CB-CD1 4.31Å; V45-L91 HydrophobicContact CG1-CD1 3.62Å; V45-L91 HydrophobicContact CG1-CG 4.49Å; V45-L91 HydrophobicContact CG2-CD1 3.68Å; V45-L91 HydrophobicContact CG2-CD2 4.38Å; V45-L91 HydrophobicContact CG2-CG 3.99Å; V45-C111 HydrophobicContact CG1-CB 4.32Å
46	L	87.9	Confident	87.3	Confident	58 Å²	58	65.1 Å²	65.1	30%	0.304	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	147.9	179.1	-61.2	172.2	0	0	0	113.2	D48 K49 R87 Q88	L46-D48 VanDerWaalsContact C-N 3.3Å; L46-D48 WeakPolarHBondContact CB-OD1 3.35Å; L46-D48 PolarHBondContact O-N 3.4Å; L46-K49 PolarHBondContact O-N 3.25Å; L46-R87 WeakPolarHBondContact CA-O 3.37Å; L46-Q88 HydrophobicContact CD2-CG 4.41Å
47	E	85.9	Confident	89	Confident	55 Å²	55	62.2 Å²	62.2	26%	0.257	34%	0.336	S	S	.	.	G	3₁₀ helix	trans	-60.4	-33.6	179.5	-176.7	-171.5	-131.2	0	0	112.8	K49 E50 L73 R87 I89	E47-K49 PolarHBondContact O-N 3.19Å; E47-E50 WeakPolarHBondContact O-CB 3.43Å; E47-E50 PolarHBondContact O-N 3.01Å; E47-E50 VanDerWaalsContact O-N 3.16Å; E47-L73 HydrophobicContact CB-CD1 3.91Å; E47-L73 HydrophobicContact CG-CD1 3.65Å; E47-L73 VanDerWaalsContact OE1-CD1 3.3Å; E47-L73 WeakPolarHBondContact OE1-CD1 3.3Å; E47-R87 HydrophobicContact CB-CB 3.81Å; E47-R87 HydrophobicContact CG-CB 4.48Å; E47-R87 PolarHBondContact N-O 2.94Å; E47-R87 IonicContact OE1-CZ 3.22Å; E47-R87 IonicContact OE1-NH1 2.73Å; E47-R87 PolarHBondContact OE1-NH1 2.92Å; E47-R87 WeakPolarHBondContact OE2-CD 3.44Å; E47-R87 IonicContact OE2-NE 3.67Å; E47-R87 IonicContact OE2-NH1 2.78Å; E47-R87 PolarHBondContact OE2-NH1 3.13Å; E47-I89 HydrophobicContact CB-CG2 4.48Å
48	D	86.4	Confident	89.9	Confident	125 Å²	125	62.4 Å²	62.4	67%	0.668	33%	0.331	S	S	*	.	G	3₁₀ helix	trans	-68.6	-15.9	-179.4	66.5	-28.4	0	0	0	113.8	L46	L46-D48 VanDerWaalsContact C-N 3.3Å; L46-D48 WeakPolarHBondContact CB-OD1 3.35Å; L46-D48 PolarHBondContact O-N 3.4Å
49	K	87.6	Confident	90.4	Very high	41 Å²	41	62.7 Å²	62.7	18%	0.178	32%	0.323	C	S	.	.	G	3₁₀ helix	trans	-87.3	-1.9	174.6	-66.4	-67.2	-172.9	149.8	0	114.4	L46 E47 E51 E52 L53 L110 C111	L46-K49 PolarHBondContact O-N 3.25Å; E47-K49 PolarHBondContact O-N 3.19Å; K49-E51 PolarHBondContact O-N 3.38Å; K49-E52 WeakPolarHBondContact CD-OE2 3.24Å; K49-E52 WeakPolarHBondContact CE-OE2 3.49Å; K49-E52 IonicContact NZ-OE1 3.8Å; K49-E52 IonicContact NZ-OE2 3.08Å; K49-E52 PolarHBondContact NZ-OE2 2.82Å; K49-E52 PolarHBondContact O-N 3.05Å; K49-L53 WeakPolarHBondContact O-CG 3.13Å; K49-L53 PolarHBondContact O-N 3.06Å; K49-L110 PolarHBondContact NZ-O 3.47Å; K49-C111 WeakPolarHBondContact CE-O 3.31Å; K49-C111 HydrophobicContact CG-CB 4.33Å; K49-C111 PolarHBondContact NZ-O 2.92Å
50	E	88.3	Confident	90.6	Very high	52 Å²	52	60.6 Å²	60.6	24%	0.243	31%	0.31	C	S	.	.	H	α-helix	trans	-58.5	-43.1	-176	-159.6	-173.7	133.9	0	0	113	E47 L53 K54 I70 I89	E47-E50 WeakPolarHBondContact O-CB 3.43Å; E47-E50 PolarHBondContact O-N 3.01Å; E47-E50 VanDerWaalsContact O-N 3.16Å; E50-L53 PolarHBondContact O-N 2.81Å; E50-K54 VanDerWaalsContact O-CG 3.32Å; E50-K54 WeakPolarHBondContact O-CG 3.44Å; E50-K54 PolarHBondContact O-N 2.79Å; E50-K54 WeakPolarHBondContact OE1-CE 3.34Å; E50-K54 IonicContact OE1-NZ 2.77Å; E50-K54 PolarHBondContact OE1-NZ 3.43Å; E50-I70 HydrophobicContact CG-CD1 4.26Å; E50-I70 HydrophobicContact CG-CG2 4.22Å; E50-I89 HydrophobicContact CB-CD1 3.8Å; E50-I89 HydrophobicContact CG-CD1 3.79Å
51	E	87.6	Confident	90.7	Very high	119 Å²	119	59.8 Å²	59.8	56%	0.556	30%	0.302	S	S	*	.	H	α-helix	trans	-70.7	-38.7	179.9	-60.8	-53.4	133.6	0	0	112.8	K49 L53 K54 C55	K49-E51 PolarHBondContact O-N 3.38Å; E51-L53 VanDerWaalsContact C-N 3.27Å; E51-L53 PolarHBondContact O-N 3.15Å; E51-K54 PolarHBondContact O-N 2.85Å; E51-K54 IonicContact OE1-NZ 2.72Å; E51-K54 PolarHBondContact OE1-NZ 3.01Å; E51-K54 WeakPolarHBondContact OE2-CD 3.48Å; E51-K54 IonicContact OE2-NZ 3.26Å; E51-C55 PolarHBondContact O-N 2.99Å
52	E	88.5	Confident	90.6	Very high	93 Å²	93	62.6 Å²	62.6	44%	0.435	31%	0.314	S	S	.	.	H	α-helix	trans	-61.8	-38.9	174.7	-172.4	167.4	-164.2	0	0	110.7	K49 C55 A56	K49-E52 WeakPolarHBondContact CD-OE2 3.24Å; K49-E52 WeakPolarHBondContact CE-OE2 3.49Å; K49-E52 IonicContact NZ-OE1 3.8Å; K49-E52 IonicContact NZ-OE2 3.08Å; K49-E52 PolarHBondContact NZ-OE2 2.82Å; K49-E52 PolarHBondContact O-N 3.05Å; E52-C55 PolarHBondContact O-N 3.5Å; E52-A56 WeakPolarHBondContact O-CB 3.49Å; E52-A56 PolarHBondContact O-N 3.03Å
53	L	90.8	Very high	90.6	Very high	1 Å²	1	58.5 Å²	58.5	1%	0.005	30%	0.295	C	S	.	.	H	α-helix	trans	-74.8	-33.1	176.2	-67.7	177.1	0	0	0	114.1	V45 K49 E50 E51 C55 A56 R57 F68 I70 L91 V107	V45-L53 HydrophobicContact CG2-CD1 3.75Å; K49-L53 WeakPolarHBondContact O-CG 3.13Å; K49-L53 PolarHBondContact O-N 3.06Å; E50-L53 PolarHBondContact O-N 2.81Å; E51-L53 VanDerWaalsContact C-N 3.27Å; E51-L53 PolarHBondContact O-N 3.15Å; L53-C55 VanDerWaalsContact C-N 3.29Å; L53-C55 PolarHBondContact O-N 3.3Å; L53-A56 PolarHBondContact O-N 3.47Å; L53-R57 WeakPolarHBondContact O-CB 3.18Å; L53-R57 PolarHBondContact O-N 2.84Å; L53-F68 HydrophobicContact CB-CE1 4.31Å; L53-F68 HydrophobicContact CB-CZ 4.31Å; L53-F68 HydrophobicContact CD1-CZ 4.46Å; L53-F68 HydrophobicContact CD2-CZ 4.27Å; L53-I70 HydrophobicContact CB-CD1 4.16Å; L53-L91 HydrophobicContact CD1-CD1 3.7Å; L53-L91 HydrophobicContact CD1-CD2 4.04Å; L53-L91 HydrophobicContact CD1-CG 4.49Å; L53-V107 HydrophobicContact CD2-CG1 3.82Å
54	K	91	Very high	90.7	Very high	88 Å²	88	58.1 Å²	58.1	38%	0.383	29%	0.293	S	S	.	.	H	α-helix	trans	-59.2	-42.4	168.6	-76.1	165.5	-175.9	162.2	0	110.9	E50 E51 I70	E50-K54 VanDerWaalsContact O-CG 3.32Å; E50-K54 WeakPolarHBondContact O-CG 3.44Å; E50-K54 PolarHBondContact O-N 2.79Å; E50-K54 WeakPolarHBondContact OE1-CE 3.34Å; E50-K54 IonicContact OE1-NZ 2.77Å; E50-K54 PolarHBondContact OE1-NZ 3.43Å; E51-K54 PolarHBondContact O-N 2.85Å; E51-K54 IonicContact OE1-NZ 2.72Å; E51-K54 PolarHBondContact OE1-NZ 3.01Å; E51-K54 WeakPolarHBondContact OE2-CD 3.48Å; E51-K54 IonicContact OE2-NZ 3.26Å; K54-I70 HydrophobicContact CG-CD1 3.91Å
55	C	91.1	Very high	90.9	Very high	109 Å²	109	62.5 Å²	62.5	74%	0.736	31%	0.308	S	S	*	.	H	α-helix	trans	-69.8	-39.7	174.7	-70.8	0	0	0	0	113	E51 E52 L53 P58	E51-C55 PolarHBondContact O-N 2.99Å; E52-C55 PolarHBondContact O-N 3.5Å; L53-C55 VanDerWaalsContact C-N 3.29Å; L53-C55 PolarHBondContact O-N 3.3Å; C55-P58 WeakPolarHBondContact O-CD 3.29Å
56	A	90.7	Very high	91.1	Very high	15 Å²	15	62.5 Å²	62.5	12%	0.124	31%	0.308	C	S	.	.	H	α-helix	trans	-72.7	-25	179.8	0	0	0	0	0	113.7	E52 L53 R59 V60 L110	E52-A56 WeakPolarHBondContact O-CB 3.49Å; E52-A56 PolarHBondContact O-N 3.03Å; L53-A56 PolarHBondContact O-N 3.47Å; A56-R59 WeakPolarHBondContact O-CB 3.26Å; A56-R59 PolarHBondContact O-N 3.4Å; A56-V60 PolarHBondContact O-N 2.97Å; A56-L110 HydrophobicContact CB-CD1 3.75Å
57	R	92.9	Very high	91.5	Very high	89 Å²	89	63 Å²	63	34%	0.336	31%	0.314	S	S	.	.	H	α-helix	trans	-46.4	-53.6	-172.4	166.5	173.9	-178.2	157.3	20.5	114.8	L53 R59 V60 E61 F68	L53-R57 WeakPolarHBondContact O-CB 3.18Å; L53-R57 PolarHBondContact O-N 2.84Å; R57-R59 PolarHBondContact O-N 2.94Å; R57-V60 PolarHBondContact O-N 3.31Å; R57-V60 VanDerWaalsContact O-N 3.11Å; R57-E61 HydrophobicContact CG-CG 4.29Å; R57-E61 WeakPolarHBondContact CG-OE2 3.47Å; R57-E61 IonicContact CZ-OE1 3.25Å; R57-E61 IonicContact CZ-OE2 2.7Å; R57-E61 VanDerWaalsContact NE-CD 3.33Å; R57-E61 IonicContact NE-OE1 3.39Å; R57-E61 PolarHBondContact NE-OE1 3.41Å; R57-E61 IonicContact NE-OE2 2.63Å; R57-E61 PolarHBondContact NE-OE2 2.97Å; R57-E61 IonicContact NH2-OE1 2.72Å; R57-E61 PolarHBondContact NH2-OE1 3.3Å; R57-E61 IonicContact NH2-OE2 3.12Å; R57-E61 WeakPolarHBondContact O-CG 3.48Å; R57-E61 PolarHBondContact O-N 3.36Å; R57-F68 HydrophobicContact CB-CD1 3.73Å; R57-F68 HydrophobicContact CB-CE1 4.16Å; R57-F68 HydrophobicContact CG-CD1 3.91Å; R57-F68 PolarHBondContact NE-O 2.9Å; R57-F68 PolarHBondContact NH1-O 2.72Å; R57-F68 PolarHBondContact NH2-O 3.45Å; R57-F68 VanDerWaalsContact NH2-O 3.07Å
58	P	93.2	Very high	91.9	Very high	84 Å²	84	60.4 Å²	60.4	55%	0.545	30%	0.302	S	S	.	.	H	α-helix	trans	-61.1	-31.2	-176.5	-23.2	35.1	0	0	0	112.6	C55 Q62	C55-P58 WeakPolarHBondContact O-CD 3.29Å; P58-Q62 WeakPolarHBondContact O-CB 3.42Å; P58-Q62 PolarHBondContact O-N 2.78Å
59	R	92.9	Very high	92.2	Very high	71 Å²	71	56.7 Å²	56.7	27%	0.268	28%	0.283	S	S	.	.	H	α-helix	trans	-74.6	-40.2	176.8	-168.5	174.4	-176.5	-170.9	-8.5	111.9	A56 R57 Q62 V63 I141 E147 V148	A56-R59 WeakPolarHBondContact O-CB 3.26Å; A56-R59 PolarHBondContact O-N 3.4Å; R57-R59 PolarHBondContact O-N 2.94Å; R59-Q62 PolarHBondContact O-N 3.43Å; R59-V63 HydrophobicContact CG-CG2 4Å; R59-V63 VanDerWaalsContact O-CB 3.29Å; R59-V63 WeakPolarHBondContact O-CB 3.33Å; R59-V63 VanDerWaalsContact O-CG2 3.25Å; R59-V63 WeakPolarHBondContact O-CG2 3.41Å; R59-V63 PolarHBondContact O-N 3.12Å; R59-I141 VanDerWaalsContact NH2-CD1 3.25Å; R59-E147 IonicContact CZ-OE1 2.77Å; R59-E147 IonicContact CZ-OE2 3.34Å; R59-E147 VanDerWaalsContact NH1-CD 3.34Å; R59-E147 IonicContact NH1-OE1 3.19Å; R59-E147 PolarHBondContact NH1-OE1 3.43Å; R59-E147 IonicContact NH1-OE2 3.23Å; R59-E147 PolarHBondContact NH1-OE2 2.86Å; R59-E147 IonicContact NH2-OE1 2.76Å; R59-E147 IonicContact NH2-OE2 2.99Å; R59-E147 PolarHBondContact NH2-OE2 3.48Å; R59-V148 PolarHBondContact NH2-O 2.94Å
60	V	94.3	Very high	92.4	Very high	0 Å²	0	56.6 Å²	56.6	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-59.2	-49.5	173.2	177.7	0	0	0	0	110.4	A56 R57 F64 V66 F68 L93 A103 Y106 V107	A56-V60 PolarHBondContact O-N 2.97Å; R57-V60 PolarHBondContact O-N 3.31Å; R57-V60 VanDerWaalsContact O-N 3.11Å; V60-F64 PolarHBondContact O-N 3.31Å; V60-F64 VanDerWaalsContact O-N 3.13Å; V60-V66 HydrophobicContact CG1-CG2 3.84Å; V60-F68 HydrophobicContact CB-CD1 4.46Å; V60-F68 HydrophobicContact CG1-CB 4.21Å; V60-F68 HydrophobicContact CG1-CG 4.28Å; V60-L93 HydrophobicContact CG1-CD2 4.14Å; V60-A103 HydrophobicContact CG1-CB 4.29Å; V60-Y106 HydrophobicContact CG2-CD1 4.07Å; V60-Y106 HydrophobicContact CG2-CE1 3.78Å; V60-V107 HydrophobicContact CG1-CG2 4.12Å; V60-V107 HydrophobicContact CG2-CG2 3.82Å
61	E	94.6	Very high	92.3	Very high	52 Å²	52	58.5 Å²	58.5	24%	0.243	30%	0.295	C	S	.	.	H	α-helix	trans	-65.9	-39.7	179.6	-62.4	-178	136.4	0	0	111.5	R57 K65 V66 F68	R57-E61 HydrophobicContact CG-CG 4.29Å; R57-E61 WeakPolarHBondContact CG-OE2 3.47Å; R57-E61 IonicContact CZ-OE1 3.25Å; R57-E61 IonicContact CZ-OE2 2.7Å; R57-E61 VanDerWaalsContact NE-CD 3.33Å; R57-E61 IonicContact NE-OE1 3.39Å; R57-E61 PolarHBondContact NE-OE1 3.41Å; R57-E61 IonicContact NE-OE2 2.63Å; R57-E61 PolarHBondContact NE-OE2 2.97Å; R57-E61 IonicContact NH2-OE1 2.72Å; R57-E61 PolarHBondContact NH2-OE1 3.3Å; R57-E61 IonicContact NH2-OE2 3.12Å; R57-E61 WeakPolarHBondContact O-CG 3.48Å; R57-E61 PolarHBondContact O-N 3.36Å; E61-K65 WeakPolarHBondContact O-CA 3.22Å; E61-K65 PolarHBondContact O-N 3Å; E61-V66 WeakPolarHBondContact CA-O 3.42Å; E61-V66 WeakPolarHBondContact CB-O 3.48Å; E61-V66 WeakPolarHBondContact CG-O 3.28Å; E61-F68 HydrophobicContact CG-CB 3.83Å; E61-F68 PolarHBondContact OE1-N 2.83Å
62	Q	93.1	Very high	91.5	Very high	106 Å²	106	53.9 Å²	53.9	50%	0.495	28%	0.28	S	S	.	.	H	α-helix	trans	-65.4	-51.5	175.2	173.2	174.4	-41.9	0	0	113.1	P58 R59 K65 D138	P58-Q62 WeakPolarHBondContact O-CB 3.42Å; P58-Q62 PolarHBondContact O-N 2.78Å; R59-Q62 PolarHBondContact O-N 3.43Å; Q62-K65 WeakPolarHBondContact O-CD 3.46Å; Q62-K65 WeakPolarHBondContact O-CE 3.41Å; Q62-K65 PolarHBondContact O-NZ 2.71Å; Q62-D138 PolarHBondContact NE2-OD2 2.95Å
63	V	93.9	Very high	90.7	Very high	7 Å²	7	52 Å²	52	4%	0.042	27%	0.272	C	S	.	.	H	α-helix	trans	-75.8	-46.1	-168	173	0	0	0	0	111	R59 D138 I141 R142	R59-V63 HydrophobicContact CG-CG2 4Å; R59-V63 VanDerWaalsContact O-CB 3.29Å; R59-V63 WeakPolarHBondContact O-CB 3.33Å; R59-V63 VanDerWaalsContact O-CG2 3.25Å; R59-V63 WeakPolarHBondContact O-CG2 3.41Å; R59-V63 PolarHBondContact O-N 3.12Å; V63-D138 WeakPolarHBondContact CG1-O 3.31Å; V63-D138 HydrophobicContact CG2-CB 4.43Å; V63-I141 HydrophobicContact CG1-CB 4.27Å; V63-I141 HydrophobicContact CG1-CG2 3.9Å; V63-R142 HydrophobicContact CG1-CB 3.71Å; V63-R142 HydrophobicContact CG1-CG 4.25Å; V63-R142 WeakPolarHBondContact O-CD 3.41Å; V63-R142 WeakPolarHBondContact O-CG 3.41Å
64	F	94.8	Very high	89.2	Confident	0 Å²	0	56.5 Å²	56.5	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-97.1	-2.7	-174.2	-58	-88.5	0	0	0	113.8	V60 V66 D99 K102 A103 Y106 I141 R142	V60-F64 PolarHBondContact O-N 3.31Å; V60-F64 VanDerWaalsContact O-N 3.13Å; F64-V66 HydrophobicContact CB-CG1 4.24Å; F64-V66 HydrophobicContact CB-CG2 4.13Å; F64-V66 PolarHBondContact O-N 2.71Å; F64-D99 WeakPolarHBondContact O-CB 3.18Å; F64-K102 HydrophobicContact CD1-CB 3.73Å; F64-K102 HydrophobicContact CE1-CB 3.78Å; F64-A103 HydrophobicContact CB-CB 3.76Å; F64-A103 HydrophobicContact CD1-CB 4.27Å; F64-A103 HydrophobicContact CD2-CB 4.21Å; F64-A103 HydrophobicContact CG-CB 3.83Å; F64-Y106 AromaticContact CE2-CD1 3.64Å; F64-Y106 HydrophobicContact CE2-CD1 3.64Å; F64-Y106 AromaticContact CE2-CD2 3.95Å; F64-Y106 HydrophobicContact CE2-CD2 3.95Å; F64-Y106 HydrophobicContact CE2-CE1 4.16Å; F64-Y106 HydrophobicContact CE2-CE2 4.42Å; F64-Y106 AromaticContact CE2-CG 3.53Å; F64-Y106 HydrophobicContact CE2-CG 3.53Å; F64-Y106 HydrophobicContact CZ-CD1 4.19Å; F64-Y106 AromaticContact CZ-CD2 3.83Å; F64-Y106 HydrophobicContact CZ-CD2 3.83Å; F64-Y106 AromaticContact CZ-CG 3.59Å; F64-Y106 HydrophobicContact CZ-CG 3.59Å; F64-I141 HydrophobicContact CE2-CG2 4.35Å; F64-I141 HydrophobicContact CZ-CG2 4.12Å; F64-R142 HydrophobicContact CD1-CG 3.87Å; F64-R142 HydrophobicContact CE1-CB 4.41Å; F64-R142 HydrophobicContact CE1-CG 4.17Å
65	K	93.4	Very high	87.3	Confident	140 Å²	140	57.6 Å²	57.6	61%	0.609	31%	0.306	S	S	*	.			trans	58.3	27.5	179.1	-50	-54.3	179.8	-163.9	0	114.5	E61 Q62	E61-K65 WeakPolarHBondContact O-CA 3.22Å; E61-K65 PolarHBondContact O-N 3Å; Q62-K65 WeakPolarHBondContact O-CD 3.46Å; Q62-K65 WeakPolarHBondContact O-CE 3.41Å; Q62-K65 PolarHBondContact O-NZ 2.71Å
66	V	95.1	Very high	85.2	Confident	8 Å²	8	61 Å²	61	5%	0.048	31%	0.311	C	S	.	.			trans	-95.2	160.1	174.6	-64.4	0	0	0	0	110.9	V60 E61 F64 L93 R94 D99 V100 A103	V60-V66 HydrophobicContact CG1-CG2 3.84Å; E61-V66 WeakPolarHBondContact CA-O 3.42Å; E61-V66 WeakPolarHBondContact CB-O 3.48Å; E61-V66 WeakPolarHBondContact CG-O 3.28Å; F64-V66 HydrophobicContact CB-CG1 4.24Å; F64-V66 HydrophobicContact CB-CG2 4.13Å; F64-V66 PolarHBondContact O-N 2.71Å; V66-L93 HydrophobicContact CB-CD2 4.28Å; V66-L93 HydrophobicContact CG2-CD2 3.78Å; V66-R94 CarbonylContact C-O 3.48Å; V66-R94 WeakPolarHBondContact CA-O 3.44Å; V66-D99 HydrophobicContact CG1-CB 4.26Å; V66-V100 HydrophobicContact CG1-CG2 3.87Å; V66-A103 HydrophobicContact CG1-CB 3.99Å; V66-A103 HydrophobicContact CG2-CB 3.9Å
67	T	94.9	Very high	83.1	Confident	69 Å²	69	65.9 Å²	65.9	42%	0.423	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	134.9	156.5	-46.5	0	0	0	0	108.1	L93 R94	T67-L93 WeakPolarHBondContact O-CA 3.32Å; T67-R94 PolarHBondContact N-O 2.93Å; T67-R94 PolarHBondContact O-N 3.24Å
68	F	95.3	Very high	81.1	Confident	0 Å²	0	65.2 Å²	65.2	0%	0	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	116.7	-179.9	177.7	-128.9	0	0	0	111.1	L53 R57 V60 E61 I70 L91 L93 V107	L53-F68 HydrophobicContact CB-CE1 4.31Å; L53-F68 HydrophobicContact CB-CZ 4.31Å; L53-F68 HydrophobicContact CD1-CZ 4.46Å; L53-F68 HydrophobicContact CD2-CZ 4.27Å; R57-F68 HydrophobicContact CB-CD1 3.73Å; R57-F68 HydrophobicContact CB-CE1 4.16Å; R57-F68 HydrophobicContact CG-CD1 3.91Å; R57-F68 PolarHBondContact NE-O 2.9Å; R57-F68 PolarHBondContact NH1-O 2.72Å; R57-F68 PolarHBondContact NH2-O 3.45Å; R57-F68 VanDerWaalsContact NH2-O 3.07Å; V60-F68 HydrophobicContact CB-CD1 4.46Å; V60-F68 HydrophobicContact CG1-CB 4.21Å; V60-F68 HydrophobicContact CG1-CG 4.28Å; E61-F68 HydrophobicContact CG-CB 3.83Å; E61-F68 PolarHBondContact OE1-N 2.83Å; F68-I70 HydrophobicContact CZ-CG1 4.49Å; F68-L91 HydrophobicContact CE2-CB 4.09Å; F68-L91 HydrophobicContact CE2-CD1 4.03Å; F68-L91 HydrophobicContact CE2-CD2 4.11Å; F68-L91 HydrophobicContact CE2-CG 4.31Å; F68-L91 HydrophobicContact CZ-CD1 4.12Å; F68-L91 HydrophobicContact CZ-CD2 4.04Å; F68-L93 HydrophobicContact CB-CD2 3.91Å; F68-L93 HydrophobicContact CD2-CD2 3.48Å; F68-L93 VanDerWaalsContact CD2-CD2 3.48Å; F68-L93 HydrophobicContact CD2-CG 4.05Å; F68-L93 HydrophobicContact CE2-CD2 4.36Å; F68-L93 HydrophobicContact CG-CD2 4.04Å; F68-V107 HydrophobicContact CE2-CG1 4.44Å; F68-V107 HydrophobicContact CE2-CG2 4.41Å; F68-V107 HydrophobicContact CZ-CG1 4.33Å; F68-V107 HydrophobicContact CZ-CG2 4.41Å
69	T	93.2	Very high	78.6	Confident	46 Å²	46	69.2 Å²	69.2	28%	0.282	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	125.8	-175.5	-57.6	0	0	0	0	110.1	I71 Q92	T69-I71 HydrophobicContact CG2-CG1 4.3Å; T69-Q92 PolarHBondContact N-O 3.48Å; T69-Q92 PolarHBondContact O-N 3.48Å
70	I	91.2	Very high	76.5	Confident	39 Å²	39	71.7 Å²	71.7	20%	0.2	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	117.9	165	-54.1	177	0	0	0	106.4	E50 L53 K54 F68 I89 L91	E50-I70 HydrophobicContact CG-CD1 4.26Å; E50-I70 HydrophobicContact CG-CG2 4.22Å; L53-I70 HydrophobicContact CB-CD1 4.16Å; K54-I70 HydrophobicContact CG-CD1 3.91Å; F68-I70 HydrophobicContact CZ-CG1 4.49Å; I70-I89 HydrophobicContact CG2-CD1 4.18Å; I70-L91 HydrophobicContact CB-CD2 4.26Å; I70-L91 HydrophobicContact CG1-CD2 3.84Å; I70-L91 HydrophobicContact CG2-CD2 4.17Å
71	I	85.4	Confident	74.1	Confident	92 Å²	92	79.2 Å²	79.2	47%	0.472	43%	0.432	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	-35.1	-177.3	-67.3	177.3	0	0	0	111	T69 W90 Q92	T69-I71 HydrophobicContact CG2-CG1 4.3Å; I71-W90 HydrophobicContact CB-CB 3.99Å; I71-W90 HydrophobicContact CG2-CB 4.39Å; I71-W90 PolarHBondContact N-O 3.49Å; I71-Q92 HydrophobicContact CD1-CB 3.8Å; I71-Q92 HydrophobicContact CG1-CB 4.3Å
72	G	71.8	Confident	71.8	Confident	23 Å²	23	80 Å²	80	24%	0.237	45%	0.454	C	S	.	.	E	Extended strand (participates in β ladder)	trans	118.4	-168.9	178.2	0	0	0	0	0	113.9	I89 W90	G72-I89 CarbonylContact O-C 3.58Å; G72-I89 VanDerWaalsContact O-CA 3.31Å; G72-I89 WeakPolarHBondContact O-CA 3.3Å; G72-W90 PolarHBondContact O-N 3.31Å
73	L	70.2	Confident	69.8	Low	52 Å²	52	79 Å²	79	27%	0.272	46%	0.458	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	132.6	-165.5	-152.6	78.8	0	0	0	114	E47 D75 R87 I89	E47-L73 HydrophobicContact CB-CD1 3.91Å; E47-L73 HydrophobicContact CG-CD1 3.65Å; E47-L73 VanDerWaalsContact OE1-CD1 3.3Å; E47-L73 WeakPolarHBondContact OE1-CD1 3.3Å; L73-D75 PolarHBondContact O-N 2.92Å; L73-R87 HydrophobicContact CD1-CB 4.22Å; L73-I89 HydrophobicContact CD1-CG2 3.76Å
74	L	60.1	Low	67.8	Low	96 Å²	96	86.6 Å²	86.6	50%	0.503	49%	0.491	S	S	.	.	S	Bend	trans	-85	83.1	165.5	-170.9	71	0	0	0	110.3	Q88	L74-Q88 PolarHBondContact N-O 3.32Å
75	D	50.5	Low	65.8	Low	112 Å²	112	92.3 Å²	92.3	60%	0.599	53%	0.526	S	S	*	.			trans	175.1	129.6	139.5	-95.6	-16.8	0	0	0	111	L73	L73-D75 PolarHBondContact O-N 2.92Å
76	H	47.1	Very low	64.3	Low	181 Å²	181	89.9 Å²	89.9	84%	0.838	53%	0.527	S	S	*	.			trans	-116.1	-5.7	171.4	-44.2	-26.3	0	0	0	111.6	G78	H76-G78 PolarHBondContact O-N 2.93Å; H76-G78 VanDerWaalsContact O-N 3.11Å
77	T	47.2	Very low	63.5	Low	117 Å²	117	95 Å²	95	72%	0.718	55%	0.545	S	S	*	.	S	Bend	trans	-80.6	84	-179.6	38.4	0	0	0	0	110.5	Q79	T77-Q79 PolarHBondContact O-N 3.1Å
78	G	50.2	Low	63.1	Low	75 Å²	75	95.4 Å²	95.4	77%	0.773	54%	0.542	S	S	*	.			trans	-65.4	118.5	-169.2	0	0	0	0	0	115.7	H76	H76-G78 PolarHBondContact O-N 2.93Å; H76-G78 VanDerWaalsContact O-N 3.11Å
79	Q	41.9	Very low	62.8	Low	167 Å²	167	95.4 Å²	95.4	78%	0.78	54%	0.542	S	S	*	.			trans	-130.5	129.9	146	-77.7	-160.6	-20.8	0	0	110.2	T77 H81	T77-Q79 PolarHBondContact O-N 3.1Å; Q79-H81 VanDerWaalsContact C-N 3.3Å; Q79-H81 PolarHBondContact O-N 3.21Å; Q79-H81 VanDerWaalsContact O-N 3.11Å
80	P	49.3	Very low	62.7	Low	123 Å²	123	97.4 Å²	97.4	80%	0.799	54%	0.544	S	S	*	.			trans	-89	54.1	-176.6	36.8	-37.1	0	0	0	112.5
81	H	43.2	Very low	62.9	Low	158 Å²	158	95.5 Å²	95.5	73%	0.731	54%	0.535	S	S	*	.			trans	-136.3	121.6	-177.2	-67.5	95.8	0	0	0	112.6	Q79	Q79-H81 VanDerWaalsContact C-N 3.3Å; Q79-H81 PolarHBondContact O-N 3.21Å; Q79-H81 VanDerWaalsContact O-N 3.11Å
82	G	45.6	Very low	63.3	Low	69 Å²	69	93.5 Å²	93.5	71%	0.711	52%	0.524	S	S	*	.	S	Bend	trans	97.8	80.3	161.8	0	0	0	0	0	117.4
83	S	50.6	Low	64.4	Low	84 Å²	84	92.4 Å²	92.4	59%	0.587	51%	0.512	S	S	*	.			trans	65.5	156.6	166.3	-157.7	0	0	0	0	118	T85	S83-T85 WeakPolarHBondContact OG-CG2 3.07Å; S83-T85 PolarHBondContact OG-N 2.76Å; S83-T85 PolarHBondContact OG-OG1 2.97Å
84	K	53	Low	65.6	Low	168 Å²	168	95.7 Å²	95.7	73%	0.73	52%	0.521	S	S	*	.	S	Bend	trans	-93.7	-10.5	168	-66	-172.8	177.1	-172.9	0	112.9	S86	K84-S86 PolarHBondContact O-N 3.03Å
85	T	52.2	Low	67.2	Low	120 Å²	120	91.7 Å²	91.7	74%	0.736	50%	0.503	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.5	15.8	-162.7	57.2	0	0	0	0	115.8	S83	S83-T85 WeakPolarHBondContact OG-CG2 3.07Å; S83-T85 PolarHBondContact OG-N 2.76Å; S83-T85 PolarHBondContact OG-OG1 2.97Å
86	S	61.8	Low	69.2	Low	88 Å²	88	91.1 Å²	91.1	62%	0.615	50%	0.5	S	S	*	.	T	Hydrogen-bonded Turn	trans	-143	11.5	-175.5	62.2	0	0	0	0	113.8	K84	K84-S86 PolarHBondContact O-N 3.03Å
87	R	79	Confident	71.3	Confident	116 Å²	116	88.8 Å²	88.8	44%	0.438	48%	0.484	S	S	.	.			trans	-79.8	142.1	179	-71.9	175.4	162.3	-149.4	-6.4	110.7	L46 E47 L73	L46-R87 WeakPolarHBondContact CA-O 3.37Å; E47-R87 HydrophobicContact CB-CB 3.81Å; E47-R87 HydrophobicContact CG-CB 4.48Å; E47-R87 PolarHBondContact N-O 2.94Å; E47-R87 IonicContact OE1-CZ 3.22Å; E47-R87 IonicContact OE1-NH1 2.73Å; E47-R87 PolarHBondContact OE1-NH1 2.92Å; E47-R87 WeakPolarHBondContact OE2-CD 3.44Å; E47-R87 IonicContact OE2-NE 3.67Å; E47-R87 IonicContact OE2-NH1 2.78Å; E47-R87 PolarHBondContact OE2-NH1 3.13Å; L73-R87 HydrophobicContact CD1-CB 4.22Å
88	Q	86.7	Confident	73.4	Confident	77 Å²	77	88 Å²	88	36%	0.36	48%	0.475	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	143.2	-178.2	-68.7	-172.5	-1.4	0	0	112.5	T44 V45 L46 L74	T44-Q88 HydrophobicContact CG2-CB 4.39Å; T44-Q88 PolarHBondContact OG1-OE1 2.95Å; V45-Q88 CarbonylContact O-C 3.58Å; V45-Q88 WeakPolarHBondContact O-CA 3.41Å; V45-Q88 WeakPolarHBondContact O-CB 3.05Å; L46-Q88 HydrophobicContact CD2-CG 4.41Å; L74-Q88 PolarHBondContact N-O 3.32Å
89	I	89.4	Confident	75.5	Confident	0 Å²	0	85 Å²	85	0%	0	44%	0.441	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	144.6	170.3	57.2	177.1	0	0	0	110	T44 V45 E47 E50 I70 G72 L73 L91	T44-I89 VanDerWaalsContact CA-O 3.3Å; T44-I89 WeakPolarHBondContact CA-O 3.33Å; V45-I89 HydrophobicContact CG2-CD1 3.83Å; V45-I89 HydrophobicContact CG2-CG1 3.51Å; V45-I89 PolarHBondContact N-O 2.65Å; V45-I89 VanDerWaalsContact N-O 3.13Å; V45-I89 PolarHBondContact O-N 3.39Å; E47-I89 HydrophobicContact CB-CG2 4.48Å; E50-I89 HydrophobicContact CB-CD1 3.8Å; E50-I89 HydrophobicContact CG-CD1 3.79Å; I70-I89 HydrophobicContact CG2-CD1 4.18Å; G72-I89 CarbonylContact O-C 3.58Å; G72-I89 VanDerWaalsContact O-CA 3.31Å; G72-I89 WeakPolarHBondContact O-CA 3.3Å; L73-I89 HydrophobicContact CD1-CG2 3.76Å; I89-L91 HydrophobicContact CD1-CD2 4.29Å
90	W	90.4	Very high	78	Confident	88 Å²	88	77.1 Å²	77.1	33%	0.333	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85	135.9	170.8	-81.9	92.1	0	0	0	111.5	E42 T44 I71 G72	E42-W90 HydrophobicContact CB-CE3 3.99Å; E42-W90 HydrophobicContact CB-CZ3 3.86Å; T44-W90 HydrophobicContact CG2-CD2 3.61Å; T44-W90 VanDerWaalsContact CG2-CE2 3.46Å; T44-W90 HydrophobicContact CG2-CE3 4.08Å; T44-W90 HydrophobicContact CG2-CG 3.98Å; T44-W90 HydrophobicContact CG2-CH2 4.3Å; T44-W90 HydrophobicContact CG2-CZ2 3.84Å; T44-W90 HydrophobicContact CG2-CZ3 4.4Å; I71-W90 HydrophobicContact CB-CB 3.99Å; I71-W90 HydrophobicContact CG2-CB 4.39Å; I71-W90 PolarHBondContact N-O 3.49Å; G72-W90 PolarHBondContact O-N 3.31Å
91	L	94.4	Very high	80.1	Confident	0 Å²	0	74.8 Å²	74.8	0%	0	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	141.9	173.4	-56.6	-177.6	0	0	0	109.4	E42 F43 V45 L53 F68 I70 I89 V107	E42-L91 VanDerWaalsContact CA-O 3.28Å; E42-L91 WeakPolarHBondContact CA-O 3.27Å; F43-L91 HydrophobicContact CD1-CB 4.35Å; F43-L91 HydrophobicContact CD2-CD1 4.45Å; F43-L91 HydrophobicContact CE1-CB 4.02Å; F43-L91 HydrophobicContact CE1-CD1 4.48Å; F43-L91 HydrophobicContact CE2-CB 4.49Å; F43-L91 HydrophobicContact CE2-CD1 3.74Å; F43-L91 HydrophobicContact CZ-CB 4.12Å; F43-L91 HydrophobicContact CZ-CD1 3.76Å; F43-L91 PolarHBondContact N-O 3.32Å; F43-L91 PolarHBondContact O-N 3.01Å; V45-L91 HydrophobicContact CB-CD1 4.31Å; V45-L91 HydrophobicContact CG1-CD1 3.62Å; V45-L91 HydrophobicContact CG1-CG 4.49Å; V45-L91 HydrophobicContact CG2-CD1 3.68Å; V45-L91 HydrophobicContact CG2-CD2 4.38Å; V45-L91 HydrophobicContact CG2-CG 3.99Å; L53-L91 HydrophobicContact CD1-CD1 3.7Å; L53-L91 HydrophobicContact CD1-CD2 4.04Å; L53-L91 HydrophobicContact CD1-CG 4.49Å; F68-L91 HydrophobicContact CE2-CB 4.09Å; F68-L91 HydrophobicContact CE2-CD1 4.03Å; F68-L91 HydrophobicContact CE2-CD2 4.11Å; F68-L91 HydrophobicContact CE2-CG 4.31Å; F68-L91 HydrophobicContact CZ-CD1 4.12Å; F68-L91 HydrophobicContact CZ-CD2 4.04Å; I70-L91 HydrophobicContact CB-CD2 4.26Å; I70-L91 HydrophobicContact CG1-CD2 3.84Å; I70-L91 HydrophobicContact CG2-CD2 4.17Å; I89-L91 HydrophobicContact CD1-CD2 4.29Å; L91-V107 HydrophobicContact CD1-CG1 3.75Å
92	Q	94.6	Very high	82.6	Confident	50 Å²	50	70 Å²	70	23%	0.234	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	130.5	174	-179	-171.2	93.8	0	0	109.8	V40 D41 E42 T69 I71	V40-Q92 HydrophobicContact CG1-CG 3.6Å; D41-Q92 WeakPolarHBondContact O-CA 3.26Å; E42-Q92 HydrophobicContact CG-CB 4.07Å; E42-Q92 HydrophobicContact CG-CG 3.93Å; E42-Q92 PolarHBondContact OE1-NE2 2.77Å; T69-Q92 PolarHBondContact N-O 3.48Å; T69-Q92 PolarHBondContact O-N 3.48Å; I71-Q92 HydrophobicContact CD1-CB 3.8Å; I71-Q92 HydrophobicContact CG1-CB 4.3Å
93	L	96.1	Very high	85	Confident	0 Å²	0	66.8 Å²	66.8	0%	0	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	136.2	171.9	-74.1	168.1	0	0	0	109.5	V40 D41 F43 V60 V66 T67 F68 V100 A103 K104	V40-L93 WeakPolarHBondContact CA-O 3.4Å; D41-L93 PolarHBondContact N-O 3.41Å; D41-L93 PolarHBondContact O-N 3.2Å; F43-L93 HydrophobicContact CE1-CD1 3.72Å; F43-L93 HydrophobicContact CE1-CG 4.22Å; F43-L93 HydrophobicContact CZ-CD1 4.21Å; V60-L93 HydrophobicContact CG1-CD2 4.14Å; V66-L93 HydrophobicContact CB-CD2 4.28Å; V66-L93 HydrophobicContact CG2-CD2 3.78Å; T67-L93 WeakPolarHBondContact O-CA 3.32Å; F68-L93 HydrophobicContact CB-CD2 3.91Å; F68-L93 HydrophobicContact CD2-CD2 3.48Å; F68-L93 VanDerWaalsContact CD2-CD2 3.48Å; F68-L93 HydrophobicContact CD2-CG 4.05Å; F68-L93 HydrophobicContact CE2-CD2 4.36Å; F68-L93 HydrophobicContact CG-CD2 4.04Å; L93-V100 HydrophobicContact CB-CG1 3.94Å; L93-V100 HydrophobicContact CB-CG2 4.49Å; L93-A103 HydrophobicContact CD1-CB 3.87Å; L93-A103 HydrophobicContact CD2-CB 4.04Å; L93-K104 HydrophobicContact CD1-CB 3.73Å; L93-K104 VanDerWaalsContact CD1-N 3.35Å
94	R	94.3	Very high	87.1	Confident	121 Å²	121	64.4 Å²	64.4	46%	0.457	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	129.9	-179.9	-177.2	174.6	-174	-135.5	4.4	112.4	P38 T39 V40 V66 T67	P38-R94 HydrophobicContact CB-CG 4.26Å; T39-R94 VanDerWaalsContact O-CA 3.28Å; T39-R94 WeakPolarHBondContact O-CA 3.34Å; V40-R94 HydrophobicContact CG2-CB 4.28Å; V40-R94 HydrophobicContact CG2-CG 3.86Å; V66-R94 CarbonylContact C-O 3.48Å; V66-R94 WeakPolarHBondContact CA-O 3.44Å; T67-R94 PolarHBondContact N-O 2.93Å; T67-R94 PolarHBondContact O-N 3.24Å
95	G	93.8	Very high	89.1	Confident	12 Å²	12	59.6 Å²	59.6	12%	0.124	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	170.6	-151.2	-176.1	0	0	0	0	0	112.5	P38 T39 V100	P38-G95 CarbonylContact C-O 3.5Å; P38-G95 WeakPolarHBondContact CA-O 3.47Å; T39-G95 PolarHBondContact N-O 2.94Å; T39-G95 PolarHBondContact O-N 2.95Å; G95-V100 VanDerWaalsContact N-CG2 3.3Å
96	N	92.4	Very high	91.2	Very high	100 Å²	100	54.1 Å²	54.1	54%	0.535	26%	0.26	S	S	.	.			trans	-70.4	146.4	167.2	-52	-46.9	0	0	0	109.1	D98 D99 V100	N96-D98 VanDerWaalsContact C-N 3.29Å; N96-D98 PolarHBondContact O-N 3.04Å; N96-D99 HydrophobicContact CB-CB 4.19Å; N96-D99 WeakPolarHBondContact CB-OD2 3.4Å; N96-D99 PolarHBondContact ND2-OD2 2.89Å; N96-D99 PolarHBondContact O-N 2.96Å; N96-V100 WeakPolarHBondContact O-CB 3.38Å; N96-V100 VanDerWaalsContact O-CG2 3.31Å; N96-V100 WeakPolarHBondContact O-CG2 3.49Å; N96-V100 PolarHBondContact O-N 2.81Å
97	R	91.7	Very high	92.8	Very high	132 Å²	132	49.9 Å²	49.9	50%	0.498	23%	0.23	S	C	.	.	H	α-helix	trans	-50.8	-47.3	-178	179.8	-179.1	55.9	-108.6	-14.4	113.2	E36 T39 V100 S101	E36-R97 IonicContact OE1-NH1 3.54Å; E36-R97 PolarHBondContact OE1-NH1 3.39Å; T39-R97 HydrophobicContact CG2-CB 4.3Å; T39-R97 HydrophobicContact CG2-CG 4.48Å; T39-R97 WeakPolarHBondContact OG1-CB 3.31Å; R97-V100 PolarHBondContact O-N 2.67Å; R97-S101 PolarHBondContact O-N 3.25Å
98	D	91.1	Very high	93.5	Very high	100 Å²	100	49.9 Å²	49.9	54%	0.535	23%	0.23	S	C	.	.	H	α-helix	trans	-75.4	-36.1	-172.4	-49.3	-9.9	0	0	0	110.8	N96 S101 K102	N96-D98 VanDerWaalsContact C-N 3.29Å; N96-D98 PolarHBondContact O-N 3.04Å; D98-S101 PolarHBondContact O-N 3.36Å; D98-K102 WeakPolarHBondContact O-CG 3.27Å; D98-K102 PolarHBondContact O-N 2.8Å; D98-K102 VanDerWaalsContact O-N 3.14Å
99	D	93.1	Very high	93.8	Very high	11 Å²	11	46.4 Å²	46.4	6%	0.059	22%	0.215	C	C	.	.	H	α-helix	trans	-65.7	-41.6	171.9	-73.7	-41.2	0	0	0	112	F64 V66 N96 K102 A103	F64-D99 WeakPolarHBondContact O-CB 3.18Å; V66-D99 HydrophobicContact CG1-CB 4.26Å; N96-D99 HydrophobicContact CB-CB 4.19Å; N96-D99 WeakPolarHBondContact CB-OD2 3.4Å; N96-D99 PolarHBondContact ND2-OD2 2.89Å; N96-D99 PolarHBondContact O-N 2.96Å; D99-K102 PolarHBondContact O-N 3.33Å; D99-A103 WeakPolarHBondContact O-CB 3.28Å; D99-A103 PolarHBondContact O-N 2.69Å
100	V	94.9	Very high	94	Very high	2 Å²	2	47.3 Å²	47.3	1%	0.012	22%	0.22	C	C	.	.	H	α-helix	trans	-63.8	-42.7	175.1	166.4	0	0	0	0	111.3	D41 V66 L93 G95 N96 R97 A103 K104	D41-V100 HydrophobicContact CB-CG1 3.44Å; D41-V100 VanDerWaalsContact CB-CG1 3.44Å; V66-V100 HydrophobicContact CG1-CG2 3.87Å; L93-V100 HydrophobicContact CB-CG1 3.94Å; L93-V100 HydrophobicContact CB-CG2 4.49Å; G95-V100 VanDerWaalsContact N-CG2 3.3Å; N96-V100 WeakPolarHBondContact O-CB 3.38Å; N96-V100 VanDerWaalsContact O-CG2 3.31Å; N96-V100 WeakPolarHBondContact O-CG2 3.49Å; N96-V100 PolarHBondContact O-N 2.81Å; R97-V100 PolarHBondContact O-N 2.67Å; V100-A103 PolarHBondContact O-N 2.77Å; V100-K104 WeakPolarHBondContact O-CB 3.22Å; V100-K104 PolarHBondContact O-N 2.73Å
101	S	94.3	Very high	94	Very high	74 Å²	74	43.3 Å²	43.3	52%	0.517	21%	0.205	S	C	.	.	H	α-helix	trans	-60.2	-47	176.7	-169.4	0	0	0	0	111.8	R97 D98 K104 E105	R97-S101 PolarHBondContact O-N 3.25Å; D98-S101 PolarHBondContact O-N 3.36Å; S101-K104 PolarHBondContact O-N 2.82Å; S101-E105 PolarHBondContact O-N 3.35Å
102	K	94.7	Very high	93.8	Very high	59 Å²	59	47.1 Å²	47.1	26%	0.257	23%	0.226	S	C	.	.	H	α-helix	trans	-64.8	-43.9	177.1	-73.6	173	152.6	-156.4	0	112.7	F64 D98 D99 K104 E105 Y106 R142 D143	F64-K102 HydrophobicContact CD1-CB 3.73Å; F64-K102 HydrophobicContact CE1-CB 3.78Å; D98-K102 WeakPolarHBondContact O-CG 3.27Å; D98-K102 PolarHBondContact O-N 2.8Å; D98-K102 VanDerWaalsContact O-N 3.14Å; D99-K102 PolarHBondContact O-N 3.33Å; K102-K104 VanDerWaalsContact C-N 3.3Å; K102-K104 PolarHBondContact O-N 3.2Å; K102-E105 PolarHBondContact O-N 2.88Å; K102-Y106 WeakPolarHBondContact O-CB 3.44Å; K102-Y106 PolarHBondContact O-N 3.04Å; K102-R142 WeakPolarHBondContact CD-O 3.41Å; K102-R142 WeakPolarHBondContact CE-O 2.97Å; K102-R142 PolarHBondContact NZ-O 3.13Å; K102-D143 IonicContact NZ-OD1 3.68Å; K102-D143 PolarHBondContact NZ-OD1 3.49Å
103	A	96.1	Very high	93.6	Very high	0 Å²	0	47 Å²	47	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-60.8	-38.9	175.6	0	0	0	0	0	112.2	V60 F64 V66 L93 D99 V100 Y106 V107	V60-A103 HydrophobicContact CG1-CB 4.29Å; F64-A103 HydrophobicContact CB-CB 3.76Å; F64-A103 HydrophobicContact CD1-CB 4.27Å; F64-A103 HydrophobicContact CD2-CB 4.21Å; F64-A103 HydrophobicContact CG-CB 3.83Å; V66-A103 HydrophobicContact CG1-CB 3.99Å; V66-A103 HydrophobicContact CG2-CB 3.9Å; L93-A103 HydrophobicContact CD1-CB 3.87Å; L93-A103 HydrophobicContact CD2-CB 4.04Å; D99-A103 WeakPolarHBondContact O-CB 3.28Å; D99-A103 PolarHBondContact O-N 2.69Å; V100-A103 PolarHBondContact O-N 2.77Å; A103-Y106 PolarHBondContact O-N 2.92Å; A103-V107 WeakPolarHBondContact O-CB 3.45Å; A103-V107 VanDerWaalsContact O-CG2 3.26Å; A103-V107 WeakPolarHBondContact O-CG2 3.49Å; A103-V107 PolarHBondContact O-N 3.34Å
104	K	95.1	Very high	93.5	Very high	34 Å²	34	52.2 Å²	52.2	15%	0.148	25%	0.253	C	S	.	.	H	α-helix	trans	-66.5	-41	177.1	-179.6	166.5	173	177.8	0	112.3	D41 F43 L93 V100 S101 K102 R108	D41-K104 IonicContact OD1-NZ 3.95Å; D41-K104 PolarHBondContact OD1-NZ 3.07Å; D41-K104 WeakPolarHBondContact OD2-CD 3.22Å; D41-K104 WeakPolarHBondContact OD2-CE 3.49Å; D41-K104 IonicContact OD2-NZ 2.7Å; D41-K104 PolarHBondContact OD2-NZ 3.24Å; F43-K104 HydrophobicContact CD1-CD 3.84Å; F43-K104 HydrophobicContact CD1-CG 3.89Å; F43-K104 HydrophobicContact CD2-CG 4.5Å; F43-K104 HydrophobicContact CE1-CB 4.25Å; F43-K104 HydrophobicContact CE1-CD 4.16Å; F43-K104 HydrophobicContact CE1-CG 3.78Å; F43-K104 HydrophobicContact CE2-CG 4.36Å; F43-K104 HydrophobicContact CG-CD 4.28Å; F43-K104 HydrophobicContact CG-CG 4.27Å; F43-K104 HydrophobicContact CZ-CB 4.49Å; F43-K104 HydrophobicContact CZ-CG 4Å; L93-K104 HydrophobicContact CD1-CB 3.73Å; L93-K104 VanDerWaalsContact CD1-N 3.35Å; V100-K104 WeakPolarHBondContact O-CB 3.22Å; V100-K104 PolarHBondContact O-N 2.73Å; S101-K104 PolarHBondContact O-N 2.82Å; K102-K104 VanDerWaalsContact C-N 3.3Å; K102-K104 PolarHBondContact O-N 3.2Å; K104-R108 WeakPolarHBondContact O-CB 3.23Å; K104-R108 WeakPolarHBondContact O-CD 3.44Å; K104-R108 VanDerWaalsContact O-CG 3.23Å; K104-R108 WeakPolarHBondContact O-CG 3.45Å; K104-R108 PolarHBondContact O-N 3.29Å
105	E	95.5	Very high	93.4	Very high	68 Å²	68	49.3 Å²	49.3	32%	0.318	25%	0.246	S	C	.	.	H	α-helix	trans	-63.5	-47.5	174.4	-178.7	173.8	-140.1	0	0	111.9	S101 K102 R108 G109 S145 P164	S101-E105 PolarHBondContact O-N 3.35Å; K102-E105 PolarHBondContact O-N 2.88Å; E105-R108 WeakPolarHBondContact O-CB 3.36Å; E105-R108 PolarHBondContact O-N 2.95Å; E105-G109 PolarHBondContact O-N 3Å; E105-S145 WeakPolarHBondContact OE2-CB 3.18Å; E105-S145 PolarHBondContact OE2-OG 3.45Å; E105-P164 HydrophobicContact CG-CG 3.81Å; E105-P164 VanDerWaalsContact OE1-CG 3.3Å; E105-P164 WeakPolarHBondContact OE1-CG 3.34Å
106	Y	96.6	Very high	93.5	Very high	4 Å²	4	53.7 Å²	53.7	2%	0.016	26%	0.264	C	S	.	.	H	α-helix	trans	-60.3	-47.5	175.5	172.5	-91.3	0	0	0	112.5	V60 F64 K102 A103 R108 G109 L110 I141 S145 E147	V60-Y106 HydrophobicContact CG2-CD1 4.07Å; V60-Y106 HydrophobicContact CG2-CE1 3.78Å; F64-Y106 AromaticContact CE2-CD1 3.64Å; F64-Y106 HydrophobicContact CE2-CD1 3.64Å; F64-Y106 AromaticContact CE2-CD2 3.95Å; F64-Y106 HydrophobicContact CE2-CD2 3.95Å; F64-Y106 HydrophobicContact CE2-CE1 4.16Å; F64-Y106 HydrophobicContact CE2-CE2 4.42Å; F64-Y106 AromaticContact CE2-CG 3.53Å; F64-Y106 HydrophobicContact CE2-CG 3.53Å; F64-Y106 HydrophobicContact CZ-CD1 4.19Å; F64-Y106 AromaticContact CZ-CD2 3.83Å; F64-Y106 HydrophobicContact CZ-CD2 3.83Å; F64-Y106 AromaticContact CZ-CG 3.59Å; F64-Y106 HydrophobicContact CZ-CG 3.59Å; K102-Y106 WeakPolarHBondContact O-CB 3.44Å; K102-Y106 PolarHBondContact O-N 3.04Å; A103-Y106 PolarHBondContact O-N 2.92Å; Y106-R108 VanDerWaalsContact C-N 3.32Å; Y106-R108 PolarHBondContact O-N 2.75Å; Y106-G109 CarbonylContact O-C 3.6Å; Y106-G109 WeakPolarHBondContact O-CA 3.47Å; Y106-G109 PolarHBondContact O-N 2.94Å; Y106-L110 HydrophobicContact CD1-CD1 4.16Å; Y106-L110 HydrophobicContact CE1-CD1 3.48Å; Y106-L110 VanDerWaalsContact CE1-CD1 3.48Å; Y106-L110 HydrophobicContact CE1-CG 4.12Å; Y106-L110 PolarHBondContact O-N 3.45Å; Y106-I141 HydrophobicContact CD2-CG2 3.91Å; Y106-I141 HydrophobicContact CE2-CG2 3.58Å; Y106-S145 VanDerWaalsContact CA-O 3.31Å; Y106-S145 WeakPolarHBondContact CA-O 3.5Å; Y106-E147 HydrophobicContact CE2-CB 4Å
107	V	95.5	Very high	93.6	Very high	0 Å²	0	52.9 Å²	52.9	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-62.3	-38.3	177.6	167.9	0	0	0	0	111.6	F43 L53 V60 F68 L91 A103 G109 L110 C111	F43-V107 HydrophobicContact CE2-CG1 3.96Å; F43-V107 HydrophobicContact CZ-CB 4.09Å; F43-V107 HydrophobicContact CZ-CG1 3.68Å; L53-V107 HydrophobicContact CD2-CG1 3.82Å; V60-V107 HydrophobicContact CG1-CG2 4.12Å; V60-V107 HydrophobicContact CG2-CG2 3.82Å; F68-V107 HydrophobicContact CE2-CG1 4.44Å; F68-V107 HydrophobicContact CE2-CG2 4.41Å; F68-V107 HydrophobicContact CZ-CG1 4.33Å; F68-V107 HydrophobicContact CZ-CG2 4.41Å; L91-V107 HydrophobicContact CD1-CG1 3.75Å; A103-V107 WeakPolarHBondContact O-CB 3.45Å; A103-V107 VanDerWaalsContact O-CG2 3.26Å; A103-V107 WeakPolarHBondContact O-CG2 3.49Å; A103-V107 PolarHBondContact O-N 3.34Å; V107-G109 VanDerWaalsContact C-N 3.34Å; V107-L110 PolarHBondContact O-N 2.64Å; V107-C111 PolarHBondContact O-N 3.29Å; V107-C111 VanDerWaalsContact O-N 3.09Å; V107-C111 PolarHBondContact O-SG 3.35Å
108	R	93.6	Very high	93.9	Very high	116 Å²	116	50.3 Å²	50.3	44%	0.438	25%	0.249	S	C	.	.	H	α-helix	trans	-63.9	-37.9	171	-75.4	168.8	167.8	-163.7	-8.9	112.3	F43 K104 E105 Y106 L110 C111 D112	F43-R108 HydrophobicContact CD2-CG 4.41Å; F43-R108 HydrophobicContact CE2-CG 4.08Å; K104-R108 WeakPolarHBondContact O-CB 3.23Å; K104-R108 WeakPolarHBondContact O-CD 3.44Å; K104-R108 VanDerWaalsContact O-CG 3.23Å; K104-R108 WeakPolarHBondContact O-CG 3.45Å; K104-R108 PolarHBondContact O-N 3.29Å; E105-R108 WeakPolarHBondContact O-CB 3.36Å; E105-R108 PolarHBondContact O-N 2.95Å; Y106-R108 VanDerWaalsContact C-N 3.32Å; Y106-R108 PolarHBondContact O-N 2.75Å; R108-L110 VanDerWaalsContact C-N 3.34Å; R108-C111 PolarHBondContact O-N 3.02Å; R108-D112 PolarHBondContact O-N 3.01Å
109	G	93.3	Very high	94.1	Very high	3 Å²	3	46.6 Å²	46.6	3%	0.031	23%	0.228	C	C	.	.	H	α-helix	trans	-64.7	-32	174.7	0	0	0	0	0	114.2	E105 Y106 V107 P113	E105-G109 PolarHBondContact O-N 3Å; Y106-G109 CarbonylContact O-C 3.6Å; Y106-G109 WeakPolarHBondContact O-CA 3.47Å; Y106-G109 PolarHBondContact O-N 2.94Å; V107-G109 VanDerWaalsContact C-N 3.34Å; G109-P113 WeakPolarHBondContact O-CA 3.41Å; G109-P113 WeakPolarHBondContact O-CB 3.34Å
110	L	92.2	Very high	94.2	Very high	20 Å²	20	50.9 Å²	50.9	11%	0.105	25%	0.248	C	C	.	.	H	α-helix	trans	-74.3	-40.1	172.6	-66.8	-179.5	0	0	0	112.6	K49 A56 Y106 V107 R108 E147	K49-L110 PolarHBondContact NZ-O 3.47Å; A56-L110 HydrophobicContact CB-CD1 3.75Å; Y106-L110 HydrophobicContact CD1-CD1 4.16Å; Y106-L110 HydrophobicContact CE1-CD1 3.48Å; Y106-L110 VanDerWaalsContact CE1-CD1 3.48Å; Y106-L110 HydrophobicContact CE1-CG 4.12Å; Y106-L110 PolarHBondContact O-N 3.45Å; V107-L110 PolarHBondContact O-N 2.64Å; R108-L110 VanDerWaalsContact C-N 3.34Å; L110-E147 HydrophobicContact CD2-CB 3.82Å; L110-E147 HydrophobicContact CD2-CG 4.02Å
111	C	90.9	Very high	94.3	Very high	4 Å²	4	51.3 Å²	51.3	3%	0.027	25%	0.25	C	C	.	.	H	α-helix	trans	-69.1	-56.6	179.3	-61.4	0	0	0	0	110.9	V45 K49 V107 R108 P113	V45-C111 HydrophobicContact CG1-CB 4.32Å; K49-C111 WeakPolarHBondContact CE-O 3.31Å; K49-C111 HydrophobicContact CG-CB 4.33Å; K49-C111 PolarHBondContact NZ-O 2.92Å; V107-C111 PolarHBondContact O-N 3.29Å; V107-C111 VanDerWaalsContact O-N 3.09Å; V107-C111 PolarHBondContact O-SG 3.35Å; R108-C111 PolarHBondContact O-N 3.02Å; C111-P113 VanDerWaalsContact C-CD 3.47Å; C111-P113 VanDerWaalsContact O-CD 3.32Å; C111-P113 WeakPolarHBondContact O-CD 3.16Å
112	D	89.2	Confident	94.4	Very high	80 Å²	80	49.6 Å²	49.6	43%	0.428	24%	0.236	S	C	.	.	S	Bend	trans	-124.8	73	-172.3	-59.3	-62.4	0	0	0	110.4	R108 E114 R161	R108-D112 PolarHBondContact O-N 3.01Å; D112-E114 PolarHBondContact O-N 3.21Å; D112-R161 PolarHBondContact O-NH1 2.83Å
113	P	91.6	Very high	94.4	Very high	47 Å²	47	50.8 Å²	50.8	31%	0.305	25%	0.249	S	C	.	.			trans	-68.2	117.9	177.5	26.3	-33.1	0	0	0	111.1	G109 C111 V159 G160	G109-P113 WeakPolarHBondContact O-CA 3.41Å; G109-P113 WeakPolarHBondContact O-CB 3.34Å; C111-P113 VanDerWaalsContact C-CD 3.47Å; C111-P113 VanDerWaalsContact O-CD 3.32Å; C111-P113 WeakPolarHBondContact O-CD 3.16Å; P113-V159 HydrophobicContact CB-CG1 3.73Å; P113-V159 HydrophobicContact CG-CG1 4.41Å; P113-G160 CarbonylContact C-O 3.52Å; P113-G160 WeakPolarHBondContact CA-O 3.38Å
114	E	93.4	Very high	94.3	Very high	109 Å²	109	56 Å²	56	51%	0.509	28%	0.277	S	S	.	.	S	Bend	trans	-83.3	-28.4	176	-62.9	176.8	134.1	0	0	112.2	D112 G160 R161 A162	D112-E114 PolarHBondContact O-N 3.21Å; E114-G160 PolarHBondContact N-O 3.03Å; E114-R161 VanDerWaalsContact CD-NH1 3.3Å; E114-R161 IonicContact OE1-CZ 2.92Å; E114-R161 IonicContact OE1-NE 3.99Å; E114-R161 IonicContact OE1-NH1 2.65Å; E114-R161 PolarHBondContact OE1-NH1 2.89Å; E114-R161 IonicContact OE1-NH2 3.86Å; E114-R161 PolarHBondContact OE1-NH2 2.84Å; E114-R161 WeakPolarHBondContact OE2-CA 3.39Å; E114-R161 IonicContact OE2-CZ 3.69Å; E114-R161 IonicContact OE2-NE 2.96Å; E114-R161 PolarHBondContact OE2-NE 3.4Å; E114-R161 IonicContact OE2-NH1 3.53Å; E114-R161 IonicContact OE2-NH2 2.8Å; E114-R161 PolarHBondContact OE2-NH2 3.36Å; E114-A162 HydrophobicContact CB-CB 4.41Å; E114-A162 PolarHBondContact OE2-N 2.71Å
115	L	92.4	Very high	94.3	Very high	60 Å²	60	54.4 Å²	54.4	31%	0.314	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	137.4	-177.7	-170.9	57.3	0	0	0	110.2	G160 V165 V166	L115-G160 PolarHBondContact N-O 3.11Å; L115-G160 PolarHBondContact O-N 2.67Å; L115-G160 VanDerWaalsContact O-N 3.14Å; L115-V165 HydrophobicContact CB-CB 4.23Å; L115-V165 HydrophobicContact CB-CG1 4.27Å; L115-V165 HydrophobicContact CB-CG2 4.4Å; L115-V165 HydrophobicContact CD2-CB 4.02Å; L115-V165 HydrophobicContact CD2-CG1 3.72Å; L115-V165 HydrophobicContact CG-CB 4.25Å; L115-V165 HydrophobicContact CG-CG1 3.81Å; L115-V166 HydrophobicContact CD2-CG2 4.09Å
116	Q	95.9	Very high	94.4	Very high	105 Å²	105	52.2 Å²	52.2	49%	0.491	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	130.6	167.6	-56.6	-165	23.2	0	0	108	W157 L158 V159	Q116-W157 HydrophobicContact CB-CZ2 4.13Å; Q116-L158 CarbonylContact C-O 3.21Å; Q116-L158 VanDerWaalsContact CA-O 3.32Å; Q116-L158 WeakPolarHBondContact CA-O 3.23Å; Q116-V159 HydrophobicContact CB-CG2 4.41Å; Q116-V159 HydrophobicContact CG-CG1 4.2Å; Q116-V159 HydrophobicContact CG-CG2 4.07Å
117	K	95.4	Very high	94.3	Very high	82 Å²	82	52 Å²	52	36%	0.357	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	123.5	-170.3	-179.1	56.8	177.7	167.8	0	111.3	L158 V165 Q169	K117-L158 HydrophobicContact CB-CB 4.41Å; K117-L158 PolarHBondContact N-O 3.27Å; K117-L158 WeakPolarHBondContact O-CB 3.35Å; K117-L158 PolarHBondContact O-N 2.93Å; K117-V165 HydrophobicContact CB-CG1 3.8Å; K117-Q169 HydrophobicContact CG-CG 4.46Å
118	E	96.6	Very high	94.3	Very high	78 Å²	78	52.1 Å²	52.1	36%	0.364	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	129	164.8	-159.6	174.7	177.8	0	0	109.8	H120 R155 L156 W157	E118-H120 IonicContact OE1-CE1 3.88Å; E118-H120 PolarHBondContact OE1-CE1 3.22Å; E118-H120 VanDerWaalsContact OE1-CE1 3.26Å; E118-H120 IonicContact OE1-NE2 3.56Å; E118-R155 WeakPolarHBondContact OE1-CD 3.21Å; E118-L156 WeakPolarHBondContact CA-O 3.38Å; E118-W157 HydrophobicContact CB-CE3 3.8Å; E118-W157 HydrophobicContact CB-CZ3 3.65Å; E118-W157 HydrophobicContact CG-CE3 4Å; E118-W157 HydrophobicContact CG-CZ3 4.07Å
119	E	96.2	Very high	94.5	Very high	22 Å²	22	46.8 Å²	46.8	10%	0.103	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	135.4	174.8	-167.1	58.7	-153.5	0	0	110.1	L156 L158 Q169 V172 Q173	E119-L156 PolarHBondContact N-O 2.85Å; E119-L156 PolarHBondContact O-N 2.97Å; E119-L158 HydrophobicContact CB-CD1 3.97Å; E119-L158 HydrophobicContact CB-CG 4.47Å; E119-Q169 HydrophobicContact CB-CG 4.42Å; E119-Q169 HydrophobicContact CG-CG 3.97Å; E119-Q169 WeakPolarHBondContact OE2-CG 3.38Å; E119-Q169 PolarHBondContact OE2-NE2 3.47Å; E119-V172 HydrophobicContact CG-CB 4.29Å; E119-V172 HydrophobicContact CG-CG1 3.83Å; E119-Q173 VanDerWaalsContact CD-NE2 3.35Å; E119-Q173 WeakPolarHBondContact OE1-CG 3.42Å; E119-Q173 PolarHBondContact OE1-NE2 2.82Å; E119-Q173 PolarHBondContact OE2-NE2 2.81Å
120	H	95.5	Very high	94.5	Very high	101 Å²	101	48.2 Å²	48.2	47%	0.468	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	139.3	-171.4	-81.3	71.1	0	0	0	111.3	E118	E118-H120 IonicContact OE1-CE1 3.88Å; E118-H120 PolarHBondContact OE1-CE1 3.22Å; E118-H120 VanDerWaalsContact OE1-CE1 3.26Å; E118-H120 IonicContact OE1-NE2 3.56Å
121	Y	96.3	Very high	94.5	Very high	12 Å²	12	47.3 Å²	47.3	5%	0.047	25%	0.246	C	C	.	.			trans	-137.7	152.5	178.3	63.1	-90.9	0	0	0	111.7	T123 M125 H126 F129 E152 G154 R155 L156	Y121-T123 PolarHBondContact O-N 3.44Å; Y121-M125 HydrophobicContact CD2-CB 4.07Å; Y121-H126 HydrophobicContact CE2-CB 3.93Å; Y121-H126 PolarHBondContact OH-ND1 3.19Å; Y121-H126 VanDerWaalsContact OH-ND1 3.07Å; Y121-F129 HydrophobicContact CD1-CD2 4.34Å; Y121-F129 AromaticContact CD1-CE2 3.89Å; Y121-F129 HydrophobicContact CD1-CE2 3.89Å; Y121-F129 HydrophobicContact CD2-CD2 4.16Å; Y121-F129 AromaticContact CD2-CE2 3.81Å; Y121-F129 HydrophobicContact CD2-CE2 3.81Å; Y121-F129 AromaticContact CE1-CD2 3.94Å; Y121-F129 HydrophobicContact CE1-CD2 3.94Å; Y121-F129 AromaticContact CE1-CE2 3.98Å; Y121-F129 HydrophobicContact CE1-CE2 3.98Å; Y121-F129 AromaticContact CE2-CD2 3.78Å; Y121-F129 HydrophobicContact CE2-CD2 3.78Å; Y121-F129 AromaticContact CE2-CE2 3.94Å; Y121-F129 HydrophobicContact CE2-CE2 3.94Å; Y121-F129 HydrophobicContact CG-CD2 4.44Å; Y121-F129 AromaticContact CG-CE2 3.81Å; Y121-F129 HydrophobicContact CG-CE2 3.81Å; Y121-F129 AromaticContact CZ-CD2 3.67Å; Y121-E152 PolarHBondContact OH-O 3.5Å; Y121-G154 VanDerWaalsContact CE1-C 3.46Å; Y121-G154 VanDerWaalsContact CZ-CA 3.5Å; Y121-G154 PolarHBondContact N-O 3.2Å; Y121-G154 WeakPolarHBondContact O-CA 3.29Å; Y121-G154 PolarHBondContact OH-N 2.9Å; Y121-G154 VanDerWaalsContact OH-N 3.09Å; Y121-R155 VanDerWaalsContact CE1-C 3.42Å; Y121-R155 WeakPolarHBondContact CE1-O 3.39Å; Y121-L156 HydrophobicContact CD1-CD1 4.45Å; Y121-L156 HydrophobicContact CD1-CD2 4.37Å; Y121-L156 HydrophobicContact CD1-CG 3.84Å; Y121-L156 HydrophobicContact CE1-CD2 3.66Å; Y121-L156 HydrophobicContact CE1-CG 3.6Å
122	P	96.4	Very high	94.6	Very high	37 Å²	37	47.1 Å²	47.1	24%	0.24	25%	0.245	C	C	.	.			trans	-55.8	132	173.6	-25.3	34	0	0	0	112	D124 M125 V176 F179	P122-D124 PolarHBondContact O-N 3.13Å; P122-M125 HydrophobicContact CB-CG 4.49Å; P122-M125 HydrophobicContact CB-SD 4.38Å; P122-M125 HydrophobicContact CG-SD 4.01Å; P122-M125 WeakPolarHBondContact O-CB 3.24Å; P122-M125 PolarHBondContact O-N 2.72Å; P122-V176 HydrophobicContact CG-CG1 4.37Å; P122-F179 HydrophobicContact CB-CD1 4.18Å; P122-F179 HydrophobicContact CB-CE1 3.99Å; P122-F179 HydrophobicContact CG-CD1 4.03Å; P122-F179 HydrophobicContact CG-CE1 4.33Å
123	T	94.9	Very high	94.7	Very high	85 Å²	85	50.8 Å²	50.8	52%	0.521	25%	0.252	S	S	.	.	G	3₁₀ helix	trans	-55.6	-32.6	-174.6	-50.4	0	0	0	0	113.4	Y121 M125 H126 P153	Y121-T123 PolarHBondContact O-N 3.44Å; T123-M125 PolarHBondContact O-N 2.63Å; T123-H126 WeakPolarHBondContact O-CB 3.44Å; T123-H126 PolarHBondContact O-N 3.43Å; T123-P153 HydrophobicContact CG2-CB 3.77Å
124	D	93.6	Very high	94.7	Very high	110 Å²	110	49.3 Å²	49.3	59%	0.588	25%	0.246	S	C	*	.	G	3₁₀ helix	trans	-59.7	-24.1	175.8	-52.2	-17.5	0	0	0	113.3	P122 H126 C127 F179	P122-D124 PolarHBondContact O-N 3.13Å; D124-H126 VanDerWaalsContact C-N 3.34Å; D124-C127 PolarHBondContact O-SG 3.49Å; D124-F179 HydrophobicContact CB-CE1 4.43Å; D124-F179 HydrophobicContact CB-CE2 4.39Å; D124-F179 HydrophobicContact CB-CZ 3.69Å
125	M	95.5	Very high	94.7	Very high	0 Å²	0	46.8 Å²	46.8	0%	0	24%	0.236	C	C	.	.	G	3₁₀ helix	trans	-83.7	-2.9	174.1	-66.6	173.6	60.5	0	0	113.5	Y121 P122 T123 C127 I128 F175 V176 F179 L219	Y121-M125 HydrophobicContact CD2-CB 4.07Å; P122-M125 HydrophobicContact CB-CG 4.49Å; P122-M125 HydrophobicContact CB-SD 4.38Å; P122-M125 HydrophobicContact CG-SD 4.01Å; P122-M125 WeakPolarHBondContact O-CB 3.24Å; P122-M125 PolarHBondContact O-N 2.72Å; T123-M125 PolarHBondContact O-N 2.63Å; M125-C127 PolarHBondContact O-N 3.11Å; M125-C127 VanDerWaalsContact O-N 3.17Å; M125-I128 HydrophobicContact CB-CD1 3.95Å; M125-I128 HydrophobicContact CE-CD1 3.82Å; M125-I128 HydrophobicContact CG-CD1 4.19Å; M125-I128 VanDerWaalsContact O-CB 3.27Å; M125-I128 WeakPolarHBondContact O-CB 3.4Å; M125-I128 WeakPolarHBondContact O-CG1 3.37Å; M125-I128 PolarHBondContact O-N 3.2Å; M125-F175 HydrophobicContact CE-CB 3.61Å; M125-V176 HydrophobicContact CE-CG2 3.92Å; M125-V176 HydrophobicContact SD-CG2 4.05Å; M125-F179 HydrophobicContact CE-CB 4.35Å; M125-F179 HydrophobicContact CG-CB 4.14Å; M125-F179 HydrophobicContact CG-CD1 4.09Å; M125-F179 HydrophobicContact CG-CD2 3.48Å; M125-F179 VanDerWaalsContact CG-CD2 3.48Å; M125-F179 HydrophobicContact CG-CE1 4.38Å; M125-F179 HydrophobicContact CG-CE2 3.83Å; M125-F179 HydrophobicContact CG-CG 3.63Å; M125-F179 HydrophobicContact CG-CZ 4.27Å; M125-F179 HydrophobicContact SD-CB 3.41Å; M125-F179 WeakPolarHBondContact SD-CB 3.39Å; M125-F179 HydrophobicContact SD-CD1 3.92Å; M125-F179 HydrophobicContact SD-CD2 3.97Å; M125-F179 HydrophobicContact SD-CG 3.5Å; M125-F179 WeakPolarHBondContact SD-CG 3.31Å; M125-L219 HydrophobicContact CE-CD2 4.42Å
126	H	96.4	Very high	94.8	Very high	22 Å²	22	44 Å²	44	10%	0.102	22%	0.221	C	C	.	.	H	α-helix	trans	-58.8	-29.2	178.2	-179.6	64	0	0	0	112.5	Y121 T123 D124 I128 F129 A130 P153 Y208	Y121-H126 HydrophobicContact CE2-CB 3.93Å; Y121-H126 PolarHBondContact OH-ND1 3.19Å; Y121-H126 VanDerWaalsContact OH-ND1 3.07Å; T123-H126 WeakPolarHBondContact O-CB 3.44Å; T123-H126 PolarHBondContact O-N 3.43Å; D124-H126 VanDerWaalsContact C-N 3.34Å; H126-I128 PolarHBondContact O-N 3.38Å; H126-I128 VanDerWaalsContact O-N 3.14Å; H126-F129 PolarHBondContact O-N 3.12Å; H126-F129 VanDerWaalsContact O-N 3.08Å; H126-A130 PolarHBondContact O-N 3.27Å; H126-P153 HydrophobicContact CB-CB 4.16Å; H126-Y208 AromaticContact CD2-CE1 3.7Å; H126-Y208 AromaticContact CD2-CZ 3.93Å; H126-Y208 AromaticContact NE2-CZ 3.89Å; H126-Y208 PolarHBondContact NE2-OH 3.49Å
127	C	95.4	Very high	94.8	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-53	-27.7	170.5	64.5	0	0	0	0	114.2	D124 M125 G131 Y208 E211 L212	D124-C127 PolarHBondContact O-SG 3.49Å; M125-C127 PolarHBondContact O-N 3.11Å; M125-C127 VanDerWaalsContact O-N 3.17Å; C127-G131 WeakPolarHBondContact O-CA 3.44Å; C127-G131 PolarHBondContact O-N 3.03Å; C127-Y208 HydrophobicContact CB-CD1 4.19Å; C127-Y208 HydrophobicContact CB-CG 4.38Å; C127-E211 HydrophobicContact CB-CB 3.5Å; C127-E211 WeakPolarHBondContact CB-OE2 3.31Å; C127-L212 HydrophobicContact CB-CD2 4.17Å; C127-L212 HydrophobicContact CB-CG 4.07Å; C127-L212 WeakPolarHBondContact O-CD2 3.37Å
128	I	96.3	Very high	94.8	Very high	1 Å²	1	37.7 Å²	37.7	1%	0.005	19%	0.194	C	C	.	.	H	α-helix	trans	-68.8	-47	176	-58.1	173.7	0	0	0	110.5	M125 H126 F136 L212 L215 L219 L223	M125-I128 HydrophobicContact CB-CD1 3.95Å; M125-I128 HydrophobicContact CE-CD1 3.82Å; M125-I128 HydrophobicContact CG-CD1 4.19Å; M125-I128 VanDerWaalsContact O-CB 3.27Å; M125-I128 WeakPolarHBondContact O-CB 3.4Å; M125-I128 WeakPolarHBondContact O-CG1 3.37Å; M125-I128 PolarHBondContact O-N 3.2Å; H126-I128 PolarHBondContact O-N 3.38Å; H126-I128 VanDerWaalsContact O-N 3.14Å; I128-F136 HydrophobicContact CG2-CB 4.09Å; I128-F136 HydrophobicContact CG2-CG 4.47Å; I128-F136 WeakPolarHBondContact O-CB 3.26Å; I128-L212 HydrophobicContact CG1-CD2 4.48Å; I128-L215 HydrophobicContact CD1-CD1 4.02Å; I128-L215 HydrophobicContact CG1-CD1 3.68Å; I128-L219 HydrophobicContact CD1-CD1 4.48Å; I128-L219 HydrophobicContact CD1-CD2 3.96Å; I128-L219 HydrophobicContact CD1-CG 4.46Å; I128-L223 HydrophobicContact CD1-CD1 4.03Å; I128-L223 HydrophobicContact CG1-CD1 3.98Å; I128-L223 HydrophobicContact CG2-CD1 4.29Å; I128-L223 HydrophobicContact CG2-CD2 3.6Å
129	F	96.3	Very high	94.7	Very high	5 Å²	5	37.2 Å²	37.2	2%	0.022	19%	0.189	C	C	.	.	H	α-helix	trans	-86.5	-21	-172.2	-52.9	-70	0	0	0	113.3	Y121 H126 L137 L140 V150 L156 V172 F175	Y121-F129 HydrophobicContact CD1-CD2 4.34Å; Y121-F129 AromaticContact CD1-CE2 3.89Å; Y121-F129 HydrophobicContact CD1-CE2 3.89Å; Y121-F129 HydrophobicContact CD2-CD2 4.16Å; Y121-F129 AromaticContact CD2-CE2 3.81Å; Y121-F129 HydrophobicContact CD2-CE2 3.81Å; Y121-F129 AromaticContact CE1-CD2 3.94Å; Y121-F129 HydrophobicContact CE1-CD2 3.94Å; Y121-F129 AromaticContact CE1-CE2 3.98Å; Y121-F129 HydrophobicContact CE1-CE2 3.98Å; Y121-F129 AromaticContact CE2-CD2 3.78Å; Y121-F129 HydrophobicContact CE2-CD2 3.78Å; Y121-F129 AromaticContact CE2-CE2 3.94Å; Y121-F129 HydrophobicContact CE2-CE2 3.94Å; Y121-F129 HydrophobicContact CG-CD2 4.44Å; Y121-F129 AromaticContact CG-CE2 3.81Å; Y121-F129 HydrophobicContact CG-CE2 3.81Å; Y121-F129 AromaticContact CZ-CD2 3.67Å; H126-F129 PolarHBondContact O-N 3.12Å; H126-F129 VanDerWaalsContact O-N 3.08Å; F129-L137 HydrophobicContact CD1-CD1 4.36Å; F129-L140 HydrophobicContact CE1-CD2 4.03Å; F129-V150 HydrophobicContact CB-CG1 4.48Å; F129-V150 HydrophobicContact CB-CG2 3.92Å; F129-L156 HydrophobicContact CD1-CD1 4.36Å; F129-L156 HydrophobicContact CD1-CD2 4.3Å; F129-L156 HydrophobicContact CD2-CD2 4.34Å; F129-L156 HydrophobicContact CE1-CD1 3.94Å; F129-L156 HydrophobicContact CE2-CD1 4.47Å; F129-L156 HydrophobicContact CG-CD2 4.14Å; F129-L156 HydrophobicContact CZ-CD1 4Å; F129-V172 HydrophobicContact CE1-CG2 4.42Å; F129-V172 HydrophobicContact CZ-CG1 4.44Å; F129-V172 HydrophobicContact CZ-CG2 4.4Å; F129-F175 HydrophobicContact CZ-CD2 4.39Å
130	A	93.9	Very high	94.6	Very high	33 Å²	33	36.2 Å²	36.2	27%	0.273	19%	0.185	S	C	.	.	H	α-helix	trans	-114.1	-12.2	-179	0	0	0	0	0	114.5	H126 Y208	H126-A130 PolarHBondContact O-N 3.27Å; A130-Y208 HydrophobicContact CB-CD2 4.16Å; A130-Y208 HydrophobicContact CB-CE1 4.3Å; A130-Y208 HydrophobicContact CB-CE2 3.38Å; A130-Y208 VanDerWaalsContact CB-CZ 3.46Å; A130-Y208 WeakPolarHBondContact CB-OH 3.43Å; A130-Y208 VanDerWaalsContact O-CD2 3.31Å; A130-Y208 WeakPolarHBondContact O-CD2 3.46Å; A130-Y208 WeakPolarHBondContact O-CE2 3.42Å
131	G	92.9	Very high	94.7	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	16%	0.163	C	C	.	.	S	Bend	trans	-101.6	-176.3	179.5	0	0	0	0	0	114.4	C127 R133 G134 D206	C127-G131 WeakPolarHBondContact O-CA 3.44Å; C127-G131 PolarHBondContact O-N 3.03Å; G131-R133 PolarHBondContact O-N 2.79Å; G131-G134 PolarHBondContact O-N 3.4Å; G131-D206 VanDerWaalsContact C-OD2 3.28Å; G131-D206 WeakPolarHBondContact CA-OD2 3.42Å
132	A	93.1	Very high	94.6	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	16%	0.163	C	C	.	.	G	3₁₀ helix	trans	47.6	37.9	-167.2	0	0	0	0	0	112.1	G134 L135 F136 D206 L212	A132-G134 PolarHBondContact O-N 3.41Å; A132-L135 WeakPolarHBondContact O-CB 3.43Å; A132-L135 PolarHBondContact O-N 3.43Å; A132-L135 VanDerWaalsContact O-N 3.13Å; A132-F136 HydrophobicContact CB-CD2 3.87Å; A132-F136 HydrophobicContact CB-CE2 3.54Å; A132-F136 HydrophobicContact CB-CZ 4.35Å; A132-D206 WeakPolarHBondContact CA-OD2 3.42Å; A132-D206 PolarHBondContact N-OD2 3.18Å; A132-L212 HydrophobicContact CB-CD1 4.14Å
133	R	90.7	Very high	94.4	Very high	157 Å²	157	31.5 Å²	31.5	59%	0.592	16%	0.161	S	C	*	.	G	3₁₀ helix	trans	54.9	31.9	-176.1	-52	179.9	-174.9	169.1	3.4	113.7	G131 D205 D206	G131-R133 PolarHBondContact O-N 2.79Å; R133-D205 IonicContact CZ-OD1 2.67Å; R133-D205 PolarHBondContact NE-O 3.07Å; R133-D205 VanDerWaalsContact NE-O 3.08Å; R133-D205 PolarHBondContact NH2-O 3.43Å; R133-D205 IonicContact NH2-OD1 3.65Å; R133-D205 PolarHBondContact NH2-OD1 2.68Å; R133-D206 PolarHBondContact N-OD2 3.04Å
134	G	91.6	Very high	94.5	Very high	17 Å²	17	28 Å²	28	18%	0.175	14%	0.139	C	C	.	.	G	3₁₀ helix	trans	84	1.2	179.3	0	0	0	0	0	115.1	G131 A132 F136 L137 D138	G131-G134 PolarHBondContact O-N 3.4Å; A132-G134 PolarHBondContact O-N 3.41Å; G134-F136 PolarHBondContact O-N 2.85Å; G134-L137 WeakPolarHBondContact O-CB 3.29Å; G134-L137 PolarHBondContact O-N 3.47Å; G134-D138 PolarHBondContact O-N 2.98Å
135	L	92.5	Very high	94.7	Very high	55 Å²	55	23 Å²	23	29%	0.288	11%	0.113	S	C	.	.	H	α-helix	trans	-65.2	-30.9	-169.1	-79.3	164.3	0	0	0	114.8	A132 R139 R204	A132-L135 WeakPolarHBondContact O-CB 3.43Å; A132-L135 PolarHBondContact O-N 3.43Å; A132-L135 VanDerWaalsContact O-N 3.13Å; L135-R139 WeakPolarHBondContact O-CB 3.16Å; L135-R139 WeakPolarHBondContact O-CG 3.34Å; L135-R139 PolarHBondContact O-N 2.69Å; L135-R204 HydrophobicContact CD1-CG 4.26Å
136	F	95.3	Very high	94.7	Very high	2 Å²	2	23 Å²	23	1%	0.009	11%	0.113	C	C	.	.	H	α-helix	trans	-70.6	-33.5	174.1	-58.8	-66.8	0	0	0	111.9	I128 A132 G134 R139 L140 F197 F200 L212 L223 V227	I128-F136 HydrophobicContact CG2-CB 4.09Å; I128-F136 HydrophobicContact CG2-CG 4.47Å; I128-F136 WeakPolarHBondContact O-CB 3.26Å; A132-F136 HydrophobicContact CB-CD2 3.87Å; A132-F136 HydrophobicContact CB-CE2 3.54Å; A132-F136 HydrophobicContact CB-CZ 4.35Å; G134-F136 PolarHBondContact O-N 2.85Å; F136-R139 PolarHBondContact O-N 2.9Å; F136-L140 WeakPolarHBondContact O-CB 3.38Å; F136-L140 PolarHBondContact O-N 2.92Å; F136-F197 AromaticContact CZ-CE2 3.88Å; F136-F197 HydrophobicContact CZ-CE2 3.88Å; F136-F197 HydrophobicContact CZ-CZ 4.26Å; F136-F200 HydrophobicContact CE1-CD1 4.44Å; F136-F200 AromaticContact CE1-CE1 3.83Å; F136-F200 HydrophobicContact CE1-CE1 3.83Å; F136-F200 HydrophobicContact CE2-CE1 4.4Å; F136-F200 HydrophobicContact CZ-CD1 4.02Å; F136-F200 AromaticContact CZ-CE1 3.61Å; F136-F200 HydrophobicContact CZ-CE1 3.61Å; F136-L212 HydrophobicContact CD2-CD2 4.47Å; F136-L212 HydrophobicContact CE2-CD1 4.34Å; F136-L212 HydrophobicContact CE2-CD2 3.97Å; F136-L223 HydrophobicContact CD1-CB 4.18Å; F136-L223 HydrophobicContact CD1-CD2 4.12Å; F136-L223 HydrophobicContact CE1-CB 3.82Å; F136-L223 HydrophobicContact CG-CD2 4.36Å; F136-L223 HydrophobicContact CZ-CB 4.38Å; F136-V227 HydrophobicContact CD1-CG2 3.68Å; F136-V227 HydrophobicContact CE1-CG2 3.61Å
137	L	95.6	Very high	94.7	Very high	24 Å²	24	22.8 Å²	22.8	13%	0.126	11%	0.112	C	C	.	.	H	α-helix	trans	-68.8	-47.8	174.9	-179.5	65.2	0	0	0	111	F129 G134 R139 L140 I141 V148 V150	F129-L137 HydrophobicContact CD1-CD1 4.36Å; G134-L137 WeakPolarHBondContact O-CB 3.29Å; G134-L137 PolarHBondContact O-N 3.47Å; L137-R139 VanDerWaalsContact C-N 3.25Å; L137-R139 PolarHBondContact O-N 3.13Å; L137-L140 PolarHBondContact O-N 2.88Å; L137-L140 VanDerWaalsContact O-N 3.16Å; L137-I141 HydrophobicContact CD1-CD1 4.31Å; L137-I141 HydrophobicContact CG-CD1 4.02Å; L137-I141 WeakPolarHBondContact O-CD1 3.46Å; L137-I141 WeakPolarHBondContact O-CG1 3.33Å; L137-I141 PolarHBondContact O-N 2.86Å; L137-V148 HydrophobicContact CD1-CB 3.8Å; L137-V148 HydrophobicContact CD1-CG1 3.48Å; L137-V148 VanDerWaalsContact CD1-CG1 3.48Å; L137-V150 HydrophobicContact CD1-CG2 4.24Å; L137-V150 HydrophobicContact CD2-CG2 3.83Å
138	D	94.9	Very high	94.8	Very high	30 Å²	30	22.8 Å²	22.8	16%	0.16	11%	0.112	C	C	.	.	H	α-helix	trans	-55.1	-41.4	173.3	-88.9	13.5	0	0	0	111.2	Q62 V63 G134 R142	Q62-D138 PolarHBondContact NE2-OD2 2.95Å; V63-D138 WeakPolarHBondContact CG1-O 3.31Å; V63-D138 HydrophobicContact CG2-CB 4.43Å; G134-D138 PolarHBondContact O-N 2.98Å; D138-R142 VanDerWaalsContact O-CB 3.31Å; D138-R142 WeakPolarHBondContact O-CB 3.47Å; D138-R142 PolarHBondContact O-N 3.21Å
139	R	94.7	Very high	94.7	Very high	68 Å²	68	26.3 Å²	26.3	26%	0.257	13%	0.13	S	C	.	.	H	α-helix	trans	-70.2	-39.1	177.4	-67.2	-75.1	164.5	151.8	-0.1	112.9	L135 F136 L137 R142 D143 L226 V227	L135-R139 WeakPolarHBondContact O-CB 3.16Å; L135-R139 WeakPolarHBondContact O-CG 3.34Å; L135-R139 PolarHBondContact O-N 2.69Å; F136-R139 PolarHBondContact O-N 2.9Å; L137-R139 VanDerWaalsContact C-N 3.25Å; L137-R139 PolarHBondContact O-N 3.13Å; R139-R142 PolarHBondContact O-N 3.43Å; R139-D143 VanDerWaalsContact O-CB 3.29Å; R139-D143 WeakPolarHBondContact O-CB 3.46Å; R139-D143 PolarHBondContact O-N 2.88Å; R139-L226 HydrophobicContact CB-CD1 4.43Å; R139-L226 HydrophobicContact CB-CD2 4.21Å; R139-L226 HydrophobicContact CB-CG 3.86Å; R139-V227 HydrophobicContact CG-CG2 4.45Å; R139-V227 PolarHBondContact NH1-O 2.8Å
140	L	95.8	Very high	94.7	Very high	2 Å²	2	28.2 Å²	28.2	1%	0.01	14%	0.142	C	C	.	.	H	α-helix	trans	-61.1	-46	174.8	-179.4	62.9	0	0	0	111.3	F129 F136 L137 D143 T144 V148 R171 V172 F175 L226	F129-L140 HydrophobicContact CE1-CD2 4.03Å; F136-L140 WeakPolarHBondContact O-CB 3.38Å; F136-L140 PolarHBondContact O-N 2.92Å; L137-L140 PolarHBondContact O-N 2.88Å; L137-L140 VanDerWaalsContact O-N 3.16Å; L140-D143 PolarHBondContact O-N 3.34Å; L140-T144 HydrophobicContact CD1-CG2 3.92Å; L140-T144 WeakPolarHBondContact O-CB 3.4Å; L140-T144 VanDerWaalsContact O-CG2 3.28Å; L140-T144 WeakPolarHBondContact O-CG2 3.42Å; L140-T144 PolarHBondContact O-N 2.97Å; L140-T144 VanDerWaalsContact O-N 3.12Å; L140-T144 PolarHBondContact O-OG1 3.45Å; L140-V148 HydrophobicContact CD2-CG2 4.44Å; L140-R171 HydrophobicContact CD1-CB 3.71Å; L140-R171 HydrophobicContact CD1-CG 4.27Å; L140-V172 HydrophobicContact CD2-CG2 3.92Å; L140-F175 HydrophobicContact CD1-CE2 4.4Å; L140-L226 HydrophobicContact CB-CD2 4.44Å
141	I	96	Very high	94.6	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-59.6	-49.8	174.7	-66.6	160	0	0	0	110.2	R59 V63 F64 Y106 L137 D143 T144 S145 A146 V148	R59-I141 VanDerWaalsContact NH2-CD1 3.25Å; V63-I141 HydrophobicContact CG1-CB 4.27Å; V63-I141 HydrophobicContact CG1-CG2 3.9Å; F64-I141 HydrophobicContact CE2-CG2 4.35Å; F64-I141 HydrophobicContact CZ-CG2 4.12Å; Y106-I141 HydrophobicContact CD2-CG2 3.91Å; Y106-I141 HydrophobicContact CE2-CG2 3.58Å; L137-I141 HydrophobicContact CD1-CD1 4.31Å; L137-I141 HydrophobicContact CG-CD1 4.02Å; L137-I141 WeakPolarHBondContact O-CD1 3.46Å; L137-I141 WeakPolarHBondContact O-CG1 3.33Å; L137-I141 PolarHBondContact O-N 2.86Å; I141-D143 VanDerWaalsContact C-N 3.31Å; I141-D143 PolarHBondContact O-N 3.3Å; I141-T144 PolarHBondContact O-N 3.41Å; I141-S145 WeakPolarHBondContact O-CA 3.41Å; I141-S145 PolarHBondContact O-N 2.89Å; I141-A146 WeakPolarHBondContact CG2-O 3.44Å; I141-V148 HydrophobicContact CD1-CB 4.34Å; I141-V148 HydrophobicContact CG1-CB 3.85Å; I141-V148 HydrophobicContact CG1-CG2 3.84Å
142	R	94.5	Very high	94.6	Very high	16 Å²	16	34.9 Å²	34.9	6%	0.06	18%	0.175	C	C	.	.	H	α-helix	trans	-64.6	-31.5	-178.9	-163.3	-157.9	64.7	154.1	-3.5	113.7	V63 F64 K102 D138 R139 S229 T231	V63-R142 HydrophobicContact CG1-CB 3.71Å; V63-R142 HydrophobicContact CG1-CG 4.25Å; V63-R142 WeakPolarHBondContact O-CD 3.41Å; V63-R142 WeakPolarHBondContact O-CG 3.41Å; F64-R142 HydrophobicContact CD1-CG 3.87Å; F64-R142 HydrophobicContact CE1-CB 4.41Å; F64-R142 HydrophobicContact CE1-CG 4.17Å; K102-R142 WeakPolarHBondContact CD-O 3.41Å; K102-R142 WeakPolarHBondContact CE-O 2.97Å; K102-R142 PolarHBondContact NZ-O 3.13Å; D138-R142 VanDerWaalsContact O-CB 3.31Å; D138-R142 WeakPolarHBondContact O-CB 3.47Å; D138-R142 PolarHBondContact O-N 3.21Å; R139-R142 PolarHBondContact O-N 3.43Å; R142-S229 PolarHBondContact NH2-OG 2.84Å; R142-T231 PolarHBondContact NH1-OG1 2.88Å
143	D	93.4	Very high	94.6	Very high	35 Å²	35	38.2 Å²	38.2	19%	0.187	20%	0.197	C	C	.	.	H	α-helix	trans	-93.6	-5.5	-176.2	-72.4	9.8	0	0	0	113.4	K102 R139 L140 I141 L226 S229	K102-D143 IonicContact NZ-OD1 3.68Å; K102-D143 PolarHBondContact NZ-OD1 3.49Å; R139-D143 VanDerWaalsContact O-CB 3.29Å; R139-D143 WeakPolarHBondContact O-CB 3.46Å; R139-D143 PolarHBondContact O-N 2.88Å; L140-D143 PolarHBondContact O-N 3.34Å; I141-D143 VanDerWaalsContact C-N 3.31Å; I141-D143 PolarHBondContact O-N 3.3Å; D143-L226 HydrophobicContact CB-CD1 4.38Å; D143-S229 VanDerWaalsContact OD2-CB 3.31Å; D143-S229 WeakPolarHBondContact OD2-CB 3.41Å; D143-S229 PolarHBondContact OD2-OG 3.37Å
144	T	96	Very high	94.8	Very high	10 Å²	10	31.1 Å²	31.1	6%	0.061	17%	0.172	C	C	.	.	H	α-helix	trans	-120.9	-15.1	177	61.6	0	0	0	0	114.1	L140 I141 A146 P164 M167 A168 R171	L140-T144 HydrophobicContact CD1-CG2 3.92Å; L140-T144 WeakPolarHBondContact O-CB 3.4Å; L140-T144 VanDerWaalsContact O-CG2 3.28Å; L140-T144 WeakPolarHBondContact O-CG2 3.42Å; L140-T144 PolarHBondContact O-N 2.97Å; L140-T144 VanDerWaalsContact O-N 3.12Å; L140-T144 PolarHBondContact O-OG1 3.45Å; I141-T144 PolarHBondContact O-N 3.41Å; T144-A146 PolarHBondContact O-N 3.24Å; T144-A146 VanDerWaalsContact O-N 3.16Å; T144-A146 PolarHBondContact OG1-N 3.09Å; T144-P164 VanDerWaalsContact O-CA 3.23Å; T144-P164 WeakPolarHBondContact O-CA 3.39Å; T144-P164 WeakPolarHBondContact O-CB 3.38Å; T144-M167 HydrophobicContact CG2-CB 4.4Å; T144-A168 HydrophobicContact CG2-CB 3.99Å; T144-R171 HydrophobicContact CG2-CG 4.31Å
145	S	96.9	Very high	95	Very high	5 Å²	5	33.8 Å²	33.8	4%	0.035	18%	0.177	C	C	.	.			trans	59.9	10.6	-170.5	-49.8	0	0	0	0	115	E105 Y106 I141	E105-S145 WeakPolarHBondContact OE2-CB 3.18Å; E105-S145 PolarHBondContact OE2-OG 3.45Å; Y106-S145 VanDerWaalsContact CA-O 3.31Å; Y106-S145 WeakPolarHBondContact CA-O 3.5Å; I141-S145 WeakPolarHBondContact O-CA 3.41Å; I141-S145 PolarHBondContact O-N 2.89Å
146	A	97.1	Very high	95.2	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	16%	0.163	C	C	.	.			trans	-93.5	146.6	177.3	0	0	0	0	0	111.7	I141 T144 P164 V165 A168	I141-A146 WeakPolarHBondContact CG2-O 3.44Å; T144-A146 PolarHBondContact O-N 3.24Å; T144-A146 VanDerWaalsContact O-N 3.16Å; T144-A146 PolarHBondContact OG1-N 3.09Å; A146-P164 HydrophobicContact CB-CB 3.98Å; A146-V165 HydrophobicContact CB-CG2 4.4Å; A146-A168 HydrophobicContact CB-CB 3.84Å
147	E	96.2	Very high	95.3	Very high	18 Å²	18	35.6 Å²	35.6	8%	0.084	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	130.5	165.6	167.4	61.1	149.5	0	0	109.7	R59 Y106 L110 L149 L158 V159	R59-E147 IonicContact CZ-OE1 2.77Å; R59-E147 IonicContact CZ-OE2 3.34Å; R59-E147 VanDerWaalsContact NH1-CD 3.34Å; R59-E147 IonicContact NH1-OE1 3.19Å; R59-E147 PolarHBondContact NH1-OE1 3.43Å; R59-E147 IonicContact NH1-OE2 3.23Å; R59-E147 PolarHBondContact NH1-OE2 2.86Å; R59-E147 IonicContact NH2-OE1 2.76Å; R59-E147 IonicContact NH2-OE2 2.99Å; R59-E147 PolarHBondContact NH2-OE2 3.48Å; Y106-E147 HydrophobicContact CE2-CB 4Å; L110-E147 HydrophobicContact CD2-CB 3.82Å; L110-E147 HydrophobicContact CD2-CG 4.02Å; E147-L149 HydrophobicContact CG-CG 4.21Å; E147-L149 VanDerWaalsContact OE1-CD2 3.24Å; E147-L149 WeakPolarHBondContact OE1-CD2 3.37Å; E147-L158 WeakPolarHBondContact O-CA 3.44Å; E147-V159 HydrophobicContact CB-CB 4.25Å; E147-V159 WeakPolarHBondContact CB-O 3.28Å; E147-V159 HydrophobicContact CG-CB 4.4Å; E147-V159 PolarHBondContact N-O 2.98Å; E147-V159 PolarHBondContact O-N 3.28Å
148	V	96.9	Very high	95.4	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	110.8	-178.4	-174.5	0	0	0	0	108.2	R59 L137 L140 I141 L156 L158	R59-V148 PolarHBondContact NH2-O 2.94Å; L137-V148 HydrophobicContact CD1-CB 3.8Å; L137-V148 HydrophobicContact CD1-CG1 3.48Å; L137-V148 VanDerWaalsContact CD1-CG1 3.48Å; L140-V148 HydrophobicContact CD2-CG2 4.44Å; I141-V148 HydrophobicContact CD1-CB 4.34Å; I141-V148 HydrophobicContact CG1-CB 3.85Å; I141-V148 HydrophobicContact CG1-CG2 3.84Å; V148-L156 HydrophobicContact CG1-CD1 4.03Å; V148-L156 HydrophobicContact CG1-CD2 4.09Å; V148-L156 HydrophobicContact CG1-CG 4.45Å; V148-L158 HydrophobicContact CB-CD2 4.28Å; V148-L158 HydrophobicContact CG1-CD2 3.87Å; V148-L158 HydrophobicContact CG2-CD2 3.83Å
149	L	95	Very high	95.5	Very high	76 Å²	76	33.9 Å²	33.9	40%	0.398	17%	0.171	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	141	175.4	-64.1	171.5	0	0	0	110	E147 P151 L156 W157	E147-L149 HydrophobicContact CG-CG 4.21Å; E147-L149 VanDerWaalsContact OE1-CD2 3.24Å; E147-L149 WeakPolarHBondContact OE1-CD2 3.37Å; L149-P151 VanDerWaalsContact C-CD 3.49Å; L149-P151 WeakPolarHBondContact O-CD 3.12Å; L149-L156 WeakPolarHBondContact O-CA 3.43Å; L149-W157 HydrophobicContact CB-CB 4.26Å; L149-W157 PolarHBondContact N-O 2.84Å; L149-W157 PolarHBondContact O-N 3.25Å
150	V	95.8	Very high	95.5	Very high	44 Å²	44	30.6 Å²	30.6	27%	0.267	16%	0.159	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	80.3	177	-166.4	0	0	0	0	108.5	F129 L137 E152 L156	F129-V150 HydrophobicContact CB-CG1 4.48Å; F129-V150 HydrophobicContact CB-CG2 3.92Å; L137-V150 HydrophobicContact CD1-CG2 4.24Å; L137-V150 HydrophobicContact CD2-CG2 3.83Å; V150-E152 VanDerWaalsContact C-N 3.3Å; V150-E152 PolarHBondContact O-N 3.25Å; V150-L156 HydrophobicContact CB-CD2 4.35Å; V150-L156 HydrophobicContact CG1-CD2 4.29Å; V150-L156 HydrophobicContact CG2-CD2 3.78Å
151	P	91.3	Very high	95.5	Very high	85 Å²	85	34.3 Å²	34.3	55%	0.552	17%	0.173	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-62.7	-36.4	-176.3	24.3	-34.5	0	0	0	112.6	L149 R155	L149-P151 VanDerWaalsContact C-CD 3.49Å; L149-P151 WeakPolarHBondContact O-CD 3.12Å; P151-R155 HydrophobicContact CG-CB 4.18Å
152	E	92.9	Very high	95.4	Very high	88 Å²	88	36.3 Å²	36.3	41%	0.411	19%	0.19	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-163.3	164.2	179.7	61.6	-168.1	129.8	0	0	111.8	Y121 V150 G154 R155	Y121-E152 PolarHBondContact OH-O 3.5Å; V150-E152 VanDerWaalsContact C-N 3.3Å; V150-E152 PolarHBondContact O-N 3.25Å; E152-G154 PolarHBondContact O-N 3.34Å; E152-R155 VanDerWaalsContact CD-CZ 3.5Å; E152-R155 VanDerWaalsContact CD-NE 3.31Å; E152-R155 HydrophobicContact CG-CB 4.29Å; E152-R155 PolarHBondContact O-N 3.48Å; E152-R155 IonicContact OE1-CZ 3.83Å; E152-R155 IonicContact OE1-NE 3.41Å; E152-R155 PolarHBondContact OE1-NE 2.98Å; E152-R155 IonicContact OE1-NH2 3.8Å; E152-R155 PolarHBondContact OE1-NH2 3.17Å; E152-R155 IonicContact OE2-CZ 3.69Å; E152-R155 IonicContact OE2-NE 2.68Å; E152-R155 IonicContact OE2-NH2 3.93Å; E152-R155 PolarHBondContact OE2-NH2 2.69Å
153	P	94.5	Very high	95.5	Very high	71 Å²	71	41.3 Å²	41.3	46%	0.461	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.9	117.4	-179	-24.2	35.2	0	0	0	113.3	T123 H126	T123-P153 HydrophobicContact CG2-CB 3.77Å; H126-P153 HydrophobicContact CB-CB 4.16Å
154	G	93.8	Very high	95.7	Very high	7 Å²	7	39.8 Å²	39.8	7%	0.072	21%	0.206	C	C	.	.	T	Hydrogen-bonded Turn	trans	102.1	-3.9	-179.7	0	0	0	0	0	115.6	Y121 E152	Y121-G154 VanDerWaalsContact CE1-C 3.46Å; Y121-G154 VanDerWaalsContact CZ-CA 3.5Å; Y121-G154 PolarHBondContact N-O 3.2Å; Y121-G154 WeakPolarHBondContact O-CA 3.29Å; Y121-G154 PolarHBondContact OH-N 2.9Å; Y121-G154 VanDerWaalsContact OH-N 3.09Å; E152-G154 PolarHBondContact O-N 3.34Å
155	R	95.9	Very high	95.7	Very high	73 Å²	73	39.3 Å²	39.3	28%	0.275	20%	0.203	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	139	174.5	-76.3	-172	-89.3	-82.8	7.8	112.3	E118 Y121 P151 E152	E118-R155 WeakPolarHBondContact OE1-CD 3.21Å; Y121-R155 VanDerWaalsContact CE1-C 3.42Å; Y121-R155 WeakPolarHBondContact CE1-O 3.39Å; P151-R155 HydrophobicContact CG-CB 4.18Å; E152-R155 VanDerWaalsContact CD-CZ 3.5Å; E152-R155 VanDerWaalsContact CD-NE 3.31Å; E152-R155 HydrophobicContact CG-CB 4.29Å; E152-R155 PolarHBondContact O-N 3.48Å; E152-R155 IonicContact OE1-CZ 3.83Å; E152-R155 IonicContact OE1-NE 3.41Å; E152-R155 PolarHBondContact OE1-NE 2.98Å; E152-R155 IonicContact OE1-NH2 3.8Å; E152-R155 PolarHBondContact OE1-NH2 3.17Å; E152-R155 IonicContact OE2-CZ 3.69Å; E152-R155 IonicContact OE2-NE 2.68Å; E152-R155 IonicContact OE2-NH2 3.93Å; E152-R155 PolarHBondContact OE2-NH2 2.69Å
156	L	97.2	Very high	95.7	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	145.9	162.8	-60.8	-178.9	0	0	0	109.5	E118 E119 Y121 F129 V148 L149 V150 L158 V172	E118-L156 WeakPolarHBondContact CA-O 3.38Å; E119-L156 PolarHBondContact N-O 2.85Å; E119-L156 PolarHBondContact O-N 2.97Å; Y121-L156 HydrophobicContact CD1-CD1 4.45Å; Y121-L156 HydrophobicContact CD1-CD2 4.37Å; Y121-L156 HydrophobicContact CD1-CG 3.84Å; Y121-L156 HydrophobicContact CE1-CD2 3.66Å; Y121-L156 HydrophobicContact CE1-CG 3.6Å; F129-L156 HydrophobicContact CD1-CD1 4.36Å; F129-L156 HydrophobicContact CD1-CD2 4.3Å; F129-L156 HydrophobicContact CD2-CD2 4.34Å; F129-L156 HydrophobicContact CE1-CD1 3.94Å; F129-L156 HydrophobicContact CE2-CD1 4.47Å; F129-L156 HydrophobicContact CG-CD2 4.14Å; F129-L156 HydrophobicContact CZ-CD1 4Å; V148-L156 HydrophobicContact CG1-CD1 4.03Å; V148-L156 HydrophobicContact CG1-CD2 4.09Å; V148-L156 HydrophobicContact CG1-CG 4.45Å; L149-L156 WeakPolarHBondContact O-CA 3.43Å; V150-L156 HydrophobicContact CB-CD2 4.35Å; V150-L156 HydrophobicContact CG1-CD2 4.29Å; V150-L156 HydrophobicContact CG2-CD2 3.78Å; L156-L158 HydrophobicContact CB-CD2 4.21Å; L156-L158 HydrophobicContact CD1-CD2 4.35Å; L156-V172 HydrophobicContact CD1-CB 4.39Å; L156-V172 HydrophobicContact CD1-CG1 3.99Å; L156-V172 HydrophobicContact CD1-CG2 3.5Å; L156-V172 VanDerWaalsContact CD1-CG2 3.5Å
157	W	97.3	Very high	95.7	Very high	96 Å²	96	47.4 Å²	47.4	36%	0.364	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	115.5	164.3	-163.1	-101.1	0	0	0	108.3	Q116 E118 L149 V159	Q116-W157 HydrophobicContact CB-CZ2 4.13Å; E118-W157 HydrophobicContact CB-CE3 3.8Å; E118-W157 HydrophobicContact CB-CZ3 3.65Å; E118-W157 HydrophobicContact CG-CE3 4Å; E118-W157 HydrophobicContact CG-CZ3 4.07Å; L149-W157 HydrophobicContact CB-CB 4.26Å; L149-W157 PolarHBondContact N-O 2.84Å; L149-W157 PolarHBondContact O-N 3.25Å; W157-V159 HydrophobicContact CG-CG2 4.47Å
158	L	97.6	Very high	95.7	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	127.6	-178.3	-52.2	177.1	0	0	0	108.9	Q116 K117 E119 E147 V148 L156 V165 A168 Q169	Q116-L158 CarbonylContact C-O 3.21Å; Q116-L158 VanDerWaalsContact CA-O 3.32Å; Q116-L158 WeakPolarHBondContact CA-O 3.23Å; K117-L158 HydrophobicContact CB-CB 4.41Å; K117-L158 PolarHBondContact N-O 3.27Å; K117-L158 WeakPolarHBondContact O-CB 3.35Å; K117-L158 PolarHBondContact O-N 2.93Å; E119-L158 HydrophobicContact CB-CD1 3.97Å; E119-L158 HydrophobicContact CB-CG 4.47Å; E147-L158 WeakPolarHBondContact O-CA 3.44Å; V148-L158 HydrophobicContact CB-CD2 4.28Å; V148-L158 HydrophobicContact CG1-CD2 3.87Å; V148-L158 HydrophobicContact CG2-CD2 3.83Å; L156-L158 HydrophobicContact CB-CD2 4.21Å; L156-L158 HydrophobicContact CD1-CD2 4.35Å; L158-V165 HydrophobicContact CB-CG1 3.91Å; L158-A168 HydrophobicContact CD1-CB 4.32Å; L158-A168 HydrophobicContact CD2-CB 4.19Å; L158-Q169 HydrophobicContact CD1-CB 3.8Å; L158-Q169 HydrophobicContact CD1-CG 4.18Å
159	V	96.2	Very high	95.7	Very high	17 Å²	17	48.3 Å²	48.3	10%	0.103	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	138.7	-175.3	177.3	0	0	0	0	110.3	P113 Q116 E147 W157 V165	P113-V159 HydrophobicContact CB-CG1 3.73Å; P113-V159 HydrophobicContact CG-CG1 4.41Å; Q116-V159 HydrophobicContact CB-CG2 4.41Å; Q116-V159 HydrophobicContact CG-CG1 4.2Å; Q116-V159 HydrophobicContact CG-CG2 4.07Å; E147-V159 HydrophobicContact CB-CB 4.25Å; E147-V159 WeakPolarHBondContact CB-O 3.28Å; E147-V159 HydrophobicContact CG-CB 4.4Å; E147-V159 PolarHBondContact N-O 2.98Å; E147-V159 PolarHBondContact O-N 3.28Å; W157-V159 HydrophobicContact CG-CG2 4.47Å; V159-V165 VanDerWaalsContact C-CG2 3.41Å
160	G	96.1	Very high	95.8	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	156.3	-154.7	172.2	0	0	0	0	0	114.4	P113 E114 L115 V165	P113-G160 CarbonylContact C-O 3.52Å; P113-G160 WeakPolarHBondContact CA-O 3.38Å; E114-G160 PolarHBondContact N-O 3.03Å; L115-G160 PolarHBondContact N-O 3.11Å; L115-G160 PolarHBondContact O-N 2.67Å; L115-G160 VanDerWaalsContact O-N 3.14Å; G160-V165 VanDerWaalsContact N-CG2 3.26Å
161	R	94.8	Very high	95.8	Very high	79 Å²	79	49.5 Å²	49.5	30%	0.298	26%	0.255	S	S	.	.	S	Bend	trans	-67.5	154	168.8	-52.2	-65.4	-67	165.1	9	109.6	D112 E114 E163 P164 V165	D112-R161 PolarHBondContact O-NH1 2.83Å; E114-R161 VanDerWaalsContact CD-NH1 3.3Å; E114-R161 IonicContact OE1-CZ 2.92Å; E114-R161 IonicContact OE1-NE 3.99Å; E114-R161 IonicContact OE1-NH1 2.65Å; E114-R161 PolarHBondContact OE1-NH1 2.89Å; E114-R161 IonicContact OE1-NH2 3.86Å; E114-R161 PolarHBondContact OE1-NH2 2.84Å; E114-R161 WeakPolarHBondContact OE2-CA 3.39Å; E114-R161 IonicContact OE2-CZ 3.69Å; E114-R161 IonicContact OE2-NE 2.96Å; E114-R161 PolarHBondContact OE2-NE 3.4Å; E114-R161 IonicContact OE2-NH1 3.53Å; E114-R161 IonicContact OE2-NH2 2.8Å; E114-R161 PolarHBondContact OE2-NH2 3.36Å; R161-E163 PolarHBondContact O-N 3.17Å; R161-P164 HydrophobicContact CB-CG 4.02Å; R161-V165 WeakPolarHBondContact O-CG2 3.11Å; R161-V165 PolarHBondContact O-N 2.91Å
162	A	95.3	Very high	96.1	Very high	43 Å²	43	45.5 Å²	45.5	36%	0.355	23%	0.229	S	C	.	.	H	α-helix	trans	-60.1	-44.7	-169.5	0	0	0	0	0	113.8	E114 V165 V166	E114-A162 HydrophobicContact CB-CB 4.41Å; E114-A162 PolarHBondContact OE2-N 2.71Å; A162-V165 PolarHBondContact O-N 2.81Å; A162-V166 WeakPolarHBondContact O-CG2 3.43Å; A162-V166 PolarHBondContact O-N 3.11Å; A162-V166 VanDerWaalsContact O-N 3.14Å
163	E	95.8	Very high	96.2	Very high	120 Å²	120	45.3 Å²	45.3	56%	0.561	23%	0.228	S	C	*	.	H	α-helix	trans	-65.1	-53.6	179.9	172	169.3	-162.1	0	0	112.8	R161 V165 V166 M167	R161-E163 PolarHBondContact O-N 3.17Å; E163-V165 VanDerWaalsContact C-N 3.32Å; E163-V165 PolarHBondContact O-N 3.05Å; E163-V166 PolarHBondContact O-N 3.16Å; E163-M167 HydrophobicContact CG-CG 4.4Å; E163-M167 WeakPolarHBondContact O-CB 3.35Å; E163-M167 VanDerWaalsContact O-CG 3.32Å; E163-M167 WeakPolarHBondContact O-CG 3.26Å; E163-M167 PolarHBondContact O-N 2.91Å
164	P	97.1	Very high	96.3	Very high	3 Å²	3	45 Å²	45	2%	0.019	22%	0.221	C	C	.	.	H	α-helix	trans	-45.3	-48.2	169	-38.8	40.7	0	0	0	115.5	E105 T144 A146 R161 M167 A168	E105-P164 HydrophobicContact CG-CG 3.81Å; E105-P164 VanDerWaalsContact OE1-CG 3.3Å; E105-P164 WeakPolarHBondContact OE1-CG 3.34Å; T144-P164 VanDerWaalsContact O-CA 3.23Å; T144-P164 WeakPolarHBondContact O-CA 3.39Å; T144-P164 WeakPolarHBondContact O-CB 3.38Å; A146-P164 HydrophobicContact CB-CB 3.98Å; R161-P164 HydrophobicContact CB-CG 4.02Å; P164-M167 PolarHBondContact O-N 3.11Å; P164-A168 WeakPolarHBondContact O-CB 3.36Å; P164-A168 PolarHBondContact O-N 2.93Å
165	V	97.4	Very high	96.3	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-67.3	-40.7	-177.3	171.8	0	0	0	0	111.5	L115 K117 A146 L158 V159 G160 R161 A162 E163 A168 Q169	L115-V165 HydrophobicContact CB-CB 4.23Å; L115-V165 HydrophobicContact CB-CG1 4.27Å; L115-V165 HydrophobicContact CB-CG2 4.4Å; L115-V165 HydrophobicContact CD2-CB 4.02Å; L115-V165 HydrophobicContact CD2-CG1 3.72Å; L115-V165 HydrophobicContact CG-CB 4.25Å; L115-V165 HydrophobicContact CG-CG1 3.81Å; K117-V165 HydrophobicContact CB-CG1 3.8Å; A146-V165 HydrophobicContact CB-CG2 4.4Å; L158-V165 HydrophobicContact CB-CG1 3.91Å; V159-V165 VanDerWaalsContact C-CG2 3.41Å; G160-V165 VanDerWaalsContact N-CG2 3.26Å; R161-V165 WeakPolarHBondContact O-CG2 3.11Å; R161-V165 PolarHBondContact O-N 2.91Å; A162-V165 PolarHBondContact O-N 2.81Å; E163-V165 VanDerWaalsContact C-N 3.32Å; E163-V165 PolarHBondContact O-N 3.05Å; V165-A168 PolarHBondContact O-N 3.37Å; V165-Q169 WeakPolarHBondContact O-CB 3.23Å; V165-Q169 PolarHBondContact O-N 3.3Å
166	V	96.9	Very high	96.3	Very high	77 Å²	77	42.1 Å²	42.1	47%	0.467	21%	0.209	S	C	.	.	H	α-helix	trans	-66.6	-38.3	174.6	172.2	0	0	0	0	111.3	L115 A162 E163 Q169 S170	L115-V166 HydrophobicContact CD2-CG2 4.09Å; A162-V166 WeakPolarHBondContact O-CG2 3.43Å; A162-V166 PolarHBondContact O-N 3.11Å; A162-V166 VanDerWaalsContact O-N 3.14Å; E163-V166 PolarHBondContact O-N 3.16Å; V166-Q169 PolarHBondContact O-N 3.45Å; V166-S170 WeakPolarHBondContact O-CB 3.44Å; V166-S170 PolarHBondContact O-N 2.84Å
167	M	96.4	Very high	96.2	Very high	99 Å²	99	44.1 Å²	44.1	49%	0.488	23%	0.226	S	C	.	.	H	α-helix	trans	-63.1	-44.8	174.8	-73.3	-70.5	-78.6	0	0	111.7	T144 E163 P164 S170 R171	T144-M167 HydrophobicContact CG2-CB 4.4Å; E163-M167 HydrophobicContact CG-CG 4.4Å; E163-M167 WeakPolarHBondContact O-CB 3.35Å; E163-M167 VanDerWaalsContact O-CG 3.32Å; E163-M167 WeakPolarHBondContact O-CG 3.26Å; E163-M167 PolarHBondContact O-N 2.91Å; P164-M167 PolarHBondContact O-N 3.11Å; M167-S170 PolarHBondContact O-N 3.03Å; M167-R171 WeakPolarHBondContact O-CG 3.33Å; M167-R171 PolarHBondContact O-N 2.8Å
168	A	96.8	Very high	96	Very high	0 Å²	0	41 Å²	41	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-64	-42.5	174.2	0	0	0	0	0	112.4	T144 A146 L158 P164 V165 R171 V172	T144-A168 HydrophobicContact CG2-CB 3.99Å; A146-A168 HydrophobicContact CB-CB 3.84Å; L158-A168 HydrophobicContact CD1-CB 4.32Å; L158-A168 HydrophobicContact CD2-CB 4.19Å; P164-A168 WeakPolarHBondContact O-CB 3.36Å; P164-A168 PolarHBondContact O-N 2.93Å; V165-A168 PolarHBondContact O-N 3.37Å; A168-R171 PolarHBondContact O-N 3.28Å; A168-V172 VanDerWaalsContact O-CG2 3.29Å; A168-V172 WeakPolarHBondContact O-CG2 3.44Å; A168-V172 PolarHBondContact O-N 3.17Å
169	Q	96.8	Very high	95.8	Very high	36 Å²	36	42.6 Å²	42.6	17%	0.168	22%	0.224	C	C	.	.	H	α-helix	trans	-60.1	-48.3	176.8	-161	-166.4	-1.1	0	0	111.2	K117 E119 L158 V165 V166 R171 V172 Q173	K117-Q169 HydrophobicContact CG-CG 4.46Å; E119-Q169 HydrophobicContact CB-CG 4.42Å; E119-Q169 HydrophobicContact CG-CG 3.97Å; E119-Q169 WeakPolarHBondContact OE2-CG 3.38Å; E119-Q169 PolarHBondContact OE2-NE2 3.47Å; L158-Q169 HydrophobicContact CD1-CB 3.8Å; L158-Q169 HydrophobicContact CD1-CG 4.18Å; V165-Q169 WeakPolarHBondContact O-CB 3.23Å; V165-Q169 PolarHBondContact O-N 3.3Å; V166-Q169 PolarHBondContact O-N 3.45Å; Q169-R171 PolarHBondContact O-N 3.01Å; Q169-V172 PolarHBondContact O-N 3.06Å; Q169-Q173 VanDerWaalsContact NE2-NE2 3.2Å; Q169-Q173 WeakPolarHBondContact O-CB 3.2Å; Q169-Q173 WeakPolarHBondContact O-CG 3.36Å; Q169-Q173 PolarHBondContact O-N 3.06Å
170	S	96.8	Very high	95.5	Very high	67 Å²	67	45.8 Å²	45.8	47%	0.469	24%	0.237	S	C	.	.	H	α-helix	trans	-61.7	-41.8	178.5	-179.1	0	0	0	0	112.3	V166 M167 Q173 Q174	V166-S170 WeakPolarHBondContact O-CB 3.44Å; V166-S170 PolarHBondContact O-N 2.84Å; M167-S170 PolarHBondContact O-N 3.03Å; S170-Q173 PolarHBondContact O-N 3.1Å; S170-Q174 WeakPolarHBondContact O-CB 3.32Å; S170-Q174 PolarHBondContact O-N 2.75Å
171	R	95.8	Very high	94.8	Very high	79 Å²	79	50.6 Å²	50.6	30%	0.298	26%	0.26	S	S	.	.	H	α-helix	trans	-62	-43.3	173.8	-73.6	-57.4	-155.7	156.2	10.7	113	L140 T144 M167 A168 Q169 Q174 F175 E222	L140-R171 HydrophobicContact CD1-CB 3.71Å; L140-R171 HydrophobicContact CD1-CG 4.27Å; T144-R171 HydrophobicContact CG2-CG 4.31Å; M167-R171 WeakPolarHBondContact O-CG 3.33Å; M167-R171 PolarHBondContact O-N 2.8Å; A168-R171 PolarHBondContact O-N 3.28Å; Q169-R171 PolarHBondContact O-N 3.01Å; R171-Q174 WeakPolarHBondContact O-CB 3.39Å; R171-Q174 PolarHBondContact O-N 3.46Å; R171-F175 HydrophobicContact CB-CZ 4.44Å; R171-F175 WeakPolarHBondContact O-CD1 3.15Å; R171-F175 VanDerWaalsContact O-CG 3.26Å; R171-F175 WeakPolarHBondContact O-CG 3.5Å; R171-F175 PolarHBondContact O-N 2.89Å; R171-E222 IonicContact CZ-OE1 3.77Å; R171-E222 IonicContact NH1-OE1 2.62Å; R171-E222 PolarHBondContact NH1-OE1 3.09Å
172	V	96.6	Very high	94	Very high	0 Å²	0	52.2 Å²	52.2	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-64.3	-43.4	176.5	172.5	0	0	0	0	110.6	E119 F129 L140 L156 A168 Q169 Q174 F175 V176	E119-V172 HydrophobicContact CG-CB 4.29Å; E119-V172 HydrophobicContact CG-CG1 3.83Å; F129-V172 HydrophobicContact CE1-CG2 4.42Å; F129-V172 HydrophobicContact CZ-CG1 4.44Å; F129-V172 HydrophobicContact CZ-CG2 4.4Å; L140-V172 HydrophobicContact CD2-CG2 3.92Å; L156-V172 HydrophobicContact CD1-CB 4.39Å; L156-V172 HydrophobicContact CD1-CG1 3.99Å; L156-V172 HydrophobicContact CD1-CG2 3.5Å; L156-V172 VanDerWaalsContact CD1-CG2 3.5Å; A168-V172 VanDerWaalsContact O-CG2 3.29Å; A168-V172 WeakPolarHBondContact O-CG2 3.44Å; A168-V172 PolarHBondContact O-N 3.17Å; Q169-V172 PolarHBondContact O-N 3.06Å; V172-Q174 VanDerWaalsContact C-N 3.34Å; V172-Q174 PolarHBondContact O-N 2.86Å; V172-F175 WeakPolarHBondContact O-CB 2.98Å; V172-F175 PolarHBondContact O-N 3.09Å; V172-F175 VanDerWaalsContact O-N 3.16Å; V172-V176 WeakPolarHBondContact O-CG2 3.46Å; V172-V176 PolarHBondContact O-N 2.97Å
173	Q	95.9	Very high	92.7	Very high	85 Å²	85	55.5 Å²	55.5	40%	0.397	28%	0.275	S	S	.	.	H	α-helix	trans	-63.9	-37.3	176.1	-72.1	173	-4.2	0	0	112.5	E119 Q169 S170 V176 A177	E119-Q173 VanDerWaalsContact CD-NE2 3.35Å; E119-Q173 WeakPolarHBondContact OE1-CG 3.42Å; E119-Q173 PolarHBondContact OE1-NE2 2.82Å; E119-Q173 PolarHBondContact OE2-NE2 2.81Å; Q169-Q173 VanDerWaalsContact NE2-NE2 3.2Å; Q169-Q173 WeakPolarHBondContact O-CB 3.2Å; Q169-Q173 WeakPolarHBondContact O-CG 3.36Å; Q169-Q173 PolarHBondContact O-N 3.06Å; S170-Q173 PolarHBondContact O-N 3.1Å; Q173-V176 PolarHBondContact O-N 2.68Å; Q173-A177 WeakPolarHBondContact O-CB 3.41Å; Q173-A177 PolarHBondContact O-N 3.29Å
174	Q	95.1	Very high	91.5	Very high	64 Å²	64	54.5 Å²	54.5	30%	0.299	28%	0.282	S	S	.	.	H	α-helix	trans	-59.9	-45	171.4	-172.7	-166.7	-5.7	0	0	111.1	S170 R171 V172 V176 A177 L178 E222	S170-Q174 WeakPolarHBondContact O-CB 3.32Å; S170-Q174 PolarHBondContact O-N 2.75Å; R171-Q174 WeakPolarHBondContact O-CB 3.39Å; R171-Q174 PolarHBondContact O-N 3.46Å; V172-Q174 VanDerWaalsContact C-N 3.34Å; V172-Q174 PolarHBondContact O-N 2.86Å; Q174-V176 VanDerWaalsContact C-N 3.34Å; Q174-V176 PolarHBondContact O-N 2.84Å; Q174-A177 PolarHBondContact O-N 3.03Å; Q174-L178 HydrophobicContact CG-CD1 4.42Å; Q174-L178 WeakPolarHBondContact O-CG 3.29Å; Q174-L178 PolarHBondContact O-N 3.21Å; Q174-E222 PolarHBondContact NE2-OE1 3.13Å; Q174-E222 PolarHBondContact NE2-OE2 3.29Å; Q174-E222 VanDerWaalsContact NE2-OE2 3.12Å
175	F	95.5	Very high	90.8	Very high	1 Å²	1	55.6 Å²	55.6	0%	0.004	29%	0.287	C	S	.	.	H	α-helix	trans	-62.6	-41.3	175.6	-56.4	-20.6	0	0	0	111.8	M125 F129 L140 R171 V172 L178 F179 L219 E222 L226	M125-F175 HydrophobicContact CE-CB 3.61Å; F129-F175 HydrophobicContact CZ-CD2 4.39Å; L140-F175 HydrophobicContact CD1-CE2 4.4Å; R171-F175 HydrophobicContact CB-CZ 4.44Å; R171-F175 WeakPolarHBondContact O-CD1 3.15Å; R171-F175 VanDerWaalsContact O-CG 3.26Å; R171-F175 WeakPolarHBondContact O-CG 3.5Å; R171-F175 PolarHBondContact O-N 2.89Å; V172-F175 WeakPolarHBondContact O-CB 2.98Å; V172-F175 PolarHBondContact O-N 3.09Å; V172-F175 VanDerWaalsContact O-N 3.16Å; F175-L178 PolarHBondContact O-N 2.66Å; F175-F179 WeakPolarHBondContact O-CB 3.44Å; F175-F179 PolarHBondContact O-N 2.92Å; F175-L219 HydrophobicContact CB-CD1 3.77Å; F175-L219 HydrophobicContact CD1-CD1 4.17Å; F175-L219 HydrophobicContact CG-CD1 4.17Å; F175-E222 HydrophobicContact CD1-CG 4Å; F175-E222 HydrophobicContact CE1-CG 3.75Å; F175-L226 HydrophobicContact CE2-CD2 4.48Å; F175-L226 HydrophobicContact CZ-CD2 3.98Å
176	V	95.6	Very high	90.2	Very high	18 Å²	18	60 Å²	60	11%	0.109	32%	0.316	C	S	.	.	H	α-helix	trans	-66.1	-40.5	178.6	172.6	0	0	0	0	111.3	P122 M125 V172 Q173 Q174 F179 Q180	P122-V176 HydrophobicContact CG-CG1 4.37Å; M125-V176 HydrophobicContact CE-CG2 3.92Å; M125-V176 HydrophobicContact SD-CG2 4.05Å; V172-V176 WeakPolarHBondContact O-CG2 3.46Å; V172-V176 PolarHBondContact O-N 2.97Å; Q173-V176 PolarHBondContact O-N 2.68Å; Q174-V176 VanDerWaalsContact C-N 3.34Å; Q174-V176 PolarHBondContact O-N 2.84Å; V176-F179 PolarHBondContact O-N 3.41Å; V176-Q180 HydrophobicContact CG1-CG 4.46Å; V176-Q180 VanDerWaalsContact CG1-NE2 3.26Å; V176-Q180 WeakPolarHBondContact O-CG 3.45Å; V176-Q180 PolarHBondContact O-N 3.38Å
177	A	94.4	Very high	89.3	Confident	42 Å²	42	60.7 Å²	60.7	35%	0.347	32%	0.324	S	S	.	.	H	α-helix	trans	-62	-50.6	174.1	0	0	0	0	0	111.5	Q173 Q174 F179 Q180 E181	Q173-A177 WeakPolarHBondContact O-CB 3.41Å; Q173-A177 PolarHBondContact O-N 3.29Å; Q174-A177 PolarHBondContact O-N 3.03Å; A177-F179 PolarHBondContact O-N 2.94Å; A177-Q180 PolarHBondContact O-N 3.28Å; A177-Q180 VanDerWaalsContact O-N 3.13Å; A177-E181 WeakPolarHBondContact O-CB 3.06Å; A177-E181 WeakPolarHBondContact O-CG 3.37Å; A177-E181 PolarHBondContact O-N 3.11Å
178	L	92.9	Very high	88.5	Confident	31 Å²	31	62.5 Å²	62.5	16%	0.162	34%	0.335	C	S	.	.	H	α-helix	trans	-60.9	-29	177.3	-68.4	175	0	0	0	113.1	Q174 F175 A218 L219 E222	Q174-L178 HydrophobicContact CG-CD1 4.42Å; Q174-L178 WeakPolarHBondContact O-CG 3.29Å; Q174-L178 PolarHBondContact O-N 3.21Å; F175-L178 PolarHBondContact O-N 2.66Å; L178-A218 HydrophobicContact CD2-CB 4.18Å; L178-L219 HydrophobicContact CB-CB 4.13Å; L178-L219 HydrophobicContact CB-CD1 4.31Å; L178-E222 HydrophobicContact CD1-CB 3.68Å; L178-E222 HydrophobicContact CD1-CG 3.98Å
179	F	93.3	Very high	88.1	Confident	34 Å²	34	69 Å²	69	15%	0.149	36%	0.36	C	S	.	.	H	α-helix	trans	-71.6	-47.7	172.6	-171.4	-97.5	0	0	0	112.6	P122 D124 M125 F175 V176 A177 K182 L215 P216 L219	P122-F179 HydrophobicContact CB-CD1 4.18Å; P122-F179 HydrophobicContact CB-CE1 3.99Å; P122-F179 HydrophobicContact CG-CD1 4.03Å; P122-F179 HydrophobicContact CG-CE1 4.33Å; D124-F179 HydrophobicContact CB-CE1 4.43Å; D124-F179 HydrophobicContact CB-CE2 4.39Å; D124-F179 HydrophobicContact CB-CZ 3.69Å; M125-F179 HydrophobicContact CE-CB 4.35Å; M125-F179 HydrophobicContact CG-CB 4.14Å; M125-F179 HydrophobicContact CG-CD1 4.09Å; M125-F179 HydrophobicContact CG-CD2 3.48Å; M125-F179 VanDerWaalsContact CG-CD2 3.48Å; M125-F179 HydrophobicContact CG-CE1 4.38Å; M125-F179 HydrophobicContact CG-CE2 3.83Å; M125-F179 HydrophobicContact CG-CG 3.63Å; M125-F179 HydrophobicContact CG-CZ 4.27Å; M125-F179 HydrophobicContact SD-CB 3.41Å; M125-F179 WeakPolarHBondContact SD-CB 3.39Å; M125-F179 HydrophobicContact SD-CD1 3.92Å; M125-F179 HydrophobicContact SD-CD2 3.97Å; M125-F179 HydrophobicContact SD-CG 3.5Å; M125-F179 WeakPolarHBondContact SD-CG 3.31Å; F175-F179 WeakPolarHBondContact O-CB 3.44Å; F175-F179 PolarHBondContact O-N 2.92Å; V176-F179 PolarHBondContact O-N 3.41Å; A177-F179 PolarHBondContact O-N 2.94Å; F179-K182 WeakPolarHBondContact O-CG 3.38Å; F179-L215 HydrophobicContact CD2-CD2 4.09Å; F179-L215 HydrophobicContact CE2-CD2 3.83Å; F179-P216 HydrophobicContact CD2-CG 4.11Å; F179-L219 HydrophobicContact CB-CD2 4Å; F179-L219 HydrophobicContact CD2-CD2 3.88Å; F179-L219 HydrophobicContact CG-CD2 4.44Å
180	Q	89.4	Confident	87.9	Confident	84 Å²	84	69.2 Å²	69.2	39%	0.393	36%	0.361	S	S	.	.	H	α-helix	trans	-71.8	-42.1	-176.6	-71.1	-177	29.4	0	0	113.2	V176 A177 K182	V176-Q180 HydrophobicContact CG1-CG 4.46Å; V176-Q180 VanDerWaalsContact CG1-NE2 3.26Å; V176-Q180 WeakPolarHBondContact O-CG 3.45Å; V176-Q180 PolarHBondContact O-N 3.38Å; A177-Q180 PolarHBondContact O-N 3.28Å; A177-Q180 VanDerWaalsContact O-N 3.13Å; Q180-K182 PolarHBondContact O-N 3.05Å
181	E	83.1	Confident	87.6	Confident	100 Å²	100	68.7 Å²	68.7	47%	0.467	36%	0.357	S	S	.	.	S	Bend	trans	-69.3	-20.6	-177.6	-67.6	-175.1	121.5	0	0	113.1	A177 K183	A177-E181 WeakPolarHBondContact O-CB 3.06Å; A177-E181 WeakPolarHBondContact O-CG 3.37Å; A177-E181 PolarHBondContact O-N 3.11Å; E181-K183 HydrophobicContact CB-CD 4.29Å; E181-K183 HydrophobicContact CB-CG 4.1Å; E181-K183 VanDerWaalsContact CD-CE 3.43Å; E181-K183 PolarHBondContact O-N 3.41Å; E181-K183 VanDerWaalsContact OE1-CE 3.29Å; E181-K183 WeakPolarHBondContact OE1-CE 3.45Å; E181-K183 IonicContact OE1-NZ 3.3Å; E181-K183 PolarHBondContact OE1-NZ 3.01Å; E181-K183 WeakPolarHBondContact OE2-CD 3.43Å; E181-K183 VanDerWaalsContact OE2-CE 3.23Å; E181-K183 WeakPolarHBondContact OE2-CE 3.22Å; E181-K183 IonicContact OE2-NZ 3.59Å; E181-K183 PolarHBondContact OE2-NZ 2.89Å
182	K	76.9	Confident	87.4	Confident	114 Å²	114	67.1 Å²	67.1	50%	0.496	36%	0.361	S	S	.	.			trans	50.3	25.5	-179.8	-59.7	179.3	-173.2	178.7	0	114.9	F179 Q180 S184 C787	F179-K182 WeakPolarHBondContact O-CG 3.38Å; Q180-K182 PolarHBondContact O-N 3.05Å; K182-S184 PolarHBondContact O-N 3.33Å; K182-S184 VanDerWaalsContact O-N 3.12Å; K182-C787 PolarHBondContact NZ-O 3.45Å
183	K	67.6	Low	87.3	Confident	112 Å²	112	67.6 Å²	67.6	49%	0.487	36%	0.364	S	S	.	.	P	Polyproline II helix	trans	-52.2	117.8	-178.3	-78	169.6	-179.6	158.6	0	110.7	E181	E181-K183 HydrophobicContact CB-CD 4.29Å; E181-K183 HydrophobicContact CB-CG 4.1Å; E181-K183 VanDerWaalsContact CD-CE 3.43Å; E181-K183 PolarHBondContact O-N 3.41Å; E181-K183 VanDerWaalsContact OE1-CE 3.29Å; E181-K183 WeakPolarHBondContact OE1-CE 3.45Å; E181-K183 IonicContact OE1-NZ 3.3Å; E181-K183 PolarHBondContact OE1-NZ 3.01Å; E181-K183 WeakPolarHBondContact OE2-CD 3.43Å; E181-K183 VanDerWaalsContact OE2-CE 3.23Å; E181-K183 WeakPolarHBondContact OE2-CE 3.22Å; E181-K183 IonicContact OE2-NZ 3.59Å; E181-K183 PolarHBondContact OE2-NZ 2.89Å
184	S	71.4	Confident	87.3	Confident	99 Å²	99	67.8 Å²	67.8	69%	0.692	36%	0.363	S	S	*	.	P	Polyproline II helix	trans	-71.2	135.1	169.2	42.1	0	0	0	0	109.5	K182	K182-S184 PolarHBondContact O-N 3.33Å; K182-S184 VanDerWaalsContact O-N 3.12Å
185	L	81.5	Confident	87.2	Confident	26 Å²	26	72.6 Å²	72.6	14%	0.136	38%	0.379	C	S	.	.	P	Polyproline II helix	trans	-76.8	157	166	-59.9	172.3	0	0	0	108.7	S187 E190 V193 A218 E221	L185-S187 PolarHBondContact O-N 2.83Å; L185-E190 HydrophobicContact CB-CB 3.92Å; L185-E190 HydrophobicContact CB-CG 4.03Å; L185-V193 HydrophobicContact CD1-CB 4.25Å; L185-V193 HydrophobicContact CD1-CG1 4.36Å; L185-V193 HydrophobicContact CD1-CG2 3.92Å; L185-A218 HydrophobicContact CD2-CB 4.21Å; L185-A218 HydrophobicContact CG-CB 4.44Å; L185-E221 HydrophobicContact CD1-CB 4.15Å; L185-E221 WeakPolarHBondContact CD1-OE2 3.44Å; L185-E221 WeakPolarHBondContact CD2-OE2 3.25Å
186	P	84.6	Confident	87.2	Confident	92 Å²	92	74.8 Å²	74.8	60%	0.597	40%	0.397	S	S	*	.	P	Polyproline II helix	trans	-52.8	134.8	170.4	-25.7	35	0	0	0	111	D188 R189 E190	P186-D188 VanDerWaalsContact C-N 3.27Å; P186-D188 PolarHBondContact O-N 3.24Å; P186-R189 WeakPolarHBondContact O-CB 3.43Å; P186-R189 PolarHBondContact O-N 3.4Å; P186-E190 PolarHBondContact O-N 2.78Å
187	S	78.6	Confident	87.2	Confident	91 Å²	91	74 Å²	74	64%	0.636	39%	0.392	S	S	*	.	H	α-helix	trans	-40.9	-49.2	-168.1	177.1	0	0	0	0	114.5	L185 E190 S191	L185-S187 PolarHBondContact O-N 2.83Å; S187-E190 PolarHBondContact O-N 2.85Å; S187-S191 PolarHBondContact O-N 2.8Å
188	D	80.8	Confident	87.3	Confident	137 Å²	137	76.5 Å²	76.5	73%	0.733	40%	0.395	S	S	*	.	H	α-helix	trans	-63.2	-48.4	-176.5	-52.7	-33.7	0	0	0	111.7	P186 S191 A192	P186-D188 VanDerWaalsContact C-N 3.27Å; P186-D188 PolarHBondContact O-N 3.24Å; D188-S191 PolarHBondContact O-N 3.22Å; D188-S191 PolarHBondContact O-OG 3.41Å; D188-A192 PolarHBondContact O-N 3.39Å
189	R	88.3	Confident	87.4	Confident	138 Å²	138	78.7 Å²	78.7	52%	0.521	41%	0.413	S	S	.	.	H	α-helix	trans	-65	-41.3	175.8	-175.4	177.1	-179.5	168.9	0	111.2	P186 S191 A192 V193 E221	P186-R189 WeakPolarHBondContact O-CB 3.43Å; P186-R189 PolarHBondContact O-N 3.4Å; R189-S191 VanDerWaalsContact C-N 3.32Å; R189-S191 PolarHBondContact O-N 2.7Å; R189-A192 PolarHBondContact O-N 3.18Å; R189-V193 HydrophobicContact CG-CG2 4.49Å; R189-V193 WeakPolarHBondContact O-CG2 3.36Å; R189-V193 PolarHBondContact O-N 3Å; R189-E221 IonicContact CZ-OE1 2.64Å; R189-E221 IonicContact CZ-OE2 2.96Å; R189-E221 IonicContact NE-OE1 3.32Å; R189-E221 PolarHBondContact NE-OE1 2.86Å; R189-E221 IonicContact NE-OE2 2.78Å; R189-E221 PolarHBondContact NE-OE2 2.91Å; R189-E221 IonicContact NH2-OE1 3.7Å; R189-E221 PolarHBondContact NH2-OE1 3.24Å; R189-E221 IonicContact NH2-OE2 3.18Å; R189-E221 PolarHBondContact NH2-OE2 3.19Å
190	E	91.7	Very high	87.4	Confident	40 Å²	40	78.1 Å²	78.1	19%	0.187	41%	0.411	C	S	.	.	H	α-helix	trans	-60.7	-41.6	178.5	-152.6	-152.1	-167.2	0	0	111.8	L185 P186 S187 A192 V193 K194 S217	L185-E190 HydrophobicContact CB-CB 3.92Å; L185-E190 HydrophobicContact CB-CG 4.03Å; P186-E190 PolarHBondContact O-N 2.78Å; S187-E190 PolarHBondContact O-N 2.85Å; E190-A192 VanDerWaalsContact C-N 3.33Å; E190-A192 PolarHBondContact O-N 3.12Å; E190-V193 PolarHBondContact O-N 3.44Å; E190-K194 HydrophobicContact CG-CD 4.38Å; E190-K194 WeakPolarHBondContact O-CB 3.43Å; E190-K194 VanDerWaalsContact O-CG 3.29Å; E190-K194 WeakPolarHBondContact O-CG 3.38Å; E190-K194 PolarHBondContact O-N 3.07Å; E190-K194 WeakPolarHBondContact OE1-CE 3.44Å; E190-K194 IonicContact OE1-NZ 3.19Å; E190-K194 PolarHBondContact OE1-NZ 3.3Å; E190-K194 WeakPolarHBondContact OE2-CE 3.4Å; E190-K194 IonicContact OE2-NZ 3.76Å; E190-K194 PolarHBondContact OE2-NZ 3.29Å; E190-S217 VanDerWaalsContact CG-CB 3.4Å; E190-S217 WeakPolarHBondContact CG-OG 3.15Å; E190-S217 WeakPolarHBondContact OE1-CB 3.22Å; E190-S217 PolarHBondContact OE1-OG 2.98Å
191	S	90.6	Very high	87.6	Confident	55 Å²	55	74.1 Å²	74.1	39%	0.385	39%	0.392	S	S	.	.	H	α-helix	trans	-64	-37.1	177	84.6	0	0	0	0	112.5	S187 D188 R189 R195	S187-S191 PolarHBondContact O-N 2.8Å; D188-S191 PolarHBondContact O-N 3.22Å; D188-S191 PolarHBondContact O-OG 3.41Å; R189-S191 VanDerWaalsContact C-N 3.32Å; R189-S191 PolarHBondContact O-N 2.7Å; S191-R195 WeakPolarHBondContact O-CB 3.28Å; S191-R195 PolarHBondContact O-N 3.13Å; S191-R195 VanDerWaalsContact O-N 3.12Å
192	A	92.7	Very high	88.1	Confident	46 Å²	46	74.1 Å²	74.1	38%	0.38	39%	0.392	S	S	.	.	H	α-helix	trans	-70	-47.6	177.8	0	0	0	0	0	111.4	D188 R189 E190 R195 A196	D188-A192 PolarHBondContact O-N 3.39Å; R189-A192 PolarHBondContact O-N 3.18Å; E190-A192 VanDerWaalsContact C-N 3.33Å; E190-A192 PolarHBondContact O-N 3.12Å; A192-R195 PolarHBondContact O-N 3.48Å; A192-A196 WeakPolarHBondContact O-CB 3.43Å; A192-A196 PolarHBondContact O-N 3.05Å
193	V	94.4	Very high	88.8	Confident	10 Å²	10	74.8 Å²	74.8	6%	0.061	40%	0.397	C	S	.	.	H	α-helix	trans	-59.9	-47.1	175.9	169.8	0	0	0	0	111.1	L185 R189 E190 R195 A196 F197 S217 K220 E221 L224	L185-V193 HydrophobicContact CD1-CB 4.25Å; L185-V193 HydrophobicContact CD1-CG1 4.36Å; L185-V193 HydrophobicContact CD1-CG2 3.92Å; R189-V193 HydrophobicContact CG-CG2 4.49Å; R189-V193 WeakPolarHBondContact O-CG2 3.36Å; R189-V193 PolarHBondContact O-N 3Å; E190-V193 PolarHBondContact O-N 3.44Å; V193-R195 VanDerWaalsContact C-N 3.31Å; V193-R195 PolarHBondContact O-N 3.28Å; V193-A196 PolarHBondContact O-N 3.23Å; V193-F197 VanDerWaalsContact O-CB 3.27Å; V193-F197 WeakPolarHBondContact O-CB 3.49Å; V193-F197 PolarHBondContact O-N 3.08Å; V193-S217 WeakPolarHBondContact CG1-O 3.37Å; V193-K220 HydrophobicContact CG1-CB 3.91Å; V193-E221 HydrophobicContact CG1-CB 3.93Å; V193-E221 HydrophobicContact CG2-CB 4.05Å; V193-E221 HydrophobicContact CG2-CG 4.07Å; V193-L224 HydrophobicContact CG1-CD1 4.35Å
194	K	94.1	Very high	89.8	Confident	89 Å²	89	71.6 Å²	71.6	39%	0.387	38%	0.382	S	S	.	.	H	α-helix	trans	-57	-42.9	176.1	-77.7	172.6	178.2	169.6	0	111.9	E190 K198 S217	E190-K194 HydrophobicContact CG-CD 4.38Å; E190-K194 WeakPolarHBondContact O-CB 3.43Å; E190-K194 VanDerWaalsContact O-CG 3.29Å; E190-K194 WeakPolarHBondContact O-CG 3.38Å; E190-K194 PolarHBondContact O-N 3.07Å; E190-K194 WeakPolarHBondContact OE1-CE 3.44Å; E190-K194 IonicContact OE1-NZ 3.19Å; E190-K194 PolarHBondContact OE1-NZ 3.3Å; E190-K194 WeakPolarHBondContact OE2-CE 3.4Å; E190-K194 IonicContact OE2-NZ 3.76Å; E190-K194 PolarHBondContact OE2-NZ 3.29Å; K194-K198 WeakPolarHBondContact O-CB 3.31Å; K194-K198 PolarHBondContact O-N 2.98Å; K194-S217 WeakPolarHBondContact CE-OG 3.22Å
195	R	94.8	Very high	90.7	Very high	165 Å²	165	71.4 Å²	71.4	62%	0.623	37%	0.373	S	S	*	.	H	α-helix	trans	-67.9	-46.6	178.5	-168.9	-173.7	-59	105.4	3.2	112.3	S191 A192 V193 K198 S199	S191-R195 WeakPolarHBondContact O-CB 3.28Å; S191-R195 PolarHBondContact O-N 3.13Å; S191-R195 VanDerWaalsContact O-N 3.12Å; A192-R195 PolarHBondContact O-N 3.48Å; V193-R195 VanDerWaalsContact C-N 3.31Å; V193-R195 PolarHBondContact O-N 3.28Å; R195-K198 PolarHBondContact O-N 3.24Å; R195-S199 PolarHBondContact O-N 3.37Å
196	A	94.4	Very high	91.3	Very high	48 Å²	48	72.2 Å²	72.2	40%	0.397	38%	0.378	S	S	.	.	H	α-helix	trans	-65	-48.3	-179.8	0	0	0	0	0	111.8	A192 V193 K198 S199 F200 L224	A192-A196 WeakPolarHBondContact O-CB 3.43Å; A192-A196 PolarHBondContact O-N 3.05Å; V193-A196 PolarHBondContact O-N 3.23Å; A196-K198 VanDerWaalsContact C-N 3.34Å; A196-K198 PolarHBondContact O-N 2.89Å; A196-S199 PolarHBondContact O-N 3.31Å; A196-F200 WeakPolarHBondContact O-CB 3.47Å; A196-F200 PolarHBondContact O-N 3.35Å; A196-L224 HydrophobicContact CB-CD1 3.94Å
197	F	96	Very high	91.7	Very high	0 Å²	0	76 Å²	76	0%	0	38%	0.384	C	S	.	.	H	α-helix	trans	-62.3	-41.5	176.8	-173.2	-85.2	0	0	0	111.5	F136 V193 F200 V201 L212 L213 L215 K220 L223 L224	F136-F197 AromaticContact CZ-CE2 3.88Å; F136-F197 HydrophobicContact CZ-CE2 3.88Å; F136-F197 HydrophobicContact CZ-CZ 4.26Å; V193-F197 VanDerWaalsContact O-CB 3.27Å; V193-F197 WeakPolarHBondContact O-CB 3.49Å; V193-F197 PolarHBondContact O-N 3.08Å; F197-F200 PolarHBondContact O-N 3.16Å; F197-V201 HydrophobicContact CD1-CG2 4.01Å; F197-V201 HydrophobicContact CE1-CG2 3.59Å; F197-V201 HydrophobicContact CE2-CG2 4.43Å; F197-V201 HydrophobicContact CZ-CG2 3.83Å; F197-V201 WeakPolarHBondContact O-CG2 3.48Å; F197-V201 PolarHBondContact O-N 2.82Å; F197-L212 HydrophobicContact CE1-CB 4.05Å; F197-L212 VanDerWaalsContact CE1-O 3.24Å; F197-L212 WeakPolarHBondContact CE1-O 3.36Å; F197-L212 HydrophobicContact CZ-CB 4.18Å; F197-L212 HydrophobicContact CZ-CD2 4.24Å; F197-L213 HydrophobicContact CD1-CD2 4.39Å; F197-L215 HydrophobicContact CZ-CD1 4.49Å; F197-K220 HydrophobicContact CB-CB 4.09Å; F197-K220 HydrophobicContact CB-CD 4.28Å; F197-K220 HydrophobicContact CB-CG 4.34Å; F197-K220 HydrophobicContact CD1-CB 4.39Å; F197-K220 HydrophobicContact CD1-CD 3.73Å; F197-K220 HydrophobicContact CD1-CG 3.76Å; F197-K220 HydrophobicContact CD2-CB 3.66Å; F197-K220 HydrophobicContact CD2-CD 4.49Å; F197-K220 HydrophobicContact CD2-CG 3.75Å; F197-K220 HydrophobicContact CE1-CD 4.17Å; F197-K220 HydrophobicContact CE1-CG 3.92Å; F197-K220 HydrophobicContact CE2-CB 4.16Å; F197-K220 HydrophobicContact CE2-CG 3.91Å; F197-K220 HydrophobicContact CG-CB 3.78Å; F197-K220 HydrophobicContact CG-CD 3.91Å; F197-K220 HydrophobicContact CG-CG 3.67Å; F197-K220 HydrophobicContact CZ-CG 3.99Å; F197-L223 HydrophobicContact CE2-CB 4.01Å; F197-L223 HydrophobicContact CE2-CD1 4.03Å; F197-L223 HydrophobicContact CZ-CD1 4.39Å; F197-L224 HydrophobicContact CB-CD1 4.1Å; F197-L224 HydrophobicContact CB-CG 4.37Å; F197-L224 HydrophobicContact CD2-CG 4.2Å
198	K	95.8	Very high	92.5	Very high	95 Å²	95	73.1 Å²	73.1	41%	0.413	36%	0.36	S	S	.	.	H	α-helix	trans	-58.4	-51.9	175.3	176.8	172.4	174.4	173.3	0	111.5	K194 R195 A196 F200 V201 E202 L213	K194-K198 WeakPolarHBondContact O-CB 3.31Å; K194-K198 PolarHBondContact O-N 2.98Å; R195-K198 PolarHBondContact O-N 3.24Å; A196-K198 VanDerWaalsContact C-N 3.34Å; A196-K198 PolarHBondContact O-N 2.89Å; K198-F200 VanDerWaalsContact C-N 3.29Å; K198-F200 PolarHBondContact O-N 3.48Å; K198-V201 PolarHBondContact O-N 2.97Å; K198-E202 WeakPolarHBondContact CE-OE1 3.35Å; K198-E202 WeakPolarHBondContact CE-OE2 3.31Å; K198-E202 HydrophobicContact CG-CG 4.29Å; K198-E202 WeakPolarHBondContact CG-OE2 3.3Å; K198-E202 IonicContact NZ-OE1 3.39Å; K198-E202 PolarHBondContact NZ-OE1 3.19Å; K198-E202 IonicContact NZ-OE2 2.88Å; K198-E202 WeakPolarHBondContact O-CB 3.45Å; K198-E202 WeakPolarHBondContact O-CG 3.28Å; K198-E202 PolarHBondContact O-N 3.13Å; K198-L213 HydrophobicContact CB-CD2 3.89Å; K198-L213 HydrophobicContact CG-CD2 3.98Å
199	S	94.9	Very high	93.2	Very high	77 Å²	77	67.2 Å²	67.2	54%	0.538	33%	0.329	S	S	.	.	H	α-helix	trans	-61	-37.1	178.4	-168.1	0	0	0	0	112.7	R195 A196 E203	R195-S199 PolarHBondContact O-N 3.37Å; A196-S199 PolarHBondContact O-N 3.31Å; S199-E203 PolarHBondContact O-N 2.81Å
200	F	94.5	Very high	93.5	Very high	23 Å²	23	66.4 Å²	66.4	10%	0.101	33%	0.333	C	S	.	.	H	α-helix	trans	-65.9	-40	178.6	176.4	-97	0	0	0	112.7	F136 A196 F197 K198 R204 L224 V227	F136-F200 HydrophobicContact CE1-CD1 4.44Å; F136-F200 AromaticContact CE1-CE1 3.83Å; F136-F200 HydrophobicContact CE1-CE1 3.83Å; F136-F200 HydrophobicContact CE2-CE1 4.4Å; F136-F200 HydrophobicContact CZ-CD1 4.02Å; F136-F200 AromaticContact CZ-CE1 3.61Å; F136-F200 HydrophobicContact CZ-CE1 3.61Å; A196-F200 WeakPolarHBondContact O-CB 3.47Å; A196-F200 PolarHBondContact O-N 3.35Å; F197-F200 PolarHBondContact O-N 3.16Å; K198-F200 VanDerWaalsContact C-N 3.29Å; K198-F200 PolarHBondContact O-N 3.48Å; F200-R204 VanDerWaalsContact CE2-CZ 3.41Å; F200-R204 WeakPolarHBondContact O-CD 3.37Å; F200-R204 PolarHBondContact O-NH1 3.33Å; F200-L224 HydrophobicContact CB-CD2 4.35Å; F200-V227 HydrophobicContact CE1-CG2 4.19Å; F200-V227 HydrophobicContact CE2-CG1 3.64Å; F200-V227 HydrophobicContact CZ-CB 4.38Å; F200-V227 HydrophobicContact CZ-CG1 3.77Å; F200-V227 HydrophobicContact CZ-CG2 3.85Å
201	V	93.8	Very high	93.6	Very high	0 Å²	0	68.7 Å²	68.7	0%	0	34%	0.343	C	S	.	.	H	α-helix	trans	-81.1	-35.1	-179.1	177.5	0	0	0	0	111.9	F197 K198 E203 R204 D205 T209 L212	F197-V201 HydrophobicContact CD1-CG2 4.01Å; F197-V201 HydrophobicContact CE1-CG2 3.59Å; F197-V201 HydrophobicContact CE2-CG2 4.43Å; F197-V201 HydrophobicContact CZ-CG2 3.83Å; F197-V201 WeakPolarHBondContact O-CG2 3.48Å; F197-V201 PolarHBondContact O-N 2.82Å; K198-V201 PolarHBondContact O-N 2.97Å; V201-E203 VanDerWaalsContact C-N 3.31Å; V201-E203 PolarHBondContact O-N 2.85Å; V201-R204 CarbonylContact O-C 3.55Å; V201-R204 WeakPolarHBondContact O-CA 3.36Å; V201-R204 PolarHBondContact O-N 3.03Å; V201-D205 PolarHBondContact O-N 2.82Å; V201-T209 HydrophobicContact CG1-CG2 3.92Å; V201-L212 HydrophobicContact CG1-CB 4.11Å; V201-L212 HydrophobicContact CG1-CD1 3.73Å; V201-L212 HydrophobicContact CG2-CB 4.41Å; V201-L212 HydrophobicContact CG2-CD1 4.18Å
202	E	92.3	Very high	93.9	Very high	99 Å²	99	66 Å²	66	46%	0.463	33%	0.325	S	S	.	.	H	α-helix	trans	-66.3	-28.3	175.5	-75.6	-178.9	145.4	0	0	113.3	K198 R204	K198-E202 WeakPolarHBondContact CE-OE1 3.35Å; K198-E202 WeakPolarHBondContact CE-OE2 3.31Å; K198-E202 HydrophobicContact CG-CG 4.29Å; K198-E202 WeakPolarHBondContact CG-OE2 3.3Å; K198-E202 IonicContact NZ-OE1 3.39Å; K198-E202 PolarHBondContact NZ-OE1 3.19Å; K198-E202 IonicContact NZ-OE2 2.88Å; K198-E202 WeakPolarHBondContact O-CB 3.45Å; K198-E202 WeakPolarHBondContact O-CG 3.28Å; K198-E202 PolarHBondContact O-N 3.13Å; E202-R204 PolarHBondContact O-N 2.85Å
203	E	91.8	Very high	94	Very high	128 Å²	128	66 Å²	66	60%	0.598	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.6	-17	170.2	-163.5	-158.4	138.5	0	0	112.7	S199 V201	S199-E203 PolarHBondContact O-N 2.81Å; V201-E203 VanDerWaalsContact C-N 3.31Å; V201-E203 PolarHBondContact O-N 2.85Å
204	R	88.6	Confident	94	Very high	45 Å²	45	72.6 Å²	72.6	17%	0.17	35%	0.352	C	S	.	.	T	Hydrogen-bonded Turn	trans	-127.1	35	-169.7	-68.2	165.1	-176.5	73.7	20.4	111.1	L135 F200 V201 E202 D206	L135-R204 HydrophobicContact CD1-CG 4.26Å; F200-R204 VanDerWaalsContact CE2-CZ 3.41Å; F200-R204 WeakPolarHBondContact O-CD 3.37Å; F200-R204 PolarHBondContact O-NH1 3.33Å; V201-R204 CarbonylContact O-C 3.55Å; V201-R204 WeakPolarHBondContact O-CA 3.36Å; V201-R204 PolarHBondContact O-N 3.03Å; E202-R204 PolarHBondContact O-N 2.85Å; R204-D206 PolarHBondContact O-N 2.9Å
205	D	90.3	Very high	94	Very high	96 Å²	96	68.7 Å²	68.7	51%	0.513	34%	0.335	S	S	.	.			trans	-55.3	137.4	-171.2	76.5	-57	0	0	0	112.6	R133 V201	R133-D205 IonicContact CZ-OD1 2.67Å; R133-D205 PolarHBondContact NE-O 3.07Å; R133-D205 VanDerWaalsContact NE-O 3.08Å; R133-D205 PolarHBondContact NH2-O 3.43Å; R133-D205 IonicContact NH2-OD1 3.65Å; R133-D205 PolarHBondContact NH2-OD1 2.68Å; V201-D205 PolarHBondContact O-N 2.82Å
206	D	94.1	Very high	94	Very high	43 Å²	43	62 Å²	62	23%	0.23	31%	0.313	C	S	.	.			trans	-155.4	-175.2	170.7	65.7	43.3	0	0	0	110.9	G131 A132 R133 R204 Y208 T209	G131-D206 VanDerWaalsContact C-OD2 3.28Å; G131-D206 WeakPolarHBondContact CA-OD2 3.42Å; A132-D206 WeakPolarHBondContact CA-OD2 3.42Å; A132-D206 PolarHBondContact N-OD2 3.18Å; R133-D206 PolarHBondContact N-OD2 3.04Å; R204-D206 PolarHBondContact O-N 2.9Å; D206-Y208 PolarHBondContact O-N 3.02Å; D206-Y208 VanDerWaalsContact O-N 3.12Å; D206-Y208 WeakPolarHBondContact OD1-CA 3.45Å; D206-Y208 WeakPolarHBondContact OD1-CB 3.44Å; D206-Y208 PolarHBondContact OD1-N 3.01Å; D206-T209 PolarHBondContact N-OG1 3.41Å; D206-T209 WeakPolarHBondContact O-CB 3.24Å; D206-T209 PolarHBondContact O-N 2.9Å; D206-T209 VanDerWaalsContact O-N 3.16Å; D206-T209 PolarHBondContact O-OG1 2.91Å
207	K	94.6	Very high	94	Very high	170 Å²	170	60.2 Å²	60.2	74%	0.739	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.5	-18.5	-177.9	68.2	-177.9	-172.9	174.7	0	114.9
208	Y	94.9	Very high	93.8	Very high	31 Å²	31	60.7 Å²	60.7	12%	0.122	30%	0.302	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.2	-2	-179.6	-58.9	-77.2	0	0	0	113.4	H126 C127 A130 D206 M210 E211 L212	H126-Y208 AromaticContact CD2-CE1 3.7Å; H126-Y208 AromaticContact CD2-CZ 3.93Å; H126-Y208 AromaticContact NE2-CZ 3.89Å; H126-Y208 PolarHBondContact NE2-OH 3.49Å; C127-Y208 HydrophobicContact CB-CD1 4.19Å; C127-Y208 HydrophobicContact CB-CG 4.38Å; A130-Y208 HydrophobicContact CB-CD2 4.16Å; A130-Y208 HydrophobicContact CB-CE1 4.3Å; A130-Y208 HydrophobicContact CB-CE2 3.38Å; A130-Y208 VanDerWaalsContact CB-CZ 3.46Å; A130-Y208 WeakPolarHBondContact CB-OH 3.43Å; A130-Y208 VanDerWaalsContact O-CD2 3.31Å; A130-Y208 WeakPolarHBondContact O-CD2 3.46Å; A130-Y208 WeakPolarHBondContact O-CE2 3.42Å; D206-Y208 PolarHBondContact O-N 3.02Å; D206-Y208 VanDerWaalsContact O-N 3.12Å; D206-Y208 WeakPolarHBondContact OD1-CA 3.45Å; D206-Y208 WeakPolarHBondContact OD1-CB 3.44Å; D206-Y208 PolarHBondContact OD1-N 3.01Å; Y208-M210 VanDerWaalsContact C-N 3.25Å; Y208-M210 PolarHBondContact O-N 2.93Å; Y208-M210 VanDerWaalsContact O-N 3.13Å; Y208-E211 WeakPolarHBondContact CD1-OE2 3.07Å; Y208-E211 PolarHBondContact O-N 3.43Å; Y208-L212 PolarHBondContact O-N 3.08Å
209	T	94.8	Very high	93.8	Very high	14 Å²	14	56.2 Å²	56.2	9%	0.086	28%	0.283	C	S	.	.	H	α-helix	trans	-45	-47.3	179.8	-55.3	0	0	0	0	112.5	V201 D206 L213	V201-T209 HydrophobicContact CG1-CG2 3.92Å; D206-T209 PolarHBondContact N-OG1 3.41Å; D206-T209 WeakPolarHBondContact O-CB 3.24Å; D206-T209 PolarHBondContact O-N 2.9Å; D206-T209 VanDerWaalsContact O-N 3.16Å; D206-T209 PolarHBondContact O-OG1 2.91Å; T209-L213 HydrophobicContact CG2-CD1 4.43Å; T209-L213 VanDerWaalsContact O-CG 3.3Å; T209-L213 WeakPolarHBondContact O-CG 3.5Å; T209-L213 PolarHBondContact O-N 3.45Å
210	M	94.9	Very high	93.8	Very high	121 Å²	121	53.2 Å²	53.2	60%	0.596	26%	0.26	S	S	*	.	H	α-helix	trans	-68.8	-38.8	-177.8	-63.5	-61.9	101.2	0	0	112.8	Y208 L213 L214	Y208-M210 VanDerWaalsContact C-N 3.25Å; Y208-M210 PolarHBondContact O-N 2.93Å; Y208-M210 VanDerWaalsContact O-N 3.13Å; M210-L213 HydrophobicContact CE-CD1 3.82Å; M210-L213 PolarHBondContact O-N 2.96Å; M210-L214 WeakPolarHBondContact O-CG 3.47Å; M210-L214 PolarHBondContact O-N 3.45Å; M210-L214 VanDerWaalsContact O-N 3.13Å
211	E	94.3	Very high	93.7	Very high	87 Å²	87	54.5 Å²	54.5	41%	0.407	27%	0.266	S	S	.	.	H	α-helix	trans	-65.9	-44.4	177.1	-65.2	173.1	-163.2	0	0	110.7	C127 Y208 L213 L214 L215	C127-E211 HydrophobicContact CB-CB 3.5Å; C127-E211 WeakPolarHBondContact CB-OE2 3.31Å; Y208-E211 WeakPolarHBondContact CD1-OE2 3.07Å; Y208-E211 PolarHBondContact O-N 3.43Å; E211-L213 VanDerWaalsContact C-N 3.31Å; E211-L213 PolarHBondContact O-N 3.32Å; E211-L214 WeakPolarHBondContact O-CB 3.34Å; E211-L214 PolarHBondContact O-N 3.1Å; E211-L215 PolarHBondContact O-N 3.28Å
212	L	95.4	Very high	93.8	Very high	0 Å²	0	56.8 Å²	56.8	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-56	-44.5	171.6	-73.6	171.9	0	0	0	111.7	C127 I128 A132 F136 F197 V201 Y208 L214 L215 K220	C127-L212 HydrophobicContact CB-CD2 4.17Å; C127-L212 HydrophobicContact CB-CG 4.07Å; C127-L212 WeakPolarHBondContact O-CD2 3.37Å; I128-L212 HydrophobicContact CG1-CD2 4.48Å; A132-L212 HydrophobicContact CB-CD1 4.14Å; F136-L212 HydrophobicContact CD2-CD2 4.47Å; F136-L212 HydrophobicContact CE2-CD1 4.34Å; F136-L212 HydrophobicContact CE2-CD2 3.97Å; F197-L212 HydrophobicContact CE1-CB 4.05Å; F197-L212 VanDerWaalsContact CE1-O 3.24Å; F197-L212 WeakPolarHBondContact CE1-O 3.36Å; F197-L212 HydrophobicContact CZ-CB 4.18Å; F197-L212 HydrophobicContact CZ-CD2 4.24Å; V201-L212 HydrophobicContact CG1-CB 4.11Å; V201-L212 HydrophobicContact CG1-CD1 3.73Å; V201-L212 HydrophobicContact CG2-CB 4.41Å; V201-L212 HydrophobicContact CG2-CD1 4.18Å; Y208-L212 PolarHBondContact O-N 3.08Å; L212-L214 PolarHBondContact O-N 3.11Å; L212-L215 HydrophobicContact CD2-CD1 3.98Å; L212-L215 WeakPolarHBondContact O-CB 3.31Å; L212-L215 WeakPolarHBondContact O-CG 3.47Å; L212-L215 PolarHBondContact O-N 2.95Å; L212-K220 WeakPolarHBondContact O-CE 3.47Å
213	L	95	Very high	93.9	Very high	44 Å²	44	52 Å²	52	23%	0.23	26%	0.255	C	S	.	.	H	α-helix	trans	-67.8	-15.4	177.1	-68.9	-176.7	0	0	0	113.8	F197 K198 T209 M210 E211 K220	F197-L213 HydrophobicContact CD1-CD2 4.39Å; K198-L213 HydrophobicContact CB-CD2 3.89Å; K198-L213 HydrophobicContact CG-CD2 3.98Å; T209-L213 HydrophobicContact CG2-CD1 4.43Å; T209-L213 VanDerWaalsContact O-CG 3.3Å; T209-L213 WeakPolarHBondContact O-CG 3.5Å; T209-L213 PolarHBondContact O-N 3.45Å; M210-L213 HydrophobicContact CE-CD1 3.82Å; M210-L213 PolarHBondContact O-N 2.96Å; E211-L213 VanDerWaalsContact C-N 3.31Å; E211-L213 PolarHBondContact O-N 3.32Å; L213-K220 PolarHBondContact O-NZ 3.3Å
214	L	94.7	Very high	94	Very high	150 Å²	150	47 Å²	47	79%	0.785	23%	0.231	S	C	*	.	H	α-helix	trans	-90.3	-12.6	175.1	-70.4	168.2	0	0	0	114.2	M210 E211 L212	M210-L214 WeakPolarHBondContact O-CG 3.47Å; M210-L214 PolarHBondContact O-N 3.45Å; M210-L214 VanDerWaalsContact O-N 3.13Å; E211-L214 WeakPolarHBondContact O-CB 3.34Å; E211-L214 PolarHBondContact O-N 3.1Å; L212-L214 PolarHBondContact O-N 3.11Å
215	L	94.9	Very high	94.2	Very high	6 Å²	6	46.8 Å²	46.8	3%	0.031	24%	0.244	C	C	.	.	S	Bend	trans	-58.8	150.9	-178.5	-64.5	178.2	0	0	0	113.9	I128 F179 F197 E211 L212 L219 K220 L223	I128-L215 HydrophobicContact CD1-CD1 4.02Å; I128-L215 HydrophobicContact CG1-CD1 3.68Å; F179-L215 HydrophobicContact CD2-CD2 4.09Å; F179-L215 HydrophobicContact CE2-CD2 3.83Å; F197-L215 HydrophobicContact CZ-CD1 4.49Å; E211-L215 PolarHBondContact O-N 3.28Å; L212-L215 HydrophobicContact CD2-CD1 3.98Å; L212-L215 WeakPolarHBondContact O-CB 3.31Å; L212-L215 WeakPolarHBondContact O-CG 3.47Å; L212-L215 PolarHBondContact O-N 2.95Å; L215-L219 HydrophobicContact CB-CD2 4.48Å; L215-L219 HydrophobicContact CD1-CD2 4.42Å; L215-L219 HydrophobicContact CD2-CD2 4.26Å; L215-K220 HydrophobicContact CB-CG 4.19Å; L215-K220 WeakPolarHBondContact O-CE 3.32Å; L215-K220 PolarHBondContact O-NZ 2.95Å; L215-L223 HydrophobicContact CD1-CD1 3.84Å
216	P	94.8	Very high	94.2	Very high	25 Å²	25	42.3 Å²	42.3	16%	0.162	22%	0.22	C	C	.	.			trans	-57.9	148	175.2	-27.9	38.1	0	0	0	113.8	F179 A218 L219 K220	F179-P216 HydrophobicContact CD2-CG 4.11Å; P216-A218 PolarHBondContact O-N 3.05Å; P216-L219 HydrophobicContact CB-CB 4.47Å; P216-L219 WeakPolarHBondContact O-CB 3.37Å; P216-L219 PolarHBondContact O-N 3.46Å; P216-L219 VanDerWaalsContact O-N 3.14Å; P216-K220 PolarHBondContact O-N 3.47Å
217	S	93.3	Very high	93.8	Very high	10 Å²	10	41.2 Å²	41.2	7%	0.07	21%	0.214	C	C	.	.	H	α-helix	trans	-66.3	-37.4	-171.3	-51.3	0	0	0	0	113.9	E190 V193 K194 L219 K220 E221	E190-S217 VanDerWaalsContact CG-CB 3.4Å; E190-S217 WeakPolarHBondContact CG-OG 3.15Å; E190-S217 WeakPolarHBondContact OE1-CB 3.22Å; E190-S217 PolarHBondContact OE1-OG 2.98Å; V193-S217 WeakPolarHBondContact CG1-O 3.37Å; K194-S217 WeakPolarHBondContact CE-OG 3.22Å; S217-L219 VanDerWaalsContact C-N 3.33Å; S217-K220 PolarHBondContact O-N 2.98Å; S217-E221 PolarHBondContact O-N 3.49Å
218	A	92.8	Very high	93.1	Very high	11 Å²	11	39 Å²	39	9%	0.091	21%	0.206	C	C	.	.	H	α-helix	trans	-64.9	-36.6	173.6	0	0	0	0	0	112.2	L178 L185 P216 E221 E222	L178-A218 HydrophobicContact CD2-CB 4.18Å; L185-A218 HydrophobicContact CD2-CB 4.21Å; L185-A218 HydrophobicContact CG-CB 4.44Å; P216-A218 PolarHBondContact O-N 3.05Å; A218-E221 PolarHBondContact O-N 3.27Å; A218-E222 PolarHBondContact O-N 3.05Å; A218-E222 VanDerWaalsContact O-N 3.08Å
219	L	94.9	Very high	91.2	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-69.1	-39.2	174.4	179.9	58.8	0	0	0	111.9	M125 I128 F175 L178 F179 L215 P216 S217 E221 E222 L223	M125-L219 HydrophobicContact CE-CD2 4.42Å; I128-L219 HydrophobicContact CD1-CD1 4.48Å; I128-L219 HydrophobicContact CD1-CD2 3.96Å; I128-L219 HydrophobicContact CD1-CG 4.46Å; F175-L219 HydrophobicContact CB-CD1 3.77Å; F175-L219 HydrophobicContact CD1-CD1 4.17Å; F175-L219 HydrophobicContact CG-CD1 4.17Å; L178-L219 HydrophobicContact CB-CB 4.13Å; L178-L219 HydrophobicContact CB-CD1 4.31Å; F179-L219 HydrophobicContact CB-CD2 4Å; F179-L219 HydrophobicContact CD2-CD2 3.88Å; F179-L219 HydrophobicContact CG-CD2 4.44Å; L215-L219 HydrophobicContact CB-CD2 4.48Å; L215-L219 HydrophobicContact CD1-CD2 4.42Å; L215-L219 HydrophobicContact CD2-CD2 4.26Å; P216-L219 HydrophobicContact CB-CB 4.47Å; P216-L219 WeakPolarHBondContact O-CB 3.37Å; P216-L219 PolarHBondContact O-N 3.46Å; P216-L219 VanDerWaalsContact O-N 3.14Å; S217-L219 VanDerWaalsContact C-N 3.33Å; L219-E221 VanDerWaalsContact C-N 3.26Å; L219-E221 PolarHBondContact O-N 3.19Å; L219-E222 PolarHBondContact O-N 3.42Å; L219-L223 HydrophobicContact CD1-CD1 4.42Å; L219-L223 HydrophobicContact CD1-CG 4.26Å; L219-L223 HydrophobicContact CG-CD1 4.17Å; L219-L223 HydrophobicContact CG-CG 4.45Å; L219-L223 WeakPolarHBondContact O-CB 3.44Å; L219-L223 VanDerWaalsContact O-CG 3.27Å; L219-L223 WeakPolarHBondContact O-CG 3.42Å; L219-L223 PolarHBondContact O-N 2.87Å
220	K	94.9	Very high	89	Confident	14 Å²	14	44.1 Å²	44.1	6%	0.061	24%	0.244	C	C	.	.	H	α-helix	trans	-60.5	-35.2	171.9	-73.2	174.6	171	141.4	0	112.5	V193 F197 L212 L213 L215 P216 S217 L224	V193-K220 HydrophobicContact CG1-CB 3.91Å; F197-K220 HydrophobicContact CB-CB 4.09Å; F197-K220 HydrophobicContact CB-CD 4.28Å; F197-K220 HydrophobicContact CB-CG 4.34Å; F197-K220 HydrophobicContact CD1-CB 4.39Å; F197-K220 HydrophobicContact CD1-CD 3.73Å; F197-K220 HydrophobicContact CD1-CG 3.76Å; F197-K220 HydrophobicContact CD2-CB 3.66Å; F197-K220 HydrophobicContact CD2-CD 4.49Å; F197-K220 HydrophobicContact CD2-CG 3.75Å; F197-K220 HydrophobicContact CE1-CD 4.17Å; F197-K220 HydrophobicContact CE1-CG 3.92Å; F197-K220 HydrophobicContact CE2-CB 4.16Å; F197-K220 HydrophobicContact CE2-CG 3.91Å; F197-K220 HydrophobicContact CG-CB 3.78Å; F197-K220 HydrophobicContact CG-CD 3.91Å; F197-K220 HydrophobicContact CG-CG 3.67Å; F197-K220 HydrophobicContact CZ-CG 3.99Å; L212-K220 WeakPolarHBondContact O-CE 3.47Å; L213-K220 PolarHBondContact O-NZ 3.3Å; L215-K220 HydrophobicContact CB-CG 4.19Å; L215-K220 WeakPolarHBondContact O-CE 3.32Å; L215-K220 PolarHBondContact O-NZ 2.95Å; P216-K220 PolarHBondContact O-N 3.47Å; S217-K220 PolarHBondContact O-N 2.98Å; K220-L224 WeakPolarHBondContact O-CG 3.5Å; K220-L224 PolarHBondContact O-N 3.03Å
221	E	93.7	Very high	86.1	Confident	51 Å²	51	41.7 Å²	41.7	24%	0.238	24%	0.236	C	C	.	.	H	α-helix	trans	-67.7	-45.6	174.4	-172.3	162	-131.5	0	0	112	L185 R189 V193 S217 A218 L219 L223 L224 G225	L185-E221 HydrophobicContact CD1-CB 4.15Å; L185-E221 WeakPolarHBondContact CD1-OE2 3.44Å; L185-E221 WeakPolarHBondContact CD2-OE2 3.25Å; R189-E221 IonicContact CZ-OE1 2.64Å; R189-E221 IonicContact CZ-OE2 2.96Å; R189-E221 IonicContact NE-OE1 3.32Å; R189-E221 PolarHBondContact NE-OE1 2.86Å; R189-E221 IonicContact NE-OE2 2.78Å; R189-E221 PolarHBondContact NE-OE2 2.91Å; R189-E221 IonicContact NH2-OE1 3.7Å; R189-E221 PolarHBondContact NH2-OE1 3.24Å; R189-E221 IonicContact NH2-OE2 3.18Å; R189-E221 PolarHBondContact NH2-OE2 3.19Å; V193-E221 HydrophobicContact CG1-CB 3.93Å; V193-E221 HydrophobicContact CG2-CB 4.05Å; V193-E221 HydrophobicContact CG2-CG 4.07Å; S217-E221 PolarHBondContact O-N 3.49Å; A218-E221 PolarHBondContact O-N 3.27Å; L219-E221 VanDerWaalsContact C-N 3.26Å; L219-E221 PolarHBondContact O-N 3.19Å; E221-L223 PolarHBondContact O-N 3.21Å; E221-L224 WeakPolarHBondContact O-CB 3.5Å; E221-L224 PolarHBondContact O-N 2.98Å; E221-G225 PolarHBondContact O-N 3.45Å
222	E	94.2	Very high	83.3	Confident	47 Å²	47	42.9 Å²	42.9	22%	0.22	25%	0.254	C	S	.	.	H	α-helix	trans	-63.2	-40.1	176.2	-169.6	66.1	-155.1	0	0	112	R171 Q174 F175 L178 A218 L219 G225 L226	R171-E222 IonicContact CZ-OE1 3.77Å; R171-E222 IonicContact NH1-OE1 2.62Å; R171-E222 PolarHBondContact NH1-OE1 3.09Å; Q174-E222 PolarHBondContact NE2-OE1 3.13Å; Q174-E222 PolarHBondContact NE2-OE2 3.29Å; Q174-E222 VanDerWaalsContact NE2-OE2 3.12Å; F175-E222 HydrophobicContact CD1-CG 4Å; F175-E222 HydrophobicContact CE1-CG 3.75Å; L178-E222 HydrophobicContact CD1-CB 3.68Å; L178-E222 HydrophobicContact CD1-CG 3.98Å; A218-E222 PolarHBondContact O-N 3.05Å; A218-E222 VanDerWaalsContact O-N 3.08Å; L219-E222 PolarHBondContact O-N 3.42Å; E222-G225 CarbonylContact O-C 3.51Å; E222-G225 WeakPolarHBondContact O-CA 3.36Å; E222-G225 PolarHBondContact O-N 2.91Å; E222-G225 VanDerWaalsContact O-N 3.1Å; E222-L226 PolarHBondContact O-N 2.86Å
223	L	94.9	Very high	80.1	Confident	0 Å²	0	48.4 Å²	48.4	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-66.8	-34.5	175.5	-69.9	175.1	0	0	0	112.8	I128 F136 F197 L215 L219 E221 V227	I128-L223 HydrophobicContact CD1-CD1 4.03Å; I128-L223 HydrophobicContact CG1-CD1 3.98Å; I128-L223 HydrophobicContact CG2-CD1 4.29Å; I128-L223 HydrophobicContact CG2-CD2 3.6Å; F136-L223 HydrophobicContact CD1-CB 4.18Å; F136-L223 HydrophobicContact CD1-CD2 4.12Å; F136-L223 HydrophobicContact CE1-CB 3.82Å; F136-L223 HydrophobicContact CG-CD2 4.36Å; F136-L223 HydrophobicContact CZ-CB 4.38Å; F197-L223 HydrophobicContact CE2-CB 4.01Å; F197-L223 HydrophobicContact CE2-CD1 4.03Å; F197-L223 HydrophobicContact CZ-CD1 4.39Å; L215-L223 HydrophobicContact CD1-CD1 3.84Å; L219-L223 HydrophobicContact CD1-CD1 4.42Å; L219-L223 HydrophobicContact CD1-CG 4.26Å; L219-L223 HydrophobicContact CG-CD1 4.17Å; L219-L223 HydrophobicContact CG-CG 4.45Å; L219-L223 WeakPolarHBondContact O-CB 3.44Å; L219-L223 VanDerWaalsContact O-CG 3.27Å; L219-L223 WeakPolarHBondContact O-CG 3.42Å; L219-L223 PolarHBondContact O-N 2.87Å; E221-L223 PolarHBondContact O-N 3.21Å; L223-V227 WeakPolarHBondContact O-CG2 3.48Å; L223-V227 PolarHBondContact O-N 3.17Å
224	L	94	Very high	77.2	Confident	21 Å²	21	52.8 Å²	52.8	11%	0.11	31%	0.312	C	S	.	.	H	α-helix	trans	-64.5	-44.1	167.1	-74.7	169.6	0	0	0	110.4	V193 A196 F197 F200 K220 E221 L226 V227 H228	V193-L224 HydrophobicContact CG1-CD1 4.35Å; A196-L224 HydrophobicContact CB-CD1 3.94Å; F197-L224 HydrophobicContact CB-CD1 4.1Å; F197-L224 HydrophobicContact CB-CG 4.37Å; F197-L224 HydrophobicContact CD2-CG 4.2Å; F200-L224 HydrophobicContact CB-CD2 4.35Å; K220-L224 WeakPolarHBondContact O-CG 3.5Å; K220-L224 PolarHBondContact O-N 3.03Å; E221-L224 WeakPolarHBondContact O-CB 3.5Å; E221-L224 PolarHBondContact O-N 2.98Å; L224-L226 VanDerWaalsContact C-N 3.31Å; L224-L226 PolarHBondContact O-N 3.38Å; L224-V227 PolarHBondContact O-N 2.75Å; L224-V227 VanDerWaalsContact O-N 3.11Å; L224-H228 WeakPolarHBondContact O-CB 3.3Å; L224-H228 PolarHBondContact O-N 3.42Å; L224-H228 PolarHBondContact O-ND1 3.1Å
225	G	92	Very high	74.1	Confident	41 Å²	41	52 Å²	52	42%	0.423	31%	0.313	S	S	.	.	H	α-helix	trans	-56.5	-40.3	176	0	0	0	0	0	113.6	E221 E222 V227 H228 S229	E221-G225 PolarHBondContact O-N 3.45Å; E222-G225 CarbonylContact O-C 3.51Å; E222-G225 WeakPolarHBondContact O-CA 3.36Å; E222-G225 PolarHBondContact O-N 2.91Å; E222-G225 VanDerWaalsContact O-N 3.1Å; G225-V227 PolarHBondContact O-N 3.26Å; G225-H228 CarbonylContact O-C 3.47Å; G225-H228 PolarHBondContact O-N 3.46Å; G225-S229 PolarHBondContact O-N 3.49Å
226	L	90.8	Very high	70.9	Confident	2 Å²	2	60.4 Å²	60.4	1%	0.01	36%	0.358	C	S	.	.	H	α-helix	trans	-65.1	-34.8	175.4	-175.4	70	0	0	0	113.1	R139 L140 D143 F175 E222 L224 S229	R139-L226 HydrophobicContact CB-CD1 4.43Å; R139-L226 HydrophobicContact CB-CD2 4.21Å; R139-L226 HydrophobicContact CB-CG 3.86Å; L140-L226 HydrophobicContact CB-CD2 4.44Å; D143-L226 HydrophobicContact CB-CD1 4.38Å; F175-L226 HydrophobicContact CE2-CD2 4.48Å; F175-L226 HydrophobicContact CZ-CD2 3.98Å; E222-L226 PolarHBondContact O-N 2.86Å; L224-L226 VanDerWaalsContact C-N 3.31Å; L224-L226 PolarHBondContact O-N 3.38Å; L226-S229 PolarHBondContact O-OG 3.34Å
227	V	86.3	Confident	67.7	Low	20 Å²	20	63.4 Å²	63.4	12%	0.121	38%	0.384	C	S	.	.	H	α-helix	trans	-80.2	-38.1	177.4	173.7	0	0	0	0	111.7	F136 R139 F200 L223 L224 G225 S229	F136-V227 HydrophobicContact CD1-CG2 3.68Å; F136-V227 HydrophobicContact CE1-CG2 3.61Å; R139-V227 HydrophobicContact CG-CG2 4.45Å; R139-V227 PolarHBondContact NH1-O 2.8Å; F200-V227 HydrophobicContact CE1-CG2 4.19Å; F200-V227 HydrophobicContact CE2-CG1 3.64Å; F200-V227 HydrophobicContact CZ-CB 4.38Å; F200-V227 HydrophobicContact CZ-CG1 3.77Å; F200-V227 HydrophobicContact CZ-CG2 3.85Å; L223-V227 WeakPolarHBondContact O-CG2 3.48Å; L223-V227 PolarHBondContact O-N 3.17Å; L224-V227 PolarHBondContact O-N 2.75Å; L224-V227 VanDerWaalsContact O-N 3.11Å; G225-V227 PolarHBondContact O-N 3.26Å; V227-S229 VanDerWaalsContact C-N 3.33Å
228	H	80.2	Confident	64.8	Low	123 Å²	123	70.8 Å²	70.8	57%	0.569	42%	0.422	S	S	*	.	S	Bend	trans	-91.7	10.6	-176.9	-61.1	79.7	0	0	0	113	L224 G225	L224-H228 WeakPolarHBondContact O-CB 3.3Å; L224-H228 PolarHBondContact O-N 3.42Å; L224-H228 PolarHBondContact O-ND1 3.1Å; G225-H228 CarbonylContact O-C 3.47Å; G225-H228 PolarHBondContact O-N 3.46Å
229	S	54.6	Low	61.9	Low	27 Å²	27	76.6 Å²	76.6	19%	0.189	46%	0.456	C	S	.	.	S	Bend	trans	-56.9	119.3	175.5	61.9	0	0	0	0	109.4	R142 D143 G225 L226 V227 T231	R142-S229 PolarHBondContact NH2-OG 2.84Å; D143-S229 VanDerWaalsContact OD2-CB 3.31Å; D143-S229 WeakPolarHBondContact OD2-CB 3.41Å; D143-S229 PolarHBondContact OD2-OG 3.37Å; G225-S229 PolarHBondContact O-N 3.49Å; L226-S229 PolarHBondContact O-OG 3.34Å; V227-S229 VanDerWaalsContact C-N 3.33Å; S229-T231 PolarHBondContact O-N 3.49Å; S229-T231 PolarHBondContact O-OG1 2.95Å
230	P	47.6	Very low	58.8	Low	126 Å²	126	84 Å²	84	82%	0.818	50%	0.496	S	S	*	.			trans	-71.1	99.3	-153.8	25	-35.2	0	0	0	112.2
231	T	35.6	Very low	55.8	Low	70 Å²	70	92.1 Å²	92.1	43%	0.429	53%	0.534	S	S	.	.			trans	-87.8	114.3	160.1	-36.7	0	0	0	0	105.7	R142 S229 T233	R142-T231 PolarHBondContact NH1-OG1 2.88Å; S229-T231 PolarHBondContact O-N 3.49Å; S229-T231 PolarHBondContact O-OG1 2.95Å; T231-T233 PolarHBondContact O-N 3.33Å
232	S	35.1	Very low	52.7	Low	112 Å²	112	94.1 Å²	94.1	78%	0.783	56%	0.559	S	S	*	*	S	Bend	trans	-62.1	101.7	-157.5	-57.4	0	0	0	0	115.6
233	T	28.2	Very low	49.6	Very low	116 Å²	116	100 Å²	100	71%	0.712	59%	0.591	S	S	*	*			trans	-169.4	124.3	143.6	7.8	0	0	0	0	114.8	T231	T231-T233 PolarHBondContact O-N 3.33Å
234	N	33.6	Very low	46.3	Very low	136 Å²	136	107.9 Å²	107.9	73%	0.727	63%	0.632	S	S	*	*			trans	29.8	84.7	149.4	-63.9	-18.4	0	0	0	120.2
235	T	29.3	Very low	43.4	Very low	133 Å²	133	112.9 Å²	112.9	82%	0.816	67%	0.666	S	S	*	*			trans	-151.5	13.1	151.4	-15.8	0	0	0	0	117.1
236	L	29.2	Very low	40	Very low	184 Å²	184	116 Å²	116	96%	0.963	68%	0.681	S	S	*	*			trans	-111.1	34.9	179.1	-74.1	175.4	0	0	0	114.4
237	A	27.5	Very low	36.9	Very low	87 Å²	87	124.7 Å²	124.7	72%	0.719	72%	0.724	S	S	*	*			trans	-104.4	14.8	-175.4	0	0	0	0	0	115
238	L	31	Very low	34.2	Very low	165 Å²	165	127.9 Å²	127.9	86%	0.864	75%	0.753	S	S	*	*	S	Bend	trans	-131.1	12.4	-163	-116.6	169.1	0	0	0	116.5
239	V	31.3	Very low	31.6	Very low	134 Å²	134	130.7 Å²	130.7	81%	0.812	77%	0.766	S	S	*	*	S	Bend	trans	-125.1	-37.6	177.7	-176.2	0	0	0	0	113	Q241	V239-Q241 PolarHBondContact O-N 3.37Å
240	N	30.8	Very low	30.3	Very low	156 Å²	156	136.7 Å²	136.7	83%	0.834	80%	0.801	S	S	*	*			trans	-101.9	72.6	-175.2	-69	-0.2	0	0	0	112.6
241	Q	31.1	Very low	29.4	Very low	184 Å²	184	137.9 Å²	137.9	86%	0.86	80%	0.801	S	S	*	*			trans	-125.8	81.5	163.9	-82.5	-163.7	14.8	0	0	111.9	V239	V239-Q241 PolarHBondContact O-N 3.37Å
242	A	29.6	Very low	29.1	Very low	92 Å²	92	143 Å²	143	76%	0.76	82%	0.82	S	S	*	*	S	Bend	trans	-158.6	132.8	154.8	0	0	0	0	0	110.6
243	L	27.9	Very low	28.7	Very low	170 Å²	170	144.9 Å²	144.9	89%	0.89	82%	0.821	S	S	*	*			trans	62.4	72.2	160	-57.6	174.2	0	0	0	118.9
244	L	27.1	Very low	28.9	Very low	166 Å²	166	150.4 Å²	150.4	87%	0.869	83%	0.829	S	S	*	*			trans	-144.3	128.2	143	-97.3	178.7	0	0	0	110.5
245	P	31.8	Very low	28.8	Very low	127 Å²	127	148.8 Å²	148.8	83%	0.825	83%	0.828	S	S	*	*			trans	-80.7	137.6	158.5	-10.9	28.8	0	0	0	110.3
246	S	22.5	Very low	28.7	Very low	105 Å²	105	150.7 Å²	150.7	73%	0.734	83%	0.828	S	S	*	*			trans	-93.8	152.4	-174.7	-177.1	0	0	0	0	113.6
247	M	25.7	Very low	28.6	Very low	185 Å²	185	147.8 Å²	147.8	91%	0.911	82%	0.823	S	S	*	*			trans	-137.9	153	152.4	-100.1	-66.8	134.1	0	0	109
248	A	27.7	Very low	28.7	Very low	88 Å²	88	148.7 Å²	148.7	73%	0.727	82%	0.824	S	S	*	*			trans	-100.7	178.8	-140.7	0	0	0	0	0	117.5
249	E	26.9	Very low	28.9	Very low	182 Å²	182	144.8 Å²	144.8	85%	0.85	81%	0.807	S	S	*	*			trans	-61.5	151	-172.1	-54.5	156.7	134.5	0	0	115.4
250	V	27.7	Very low	29.1	Very low	152 Å²	152	144.9 Å²	144.9	92%	0.921	81%	0.811	S	S	*	*				-136.8	134.7	130	179	0	0	0	0	107
251	D	26.9	Very low	29.3	Very low	151 Å²	151	143.1 Å²	143.1	81%	0.807	81%	0.805	S	S	*	*			trans	-111.3	179.7	179	-165.5	3.3	0	0	0	110.2
252	Q	29.8	Very low	29.6	Very low	179 Å²	179	138.5 Å²	138.5	84%	0.836	79%	0.79	S	S	*	*			trans	78.8	128.6	175.6	-141.3	157.6	30.7	0	0	113.7
253	D	27.3	Very low	29.9	Very low	151 Å²	151	141.9 Å²	141.9	81%	0.807	79%	0.79	S	S	*	*			cis	-140.6	171.4	29.9	-161	5.5	0	0	0	114
254	R	32	Very low	30.2	Very low	232 Å²	232	141 Å²	141	88%	0.875	79%	0.785	S	S	*	*			trans	-128.4	89.8	-158	-177.8	-168	178.9	139.9	-0.9	114
255	S	31.2	Very low	30.7	Very low	101 Å²	101	136.4 Å²	136.4	71%	0.706	77%	0.767	S	S	*	*			trans	-170.1	88.6	156.8	46.1	0	0	0	0	115.1
256	Q	28.1	Very low	31	Very low	174 Å²	174	137 Å²	137	81%	0.813	76%	0.763	S	S	*	*			trans	-164.5	107	144	-83.1	-40.1	-66.1	0	0	108.8
257	S	27.5	Very low	31.8	Very low	123 Å²	123	142.2 Å²	142.2	86%	0.86	77%	0.767	S	S	*	*			trans	-151.4	63.9	172.8	64.4	0	0	0	0	110.3
258	S	28.8	Very low	32.6	Very low	106 Å²	106	140 Å²	140	74%	0.741	76%	0.757	S	S	*	*			trans	-85.8	158.1	175.8	-59.4	0	0	0	0	111.5
259	T	35.2	Very low	33.1	Very low	83 Å²	83	143 Å²	143	51%	0.509	76%	0.76	S	S	.	*			trans	-68.6	159.1	-173.3	44.4	0	0	0	0	114	V261	T259-V261 VanDerWaalsContact C-N 3.26Å; T259-V261 PolarHBondContact O-N 3.22Å
260	P	36.5	Very low	33.2	Very low	136 Å²	136	141.8 Å²	141.8	88%	0.883	76%	0.76	S	S	*	*	S	Bend	trans	-78.4	64.3	-173.8	33.6	-37.8	0	0	0	113
261	V	33.4	Very low	33.4	Very low	119 Å²	119	141.2 Å²	141.2	72%	0.721	76%	0.757	S	S	*	*			trans	-132.6	42.5	-177.3	-159.3	0	0	0	0	111.8	T259	T259-V261 VanDerWaalsContact C-N 3.26Å; T259-V261 PolarHBondContact O-N 3.22Å
262	T	38.4	Very low	33.6	Very low	87 Å²	87	139.6 Å²	139.6	53%	0.534	76%	0.757	S	S	.	*			trans	-133.9	-14.4	-177.2	2.1	0	0	0	0	115.7	L264 S265	T262-L264 VanDerWaalsContact C-N 3.31Å; T262-L264 PolarHBondContact O-N 3.42Å; T262-S265 PolarHBondContact O-N 3.26Å
263	E	35.6	Very low	33.4	Very low	162 Å²	162	141 Å²	141	76%	0.757	76%	0.761	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75	-18.6	-174.6	-154.1	174.6	179.3	0	0	113.7
264	L	34.1	Very low	33.5	Very low	151 Å²	151	142 Å²	142	79%	0.791	76%	0.761	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.9	-26.2	175.5	-66.5	178.2	0	0	0	113.9	T262	T262-L264 VanDerWaalsContact C-N 3.31Å; T262-L264 PolarHBondContact O-N 3.42Å
265	S	37	Very low	33.3	Very low	71 Å²	71	139.9 Å²	139.9	50%	0.497	76%	0.761	S	S	.	*	G	3₁₀ helix	trans	-72.1	-31.9	179.3	-60.2	0	0	0	0	112.5	T262 R267	T262-S265 PolarHBondContact O-N 3.26Å; S265-R267 VanDerWaalsContact C-N 3.27Å; S265-R267 PolarHBondContact O-N 3.32Å
266	N	37.8	Very low	33.1	Very low	140 Å²	140	144.1 Å²	144.1	75%	0.749	77%	0.766	S	S	*	*	G	3₁₀ helix	trans	-87.3	19.9	-173.8	-66.6	-9.2	0	0	0	114.2
267	R	40.1	Very low	33	Very low	213 Å²	213	139.4 Å²	139.4	80%	0.804	77%	0.765	S	S	*	*	G	3₁₀ helix	trans	-125.2	0	172.3	-70.8	-165.4	179.5	-158.7	3.2	114.9	S265	S265-R267 VanDerWaalsContact C-N 3.27Å; S265-R267 PolarHBondContact O-N 3.32Å
268	I	43.4	Very low	32.9	Very low	138 Å²	138	139.6 Å²	139.6	71%	0.708	76%	0.761	S	S	*	*	S	Bend	trans	-107.9	-7.7	-174.2	-64.3	177.2	0	0	0	112.4
269	L	37.5	Very low	32.8	Very low	151 Å²	151	139.8 Å²	139.8	79%	0.791	76%	0.762	S	S	*	*	S	Bend	trans	-113.4	7.1	-172.5	-67.1	177.6	0	0	0	116.3
270	D	28.4	Very low	32.4	Very low	158 Å²	158	140.5 Å²	140.5	85%	0.845	78%	0.776	S	S	*	*			trans	-127.9	57.8	178.6	-94.3	-49.2	0	0	0	113.3
271	T	31.3	Very low	31.9	Very low	139 Å²	139	138.5 Å²	138.5	85%	0.853	77%	0.771	S	S	*	*			trans	-134.3	90.1	150	46	0	0	0	0	108.8
272	S	31	Very low	31.5	Very low	118 Å²	118	137.7 Å²	137.7	83%	0.825	78%	0.777	S	S	*	*			trans	-76.9	143.4	-177.2	48.2	0	0	0	0	112.4
273	F	26.6	Very low	31	Very low	207 Å²	207	138.1 Å²	138.1	91%	0.908	78%	0.783	S	S	*	*			trans	-118.2	132.6	169.5	-151.6	-90.6	0	0	0	108.7
274	E	28.9	Very low	30.6	Very low	174 Å²	174	136.7 Å²	136.7	81%	0.813	79%	0.785	S	S	*	*			trans	-92.5	122.6	-170.7	-102.2	-81.5	141.6	0	0	112
275	E	27.7	Very low	30.3	Very low	186 Å²	186	134.6 Å²	134.6	87%	0.869	78%	0.783	S	S	*	*			trans	-136.5	66.1	165.9	-158.3	172.8	177.7	0	0	113.8
276	K	27.9	Very low	29.8	Very low	190 Å²	190	136.6 Å²	136.6	83%	0.826	80%	0.803	S	S	*	*				44.5	80.3	126.4	-161.4	176.5	-173.3	176.4	0	118
277	G	26.5	Very low	29.2	Very low	76 Å²	76	133.8 Å²	133.8	78%	0.784	81%	0.807	S	S	*	*			trans	-123.2	17	-168	0	0	0	0	0	121.5
278	V	25.3	Very low	28.5	Very low	127 Å²	127	127 Å²	127	77%	0.77	80%	0.804	S	S	*	*			trans	60	104.2	159	-170.5	0	0	0	0	120.7
279	S	25.9	Very low	27.8	Very low	109 Å²	109	130.8 Å²	130.8	76%	0.762	82%	0.815	S	S	*	*			trans	89.3	137.3	137.9	78.9	0	0	0	0	124.6
280	A	26.5	Very low	27.3	Very low	99 Å²	99	128 Å²	128	82%	0.818	81%	0.814	S	S	*	*			trans	68.1	141.1	149	0	0	0	0	0	121.1
281	A	26.3	Very low	27.1	Very low	93 Å²	93	123.7 Å²	123.7	77%	0.769	81%	0.807	S	S	*	*			cis	-167.3	173.1	-16	0	0	0	0	0	111.2
282	A	26.1	Very low	27	Very low	102 Å²	102	125.6 Å²	125.6	84%	0.843	81%	0.811	S	S	*	*			trans	76.3	146.8	168.6	0	0	0	0	0	116.8
283	S	27.3	Very low	26.6	Very low	96 Å²	96	123.3 Å²	123.3	67%	0.671	81%	0.806	S	S	*	*			cis	-170.5	141.9	-5.3	141.6	0	0	0	0	112.9
284	V	27.7	Very low	27.3	Very low	132 Å²	132	119.9 Å²	119.9	80%	0.8	81%	0.805	S	S	*	*			trans	67.9	151.2	151	166.5	0	0	0	0	118.4
285	C	26.5	Very low	27.1	Very low	108 Å²	108	119.6 Å²	119.6	73%	0.73	80%	0.803	S	S	*	*			cis	-170.2	152.6	-37.9	-97	0	0	0	0	109.3
286	A	26.2	Very low	27.1	Very low	112 Å²	112	115 Å²	115	93%	0.926	80%	0.797	S	S	*	*			trans	62.1	156.5	161.1	0	0	0	0	0	118.8
287	G	25.7	Very low	27	Very low	81 Å²	81	111.6 Å²	111.6	84%	0.835	79%	0.792	S	S	*	*			cis	163	150.5	-10.9	0	0	0	0	0	114.2
288	G	26.5	Very low	27	Very low	72 Å²	72	115 Å²	115	74%	0.742	79%	0.791	S	S	*	*			trans	106.9	120	179.3	0	0	0	0	0	112.8
289	K	28.6	Very low	27.1	Very low	216 Å²	216	115 Å²	115	94%	0.939	79%	0.786	S	S	*	*				74.4	132.4	66.8	-76.5	-173	175.3	-176.4	0	112.9
290	A	27.1	Very low	27.1	Very low	93 Å²	93	117.1 Å²	117.1	77%	0.769	79%	0.789	S	S	*	*			cis	-148.6	168.7	-6.7	0	0	0	0	0	109.1
291	G	24.5	Very low	27.1	Very low	68 Å²	68	116.1 Å²	116.1	70%	0.701	79%	0.789	S	S	*	*				77.6	134.3	82.9	0	0	0	0	0	112
292	L	27.7	Very low	27.1	Very low	179 Å²	179	118.4 Å²	118.4	94%	0.937	79%	0.793	S	S	*	*			cis	-152.7	173.5	16.1	-70.9	164.8	0	0	0	111.3
293	G	23.3	Very low	27.4	Very low	70 Å²	70	124.8 Å²	124.8	72%	0.722	80%	0.796	S	S	*	*			trans	-84.4	-154.2	161.2	0	0	0	0	0	112.6
294	P	40.5	Very low	27.9	Very low	134 Å²	134	126.6 Å²	126.6	87%	0.87	81%	0.805	S	S	*	*			cis	-140.4	-155.9	22.1	43.8	-23.5	0	0	0	115.6
295	E	24.9	Very low	27.8	Very low	168 Å²	168	125.2 Å²	125.2	79%	0.785	80%	0.801	S	S	*	*			trans	-75.2	160.3	-179.4	-58	-176.1	126.3	0	0	116.4
296	A	27.1	Very low	27.9	Very low	89 Å²	89	128.2 Å²	128.2	74%	0.736	80%	0.804	S	S	*	*			trans	-158.4	140.9	139.2	0	0	0	0	0	109.4
297	V	26.6	Very low	28	Very low	120 Å²	120	131.5 Å²	131.5	73%	0.727	80%	0.798	S	S	*	*			cis	75.3	119.9	41.6	173.5	0	0	0	0	110.4
298	L	26	Very low	28.3	Very low	146 Å²	146	139.9 Å²	139.9	76%	0.764	80%	0.804	S	S	*	*			cis	-167.4	-178.7	9.5	-126.4	-179	0	0	0	112.9
299	L	28.7	Very low	28.5	Very low	127 Å²	127	147.7 Å²	147.7	67%	0.665	81%	0.811	S	S	*	*			trans	78.1	118.9	148.5	-74.4	163.6	0	0	0	124.6
300	N	25.5	Very low	28.5	Very low	154 Å²	154	143.3 Å²	143.3	82%	0.824	81%	0.807	S	S	*	*				31	141.9	127.2	-60.3	-2.2	0	0	0	123.5
301	G	25.6	Very low	28.6	Very low	79 Å²	79	143 Å²	143	81%	0.814	80%	0.8	S	S	*	*			trans	166.4	91.3	152.6	0	0	0	0	0	119.1
302	T	26.8	Very low	28.8	Very low	140 Å²	140	148 Å²	148	86%	0.859	81%	0.805	S	S	*	*			trans	-49.1	147.3	178.2	-50.5	0	0	0	0	118.6
303	R	32.7	Very low	28.9	Very low	237 Å²	237	145 Å²	145	89%	0.894	80%	0.799	S	S	*	*			trans	-32.8	153.3	161.8	-64.5	178.5	168.6	-173.9	-2.4	116
304	P	38	Very low	29.3	Very low	134 Å²	134	150.2 Å²	150.2	87%	0.87	81%	0.805	S	S	*	*				-146.2	-172	92.3	39.3	-22.1	0	0	0	115.8
305	S	26	Very low	28.9	Very low	102 Å²	102	148.7 Å²	148.7	71%	0.713	79%	0.793	S	S	*	*			trans	-110.8	164.1	-172.4	57.5	0	0	0	0	113.7
306	H	27.2	Very low	29.3	Very low	171 Å²	171	151.9 Å²	151.9	79%	0.792	80%	0.798	S	S	*	*			trans	-166.7	167.5	134.4	-112.1	64.4	0	0	0	116.6
307	K	29.7	Very low	29.5	Very low	182 Å²	182	154.3 Å²	154.3	79%	0.791	80%	0.798	S	S	*	*			trans	-73	162.6	-170.1	-53.9	161.6	177.7	166.5	0	115.6
308	R	32.1	Very low	29.7	Very low	256 Å²	256	155.7 Å²	155.7	97%	0.966	81%	0.807	S	S	*	*				-156.7	167.9	122.5	-113.3	172.2	-175.5	-137.4	-2	113.9
309	R	30.8	Very low	30	Very low	237 Å²	237	156.5 Å²	156.5	89%	0.894	80%	0.804	S	S	*	*			trans	-94.4	167.1	-178	-64.7	172.2	164	-179.5	-7.7	111.8
310	S	27.9	Very low	30	Very low	123 Å²	123	160.6 Å²	160.6	86%	0.86	81%	0.811	S	S	*	*				-171.1	166.4	126.1	-105.4	0	0	0	0	113.9
311	S	28.8	Very low	30.2	Very low	88 Å²	88	160.7 Å²	160.7	62%	0.615	81%	0.807	S	S	*	*			trans	-157.7	-160.9	-170.3	-44.9	0	0	0	0	110.3
312	E	29.5	Very low	30.2	Very low	172 Å²	172	165.8 Å²	165.8	80%	0.804	80%	0.803	S	S	*	*			cis	-158.6	129.4	1.6	-129.7	119.9	48	0	0	108.6
313	S	29.5	Very low	30.4	Very low	115 Å²	115	163 Å²	163	80%	0.804	79%	0.788	S	S	*	*			trans	-169	136.5	170.4	-19.1	0	0	0	0	110.5
314	E	31.7	Very low	30.3	Very low	181 Å²	181	158.9 Å²	158.9	85%	0.846	78%	0.784	S	S	*	*			cis	70.2	131.3	11.4	-85.4	-152.9	117.1	0	0	116.4
315	T	32.7	Very low	29.8	Very low	102 Å²	102	158.7 Å²	158.7	63%	0.626	77%	0.771	S	S	*	*			cis	-150.3	176	2.9	46.4	0	0	0	0	112.7
316	R	32.6	Very low	30	Very low	234 Å²	234	162.1 Å²	162.1	88%	0.883	77%	0.768	S	S	*	*			trans	117.5	138.3	135.8	-92.8	177.9	171.6	173.5	-1.4	121.2
317	D	31.8	Very low	30.1	Very low	140 Å²	140	161 Å²	161	75%	0.749	76%	0.761	S	S	*	*			trans	-64.1	151.9	174.3	-55.1	-116.4	0	0	0	115.2
318	T	31.3	Very low	29.9	Very low	150 Å²	150	160.7 Å²	160.7	92%	0.92	76%	0.763	S	S	*	*				-134.9	157	126.2	46.4	0	0	0	0	109.7
319	K	30.3	Very low	29.6	Very low	162 Å²	162	154.5 Å²	154.5	70%	0.704	75%	0.745	S	S	*	*			trans	-147.6	120.2	-161.4	171.3	-178.9	176	179.4	0	112
320	R	30.7	Very low	29.2	Very low	214 Å²	214	148.4 Å²	148.4	81%	0.808	74%	0.738	S	S	*	*			trans	68.1	164.2	176.9	-58.9	176	173.9	-162	-4.8	111.6
321	Q	28.2	Very low	30.1	Very low	155 Å²	155	147.4 Å²	147.4	72%	0.724	73%	0.729	S	S	*	*			cis	-149.1	151.1	32.3	-79.5	-176.8	-112.2	0	0	114.2
322	Y	27	Very low	30	Very low	187 Å²	187	149.3 Å²	149.3	73%	0.733	73%	0.728	S	S	*	*			trans	55.6	161.7	134.3	-72.6	-127.3	0	0	0	119.6
323	S	29.1	Very low	30	Very low	80 Å²	80	150.3 Å²	150.3	56%	0.559	72%	0.724	S	S	*	*			cis	179.3	165.3	-29	-86.1	0	0	0	0	106.7
324	L	31.1	Very low	29.8	Very low	152 Å²	152	151 Å²	151	80%	0.796	72%	0.724	S	S	*	*			trans	70.2	157.1	168.3	-51.2	136.1	0	0	0	113.5
325	E	27.7	Very low	29.7	Very low	129 Å²	129	146.5 Å²	146.5	60%	0.603	72%	0.718	S	S	*	*			cis	-169.6	172	-18	-111.7	-162.6	124.3	0	0	108.2
326	R	29.9	Very low	29.5	Very low	174 Å²	174	152 Å²	152	66%	0.657	73%	0.727	S	S	*	*			cis	-169	152.7	-6.9	177.4	-158.6	-58.9	137	6.7	107.4
327	K	29.6	Very low	29.2	Very low	147 Å²	147	145.6 Å²	145.6	64%	0.639	71%	0.707	S	S	*	*			trans	66.3	169.9	161.6	-93.2	-176.9	-176.6	-149.3	0	115.2	E329	K327-E329 VanDerWaalsContact CD-OE2 3.32Å; K327-E329 WeakPolarHBondContact CD-OE2 3.15Å; K327-E329 WeakPolarHBondContact CE-OE2 3.41Å; K327-E329 HydrophobicContact CG-CB 4.45Å; K327-E329 IonicContact NZ-OE1 3.76Å; K327-E329 IonicContact NZ-OE2 2.59Å; K327-E329 PolarHBondContact NZ-OE2 3.08Å
328	E	26.5	Very low	29.1	Very low	177 Å²	177	149 Å²	149	83%	0.827	71%	0.709	S	S	*	*			cis	-109.8	150.9	1.4	-68.4	176.3	141.2	0	0	109.7
329	E	24.1	Very low	29.2	Very low	126 Å²	126	147.7 Å²	147.7	59%	0.589	70%	0.704	S	S	*	*			cis	87.8	101.9	34.6	-166.2	174.3	-161.8	0	0	115	K327	K327-E329 VanDerWaalsContact CD-OE2 3.32Å; K327-E329 WeakPolarHBondContact CD-OE2 3.15Å; K327-E329 WeakPolarHBondContact CE-OE2 3.41Å; K327-E329 HydrophobicContact CG-CB 4.45Å; K327-E329 IonicContact NZ-OE1 3.76Å; K327-E329 IonicContact NZ-OE2 2.59Å; K327-E329 PolarHBondContact NZ-OE2 3.08Å
330	S	23.8	Very low	29.1	Very low	109 Å²	109	150.5 Å²	150.5	76%	0.762	71%	0.71	S	S	*	*				42.2	172.4	120.1	-113.7	0	0	0	0	121.4
331	P	46.6	Very low	29.1	Very low	102 Å²	102	147.1 Å²	147.1	66%	0.662	71%	0.708	S	S	*	*			cis	-139.3	-157.8	3.4	28.7	-1.6	0	0	0	115
332	E	27	Very low	29.1	Very low	128 Å²	128	150 Å²	150	60%	0.598	71%	0.712	S	S	*	*			trans	91	131.9	157	-54.2	-91.8	118.4	0	0	118.2
333	R	28.7	Very low	29	Very low	192 Å²	192	147.9 Å²	147.9	73%	0.725	71%	0.709	S	S	*	*			cis	-163.7	176.5	-18	-131.1	-172.2	-164.9	138.7	0.6	113
334	T	26.1	Very low	28.9	Very low	131 Å²	131	149.5 Å²	149.5	80%	0.804	72%	0.715	S	S	*	*			trans	72.7	120.9	174.4	62.1	0	0	0	0	116.1
335	A	29.4	Very low	28.8	Very low	85 Å²	85	154.1 Å²	154.1	70%	0.702	72%	0.722	S	S	*	*			cis	81.8	136.6	45.4	0	0	0	0	0	112.3
336	R	28.5	Very low	28.7	Very low	218 Å²	218	151.5 Å²	151.5	82%	0.823	73%	0.73	S	S	*	*			cis	-164.8	167.2	11.4	-119.8	176.6	-154.2	-129.4	17	107.4
337	E	26.5	Very low	28.6	Very low	100 Å²	100	148.3 Å²	148.3	47%	0.467	74%	0.741	S	S	.	*			cis	-167	160.6	-3.2	-153.5	178.9	-96.1	0	0	111
338	R	29.7	Very low	28.4	Very low	210 Å²	210	145 Å²	145	79%	0.792	75%	0.748	S	S	*	*			trans	64.3	146.3	160.2	-82	163	177.3	150.9	-12.1	119.4
339	P	32.3	Very low	28.4	Very low	124 Å²	124	142 Å²	142	81%	0.805	75%	0.747	S	S	*	*				-138	164.3	98.6	40.1	-30.4	0	0	0	114.6
340	R	28.9	Very low	28.6	Very low	220 Å²	220	140.8 Å²	140.8	83%	0.83	75%	0.752	S	S	*	*			trans	-157.6	150.6	161.6	-92.2	-153.4	-174.5	-173.8	2.1	111.6
341	D	29.8	Very low	28.7	Very low	144 Å²	144	139.8 Å²	139.8	77%	0.77	74%	0.744	S	S	*	*			trans	58.1	125.1	161.7	-45.5	-32.1	0	0	0	116.4
342	R	28	Very low	27.8	Very low	216 Å²	216	145.9 Å²	145.9	82%	0.815	75%	0.754	S	S	*	*				-154.2	151.1	52.4	-168.7	169.7	-175.2	142.8	13.3	115.2
343	E	26.5	Very low	27.8	Very low	142 Å²	142	144.5 Å²	144.5	66%	0.664	76%	0.759	S	S	*	*			trans	-3.4	134.9	164.3	-50.9	168.4	84.5	0	0	121.4
344	V	27.2	Very low	27.7	Very low	114 Å²	114	144.4 Å²	144.4	69%	0.691	76%	0.764	S	S	*	*				156.1	117.9	112	165.9	0	0	0	0	111.6
345	R	27.9	Very low	27.9	Very low	248 Å²	248	144.2 Å²	144.2	94%	0.936	76%	0.762	S	S	*	*			trans	49.9	135	160.4	-60.2	165.8	-162	-125.6	2.7	118.8
346	G	26.9	Very low	28.7	Very low	75 Å²	75	145.6 Å²	145.6	77%	0.773	76%	0.764	S	S	*	*			cis	-175.7	163.4	-0	0	0	0	0	0	111.1
347	A	26.2	Very low	28.5	Very low	106 Å²	106	140.4 Å²	140.4	88%	0.876	76%	0.761	S	S	*	*			trans	-71.9	157.9	-173.5	0	0	0	0	0	113.8
348	G	25.8	Very low	28.5	Very low	78 Å²	78	140 Å²	140	80%	0.804	78%	0.775	S	S	*	*			cis	104	81.3	-4.6	0	0	0	0	0	115.9
349	S	27	Very low	28.3	Very low	113 Å²	113	135.3 Å²	135.3	79%	0.79	77%	0.774	S	S	*	*			trans	-155.2	136.3	162.2	-150.6	0	0	0	0	109.1
350	S	28.2	Very low	27.8	Very low	101 Å²	101	135 Å²	135	71%	0.706	77%	0.774	S	S	*	*			cis	77.3	137.2	24.4	-157.7	0	0	0	0	113.6
351	C	26.1	Very low	27.6	Very low	88 Å²	88	130.7 Å²	130.7	60%	0.595	77%	0.772	S	S	*	*			cis	-168.3	171.9	-23.4	58.5	0	0	0	0	110.2
352	R	27.8	Very low	27.4	Very low	230 Å²	230	131.1 Å²	131.1	87%	0.868	77%	0.774	S	S	*	*			trans	69.2	163.4	165.5	-57.3	165.9	171.1	171	-4.1	114.2
353	S	26	Very low	27.2	Very low	99 Å²	99	125.5 Å²	125.5	69%	0.692	77%	0.767	S	S	*	*			cis	-153.8	150.9	25.2	-57.7	0	0	0	0	115.3
354	K	27.6	Very low	27.1	Very low	191 Å²	191	123.8 Å²	123.8	83%	0.83	77%	0.771	S	S	*	*			trans	45.3	116.6	137	-61.7	176.8	179.2	-178.3	0	122
355	T	30.1	Very low	27	Very low	127 Å²	127	123.3 Å²	123.3	78%	0.779	77%	0.773	S	S	*	*				14.2	150.4	121.8	60.4	0	0	0	0	120.2
356	P	45.2	Very low	26.9	Very low	114 Å²	114	116.4 Å²	116.4	74%	0.74	76%	0.762	S	S	*	*			cis	-153.4	-168.3	35.3	44	-22.3	0	0	0	118.6
357	S	26	Very low	26.8	Very low	109 Å²	109	118.1 Å²	118.1	76%	0.762	76%	0.762	S	S	*	*			trans	80.3	109	144.5	-64.2	0	0	0	0	124.5
358	A	25.9	Very low	26.7	Very low	92 Å²	92	117.7 Å²	117.7	76%	0.76	75%	0.752	S	S	*	*				64.2	145.3	115.6	0	0	0	0	0	125
359	S	24.1	Very low	26.7	Very low	110 Å²	110	124.2 Å²	124.2	77%	0.769	75%	0.754	S	S	*	*			trans	84.3	103.5	150.2	-60.1	0	0	0	0	121.9
360	C	23.1	Very low	26.6	Very low	118 Å²	118	123.9 Å²	123.9	80%	0.797	75%	0.752	S	S	*	*			trans	22.5	124.8	134.7	-48.4	0	0	0	0	121.1
361	T	23.8	Very low	26.5	Very low	130 Å²	130	121.8 Å²	121.8	80%	0.798	75%	0.746	S	S	*	*				-175.6	137.5	111.7	21.8	0	0	0	0	115.2
362	L	25.4	Very low	26.6	Very low	153 Å²	153	127 Å²	127	80%	0.801	76%	0.759	S	S	*	*			trans	47.7	120.5	139.6	-63.2	171.1	0	0	0	123.6
363	S	24.8	Very low	26.6	Very low	97 Å²	97	120.2 Å²	120.2	68%	0.678	75%	0.751	S	S	*	*				84.6	106.2	123.9	-61.3	0	0	0	0	123.5
364	S	24.6	Very low	26.7	Very low	106 Å²	106	122.6 Å²	122.6	74%	0.741	76%	0.757	S	S	*	*				84.2	154.4	117.4	-59	0	0	0	0	122.6
365	S	25	Very low	26.9	Very low	105 Å²	105	118.6 Å²	118.6	73%	0.734	75%	0.748	S	S	*	*			trans	64.7	97.7	162.7	26.1	0	0	0	0	116.8
366	S	25.2	Very low	26.8	Very low	102 Å²	102	119.1 Å²	119.1	71%	0.713	75%	0.751	S	S	*	*				77.8	133	69.7	72.9	0	0	0	0	115.3
367	S	26.1	Very low	26	Very low	111 Å²	111	118.4 Å²	118.4	78%	0.776	76%	0.755	S	S	*	*			trans	73.7	153.4	163.3	91.6	0	0	0	0	115.9
368	C	24	Very low	26	Very low	97 Å²	97	116.6 Å²	116.6	66%	0.655	75%	0.753	S	S	*	*			cis	-173	174	-21.5	51.1	0	0	0	0	110.8
369	Y	24.2	Very low	26.7	Very low	215 Å²	215	117.6 Å²	117.6	84%	0.843	75%	0.752	S	S	*	*			trans	66.8	131	158.1	-88.5	-82.8	0	0	0	121.2
370	S	26.2	Very low	26.9	Very low	106 Å²	106	119.6 Å²	119.6	74%	0.741	75%	0.752	S	S	*	*			trans	60.8	131	139	-139.5	0	0	0	0	119.4
371	G	26.3	Very low	27	Very low	57 Å²	57	120.1 Å²	120.1	59%	0.588	75%	0.752	S	S	*	*			cis	99.7	111.8	13.5	0	0	0	0	0	112
372	K	28	Very low	27.2	Very low	198 Å²	198	122.4 Å²	122.4	86%	0.861	75%	0.754	S	S	*	*			trans	-173.4	127.7	165.7	-95.2	140.7	-173.4	176.2	0	104.5
373	A	27	Very low	27.2	Very low	87 Å²	87	123.1 Å²	123.1	72%	0.719	75%	0.753	S	S	*	*				66.6	136.8	78.2	0	0	0	0	0	111.8
374	N	29.3	Very low	27.4	Very low	150 Å²	150	123.3 Å²	123.3	80%	0.802	75%	0.754	S	S	*	*			cis	-165.9	-179.4	16.7	-148	15.2	0	0	0	112.9
375	T	30.3	Very low	27.6	Very low	106 Å²	106	122.2 Å²	122.2	65%	0.65	76%	0.76	S	S	*	*			trans	88.4	98.5	144.9	-57.9	0	0	0	0	121.8
376	V	28	Very low	27.7	Very low	138 Å²	138	126.8 Å²	126.8	84%	0.836	77%	0.77	S	S	*	*				81.8	144.3	126.8	168.7	0	0	0	0	123.2
377	A	28.6	Very low	28.1	Very low	100 Å²	100	126.5 Å²	126.5	83%	0.826	77%	0.774	S	S	*	*			trans	91	135.9	161.5	0	0	0	0	0	120.3
378	G	25.6	Very low	28.3	Very low	71 Å²	71	127.4 Å²	127.4	73%	0.732	77%	0.774	S	S	*	*			trans	-135.1	-153.9	157.4	0	0	0	0	0	107.8
379	P	41.1	Very low	29.1	Very low	112 Å²	112	128.4 Å²	128.4	73%	0.727	78%	0.779	S	S	*	*			cis	-135.7	-168.2	2.3	39.4	-19.3	0	0	0	114.3
380	I	27.8	Very low	29.3	Very low	152 Å²	152	125.9 Å²	125.9	78%	0.779	78%	0.78	S	S	*	*			trans	73.9	127.6	167.1	-52.3	158.5	0	0	0	113.1
381	T	26.7	Very low	29.7	Very low	130 Å²	130	128.2 Å²	128.2	80%	0.798	79%	0.785	S	S	*	*				-165.4	162.9	72.5	-42.7	0	0	0	0	111.5
382	Q	27.5	Very low	30.4	Very low	178 Å²	178	128.8 Å²	128.8	83%	0.832	79%	0.791	S	S	*	*			trans	-75.2	148.1	167.1	-61.1	164.4	-101.8	0	0	110
383	E	25.9	Very low	31.1	Very low	168 Å²	168	128.5 Å²	128.5	79%	0.785	79%	0.793	S	S	*	*				-177.9	161.7	75.5	-113.9	-153.8	93	0	0	113.3
384	S	28.9	Very low	32.5	Very low	100 Å²	100	129 Å²	129	70%	0.699	80%	0.797	S	S	*	*			trans	47.1	80.9	139.3	-57.5	0	0	0	0	121.8
385	G	28.6	Very low	34.3	Very low	84 Å²	84	127 Å²	127	87%	0.866	79%	0.79	S	S	*	*			trans	-5.8	152.5	152.3	0	0	0	0	0	124.9
386	E	27.2	Very low	36.2	Very low	200 Å²	200	124.1 Å²	124.1	94%	0.935	77%	0.774	S	S	*	*			trans	-140.9	168.9	146.6	-150.6	173.4	-162.5	0	0	109.5
387	A	33.7	Very low	38.3	Very low	96 Å²	96	121 Å²	121	79%	0.793	76%	0.756	S	S	*	*			trans	-90.7	148.6	-170	0	0	0	0	0	114.1
388	V	30.4	Very low	40.4	Very low	131 Å²	131	121.9 Å²	121.9	79%	0.794	74%	0.743	S	S	*	*			trans	-128.2	133.6	172.4	-179.3	0	0	0	0	108.3
389	P	39	Very low	43.1	Very low	117 Å²	117	121.1 Å²	121.1	76%	0.76	73%	0.725	S	S	*	*			trans	-73.3	136.8	172.6	31	-33.7	0	0	0	110.6	D391	P389-D391 PolarHBondContact O-N 2.83Å
390	D	29.7	Very low	44.9	Very low	162 Å²	162	118.1 Å²	118.1	87%	0.866	70%	0.702	S	S	*	*			trans	-86.3	106.2	179.2	-165.8	39.1	0	0	0	109.9	G392	D390-G392 PolarHBondContact O-N 3.09Å
391	D	34.1	Very low	47.5	Very low	156 Å²	156	112.6 Å²	112.6	83%	0.834	67%	0.674	S	S	*	*			trans	-74.9	115	174.5	-100.6	-36.5	0	0	0	109.4	P389 E393	P389-D391 PolarHBondContact O-N 2.83Å; D391-E393 PolarHBondContact O-N 3.16Å
392	G	39.9	Very low	50.3	Low	69 Å²	69	114 Å²	114	71%	0.711	67%	0.665	S	S	*	*			trans	-58.3	125.5	-170.4	0	0	0	0	0	114.2	D390 A394	D390-G392 PolarHBondContact O-N 3.09Å; G392-A394 PolarHBondContact O-N 3.1Å; G392-A394 VanDerWaalsContact O-N 3.14Å
393	E	43.7	Very low	53	Low	192 Å²	192	109.5 Å²	109.5	90%	0.897	65%	0.652	S	S	*	*			trans	-57.8	114.1	-178.6	-171.2	176.7	-164	0	0	111.9	D391 V395	D391-E393 PolarHBondContact O-N 3.16Å; E393-V395 PolarHBondContact O-N 3.33Å
394	A	56	Low	55.9	Low	98 Å²	98	102.3 Å²	102.3	81%	0.81	62%	0.619	S	S	*	*			trans	-71.8	101.5	-175.1	0	0	0	0	0	111.8	G392 S396	G392-A394 PolarHBondContact O-N 3.1Å; G392-A394 VanDerWaalsContact O-N 3.14Å; A394-S396 PolarHBondContact O-N 3.28Å
395	V	67.1	Low	58.6	Low	107 Å²	107	97.9 Å²	97.9	65%	0.648	59%	0.588	S	S	*	*			trans	-48.3	123.7	176.7	178.2	0	0	0	0	111.4	E393 T399 N400	E393-V395 PolarHBondContact O-N 3.33Å; V395-T399 WeakPolarHBondContact CG1-OG1 3.38Å; V395-N400 HydrophobicContact CG1-CB 4.41Å
396	S	69.8	Low	61.3	Low	45 Å²	45	97.8 Å²	97.8	32%	0.315	57%	0.567	S	S	.	*			trans	-64.5	146.6	-174	108	0	0	0	0	112.1	A394 E398 T399 N400	A394-S396 PolarHBondContact O-N 3.28Å; S396-E398 WeakPolarHBondContact CB-OE2 3.44Å; S396-E398 PolarHBondContact O-N 2.82Å; S396-E398 VanDerWaalsContact O-N 3.17Å; S396-E398 PolarHBondContact OG-N 3.1Å; S396-E398 PolarHBondContact OG-OE2 3.38Å; S396-T399 PolarHBondContact N-OG1 3.04Å; S396-T399 PolarHBondContact O-N 3.4Å; S396-T399 PolarHBondContact O-OG1 3.28Å; S396-T399 PolarHBondContact OG-N 3.18Å; S396-N400 PolarHBondContact O-N 3.17Å
397	P	72.6	Confident	64.3	Low	72 Å²	72	93.3 Å²	93.3	47%	0.468	55%	0.545	S	S	.	.	H	α-helix	trans	-52.2	-39.8	177.9	-27.8	36.1	0	0	0	113.5	T399 N400 L401 Q427	P397-T399 VanDerWaalsContact C-N 3.27Å; P397-T399 PolarHBondContact O-N 2.78Å; P397-N400 PolarHBondContact O-N 3.06Å; P397-L401 VanDerWaalsContact O-CB 3.25Å; P397-L401 WeakPolarHBondContact O-CB 3.49Å; P397-L401 PolarHBondContact O-N 3.16Å; P397-Q427 VanDerWaalsContact CA-OE1 3.26Å; P397-Q427 VanDerWaalsContact CB-OE1 3.31Å; P397-Q427 PolarHBondContact O-OE1 2.71Å
398	E	74	Confident	66.9	Low	119 Å²	119	88.8 Å²	88.8	56%	0.556	51%	0.507	S	S	*	.	H	α-helix	trans	-66.2	-29.6	179.6	-55.6	70.5	-152.2	0	0	112.5	S396 R402	S396-E398 WeakPolarHBondContact CB-OE2 3.44Å; S396-E398 PolarHBondContact O-N 2.82Å; S396-E398 VanDerWaalsContact O-N 3.17Å; S396-E398 PolarHBondContact OG-N 3.1Å; S396-E398 PolarHBondContact OG-OE2 3.38Å; E398-R402 WeakPolarHBondContact O-CB 3.28Å; E398-R402 PolarHBondContact O-N 3.39Å
399	T	80.8	Confident	69.7	Low	56 Å²	56	89.3 Å²	89.3	34%	0.344	50%	0.495	S	S	.	.	H	α-helix	trans	-82.8	-40.2	175.8	61.1	0	0	0	0	112.1	V395 S396 P397 R402 C403	V395-T399 WeakPolarHBondContact CG1-OG1 3.38Å; S396-T399 PolarHBondContact N-OG1 3.04Å; S396-T399 PolarHBondContact O-N 3.4Å; S396-T399 PolarHBondContact O-OG1 3.28Å; S396-T399 PolarHBondContact OG-N 3.18Å; P397-T399 VanDerWaalsContact C-N 3.27Å; P397-T399 PolarHBondContact O-N 2.78Å; T399-R402 PolarHBondContact O-N 2.91Å; T399-C403 PolarHBondContact O-N 3.1Å; T399-C403 PolarHBondContact O-SG 2.56Å
400	N	79.3	Confident	72	Confident	49 Å²	49	89.6 Å²	89.6	26%	0.262	50%	0.495	S	S	.	.	H	α-helix	trans	-60.9	-50.3	172.8	-176.7	-2.1	0	0	0	111.1	V395 S396 P397 R402 C403 L404 Q427	V395-N400 HydrophobicContact CG1-CB 4.41Å; S396-N400 PolarHBondContact O-N 3.17Å; P397-N400 PolarHBondContact O-N 3.06Å; N400-R402 VanDerWaalsContact C-N 3.27Å; N400-R402 PolarHBondContact O-N 3.39Å; N400-C403 WeakPolarHBondContact O-CB 3.22Å; N400-C403 PolarHBondContact O-N 2.85Å; N400-L404 PolarHBondContact O-N 3.2Å; N400-L404 WeakPolarHBondContact OD1-CD1 3.21Å; N400-Q427 PolarHBondContact ND2-O 2.79Å
401	L	83.3	Confident	74.5	Confident	35 Å²	35	87.8 Å²	87.8	18%	0.183	48%	0.483	C	S	.	.	H	α-helix	trans	-52.2	-44.6	173.5	179.1	61	0	0	0	112.1	P397 C403 L404 V405 V422 Q427	P397-L401 VanDerWaalsContact O-CB 3.25Å; P397-L401 WeakPolarHBondContact O-CB 3.49Å; P397-L401 PolarHBondContact O-N 3.16Å; L401-C403 PolarHBondContact O-N 3.34Å; L401-L404 PolarHBondContact O-N 3.3Å; L401-V405 HydrophobicContact CD1-CG2 3.96Å; L401-V405 HydrophobicContact CG-CG2 4.38Å; L401-V405 WeakPolarHBondContact O-CB 3.42Å; L401-V405 WeakPolarHBondContact O-CG2 3.2Å; L401-V405 PolarHBondContact O-N 3.3Å; L401-V422 HydrophobicContact CD1-CB 4.1Å; L401-V422 HydrophobicContact CD1-CG1 3.53Å; L401-Q427 HydrophobicContact CB-CG 4.34Å; L401-Q427 HydrophobicContact CD1-CG 4.46Å
402	R	83.9	Confident	76.8	Confident	159 Å²	159	83.5 Å²	83.5	60%	0.6	48%	0.476	S	S	*	.	H	α-helix	trans	-65.4	-37.7	178.7	-168.4	-177.7	-57.1	169.1	5.7	112.2	E398 T399 N400 N406	E398-R402 WeakPolarHBondContact O-CB 3.28Å; E398-R402 PolarHBondContact O-N 3.39Å; T399-R402 PolarHBondContact O-N 2.91Å; N400-R402 VanDerWaalsContact C-N 3.27Å; N400-R402 PolarHBondContact O-N 3.39Å; R402-N406 VanDerWaalsContact O-CB 3.3Å; R402-N406 WeakPolarHBondContact O-CB 3.16Å; R402-N406 VanDerWaalsContact O-CG 3.27Å; R402-N406 PolarHBondContact O-N 2.92Å; R402-N406 PolarHBondContact O-ND2 2.95Å
403	C	85.8	Confident	79.2	Confident	84 Å²	84	83.2 Å²	83.2	57%	0.568	45%	0.454	S	S	*	.	H	α-helix	trans	-66.6	-48.9	176.2	-65.4	0	0	0	0	111.5	T399 N400 L401 V405 N406 F407	T399-C403 PolarHBondContact O-N 3.1Å; T399-C403 PolarHBondContact O-SG 2.56Å; N400-C403 WeakPolarHBondContact O-CB 3.22Å; N400-C403 PolarHBondContact O-N 2.85Å; L401-C403 PolarHBondContact O-N 3.34Å; C403-V405 PolarHBondContact O-N 2.95Å; C403-N406 PolarHBondContact O-N 2.87Å; C403-F407 VanDerWaalsContact O-CB 3.32Å; C403-F407 WeakPolarHBondContact O-CB 3.37Å; C403-F407 PolarHBondContact O-N 3Å
404	L	85.3	Confident	81.3	Confident	17 Å²	17	80.2 Å²	80.2	9%	0.089	44%	0.44	C	S	.	.	H	α-helix	trans	-58.9	-45.7	175.9	-71.8	168.7	0	0	0	111.8	N400 L401 F407 F408 V422 Q427 I434	N400-L404 PolarHBondContact O-N 3.2Å; N400-L404 WeakPolarHBondContact OD1-CD1 3.21Å; L401-L404 PolarHBondContact O-N 3.3Å; L404-F407 PolarHBondContact O-N 3.22Å; L404-F408 HydrophobicContact CD2-CE2 4.23Å; L404-F408 WeakPolarHBondContact O-CD2 3.41Å; L404-F408 PolarHBondContact O-N 2.91Å; L404-F408 VanDerWaalsContact O-N 3.11Å; L404-V422 HydrophobicContact CB-CG1 4.41Å; L404-V422 HydrophobicContact CB-CG2 4.33Å; L404-V422 HydrophobicContact CD1-CG1 3.84Å; L404-Q427 HydrophobicContact CD1-CB 4.29Å; L404-I434 HydrophobicContact CD1-CD1 4.42Å
405	V	86.8	Confident	82.8	Confident	8 Å²	8	78.2 Å²	78.2	5%	0.048	41%	0.413	C	S	.	.	H	α-helix	trans	-63.9	-45.1	179.4	171.6	0	0	0	0	111.6	L401 C403 F407 R409 Q415 V418 E419	L401-V405 HydrophobicContact CD1-CG2 3.96Å; L401-V405 HydrophobicContact CG-CG2 4.38Å; L401-V405 WeakPolarHBondContact O-CB 3.42Å; L401-V405 WeakPolarHBondContact O-CG2 3.2Å; L401-V405 PolarHBondContact O-N 3.3Å; C403-V405 PolarHBondContact O-N 2.95Å; V405-F407 PolarHBondContact O-N 3.04Å; V405-R409 WeakPolarHBondContact O-CB 3.43Å; V405-R409 PolarHBondContact O-N 2.78Å; V405-Q415 HydrophobicContact CG1-CG 3.84Å; V405-V418 HydrophobicContact CB-CG1 4.4Å; V405-V418 HydrophobicContact CG2-CG1 4.17Å; V405-E419 HydrophobicContact CB-CG 4.45Å; V405-E419 HydrophobicContact CG1-CG 3.93Å; V405-E419 HydrophobicContact CG2-CG 3.59Å
406	N	85.4	Confident	83.7	Confident	81 Å²	81	79.2 Å²	79.2	43%	0.433	41%	0.411	S	S	.	.	H	α-helix	trans	-65.1	-37.3	176	-77	-13.4	0	0	0	112.4	R402 C403 T410	R402-N406 VanDerWaalsContact O-CB 3.3Å; R402-N406 WeakPolarHBondContact O-CB 3.16Å; R402-N406 VanDerWaalsContact O-CG 3.27Å; R402-N406 PolarHBondContact O-N 2.92Å; R402-N406 PolarHBondContact O-ND2 2.95Å; C403-N406 PolarHBondContact O-N 2.87Å; N406-T410 WeakPolarHBondContact O-CB 3.36Å; N406-T410 PolarHBondContact O-N 3.21Å; N406-T410 PolarHBondContact O-OG1 2.99Å
407	F	89.6	Confident	84.5	Confident	106 Å²	106	77.1 Å²	77.1	47%	0.465	40%	0.397	S	S	.	.	H	α-helix	trans	-60.9	-57.5	177.7	175.8	-103.1	0	0	0	111.6	C403 L404 V405 R409 T410 M411 T431	C403-F407 VanDerWaalsContact O-CB 3.32Å; C403-F407 WeakPolarHBondContact O-CB 3.37Å; C403-F407 PolarHBondContact O-N 3Å; L404-F407 PolarHBondContact O-N 3.22Å; V405-F407 PolarHBondContact O-N 3.04Å; F407-R409 VanDerWaalsContact C-N 3.34Å; F407-R409 PolarHBondContact O-N 3.42Å; F407-T410 WeakPolarHBondContact O-CB 3.47Å; F407-T410 PolarHBondContact O-N 2.86Å; F407-T410 VanDerWaalsContact O-N 3.1Å; F407-M411 WeakPolarHBondContact O-CG 3.46Å; F407-M411 PolarHBondContact O-N 3.34Å; F407-M411 VanDerWaalsContact O-N 3.08Å; F407-T431 HydrophobicContact CE1-CG2 4.12Å
408	F	89	Confident	85.2	Confident	1 Å²	1	73.7 Å²	73.7	0%	0.004	37%	0.374	C	S	.	.	H	α-helix	trans	-69.3	-30.7	-179.3	-63.6	-64.9	0	0	0	113.1	L404 T410 M411 G412 Y413 V418 T431 I434 L435 I438	L404-F408 HydrophobicContact CD2-CE2 4.23Å; L404-F408 WeakPolarHBondContact O-CD2 3.41Å; L404-F408 PolarHBondContact O-N 2.91Å; L404-F408 VanDerWaalsContact O-N 3.11Å; F408-T410 VanDerWaalsContact C-N 3.32Å; F408-T410 PolarHBondContact O-N 3.27Å; F408-M411 CarbonylContact O-C 3.58Å; F408-M411 WeakPolarHBondContact O-CB 3.43Å; F408-M411 PolarHBondContact O-N 3.1Å; F408-G412 PolarHBondContact O-N 3.44Å; F408-Y413 HydrophobicContact CB-CD2 4.28Å; F408-Y413 WeakPolarHBondContact O-CD2 3.34Å; F408-Y413 PolarHBondContact O-N 2.73Å; F408-Y413 VanDerWaalsContact O-N 3.12Å; F408-V418 HydrophobicContact CB-CB 4.41Å; F408-V418 HydrophobicContact CB-CG1 3.74Å; F408-V418 HydrophobicContact CB-CG2 3.67Å; F408-V418 HydrophobicContact CD2-CG1 3.98Å; F408-V418 HydrophobicContact CG-CG1 4.3Å; F408-T431 HydrophobicContact CE1-CG2 4.35Å; F408-T431 HydrophobicContact CE2-CG2 4.43Å; F408-T431 HydrophobicContact CZ-CG2 3.64Å; F408-I434 HydrophobicContact CD2-CG2 4.33Å; F408-I434 HydrophobicContact CE2-CB 4.35Å; F408-I434 HydrophobicContact CE2-CG2 3.48Å; F408-I434 VanDerWaalsContact CE2-CG2 3.48Å; F408-I434 HydrophobicContact CZ-CB 4.29Å; F408-I434 HydrophobicContact CZ-CG2 3.83Å; F408-L435 HydrophobicContact CD1-CD1 4.02Å; F408-L435 HydrophobicContact CE1-CB 3.81Å; F408-L435 HydrophobicContact CE1-CD1 3.87Å; F408-L435 HydrophobicContact CE1-CG 4.33Å; F408-L435 HydrophobicContact CZ-CB 4.31Å; F408-I438 HydrophobicContact CB-CD1 4.1Å; F408-I438 HydrophobicContact CD1-CD1 3.98Å; F408-I438 HydrophobicContact CD2-CD1 3.54Å; F408-I438 HydrophobicContact CE1-CD1 4.29Å; F408-I438 HydrophobicContact CE2-CD1 3.88Å; F408-I438 HydrophobicContact CG-CD1 3.59Å; F408-I438 HydrophobicContact CZ-CD1 4.23Å
409	R	87.8	Confident	85.9	Confident	143 Å²	143	70.7 Å²	70.7	54%	0.54	36%	0.36	S	S	.	.	H	α-helix	trans	-63	-37.7	170.1	177.1	177.2	157.3	176.2	-9.4	112	V405 F407 M411 G412	V405-R409 WeakPolarHBondContact O-CB 3.43Å; V405-R409 PolarHBondContact O-N 2.78Å; F407-R409 VanDerWaalsContact C-N 3.34Å; F407-R409 PolarHBondContact O-N 3.42Å; R409-M411 VanDerWaalsContact C-N 3.28Å; R409-M411 PolarHBondContact O-N 2.78Å; R409-G412 PolarHBondContact O-N 3Å; R409-G412 VanDerWaalsContact O-N 3.08Å
410	T	87.1	Confident	86.2	Confident	123 Å²	123	73.3 Å²	73.3	76%	0.755	36%	0.364	S	S	*	.	H	α-helix	trans	-68.2	-30.8	175	-55.4	0	0	0	0	111.5	N406 F407 F408 G412	N406-T410 WeakPolarHBondContact O-CB 3.36Å; N406-T410 PolarHBondContact O-N 3.21Å; N406-T410 PolarHBondContact O-OG1 2.99Å; F407-T410 WeakPolarHBondContact O-CB 3.47Å; F407-T410 PolarHBondContact O-N 2.86Å; F407-T410 VanDerWaalsContact O-N 3.1Å; F408-T410 VanDerWaalsContact C-N 3.32Å; F408-T410 PolarHBondContact O-N 3.27Å; T410-G412 PolarHBondContact O-N 3.03Å
411	M	83.4	Confident	86.5	Confident	123 Å²	123	71.4 Å²	71.4	61%	0.606	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.3	2	170.6	-62.7	-67	-69.8	0	0	114.1	F407 F408 R409 Y413	F407-M411 WeakPolarHBondContact O-CG 3.46Å; F407-M411 PolarHBondContact O-N 3.34Å; F407-M411 VanDerWaalsContact O-N 3.08Å; F408-M411 CarbonylContact O-C 3.58Å; F408-M411 WeakPolarHBondContact O-CB 3.43Å; F408-M411 PolarHBondContact O-N 3.1Å; R409-M411 VanDerWaalsContact C-N 3.28Å; R409-M411 PolarHBondContact O-N 2.78Å; M411-Y413 HydrophobicContact CB-CD2 4.05Å; M411-Y413 HydrophobicContact CB-CE2 4.07Å
412	G	82.8	Confident	86.7	Confident	67 Å²	67	69.7 Å²	69.7	69%	0.691	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	95.4	2.9	173	0	0	0	0	0	116.4	F408 R409 T410	F408-G412 PolarHBondContact O-N 3.44Å; R409-G412 PolarHBondContact O-N 3Å; R409-G412 VanDerWaalsContact O-N 3.08Å; T410-G412 PolarHBondContact O-N 3.03Å
413	Y	89.2	Confident	86.8	Confident	63 Å²	63	68 Å²	68	25%	0.247	34%	0.342	C	S	.	.			trans	-79.9	146.9	179	-63.1	-78.4	0	0	0	112.6	F408 M411 Q415 L435 I438 V439	F408-Y413 HydrophobicContact CB-CD2 4.28Å; F408-Y413 WeakPolarHBondContact O-CD2 3.34Å; F408-Y413 PolarHBondContact O-N 2.73Å; F408-Y413 VanDerWaalsContact O-N 3.12Å; M411-Y413 HydrophobicContact CB-CD2 4.05Å; M411-Y413 HydrophobicContact CB-CE2 4.07Å; Y413-Q415 PolarHBondContact O-N 3.08Å; Y413-L435 HydrophobicContact CE2-CD1 3.66Å; Y413-I438 HydrophobicContact CD1-CG2 3.46Å; Y413-I438 VanDerWaalsContact CD1-CG2 3.46Å; Y413-I438 HydrophobicContact CD2-CG2 4.17Å; Y413-I438 HydrophobicContact CE1-CG2 3.99Å; Y413-I438 HydrophobicContact CG-CG2 3.57Å; Y413-V439 HydrophobicContact CE1-CG2 3.93Å; Y413-V439 WeakPolarHBondContact OH-CG2 3.14Å
414	Q	87.6	Confident	86.6	Confident	129 Å²	129	68 Å²	68	60%	0.603	35%	0.348	S	S	*	.			trans	-65	129.6	178.6	-68.5	-175.5	0.1	0	0	111.3	E416 V417 V418	Q414-E416 PolarHBondContact O-N 3.19Å; Q414-V417 HydrophobicContact CB-CB 4.48Å; Q414-V417 HydrophobicContact CB-CG2 4.15Å; Q414-V417 PolarHBondContact O-N 3.3Å; Q414-V418 WeakPolarHBondContact O-CG2 3.49Å; Q414-V418 PolarHBondContact O-N 3.04Å
415	Q	87.9	Confident	86.5	Confident	55 Å²	55	68.1 Å²	68.1	26%	0.257	35%	0.35	S	S	.	.	H	α-helix	trans	-59.6	-35.5	-173.1	-179.8	170.2	-29.2	0	0	112.2	V405 Y413 V417 V418 E419	V405-Q415 HydrophobicContact CG1-CG 3.84Å; Y413-Q415 PolarHBondContact O-N 3.08Å; Q415-V417 VanDerWaalsContact C-N 3.3Å; Q415-V417 PolarHBondContact O-N 3.07Å; Q415-V418 PolarHBondContact O-N 2.82Å; Q415-E419 HydrophobicContact CG-CG 4.26Å; Q415-E419 WeakPolarHBondContact CG-OE1 3.49Å; Q415-E419 PolarHBondContact NE2-OE1 3.49Å; Q415-E419 VanDerWaalsContact O-CB 3.31Å; Q415-E419 WeakPolarHBondContact O-CB 3.3Å; Q415-E419 WeakPolarHBondContact O-CG 3.31Å; Q415-E419 PolarHBondContact O-N 3.49Å
416	E	85.4	Confident	86	Confident	128 Å²	128	69 Å²	69	60%	0.598	36%	0.36	S	S	*	.	H	α-helix	trans	-69.7	-25.4	-179.3	-59	72.2	-160.5	0	0	112.9	Q414 R420	Q414-E416 PolarHBondContact O-N 3.19Å; E416-R420 WeakPolarHBondContact O-CB 3.32Å
417	V	87.5	Confident	85.5	Confident	2 Å²	2	67.6 Å²	67.6	1%	0.012	35%	0.351	C	S	.	.	H	α-helix	trans	-84.2	-47.6	173.7	178.8	0	0	0	0	109.5	Q414 Q415 E419 R420 V421 E441	Q414-V417 HydrophobicContact CB-CB 4.48Å; Q414-V417 HydrophobicContact CB-CG2 4.15Å; Q414-V417 PolarHBondContact O-N 3.3Å; Q415-V417 VanDerWaalsContact C-N 3.3Å; Q415-V417 PolarHBondContact O-N 3.07Å; V417-E419 PolarHBondContact O-N 3.08Å; V417-R420 WeakPolarHBondContact O-CB 3.41Å; V417-R420 PolarHBondContact O-N 3.21Å; V417-V421 HydrophobicContact CG1-CG2 4.48Å; V417-V421 WeakPolarHBondContact O-CG2 3.33Å; V417-V421 PolarHBondContact O-N 3.32Å; V417-E441 HydrophobicContact CG1-CB 3.96Å; V417-E441 HydrophobicContact CG1-CG 3.8Å
418	V	87.4	Confident	84.8	Confident	0 Å²	0	68.8 Å²	68.8	0%	0	37%	0.367	C	S	.	.	H	α-helix	trans	-57	-51.1	177.1	176.1	0	0	0	0	111.3	V405 F408 Q414 Q415 R420 V421 V422 I438	V405-V418 HydrophobicContact CB-CG1 4.4Å; V405-V418 HydrophobicContact CG2-CG1 4.17Å; F408-V418 HydrophobicContact CB-CB 4.41Å; F408-V418 HydrophobicContact CB-CG1 3.74Å; F408-V418 HydrophobicContact CB-CG2 3.67Å; F408-V418 HydrophobicContact CD2-CG1 3.98Å; F408-V418 HydrophobicContact CG-CG1 4.3Å; Q414-V418 WeakPolarHBondContact O-CG2 3.49Å; Q414-V418 PolarHBondContact O-N 3.04Å; Q415-V418 PolarHBondContact O-N 2.82Å; V418-R420 VanDerWaalsContact C-N 3.27Å; V418-R420 PolarHBondContact O-N 3.2Å; V418-V421 PolarHBondContact O-N 3.01Å; V418-V422 HydrophobicContact CG1-CG2 4.28Å; V418-V422 VanDerWaalsContact O-CG2 3.31Å; V418-V422 WeakPolarHBondContact O-CG2 3.32Å; V418-V422 PolarHBondContact O-N 3.37Å; V418-I438 HydrophobicContact CB-CD1 4.41Å; V418-I438 HydrophobicContact CG1-CD1 4.15Å; V418-I438 HydrophobicContact CG2-CD1 4.13Å; V418-I438 HydrophobicContact CG2-CG2 4.27Å
419	E	87.9	Confident	84.2	Confident	56 Å²	56	73.2 Å²	73.2	26%	0.262	39%	0.388	S	S	.	.	H	α-helix	trans	-60.5	-36	178.4	-82.2	-167.5	-135.2	0	0	112.5	V405 Q415 V417 K423	V405-E419 HydrophobicContact CB-CG 4.45Å; V405-E419 HydrophobicContact CG1-CG 3.93Å; V405-E419 HydrophobicContact CG2-CG 3.59Å; Q415-E419 HydrophobicContact CG-CG 4.26Å; Q415-E419 WeakPolarHBondContact CG-OE1 3.49Å; Q415-E419 PolarHBondContact NE2-OE1 3.49Å; Q415-E419 VanDerWaalsContact O-CB 3.31Å; Q415-E419 WeakPolarHBondContact O-CB 3.3Å; Q415-E419 WeakPolarHBondContact O-CG 3.31Å; Q415-E419 PolarHBondContact O-N 3.49Å; V417-E419 PolarHBondContact O-N 3.08Å; E419-K423 VanDerWaalsContact O-CB 3.24Å; E419-K423 WeakPolarHBondContact O-CB 3.48Å; E419-K423 WeakPolarHBondContact O-CD 3.46Å; E419-K423 WeakPolarHBondContact O-CG 3.33Å; E419-K423 PolarHBondContact O-N 2.89Å; E419-K423 VanDerWaalsContact O-N 3.12Å; E419-K423 IonicContact OE2-NZ 3.29Å; E419-K423 PolarHBondContact OE2-NZ 2.92Å
420	R	86.8	Confident	83.7	Confident	110 Å²	110	70.9 Å²	70.9	42%	0.415	39%	0.386	S	S	.	.	H	α-helix	trans	-67.4	-48.8	177.7	-170.5	-167.2	-48.5	157.2	9.9	110.9	E416 V417 V418 K423 A424 E441	E416-R420 WeakPolarHBondContact O-CB 3.32Å; V417-R420 WeakPolarHBondContact O-CB 3.41Å; V417-R420 PolarHBondContact O-N 3.21Å; V418-R420 VanDerWaalsContact C-N 3.27Å; V418-R420 PolarHBondContact O-N 3.2Å; R420-K423 PolarHBondContact O-N 3.08Å; R420-A424 VanDerWaalsContact O-CB 3.29Å; R420-A424 WeakPolarHBondContact O-CB 3.5Å; R420-A424 PolarHBondContact O-N 2.8Å; R420-E441 VanDerWaalsContact CD-OE1 3.26Å; R420-E441 WeakPolarHBondContact CD-OE1 3.47Å; R420-E441 IonicContact CZ-OE1 3.18Å; R420-E441 IonicContact NE-OE1 2.71Å; R420-E441 IonicContact NH1-OE1 3.89Å; R420-E441 PolarHBondContact NH1-OE1 3.08Å
421	V	87.4	Confident	83.4	Confident	9 Å²	9	68 Å²	68	6%	0.055	37%	0.369	C	S	.	.	H	α-helix	trans	-68.6	-40.9	-177.3	174.1	0	0	0	0	112	V417 V418 A424 T425 K437 I438 E441	V417-V421 HydrophobicContact CG1-CG2 4.48Å; V417-V421 WeakPolarHBondContact O-CG2 3.33Å; V417-V421 PolarHBondContact O-N 3.32Å; V418-V421 PolarHBondContact O-N 3.01Å; V421-A424 PolarHBondContact O-N 3.5Å; V421-T425 WeakPolarHBondContact O-CB 3.44Å; V421-T425 PolarHBondContact O-N 2.69Å; V421-T425 PolarHBondContact O-OG1 3.31Å; V421-K437 HydrophobicContact CG1-CB 3.43Å; V421-K437 VanDerWaalsContact CG1-CB 3.43Å; V421-K437 HydrophobicContact CG1-CD 4.39Å; V421-I438 HydrophobicContact CB-CG1 3.81Å; V421-I438 HydrophobicContact CG1-CG1 3.83Å; V421-I438 HydrophobicContact CG2-CG1 4.2Å; V421-E441 HydrophobicContact CG2-CB 3.85Å; V421-E441 HydrophobicContact CG2-CG 4.06Å
422	V	87.3	Confident	83.4	Confident	0 Å²	0	68.7 Å²	68.7	0%	0	37%	0.368	C	S	.	.	H	α-helix	trans	-65.9	-40.2	175.9	179.1	0	0	0	0	111	L401 L404 V418 A424 G426 Q427 I434	L401-V422 HydrophobicContact CD1-CB 4.1Å; L401-V422 HydrophobicContact CD1-CG1 3.53Å; L404-V422 HydrophobicContact CB-CG1 4.41Å; L404-V422 HydrophobicContact CB-CG2 4.33Å; L404-V422 HydrophobicContact CD1-CG1 3.84Å; V418-V422 HydrophobicContact CG1-CG2 4.28Å; V418-V422 VanDerWaalsContact O-CG2 3.31Å; V418-V422 WeakPolarHBondContact O-CG2 3.32Å; V418-V422 PolarHBondContact O-N 3.37Å; V422-A424 VanDerWaalsContact C-N 3.32Å; V422-A424 PolarHBondContact O-N 3.1Å; V422-G426 CarbonylContact O-C 3.6Å; V422-G426 PolarHBondContact O-N 2.94Å; V422-Q427 HydrophobicContact CG1-CG 3.95Å; V422-I434 HydrophobicContact CG2-CG2 3.73Å
423	K	84.9	Confident	83.4	Confident	123 Å²	123	68.9 Å²	68.9	54%	0.535	35%	0.353	S	S	.	.	H	α-helix	trans	-68	-29.3	175.1	-70.4	167.1	-163.6	167.3	0	113.1	E419 R420	E419-K423 VanDerWaalsContact O-CB 3.24Å; E419-K423 WeakPolarHBondContact O-CB 3.48Å; E419-K423 WeakPolarHBondContact O-CD 3.46Å; E419-K423 WeakPolarHBondContact O-CG 3.33Å; E419-K423 PolarHBondContact O-N 2.89Å; E419-K423 VanDerWaalsContact O-N 3.12Å; E419-K423 IonicContact OE2-NZ 3.29Å; E419-K423 PolarHBondContact OE2-NZ 2.92Å; R420-K423 PolarHBondContact O-N 3.08Å
424	A	81.9	Confident	83.3	Confident	85 Å²	85	65.9 Å²	65.9	70%	0.702	34%	0.342	S	S	*	.	H	α-helix	trans	-86.4	-24.6	178.2	0	0	0	0	0	114.2	R420 V421 V422	R420-A424 VanDerWaalsContact O-CB 3.29Å; R420-A424 WeakPolarHBondContact O-CB 3.5Å; R420-A424 PolarHBondContact O-N 2.8Å; V421-A424 PolarHBondContact O-N 3.5Å; V422-A424 VanDerWaalsContact C-N 3.32Å; V422-A424 PolarHBondContact O-N 3.1Å
425	T	83	Confident	83.3	Confident	19 Å²	19	62.2 Å²	62.2	12%	0.117	33%	0.326	C	S	.	.	H	α-helix	trans	-98.4	-25.9	-176.8	-59.6	0	0	0	0	113.1	V421 E429 I434 K437	V421-T425 WeakPolarHBondContact O-CB 3.44Å; V421-T425 PolarHBondContact O-N 2.69Å; V421-T425 PolarHBondContact O-OG1 3.31Å; T425-E429 HydrophobicContact CG2-CB 3.78Å; T425-E429 HydrophobicContact CG2-CG 3.82Å; T425-I434 HydrophobicContact CG2-CG1 3.84Å; T425-K437 HydrophobicContact CG2-CD 4.17Å; T425-K437 VanDerWaalsContact CG2-NZ 3.29Å; T425-K437 WeakPolarHBondContact OG1-CD 3.48Å; T425-K437 PolarHBondContact OG1-NZ 2.88Å
426	G	77.1	Confident	83.3	Confident	26 Å²	26	65 Å²	65	27%	0.268	34%	0.339	S	S	.	.			trans	100.6	153.3	-170.8	0	0	0	0	0	111.8	V422	V422-G426 CarbonylContact O-C 3.6Å; V422-G426 PolarHBondContact O-N 2.94Å
427	Q	75.3	Confident	83.4	Confident	51 Å²	51	62.9 Å²	62.9	24%	0.238	33%	0.327	C	S	.	.	S	Bend	trans	-93.1	-4.6	-177.3	-60.8	161.7	15.1	0	0	112.7	P397 N400 L401 L404 V422	P397-Q427 VanDerWaalsContact CA-OE1 3.26Å; P397-Q427 VanDerWaalsContact CB-OE1 3.31Å; P397-Q427 PolarHBondContact O-OE1 2.71Å; N400-Q427 PolarHBondContact ND2-O 2.79Å; L401-Q427 HydrophobicContact CB-CG 4.34Å; L401-Q427 HydrophobicContact CD1-CG 4.46Å; L404-Q427 HydrophobicContact CD1-CB 4.29Å; V422-Q427 HydrophobicContact CG1-CG 3.95Å
428	T	73.3	Confident	83.6	Confident	132 Å²	132	62.8 Å²	62.8	81%	0.81	33%	0.327	S	S	*	.	S	Bend	trans	-107	-3.2	179.6	49.5	0	0	0	0	112.7
429	E	77.8	Confident	83.6	Confident	93 Å²	93	64.8 Å²	64.8	44%	0.435	34%	0.339	S	S	.	.	S	Bend	trans	-76.8	161.8	-179.4	-137.8	74.8	167.5	0	0	111.2	T425 T431 I434	T425-E429 HydrophobicContact CG2-CB 3.78Å; T425-E429 HydrophobicContact CG2-CG 3.82Å; E429-T431 PolarHBondContact O-N 3.5Å; E429-I434 HydrophobicContact CB-CD1 4.3Å; E429-I434 HydrophobicContact CB-CG1 4.36Å
430	D	77.2	Confident	83.6	Confident	94 Å²	94	68 Å²	68	50%	0.503	35%	0.354	S	S	.	.			trans	-56.9	127.4	177.9	-172.6	-12.9	0	0	0	111	F432 L433 I434	D430-F432 PolarHBondContact O-N 2.65Å; D430-F432 VanDerWaalsContact O-N 3.12Å; D430-F432 WeakPolarHBondContact OD1-CB 3.36Å; D430-F432 PolarHBondContact OD1-N 2.96Å; D430-L433 HydrophobicContact CB-CB 4.36Å; D430-L433 HydrophobicContact CB-CD1 4.06Å; D430-L433 HydrophobicContact CB-CG 4.1Å; D430-L433 PolarHBondContact O-N 2.98Å; D430-I434 WeakPolarHBondContact O-CG1 3.47Å; D430-I434 PolarHBondContact O-N 3.49Å
431	T	80	Confident	83.5	Confident	64 Å²	64	65 Å²	65	39%	0.393	35%	0.345	S	S	.	.	H	α-helix	trans	-55.8	-28.2	176.3	-53.6	0	0	0	0	111.8	F407 F408 E429 L435	F407-T431 HydrophobicContact CE1-CG2 4.12Å; F408-T431 HydrophobicContact CE1-CG2 4.35Å; F408-T431 HydrophobicContact CE2-CG2 4.43Å; F408-T431 HydrophobicContact CZ-CG2 3.64Å; E429-T431 PolarHBondContact O-N 3.5Å; T431-L435 WeakPolarHBondContact O-CB 3.41Å; T431-L435 PolarHBondContact O-N 3.19Å
432	F	83.1	Confident	83.4	Confident	136 Å²	136	66 Å²	66	60%	0.596	35%	0.351	S	S	*	.	H	α-helix	trans	-70.1	-43.9	173.5	-168.8	-93.6	0	0	0	112.8	D430 I434 L435 E436	D430-F432 PolarHBondContact O-N 2.65Å; D430-F432 VanDerWaalsContact O-N 3.12Å; D430-F432 WeakPolarHBondContact OD1-CB 3.36Å; D430-F432 PolarHBondContact OD1-N 2.96Å; F432-I434 VanDerWaalsContact C-N 3.31Å; F432-I434 PolarHBondContact O-N 3.02Å; F432-L435 WeakPolarHBondContact O-CB 3.16Å; F432-L435 PolarHBondContact O-N 2.74Å; F432-E436 PolarHBondContact O-N 3.5Å
433	L	82.9	Confident	83.3	Confident	72 Å²	72	72 Å²	72	38%	0.377	38%	0.377	S	S	.	.	H	α-helix	trans	-66.8	-34	175.4	-66.9	174.1	0	0	0	111.9	D430 K437	D430-L433 HydrophobicContact CB-CB 4.36Å; D430-L433 HydrophobicContact CB-CD1 4.06Å; D430-L433 HydrophobicContact CB-CG 4.1Å; D430-L433 PolarHBondContact O-N 2.98Å; L433-K437 WeakPolarHBondContact O-CG 3.3Å; L433-K437 PolarHBondContact O-N 2.8Å
434	I	87.1	Confident	83.1	Confident	0 Å²	0	72.8 Å²	72.8	0%	0	38%	0.377	C	S	.	.	H	α-helix	trans	-64.7	-44.7	171.9	-65.3	171.2	0	0	0	110.1	L404 F408 V422 T425 E429 D430 F432 I438	L404-I434 HydrophobicContact CD1-CD1 4.42Å; F408-I434 HydrophobicContact CD2-CG2 4.33Å; F408-I434 HydrophobicContact CE2-CB 4.35Å; F408-I434 HydrophobicContact CE2-CG2 3.48Å; F408-I434 VanDerWaalsContact CE2-CG2 3.48Å; F408-I434 HydrophobicContact CZ-CB 4.29Å; F408-I434 HydrophobicContact CZ-CG2 3.83Å; V422-I434 HydrophobicContact CG2-CG2 3.73Å; T425-I434 HydrophobicContact CG2-CG1 3.84Å; E429-I434 HydrophobicContact CB-CD1 4.3Å; E429-I434 HydrophobicContact CB-CG1 4.36Å; D430-I434 WeakPolarHBondContact O-CG1 3.47Å; D430-I434 PolarHBondContact O-N 3.49Å; F432-I434 VanDerWaalsContact C-N 3.31Å; F432-I434 PolarHBondContact O-N 3.02Å; I434-I438 HydrophobicContact CG2-CD1 3.79Å; I434-I438 WeakPolarHBondContact O-CD1 3.43Å; I434-I438 VanDerWaalsContact O-CG1 3.24Å; I434-I438 WeakPolarHBondContact O-CG1 3.48Å; I434-I438 PolarHBondContact O-N 3.12Å
435	L	87.8	Confident	82.6	Confident	51 Å²	51	70.4 Å²	70.4	27%	0.267	36%	0.355	S	S	.	.	H	α-helix	trans	-62.4	-45.3	176.6	179.7	58.8	0	0	0	112.6	F408 Y413 T431 F432 K437 I438 V439	F408-L435 HydrophobicContact CD1-CD1 4.02Å; F408-L435 HydrophobicContact CE1-CB 3.81Å; F408-L435 HydrophobicContact CE1-CD1 3.87Å; F408-L435 HydrophobicContact CE1-CG 4.33Å; F408-L435 HydrophobicContact CZ-CB 4.31Å; Y413-L435 HydrophobicContact CE2-CD1 3.66Å; T431-L435 WeakPolarHBondContact O-CB 3.41Å; T431-L435 PolarHBondContact O-N 3.19Å; F432-L435 WeakPolarHBondContact O-CB 3.16Å; F432-L435 PolarHBondContact O-N 2.74Å; L435-K437 PolarHBondContact O-N 3.24Å; L435-I438 PolarHBondContact O-N 3.04Å; L435-I438 VanDerWaalsContact O-N 3.16Å; L435-V439 HydrophobicContact CD1-CG2 4.32Å; L435-V439 WeakPolarHBondContact O-CG2 3.39Å; L435-V439 PolarHBondContact O-N 3.33Å
436	E	89.1	Confident	81.9	Confident	113 Å²	113	74.8 Å²	74.8	53%	0.528	37%	0.374	S	S	.	.	H	α-helix	trans	-57.1	-48.2	178.8	-177.3	169.8	-138.7	0	0	111.3	F432 I438 V439 E440	F432-E436 PolarHBondContact O-N 3.5Å; E436-I438 PolarHBondContact O-N 3.14Å; E436-V439 PolarHBondContact O-N 3.46Å; E436-E440 PolarHBondContact O-N 3.41Å
437	K	86.9	Confident	81.2	Confident	84 Å²	84	79.9 Å²	79.9	37%	0.365	39%	0.391	S	S	.	.	H	α-helix	trans	-66.2	-33.8	175.4	-70.5	172	177.7	172.6	0	113.4	V421 T425 L433 L435 V439 E440 E441	V421-K437 HydrophobicContact CG1-CB 3.43Å; V421-K437 VanDerWaalsContact CG1-CB 3.43Å; V421-K437 HydrophobicContact CG1-CD 4.39Å; T425-K437 HydrophobicContact CG2-CD 4.17Å; T425-K437 VanDerWaalsContact CG2-NZ 3.29Å; T425-K437 WeakPolarHBondContact OG1-CD 3.48Å; T425-K437 PolarHBondContact OG1-NZ 2.88Å; L433-K437 WeakPolarHBondContact O-CG 3.3Å; L433-K437 PolarHBondContact O-N 2.8Å; L435-K437 PolarHBondContact O-N 3.24Å; K437-V439 VanDerWaalsContact C-N 3.34Å; K437-E440 PolarHBondContact O-N 3.29Å; K437-E441 VanDerWaalsContact O-CB 3.27Å; K437-E441 WeakPolarHBondContact O-CB 3.32Å; K437-E441 PolarHBondContact O-N 3.41Å
438	I	90.6	Very high	80.5	Confident	0 Å²	0	81.9 Å²	81.9	0%	0	40%	0.403	C	S	.	.	H	α-helix	trans	-63.1	-42.5	172.7	-73.2	163.4	0	0	0	110.2	F408 Y413 V418 V421 I434 L435 E436 T442	F408-I438 HydrophobicContact CB-CD1 4.1Å; F408-I438 HydrophobicContact CD1-CD1 3.98Å; F408-I438 HydrophobicContact CD2-CD1 3.54Å; F408-I438 HydrophobicContact CE1-CD1 4.29Å; F408-I438 HydrophobicContact CE2-CD1 3.88Å; F408-I438 HydrophobicContact CG-CD1 3.59Å; F408-I438 HydrophobicContact CZ-CD1 4.23Å; Y413-I438 HydrophobicContact CD1-CG2 3.46Å; Y413-I438 VanDerWaalsContact CD1-CG2 3.46Å; Y413-I438 HydrophobicContact CD2-CG2 4.17Å; Y413-I438 HydrophobicContact CE1-CG2 3.99Å; Y413-I438 HydrophobicContact CG-CG2 3.57Å; V418-I438 HydrophobicContact CB-CD1 4.41Å; V418-I438 HydrophobicContact CG1-CD1 4.15Å; V418-I438 HydrophobicContact CG2-CD1 4.13Å; V418-I438 HydrophobicContact CG2-CG2 4.27Å; V421-I438 HydrophobicContact CB-CG1 3.81Å; V421-I438 HydrophobicContact CG1-CG1 3.83Å; V421-I438 HydrophobicContact CG2-CG1 4.2Å; I434-I438 HydrophobicContact CG2-CD1 3.79Å; I434-I438 WeakPolarHBondContact O-CD1 3.43Å; I434-I438 VanDerWaalsContact O-CG1 3.24Å; I434-I438 WeakPolarHBondContact O-CG1 3.48Å; I434-I438 PolarHBondContact O-N 3.12Å; L435-I438 PolarHBondContact O-N 3.04Å; L435-I438 VanDerWaalsContact O-N 3.16Å; E436-I438 PolarHBondContact O-N 3.14Å; I438-T442 VanDerWaalsContact O-CB 3.28Å; I438-T442 WeakPolarHBondContact O-CB 3.14Å; I438-T442 PolarHBondContact O-N 2.88Å; I438-T442 PolarHBondContact O-OG1 2.99Å
439	V	88.1	Confident	79.6	Confident	42 Å²	42	80.3 Å²	80.3	26%	0.255	40%	0.396	S	S	.	.	H	α-helix	trans	-66.7	-40.1	177	170.9	0	0	0	0	111.5	Y413 L435 E436 K437 K443	Y413-V439 HydrophobicContact CE1-CG2 3.93Å; Y413-V439 WeakPolarHBondContact OH-CG2 3.14Å; L435-V439 HydrophobicContact CD1-CG2 4.32Å; L435-V439 WeakPolarHBondContact O-CG2 3.39Å; L435-V439 PolarHBondContact O-N 3.33Å; E436-V439 PolarHBondContact O-N 3.46Å; K437-V439 VanDerWaalsContact C-N 3.34Å; V439-K443 HydrophobicContact CG1-CD 4.24Å; V439-K443 WeakPolarHBondContact O-CD 3.4Å; V439-K443 VanDerWaalsContact O-CG 3.28Å; V439-K443 WeakPolarHBondContact O-CG 3.25Å; V439-K443 PolarHBondContact O-N 3.37Å
440	E	87.6	Confident	78.4	Confident	125 Å²	125	82.2 Å²	82.2	58%	0.584	40%	0.403	S	S	*	.	H	α-helix	trans	-65.8	-50.1	176	-170	-179.6	-164.3	0	0	112.2	E436 K437 T442 K443 R444	E436-E440 PolarHBondContact O-N 3.41Å; K437-E440 PolarHBondContact O-N 3.29Å; E440-T442 VanDerWaalsContact C-N 3.32Å; E440-T442 PolarHBondContact O-N 2.77Å; E440-K443 WeakPolarHBondContact O-CB 3.33Å; E440-K443 PolarHBondContact O-N 2.8Å; E440-R444 PolarHBondContact O-N 3.04Å
441	E	85.6	Confident	77.1	Confident	45 Å²	45	82 Å²	82	21%	0.21	41%	0.405	C	S	.	.	H	α-helix	trans	-65.8	-34.3	-179.7	-173.4	73.4	164.6	0	0	111.9	V417 R420 V421 K437 R444 C445	V417-E441 HydrophobicContact CG1-CB 3.96Å; V417-E441 HydrophobicContact CG1-CG 3.8Å; R420-E441 VanDerWaalsContact CD-OE1 3.26Å; R420-E441 WeakPolarHBondContact CD-OE1 3.47Å; R420-E441 IonicContact CZ-OE1 3.18Å; R420-E441 IonicContact NE-OE1 2.71Å; R420-E441 IonicContact NH1-OE1 3.89Å; R420-E441 PolarHBondContact NH1-OE1 3.08Å; V421-E441 HydrophobicContact CG2-CB 3.85Å; V421-E441 HydrophobicContact CG2-CG 4.06Å; K437-E441 VanDerWaalsContact O-CB 3.27Å; K437-E441 WeakPolarHBondContact O-CB 3.32Å; K437-E441 PolarHBondContact O-N 3.41Å; E441-R444 WeakPolarHBondContact O-CB 3.17Å; E441-R444 PolarHBondContact O-N 3.01Å; E441-R444 WeakPolarHBondContact OE2-CD 3.46Å; E441-R444 IonicContact OE2-NE 3.96Å; E441-C445 PolarHBondContact O-N 3.44Å; E441-C445 PolarHBondContact O-SG 3.35Å
442	T	85.2	Confident	75.4	Confident	31 Å²	31	81 Å²	81	19%	0.19	41%	0.407	C	S	.	.	H	α-helix	trans	-62.6	-46.1	172.4	-57.6	0	0	0	0	110.9	I438 E440 R444 C445 E446	I438-T442 VanDerWaalsContact O-CB 3.28Å; I438-T442 WeakPolarHBondContact O-CB 3.14Å; I438-T442 PolarHBondContact O-N 2.88Å; I438-T442 PolarHBondContact O-OG1 2.99Å; E440-T442 VanDerWaalsContact C-N 3.32Å; E440-T442 PolarHBondContact O-N 2.77Å; T442-R444 VanDerWaalsContact C-N 3.33Å; T442-R444 PolarHBondContact O-N 2.84Å; T442-C445 PolarHBondContact O-N 3.11Å; T442-E446 PolarHBondContact O-N 3.26Å
443	K	84.5	Confident	73.5	Confident	126 Å²	126	80.9 Å²	80.9	55%	0.548	41%	0.413	S	S	.	.	H	α-helix	trans	-63.3	-36.4	176.4	-72.6	166.8	-178.1	172.2	0	112.4	V439 E440 E446 Q447	V439-K443 HydrophobicContact CG1-CD 4.24Å; V439-K443 WeakPolarHBondContact O-CD 3.4Å; V439-K443 VanDerWaalsContact O-CG 3.28Å; V439-K443 WeakPolarHBondContact O-CG 3.25Å; V439-K443 PolarHBondContact O-N 3.37Å; E440-K443 WeakPolarHBondContact O-CB 3.33Å; E440-K443 PolarHBondContact O-N 2.8Å; K443-E446 PolarHBondContact O-N 3.24Å; K443-Q447 WeakPolarHBondContact O-CG 2.92Å; K443-Q447 PolarHBondContact O-N 2.97Å
444	R	80.8	Confident	71.6	Confident	139 Å²	139	87.1 Å²	87.1	53%	0.525	43%	0.431	S	S	.	.	H	α-helix	trans	-59.9	-53.9	172.7	175.9	-176.1	-71.4	-82.2	0.6	110.9	E440 E441 T442 E446 Q447 D448	E440-R444 PolarHBondContact O-N 3.04Å; E441-R444 WeakPolarHBondContact O-CB 3.17Å; E441-R444 PolarHBondContact O-N 3.01Å; E441-R444 WeakPolarHBondContact OE2-CD 3.46Å; E441-R444 IonicContact OE2-NE 3.96Å; T442-R444 VanDerWaalsContact C-N 3.33Å; T442-R444 PolarHBondContact O-N 2.84Å; R444-E446 VanDerWaalsContact C-N 3.28Å; R444-E446 PolarHBondContact O-N 2.87Å; R444-Q447 PolarHBondContact O-N 3.38Å; R444-D448 PolarHBondContact O-N 3.34Å
445	C	70.8	Confident	69.3	Low	36 Å²	36	95 Å²	95	24%	0.243	47%	0.469	C	S	.	.	H	α-helix	trans	-59.4	-37.8	178.9	-69.1	0	0	0	0	112.5	E441 T442 Q447 D448 C449	E441-C445 PolarHBondContact O-N 3.44Å; E441-C445 PolarHBondContact O-SG 3.35Å; T442-C445 PolarHBondContact O-N 3.11Å; C445-Q447 VanDerWaalsContact C-N 3.26Å; C445-Q447 PolarHBondContact O-N 3.46Å; C445-D448 PolarHBondContact O-N 2.93Å; C445-C449 PolarHBondContact O-N 2.94Å; C445-C449 PolarHBondContact O-SG 3.49Å; C445-C449 VanDerWaalsContact O-SG 3.37Å
446	E	69.9	Low	67.1	Low	110 Å²	110	103.8 Å²	103.8	51%	0.514	50%	0.498	S	S	.	.	H	α-helix	trans	-65.6	-22.3	173.5	-81.6	-166.9	-155.8	0	0	115.1	T442 K443 R444 K450	T442-E446 PolarHBondContact O-N 3.26Å; K443-E446 PolarHBondContact O-N 3.24Å; R444-E446 VanDerWaalsContact C-N 3.28Å; R444-E446 PolarHBondContact O-N 2.87Å; E446-K450 VanDerWaalsContact O-CD 3.27Å; E446-K450 WeakPolarHBondContact O-CD 3.21Å; E446-K450 WeakPolarHBondContact O-CE 3.36Å; E446-K450 WeakPolarHBondContact O-CG 3.38Å; E446-K450 PolarHBondContact O-NZ 2.92Å; E446-K450 VanDerWaalsContact O-NZ 3.07Å; E446-K450 IonicContact OE2-NZ 3.97Å
447	Q	61.8	Low	64.8	Low	133 Å²	133	109.1 Å²	109.1	62%	0.621	51%	0.513	S	S	*	.	H	α-helix	trans	-86	-42.8	174.6	-74.2	-177.6	-6.2	0	0	111.2	K443 R444 C445 C449 K450 V451	K443-Q447 WeakPolarHBondContact O-CG 2.92Å; K443-Q447 PolarHBondContact O-N 2.97Å; R444-Q447 PolarHBondContact O-N 3.38Å; C445-Q447 VanDerWaalsContact C-N 3.26Å; C445-Q447 PolarHBondContact O-N 3.46Å; Q447-C449 VanDerWaalsContact C-N 3.28Å; Q447-C449 PolarHBondContact O-N 2.86Å; Q447-K450 WeakPolarHBondContact O-CA 3.39Å; Q447-K450 WeakPolarHBondContact O-CB 3.42Å; Q447-K450 PolarHBondContact O-N 3.44Å; Q447-V451 PolarHBondContact O-N 3.31Å
448	D	59.5	Low	62.5	Low	93 Å²	93	112.9 Å²	112.9	50%	0.497	53%	0.534	S	S	.	.	H	α-helix	trans	-58.7	-40.2	177.8	-67.7	-35.2	0	0	0	111.6	R444 C445 K450 V451 G452	R444-D448 PolarHBondContact O-N 3.34Å; C445-D448 PolarHBondContact O-N 2.93Å; D448-K450 PolarHBondContact O-N 2.94Å; D448-V451 PolarHBondContact O-N 2.62Å; D448-V451 VanDerWaalsContact O-N 3.16Å; D448-G452 PolarHBondContact O-N 3.48Å
449	C	54.9	Low	59.7	Low	99 Å²	99	120.9 Å²	120.9	67%	0.669	58%	0.577	S	S	*	*	H	α-helix	trans	-59.4	-28.4	172.3	-70.5	0	0	0	0	114	C445 Q447	C445-C449 PolarHBondContact O-N 2.94Å; C445-C449 PolarHBondContact O-SG 3.49Å; C445-C449 VanDerWaalsContact O-SG 3.37Å; Q447-C449 VanDerWaalsContact C-N 3.28Å; Q447-C449 PolarHBondContact O-N 2.86Å
450	K	53.2	Low	57.1	Low	133 Å²	133	124.8 Å²	124.8	58%	0.578	61%	0.606	S	S	*	*	H	α-helix	trans	-87.3	-14.1	179.7	-67.2	168.1	-173.7	130.2	0	112.9	E446 Q447 D448	E446-K450 VanDerWaalsContact O-CD 3.27Å; E446-K450 WeakPolarHBondContact O-CD 3.21Å; E446-K450 WeakPolarHBondContact O-CE 3.36Å; E446-K450 WeakPolarHBondContact O-CG 3.38Å; E446-K450 PolarHBondContact O-NZ 2.92Å; E446-K450 VanDerWaalsContact O-NZ 3.07Å; E446-K450 IonicContact OE2-NZ 3.97Å; Q447-K450 WeakPolarHBondContact O-CA 3.39Å; Q447-K450 WeakPolarHBondContact O-CB 3.42Å; Q447-K450 PolarHBondContact O-N 3.44Å; D448-K450 PolarHBondContact O-N 2.94Å
451	V	49.6	Very low	54.5	Low	89 Å²	89	125.3 Å²	125.3	54%	0.539	62%	0.617	S	S	.	*	H	α-helix	trans	-85.2	-44.1	174.6	177.3	0	0	0	0	111	Q447 D448 D453 R454 E455	Q447-V451 PolarHBondContact O-N 3.31Å; D448-V451 PolarHBondContact O-N 2.62Å; D448-V451 VanDerWaalsContact O-N 3.16Å; V451-D453 VanDerWaalsContact C-N 3.28Å; V451-D453 PolarHBondContact O-N 3.26Å; V451-R454 PolarHBondContact O-N 3.4Å; V451-E455 PolarHBondContact O-N 3.17Å
452	G	44.2	Very low	51.7	Low	43 Å²	43	133.2 Å²	133.2	44%	0.443	65%	0.645	S	S	.	*	H	α-helix	trans	-57.6	-33.8	-176.2	0	0	0	0	0	115.1	D448 R454	D448-G452 PolarHBondContact O-N 3.48Å; G452-R454 VanDerWaalsContact C-N 3.33Å; G452-R454 PolarHBondContact O-N 2.98Å
453	D	43.9	Very low	49.9	Very low	134 Å²	134	137.7 Å²	137.7	72%	0.717	68%	0.675	S	S	*	*	H	α-helix	trans	-75.6	-16.7	177.7	-103.7	-9	0	0	0	114.1	V451	V451-D453 VanDerWaalsContact C-N 3.28Å; V451-D453 PolarHBondContact O-N 3.26Å
454	R	43.2	Very low	47.3	Very low	203 Å²	203	135.5 Å²	135.5	77%	0.766	68%	0.68	S	S	*	*	H	α-helix	trans	-82	-40.4	175	-77.1	-173.2	167.1	-167.1	-3.3	112.2	V451 G452 R456 R457	V451-R454 PolarHBondContact O-N 3.4Å; G452-R454 VanDerWaalsContact C-N 3.33Å; G452-R454 PolarHBondContact O-N 2.98Å; R454-R456 VanDerWaalsContact C-N 3.32Å; R454-R456 PolarHBondContact O-N 3.05Å; R454-R457 PolarHBondContact O-N 3.42Å; R454-R457 VanDerWaalsContact O-N 3.14Å
455	E	38.6	Very low	44.8	Very low	167 Å²	167	135.9 Å²	135.9	78%	0.78	69%	0.693	S	S	*	*	H	α-helix	trans	-68.6	-29.4	-172.9	-162.3	166.4	-147.9	0	0	112.8	V451 R457	V451-E455 PolarHBondContact O-N 3.17Å; E455-R457 VanDerWaalsContact C-N 3.27Å; E455-R457 PolarHBondContact O-N 3.03Å
456	R	41	Very low	42.9	Very low	235 Å²	235	140.1 Å²	140.1	89%	0.887	72%	0.718	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.2	-8.9	173.6	-88.6	-173.7	174.4	177.9	0.5	115.5	R454	R454-R456 VanDerWaalsContact C-N 3.32Å; R454-R456 PolarHBondContact O-N 3.05Å
457	R	42.1	Very low	40.9	Very low	224 Å²	224	141.9 Å²	141.9	85%	0.845	73%	0.73	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109.7	7	-170.1	-146	172.6	-177.8	179.4	0.1	115.2	R454 E455	R454-R457 PolarHBondContact O-N 3.42Å; R454-R457 VanDerWaalsContact O-N 3.14Å; E455-R457 VanDerWaalsContact C-N 3.27Å; E455-R457 PolarHBondContact O-N 3.03Å
458	M	36.8	Very low	39.2	Very low	164 Å²	164	140.8 Å²	140.8	81%	0.808	74%	0.736	S	S	*	*			trans	-111.5	64.2	178	-70.3	-177	61.1	0	0	112.6
459	N	33.6	Very low	37.7	Very low	168 Å²	168	141.1 Å²	141.1	90%	0.898	75%	0.745	S	S	*	*			trans	-155.2	64.8	170.9	-108.9	-28.7	0	0	0	113.8
460	S	31.9	Very low	36.5	Very low	124 Å²	124	141.9 Å²	141.9	87%	0.867	75%	0.752	S	S	*	*			trans	-162.1	154.9	149.3	-163.6	0	0	0	0	109.6
461	V	33.4	Very low	35.4	Very low	135 Å²	135	140.3 Å²	140.3	82%	0.818	76%	0.758	S	S	*	*			trans	-122.2	153	-162.4	178.4	0	0	0	0	113.2
462	R	28	Very low	34.4	Very low	212 Å²	212	140.6 Å²	140.6	80%	0.8	76%	0.763	S	S	*	*			trans	-38.9	162	167	-72.5	180	177.7	-173.9	-0.8	115
463	P	46.8	Very low	33.7	Very low	125 Å²	125	143.2 Å²	143.2	81%	0.812	78%	0.775	S	S	*	*			cis	-130.3	-156.9	33.2	36.7	-13.4	0	0	0	113.4
464	A	30.2	Very low	32.9	Very low	80 Å²	80	142.3 Å²	142.3	66%	0.661	78%	0.779	S	S	*	*			cis	-158.7	156.9	12.1	0	0	0	0	0	115.7
465	D	28.2	Very low	32.3	Very low	146 Å²	146	138.4 Å²	138.4	78%	0.781	78%	0.783	S	S	*	*				59.7	98.1	128.6	-65.7	9.3	0	0	0	125.1
466	T	30.6	Very low	31.9	Very low	125 Å²	125	136 Å²	136	77%	0.767	79%	0.785	S	S	*	*				83.2	146.9	125.5	9	0	0	0	0	126
467	L	28.3	Very low	31.2	Very low	148 Å²	148	129.5 Å²	129.5	78%	0.775	78%	0.775	S	S	*	*			trans	85.9	91.9	149.6	-75.1	165.2	0	0	0	122.2
468	C	25.5	Very low	30.6	Very low	109 Å²	109	123.8 Å²	123.8	74%	0.736	77%	0.77	S	S	*	*				67.6	122.9	118.6	-79.1	0	0	0	0	124.4
469	S	28.4	Very low	30.1	Very low	101 Å²	101	120.8 Å²	120.8	71%	0.706	77%	0.765	S	S	*	*				95.6	128.5	127.9	-65.2	0	0	0	0	121.5
470	S	29.6	Very low	29.7	Very low	115 Å²	115	118.1 Å²	118.1	80%	0.804	76%	0.759	S	S	*	*			trans	63.6	140.3	157.1	38.5	0	0	0	0	118.8
471	S	30	Very low	29.8	Very low	100 Å²	100	118.3 Å²	118.3	70%	0.699	76%	0.76	S	S	*	*			cis	-165.5	170.2	-10	50.8	0	0	0	0	111.6
472	S	29.1	Very low	29.5	Very low	94 Å²	94	116.1 Å²	116.1	66%	0.657	76%	0.756	S	S	*	*			trans	61.7	121.6	146.6	55.1	0	0	0	0	120.7
473	S	28.4	Very low	29.4	Very low	99 Å²	99	111.1 Å²	111.1	69%	0.692	75%	0.754	S	S	*	*			trans	49	100	143.4	57.4	0	0	0	0	118.6
474	S	27.5	Very low	28.4	Very low	115 Å²	115	110.5 Å²	110.5	80%	0.804	75%	0.753	S	S	*	*				74.7	87.8	70.8	76.8	0	0	0	0	115.9
475	S	30.2	Very low	28.1	Very low	120 Å²	120	114.8 Å²	114.8	84%	0.839	76%	0.761	S	S	*	*			trans	-159.4	146.8	132.5	53.9	0	0	0	0	109.7	S477	S475-S477 PolarHBondContact O-N 3.2Å
476	S	30.2	Very low	27.8	Very low	118 Å²	118	113.8 Å²	113.8	83%	0.825	76%	0.761	S	S	*	*			trans	-66.3	127.8	179.1	38	0	0	0	0	112.4	S478	S476-S478 PolarHBondContact O-N 3.49Å
477	S	27.5	Very low	27.5	Very low	97 Å²	97	112.4 Å²	112.4	68%	0.678	76%	0.756	S	S	*	*			trans	-54.9	129.5	157	53.2	0	0	0	0	109	S475	S475-S477 PolarHBondContact O-N 3.2Å
478	S	27.9	Very low	27.3	Very low	105 Å²	105	115.2 Å²	115.2	73%	0.734	76%	0.756	S	S	*	*				38.8	128.3	83.6	72.3	0	0	0	0	113	S476	S476-S478 PolarHBondContact O-N 3.49Å
479	S	26.6	Very low	27.2	Very low	101 Å²	101	117.6 Å²	117.6	71%	0.706	75%	0.754	S	S	*	*			cis	-153.6	132.6	39.2	59.4	0	0	0	0	111.7
480	S	26.7	Very low	26.9	Very low	111 Å²	111	121.8 Å²	121.8	78%	0.776	76%	0.755	S	S	*	*				90.3	131.2	97.2	70.9	0	0	0	0	116
481	S	32.7	Very low	26.7	Very low	128 Å²	128	122.5 Å²	122.5	90%	0.895	75%	0.745	S	S	*	*			trans	-101.3	130.8	179.7	-45.5	0	0	0	0	113
482	A	27.4	Very low	26.6	Very low	89 Å²	89	125.4 Å²	125.4	74%	0.736	75%	0.745	S	S	*	*			trans	-171.9	137.8	161.3	0	0	0	0	0	108
483	S	26.7	Very low	26.5	Very low	107 Å²	107	127.5 Å²	127.5	75%	0.748	75%	0.745	S	S	*	*			cis	92	132.5	26.2	80.8	0	0	0	0	115.2
484	S	24.7	Very low	26.4	Very low	112 Å²	112	130.5 Å²	130.5	78%	0.783	75%	0.752	S	S	*	*			trans	68	125.3	-179.3	-79.5	0	0	0	0	115.5
485	M	24	Very low	26.4	Very low	171 Å²	171	128.2 Å²	128.2	84%	0.842	75%	0.747	S	S	*	*				87.6	118.7	64.5	-81.4	-158.9	172.6	0	0	114.9
486	T	23	Very low	26.2	Very low	125 Å²	125	129.8 Å²	129.8	77%	0.767	75%	0.746	S	S	*	*			trans	47.8	104.6	152	49.2	0	0	0	0	121.3
487	S	23.6	Very low	26.1	Very low	96 Å²	96	129.1 Å²	129.1	67%	0.671	74%	0.742	S	S	*	*				97.8	133.3	115.6	83.6	0	0	0	0	121.1
488	R	23.8	Very low	26.2	Very low	207 Å²	207	127.7 Å²	127.7	78%	0.781	74%	0.742	S	S	*	*			trans	68.4	160.9	165.3	-44.7	178.2	-172.6	164.3	3.2	113.4
489	F	22.6	Very low	26.4	Very low	159 Å²	159	134.1 Å²	134.1	70%	0.697	75%	0.75	S	S	*	*			cis	-144.2	160.6	16.2	-106.3	-68.1	0	0	0	112.1
490	R	23.5	Very low	26.6	Very low	189 Å²	189	134.2 Å²	134.2	71%	0.713	75%	0.75	S	S	*	*			trans	19.5	155.3	133.4	-77.9	179.7	119.4	-165.8	-7.5	120.6
491	E	25	Very low	26.9	Very low	130 Å²	130	137.5 Å²	137.5	61%	0.607	75%	0.751	S	S	*	*			cis	174.4	161.4	-2.7	169.2	172.9	-99.6	0	0	109.1
492	K	27.5	Very low	26.8	Very low	160 Å²	160	138.3 Å²	138.3	70%	0.696	74%	0.74	S	S	*	*			trans	146.5	136	157.4	-87	176.3	163.7	-73.5	0	109.3
493	E	26.1	Very low	26.9	Very low	138 Å²	138	140.1 Å²	140.1	65%	0.645	74%	0.738	S	S	*	*			cis	-161.1	165.3	-5.2	-130.1	150	-166.9	0	0	107.4
494	L	27.6	Very low	27.2	Very low	162 Å²	162	142 Å²	142	85%	0.848	74%	0.738	S	S	*	*			cis	-106.8	-125.3	5.2	-56.1	80.7	0	0	0	110.8
495	G	26.7	Very low	27.5	Very low	68 Å²	68	145.9 Å²	145.9	70%	0.701	74%	0.741	S	S	*	*			cis	85.6	138	6.6	0	0	0	0	0	114.1
496	D	26.5	Very low	28.9	Very low	152 Å²	152	142.8 Å²	142.8	81%	0.813	73%	0.733	S	S	*	*			cis	-132.9	153.1	-4.3	-159.5	49.7	0	0	0	108.4
497	S	28.5	Very low	29.1	Very low	105 Å²	105	141.9 Å²	141.9	73%	0.734	73%	0.732	S	S	*	*			cis	-165.1	172.8	41.1	-155.7	0	0	0	0	113.8
498	G	29.7	Very low	29.3	Very low	66 Å²	66	144.8 Å²	144.8	68%	0.68	74%	0.735	S	S	*	*			trans	125.5	40	145.9	0	0	0	0	0	124.1
499	R	31.4	Very low	29.3	Very low	241 Å²	241	145.7 Å²	145.7	91%	0.909	74%	0.738	S	S	*	*			trans	47.3	107.7	147.7	-78.9	-175.4	168.2	-171.9	-3.5	123.4
500	S	31.9	Very low	29.4	Very low	102 Å²	102	142.3 Å²	142.3	71%	0.713	75%	0.748	S	S	*	*				71.2	132.1	117.8	71.2	0	0	0	0	126.7
501	K	31.2	Very low	29.5	Very low	181 Å²	181	136.7 Å²	136.7	79%	0.787	75%	0.749	S	S	*	*			trans	98	114.6	131.1	-101.3	176	173	-93.2	0	123.9
502	E	31.5	Very low	29.7	Very low	144 Å²	144	136.9 Å²	136.9	67%	0.673	77%	0.765	S	S	*	*				85.6	127.4	129.9	-111.4	169.1	127	0	0	126.3
503	N	29	Very low	29.9	Very low	127 Å²	127	134 Å²	134	68%	0.679	77%	0.765	S	S	*	*			trans	37.6	116.1	149.7	-71.8	-24.1	0	0	0	125.9
504	I	34	Very low	30.2	Very low	146 Å²	146	134 Å²	134	75%	0.749	77%	0.769	S	S	*	*				50.5	114.8	123.7	-53.7	174.8	0	0	0	120.8
505	K	30.8	Very low	30.3	Very low	195 Å²	195	129 Å²	129	85%	0.848	76%	0.758	S	S	*	*			trans	24	155.3	141.5	-73.4	-174.7	177	-180	0	121.9
506	P	53.9	Low	30.7	Very low	106 Å²	106	134 Å²	134	69%	0.688	77%	0.767	S	S	*	*			cis	-145.6	178.3	-27.5	41.6	-23.4	0	0	0	116.5
507	S	25.8	Very low	30.8	Very low	105 Å²	105	129.5 Å²	129.5	73%	0.734	76%	0.757	S	S	*	*			trans	89	145.8	142.6	83.9	0	0	0	0	123.8
508	Q	27.5	Very low	31	Very low	157 Å²	157	132 Å²	132	73%	0.734	76%	0.757	S	S	*	*			trans	71.6	129.3	154.6	-67.8	-152.1	64.3	0	0	125
509	R	25.5	Very low	30.9	Very low	227 Å²	227	138.6 Å²	138.6	86%	0.857	76%	0.761	S	S	*	*			trans	59.3	115.4	138.5	-70.9	-176.3	174	-131.2	-3.3	123
510	G	23.8	Very low	30.9	Very low	87 Å²	87	135.9 Å²	135.9	90%	0.897	75%	0.751	S	S	*	*			trans	80.6	156	139.6	0	0	0	0	0	117.7
511	G	25.9	Very low	30.8	Very low	72 Å²	72	139.7 Å²	139.7	74%	0.742	75%	0.754	S	S	*	*			cis	156	134.5	-10.4	0	0	0	0	0	113.4
512	S	28.3	Very low	30.5	Very low	133 Å²	133	136.7 Å²	136.7	93%	0.93	76%	0.755	S	S	*	*			trans	66.4	148.8	178.3	-76.1	0	0	0	0	116.5
513	S	31.5	Very low	30.2	Very low	101 Å²	101	135.4 Å²	135.4	71%	0.706	76%	0.762	S	S	*	*			cis	-152.8	-175	-7.2	69.9	0	0	0	0	108.7
514	N	32.2	Very low	30	Very low	136 Å²	136	132.3 Å²	132.3	73%	0.727	76%	0.76	S	S	*	*			cis	-132.2	-136.7	10	-136	-84.3	0	0	0	109
515	G	30	Very low	29.7	Very low	59 Å²	59	130.3 Å²	130.3	61%	0.608	76%	0.759	S	S	*	*			cis	95.4	140.3	3.1	0	0	0	0	0	114.6
516	L	35.7	Very low	29.6	Very low	171 Å²	171	129.3 Å²	129.3	90%	0.895	76%	0.757	S	S	*	*			cis	-144.3	154.6	-3.6	-68.2	170.4	0	0	0	109.3
517	G	29.1	Very low	28.2	Very low	58 Å²	58	131 Å²	131	60%	0.598	77%	0.766	S	S	*	*			cis	166.5	-160.4	-1.5	0	0	0	0	0	111.8
518	H	31.9	Very low	28.4	Very low	158 Å²	158	130.9 Å²	130.9	73%	0.731	77%	0.765	S	S	*	*			trans	73.9	133.9	176.7	-68.6	80.1	0	0	0	116.9
519	R	28.1	Very low	28.4	Very low	204 Å²	204	129.5 Å²	129.5	77%	0.77	77%	0.767	S	S	*	*			cis	-153.7	112.3	-4.6	-157.3	176	-165.3	-163.7	5	111.9
520	R	31.8	Very low	28.5	Very low	185 Å²	185	125.9 Å²	125.9	70%	0.698	76%	0.76	S	S	*	*				37	141.9	127.2	-79.9	178.8	-77.2	-175.5	-5.8	120
521	K	28.6	Very low	28.6	Very low	181 Å²	181	130 Å²	130	79%	0.787	76%	0.756	S	S	*	*			cis	-140.1	150	17.3	-65.3	-174.2	-179.2	178.9	0	110.5
522	C	25.8	Very low	28.6	Very low	119 Å²	119	130.8 Å²	130.8	80%	0.804	76%	0.756	S	S	*	*				53.9	145.2	74.6	-35.3	0	0	0	0	113.5
523	S	26.1	Very low	28.6	Very low	116 Å²	116	132.6 Å²	132.6	81%	0.811	75%	0.753	S	S	*	*			cis	-160	175.5	10	-149.9	0	0	0	0	108
524	G	24.6	Very low	28.5	Very low	63 Å²	63	133.2 Å²	133.2	65%	0.649	75%	0.753	S	S	*	*			cis	91.7	125.2	8.7	0	0	0	0	0	113.1
525	S	27.2	Very low	28.2	Very low	103 Å²	103	133.8 Å²	133.8	72%	0.72	75%	0.754	S	S	*	*			cis	-172.2	152	1.2	45.7	0	0	0	0	110.3
526	E	27.9	Very low	28.1	Very low	175 Å²	175	139.5 Å²	139.5	82%	0.818	76%	0.763	S	S	*	*			trans	59.4	175.1	155.6	-66	-173.1	127.6	0	0	121.9
527	T	25.8	Very low	27.8	Very low	141 Å²	141	143 Å²	143	87%	0.865	76%	0.764	S	S	*	*			trans	77.5	158.1	171.3	72.6	0	0	0	0	118.9
528	S	29.1	Very low	27.6	Very low	103 Å²	103	146.4 Å²	146.4	72%	0.72	78%	0.778	S	S	*	*			cis	171.6	97	-47.1	165.7	0	0	0	0	109.9
529	T	27	Very low	27.4	Very low	127 Å²	127	144.5 Å²	144.5	78%	0.779	78%	0.783	S	S	*	*			trans	-168.6	157.8	174.2	25.1	0	0	0	0	109.2
530	Q	27.4	Very low	27.4	Very low	152 Å²	152	140.6 Å²	140.6	71%	0.71	79%	0.787	S	S	*	*			cis	-167	156.7	-34.2	-122.5	-178.6	18.9	0	0	107.2
531	Q	26	Very low	27.2	Very low	172 Å²	172	135.5 Å²	135.5	80%	0.804	79%	0.785	S	S	*	*			trans	61.3	128	152.3	-64.4	176.9	8.1	0	0	121.4
532	A	27.2	Very low	27.2	Very low	90 Å²	90	135.9 Å²	135.9	74%	0.744	79%	0.789	S	S	*	*			trans	-64.8	159.2	174.2	0	0	0	0	0	115.8
533	I	27.9	Very low	27.2	Very low	170 Å²	170	133.7 Å²	133.7	87%	0.872	79%	0.787	S	S	*	*			trans	-128.1	132.9	147.1	-74.2	172.6	0	0	0	108.2
534	T	29	Very low	27.3	Very low	115 Å²	115	132.1 Å²	132.1	71%	0.706	79%	0.789	S	S	*	*			trans	-101.9	156.5	170.8	54.3	0	0	0	0	110.5
535	I	27	Very low	27.5	Very low	147 Å²	147	134.3 Å²	134.3	75%	0.754	80%	0.8	S	S	*	*			trans	-176.8	135.5	135	-100.7	154	0	0	0	113.4
536	K	26.2	Very low	27.7	Very low	180 Å²	180	132.4 Å²	132.4	78%	0.783	80%	0.798	S	S	*	*			trans	33	130.7	153.3	-55.4	172	-173.3	174.3	0	120
537	R	29.3	Very low	27.7	Very low	244 Å²	244	131.8 Å²	131.8	92%	0.921	80%	0.8	S	S	*	*				59.7	108.6	55.6	-79.6	-168.2	172	179.2	-1.7	116.2
538	S	26	Very low	28	Very low	129 Å²	129	135.1 Å²	135.1	90%	0.902	80%	0.798	S	S	*	*			trans	-158.7	160.6	139.6	47.9	0	0	0	0	109.7
539	S	27.9	Very low	28	Very low	119 Å²	119	138.9 Å²	138.9	83%	0.832	80%	0.804	S	S	*	*			trans	-154.3	138.5	-167.7	51.2	0	0	0	0	112.5
540	S	26.8	Very low	28.1	Very low	121 Å²	121	138.8 Å²	138.8	85%	0.846	80%	0.803	S	S	*	*			trans	-177.2	167.4	168.8	48.3	0	0	0	0	109.6
541	A	27.8	Very low	28.3	Very low	79 Å²	79	139.5 Å²	139.5	65%	0.653	81%	0.81	S	S	*	*			cis	-169.9	165.2	-38.1	0	0	0	0	0	108.2
542	Q	28.3	Very low	28.4	Very low	189 Å²	189	137.1 Å²	137.1	88%	0.883	81%	0.807	S	S	*	*			trans	63.3	138.3	177.4	-95.6	70.8	-1.9	0	0	117.3
543	G	27.2	Very low	28.6	Very low	73 Å²	73	140.1 Å²	140.1	75%	0.753	81%	0.809	S	S	*	*			cis	163.7	129.9	-14.6	0	0	0	0	0	115.4
544	G	27.4	Very low	28.6	Very low	82 Å²	82	139.7 Å²	139.7	85%	0.845	81%	0.809	S	S	*	*			trans	72.1	160.8	166.2	0	0	0	0	0	116.9
545	A	29.2	Very low	29.3	Very low	109 Å²	109	140.8 Å²	140.8	90%	0.901	81%	0.81	S	S	*	*			cis	-162.6	153.8	-19.6	0	0	0	0	0	108.3
546	G	30.7	Very low	29.9	Very low	64 Å²	64	141.3 Å²	141.3	66%	0.66	82%	0.815	S	S	*	*			cis	175.9	-179.6	-5.6	0	0	0	0	0	113.5
547	N	29.4	Very low	30.5	Very low	162 Å²	162	138.7 Å²	138.7	87%	0.866	81%	0.81	S	S	*	*			trans	60.8	132.3	156.2	-60	16.3	0	0	0	121.2
548	Y	31.5	Very low	30.6	Very low	211 Å²	211	132.7 Å²	132.7	83%	0.827	80%	0.796	S	S	*	*			trans	-148.1	139.1	175.6	32.6	-100.6	0	0	0	107.5
549	E	28.3	Very low	30.8	Very low	181 Å²	181	132.9 Å²	132.9	85%	0.846	79%	0.785	S	S	*	*			trans	-160.8	123.3	162.8	-109.5	165	174.6	0	0	104.6
550	V	29.9	Very low	31	Very low	125 Å²	125	134.1 Å²	134.1	76%	0.758	78%	0.781	S	S	*	*				62.6	96.1	53.4	-173.1	0	0	0	0	110.7
551	I	30.5	Very low	32.1	Very low	167 Å²	167	133.1 Å²	133.1	86%	0.856	77%	0.772	S	S	*	*			trans	-120.3	128.9	168.8	-63.1	177.9	0	0	0	107.2
552	T	28	Very low	32	Very low	122 Å²	122	135.7 Å²	135.7	75%	0.748	78%	0.779	S	S	*	*			trans	-96.7	159.1	174.7	42.6	0	0	0	0	111.5
553	I	32.3	Very low	32	Very low	153 Å²	153	132 Å²	132	79%	0.785	77%	0.774	S	S	*	*			trans	-78.1	143.5	176	-57.4	164.6	0	0	0	109.4
554	D	27.8	Very low	32.1	Very low	161 Å²	161	132.6 Å²	132.6	86%	0.861	77%	0.772	S	S	*	*			trans	-135.5	139.6	163.5	-121.6	-42.2	0	0	0	107.8
555	D	43.7	Very low	32.2	Very low	138 Å²	138	137.7 Å²	137.7	74%	0.738	77%	0.771	S	S	*	*			trans	-156.7	114.7	-170.7	-127	-23.3	0	0	0	108.2
556	D	38.9	Very low	32.2	Very low	159 Å²	159	138.9 Å²	138.9	85%	0.85	77%	0.768	S	S	*	*			trans	-175.4	93	161.7	-109	-18.5	0	0	0	113
557	D	39.7	Very low	32.2	Very low	125 Å²	125	139.4 Å²	139.4	67%	0.668	77%	0.766	S	S	*	*				58.8	154.8	113.5	-144.1	21	0	0	0	125.4
558	N	30.7	Very low	32.1	Very low	118 Å²	118	139.9 Å²	139.9	63%	0.631	77%	0.768	S	S	*	*			trans	80.6	135.2	165.4	-65.1	-78.4	0	0	0	121.1
559	I	30.8	Very low	32	Very low	133 Å²	133	133.7 Å²	133.7	68%	0.682	77%	0.769	S	S	*	*			cis	107.3	141.6	22.9	-78.6	172.5	0	0	0	112
560	I	31.7	Very low	32.1	Very low	144 Å²	144	135.7 Å²	135.7	74%	0.738	77%	0.768	S	S	*	*			cis	-178.7	-177	-20.7	-142.8	-179.1	0	0	0	106.7
561	P	50.8	Low	32	Very low	101 Å²	101	136.8 Å²	136.8	66%	0.656	77%	0.767	S	S	*	*			cis	-126.2	-163.2	-28.9	42.8	-25.9	0	0	0	112.8
562	T	26.2	Very low	31.9	Very low	133 Å²	133	133 Å²	133	82%	0.816	76%	0.756	S	S	*	*				-164.1	141.4	129.5	11.3	0	0	0	0	116.1
563	S	26.9	Very low	32	Very low	111 Å²	111	138.1 Å²	138.1	78%	0.776	76%	0.761	S	S	*	*			trans	-2	158.7	159.4	55.7	0	0	0	0	124.3
564	A	30.4	Very low	31.8	Very low	86 Å²	86	136.6 Å²	136.6	71%	0.711	75%	0.754	S	S	*	*			cis	179.9	153.3	-20.2	0	0	0	0	0	112.2
565	K	29.5	Very low	31.8	Very low	188 Å²	188	136.7 Å²	136.7	82%	0.817	75%	0.751	S	S	*	*			trans	65.9	145	150	-79.6	-179.3	177.1	179.5	0	122.1
566	T	28.1	Very low	31.1	Very low	135 Å²	135	136.2 Å²	136.2	83%	0.828	75%	0.753	S	S	*	*			trans	64	151.9	153.2	48.3	0	0	0	0	119.4
567	A	30.5	Very low	30.7	Very low	75 Å²	75	136.2 Å²	136.2	62%	0.62	75%	0.75	S	S	*	*			cis	-171.2	154.9	-26.2	0	0	0	0	0	109.6
568	D	28	Very low	30.9	Very low	171 Å²	171	136 Å²	136	91%	0.914	76%	0.755	S	S	*	*			trans	56.7	154.5	161.5	-64.5	-50.9	0	0	0	120.4
569	G	28.7	Very low	30.9	Very low	82 Å²	82	137 Å²	137	85%	0.845	76%	0.756	S	S	*	*			trans	160.7	58.2	-178.8	0	0	0	0	0	115.2
570	R	30.7	Very low	31.2	Very low	222 Å²	222	136.5 Å²	136.5	84%	0.838	76%	0.761	S	S	*	*			trans	-100.1	135.1	-172.1	-147.2	-168.2	-173.6	-153.3	7	112
571	M	28	Very low	31.1	Very low	148 Å²	148	135.4 Å²	135.4	73%	0.729	76%	0.757	S	S	*	*			trans	67.5	161.7	160.2	-68.3	155.8	64.6	0	0	117
572	S	28.2	Very low	30.7	Very low	88 Å²	88	136.2 Å²	136.2	62%	0.615	76%	0.762	S	S	*	*			cis	-177.6	161.5	-25.9	-89.4	0	0	0	0	110.5
573	R	30.1	Very low	30.9	Very low	230 Å²	230	135.3 Å²	135.3	87%	0.868	76%	0.756	S	S	*	*			trans	70.5	162.7	156.6	-72.2	168.6	-178	-170.2	1	115.7
574	I	28	Very low	31	Very low	121 Å²	121	138.5 Å²	138.5	62%	0.621	76%	0.759	S	S	*	*			cis	-154.9	147.1	0.7	-128.5	164.6	0	0	0	112.6
575	M	27.7	Very low	31	Very low	163 Å²	163	140.4 Å²	140.4	80%	0.803	77%	0.767	S	S	*	*			trans	55.5	169.2	158.7	-60.9	178.8	179.2	0	0	118.5
576	T	28.8	Very low	30.9	Very low	128 Å²	128	134.7 Å²	134.7	79%	0.785	76%	0.762	S	S	*	*			cis	-145.1	160	10.2	-34.7	0	0	0	0	112.3
577	M	31.4	Very low	31.1	Very low	159 Å²	159	133.9 Å²	133.9	78%	0.783	76%	0.762	S	S	*	*			trans	-58.7	159.2	160.8	-89	-70.5	178.8	0	0	112.2
578	P	44.6	Very low	31.2	Very low	120 Å²	120	140.5 Å²	140.5	78%	0.779	77%	0.77	S	S	*	*				-146.1	174.9	50	42.2	-22.4	0	0	0	119.5
579	H	28.9	Very low	31.5	Very low	140 Å²	140	136.8 Å²	136.8	65%	0.648	75%	0.754	S	S	*	*			trans	-61.7	158	162.7	-120.4	-64.2	0	0	0	111.5	D581	H579-D581 IonicContact CE1-OD2 3.55Å; H579-D581 PolarHBondContact ND1-N 3.19Å
580	P	38.5	Very low	31.8	Very low	122 Å²	122	139 Å²	139	79%	0.792	75%	0.747	S	S	*	*				-142.6	159.7	79.2	39.9	-24.8	0	0	0	116.6
581	D	28.2	Very low	31.9	Very low	121 Å²	121	138.5 Å²	138.5	65%	0.647	75%	0.746	S	S	*	*			trans	-86.5	157.3	159	-119.7	-50.8	0	0	0	108.6	H579	H579-D581 IonicContact CE1-OD2 3.55Å; H579-D581 PolarHBondContact ND1-N 3.19Å
582	P	44.1	Very low	32.1	Very low	118 Å²	118	139.2 Å²	139.2	77%	0.766	75%	0.752	S	S	*	*				-153.7	167	83	40.4	-21	0	0	0	118.6
583	T	30	Very low	32.5	Very low	113 Å²	113	139.1 Å²	139.1	69%	0.693	76%	0.756	S	S	*	*			trans	-62	152.8	169.5	54.8	0	0	0	0	115.7
584	Q	28.9	Very low	32.8	Very low	178 Å²	178	139.9 Å²	139.9	83%	0.832	76%	0.759	S	S	*	*				168.5	155.7	110.1	-92.7	-168.8	29.8	0	0	114.8
585	S	29.3	Very low	32.7	Very low	127 Å²	127	137.9 Å²	137.9	89%	0.888	77%	0.769	S	S	*	*			trans	65.9	160.7	162.3	-128.9	0	0	0	0	117
586	G	27.5	Very low	32.8	Very low	68 Å²	68	134.1 Å²	134.1	70%	0.701	77%	0.772	S	S	*	*			cis	-174.6	155.4	-3.5	0	0	0	0	0	110
587	S	33.6	Very low	32.7	Very low	118 Å²	118	132.3 Å²	132.3	83%	0.825	78%	0.779	S	S	*	*			trans	-95.7	146	-174.1	-174.8	0	0	0	0	113
588	R	32.3	Very low	32.6	Very low	213 Å²	213	128 Å²	128	80%	0.804	78%	0.775	S	S	*	*				144.1	128.8	114.1	-165.3	170.4	172.7	148.3	3.7	117.3
589	T	34.1	Very low	32.1	Very low	93 Å²	93	129 Å²	129	57%	0.571	78%	0.779	S	S	*	*			trans	66.5	112.7	151.3	55.2	0	0	0	0	125.4
590	D	34.9	Very low	32.5	Very low	130 Å²	130	128 Å²	128	70%	0.695	78%	0.783	S	S	*	*				83.3	147.2	108.9	-55.9	-3.8	0	0	0	127.4
591	Y	33.1	Very low	32.4	Very low	210 Å²	210	129 Å²	129	82%	0.824	78%	0.777	S	S	*	*			trans	83.5	117.3	150.8	-78.5	-63.8	0	0	0	124
592	L	32.1	Very low	32.6	Very low	164 Å²	164	131.6 Å²	131.6	86%	0.859	78%	0.777	S	S	*	*				174.4	118	118	-86.7	166.4	0	0	0	107.9
593	A	37.4	Very low	31.9	Very low	85 Å²	85	130.7 Å²	130.7	70%	0.702	77%	0.766	S	S	*	*				74.5	144	72.5	0	0	0	0	0	113.8
594	R	34.7	Very low	31.8	Very low	246 Å²	246	134 Å²	134	93%	0.928	77%	0.767	S	S	*	*			cis	-168.8	147.6	16.4	-167	178.5	-178.7	176.4	0.1	114.2
595	G	26.6	Very low	32.2	Very low	80 Å²	80	132 Å²	132	83%	0.825	76%	0.762	S	S	*	*			trans	90.8	154	152.3	0	0	0	0	0	119.1
596	G	29.1	Very low	32.4	Very low	83 Å²	83	130.9 Å²	130.9	86%	0.856	75%	0.754	S	S	*	*			cis	171.4	144.7	-11.8	0	0	0	0	0	116
597	G	27.1	Very low	32.5	Very low	91 Å²	91	139.3 Å²	139.3	94%	0.938	77%	0.765	S	S	*	*			trans	88.3	146.5	169.5	0	0	0	0	0	117.1
598	G	28.8	Very low	32.2	Very low	69 Å²	69	139.9 Å²	139.9	71%	0.711	77%	0.767	S	S	*	*			cis	166.2	158.2	-13.9	0	0	0	0	0	115.2
599	V	34.2	Very low	32	Very low	141 Å²	141	132.9 Å²	132.9	86%	0.855	76%	0.762	S	S	*	*			trans	70.7	135.5	154.2	172.2	0	0	0	0	118.7
600	T	38.4	Very low	31.8	Very low	119 Å²	119	134.7 Å²	134.7	73%	0.73	77%	0.772	S	S	*	*			cis	-156	-156	-26.2	40.9	0	0	0	0	106.1
601	Q	35.7	Very low	31.6	Very low	143 Å²	143	136.6 Å²	136.6	67%	0.668	78%	0.777	S	S	*	*			cis	-161.8	-171.7	5.2	-146.4	-165.6	33.5	0	0	109.6
602	R	32.6	Very low	31.5	Very low	174 Å²	174	132.2 Å²	132.2	66%	0.657	77%	0.772	S	S	*	*			trans	76.9	172.8	171.4	-38.2	-130.2	74.9	64.7	23.4	114.8
603	D	29.6	Very low	31.4	Very low	100 Å²	100	132.9 Å²	132.9	54%	0.535	78%	0.776	S	S	.	*				-165	159.1	-55.5	-86.1	-11.1	0	0	0	105.9
604	Y	28.8	Very low	31	Very low	182 Å²	182	132.5 Å²	132.5	71%	0.714	78%	0.78	S	S	*	*			cis	-151	136.9	-9	-121.9	-149.1	0	0	0	106.2
605	L	35.7	Very low	30.5	Very low	136 Å²	136	124.3 Å²	124.3	71%	0.712	77%	0.772	S	S	*	*				62.4	129.3	81.9	-59.2	-168.7	0	0	0	114.6
606	S	34.2	Very low	31.3	Very low	104 Å²	104	126.2 Å²	126.2	73%	0.727	77%	0.77	S	S	*	*			cis	-147.8	-177	8.3	-56.6	0	0	0	0	110.9
607	R	30.8	Very low	31.1	Very low	244 Å²	244	128.6 Å²	128.6	92%	0.921	77%	0.768	S	S	*	*				-173.4	179.1	52.4	-132	174.1	-162.7	-131.1	3.8	114.3
608	C	26.2	Very low	31.2	Very low	131 Å²	131	133 Å²	133	89%	0.885	76%	0.761	S	S	*	*			trans	-67.7	175.6	-172	-45.7	0	0	0	0	117.4
609	G	28.4	Very low	31.3	Very low	66 Å²	66	134.9 Å²	134.9	68%	0.68	76%	0.758	S	S	*	*			cis	157.7	178.8	-7.9	0	0	0	0	0	116.4
610	T	30.6	Very low	31	Very low	130 Å²	130	136.2 Å²	136.2	80%	0.798	76%	0.756	S	S	*	*			trans	71.2	125.1	157.5	47.2	0	0	0	0	126.2
611	Q	30.4	Very low	30.5	Very low	170 Å²	170	135.5 Å²	135.5	79%	0.794	76%	0.755	S	S	*	*			trans	79.4	103.1	134.7	-67.8	-177.9	38.1	0	0	125.6
612	T	29.5	Very low	30.2	Very low	118 Å²	118	134.6 Å²	134.6	72%	0.724	76%	0.759	S	S	*	*				33	123.4	128.5	57.6	0	0	0	0	124.2
613	L	30.1	Very low	30.1	Very low	178 Å²	178	132.8 Å²	132.8	93%	0.932	77%	0.768	S	S	*	*				170.1	148.5	110.6	-99.4	157.1	0	0	0	113.7
614	G	28.7	Very low	30	Very low	77 Å²	77	131.8 Å²	131.8	79%	0.794	77%	0.773	S	S	*	*			trans	97.2	124.6	155.7	0	0	0	0	0	119
615	G	25.3	Very low	29.9	Very low	74 Å²	74	130.3 Å²	130.3	76%	0.763	78%	0.777	S	S	*	*			trans	-116.5	-164.1	150.7	0	0	0	0	0	109.4
616	P	42.3	Very low	29.5	Very low	120 Å²	120	134.7 Å²	134.7	78%	0.779	78%	0.784	S	S	*	*			cis	-135.2	-169.8	8.5	34.5	-12.3	0	0	0	114.5
617	V	26.4	Very low	29.1	Very low	133 Å²	133	135.2 Å²	135.2	81%	0.806	79%	0.788	S	S	*	*			trans	74	130.6	167.3	-168.9	0	0	0	0	113.7
618	K	28.6	Very low	29.1	Very low	184 Å²	184	130.2 Å²	130.2	80%	0.8	78%	0.784	S	S	*	*			cis	-142	124.6	27.9	-154.7	164.7	-177	179.5	0	114.2
619	V	31.1	Very low	29.2	Very low	108 Å²	108	128.1 Å²	128.1	66%	0.655	78%	0.777	S	S	*	*			trans	54.1	102.1	146.3	-176.9	0	0	0	0	118.8
620	E	27.3	Very low	29.3	Very low	170 Å²	170	132.5 Å²	132.5	79%	0.794	78%	0.78	S	S	*	*				39.4	159.1	120.1	-59.4	169.9	131.6	0	0	122.8
621	S	27.8	Very low	29.2	Very low	103 Å²	103	135.9 Å²	135.9	72%	0.72	78%	0.778	S	S	*	*			cis	175.5	108.3	-40.4	-98.8	0	0	0	0	109.9
622	V	29.5	Very low	29.1	Very low	125 Å²	125	135.2 Å²	135.2	76%	0.758	78%	0.779	S	S	*	*			trans	39	126.7	141.7	-139.4	0	0	0	0	121.8
623	T	30.8	Very low	29.2	Very low	136 Å²	136	133.4 Å²	133.4	83%	0.834	77%	0.771	S	S	*	*			trans	67.6	159.4	152.8	35.4	0	0	0	0	118.6
624	A	27.5	Very low	29	Very low	79 Å²	79	133.3 Å²	133.3	65%	0.653	77%	0.772	S	S	*	*			cis	-148.7	167.9	7.1	0	0	0	0	0	114.2
625	L	26.5	Very low	29.2	Very low	150 Å²	150	134.1 Å²	134.1	79%	0.785	77%	0.771	S	S	*	*			trans	47.6	116.9	141.9	-72.9	168.2	0	0	0	123.4
626	R	27.9	Very low	29.4	Very low	229 Å²	229	135.5 Å²	135.5	86%	0.864	77%	0.769	S	S	*	*			trans	71.9	142.4	130.1	-94.5	-173.6	177.6	172	-0.3	123.4
627	S	26.3	Very low	28.7	Very low	115 Å²	115	138.1 Å²	138.1	80%	0.804	78%	0.775	S	S	*	*			trans	90.8	160.3	149.5	-63.9	0	0	0	0	119.2
628	T	30.6	Very low	28.8	Very low	138 Å²	138	136.4 Å²	136.4	85%	0.847	78%	0.775	S	S	*	*			trans	-104.3	173.7	-156.9	45.4	0	0	0	0	113.8
629	A	28.5	Very low	28.7	Very low	88 Å²	88	133.3 Å²	133.3	73%	0.727	78%	0.777	S	S	*	*			trans	82.3	148.9	177.2	0	0	0	0	0	114.6
630	Q	29.5	Very low	28.5	Very low	158 Å²	158	134.6 Å²	134.6	74%	0.738	79%	0.785	S	S	*	*			cis	-168.6	161.8	-9.2	-118	176.8	-16.5	0	0	111.3
631	W	28.1	Very low	29.6	Very low	200 Å²	200	132 Å²	132	76%	0.758	78%	0.783	S	S	*	*			trans	71.2	168.3	157.5	-63.9	19.7	0	0	0	115.4
632	L	28.9	Very low	29.5	Very low	156 Å²	156	132.3 Å²	132.3	82%	0.817	79%	0.785	S	S	*	*			cis	-122.5	151.5	14.8	-68.7	156.8	0	0	0	110.9
633	S	31.5	Very low	29.4	Very low	80 Å²	80	131.6 Å²	131.6	56%	0.559	79%	0.785	S	S	*	*			cis	95.3	125.5	29.4	-58.5	0	0	0	0	114.7
634	N	26.7	Very low	29.3	Very low	177 Å²	177	129.6 Å²	129.6	95%	0.947	78%	0.783	S	S	*	*			trans	-130.7	143.3	152.7	-117	-4.1	0	0	0	107.5
635	A	32.2	Very low	29.3	Very low	94 Å²	94	134.7 Å²	134.7	78%	0.777	79%	0.793	S	S	*	*			trans	-126	-176.6	-169.1	0	0	0	0	0	110
636	S	29.4	Very low	30.8	Very low	103 Å²	103	132.6 Å²	132.6	72%	0.72	79%	0.788	S	S	*	*			cis	-163.1	163	-1.7	-150	0	0	0	0	108.7
637	L	28	Very low	30.8	Very low	175 Å²	175	128.9 Å²	128.9	92%	0.916	78%	0.784	S	S	*	*				169.6	157.2	120.7	-89.4	170.2	0	0	0	110.5
638	A	27.4	Very low	30.8	Very low	97 Å²	97	128.7 Å²	128.7	80%	0.802	77%	0.774	S	S	*	*			trans	-131.3	154	-163	0	0	0	0	0	113.8
639	S	27	Very low	30.7	Very low	119 Å²	119	132.2 Å²	132.2	83%	0.832	77%	0.772	S	S	*	*			trans	-157.7	151.3	151.6	43	0	0	0	0	111.6
640	T	27.7	Very low	30.6	Very low	134 Å²	134	134 Å²	134	82%	0.822	77%	0.773	S	S	*	*			trans	-144.5	176.6	174	63.3	0	0	0	0	106.6
641	P	49.2	Very low	30.5	Very low	116 Å²	116	130.9 Å²	130.9	75%	0.753	78%	0.775	S	S	*	*			cis	-127.3	-170.4	-8	41.3	-25.8	0	0	0	112.5
642	S	26.1	Very low	30.5	Very low	110 Å²	110	126.2 Å²	126.2	77%	0.769	78%	0.779	S	S	*	*				159	136.4	117.3	-164.4	0	0	0	0	115.7
643	S	27.7	Very low	30.4	Very low	109 Å²	109	123.9 Å²	123.9	76%	0.762	78%	0.776	S	S	*	*			trans	30.4	118.8	144.4	-178.2	0	0	0	0	122.4
644	A	28.4	Very low	30.3	Very low	95 Å²	95	124.3 Å²	124.3	79%	0.785	78%	0.784	S	S	*	*				-176.7	155.2	106.3	0	0	0	0	0	113.9
645	Q	28.1	Very low	30.5	Very low	186 Å²	186	126.8 Å²	126.8	87%	0.869	78%	0.782	S	S	*	*			trans	-134.5	-176.3	163.5	-75.9	-160.9	-9	0	0	108.3
646	P	57.5	Low	30.6	Very low	105 Å²	105	130.2 Å²	130.2	68%	0.682	78%	0.782	S	S	*	*				-120.8	-163.8	-65.3	38.2	-23.2	0	0	0	109.6
647	I	27.8	Very low	30.6	Very low	152 Å²	152	132.4 Å²	132.4	78%	0.779	79%	0.791	S	S	*	*			trans	-178.4	125.2	137.8	-97.7	155.4	0	0	0	114.9
648	N	26.6	Very low	30.9	Very low	110 Å²	110	130.3 Å²	130.3	59%	0.588	78%	0.779	S	S	*	*			trans	23.8	128.3	149.9	-68.9	-57.1	0	0	0	125.8
649	R	28	Very low	31	Very low	213 Å²	213	131.3 Å²	131.3	80%	0.804	78%	0.78	S	S	*	*				71.3	161.9	122.1	-61.4	175.7	-165.6	-155.1	-1.9	119.5
650	T	26.6	Very low	31.4	Very low	124 Å²	124	133.6 Å²	133.6	76%	0.761	78%	0.778	S	S	*	*			cis	-153.4	138.1	6.3	-13.1	0	0	0	0	113.9
651	A	27.3	Very low	31.7	Very low	94 Å²	94	132.3 Å²	132.3	78%	0.777	77%	0.77	S	S	*	*			trans	53.3	167.1	133.6	0	0	0	0	0	125.6
652	A	28.6	Very low	30.8	Very low	102 Å²	102	134.3 Å²	134.3	84%	0.843	77%	0.774	S	S	*	*			trans	83.7	137.7	172.3	0	0	0	0	0	116.7
653	S	26.6	Very low	31.2	Very low	107 Å²	107	138.5 Å²	138.5	75%	0.748	78%	0.778	S	S	*	*			cis	-143.2	159	1.2	-165.6	0	0	0	0	112.4
654	A	29	Very low	31.4	Very low	88 Å²	88	142.8 Å²	142.8	73%	0.727	79%	0.786	S	S	*	*			trans	-144.9	141.7	171.4	0	0	0	0	0	110.3
655	Y	30.4	Very low	31.8	Very low	229 Å²	229	142.2 Å²	142.2	90%	0.898	79%	0.79	S	S	*	*			trans	-103.9	156.3	169.1	-85.7	-80	0	0	0	111.1
656	Q	35.4	Very low	32	Very low	166 Å²	166	136.9 Å²	136.9	78%	0.776	79%	0.785	S	S	*	*			trans	-111.7	160.5	-157	-59.1	170.6	-14.2	0	0	113
657	T	28.9	Very low	31.1	Very low	150 Å²	150	138.9 Å²	138.9	92%	0.92	80%	0.795	S	S	*	*			trans	-128.9	145.7	152.2	-53.4	0	0	0	0	108.7
658	I	35.5	Very low	31.3	Very low	130 Å²	130	136.2 Å²	136.2	67%	0.667	80%	0.796	S	S	*	*			trans	-108.3	143.9	-161.6	-64.1	165.7	0	0	0	111.8
659	S	28.7	Very low	32	Very low	118 Å²	118	142.5 Å²	142.5	83%	0.825	81%	0.811	S	S	*	*			trans	-146.6	138	153.3	55.4	0	0	0	0	112.6
660	H	34.8	Very low	32.9	Very low	168 Å²	168	138.4 Å²	138.4	78%	0.778	81%	0.81	S	S	*	*			trans	-93.4	166.5	172.8	-84.5	-115.2	0	0	0	109.9
661	V	34.4	Very low	33.9	Very low	107 Å²	107	137.8 Å²	137.8	65%	0.648	81%	0.808	S	S	*	*			cis	-173.4	138.8	-25.6	-173.3	0	0	0	0	107.7
662	N	31.2	Very low	34.8	Very low	158 Å²	158	139 Å²	139	85%	0.845	81%	0.808	S	S	*	*			trans	172.1	160.8	136.2	-94.6	-18	0	0	0	115
663	F	32.8	Very low	35.9	Very low	197 Å²	197	138.8 Å²	138.8	86%	0.864	81%	0.807	S	S	*	*			trans	-85.9	143	-174.4	-94.6	-127.6	0	0	0	114.4
664	Q	32.8	Very low	37.1	Very low	199 Å²	199	141.2 Å²	141.2	93%	0.93	81%	0.811	S	S	*	*				-158.3	146.7	117.8	-109.1	172.7	17	0	0	110.7
665	G	36.5	Very low	38.2	Very low	84 Å²	84	144.2 Å²	144.2	87%	0.866	82%	0.815	S	S	*	*			trans	-91.4	142.3	-170.4	0	0	0	0	0	114.3
666	G	32.8	Very low	39.8	Very low	73 Å²	73	138.3 Å²	138.3	75%	0.753	80%	0.804	S	S	*	*			trans	-155.2	145.5	172.4	0	0	0	0	0	110.6	A668	G666-A668 PolarHBondContact O-N 3.18Å
667	V	37.9	Very low	40.7	Very low	147 Å²	147	136.3 Å²	136.3	89%	0.891	81%	0.806	S	S	*	*			trans	-66.8	125.4	-173.3	178.4	0	0	0	0	110.9	R669	V667-R669 PolarHBondContact O-N 3.39Å
668	A	32.5	Very low	42.2	Very low	97 Å²	97	133.5 Å²	133.5	80%	0.802	80%	0.798	S	S	*	*			trans	-66.7	112.1	177.1	0	0	0	0	0	111	G666	G666-A668 PolarHBondContact O-N 3.18Å
669	R	41.2	Very low	43.3	Very low	241 Å²	241	132.4 Å²	132.4	91%	0.909	80%	0.799	S	S	*	*			trans	-92.3	115.8	167.8	-146.4	178.5	-167.1	-174.6	3.3	107.6	V667	V667-R669 PolarHBondContact O-N 3.39Å
670	T	46.5	Very low	44.8	Very low	128 Å²	128	132 Å²	132	79%	0.785	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-60.4	129.3	175.7	46.6	0	0	0	0	110.3
671	P	48.3	Very low	46.7	Very low	111 Å²	111	128.5 Å²	128.5	72%	0.721	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-66.3	150.9	169.8	29.8	-34.2	0	0	0	110	A673	P671-A673 PolarHBondContact O-N 3.09Å
672	P	45.7	Very low	49.1	Very low	118 Å²	118	126.9 Å²	126.9	77%	0.766	77%	0.774	S	S	*	*	P	Polyproline II helix	trans	-67.3	123.8	175.6	28.4	-33.4	0	0	0	110.2	N674	P672-N674 PolarHBondContact O-N 3.42Å
673	A	52.1	Low	51.5	Low	99 Å²	99	121.3 Å²	121.3	82%	0.818	76%	0.755	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.8	101.2	174.1	0	0	0	0	0	110	P671	P671-A673 PolarHBondContact O-N 3.09Å
674	N	51.8	Low	54.1	Low	158 Å²	158	114.3 Å²	114.3	85%	0.845	73%	0.726	S	S	*	*	T	Hydrogen-bonded Turn	trans	-161.4	-10.2	164.6	-104.1	-26.6	0	0	0	115	P672	P672-N674 PolarHBondContact O-N 3.42Å
675	D	52.9	Low	56.7	Low	151 Å²	151	106.8 Å²	106.8	81%	0.807	70%	0.698	S	S	*	*	S	Bend	trans	-73	134.7	168.6	-70.6	-50	0	0	0	110.6
676	P	62.8	Low	59.1	Low	104 Å²	104	108.5 Å²	108.5	68%	0.675	68%	0.678	S	S	*	*	P	Polyproline II helix	trans	-65.6	151.1	173	29.1	-34.4	0	0	0	110.4	A678	P676-A678 PolarHBondContact O-N 2.86Å
677	P	55.4	Low	61.9	Low	125 Å²	125	105.6 Å²	105.6	81%	0.812	65%	0.645	S	S	*	*	P	Polyproline II helix	trans	-57.3	127.2	174.9	25.3	-33.8	0	0	0	109.5
678	A	59.5	Low	64.4	Low	90 Å²	90	102.3 Å²	102.3	74%	0.744	62%	0.619	S	S	*	*	P	Polyproline II helix	trans	-54.6	133	-177.3	0	0	0	0	0	110.2	P676	P676-A678 PolarHBondContact O-N 2.86Å
679	P	58.4	Low	67.1	Low	108 Å²	108	103.6 Å²	103.6	70%	0.701	61%	0.609	S	S	*	*	P	Polyproline II helix	trans	-59.8	141.8	-175.6	24.5	-34	0	0	0	110.3	V681	P679-V681 PolarHBondContact O-N 3.12Å
680	P	61.4	Low	69.4	Low	108 Å²	108	92.8 Å²	92.8	70%	0.701	57%	0.57	S	S	*	*	P	Polyproline II helix	trans	-57.7	131.3	-174.6	22.6	-33.3	0	0	0	110.7	T682	P680-T682 PolarHBondContact O-N 2.99Å
681	V	74.3	Confident	71.5	Confident	95 Å²	95	88.8 Å²	88.8	58%	0.576	54%	0.544	S	S	*	.			trans	-75.9	74.3	-174.1	-169.3	0	0	0	0	110.5	P679 R686	P679-V681 PolarHBondContact O-N 3.12Å; V681-R686 HydrophobicContact CG1-CG 3.85Å; V681-R686 PolarHBondContact O-NH2 2.91Å
682	T	84.2	Confident	73.4	Confident	73 Å²	73	92.7 Å²	92.7	45%	0.448	54%	0.544	S	S	.	.			trans	-68.1	157.7	175	59.4	0	0	0	0	111.7	P680 L684 A685 R686	P680-T682 PolarHBondContact O-N 2.99Å; T682-L684 PolarHBondContact O-N 3.2Å; T682-A685 WeakPolarHBondContact O-CB 3.47Å; T682-A685 PolarHBondContact O-N 2.83Å; T682-A685 PolarHBondContact OG1-N 3.3Å; T682-R686 PolarHBondContact O-N 3.48Å; T682-R686 VanDerWaalsContact O-N 3.17Å
683	G	82.4	Confident	75.5	Confident	42 Å²	42	91.5 Å²	91.5	43%	0.433	54%	0.535	S	S	.	.	H	α-helix	trans	-55.8	-37.7	172.9	0	0	0	0	0	112.7	A685 R686 F687 L724	G683-A685 VanDerWaalsContact C-N 3.34Å; G683-A685 PolarHBondContact O-N 3.31Å; G683-R686 PolarHBondContact O-N 3.42Å; G683-F687 PolarHBondContact O-N 3.17Å; G683-L724 VanDerWaalsContact C-CD1 3.49Å; G683-L724 WeakPolarHBondContact O-CD1 3.29Å
684	L	87.6	Confident	77.3	Confident	49 Å²	49	95 Å²	95	26%	0.257	53%	0.534	S	S	.	.	H	α-helix	trans	-59	-42.3	174.3	179.5	62.9	0	0	0	112.5	T682 H688 F727	T682-L684 PolarHBondContact O-N 3.2Å; L684-H688 WeakPolarHBondContact O-CB 3.41Å; L684-H688 PolarHBondContact O-N 3.46Å; L684-F727 HydrophobicContact CD1-CE2 3.59Å; L684-F727 HydrophobicContact CD1-CZ 4.12Å
685	A	86	Confident	79.3	Confident	41 Å²	41	89 Å²	89	34%	0.339	50%	0.501	S	S	.	.	H	α-helix	trans	-65	-39.5	177	0	0	0	0	0	111.7	T682 G683 Q689	T682-A685 WeakPolarHBondContact O-CB 3.47Å; T682-A685 PolarHBondContact O-N 2.83Å; T682-A685 PolarHBondContact OG1-N 3.3Å; G683-A685 VanDerWaalsContact C-N 3.34Å; G683-A685 PolarHBondContact O-N 3.31Å; A685-Q689 WeakPolarHBondContact O-CB 3.24Å; A685-Q689 PolarHBondContact O-N 2.95Å
686	R	87.2	Confident	81.3	Confident	121 Å²	121	86.4 Å²	86.4	46%	0.457	49%	0.491	S	S	.	.	H	α-helix	trans	-68.5	-43.3	175.7	-60.9	-167.2	-159.6	145.6	10.3	112.6	V681 T682 G683 H688 Q689 S690 E841	V681-R686 HydrophobicContact CG1-CG 3.85Å; V681-R686 PolarHBondContact O-NH2 2.91Å; T682-R686 PolarHBondContact O-N 3.48Å; T682-R686 VanDerWaalsContact O-N 3.17Å; G683-R686 PolarHBondContact O-N 3.42Å; R686-H688 PolarHBondContact O-N 2.84Å; R686-Q689 CarbonylContact O-C 3.52Å; R686-Q689 WeakPolarHBondContact O-CA 3.45Å; R686-Q689 WeakPolarHBondContact O-CB 3.31Å; R686-Q689 PolarHBondContact O-N 3.07Å; R686-S690 PolarHBondContact O-N 3.12Å; R686-E841 WeakPolarHBondContact CD-OE1 2.78Å
687	F	91.8	Very high	82.8	Confident	11 Å²	11	82.6 Å²	82.6	5%	0.048	46%	0.464	C	S	.	.	H	α-helix	trans	-59.4	-47.9	174.2	176	-110.8	0	0	0	111.4	G683 Q689 S690 L691 H722 L724 F727	G683-F687 PolarHBondContact O-N 3.17Å; F687-Q689 PolarHBondContact O-N 2.87Å; F687-Q689 VanDerWaalsContact O-N 3.13Å; F687-S690 PolarHBondContact O-N 2.64Å; F687-S690 PolarHBondContact O-OG 3.48Å; F687-L691 HydrophobicContact CD1-CD1 4.12Å; F687-L691 HydrophobicContact CE1-CD1 3.64Å; F687-L691 HydrophobicContact CE1-CG 4.45Å; F687-L691 HydrophobicContact CE2-CD1 4.27Å; F687-L691 HydrophobicContact CE2-CD2 4.27Å; F687-L691 HydrophobicContact CE2-CG 4.26Å; F687-L691 HydrophobicContact CZ-CD1 3.72Å; F687-L691 HydrophobicContact CZ-CD2 4.26Å; F687-L691 HydrophobicContact CZ-CG 4.19Å; F687-L691 VanDerWaalsContact O-CG 3.31Å; F687-L691 WeakPolarHBondContact O-CG 3.47Å; F687-L691 PolarHBondContact O-N 2.8Å; F687-L691 VanDerWaalsContact O-N 3.09Å; F687-H722 AromaticContact CE2-ND1 3.99Å; F687-L724 HydrophobicContact CB-CD1 3.75Å; F687-L724 HydrophobicContact CB-CG 4.35Å; F687-L724 HydrophobicContact CG-CD1 4.29Å; F687-L724 HydrophobicContact CG-CG 4.49Å; F687-F727 AromaticContact CD1-CD2 3.98Å; F687-F727 HydrophobicContact CD1-CD2 3.98Å; F687-F727 HydrophobicContact CD1-CE2 4.29Å; F687-F727 HydrophobicContact CE1-CB 4Å; F687-F727 AromaticContact CE1-CD2 3.48Å; F687-F727 HydrophobicContact CE1-CD2 3.48Å; F687-F727 VanDerWaalsContact CE1-CD2 3.48Å; F687-F727 HydrophobicContact CE1-CE2 4.13Å; F687-F727 AromaticContact CE1-CG 3.82Å; F687-F727 HydrophobicContact CE1-CG 3.82Å; F687-F727 HydrophobicContact CZ-CB 4.21Å; F687-F727 HydrophobicContact CZ-CD2 4.43Å
688	H	89.8	Confident	84.6	Confident	78 Å²	78	81.2 Å²	81.2	36%	0.361	45%	0.45	S	S	.	.	H	α-helix	trans	-62.7	-18.8	172.1	-73.9	-171.6	0	0	0	113.5	L684 R686 R692 F727	L684-H688 WeakPolarHBondContact O-CB 3.41Å; L684-H688 PolarHBondContact O-N 3.46Å; R686-H688 PolarHBondContact O-N 2.84Å; H688-R692 VanDerWaalsContact C-NH1 3.3Å; H688-R692 WeakPolarHBondContact O-CG 3.31Å; H688-R692 PolarHBondContact O-NH1 3.3Å; H688-F727 AromaticContact NE2-CE2 3.86Å; H688-F727 AromaticContact NE2-CZ 3.54Å
689	Q	88.8	Confident	86.3	Confident	124 Å²	124	78.6 Å²	78.6	58%	0.579	42%	0.423	S	S	*	.	H	α-helix	trans	-86.3	-38.3	174.3	-174.7	173.5	-14.2	0	0	112.3	A685 R686 F687 L691 R692	A685-Q689 WeakPolarHBondContact O-CB 3.24Å; A685-Q689 PolarHBondContact O-N 2.95Å; R686-Q689 CarbonylContact O-C 3.52Å; R686-Q689 WeakPolarHBondContact O-CA 3.45Å; R686-Q689 WeakPolarHBondContact O-CB 3.31Å; R686-Q689 PolarHBondContact O-N 3.07Å; F687-Q689 PolarHBondContact O-N 2.87Å; F687-Q689 VanDerWaalsContact O-N 3.13Å; Q689-L691 VanDerWaalsContact C-N 3.34Å; Q689-R692 WeakPolarHBondContact O-CB 3.46Å; Q689-R692 PolarHBondContact O-N 3.25Å; Q689-R692 VanDerWaalsContact O-N 3.07Å
690	S	89.6	Confident	87.9	Confident	15 Å²	15	75.3 Å²	75.3	11%	0.105	40%	0.402	C	S	.	.	H	α-helix	trans	-66.4	-37.9	175.8	84.8	0	0	0	0	111.4	R686 F687 R692 T693 R731 D842	R686-S690 PolarHBondContact O-N 3.12Å; F687-S690 PolarHBondContact O-N 2.64Å; F687-S690 PolarHBondContact O-OG 3.48Å; S690-R692 PolarHBondContact O-N 3.07Å; S690-R692 VanDerWaalsContact O-N 3.13Å; S690-T693 WeakPolarHBondContact O-CA 3.41Å; S690-T693 WeakPolarHBondContact O-CB 3.09Å; S690-T693 PolarHBondContact O-N 3.01Å; S690-T693 VanDerWaalsContact O-O 3.07Å; S690-R731 PolarHBondContact O-NH1 3.18Å; S690-R731 PolarHBondContact O-NH2 3.17Å; S690-D842 WeakPolarHBondContact CB-OD1 3.37Å; S690-D842 WeakPolarHBondContact CB-OD2 3.15Å; S690-D842 PolarHBondContact OG-OD1 2.91Å
691	L	90.8	Very high	89.3	Confident	44 Å²	44	78.1 Å²	78.1	23%	0.23	41%	0.411	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-15.8	170.2	-65.2	179.3	0	0	0	114.9	F687 Q689 T764 E765	F687-L691 HydrophobicContact CD1-CD1 4.12Å; F687-L691 HydrophobicContact CE1-CD1 3.64Å; F687-L691 HydrophobicContact CE1-CG 4.45Å; F687-L691 HydrophobicContact CE2-CD1 4.27Å; F687-L691 HydrophobicContact CE2-CD2 4.27Å; F687-L691 HydrophobicContact CE2-CG 4.26Å; F687-L691 HydrophobicContact CZ-CD1 3.72Å; F687-L691 HydrophobicContact CZ-CD2 4.26Å; F687-L691 HydrophobicContact CZ-CG 4.19Å; F687-L691 VanDerWaalsContact O-CG 3.31Å; F687-L691 WeakPolarHBondContact O-CG 3.47Å; F687-L691 PolarHBondContact O-N 2.8Å; F687-L691 VanDerWaalsContact O-N 3.09Å; Q689-L691 VanDerWaalsContact C-N 3.34Å; L691-T764 HydrophobicContact CD1-CG2 3.87Å; L691-E765 WeakPolarHBondContact CD2-OE2 3.29Å
692	R	89.6	Confident	90.1	Very high	193 Å²	193	79.4 Å²	79.4	73%	0.728	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.6	-20.9	170.9	-68.5	174.4	178.7	104.7	-16.8	112.5	H688 Q689 S690	H688-R692 VanDerWaalsContact C-NH1 3.3Å; H688-R692 WeakPolarHBondContact O-CG 3.31Å; H688-R692 PolarHBondContact O-NH1 3.3Å; Q689-R692 WeakPolarHBondContact O-CB 3.46Å; Q689-R692 PolarHBondContact O-N 3.25Å; Q689-R692 VanDerWaalsContact O-N 3.07Å; S690-R692 PolarHBondContact O-N 3.07Å; S690-R692 VanDerWaalsContact O-N 3.13Å
693	T	90	Very high	90.4	Very high	92 Å²	92	88 Å²	88	56%	0.564	44%	0.435	S	S	*	.	S	Bend	trans	-79.5	117.6	171.3	-54	0	0	0	0	107.3	S690 F695 R731	S690-T693 WeakPolarHBondContact O-CA 3.41Å; S690-T693 WeakPolarHBondContact O-CB 3.09Å; S690-T693 PolarHBondContact O-N 3.01Å; S690-T693 VanDerWaalsContact O-O 3.07Å; T693-F695 PolarHBondContact O-N 3.47Å; T693-F695 VanDerWaalsContact O-N 3.17Å; T693-R731 PolarHBondContact O-NH1 3.45Å; T693-R731 PolarHBondContact O-NH2 2.99Å
694	Q	89.6	Confident	90.8	Very high	173 Å²	173	87.3 Å²	87.3	81%	0.808	43%	0.429	S	S	*	.	P	Polyproline II helix	trans	-64.4	117.3	-179.3	-177.3	175.3	-2.5	0	0	110.2
695	F	94.1	Very high	91.1	Very high	33 Å²	33	88.1 Å²	88.1	15%	0.145	43%	0.433	C	S	.	.	P	Polyproline II helix	trans	-93.8	151.4	167.7	174.9	-108	0	0	0	109.7	T693 L697 R731 A734 L735 F768	T693-F695 PolarHBondContact O-N 3.47Å; T693-F695 VanDerWaalsContact O-N 3.17Å; F695-L697 HydrophobicContact CE1-CB 4.3Å; F695-R731 VanDerWaalsContact CB-CZ 3.46Å; F695-R731 HydrophobicContact CD1-CG 3.98Å; F695-R731 HydrophobicContact CG-CG 4.37Å; F695-A734 HydrophobicContact CE1-CB 3.79Å; F695-L735 HydrophobicContact CD2-CD2 4.18Å; F695-L735 HydrophobicContact CE1-CG 4.47Å; F695-L735 HydrophobicContact CE2-CD2 3.63Å; F695-L735 HydrophobicContact CE2-CG 4.41Å; F695-L735 HydrophobicContact CZ-CD2 3.83Å; F695-L735 HydrophobicContact CZ-CG 4.18Å; F695-F768 HydrophobicContact CD1-CE1 4.12Å; F695-F768 AromaticContact CD1-CE2 3.92Å; F695-F768 HydrophobicContact CD1-CE2 3.92Å; F695-F768 AromaticContact CD1-CZ 3.49Å; F695-F768 HydrophobicContact CD1-CZ 3.49Å; F695-F768 VanDerWaalsContact CD1-CZ 3.49Å; F695-F768 HydrophobicContact CE1-CE1 4.24Å; F695-F768 HydrophobicContact CE1-CZ 4.05Å
696	T	93.3	Very high	91.4	Very high	96 Å²	96	90.7 Å²	90.7	59%	0.589	45%	0.446	S	S	*	.			trans	-145	116.7	175.9	-63.1	0	0	0	0	107.6	N698	T696-N698 PolarHBondContact O-N 3.34Å
697	L	95.1	Very high	91.8	Very high	24 Å²	24	88.6 Å²	88.6	13%	0.126	44%	0.444	C	S	.	.			trans	-60.6	114.2	-178.8	173.9	57.7	0	0	0	110.5	F695 L699 A734 E738 F768 L772	F695-L697 HydrophobicContact CE1-CB 4.3Å; L697-L699 HydrophobicContact CD1-CD1 3.92Å; L697-L699 HydrophobicContact CD1-CD2 3.89Å; L697-L699 HydrophobicContact CD1-CG 3.73Å; L697-L699 HydrophobicContact CD2-CD1 3.93Å; L697-L699 HydrophobicContact CG-CD1 3.88Å; L697-L699 HydrophobicContact CG-CG 3.92Å; L697-A734 HydrophobicContact CD1-CB 4.25Å; L697-A734 HydrophobicContact CD2-CB 4.35Å; L697-E738 HydrophobicContact CD1-CB 3.97Å; L697-F768 HydrophobicContact CB-CD1 4.21Å; L697-F768 HydrophobicContact CB-CE1 3.95Å; L697-L772 HydrophobicContact CD2-CD2 3.7Å; L697-L772 HydrophobicContact CD2-CG 4.17Å
698	N	93.3	Very high	92	Very high	96 Å²	96	88.8 Å²	88.8	51%	0.513	45%	0.446	S	S	.	.			trans	-110.5	103.8	-179.6	-164	-44.5	0	0	0	111	T696 P700 E738	T696-N698 PolarHBondContact O-N 3.34Å; N698-P700 VanDerWaalsContact O-CD 3.29Å; N698-P700 WeakPolarHBondContact O-CD 3.41Å; N698-E738 WeakPolarHBondContact CB-OE1 3.35Å; N698-E738 PolarHBondContact N-OE1 3.21Å
699	L	94.9	Very high	92.4	Very high	34 Å²	34	86 Å²	86	18%	0.178	43%	0.432	C	S	.	.			trans	-114.1	83.3	179.9	-60.8	173.6	0	0	0	108.8	L697 V737 E738 W741 L775 L777	L697-L699 HydrophobicContact CD1-CD1 3.92Å; L697-L699 HydrophobicContact CD1-CD2 3.89Å; L697-L699 HydrophobicContact CD1-CG 3.73Å; L697-L699 HydrophobicContact CD2-CD1 3.93Å; L697-L699 HydrophobicContact CG-CD1 3.88Å; L697-L699 HydrophobicContact CG-CG 3.92Å; L699-V737 HydrophobicContact CD1-CG1 4.39Å; L699-V737 HydrophobicContact CD2-CG1 4.25Å; L699-E738 HydrophobicContact CD2-CB 4.44Å; L699-W741 HydrophobicContact CB-CD2 4.18Å; L699-W741 HydrophobicContact CB-CG 4.36Å; L699-W741 HydrophobicContact CB-CZ2 4.3Å; L699-W741 HydrophobicContact CD2-CB 3.52Å; L699-W741 HydrophobicContact CD2-CD2 3.8Å; L699-W741 HydrophobicContact CD2-CE3 4.3Å; L699-W741 HydrophobicContact CD2-CG 3.45Å; L699-W741 VanDerWaalsContact CD2-CG 3.45Å; L699-W741 HydrophobicContact CG-CD2 4.49Å; L699-W741 HydrophobicContact CG-CG 4.48Å; L699-L775 HydrophobicContact CD1-CD1 3.74Å; L699-L777 HydrophobicContact CD1-CD1 3.7Å
700	P	92.1	Very high	92.8	Very high	40 Å²	40	81.3 Å²	81.3	26%	0.26	41%	0.41	S	S	.	.			trans	-64.5	140.9	-176.8	26.7	-35.5	0	0	0	110.8	N698 E702 W741	N698-P700 VanDerWaalsContact O-CD 3.29Å; N698-P700 WeakPolarHBondContact O-CD 3.41Å; P700-E702 HydrophobicContact CB-CG 4.23Å; P700-E702 PolarHBondContact O-N 3.19Å; P700-W741 PolarHBondContact O-NE1 3.14Å
701	N	90.2	Very high	93.2	Very high	167 Å²	167	80.6 Å²	80.6	89%	0.893	41%	0.405	S	S	*	.			trans	-78	52.3	-177.1	-168.5	18.1	0	0	0	112.7
702	E	91.8	Very high	93.6	Very high	121 Å²	121	78.5 Å²	78.5	57%	0.565	39%	0.394	S	S	*	.	P	Polyproline II helix	trans	-88.3	149.2	175.9	-68.9	165.3	-162.1	0	0	110.5	P700 G704 R746	P700-E702 HydrophobicContact CB-CG 4.23Å; P700-E702 PolarHBondContact O-N 3.19Å; E702-G704 PolarHBondContact O-N 3.37Å; E702-R746 PolarHBondContact O-NE 3.38Å; E702-R746 PolarHBondContact O-NH2 3.04Å
703	R	89.9	Confident	94.1	Very high	253 Å²	253	69.3 Å²	69.3	96%	0.955	36%	0.359	S	S	*	.	P	Polyproline II helix	trans	-63.6	125.1	174.4	-66.2	-177	179.9	-179.4	1	110.2
704	G	92	Very high	94.5	Very high	29 Å²	29	65.4 Å²	65.4	30%	0.299	34%	0.335	S	S	.	.	P	Polyproline II helix	trans	-73.8	169.5	172.3	0	0	0	0	0	113.4	E702 G744	E702-G704 PolarHBondContact O-N 3.37Å; G704-G744 CarbonylContact C-O 3.54Å; G704-G744 WeakPolarHBondContact CA-O 3.05Å
705	N	93.9	Very high	94.9	Very high	65 Å²	65	57.1 Å²	57.1	35%	0.348	30%	0.296	S	S	.	.	P	Polyproline II helix	trans	-88.8	117.7	171.7	178.7	0.9	0	0	0	110	D707 L708 G744	N705-D707 VanDerWaalsContact C-N 3.29Å; N705-D707 PolarHBondContact O-N 2.84Å; N705-D707 WeakPolarHBondContact OD1-CB 3.08Å; N705-D707 PolarHBondContact OD1-N 3.01Å; N705-L708 HydrophobicContact CB-CD1 3.79Å; N705-L708 HydrophobicContact CB-CG 3.93Å; N705-L708 PolarHBondContact O-N 2.84Å; N705-G744 PolarHBondContact N-O 2.9Å
706	P	92.3	Very high	95	Very high	96 Å²	96	56.7 Å²	56.7	62%	0.623	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.1	-20.2	-178.2	30.6	-36.7	0	0	0	114	L708 K864	P706-L708 PolarHBondContact O-N 3.41Å; P706-K864 PolarHBondContact O-NZ 2.79Å
707	D	94.8	Very high	95.2	Very high	77 Å²	77	53.6 Å²	53.6	41%	0.412	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.4	-3.8	180	-65.6	-48.6	0	0	0	113.2	N705 R863 K864 N866	N705-D707 VanDerWaalsContact C-N 3.29Å; N705-D707 PolarHBondContact O-N 2.84Å; N705-D707 WeakPolarHBondContact OD1-CB 3.08Å; N705-D707 PolarHBondContact OD1-N 3.01Å; D707-R863 WeakPolarHBondContact O-CA 3.45Å; D707-K864 WeakPolarHBondContact O-CB 3.24Å; D707-K864 PolarHBondContact O-N 2.74Å; D707-N866 PolarHBondContact OD1-ND2 3.3Å
708	L	96.7	Very high	95.4	Very high	14 Å²	14	52.5 Å²	52.5	7%	0.073	27%	0.271	C	S	.	.	B	Isolated β-bridge	trans	-82.8	145.6	176.3	-64.2	175.3	0	0	0	111.9	N705 P706 L862 R863 K864	N705-L708 HydrophobicContact CB-CD1 3.79Å; N705-L708 HydrophobicContact CB-CG 3.93Å; N705-L708 PolarHBondContact O-N 2.84Å; P706-L708 PolarHBondContact O-N 3.41Å; L708-L862 CarbonylContact C-O 3.55Å; L708-L862 WeakPolarHBondContact CA-O 3.4Å; L708-L862 HydrophobicContact CD2-CB 4.48Å; L708-R863 HydrophobicContact CD2-CG 4.12Å; L708-K864 WeakPolarHBondContact O-CD 3.29Å; L708-K864 WeakPolarHBondContact O-CE 3.31Å; L708-K864 PolarHBondContact O-NZ 2.85Å
709	R	97.1	Very high	95.6	Very high	19 Å²	19	47.9 Å²	47.9	7%	0.072	25%	0.247	C	C	.	.	P	Polyproline II helix	trans	-67.6	155.3	174.3	-70.9	176.7	-176.5	-90	-0.9	111.6	H745 D807 I809 F861 L862 R863 K864 D865	R709-H745 PolarHBondContact O-ND1 3.46Å; R709-D807 IonicContact CZ-OD2 3.78Å; R709-D807 VanDerWaalsContact NH1-CG 3.27Å; R709-D807 PolarHBondContact NH1-O 3.4Å; R709-D807 IonicContact NH1-OD1 2.75Å; R709-D807 IonicContact NH1-OD2 3.27Å; R709-D807 PolarHBondContact NH1-OD2 3.29Å; R709-D807 IonicContact NH2-OD2 2.95Å; R709-I809 HydrophobicContact CB-CD1 4.07Å; R709-I809 HydrophobicContact CB-CG1 4.4Å; R709-F861 WeakPolarHBondContact CD-O 3.37Å; R709-L862 PolarHBondContact N-O 3.3Å; R709-R863 PolarHBondContact NE-O 2.86Å; R709-K864 HydrophobicContact CG-CG 3.96Å; R709-D865 IonicContact NH2-OD2 3.1Å; R709-D865 PolarHBondContact NH2-OD2 3.05Å
710	H	98.1	Very high	95.7	Very high	27 Å²	27	48.8 Å²	48.8	13%	0.125	25%	0.251	C	S	.	.	P	Polyproline II helix	trans	-64.2	129.5	170.4	-164.3	124.6	0	0	0	109.3	E747 T749 T806 G808 I809	H710-E747 WeakPolarHBondContact CA-O 3.21Å; H710-E747 HydrophobicContact CB-CB 4.19Å; H710-T749 PolarHBondContact CE1-OG1 3.18Å; H710-T749 PolarHBondContact NE2-OG1 2.66Å; H710-T806 HydrophobicContact CB-CG2 4.44Å; H710-G808 CarbonylContact O-C 3.57Å; H710-G808 WeakPolarHBondContact O-CA 3.4Å; H710-I809 PolarHBondContact O-N 3.18Å
711	I	98.6	Very high	95.9	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	121.1	179.4	-57.5	-56.9	0	0	0	109.9	I713 F740 H745 E747 I748 T749 I809 V811 L862	I711-I713 HydrophobicContact CG2-CD1 4.27Å; I711-I713 HydrophobicContact CG2-CG1 3.85Å; I711-F740 HydrophobicContact CD1-CD1 4.23Å; I711-F740 HydrophobicContact CD1-CE1 4.24Å; I711-F740 HydrophobicContact CG1-CD1 3.97Å; I711-F740 HydrophobicContact CG1-CE1 4.42Å; I711-F740 HydrophobicContact CG1-CG 4.29Å; I711-F740 HydrophobicContact CG2-CD1 4.14Å; I711-F740 HydrophobicContact CG2-CD2 3.81Å; I711-F740 HydrophobicContact CG2-CE1 4.26Å; I711-F740 HydrophobicContact CG2-CE2 3.96Å; I711-F740 HydrophobicContact CG2-CG 3.93Å; I711-F740 HydrophobicContact CG2-CZ 4.19Å; I711-H745 HydrophobicContact CG1-CB 4.34Å; I711-H745 VanDerWaalsContact CG1-ND1 3.28Å; I711-H745 WeakPolarHBondContact CG1-ND1 3.09Å; I711-E747 PolarHBondContact N-O 3.49Å; I711-I748 HydrophobicContact CB-CG1 4.43Å; I711-I748 HydrophobicContact CB-CG2 4.5Å; I711-I748 CarbonylContact O-C 3.55Å; I711-I748 WeakPolarHBondContact O-CA 3.32Å; I711-T749 PolarHBondContact O-N 3.41Å; I711-I809 HydrophobicContact CD1-CB 4.23Å; I711-I809 HydrophobicContact CD1-CD1 4.3Å; I711-V811 HydrophobicContact CG2-CG2 3.69Å; I711-L862 HydrophobicContact CD1-CD2 3.62Å
712	I	98.8	Very high	96.3	Very high	0 Å²	0	40 Å²	40	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	103.3	-172.2	-57.8	168.1	0	0	0	107.3	T749 F751 L799 L802 A803 I809 I810 V811	I712-T749 CarbonylContact C-O 3.57Å; I712-T749 WeakPolarHBondContact CA-O 3.32Å; I712-F751 HydrophobicContact CG2-CD2 4.36Å; I712-L799 HydrophobicContact CG2-CB 4.48Å; I712-L799 HydrophobicContact CG2-CD2 3.67Å; I712-L802 HydrophobicContact CD1-CB 3.95Å; I712-L802 HydrophobicContact CD1-CD2 4.12Å; I712-L802 HydrophobicContact CD1-CG 3.74Å; I712-L802 HydrophobicContact CG1-CD2 3.92Å; I712-L802 HydrophobicContact CG1-CG 4.11Å; I712-L802 HydrophobicContact CG2-CD2 4.17Å; I712-A803 HydrophobicContact CD1-CB 3.73Å; I712-I809 WeakPolarHBondContact CB-O 3.4Å; I712-I809 PolarHBondContact N-O 2.88Å; I712-I810 CarbonylContact O-C 3.57Å; I712-I810 VanDerWaalsContact O-CA 3.31Å; I712-I810 WeakPolarHBondContact O-CA 3.41Å; I712-V811 PolarHBondContact O-N 2.67Å
713	I	98.8	Very high	96.4	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	125.4	-170.9	-52.7	-176.2	0	0	0	110	I711 G715 V718 A736 V737 F740 I748 T749 V750 F751 V811	I711-I713 HydrophobicContact CG2-CD1 4.27Å; I711-I713 HydrophobicContact CG2-CG1 3.85Å; I713-G715 VanDerWaalsContact C-N 3.33Å; I713-G715 PolarHBondContact O-N 3.32Å; I713-V718 HydrophobicContact CG2-CB 4.43Å; I713-V718 HydrophobicContact CG2-CG2 3.73Å; I713-A736 HydrophobicContact CD1-CB 4.32Å; I713-V737 HydrophobicContact CD1-CG2 3.96Å; I713-F740 HydrophobicContact CD1-CD2 4.12Å; I713-F740 HydrophobicContact CD1-CE2 4.47Å; I713-I748 HydrophobicContact CD1-CG2 4Å; I713-I748 HydrophobicContact CG1-CG2 4.43Å; I713-T749 PolarHBondContact N-O 2.97Å; I713-V750 HydrophobicContact CB-CB 4.39Å; I713-V750 HydrophobicContact CB-CG1 4.24Å; I713-V750 HydrophobicContact CB-CG2 4.14Å; I713-V750 HydrophobicContact CD1-CG2 4.35Å; I713-V750 HydrophobicContact CG2-CG1 4.36Å; I713-V750 WeakPolarHBondContact O-CA 3.35Å; I713-F751 PolarHBondContact O-N 3Å; I713-V811 HydrophobicContact CG1-CB 4.3Å; I713-V811 HydrophobicContact CG1-CG2 4.38Å
714	D	98.4	Very high	96.6	Very high	9 Å²	9	25.8 Å²	25.8	5%	0.048	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	89.6	164.5	-177.8	-15.9	0	0	0	108.8	S716 N717 V718 L799 V811 T812	D714-S716 PolarHBondContact O-N 3.02Å; D714-S716 WeakPolarHBondContact OD1-CB 3.18Å; D714-S716 PolarHBondContact OD1-N 3.36Å; D714-N717 HydrophobicContact CB-CB 3.98Å; D714-N717 PolarHBondContact O-N 3.5Å; D714-N717 WeakPolarHBondContact OD1-CB 3.46Å; D714-N717 PolarHBondContact OD1-N 2.91Å; D714-N717 WeakPolarHBondContact OD2-CB 3.28Å; D714-V718 WeakPolarHBondContact O-CB 3.28Å; D714-V718 WeakPolarHBondContact O-CG2 3.48Å; D714-V718 PolarHBondContact O-N 2.87Å; D714-L799 HydrophobicContact CB-CD1 3.82Å; D714-L799 HydrophobicContact CB-CD2 4.25Å; D714-V811 WeakPolarHBondContact CB-O 3.18Å; D714-V811 PolarHBondContact N-O 2.87Å; D714-T812 WeakPolarHBondContact OD2-CB 3.23Å; D714-T812 PolarHBondContact OD2-OG1 3.33Å
715	G	97.9	Very high	96.6	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-64.8	-24	-178.4	0	0	0	0	0	112.6	I713 A719 I733 F751	I713-G715 VanDerWaalsContact C-N 3.33Å; I713-G715 PolarHBondContact O-N 3.32Å; G715-A719 WeakPolarHBondContact O-CB 3.17Å; G715-A719 PolarHBondContact O-N 2.67Å; G715-I733 WeakPolarHBondContact O-CD1 3.32Å; G715-F751 WeakPolarHBondContact CA-O 3.42Å; G715-F751 PolarHBondContact N-O 3.44Å
716	S	96.6	Very high	96.5	Very high	23 Å²	23	35 Å²	35	16%	0.161	18%	0.176	C	C	.	.	H	α-helix	trans	-69.1	-50.8	174	-73.5	0	0	0	0	111.5	D714 M720 P753 D795	D714-S716 PolarHBondContact O-N 3.02Å; D714-S716 WeakPolarHBondContact OD1-CB 3.18Å; D714-S716 PolarHBondContact OD1-N 3.36Å; S716-M720 WeakPolarHBondContact O-CB 3.36Å; S716-M720 VanDerWaalsContact O-CG 3.22Å; S716-M720 WeakPolarHBondContact O-CG 3.36Å; S716-M720 PolarHBondContact O-N 3.21Å; S716-M720 VanDerWaalsContact O-N 3.1Å; S716-P753 WeakPolarHBondContact OG-CD 3.48Å; S716-D795 PolarHBondContact OG-OD2 2.92Å
717	N	98	Very high	96.6	Very high	32 Å²	32	31.8 Å²	31.8	17%	0.171	15%	0.153	C	C	.	.	H	α-helix	trans	-65.5	-46.2	179.5	-168.4	-72.5	0	0	0	111.5	D714 M720 A721 T812 N813 D814 F837	D714-N717 HydrophobicContact CB-CB 3.98Å; D714-N717 PolarHBondContact O-N 3.5Å; D714-N717 WeakPolarHBondContact OD1-CB 3.46Å; D714-N717 PolarHBondContact OD1-N 2.91Å; D714-N717 WeakPolarHBondContact OD2-CB 3.28Å; N717-M720 PolarHBondContact O-N 3.48Å; N717-A721 VanDerWaalsContact O-CB 3.3Å; N717-A721 WeakPolarHBondContact O-CB 3.44Å; N717-A721 PolarHBondContact O-N 3.44Å; N717-T812 VanDerWaalsContact CG-OG1 3.31Å; N717-T812 PolarHBondContact ND2-OG1 3.39Å; N717-N813 WeakPolarHBondContact OD1-CB 3.48Å; N717-N813 PolarHBondContact OD1-N 3.04Å; N717-D814 PolarHBondContact ND2-N 3.49Å; N717-F837 WeakPolarHBondContact OD1-CE1 3.18Å; N717-F837 VanDerWaalsContact OD1-CZ 3.31Å; N717-F837 WeakPolarHBondContact OD1-CZ 3.45Å
718	V	98.5	Very high	96.7	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-60.9	-46.8	176.8	171.9	0	0	0	0	112.3	I713 D714 M720 A721 H722 G732 I733 A736 F837 F839	I713-V718 HydrophobicContact CG2-CB 4.43Å; I713-V718 HydrophobicContact CG2-CG2 3.73Å; D714-V718 WeakPolarHBondContact O-CB 3.28Å; D714-V718 WeakPolarHBondContact O-CG2 3.48Å; D714-V718 PolarHBondContact O-N 2.87Å; V718-M720 PolarHBondContact O-N 3.39Å; V718-A721 PolarHBondContact O-N 2.85Å; V718-H722 PolarHBondContact O-N 3.16Å; V718-H722 VanDerWaalsContact O-N 3.11Å; V718-G732 WeakPolarHBondContact CG1-O 3.45Å; V718-I733 HydrophobicContact CG1-CG1 4.48Å; V718-A736 HydrophobicContact CG1-CB 3.96Å; V718-F837 HydrophobicContact CB-CZ 4.21Å; V718-F837 HydrophobicContact CG2-CD1 4.4Å; V718-F837 HydrophobicContact CG2-CE1 3.7Å; V718-F837 HydrophobicContact CG2-CE2 4.18Å; V718-F837 HydrophobicContact CG2-CZ 3.59Å; V718-F839 HydrophobicContact CG1-CE2 4Å; V718-F839 HydrophobicContact CG1-CZ 3.99Å
719	A	97.8	Very high	96.7	Very high	0 Å²	0	27.5 Å²	27.5	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-65.7	-37.5	180	0	0	0	0	0	113.1	G715 G723 F728 S729 I733	G715-A719 WeakPolarHBondContact O-CB 3.17Å; G715-A719 PolarHBondContact O-N 2.67Å; A719-G723 PolarHBondContact O-N 2.98Å; A719-G723 VanDerWaalsContact O-N 3.1Å; A719-F728 HydrophobicContact CB-CD1 4.13Å; A719-F728 HydrophobicContact CB-CD2 3.69Å; A719-F728 HydrophobicContact CB-CE1 4.03Å; A719-F728 HydrophobicContact CB-CE2 3.62Å; A719-F728 HydrophobicContact CB-CG 3.97Å; A719-F728 HydrophobicContact CB-CZ 3.78Å; A719-S729 WeakPolarHBondContact CA-O 3.16Å; A719-S729 WeakPolarHBondContact CB-O 3.44Å; A719-S729 PolarHBondContact O-N 2.93Å; A719-I733 HydrophobicContact CB-CD1 4.04Å; A719-I733 HydrophobicContact CB-CG1 3.94Å
720	M	97.3	Very high	96.7	Very high	52 Å²	52	26.6 Å²	26.6	26%	0.256	13%	0.127	S	C	.	.	H	α-helix	trans	-73.7	-39	178.2	-69	-62.7	-61.5	0	0	111.8	S716 N717 V718 G723 L724 H725 F728	S716-M720 WeakPolarHBondContact O-CB 3.36Å; S716-M720 VanDerWaalsContact O-CG 3.22Å; S716-M720 WeakPolarHBondContact O-CG 3.36Å; S716-M720 PolarHBondContact O-N 3.21Å; S716-M720 VanDerWaalsContact O-N 3.1Å; N717-M720 PolarHBondContact O-N 3.48Å; V718-M720 PolarHBondContact O-N 3.39Å; M720-G723 CarbonylContact O-C 3.54Å; M720-G723 PolarHBondContact O-N 2.7Å; M720-L724 PolarHBondContact O-N 2.98Å; M720-H725 WeakPolarHBondContact CE-O 3.27Å; M720-H725 VanDerWaalsContact O-CA 3.28Å; M720-H725 WeakPolarHBondContact O-CA 3.33Å; M720-H725 PolarHBondContact O-N 3.31Å; M720-F728 HydrophobicContact CG-CD2 4.5Å; M720-F728 HydrophobicContact SD-CB 4.33Å; M720-F728 HydrophobicContact SD-CD2 4.3Å
721	A	97.3	Very high	96.7	Very high	16 Å²	16	25.5 Å²	25.5	13%	0.132	12%	0.121	C	C	.	.	H	α-helix	trans	-62.4	-48.4	176.4	0	0	0	0	0	111.9	N717 V718 G723 L724 F837 F839	N717-A721 VanDerWaalsContact O-CB 3.3Å; N717-A721 WeakPolarHBondContact O-CB 3.44Å; N717-A721 PolarHBondContact O-N 3.44Å; V718-A721 PolarHBondContact O-N 2.85Å; A721-G723 VanDerWaalsContact C-N 3.31Å; A721-G723 PolarHBondContact O-N 3.07Å; A721-L724 PolarHBondContact O-N 2.94Å; A721-F837 HydrophobicContact CB-CE2 3.66Å; A721-F837 HydrophobicContact CB-CZ 3.98Å; A721-F839 HydrophobicContact CB-CD2 4.16Å; A721-F839 HydrophobicContact CB-CE2 4.5Å
722	H	97.4	Very high	96.7	Very high	8 Å²	8	25.5 Å²	25.5	4%	0.037	12%	0.121	C	C	.	.	H	α-helix	trans	-61.2	-40.6	174.2	-173.5	-116.6	0	0	0	111.9	F687 V718 L724 S729 G732 F839 D842	F687-H722 AromaticContact CE2-ND1 3.99Å; V718-H722 PolarHBondContact O-N 3.16Å; V718-H722 VanDerWaalsContact O-N 3.11Å; H722-L724 PolarHBondContact O-N 2.89Å; H722-L724 VanDerWaalsContact O-N 3.08Å; H722-S729 WeakPolarHBondContact ND1-CB 3.42Å; H722-S729 PolarHBondContact ND1-OG 3.47Å; H722-G732 PolarHBondContact ND1-N 3.14Å; H722-F839 HydrophobicContact CB-CD1 4.28Å; H722-F839 HydrophobicContact CB-CD2 3.87Å; H722-F839 HydrophobicContact CB-CE1 4.11Å; H722-F839 HydrophobicContact CB-CE2 3.7Å; H722-F839 HydrophobicContact CB-CG 4.15Å; H722-F839 HydrophobicContact CB-CZ 3.82Å; H722-F839 AromaticContact CD2-CD1 3.44Å; H722-F839 VanDerWaalsContact CD2-CD1 3.44Å; H722-F839 WeakPolarHBondContact CD2-CD1 3.46Å; H722-F839 AromaticContact CD2-CE1 3.58Å; H722-F839 AromaticContact CD2-CG 3.92Å; H722-D842 IonicContact CE1-OD1 2.65Å; H722-D842 IonicContact NE2-OD1 3.87Å; H722-D842 PolarHBondContact NE2-OD1 3.43Å
723	G	95.2	Very high	96.7	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	12%	0.121	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.2	22.8	177.7	0	0	0	0	0	115.8	A719 M720 A721 H725 R726 F727	A719-G723 PolarHBondContact O-N 2.98Å; A719-G723 VanDerWaalsContact O-N 3.1Å; M720-G723 CarbonylContact O-C 3.54Å; M720-G723 PolarHBondContact O-N 2.7Å; A721-G723 VanDerWaalsContact C-N 3.31Å; A721-G723 PolarHBondContact O-N 3.07Å; G723-H725 PolarHBondContact O-N 3.13Å; G723-H725 VanDerWaalsContact O-N 3.16Å; G723-R726 PolarHBondContact O-N 3.34Å; G723-F727 WeakPolarHBondContact CA-O 3.43Å; G723-F727 PolarHBondContact O-N 3.22Å
724	L	93.3	Very high	96.6	Very high	74 Å²	74	25.5 Å²	25.5	39%	0.387	12%	0.121	S	C	.	.	T	Hydrogen-bonded Turn	trans	54.1	32.7	178.8	-54.5	176.8	0	0	0	113.8	G683 F687 M720 A721 H722 R726	G683-L724 VanDerWaalsContact C-CD1 3.49Å; G683-L724 WeakPolarHBondContact O-CD1 3.29Å; F687-L724 HydrophobicContact CB-CD1 3.75Å; F687-L724 HydrophobicContact CB-CG 4.35Å; F687-L724 HydrophobicContact CG-CD1 4.29Å; F687-L724 HydrophobicContact CG-CG 4.49Å; M720-L724 PolarHBondContact O-N 2.98Å; A721-L724 PolarHBondContact O-N 2.94Å; H722-L724 PolarHBondContact O-N 2.89Å; H722-L724 VanDerWaalsContact O-N 3.08Å; L724-R726 PolarHBondContact O-N 2.89Å
725	H	92.4	Very high	96.6	Very high	141 Å²	141	26.1 Å²	26.1	65%	0.653	12%	0.124	S	C	*	.	T	Hydrogen-bonded Turn	trans	55.1	14.6	-170.9	-54.7	-79	0	0	0	115.3	M720 G723	M720-H725 WeakPolarHBondContact CE-O 3.27Å; M720-H725 VanDerWaalsContact O-CA 3.28Å; M720-H725 WeakPolarHBondContact O-CA 3.33Å; M720-H725 PolarHBondContact O-N 3.31Å; G723-H725 PolarHBondContact O-N 3.13Å; G723-H725 VanDerWaalsContact O-N 3.16Å
726	R	91.9	Very high	96.7	Very high	146 Å²	146	26.1 Å²	26.1	55%	0.551	12%	0.124	S	C	*	.	T	Hydrogen-bonded Turn	trans	-114.5	-26.2	-178.7	-70.5	179	63.3	153.1	5.2	113.8	G723 L724	G723-R726 PolarHBondContact O-N 3.34Å; L724-R726 PolarHBondContact O-N 2.89Å
727	F	94.2	Very high	96.8	Very high	30 Å²	30	25 Å²	25	13%	0.132	12%	0.117	C	C	.	.	S	Bend	trans	-125.4	150.7	-179.8	-58.7	-85.4	0	0	0	109.9	L684 F687 H688 G723 S729 L762 T764	L684-F727 HydrophobicContact CD1-CE2 3.59Å; L684-F727 HydrophobicContact CD1-CZ 4.12Å; F687-F727 AromaticContact CD1-CD2 3.98Å; F687-F727 HydrophobicContact CD1-CD2 3.98Å; F687-F727 HydrophobicContact CD1-CE2 4.29Å; F687-F727 HydrophobicContact CE1-CB 4Å; F687-F727 AromaticContact CE1-CD2 3.48Å; F687-F727 HydrophobicContact CE1-CD2 3.48Å; F687-F727 VanDerWaalsContact CE1-CD2 3.48Å; F687-F727 HydrophobicContact CE1-CE2 4.13Å; F687-F727 AromaticContact CE1-CG 3.82Å; F687-F727 HydrophobicContact CE1-CG 3.82Å; F687-F727 HydrophobicContact CZ-CB 4.21Å; F687-F727 HydrophobicContact CZ-CD2 4.43Å; H688-F727 AromaticContact NE2-CE2 3.86Å; H688-F727 AromaticContact NE2-CZ 3.54Å; G723-F727 WeakPolarHBondContact CA-O 3.43Å; G723-F727 PolarHBondContact O-N 3.22Å; F727-S729 PolarHBondContact O-N 2.9Å; F727-L762 CarbonylContact C-O 3.5Å; F727-L762 WeakPolarHBondContact CA-O 3.43Å; F727-L762 WeakPolarHBondContact CB-O 3.41Å; F727-L762 HydrophobicContact CD1-CD2 4.17Å; F727-L762 HydrophobicContact CE1-CD2 4.09Å; F727-T764 HydrophobicContact CD1-CG2 4.48Å
728	F	96.8	Very high	96.8	Very high	1 Å²	1	24 Å²	24	0%	0.004	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	97.5	167.9	-173.8	-90	0	0	0	107.9	A719 M720 I733 V752 R756 L762 A763 T764 L769	A719-F728 HydrophobicContact CB-CD1 4.13Å; A719-F728 HydrophobicContact CB-CD2 3.69Å; A719-F728 HydrophobicContact CB-CE1 4.03Å; A719-F728 HydrophobicContact CB-CE2 3.62Å; A719-F728 HydrophobicContact CB-CG 3.97Å; A719-F728 HydrophobicContact CB-CZ 3.78Å; M720-F728 HydrophobicContact CG-CD2 4.5Å; M720-F728 HydrophobicContact SD-CB 4.33Å; M720-F728 HydrophobicContact SD-CD2 4.3Å; F728-I733 HydrophobicContact CE1-CD1 4.4Å; F728-I733 HydrophobicContact CZ-CD1 4.2Å; F728-V752 HydrophobicContact CZ-CG1 3.88Å; F728-R756 HydrophobicContact CD2-CG 4.47Å; F728-R756 VanDerWaalsContact CD2-NE 3.25Å; F728-R756 HydrophobicContact CE1-CB 4.29Å; F728-R756 HydrophobicContact CE1-CG 4.33Å; F728-R756 HydrophobicContact CE2-CG 3.92Å; F728-R756 HydrophobicContact CZ-CB 4.18Å; F728-R756 HydrophobicContact CZ-CG 3.87Å; F728-L762 PolarHBondContact N-O 2.98Å; F728-A763 HydrophobicContact CB-CB 4.46Å; F728-A763 HydrophobicContact CD1-CB 4.44Å; F728-A763 CarbonylContact O-C 3.52Å; F728-A763 VanDerWaalsContact O-CA 3.32Å; F728-A763 WeakPolarHBondContact O-CA 3.5Å; F728-T764 PolarHBondContact O-N 3Å; F728-L769 HydrophobicContact CE1-CD1 4.24Å; F728-L769 HydrophobicContact CE1-CD2 4.27Å
729	S	97.2	Very high	96.7	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	102.2	-174.2	-167.6	0	0	0	0	112.7	A719 H722 F727 R731 G732 T764	A719-S729 WeakPolarHBondContact CA-O 3.16Å; A719-S729 WeakPolarHBondContact CB-O 3.44Å; A719-S729 PolarHBondContact O-N 2.93Å; H722-S729 WeakPolarHBondContact ND1-CB 3.42Å; H722-S729 PolarHBondContact ND1-OG 3.47Å; F727-S729 PolarHBondContact O-N 2.9Å; S729-R731 PolarHBondContact O-N 2.96Å; S729-G732 PolarHBondContact O-N 2.93Å; S729-T764 VanDerWaalsContact CA-OG1 3.31Å; S729-T764 WeakPolarHBondContact CA-OG1 3.43Å; S729-T764 WeakPolarHBondContact CB-OG1 3.47Å; S729-T764 PolarHBondContact OG-OG1 3.21Å
730	C	97.3	Very high	96.7	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-67.1	-24.2	-178.3	-53.6	0	0	0	0	112.5	G732 I733 A734 T764 E765 F768 L769	C730-G732 VanDerWaalsContact C-N 3.31Å; C730-G732 PolarHBondContact O-N 3.2Å; C730-I733 WeakPolarHBondContact O-CB 3.37Å; C730-I733 PolarHBondContact O-N 2.93Å; C730-A734 PolarHBondContact O-N 2.85Å; C730-A734 VanDerWaalsContact O-N 3.12Å; C730-T764 WeakPolarHBondContact CB-O 3.49Å; C730-T764 PolarHBondContact N-O 2.99Å; C730-T764 VanDerWaalsContact N-O 3.1Å; C730-T764 PolarHBondContact SG-O 3.26Å; C730-T764 VanDerWaalsContact SG-O 3.42Å; C730-E765 WeakPolarHBondContact CB-O 3.34Å; C730-F768 HydrophobicContact CB-CB 4.13Å; C730-L769 HydrophobicContact CB-CD2 4.04Å; C730-L769 HydrophobicContact CB-CG 4.16Å
731	R	97.5	Very high	96.7	Very high	4 Å²	4	25.3 Å²	25.3	2%	0.015	12%	0.116	C	C	.	.	H	α-helix	trans	-60.8	-35.6	168.6	171.1	169.6	174.3	160.4	-7.3	112.9	S690 T693 F695 S729 I733 A734 L735 E765 F768 D842	S690-R731 PolarHBondContact O-NH1 3.18Å; S690-R731 PolarHBondContact O-NH2 3.17Å; T693-R731 PolarHBondContact O-NH1 3.45Å; T693-R731 PolarHBondContact O-NH2 2.99Å; F695-R731 VanDerWaalsContact CB-CZ 3.46Å; F695-R731 HydrophobicContact CD1-CG 3.98Å; F695-R731 HydrophobicContact CG-CG 4.37Å; S729-R731 PolarHBondContact O-N 2.96Å; R731-I733 VanDerWaalsContact C-N 3.3Å; R731-I733 PolarHBondContact O-N 3.17Å; R731-A734 PolarHBondContact O-N 3Å; R731-L735 HydrophobicContact CG-CD1 3.75Å; R731-L735 HydrophobicContact CG-CG 4.24Å; R731-L735 WeakPolarHBondContact O-CB 3.19Å; R731-L735 WeakPolarHBondContact O-CD1 3.21Å; R731-L735 VanDerWaalsContact O-CG 3.24Å; R731-L735 WeakPolarHBondContact O-CG 3.29Å; R731-L735 PolarHBondContact O-N 3.28Å; R731-E765 WeakPolarHBondContact CB-OE2 3.27Å; R731-E765 WeakPolarHBondContact CD-OE2 3.48Å; R731-E765 IonicContact NH1-OE1 3.8Å; R731-E765 PolarHBondContact NH1-OE1 3.18Å; R731-E765 IonicContact NH1-OE2 2.88Å; R731-F768 HydrophobicContact CB-CD2 4.24Å; R731-F768 HydrophobicContact CB-CE2 4.15Å; R731-D842 IonicContact CZ-OD2 3.3Å; R731-D842 IonicContact NE-OD1 3.25Å; R731-D842 IonicContact NE-OD2 3.96Å; R731-D842 IonicContact NH2-OD1 3.96Å; R731-D842 IonicContact NH2-OD2 3.92Å; R731-D842 PolarHBondContact NH2-OD2 3.08Å
732	G	97.9	Very high	96.7	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-59.2	-41.6	173.9	0	0	0	0	0	112.2	V718 H722 S729 C730 A736	V718-G732 WeakPolarHBondContact CG1-O 3.45Å; H722-G732 PolarHBondContact ND1-N 3.14Å; S729-G732 PolarHBondContact O-N 2.93Å; C730-G732 VanDerWaalsContact C-N 3.31Å; C730-G732 PolarHBondContact O-N 3.2Å; G732-A736 PolarHBondContact O-N 3.41Å; G732-A736 VanDerWaalsContact O-N 3.09Å
733	I	98.5	Very high	96.6	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-63	-48.1	174.2	-53.9	177.6	0	0	0	110.4	G715 V718 A719 F728 C730 R731 L735 A736 V737 V750 V752 L769 L772	G715-I733 WeakPolarHBondContact O-CD1 3.32Å; V718-I733 HydrophobicContact CG1-CG1 4.48Å; A719-I733 HydrophobicContact CB-CD1 4.04Å; A719-I733 HydrophobicContact CB-CG1 3.94Å; F728-I733 HydrophobicContact CE1-CD1 4.4Å; F728-I733 HydrophobicContact CZ-CD1 4.2Å; C730-I733 WeakPolarHBondContact O-CB 3.37Å; C730-I733 PolarHBondContact O-N 2.93Å; R731-I733 VanDerWaalsContact C-N 3.3Å; R731-I733 PolarHBondContact O-N 3.17Å; I733-L735 VanDerWaalsContact C-N 3.34Å; I733-L735 PolarHBondContact O-N 2.94Å; I733-A736 PolarHBondContact O-N 2.75Å; I733-V737 HydrophobicContact CG2-CG2 4.41Å; I733-V737 WeakPolarHBondContact O-CG2 3.49Å; I733-V737 PolarHBondContact O-N 2.87Å; I733-V750 HydrophobicContact CG2-CB 4.31Å; I733-V750 HydrophobicContact CG2-CG1 3.62Å; I733-V750 HydrophobicContact CG2-CG2 3.86Å; I733-V752 HydrophobicContact CD1-CG2 3.89Å; I733-L769 HydrophobicContact CD1-CD2 3.76Å; I733-L772 HydrophobicContact CB-CD1 4.48Å; I733-L772 HydrophobicContact CG2-CD1 3.72Å
734	A	98.2	Very high	96.6	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-62.4	-39.1	-178.9	0	0	0	0	0	112.5	F695 L697 C730 R731 V737 E738 F768	F695-A734 HydrophobicContact CE1-CB 3.79Å; L697-A734 HydrophobicContact CD1-CB 4.25Å; L697-A734 HydrophobicContact CD2-CB 4.35Å; C730-A734 PolarHBondContact O-N 2.85Å; C730-A734 VanDerWaalsContact O-N 3.12Å; R731-A734 PolarHBondContact O-N 3Å; A734-V737 PolarHBondContact O-N 3.46Å; A734-E738 VanDerWaalsContact O-CB 3.27Å; A734-E738 WeakPolarHBondContact O-CB 3.34Å; A734-E738 PolarHBondContact O-N 3.26Å; A734-F768 HydrophobicContact CB-CB 4.21Å; A734-F768 HydrophobicContact CB-CD1 3.98Å; A734-F768 HydrophobicContact CB-CD2 4.39Å; A734-F768 HydrophobicContact CB-CG 3.94Å
735	L	98.3	Very high	96.8	Very high	21 Å²	21	33.9 Å²	33.9	11%	0.11	14%	0.144	C	C	.	.	H	α-helix	trans	-62.9	-44.1	173.6	-71.9	161.2	0	0	0	112	F695 R731 I733 E738 M739 F839 D842	F695-L735 HydrophobicContact CD2-CD2 4.18Å; F695-L735 HydrophobicContact CE1-CG 4.47Å; F695-L735 HydrophobicContact CE2-CD2 3.63Å; F695-L735 HydrophobicContact CE2-CG 4.41Å; F695-L735 HydrophobicContact CZ-CD2 3.83Å; F695-L735 HydrophobicContact CZ-CG 4.18Å; R731-L735 HydrophobicContact CG-CD1 3.75Å; R731-L735 HydrophobicContact CG-CG 4.24Å; R731-L735 WeakPolarHBondContact O-CB 3.19Å; R731-L735 WeakPolarHBondContact O-CD1 3.21Å; R731-L735 VanDerWaalsContact O-CG 3.24Å; R731-L735 WeakPolarHBondContact O-CG 3.29Å; R731-L735 PolarHBondContact O-N 3.28Å; I733-L735 VanDerWaalsContact C-N 3.34Å; I733-L735 PolarHBondContact O-N 2.94Å; L735-E738 PolarHBondContact O-N 3.16Å; L735-M739 WeakPolarHBondContact O-CB 3.38Å; L735-M739 PolarHBondContact O-N 3.24Å; L735-F839 HydrophobicContact CB-CE1 4.48Å; L735-F839 HydrophobicContact CD1-CE1 4.33Å; L735-D842 HydrophobicContact CD1-CB 4.06Å; L735-D842 WeakPolarHBondContact CD1-O 2.96Å
736	A	98.6	Very high	97	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-63.9	-45.6	176.3	0	0	0	0	0	111.9	I713 V718 G732 I733 M739 F740 F844	I713-A736 HydrophobicContact CD1-CB 4.32Å; V718-A736 HydrophobicContact CG1-CB 3.96Å; G732-A736 PolarHBondContact O-N 3.41Å; G732-A736 VanDerWaalsContact O-N 3.09Å; I733-A736 PolarHBondContact O-N 2.75Å; A736-M739 PolarHBondContact O-N 3.24Å; A736-F740 VanDerWaalsContact O-CD2 3.23Å; A736-F740 WeakPolarHBondContact O-CD2 3.46Å; A736-F740 PolarHBondContact O-N 3.3Å; A736-F844 HydrophobicContact CB-CD1 4.19Å; A736-F844 HydrophobicContact CB-CD2 3.91Å; A736-F844 HydrophobicContact CB-CE1 4.07Å; A736-F844 HydrophobicContact CB-CE2 3.75Å; A736-F844 HydrophobicContact CB-CG 4.12Å; A736-F844 HydrophobicContact CB-CZ 3.85Å
737	V	98.6	Very high	97.2	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-60.8	-45.8	175.7	172.9	0	0	0	0	111.2	L699 I713 I733 A734 M739 F740 W741 I748 V750 L772 L777	L699-V737 HydrophobicContact CD1-CG1 4.39Å; L699-V737 HydrophobicContact CD2-CG1 4.25Å; I713-V737 HydrophobicContact CD1-CG2 3.96Å; I733-V737 HydrophobicContact CG2-CG2 4.41Å; I733-V737 WeakPolarHBondContact O-CG2 3.49Å; I733-V737 PolarHBondContact O-N 2.87Å; A734-V737 PolarHBondContact O-N 3.46Å; V737-M739 VanDerWaalsContact C-N 3.31Å; V737-M739 PolarHBondContact O-N 2.89Å; V737-F740 PolarHBondContact O-N 3.01Å; V737-W741 VanDerWaalsContact O-CB 3.32Å; V737-W741 WeakPolarHBondContact O-CB 3.42Å; V737-W741 PolarHBondContact O-N 3.24Å; V737-I748 HydrophobicContact CG2-CG2 4.49Å; V737-V750 HydrophobicContact CG2-CG2 3.51Å; V737-L772 HydrophobicContact CB-CD2 4.23Å; V737-L772 HydrophobicContact CG1-CD2 3.87Å; V737-L772 HydrophobicContact CG2-CD1 4.33Å; V737-L772 HydrophobicContact CG2-CD2 4.15Å; V737-L777 HydrophobicContact CG1-CD1 3.83Å
738	E	97.9	Very high	97.4	Very high	10 Å²	10	26.6 Å²	26.6	5%	0.047	11%	0.114	C	C	.	.	H	α-helix	trans	-61.1	-39.1	178	-172.7	177.7	-130.2	0	0	112	L697 N698 L699 A734 L735 W741 R742	L697-E738 HydrophobicContact CD1-CB 3.97Å; N698-E738 WeakPolarHBondContact CB-OE1 3.35Å; N698-E738 PolarHBondContact N-OE1 3.21Å; L699-E738 HydrophobicContact CD2-CB 4.44Å; A734-E738 VanDerWaalsContact O-CB 3.27Å; A734-E738 WeakPolarHBondContact O-CB 3.34Å; A734-E738 PolarHBondContact O-N 3.26Å; L735-E738 PolarHBondContact O-N 3.16Å; E738-W741 PolarHBondContact O-N 2.7Å; E738-R742 HydrophobicContact CG-CG 4.4Å; E738-R742 WeakPolarHBondContact O-CB 3.46Å; E738-R742 VanDerWaalsContact O-CG 3.3Å; E738-R742 WeakPolarHBondContact O-CG 3.45Å; E738-R742 PolarHBondContact O-N 3.19Å; E738-R742 IonicContact OE1-CZ 3.66Å; E738-R742 IonicContact OE1-NE 3.41Å; E738-R742 IonicContact OE1-NH2 3.66Å; E738-R742 PolarHBondContact OE1-NH2 3.36Å; E738-R742 IonicContact OE2-CZ 3.62Å; E738-R742 IonicContact OE2-NE 2.91Å; E738-R742 IonicContact OE2-NH1 2.64Å; E738-R742 IonicContact OE2-NH2 2.69Å; E738-R742 PolarHBondContact OE2-NH2 3Å
739	M	97.4	Very high	97.5	Very high	46 Å²	46	27.5 Å²	27.5	23%	0.227	12%	0.12	C	C	.	.	H	α-helix	trans	-61.6	-51	177.7	-170.3	-81	-172	0	0	112	L735 A736 V737 W741 R742 R743 F844 I846	L735-M739 WeakPolarHBondContact O-CB 3.38Å; L735-M739 PolarHBondContact O-N 3.24Å; A736-M739 PolarHBondContact O-N 3.24Å; V737-M739 VanDerWaalsContact C-N 3.31Å; V737-M739 PolarHBondContact O-N 2.89Å; M739-W741 VanDerWaalsContact C-N 3.33Å; M739-W741 PolarHBondContact O-N 3.19Å; M739-R742 PolarHBondContact O-N 3.48Å; M739-R743 PolarHBondContact O-N 3.32Å; M739-R743 VanDerWaalsContact O-N 3.07Å; M739-R743 VanDerWaalsContact SD-CD 3.55Å; M739-R743 HydrophobicContact SD-CG 4.31Å; M739-F844 HydrophobicContact CB-CD1 3.95Å; M739-F844 HydrophobicContact CG-CD1 3.95Å; M739-F844 HydrophobicContact SD-CD1 4.39Å; M739-F844 HydrophobicContact SD-CE1 4.49Å; M739-I846 HydrophobicContact CE-CD1 3.57Å; M739-I846 HydrophobicContact CE-CG1 3.69Å; M739-I846 HydrophobicContact SD-CD1 4.1Å
740	F	98.1	Very high	97.6	Very high	0 Å²	0	27.5 Å²	27.5	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-67	-33.3	176.2	-71.1	-71.8	0	0	0	112.4	I711 I713 A736 V737 R743 G744 H745 I748 V811 L835 F844 I846 L862	I711-F740 HydrophobicContact CD1-CD1 4.23Å; I711-F740 HydrophobicContact CD1-CE1 4.24Å; I711-F740 HydrophobicContact CG1-CD1 3.97Å; I711-F740 HydrophobicContact CG1-CE1 4.42Å; I711-F740 HydrophobicContact CG1-CG 4.29Å; I711-F740 HydrophobicContact CG2-CD1 4.14Å; I711-F740 HydrophobicContact CG2-CD2 3.81Å; I711-F740 HydrophobicContact CG2-CE1 4.26Å; I711-F740 HydrophobicContact CG2-CE2 3.96Å; I711-F740 HydrophobicContact CG2-CG 3.93Å; I711-F740 HydrophobicContact CG2-CZ 4.19Å; I713-F740 HydrophobicContact CD1-CD2 4.12Å; I713-F740 HydrophobicContact CD1-CE2 4.47Å; A736-F740 VanDerWaalsContact O-CD2 3.23Å; A736-F740 WeakPolarHBondContact O-CD2 3.46Å; A736-F740 PolarHBondContact O-N 3.3Å; V737-F740 PolarHBondContact O-N 3.01Å; F740-R743 CarbonylContact O-C 3.45Å; F740-R743 PolarHBondContact O-N 2.96Å; F740-G744 PolarHBondContact O-N 3.18Å; F740-H745 HydrophobicContact CB-CB 4.29Å; F740-H745 AromaticContact CD1-CD2 3.94Å; F740-H745 WeakPolarHBondContact O-CB 3.27Å; F740-H745 PolarHBondContact O-CD2 2.89Å; F740-H745 PolarHBondContact O-N 3.43Å; F740-I748 HydrophobicContact CB-CD1 3.87Å; F740-V811 HydrophobicContact CE2-CG1 4.3Å; F740-V811 HydrophobicContact CE2-CG2 3.83Å; F740-V811 HydrophobicContact CZ-CG2 3.74Å; F740-L835 HydrophobicContact CE1-CD2 4.01Å; F740-L835 HydrophobicContact CZ-CD2 3.81Å; F740-F844 AromaticContact CE2-CE1 3.77Å; F740-F844 HydrophobicContact CE2-CE1 3.77Å; F740-F844 HydrophobicContact CE2-CZ 4.12Å; F740-F844 HydrophobicContact CZ-CE1 4.26Å; F740-I846 HydrophobicContact CE1-CD1 4Å; F740-I846 HydrophobicContact CZ-CD1 4.06Å; F740-L862 HydrophobicContact CE1-CD2 4.01Å
741	W	97.3	Very high	97.7	Very high	35 Å²	35	28.7 Å²	28.7	13%	0.133	13%	0.125	C	C	.	.	H	α-helix	trans	-64.5	-42.8	174.8	-167.5	-84.8	0	0	0	112.3	L699 P700 V737 E738 M739 R743 G744 R746 I748 L777	L699-W741 HydrophobicContact CB-CD2 4.18Å; L699-W741 HydrophobicContact CB-CG 4.36Å; L699-W741 HydrophobicContact CB-CZ2 4.3Å; L699-W741 HydrophobicContact CD2-CB 3.52Å; L699-W741 HydrophobicContact CD2-CD2 3.8Å; L699-W741 HydrophobicContact CD2-CE3 4.3Å; L699-W741 HydrophobicContact CD2-CG 3.45Å; L699-W741 VanDerWaalsContact CD2-CG 3.45Å; L699-W741 HydrophobicContact CG-CD2 4.49Å; L699-W741 HydrophobicContact CG-CG 4.48Å; P700-W741 PolarHBondContact O-NE1 3.14Å; V737-W741 VanDerWaalsContact O-CB 3.32Å; V737-W741 WeakPolarHBondContact O-CB 3.42Å; V737-W741 PolarHBondContact O-N 3.24Å; E738-W741 PolarHBondContact O-N 2.7Å; M739-W741 VanDerWaalsContact C-N 3.33Å; M739-W741 PolarHBondContact O-N 3.19Å; W741-R743 VanDerWaalsContact C-N 3.27Å; W741-R743 PolarHBondContact O-N 3.05Å; W741-G744 WeakPolarHBondContact O-CA 3.41Å; W741-G744 PolarHBondContact O-N 2.86Å; W741-R746 VanDerWaalsContact CE2-CZ 3.5Å; W741-R746 PolarHBondContact O-NH1 3.14Å; W741-I748 HydrophobicContact CB-CD1 4.47Å; W741-I748 HydrophobicContact CE3-CD1 4.23Å; W741-L777 HydrophobicContact CE3-CD1 4.31Å; W741-L777 HydrophobicContact CZ3-CD1 4.08Å; W741-L777 HydrophobicContact CZ3-CD2 4.12Å
742	R	96.2	Very high	97.6	Very high	171 Å²	171	28.5 Å²	28.5	65%	0.645	12%	0.124	S	C	*	.	H	α-helix	trans	-66.8	-26.3	173.9	-70.9	174.8	-176	179.6	6.7	112.7	E738 M739 G744	E738-R742 HydrophobicContact CG-CG 4.4Å; E738-R742 WeakPolarHBondContact O-CB 3.46Å; E738-R742 VanDerWaalsContact O-CG 3.3Å; E738-R742 WeakPolarHBondContact O-CG 3.45Å; E738-R742 PolarHBondContact O-N 3.19Å; E738-R742 IonicContact OE1-CZ 3.66Å; E738-R742 IonicContact OE1-NE 3.41Å; E738-R742 IonicContact OE1-NH2 3.66Å; E738-R742 PolarHBondContact OE1-NH2 3.36Å; E738-R742 IonicContact OE2-CZ 3.62Å; E738-R742 IonicContact OE2-NE 2.91Å; E738-R742 IonicContact OE2-NH1 2.64Å; E738-R742 IonicContact OE2-NH2 2.69Å; E738-R742 PolarHBondContact OE2-NH2 3Å; M739-R742 PolarHBondContact O-N 3.48Å; R742-G744 PolarHBondContact O-N 2.89Å
743	R	95.3	Very high	97.5	Very high	87 Å²	87	28.7 Å²	28.7	33%	0.328	13%	0.126	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.8	2.5	168.2	-69.9	-179.6	61.8	82.2	9.1	114	M739 F740 W741 D859	M739-R743 PolarHBondContact O-N 3.32Å; M739-R743 VanDerWaalsContact O-N 3.07Å; M739-R743 VanDerWaalsContact SD-CD 3.55Å; M739-R743 HydrophobicContact SD-CG 4.31Å; F740-R743 CarbonylContact O-C 3.45Å; F740-R743 PolarHBondContact O-N 2.96Å; W741-R743 VanDerWaalsContact C-N 3.27Å; W741-R743 PolarHBondContact O-N 3.05Å; R743-D859 IonicContact CZ-OD1 3.86Å; R743-D859 IonicContact NH1-OD1 3.96Å; R743-D859 IonicContact NH2-OD1 3.72Å; R743-D859 PolarHBondContact NH2-OD1 3.11Å
744	G	96.4	Very high	97.2	Very high	16 Å²	16	33 Å²	33	17%	0.165	15%	0.146	C	C	.	.	T	Hydrogen-bonded Turn	trans	89.2	5.9	174.5	0	0	0	0	0	115.5	G704 N705 F740 W741 R742	G704-G744 CarbonylContact C-O 3.54Å; G704-G744 WeakPolarHBondContact CA-O 3.05Å; N705-G744 PolarHBondContact N-O 2.9Å; F740-G744 PolarHBondContact O-N 3.18Å; W741-G744 WeakPolarHBondContact O-CA 3.41Å; W741-G744 PolarHBondContact O-N 2.86Å; R742-G744 PolarHBondContact O-N 2.89Å
745	H	97.6	Very high	96.7	Very high	3 Å²	3	36.1 Å²	36.1	1%	0.014	16%	0.158	C	C	.	.			trans	-71.2	140.9	172.5	-63.1	-99.7	0	0	0	110.5	R709 I711 F740 I748	R709-H745 PolarHBondContact O-ND1 3.46Å; I711-H745 HydrophobicContact CG1-CB 4.34Å; I711-H745 VanDerWaalsContact CG1-ND1 3.28Å; I711-H745 WeakPolarHBondContact CG1-ND1 3.09Å; F740-H745 HydrophobicContact CB-CB 4.29Å; F740-H745 AromaticContact CD1-CD2 3.94Å; F740-H745 WeakPolarHBondContact O-CB 3.27Å; F740-H745 PolarHBondContact O-CD2 2.89Å; F740-H745 PolarHBondContact O-N 3.43Å; H745-I748 HydrophobicContact CB-CD1 4.01Å; H745-I748 HydrophobicContact CB-CG1 3.91Å
746	R	96	Very high	96.4	Very high	64 Å²	64	36.8 Å²	36.8	24%	0.242	16%	0.159	C	C	.	.			trans	-128.4	-22.9	171.7	-59	-69.1	176.9	-95.2	4.1	112.2	E702 W741 I748	E702-R746 PolarHBondContact O-NE 3.38Å; E702-R746 PolarHBondContact O-NH2 3.04Å; W741-R746 VanDerWaalsContact CE2-CZ 3.5Å; W741-R746 PolarHBondContact O-NH1 3.14Å; R746-I748 VanDerWaalsContact C-N 3.33Å; R746-I748 PolarHBondContact O-N 2.91Å; R746-I748 VanDerWaalsContact O-N 3.13Å
747	E	97.1	Very high	95.9	Very high	95 Å²	95	40.7 Å²	40.7	44%	0.444	18%	0.177	S	C	.	.			trans	-78.7	82.5	164.5	-68.2	173.6	176.3	0	0	108.6	H710 I711 K864	H710-E747 WeakPolarHBondContact CA-O 3.21Å; H710-E747 HydrophobicContact CB-CB 4.19Å; I711-E747 PolarHBondContact N-O 3.49Å; E747-K864 IonicContact OE1-NZ 2.67Å; E747-K864 IonicContact OE2-NZ 3.92Å; E747-K864 PolarHBondContact OE2-NZ 3.41Å
748	I	98.4	Very high	95.1	Very high	5 Å²	5	46.2 Å²	46.2	3%	0.026	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	137.4	177.4	-51.7	176.8	0	0	0	108.5	I711 I713 V737 F740 W741 H745 R746 L777	I711-I748 HydrophobicContact CB-CG1 4.43Å; I711-I748 HydrophobicContact CB-CG2 4.5Å; I711-I748 CarbonylContact O-C 3.55Å; I711-I748 WeakPolarHBondContact O-CA 3.32Å; I713-I748 HydrophobicContact CD1-CG2 4Å; I713-I748 HydrophobicContact CG1-CG2 4.43Å; V737-I748 HydrophobicContact CG2-CG2 4.49Å; F740-I748 HydrophobicContact CB-CD1 3.87Å; W741-I748 HydrophobicContact CB-CD1 4.47Å; W741-I748 HydrophobicContact CE3-CD1 4.23Å; H745-I748 HydrophobicContact CB-CD1 4.01Å; H745-I748 HydrophobicContact CB-CG1 3.91Å; R746-I748 VanDerWaalsContact C-N 3.33Å; R746-I748 PolarHBondContact O-N 2.91Å; R746-I748 VanDerWaalsContact O-N 3.13Å; I748-L777 HydrophobicContact CB-CD2 4.48Å
749	T	98.6	Very high	94	Very high	20 Å²	20	56.9 Å²	56.9	12%	0.123	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	118.1	173.3	-54.6	0	0	0	0	110.6	H710 I711 I712 I713 F751 L777 L802	H710-T749 PolarHBondContact CE1-OG1 3.18Å; H710-T749 PolarHBondContact NE2-OG1 2.66Å; I711-T749 PolarHBondContact O-N 3.41Å; I712-T749 CarbonylContact C-O 3.57Å; I712-T749 WeakPolarHBondContact CA-O 3.32Å; I713-T749 PolarHBondContact N-O 2.97Å; T749-F751 HydrophobicContact CG2-CE2 4.46Å; T749-F751 HydrophobicContact CG2-CZ 4.38Å; T749-L777 CarbonylContact C-O 3.47Å; T749-L777 WeakPolarHBondContact CA-O 3.16Å; T749-L802 HydrophobicContact CG2-CD2 3.91Å
750	V	98.8	Very high	93.2	Very high	0 Å²	0	57.3 Å²	57.3	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	129	169.7	-167	0	0	0	0	109	I713 I733 V737 V752 L777 L778 S779	I713-V750 HydrophobicContact CB-CB 4.39Å; I713-V750 HydrophobicContact CB-CG1 4.24Å; I713-V750 HydrophobicContact CB-CG2 4.14Å; I713-V750 HydrophobicContact CD1-CG2 4.35Å; I713-V750 HydrophobicContact CG2-CG1 4.36Å; I713-V750 WeakPolarHBondContact O-CA 3.35Å; I733-V750 HydrophobicContact CG2-CB 4.31Å; I733-V750 HydrophobicContact CG2-CG1 3.62Å; I733-V750 HydrophobicContact CG2-CG2 3.86Å; V737-V750 HydrophobicContact CG2-CG2 3.51Å; V750-V752 HydrophobicContact CG1-CG2 3.98Å; V750-L777 PolarHBondContact N-O 3.11Å; V750-L778 HydrophobicContact CB-CB 4.22Å; V750-L778 HydrophobicContact CB-CD1 4.41Å; V750-L778 HydrophobicContact CB-CG 4.27Å; V750-L778 HydrophobicContact CG1-CD1 4.39Å; V750-L778 WeakPolarHBondContact O-CA 3.38Å; V750-S779 PolarHBondContact O-N 3.25Å
751	F	98.5	Very high	92.3	Very high	25 Å²	25	69.1 Å²	69.1	11%	0.11	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	135.7	163.9	-76.9	-61.7	0	0	0	110.9	I712 I713 G715 T749 S779 T781 F798 L799 L802	I712-F751 HydrophobicContact CG2-CD2 4.36Å; I713-F751 PolarHBondContact O-N 3Å; G715-F751 WeakPolarHBondContact CA-O 3.42Å; G715-F751 PolarHBondContact N-O 3.44Å; T749-F751 HydrophobicContact CG2-CE2 4.46Å; T749-F751 HydrophobicContact CG2-CZ 4.38Å; F751-S779 WeakPolarHBondContact CD1-O 3.4Å; F751-T781 HydrophobicContact CB-CG2 3.87Å; F751-T781 HydrophobicContact CD1-CG2 3.53Å; F751-T781 HydrophobicContact CE1-CG2 4.36Å; F751-T781 HydrophobicContact CG-CG2 3.94Å; F751-F798 HydrophobicContact CD1-CB 4.32Å; F751-F798 HydrophobicContact CD2-CB 4.03Å; F751-F798 HydrophobicContact CE1-CB 4.17Å; F751-F798 HydrophobicContact CE2-CB 3.84Å; F751-F798 HydrophobicContact CG-CB 4.26Å; F751-F798 HydrophobicContact CZ-CB 3.93Å; F751-L799 HydrophobicContact CB-CD2 4.24Å; F751-L799 HydrophobicContact CD2-CD2 3.97Å; F751-L799 HydrophobicContact CD2-CG 4.49Å; F751-L802 HydrophobicContact CE2-CB 4.01Å; F751-L802 HydrophobicContact CE2-CD2 3.57Å; F751-L802 HydrophobicContact CE2-CG 4.42Å; F751-L802 HydrophobicContact CZ-CD2 3.97Å
752	V	96.9	Very high	91.8	Very high	0 Å²	0	71.7 Å²	71.7	0%	0	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	142.7	175.9	173.2	0	0	0	0	108.1	F728 I733 V750 Q754 R756 L778 S779 F780 T781	F728-V752 HydrophobicContact CZ-CG1 3.88Å; I733-V752 HydrophobicContact CD1-CG2 3.89Å; V750-V752 HydrophobicContact CG1-CG2 3.98Å; V752-Q754 PolarHBondContact O-N 3.35Å; V752-R756 HydrophobicContact CG1-CB 3.65Å; V752-R756 HydrophobicContact CG1-CG 3.94Å; V752-L778 HydrophobicContact CB-CD1 4.27Å; V752-L778 HydrophobicContact CG2-CD1 3.75Å; V752-L778 HydrophobicContact CG2-CG 4.4Å; V752-S779 PolarHBondContact N-O 2.85Å; V752-F780 HydrophobicContact CB-CD1 4.24Å; V752-F780 HydrophobicContact CB-CE1 4.24Å; V752-F780 HydrophobicContact CG1-CD1 4.2Å; V752-F780 HydrophobicContact CG1-CE1 3.91Å; V752-F780 CarbonylContact O-C 3.57Å; V752-F780 VanDerWaalsContact O-CA 3.22Å; V752-F780 WeakPolarHBondContact O-CA 3.48Å; V752-F780 WeakPolarHBondContact O-CD1 3.39Å; V752-T781 PolarHBondContact O-N 2.94Å; V752-T781 PolarHBondContact O-OG1 3.25Å
753	P	94.6	Very high	91.6	Very high	5 Å²	5	64.3 Å²	64.3	3%	0.032	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62	134.7	174.9	-23.2	32.5	0	0	0	113.1	S716 W755 R756 T781 D795	S716-P753 WeakPolarHBondContact OG-CD 3.48Å; P753-W755 HydrophobicContact CB-CD2 4.21Å; P753-W755 HydrophobicContact CB-CG 3.94Å; P753-W755 PolarHBondContact O-N 2.72Å; P753-R756 HydrophobicContact CB-CG 4.38Å; P753-R756 HydrophobicContact CG-CG 4.47Å; P753-R756 WeakPolarHBondContact O-CB 3.49Å; P753-R756 PolarHBondContact O-N 2.95Å; P753-T781 VanDerWaalsContact CA-OG1 3.3Å; P753-T781 WeakPolarHBondContact CA-OG1 3.36Å; P753-D795 WeakPolarHBondContact CD-OD2 3.5Å; P753-D795 WeakPolarHBondContact CG-OD2 3.5Å
754	Q	92	Very high	91.4	Very high	90 Å²	90	61.4 Å²	61.4	42%	0.421	27%	0.272	S	S	.	.	G	3₁₀ helix	trans	-53.2	-31.2	177	-170.5	178	13.2	0	0	112.9	V752 R756 Q757 F780 T781 S783	V752-Q754 PolarHBondContact O-N 3.35Å; Q754-R756 PolarHBondContact O-N 3.16Å; Q754-Q757 WeakPolarHBondContact O-CB 3.4Å; Q754-Q757 PolarHBondContact O-N 3.04Å; Q754-F780 HydrophobicContact CB-CB 3.97Å; Q754-F780 HydrophobicContact CG-CB 4.28Å; Q754-T781 VanDerWaalsContact CB-O 3.31Å; Q754-T781 WeakPolarHBondContact CB-O 3.48Å; Q754-T781 PolarHBondContact N-O 3.24Å; Q754-S783 PolarHBondContact OE1-O 3.14Å
755	W	89	Confident	91.3	Very high	66 Å²	66	62.6 Å²	62.6	25%	0.25	27%	0.273	C	S	.	.	G	3₁₀ helix	trans	-64.4	-19.4	175.9	66.3	-99.5	0	0	0	114.9	P753 Q757 K758 S783 R790	P753-W755 HydrophobicContact CB-CD2 4.21Å; P753-W755 HydrophobicContact CB-CG 3.94Å; P753-W755 PolarHBondContact O-N 2.72Å; W755-Q757 PolarHBondContact O-N 3.34Å; W755-K758 VanDerWaalsContact O-CB 3.32Å; W755-K758 WeakPolarHBondContact O-CB 3.46Å; W755-K758 PolarHBondContact O-N 3.26Å; W755-S783 WeakPolarHBondContact CB-OG 3.47Å; W755-S783 PolarHBondContact N-OG 2.63Å; W755-R790 VanDerWaalsContact CD2-NH1 3.26Å; W755-R790 VanDerWaalsContact CG-CD 3.49Å
756	R	90.7	Very high	91.1	Very high	35 Å²	35	64.2 Å²	64.2	13%	0.132	28%	0.281	C	S	.	.	G	3₁₀ helix	trans	-73.6	-9.6	171.4	-66.8	-70.3	-168.5	-177.1	6.6	113.2	F728 V752 P753 Q754 K758 D760 Q766	F728-R756 HydrophobicContact CD2-CG 4.47Å; F728-R756 VanDerWaalsContact CD2-NE 3.25Å; F728-R756 HydrophobicContact CE1-CB 4.29Å; F728-R756 HydrophobicContact CE1-CG 4.33Å; F728-R756 HydrophobicContact CE2-CG 3.92Å; F728-R756 HydrophobicContact CZ-CB 4.18Å; F728-R756 HydrophobicContact CZ-CG 3.87Å; V752-R756 HydrophobicContact CG1-CB 3.65Å; V752-R756 HydrophobicContact CG1-CG 3.94Å; P753-R756 HydrophobicContact CB-CG 4.38Å; P753-R756 HydrophobicContact CG-CG 4.47Å; P753-R756 WeakPolarHBondContact O-CB 3.49Å; P753-R756 PolarHBondContact O-N 2.95Å; Q754-R756 PolarHBondContact O-N 3.16Å; R756-K758 VanDerWaalsContact C-N 3.32Å; R756-D760 IonicContact NH1-OD2 3.67Å; R756-Q766 PolarHBondContact O-NE2 3.46Å
757	Q	87.6	Confident	91	Very high	81 Å²	81	65.6 Å²	65.6	38%	0.379	29%	0.29	S	S	.	.	G	3₁₀ helix	trans	-75.3	-22.6	170	-157.1	-178.6	42.4	0	0	111.7	Q754 W755 Q766 E773 F780	Q754-Q757 WeakPolarHBondContact O-CB 3.4Å; Q754-Q757 PolarHBondContact O-N 3.04Å; W755-Q757 PolarHBondContact O-N 3.34Å; Q757-Q766 PolarHBondContact O-NE2 3.46Å; Q757-E773 PolarHBondContact NE2-OE2 2.8Å; Q757-E773 VanDerWaalsContact NE2-OE2 3.16Å; Q757-F780 HydrophobicContact CB-CE1 4.08Å; Q757-F780 HydrophobicContact CB-CE2 4.35Å; Q757-F780 HydrophobicContact CB-CZ 3.88Å; Q757-F780 HydrophobicContact CG-CE2 4.02Å; Q757-F780 HydrophobicContact CG-CZ 3.88Å; Q757-F780 VanDerWaalsContact NE2-CE2 3.33Å
758	K	83.6	Confident	90.9	Very high	116 Å²	116	61.2 Å²	61.2	50%	0.504	27%	0.269	S	S	.	.	S	Bend	trans	-70	138.2	172.7	-162.5	169.6	-179.9	176.9	0	109.2	W755 R756 D760 Q766 E785	W755-K758 VanDerWaalsContact O-CB 3.32Å; W755-K758 WeakPolarHBondContact O-CB 3.46Å; W755-K758 PolarHBondContact O-N 3.26Å; R756-K758 VanDerWaalsContact C-N 3.32Å; K758-D760 PolarHBondContact O-N 3.47Å; K758-D760 VanDerWaalsContact O-N 3.1Å; K758-Q766 PolarHBondContact O-NE2 2.91Å; K758-E785 IonicContact NZ-OE1 2.65Å; K758-E785 PolarHBondContact NZ-OE1 3.36Å; K758-E785 IonicContact NZ-OE2 3.91Å; K758-E785 PolarHBondContact NZ-OE2 3.49Å
759	R	74.8	Confident	90.8	Very high	234 Å²	234	61 Å²	61	88%	0.883	27%	0.268	S	S	*	.			trans	-69.9	108.7	-173.6	-169.3	172	-176.8	158	1	111.9
760	D	80.1	Confident	90.6	Very high	56 Å²	56	63.7 Å²	63.7	30%	0.299	28%	0.282	S	S	.	.			trans	-99.8	147.5	178.4	-175.4	-6.1	0	0	0	110.1	R756 K758 L762 A763	R756-D760 IonicContact NH1-OD2 3.67Å; K758-D760 PolarHBondContact O-N 3.47Å; K758-D760 VanDerWaalsContact O-N 3.1Å; D760-L762 VanDerWaalsContact C-N 3.31Å; D760-L762 PolarHBondContact OD1-N 3Å; D760-A763 HydrophobicContact CB-CB 3.91Å
761	R	79.4	Confident	90.5	Very high	247 Å²	247	67.3 Å²	67.3	93%	0.932	30%	0.299	S	S	*	.	S	Bend	trans	-74.6	-22.1	173.3	-68.3	-175.9	179.2	180	1.1	112.5
762	L	87	Confident	90.5	Very high	90 Å²	90	66.1 Å²	66.1	47%	0.471	29%	0.294	S	S	.	.	S	Bend	trans	-94.6	-3.2	177.5	-60.7	179	0	0	0	113.1	F727 F728 D760	F727-L762 CarbonylContact C-O 3.5Å; F727-L762 WeakPolarHBondContact CA-O 3.43Å; F727-L762 WeakPolarHBondContact CB-O 3.41Å; F727-L762 HydrophobicContact CD1-CD2 4.17Å; F727-L762 HydrophobicContact CE1-CD2 4.09Å; F728-L762 PolarHBondContact N-O 2.98Å; D760-L762 VanDerWaalsContact C-N 3.31Å; D760-L762 PolarHBondContact OD1-N 3Å
763	A	91.3	Very high	90.5	Very high	16 Å²	16	68.8 Å²	68.8	13%	0.132	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	127.5	172.3	0	0	0	0	0	111	F728 D760	F728-A763 HydrophobicContact CB-CB 4.46Å; F728-A763 HydrophobicContact CD1-CB 4.44Å; F728-A763 CarbonylContact O-C 3.52Å; F728-A763 VanDerWaalsContact O-CA 3.32Å; F728-A763 WeakPolarHBondContact O-CA 3.5Å; D760-A763 HydrophobicContact CB-CB 3.91Å
764	T	92.2	Very high	90.5	Very high	25 Å²	25	74.7 Å²	74.7	15%	0.153	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	139.7	177.5	55.1	0	0	0	0	110.8	L691 F727 F728 S729 C730 Q766	L691-T764 HydrophobicContact CD1-CG2 3.87Å; F727-T764 HydrophobicContact CD1-CG2 4.48Å; F728-T764 PolarHBondContact O-N 3Å; S729-T764 VanDerWaalsContact CA-OG1 3.31Å; S729-T764 WeakPolarHBondContact CA-OG1 3.43Å; S729-T764 WeakPolarHBondContact CB-OG1 3.47Å; S729-T764 PolarHBondContact OG-OG1 3.21Å; C730-T764 WeakPolarHBondContact CB-O 3.49Å; C730-T764 PolarHBondContact N-O 2.99Å; C730-T764 VanDerWaalsContact N-O 3.1Å; C730-T764 PolarHBondContact SG-O 3.26Å; C730-T764 VanDerWaalsContact SG-O 3.42Å; T764-Q766 VanDerWaalsContact C-N 3.3Å; T764-Q766 PolarHBondContact O-N 2.98Å
765	E	93.3	Very high	90.7	Very high	41 Å²	41	75.1 Å²	75.1	19%	0.192	34%	0.342	C	S	.	.	S	Bend	trans	52.6	40.7	178.6	-65	167.3	111.1	0	0	114.4	L691 C730 R731 H767 F768	L691-E765 WeakPolarHBondContact CD2-OE2 3.29Å; C730-E765 WeakPolarHBondContact CB-O 3.34Å; R731-E765 WeakPolarHBondContact CB-OE2 3.27Å; R731-E765 WeakPolarHBondContact CD-OE2 3.48Å; R731-E765 IonicContact NH1-OE1 3.8Å; R731-E765 PolarHBondContact NH1-OE1 3.18Å; R731-E765 IonicContact NH1-OE2 2.88Å; E765-H767 PolarHBondContact O-N 2.68Å; E765-F768 HydrophobicContact CB-CD2 3.67Å; E765-F768 HydrophobicContact CB-CE2 3.73Å; E765-F768 HydrophobicContact CG-CE2 4.3Å; E765-F768 WeakPolarHBondContact O-CD2 3.4Å; E765-F768 PolarHBondContact O-N 3.14Å
766	Q	92.8	Very high	91.1	Very high	37 Å²	37	81.2 Å²	81.2	17%	0.173	37%	0.365	C	S	.	.	T	Hydrogen-bonded Turn	trans	-52.5	-21.1	-174.6	-163.6	173.2	28	0	0	115.4	R756 Q757 K758 T764 F768 L769	R756-Q766 PolarHBondContact O-NE2 3.46Å; Q757-Q766 PolarHBondContact O-NE2 3.46Å; K758-Q766 PolarHBondContact O-NE2 2.91Å; T764-Q766 VanDerWaalsContact C-N 3.3Å; T764-Q766 PolarHBondContact O-N 2.98Å; Q766-F768 PolarHBondContact O-N 3.43Å; Q766-L769 HydrophobicContact CG-CD1 4.01Å; Q766-L769 WeakPolarHBondContact O-CB 3.48Å; Q766-L769 PolarHBondContact O-N 2.95Å; Q766-L769 VanDerWaalsContact O-N 3.08Å
767	H	93.5	Very high	91.4	Very high	94 Å²	94	80.1 Å²	80.1	44%	0.435	36%	0.362	S	S	.	.	H	α-helix	trans	-59.6	-26	175.7	65.2	-96.8	0	0	0	113.7	E765 L769 N770 Q771	E765-H767 PolarHBondContact O-N 2.68Å; H767-L769 PolarHBondContact O-N 3.12Å; H767-N770 PolarHBondContact O-N 2.98Å; H767-Q771 PolarHBondContact O-N 2.72Å; H767-Q771 VanDerWaalsContact O-N 3.11Å
768	F	96.9	Very high	91.9	Very high	2 Å²	2	76.5 Å²	76.5	1%	0.009	35%	0.345	C	S	.	.	H	α-helix	trans	-64.6	-26.5	174.7	-71.2	-56.3	0	0	0	113.2	F695 L697 C730 R731 A734 E765 Q766 Q771 L772	F695-F768 HydrophobicContact CD1-CE1 4.12Å; F695-F768 AromaticContact CD1-CE2 3.92Å; F695-F768 HydrophobicContact CD1-CE2 3.92Å; F695-F768 AromaticContact CD1-CZ 3.49Å; F695-F768 HydrophobicContact CD1-CZ 3.49Å; F695-F768 VanDerWaalsContact CD1-CZ 3.49Å; F695-F768 HydrophobicContact CE1-CE1 4.24Å; F695-F768 HydrophobicContact CE1-CZ 4.05Å; L697-F768 HydrophobicContact CB-CD1 4.21Å; L697-F768 HydrophobicContact CB-CE1 3.95Å; C730-F768 HydrophobicContact CB-CB 4.13Å; R731-F768 HydrophobicContact CB-CD2 4.24Å; R731-F768 HydrophobicContact CB-CE2 4.15Å; A734-F768 HydrophobicContact CB-CB 4.21Å; A734-F768 HydrophobicContact CB-CD1 3.98Å; A734-F768 HydrophobicContact CB-CD2 4.39Å; A734-F768 HydrophobicContact CB-CG 3.94Å; E765-F768 HydrophobicContact CB-CD2 3.67Å; E765-F768 HydrophobicContact CB-CE2 3.73Å; E765-F768 HydrophobicContact CG-CE2 4.3Å; E765-F768 WeakPolarHBondContact O-CD2 3.4Å; E765-F768 PolarHBondContact O-N 3.14Å; Q766-F768 PolarHBondContact O-N 3.43Å; F768-Q771 VanDerWaalsContact CD1-OE1 3.28Å; F768-L772 WeakPolarHBondContact O-CB 3.24Å; F768-L772 VanDerWaalsContact O-CG 3.26Å; F768-L772 WeakPolarHBondContact O-CG 3.46Å; F768-L772 PolarHBondContact O-N 2.7Å
769	L	96.2	Very high	92.6	Very high	0 Å²	0	73.4 Å²	73.4	0%	0	34%	0.338	C	S	.	.	H	α-helix	trans	-64.6	-46.4	175.6	-57	-177.7	0	0	0	110.7	F728 C730 I733 Q766 H767 L772 E773 L778 F780	F728-L769 HydrophobicContact CE1-CD1 4.24Å; F728-L769 HydrophobicContact CE1-CD2 4.27Å; C730-L769 HydrophobicContact CB-CD2 4.04Å; C730-L769 HydrophobicContact CB-CG 4.16Å; I733-L769 HydrophobicContact CD1-CD2 3.76Å; Q766-L769 HydrophobicContact CG-CD1 4.01Å; Q766-L769 WeakPolarHBondContact O-CB 3.48Å; Q766-L769 PolarHBondContact O-N 2.95Å; Q766-L769 VanDerWaalsContact O-N 3.08Å; H767-L769 PolarHBondContact O-N 3.12Å; L769-L772 PolarHBondContact O-N 3.27Å; L769-E773 WeakPolarHBondContact O-CB 3.26Å; L769-E773 PolarHBondContact O-N 3.38Å; L769-L778 HydrophobicContact CB-CD1 4.44Å; L769-L778 HydrophobicContact CD2-CD1 3.84Å; L769-F780 HydrophobicContact CB-CZ 4.11Å; L769-F780 HydrophobicContact CD1-CZ 4.45Å
770	N	94.4	Very high	93.6	Very high	77 Å²	77	63.9 Å²	63.9	41%	0.412	30%	0.303	S	S	.	.	H	α-helix	trans	-64.9	-45.9	178.6	-59.9	17.8	0	0	0	110.8	H767 L772 E773 D774	H767-N770 PolarHBondContact O-N 2.98Å; N770-L772 VanDerWaalsContact C-N 3.28Å; N770-L772 PolarHBondContact O-N 3.38Å; N770-E773 PolarHBondContact O-N 3.16Å; N770-E773 VanDerWaalsContact O-N 3.11Å; N770-D774 WeakPolarHBondContact O-CB 3.34Å; N770-D774 PolarHBondContact O-N 3.12Å
771	Q	95.9	Very high	94.3	Very high	77 Å²	77	61.2 Å²	61.2	36%	0.36	29%	0.289	S	S	.	.	H	α-helix	trans	-57.7	-40	177	-71.5	178.3	-0.9	0	0	112.4	H767 F768 L775	H767-Q771 PolarHBondContact O-N 2.72Å; H767-Q771 VanDerWaalsContact O-N 3.11Å; F768-Q771 VanDerWaalsContact CD1-OE1 3.28Å; Q771-L775 WeakPolarHBondContact O-CB 3.23Å; Q771-L775 WeakPolarHBondContact O-CD1 3.42Å; Q771-L775 WeakPolarHBondContact O-CG 3.48Å; Q771-L775 PolarHBondContact O-N 2.6Å; Q771-L775 VanDerWaalsContact O-N 3.16Å
772	L	97.7	Very high	95	Very high	0 Å²	0	52.6 Å²	52.6	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-74.8	-31.4	177.1	-67.8	169.8	0	0	0	112.5	L697 I733 V737 F768 L769 N770 R776 L777 L778	L697-L772 HydrophobicContact CD2-CD2 3.7Å; L697-L772 HydrophobicContact CD2-CG 4.17Å; I733-L772 HydrophobicContact CB-CD1 4.48Å; I733-L772 HydrophobicContact CG2-CD1 3.72Å; V737-L772 HydrophobicContact CB-CD2 4.23Å; V737-L772 HydrophobicContact CG1-CD2 3.87Å; V737-L772 HydrophobicContact CG2-CD1 4.33Å; V737-L772 HydrophobicContact CG2-CD2 4.15Å; F768-L772 WeakPolarHBondContact O-CB 3.24Å; F768-L772 VanDerWaalsContact O-CG 3.26Å; F768-L772 WeakPolarHBondContact O-CG 3.46Å; F768-L772 PolarHBondContact O-N 2.7Å; L769-L772 PolarHBondContact O-N 3.27Å; N770-L772 VanDerWaalsContact C-N 3.28Å; N770-L772 PolarHBondContact O-N 3.38Å; L772-R776 PolarHBondContact O-N 3.27Å; L772-L777 HydrophobicContact CD2-CB 4.15Å; L772-L777 HydrophobicContact CD2-CD1 4.21Å; L772-L777 PolarHBondContact O-N 3.01Å; L772-L778 HydrophobicContact CB-CB 3.59Å; L772-L778 HydrophobicContact CB-CD1 4.39Å; L772-L778 PolarHBondContact O-N 3Å
773	E	96.7	Very high	95.1	Very high	56 Å²	56	49.2 Å²	49.2	26%	0.262	25%	0.248	S	C	.	.	H	α-helix	trans	-67.6	-45	172.9	179.2	174.5	-144.1	0	0	111.7	Q757 L769 N770 L775 R776 L778 F780	Q757-E773 PolarHBondContact NE2-OE2 2.8Å; Q757-E773 VanDerWaalsContact NE2-OE2 3.16Å; L769-E773 WeakPolarHBondContact O-CB 3.26Å; L769-E773 PolarHBondContact O-N 3.38Å; N770-E773 PolarHBondContact O-N 3.16Å; N770-E773 VanDerWaalsContact O-N 3.11Å; E773-L775 VanDerWaalsContact C-N 3.32Å; E773-L775 PolarHBondContact O-N 3.02Å; E773-R776 WeakPolarHBondContact O-CA 3.26Å; E773-R776 PolarHBondContact O-N 3.28Å; E773-L778 HydrophobicContact CB-CD2 4.29Å; E773-F780 HydrophobicContact CB-CE2 4.49Å; E773-F780 WeakPolarHBondContact OE1-CD2 3.33Å; E773-F780 WeakPolarHBondContact OE2-CE2 3.42Å
774	D	96.6	Very high	94.8	Very high	128 Å²	128	56.3 Å²	56.3	68%	0.684	27%	0.272	S	S	*	.	H	α-helix	trans	-60.2	-42	176.3	-73.2	-35.7	0	0	0	111.2	N770 R776	N770-D774 WeakPolarHBondContact O-CB 3.34Å; N770-D774 PolarHBondContact O-N 3.12Å; D774-R776 PolarHBondContact O-N 3.13Å
775	L	96.2	Very high	94.3	Very high	99 Å²	99	59.6 Å²	59.6	52%	0.518	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.4	-0.7	174.4	-68.6	172.7	0	0	0	114.1	L699 Q771 E773 L777	L699-L775 HydrophobicContact CD1-CD1 3.74Å; Q771-L775 WeakPolarHBondContact O-CB 3.23Å; Q771-L775 WeakPolarHBondContact O-CD1 3.42Å; Q771-L775 WeakPolarHBondContact O-CG 3.48Å; Q771-L775 PolarHBondContact O-N 2.6Å; Q771-L775 VanDerWaalsContact O-N 3.16Å; E773-L775 VanDerWaalsContact C-N 3.32Å; E773-L775 PolarHBondContact O-N 3.02Å; L775-L777 HydrophobicContact CB-CD1 4.23Å; L775-L777 HydrophobicContact CB-CG 4.07Å; L775-L777 PolarHBondContact O-N 3.13Å
776	R	96.6	Very high	93.2	Very high	194 Å²	194	60.7 Å²	60.7	73%	0.732	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.5	20.1	-175.7	-54.5	-57.4	-172	-168.8	2.2	115.1	L772 E773 D774	L772-R776 PolarHBondContact O-N 3.27Å; E773-R776 WeakPolarHBondContact O-CA 3.26Å; E773-R776 PolarHBondContact O-N 3.28Å; D774-R776 PolarHBondContact O-N 3.13Å
777	L	97.6	Very high	92.1	Very high	13 Å²	13	64.5 Å²	64.5	7%	0.068	32%	0.324	C	S	.	.	S	Bend	trans	-89.7	-21.9	175.7	-58.3	-179	0	0	0	112.4	L699 V737 W741 I748 T749 V750 L772 L775	L699-L777 HydrophobicContact CD1-CD1 3.7Å; V737-L777 HydrophobicContact CG1-CD1 3.83Å; W741-L777 HydrophobicContact CE3-CD1 4.31Å; W741-L777 HydrophobicContact CZ3-CD1 4.08Å; W741-L777 HydrophobicContact CZ3-CD2 4.12Å; I748-L777 HydrophobicContact CB-CD2 4.48Å; T749-L777 CarbonylContact C-O 3.47Å; T749-L777 WeakPolarHBondContact CA-O 3.16Å; V750-L777 PolarHBondContact N-O 3.11Å; L772-L777 HydrophobicContact CD2-CB 4.15Å; L772-L777 HydrophobicContact CD2-CD1 4.21Å; L772-L777 PolarHBondContact O-N 3.01Å; L775-L777 HydrophobicContact CB-CD1 4.23Å; L775-L777 HydrophobicContact CB-CG 4.07Å; L775-L777 PolarHBondContact O-N 3.13Å
778	L	98.1	Very high	90.9	Very high	4 Å²	4	62.7 Å²	62.7	2%	0.021	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	143.6	172	-178.5	150.4	0	0	0	110.8	V750 V752 L769 L772 E773 F780	V750-L778 HydrophobicContact CB-CB 4.22Å; V750-L778 HydrophobicContact CB-CD1 4.41Å; V750-L778 HydrophobicContact CB-CG 4.27Å; V750-L778 HydrophobicContact CG1-CD1 4.39Å; V750-L778 WeakPolarHBondContact O-CA 3.38Å; V752-L778 HydrophobicContact CB-CD1 4.27Å; V752-L778 HydrophobicContact CG2-CD1 3.75Å; V752-L778 HydrophobicContact CG2-CG 4.4Å; L769-L778 HydrophobicContact CB-CD1 4.44Å; L769-L778 HydrophobicContact CD2-CD1 3.84Å; L772-L778 HydrophobicContact CB-CB 3.59Å; L772-L778 HydrophobicContact CB-CD1 4.39Å; L772-L778 PolarHBondContact O-N 3Å; E773-L778 HydrophobicContact CB-CD2 4.29Å; L778-F780 HydrophobicContact CD2-CD1 4.09Å; L778-F780 HydrophobicContact CD2-CD2 3.84Å; L778-F780 HydrophobicContact CD2-CE1 3.95Å; L778-F780 HydrophobicContact CD2-CE2 3.67Å; L778-F780 HydrophobicContact CD2-CG 4.05Å; L778-F780 HydrophobicContact CD2-CZ 3.74Å
779	S	97	Very high	89.5	Confident	51 Å²	51	66.6 Å²	66.6	36%	0.357	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	126.7	172.8	-72.2	0	0	0	0	110	V750 F751 V752	V750-S779 PolarHBondContact O-N 3.25Å; F751-S779 WeakPolarHBondContact CD1-O 3.4Å; V752-S779 PolarHBondContact N-O 2.85Å
780	F	96.6	Very high	88.8	Confident	34 Å²	34	71 Å²	71	15%	0.149	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	125.6	177.1	-75.3	-67	0	0	0	111.6	V752 Q754 Q757 L769 E773 L778	V752-F780 HydrophobicContact CB-CD1 4.24Å; V752-F780 HydrophobicContact CB-CE1 4.24Å; V752-F780 HydrophobicContact CG1-CD1 4.2Å; V752-F780 HydrophobicContact CG1-CE1 3.91Å; V752-F780 CarbonylContact O-C 3.57Å; V752-F780 VanDerWaalsContact O-CA 3.22Å; V752-F780 WeakPolarHBondContact O-CA 3.48Å; V752-F780 WeakPolarHBondContact O-CD1 3.39Å; Q754-F780 HydrophobicContact CB-CB 3.97Å; Q754-F780 HydrophobicContact CG-CB 4.28Å; Q757-F780 HydrophobicContact CB-CE1 4.08Å; Q757-F780 HydrophobicContact CB-CE2 4.35Å; Q757-F780 HydrophobicContact CB-CZ 3.88Å; Q757-F780 HydrophobicContact CG-CE2 4.02Å; Q757-F780 HydrophobicContact CG-CZ 3.88Å; Q757-F780 VanDerWaalsContact NE2-CE2 3.33Å; L769-F780 HydrophobicContact CB-CZ 4.11Å; L769-F780 HydrophobicContact CD1-CZ 4.45Å; E773-F780 HydrophobicContact CB-CE2 4.49Å; E773-F780 WeakPolarHBondContact OE1-CD2 3.33Å; E773-F780 WeakPolarHBondContact OE2-CE2 3.42Å; L778-F780 HydrophobicContact CD2-CD1 4.09Å; L778-F780 HydrophobicContact CD2-CD2 3.84Å; L778-F780 HydrophobicContact CD2-CE1 3.95Å; L778-F780 HydrophobicContact CD2-CE2 3.67Å; L778-F780 HydrophobicContact CD2-CG 4.05Å; L778-F780 HydrophobicContact CD2-CZ 3.74Å
781	T	95.5	Very high	88.3	Confident	1 Å²	1	70.9 Å²	70.9	1%	0.006	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76	144.7	175	61.9	0	0	0	0	110.3	F751 V752 P753 Q754 S783 D795 F798	F751-T781 HydrophobicContact CB-CG2 3.87Å; F751-T781 HydrophobicContact CD1-CG2 3.53Å; F751-T781 HydrophobicContact CE1-CG2 4.36Å; F751-T781 HydrophobicContact CG-CG2 3.94Å; V752-T781 PolarHBondContact O-N 2.94Å; V752-T781 PolarHBondContact O-OG1 3.25Å; P753-T781 VanDerWaalsContact CA-OG1 3.3Å; P753-T781 WeakPolarHBondContact CA-OG1 3.36Å; Q754-T781 VanDerWaalsContact CB-O 3.31Å; Q754-T781 WeakPolarHBondContact CB-O 3.48Å; Q754-T781 PolarHBondContact N-O 3.24Å; T781-S783 PolarHBondContact O-N 3.44Å; T781-D795 WeakPolarHBondContact CB-OD1 3.38Å; T781-D795 WeakPolarHBondContact CG2-OD1 3.33Å; T781-D795 PolarHBondContact OG1-OD1 3.25Å; T781-F798 HydrophobicContact CG2-CB 4.27Å; T781-F798 HydrophobicContact CG2-CD2 3.86Å; T781-F798 HydrophobicContact CG2-CE2 4.45Å; T781-F798 HydrophobicContact CG2-CG 4.08Å
782	P	93.8	Very high	87.8	Confident	66 Å²	66	69.3 Å²	69.3	43%	0.429	36%	0.362	S	S	.	.	P	Polyproline II helix	trans	-64.2	121.6	-171.1	-24	34.9	0	0	0	113.3	S793 F798	P782-S793 WeakPolarHBondContact O-CB 3.46Å; P782-S793 PolarHBondContact O-N 3.07Å; P782-S793 PolarHBondContact O-OG 3.37Å; P782-F798 VanDerWaalsContact CD-CZ 3.47Å; P782-F798 HydrophobicContact CG-CZ 4.1Å
783	S	89.2	Confident	87.3	Confident	18 Å²	18	71.8 Å²	71.8	13%	0.126	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	139.1	169.4	77.7	0	0	0	0	111.3	Q754 W755 T781 I791	Q754-S783 PolarHBondContact OE1-O 3.14Å; W755-S783 WeakPolarHBondContact CB-OG 3.47Å; W755-S783 PolarHBondContact N-OG 2.63Å; T781-S783 PolarHBondContact O-N 3.44Å; S783-I791 CarbonylContact C-O 3.44Å; S783-I791 WeakPolarHBondContact CA-O 3.37Å
784	R	84.5	Confident	86.8	Confident	165 Å²	165	74.1 Å²	74.1	62%	0.623	39%	0.39	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-130	154.1	-179.1	58.5	178.9	-179.8	-114.7	1.5	111.2	V786 I791	R784-V786 HydrophobicContact CG-CG2 4.04Å; R784-I791 HydrophobicContact CG-CB 4.1Å; R784-I791 PolarHBondContact N-O 3.04Å; R784-I791 PolarHBondContact O-N 3.31Å
785	E	81.1	Confident	86.5	Confident	94 Å²	94	68.9 Å²	68.9	44%	0.439	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	120.2	170.8	-67.4	177.2	168.3	0	0	108.2	K758 Q789 R790	K758-E785 IonicContact NZ-OE1 2.65Å; K758-E785 PolarHBondContact NZ-OE1 3.36Å; K758-E785 IonicContact NZ-OE2 3.91Å; K758-E785 PolarHBondContact NZ-OE2 3.49Å; E785-Q789 CarbonylContact C-O 3.52Å; E785-Q789 WeakPolarHBondContact CA-O 3.14Å; E785-R790 HydrophobicContact CG-CB 4.38Å; E785-R790 IonicContact OE1-CZ 3.87Å; E785-R790 IonicContact OE1-NE 3.72Å; E785-R790 IonicContact OE1-NH2 3.42Å; E785-R790 PolarHBondContact OE1-NH2 3.3Å
786	V	71	Confident	86.4	Confident	65 Å²	65	66 Å²	66	39%	0.394	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	123.4	-177.7	179.7	0	0	0	0	107.9	R784 G788 Q789 I791	R784-V786 HydrophobicContact CG-CG2 4.04Å; V786-G788 PolarHBondContact O-N 2.91Å; V786-Q789 PolarHBondContact N-O 3.27Å; V786-Q789 PolarHBondContact O-N 2.94Å; V786-I791 HydrophobicContact CB-CD1 4.12Å; V786-I791 HydrophobicContact CG2-CD1 3.96Å
787	C	68.2	Low	86.3	Confident	117 Å²	117	62 Å²	62	79%	0.791	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.1	23	-170.3	-58.7	0	0	0	0	113.9	K182 Q789	K182-C787 PolarHBondContact NZ-O 3.45Å; C787-Q789 VanDerWaalsContact C-N 3.27Å; C787-Q789 PolarHBondContact O-N 3.49Å
788	G	70.2	Confident	86.3	Confident	56 Å²	56	64.6 Å²	64.6	58%	0.577	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.2	-4.5	-172.3	0	0	0	0	0	115.2	V786	V786-G788 PolarHBondContact O-N 2.91Å
789	Q	67.1	Low	86.3	Confident	84 Å²	84	64.4 Å²	64.4	39%	0.393	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	133.5	169.5	-177.1	63.2	1.8	0	0	109.6	E785 V786 C787	E785-Q789 CarbonylContact C-O 3.52Å; E785-Q789 WeakPolarHBondContact CA-O 3.14Å; V786-Q789 PolarHBondContact N-O 3.27Å; V786-Q789 PolarHBondContact O-N 2.94Å; C787-Q789 VanDerWaalsContact C-N 3.27Å; C787-Q789 PolarHBondContact O-N 3.49Å
790	R	81.1	Confident	86.3	Confident	92 Å²	92	62 Å²	62	35%	0.347	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	126.4	176.2	-175.1	174.3	-65.3	152	5.8	110.7	W755 E785	W755-R790 VanDerWaalsContact CD2-NH1 3.26Å; W755-R790 VanDerWaalsContact CG-CD 3.49Å; E785-R790 HydrophobicContact CG-CB 4.38Å; E785-R790 IonicContact OE1-CZ 3.87Å; E785-R790 IonicContact OE1-NE 3.72Å; E785-R790 IonicContact OE1-NH2 3.42Å; E785-R790 PolarHBondContact OE1-NH2 3.3Å
791	I	84.1	Confident	86.4	Confident	75 Å²	75	65.3 Å²	65.3	39%	0.385	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	101.6	169.1	-53.7	177.1	0	0	0	106.6	S783 R784 V786	S783-I791 CarbonylContact C-O 3.44Å; S783-I791 WeakPolarHBondContact CA-O 3.37Å; R784-I791 HydrophobicContact CG-CB 4.1Å; R784-I791 PolarHBondContact N-O 3.04Å; R784-I791 PolarHBondContact O-N 3.31Å; V786-I791 HydrophobicContact CB-CD1 4.12Å; V786-I791 HydrophobicContact CG2-CD1 3.96Å
792	S	86.1	Confident	86.5	Confident	44 Å²	44	66.8 Å²	66.8	31%	0.308	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	145	169.6	-158.6	0	0	0	0	109.7
793	S	86.1	Confident	86.7	Confident	51 Å²	51	63.7 Å²	63.7	36%	0.357	33%	0.328	S	S	.	.	P	Polyproline II helix	trans	-72.4	160.5	157.6	-46.7	0	0	0	0	109.2	P782	P782-S793 WeakPolarHBondContact O-CB 3.46Å; P782-S793 PolarHBondContact O-N 3.07Å; P782-S793 PolarHBondContact O-OG 3.37Å
794	H	85.8	Confident	87	Confident	105 Å²	105	66.2 Å²	66.2	49%	0.486	34%	0.338	S	S	.	.	P	Polyproline II helix	trans	-80.4	123.6	174.4	-68	-115.8	0	0	0	110.7	D796 R797 F798	H794-D796 VanDerWaalsContact C-N 3.29Å; H794-D796 IonicContact ND1-OD2 3.17Å; H794-D796 PolarHBondContact O-N 2.65Å; H794-R797 PolarHBondContact CD2-NH1 3.5Å; H794-R797 PolarHBondContact NE2-NH1 2.99Å; H794-R797 PolarHBondContact O-N 3.36Å; H794-F798 WeakPolarHBondContact O-CD2 3.24Å
795	D	90.6	Very high	87.6	Confident	19 Å²	19	66.9 Å²	66.9	10%	0.102	35%	0.346	C	S	.	.	H	α-helix	trans	-60.1	-40	178.8	-62.4	-18.1	0	0	0	111.7	S716 P753 T781 R797 F798 L799	S716-D795 PolarHBondContact OG-OD2 2.92Å; P753-D795 WeakPolarHBondContact CD-OD2 3.5Å; P753-D795 WeakPolarHBondContact CG-OD2 3.5Å; T781-D795 WeakPolarHBondContact CB-OD1 3.38Å; T781-D795 WeakPolarHBondContact CG2-OD1 3.33Å; T781-D795 PolarHBondContact OG1-OD1 3.25Å; D795-R797 PolarHBondContact O-N 2.85Å; D795-R797 VanDerWaalsContact O-N 3.1Å; D795-F798 CarbonylContact O-C 3.55Å; D795-F798 WeakPolarHBondContact O-CA 3.18Å; D795-F798 WeakPolarHBondContact O-CB 3.31Å; D795-F798 PolarHBondContact O-N 3.49Å; D795-L799 PolarHBondContact O-N 3.38Å
796	D	94.6	Very high	88.4	Confident	39 Å²	39	64.4 Å²	64.4	21%	0.209	34%	0.337	C	S	.	.	H	α-helix	trans	-45.3	-42.3	177.7	-32.4	-48.8	0	0	0	113.4	H794 L799 L800 L816 F819	H794-D796 VanDerWaalsContact C-N 3.29Å; H794-D796 IonicContact ND1-OD2 3.17Å; H794-D796 PolarHBondContact O-N 2.65Å; D796-L799 PolarHBondContact O-N 3.22Å; D796-L800 WeakPolarHBondContact O-CB 3.5Å; D796-L800 VanDerWaalsContact O-CG 3.3Å; D796-L800 WeakPolarHBondContact O-CG 3.43Å; D796-L800 PolarHBondContact O-N 2.89Å; D796-L816 HydrophobicContact CB-CD2 4.19Å; D796-F819 HydrophobicContact CB-CD2 4.01Å; D796-F819 HydrophobicContact CB-CE2 3.26Å; D796-F819 HydrophobicContact CB-CZ 3.72Å
797	R	94.9	Very high	89.5	Confident	108 Å²	108	65 Å²	65	41%	0.408	34%	0.338	S	S	.	.	H	α-helix	trans	-71.9	-30.2	179.6	-67.9	-174.2	176.6	88.7	-4.3	112	H794 D795 H801 F819 W826	H794-R797 PolarHBondContact CD2-NH1 3.5Å; H794-R797 PolarHBondContact NE2-NH1 2.99Å; H794-R797 PolarHBondContact O-N 3.36Å; D795-R797 PolarHBondContact O-N 2.85Å; D795-R797 VanDerWaalsContact O-N 3.1Å; R797-H801 VanDerWaalsContact O-CB 3.24Å; R797-H801 WeakPolarHBondContact O-CB 3.37Å; R797-H801 PolarHBondContact O-CD2 3.34Å; R797-H801 PolarHBondContact O-N 3.39Å; R797-F819 HydrophobicContact CG-CD1 4.48Å; R797-F819 HydrophobicContact CG-CE1 3.75Å; R797-F819 HydrophobicContact CG-CZ 4.15Å; R797-W826 HydrophobicContact CG-CH2 4.32Å
798	F	97.4	Very high	90.9	Very high	69 Å²	69	59.4 Å²	59.4	30%	0.303	30%	0.3	S	S	.	.	H	α-helix	trans	-75.2	-40	172.1	-65.4	-86.3	0	0	0	111.6	F751 T781 P782 H794 D795 L802	F751-F798 HydrophobicContact CD1-CB 4.32Å; F751-F798 HydrophobicContact CD2-CB 4.03Å; F751-F798 HydrophobicContact CE1-CB 4.17Å; F751-F798 HydrophobicContact CE2-CB 3.84Å; F751-F798 HydrophobicContact CG-CB 4.26Å; F751-F798 HydrophobicContact CZ-CB 3.93Å; T781-F798 HydrophobicContact CG2-CB 4.27Å; T781-F798 HydrophobicContact CG2-CD2 3.86Å; T781-F798 HydrophobicContact CG2-CE2 4.45Å; T781-F798 HydrophobicContact CG2-CG 4.08Å; P782-F798 VanDerWaalsContact CD-CZ 3.47Å; P782-F798 HydrophobicContact CG-CZ 4.1Å; H794-F798 WeakPolarHBondContact O-CD2 3.24Å; D795-F798 CarbonylContact O-C 3.55Å; D795-F798 WeakPolarHBondContact O-CA 3.18Å; D795-F798 WeakPolarHBondContact O-CB 3.31Å; D795-F798 PolarHBondContact O-N 3.49Å; F798-L802 VanDerWaalsContact O-CB 3.23Å; F798-L802 WeakPolarHBondContact O-CB 3.3Å; F798-L802 PolarHBondContact O-N 3.16Å
799	L	97.8	Very high	92.2	Very high	0 Å²	0	56.7 Å²	56.7	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-56.9	-53.7	172.7	-63.6	169.9	0	0	0	110.4	I712 D714 F751 D795 D796 L802 A803 I810	I712-L799 HydrophobicContact CG2-CB 4.48Å; I712-L799 HydrophobicContact CG2-CD2 3.67Å; D714-L799 HydrophobicContact CB-CD1 3.82Å; D714-L799 HydrophobicContact CB-CD2 4.25Å; F751-L799 HydrophobicContact CB-CD2 4.24Å; F751-L799 HydrophobicContact CD2-CD2 3.97Å; F751-L799 HydrophobicContact CD2-CG 4.49Å; D795-L799 PolarHBondContact O-N 3.38Å; D796-L799 PolarHBondContact O-N 3.22Å; L799-L802 PolarHBondContact O-N 3.26Å; L799-A803 WeakPolarHBondContact O-CB 3.3Å; L799-A803 PolarHBondContact O-N 2.98Å; L799-I810 HydrophobicContact CB-CD1 4.14Å; L799-I810 HydrophobicContact CB-CG2 4.14Å; L799-I810 HydrophobicContact CD1-CG2 4.33Å; L799-I810 HydrophobicContact CD2-CG2 4.28Å; L799-I810 HydrophobicContact CG-CG2 4.49Å
800	L	97.4	Very high	93.7	Very high	0 Å²	0	52.7 Å²	52.7	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-64.8	-47.8	-179.3	-71.5	167.9	0	0	0	113	D796 L802 A803 E804 I810 L816 F819 W826 I829 I830	D796-L800 WeakPolarHBondContact O-CB 3.5Å; D796-L800 VanDerWaalsContact O-CG 3.3Å; D796-L800 WeakPolarHBondContact O-CG 3.43Å; D796-L800 PolarHBondContact O-N 2.89Å; L800-L802 VanDerWaalsContact C-N 3.34Å; L800-L802 PolarHBondContact O-N 3.18Å; L800-A803 PolarHBondContact O-N 2.9Å; L800-E804 VanDerWaalsContact O-CB 3.28Å; L800-E804 WeakPolarHBondContact O-CB 3.15Å; L800-E804 PolarHBondContact O-N 3.09Å; L800-I810 HydrophobicContact CD2-CD1 3.88Å; L800-I810 HydrophobicContact CG-CD1 4.34Å; L800-L816 HydrophobicContact CD1-CD1 4.46Å; L800-L816 HydrophobicContact CD2-CD1 4.07Å; L800-L816 HydrophobicContact CG-CD1 4.19Å; L800-F819 HydrophobicContact CD1-CB 3.52Å; L800-F819 HydrophobicContact CD1-CD1 4.29Å; L800-F819 HydrophobicContact CD1-CD2 3.9Å; L800-F819 HydrophobicContact CD1-CG 3.61Å; L800-W826 HydrophobicContact CB-CD2 4.2Å; L800-W826 HydrophobicContact CB-CG 4.34Å; L800-W826 HydrophobicContact CB-CZ2 4.35Å; L800-W826 HydrophobicContact CD1-CD2 4.08Å; L800-W826 HydrophobicContact CD1-CE3 4.01Å; L800-W826 HydrophobicContact CD1-CG 4.4Å; L800-W826 HydrophobicContact CD1-CZ3 4.43Å; L800-W826 HydrophobicContact CD2-CB 4.37Å; L800-W826 HydrophobicContact CD2-CG 4.46Å; L800-I829 HydrophobicContact CD2-CB 4.35Å; L800-I829 HydrophobicContact CD2-CG2 3.91Å; L800-I830 HydrophobicContact CD2-CD1 4.18Å; L800-I830 HydrophobicContact CD2-CG1 3.91Å
801	H	97.3	Very high	94.6	Very high	103 Å²	103	48.3 Å²	48.3	48%	0.477	24%	0.237	S	C	.	.	H	α-helix	trans	-65.8	-33.3	177.8	-81.1	-50.3	0	0	0	113.2	R797 E804 K805 W826	R797-H801 VanDerWaalsContact O-CB 3.24Å; R797-H801 WeakPolarHBondContact O-CB 3.37Å; R797-H801 PolarHBondContact O-CD2 3.34Å; R797-H801 PolarHBondContact O-N 3.39Å; H801-E804 IonicContact CE1-OE2 2.65Å; H801-E804 IonicContact ND1-OE2 2.71Å; H801-E804 PolarHBondContact ND1-OE2 2.88Å; H801-K805 VanDerWaalsContact O-CB 3.26Å; H801-K805 WeakPolarHBondContact O-CB 3.44Å; H801-K805 PolarHBondContact O-N 2.65Å; H801-W826 AromaticContact CE1-CZ2 3.48Å; H801-W826 VanDerWaalsContact CE1-CZ2 3.48Å; H801-W826 WeakPolarHBondContact CE1-CZ2 3.44Å; H801-W826 AromaticContact ND1-CZ2 3.67Å; H801-W826 AromaticContact NE2-CZ2 3.74Å
802	L	97.9	Very high	95.3	Very high	33 Å²	33	44.8 Å²	44.8	17%	0.173	22%	0.219	C	C	.	.	H	α-helix	trans	-70.8	-39.8	175.5	-173.5	62.5	0	0	0	110.7	I712 T749 F751 F798 L799 L800 K805 T806	I712-L802 HydrophobicContact CD1-CB 3.95Å; I712-L802 HydrophobicContact CD1-CD2 4.12Å; I712-L802 HydrophobicContact CD1-CG 3.74Å; I712-L802 HydrophobicContact CG1-CD2 3.92Å; I712-L802 HydrophobicContact CG1-CG 4.11Å; I712-L802 HydrophobicContact CG2-CD2 4.17Å; T749-L802 HydrophobicContact CG2-CD2 3.91Å; F751-L802 HydrophobicContact CE2-CB 4.01Å; F751-L802 HydrophobicContact CE2-CD2 3.57Å; F751-L802 HydrophobicContact CE2-CG 4.42Å; F751-L802 HydrophobicContact CZ-CD2 3.97Å; F798-L802 VanDerWaalsContact O-CB 3.23Å; F798-L802 WeakPolarHBondContact O-CB 3.3Å; F798-L802 PolarHBondContact O-N 3.16Å; L799-L802 PolarHBondContact O-N 3.26Å; L800-L802 VanDerWaalsContact C-N 3.34Å; L800-L802 PolarHBondContact O-N 3.18Å; L802-K805 PolarHBondContact O-N 3.33Å; L802-T806 HydrophobicContact CD1-CG2 3.71Å; L802-T806 HydrophobicContact CG-CG2 4.22Å; L802-T806 WeakPolarHBondContact O-CB 3.09Å; L802-T806 WeakPolarHBondContact O-CG2 2.94Å; L802-T806 PolarHBondContact O-N 2.9Å; L802-T806 PolarHBondContact O-OG1 3.02Å
803	A	97.6	Very high	95.8	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-64	-44.7	176	0	0	0	0	0	111.6	I712 L799 L800 K805 T806 D807 G808 I810 I829	I712-A803 HydrophobicContact CD1-CB 3.73Å; L799-A803 WeakPolarHBondContact O-CB 3.3Å; L799-A803 PolarHBondContact O-N 2.98Å; L800-A803 PolarHBondContact O-N 2.9Å; A803-K805 VanDerWaalsContact C-N 3.3Å; A803-K805 PolarHBondContact O-N 3.02Å; A803-T806 PolarHBondContact O-N 3.18Å; A803-D807 VanDerWaalsContact O-CA 3.29Å; A803-D807 WeakPolarHBondContact O-CA 3.45Å; A803-D807 PolarHBondContact O-N 3.27Å; A803-G808 PolarHBondContact O-N 3.39Å; A803-I810 HydrophobicContact CB-CD1 3.88Å; A803-I810 HydrophobicContact CB-CG1 3.77Å; A803-I829 HydrophobicContact CB-CD1 4.27Å; A803-I829 HydrophobicContact CB-CG2 3.88Å
804	E	96.9	Very high	96.3	Very high	71 Å²	71	46.3 Å²	46.3	33%	0.332	22%	0.22	S	C	.	.	H	α-helix	trans	-57	-39.7	173.2	178.2	167.6	-134.5	0	0	112.6	L800 H801 T825 W826 I829	L800-E804 VanDerWaalsContact O-CB 3.28Å; L800-E804 WeakPolarHBondContact O-CB 3.15Å; L800-E804 PolarHBondContact O-N 3.09Å; H801-E804 IonicContact CE1-OE2 2.65Å; H801-E804 IonicContact ND1-OE2 2.71Å; H801-E804 PolarHBondContact ND1-OE2 2.88Å; E804-T825 HydrophobicContact CG-CG2 3.95Å; E804-T825 WeakPolarHBondContact OE1-CB 3.38Å; E804-T825 WeakPolarHBondContact OE1-CG2 3.35Å; E804-W826 PolarHBondContact OE2-NE1 3.3Å; E804-I829 HydrophobicContact CB-CD1 3.77Å
805	K	97.3	Very high	96.6	Very high	180 Å²	180	44.8 Å²	44.8	78%	0.783	22%	0.215	S	C	*	.	H	α-helix	trans	-80.5	-30.7	-178.7	-175.6	179.1	176.3	-173.7	0	114.4	H801 L802 A803	H801-K805 VanDerWaalsContact O-CB 3.26Å; H801-K805 WeakPolarHBondContact O-CB 3.44Å; H801-K805 PolarHBondContact O-N 2.65Å; L802-K805 PolarHBondContact O-N 3.33Å; A803-K805 VanDerWaalsContact C-N 3.3Å; A803-K805 PolarHBondContact O-N 3.02Å
806	T	96.2	Very high	96.8	Very high	42 Å²	42	44 Å²	44	26%	0.258	21%	0.211	S	C	.	.	H	α-helix	trans	-105.4	-7.9	-172.6	57.9	0	0	0	0	114	H710 L802 A803 G808	H710-T806 HydrophobicContact CB-CG2 4.44Å; L802-T806 HydrophobicContact CD1-CG2 3.71Å; L802-T806 HydrophobicContact CG-CG2 4.22Å; L802-T806 WeakPolarHBondContact O-CB 3.09Å; L802-T806 WeakPolarHBondContact O-CG2 2.94Å; L802-T806 PolarHBondContact O-N 2.9Å; L802-T806 PolarHBondContact O-OG1 3.02Å; A803-T806 PolarHBondContact O-N 3.18Å; T806-G808 PolarHBondContact O-N 3.4Å; T806-G808 PolarHBondContact OG1-N 3.16Å
807	D	95.8	Very high	96.6	Very high	76 Å²	76	50.7 Å²	50.7	41%	0.406	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	55.9	28	-163.5	-150.5	43.1	0	0	0	113.2	R709 A803 R833	R709-D807 IonicContact CZ-OD2 3.78Å; R709-D807 VanDerWaalsContact NH1-CG 3.27Å; R709-D807 PolarHBondContact NH1-O 3.4Å; R709-D807 IonicContact NH1-OD1 2.75Å; R709-D807 IonicContact NH1-OD2 3.27Å; R709-D807 PolarHBondContact NH1-OD2 3.29Å; R709-D807 IonicContact NH2-OD2 2.95Å; A803-D807 VanDerWaalsContact O-CA 3.29Å; A803-D807 WeakPolarHBondContact O-CA 3.45Å; A803-D807 PolarHBondContact O-N 3.27Å; D807-R833 IonicContact OD1-CZ 3.74Å; D807-R833 IonicContact OD1-NH1 2.63Å; D807-R833 PolarHBondContact OD1-NH1 3.08Å; D807-R833 IonicContact OD1-NH2 2.72Å
808	G	96.9	Very high	96.4	Very high	0 Å²	0	52 Å²	52	0%	0	25%	0.249	C	C	.	.			trans	-78.5	175.9	-175.7	0	0	0	0	0	115.3	H710 A803 T806	H710-G808 CarbonylContact O-C 3.57Å; H710-G808 WeakPolarHBondContact O-CA 3.4Å; A803-G808 PolarHBondContact O-N 3.39Å; T806-G808 PolarHBondContact O-N 3.4Å; T806-G808 PolarHBondContact OG1-N 3.16Å
809	I	98.3	Very high	96.2	Very high	0 Å²	0	49.1 Å²	49.1	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	137	178.6	-70.5	161.9	0	0	0	109.2	R709 H710 I711 I712 L835 F861 L862	R709-I809 HydrophobicContact CB-CD1 4.07Å; R709-I809 HydrophobicContact CB-CG1 4.4Å; H710-I809 PolarHBondContact O-N 3.18Å; I711-I809 HydrophobicContact CD1-CB 4.23Å; I711-I809 HydrophobicContact CD1-CD1 4.3Å; I712-I809 WeakPolarHBondContact CB-O 3.4Å; I712-I809 PolarHBondContact N-O 2.88Å; I809-L835 HydrophobicContact CG2-CB 3.64Å; I809-L835 HydrophobicContact CG2-CD2 4.15Å; I809-F861 HydrophobicContact CD1-CD1 3.73Å; I809-F861 HydrophobicContact CD1-CE1 3.66Å; I809-F861 WeakPolarHBondContact CD1-O 3.42Å; I809-F861 HydrophobicContact CG1-CD1 4.48Å; I809-F861 HydrophobicContact CG1-CE1 3.97Å; I809-F861 HydrophobicContact CG1-CZ 4.44Å; I809-F861 HydrophobicContact CG2-CE1 3.8Å; I809-F861 HydrophobicContact CG2-CZ 4.35Å; I809-L862 HydrophobicContact CD1-CD2 3.82Å; I809-L862 HydrophobicContact CD1-CG 4.5Å
810	I	98.6	Very high	95.9	Very high	0 Å²	0	50.8 Å²	50.8	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	121.2	175	-53.9	172.6	0	0	0	109.4	I712 L799 L800 A803 T812 L816 I829 R833 L834 L835	I712-I810 CarbonylContact O-C 3.57Å; I712-I810 VanDerWaalsContact O-CA 3.31Å; I712-I810 WeakPolarHBondContact O-CA 3.41Å; L799-I810 HydrophobicContact CB-CD1 4.14Å; L799-I810 HydrophobicContact CB-CG2 4.14Å; L799-I810 HydrophobicContact CD1-CG2 4.33Å; L799-I810 HydrophobicContact CD2-CG2 4.28Å; L799-I810 HydrophobicContact CG-CG2 4.49Å; L800-I810 HydrophobicContact CD2-CD1 3.88Å; L800-I810 HydrophobicContact CG-CD1 4.34Å; A803-I810 HydrophobicContact CB-CD1 3.88Å; A803-I810 HydrophobicContact CB-CG1 3.77Å; I810-T812 HydrophobicContact CG2-CG2 3.89Å; I810-L816 HydrophobicContact CD1-CD1 4.4Å; I810-I829 HydrophobicContact CD1-CG2 3.69Å; I810-I829 HydrophobicContact CG1-CG2 4.39Å; I810-R833 PolarHBondContact N-O 2.84Å; I810-L834 HydrophobicContact CB-CD2 3.79Å; I810-L834 HydrophobicContact CD1-CD2 4.18Å; I810-L834 HydrophobicContact CG1-CD2 4.46Å; I810-L834 HydrophobicContact CG2-CD2 4.26Å; I810-L834 CarbonylContact O-C 3.58Å; I810-L834 WeakPolarHBondContact O-CA 3.37Å; I810-L835 PolarHBondContact O-N 3.01Å
811	V	98.7	Very high	95.5	Very high	0 Å²	0	56.9 Å²	56.9	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	100.1	175.3	-176.9	0	0	0	0	108.4	I711 I712 I713 D714 F740 L835 F837 F844	I711-V811 HydrophobicContact CG2-CG2 3.69Å; I712-V811 PolarHBondContact O-N 2.67Å; I713-V811 HydrophobicContact CG1-CB 4.3Å; I713-V811 HydrophobicContact CG1-CG2 4.38Å; D714-V811 WeakPolarHBondContact CB-O 3.18Å; D714-V811 PolarHBondContact N-O 2.87Å; F740-V811 HydrophobicContact CE2-CG1 4.3Å; F740-V811 HydrophobicContact CE2-CG2 3.83Å; F740-V811 HydrophobicContact CZ-CG2 3.74Å; V811-L835 WeakPolarHBondContact CA-O 3.3Å; V811-L835 HydrophobicContact CG2-CB 4.32Å; V811-L835 HydrophobicContact CG2-CD2 4.24Å; V811-F837 HydrophobicContact CG1-CD1 3.98Å; V811-F844 HydrophobicContact CG1-CZ 3.93Å
812	T	98.3	Very high	95.2	Very high	0 Å²	0	56.2 Å²	56.2	0%	0	28%	0.282	C	S	.	.			trans	-156.5	152.6	177.9	-170.2	0	0	0	0	110.2	D714 N717 I810 D814 L834 L835	D714-T812 WeakPolarHBondContact OD2-CB 3.23Å; D714-T812 PolarHBondContact OD2-OG1 3.33Å; N717-T812 VanDerWaalsContact CG-OG1 3.31Å; N717-T812 PolarHBondContact ND2-OG1 3.39Å; I810-T812 HydrophobicContact CG2-CG2 3.89Å; T812-D814 HydrophobicContact CG2-CB 4.4Å; T812-D814 PolarHBondContact OG1-N 3.3Å; T812-D814 VanDerWaalsContact OG1-N 3.16Å; T812-L834 HydrophobicContact CG2-CD2 4.35Å; T812-L835 PolarHBondContact N-O 3.49Å
813	N	97.8	Very high	95	Very high	53 Å²	53	56.3 Å²	56.3	28%	0.283	29%	0.285	S	S	.	.	S	Bend	trans	-94.5	1.9	167.4	-70.5	-22.2	0	0	0	112.9	N717 Q836 F837	N717-N813 WeakPolarHBondContact OD1-CB 3.48Å; N717-N813 PolarHBondContact OD1-N 3.04Å; N813-Q836 VanDerWaalsContact OD1-CA 3.28Å; N813-Q836 WeakPolarHBondContact OD1-CA 3.29Å; N813-Q836 WeakPolarHBondContact OD1-CB 3.43Å; N813-F837 HydrophobicContact CB-CE1 4.34Å; N813-F837 PolarHBondContact ND2-O 2.98Å; N813-F837 WeakPolarHBondContact OD1-CD1 3.32Å; N813-F837 PolarHBondContact OD1-N 3.25Å; N813-F837 PolarHBondContact OD1-O 3.41Å
814	D	95.7	Very high	94.8	Very high	75 Å²	75	60.9 Å²	60.9	40%	0.401	31%	0.31	S	S	.	.			trans	-73.8	154.4	168.4	-150.9	-63.4	0	0	0	111.1	N717 T812 L816	N717-D814 PolarHBondContact ND2-N 3.49Å; T812-D814 HydrophobicContact CG2-CB 4.4Å; T812-D814 PolarHBondContact OG1-N 3.3Å; T812-D814 VanDerWaalsContact OG1-N 3.16Å; D814-L816 HydrophobicContact CB-CD2 4Å; D814-L816 PolarHBondContact OD1-N 2.96Å
815	N	93.3	Very high	94.8	Very high	72 Å²	72	60.3 Å²	60.3	39%	0.385	31%	0.311	S	S	.	.			trans	-97.7	-4.4	176	-66.3	-106.9	0	0	0	112.2	R817 I830	N815-R817 HydrophobicContact CB-CG 3.76Å; N815-R817 PolarHBondContact O-N 3.41Å; N815-R817 VanDerWaalsContact O-N 3.09Å; N815-I830 WeakPolarHBondContact O-CG2 3.4Å
816	L	93.9	Very high	94.7	Very high	4 Å²	4	52.5 Å²	52.5	2%	0.021	28%	0.277	C	S	.	.			trans	51.6	34.8	175.7	-55.7	-176.3	0	0	0	113.9	D796 L800 I810 D814 D818 F819 I830 L834	D796-L816 HydrophobicContact CB-CD2 4.19Å; L800-L816 HydrophobicContact CD1-CD1 4.46Å; L800-L816 HydrophobicContact CD2-CD1 4.07Å; L800-L816 HydrophobicContact CG-CD1 4.19Å; I810-L816 HydrophobicContact CD1-CD1 4.4Å; D814-L816 HydrophobicContact CB-CD2 4Å; D814-L816 PolarHBondContact OD1-N 2.96Å; L816-D818 VanDerWaalsContact C-N 3.32Å; L816-D818 PolarHBondContact O-N 2.98Å; L816-F819 HydrophobicContact CB-CD2 4.23Å; L816-F819 WeakPolarHBondContact O-CB 3.32Å; L816-F819 PolarHBondContact O-N 2.98Å; L816-I830 HydrophobicContact CB-CD1 3.89Å; L816-I830 HydrophobicContact CB-CG1 4.07Å; L816-I830 HydrophobicContact CD1-CG1 4.41Å; L816-L834 HydrophobicContact CD1-CD2 4.13Å
817	R	91.3	Very high	94.7	Very high	178 Å²	178	53.8 Å²	53.8	67%	0.672	28%	0.277	S	S	*	.	H	α-helix	trans	-57.8	-39.6	-164.2	-63.9	-174.7	179.9	178.8	1.8	113.6	N815 F819 V820	N815-R817 HydrophobicContact CB-CG 3.76Å; N815-R817 PolarHBondContact O-N 3.41Å; N815-R817 VanDerWaalsContact O-N 3.09Å; R817-F819 PolarHBondContact O-N 2.71Å; R817-V820 WeakPolarHBondContact O-CB 3.31Å; R817-V820 WeakPolarHBondContact O-CG2 3.28Å; R817-V820 PolarHBondContact O-N 3.12Å; R817-V820 VanDerWaalsContact O-N 3.08Å
818	D	90.8	Very high	94.7	Very high	137 Å²	137	56.5 Å²	56.5	73%	0.733	28%	0.282	S	S	*	.	H	α-helix	trans	-57.2	-22.5	179.5	-61.2	8.8	0	0	0	113.2	L816 T822	L816-D818 VanDerWaalsContact C-N 3.32Å; L816-D818 PolarHBondContact O-N 2.98Å; D818-T822 PolarHBondContact O-OG1 2.93Å
819	F	92.3	Very high	94.7	Very high	8 Å²	8	56.5 Å²	56.5	4%	0.035	28%	0.282	C	S	.	.	H	α-helix	trans	-98.6	-12.4	-176.9	-56.1	-67.5	0	0	0	113.8	D796 R797 L800 L816 R817 D821 T822 W826 I830	D796-F819 HydrophobicContact CB-CD2 4.01Å; D796-F819 HydrophobicContact CB-CE2 3.26Å; D796-F819 HydrophobicContact CB-CZ 3.72Å; R797-F819 HydrophobicContact CG-CD1 4.48Å; R797-F819 HydrophobicContact CG-CE1 3.75Å; R797-F819 HydrophobicContact CG-CZ 4.15Å; L800-F819 HydrophobicContact CD1-CB 3.52Å; L800-F819 HydrophobicContact CD1-CD1 4.29Å; L800-F819 HydrophobicContact CD1-CD2 3.9Å; L800-F819 HydrophobicContact CD1-CG 3.61Å; L816-F819 HydrophobicContact CB-CD2 4.23Å; L816-F819 WeakPolarHBondContact O-CB 3.32Å; L816-F819 PolarHBondContact O-N 2.98Å; R817-F819 PolarHBondContact O-N 2.71Å; F819-D821 VanDerWaalsContact C-N 3.29Å; F819-D821 PolarHBondContact O-N 3.16Å; F819-T822 WeakPolarHBondContact O-CB 3.37Å; F819-T822 PolarHBondContact O-N 3.31Å; F819-T822 VanDerWaalsContact O-N 3.07Å; F819-W826 HydrophobicContact CB-CE3 3.97Å; F819-W826 HydrophobicContact CB-CZ3 4.4Å; F819-W826 HydrophobicContact CD1-CE3 4.2Å; F819-W826 AromaticContact CD1-CZ3 3.76Å; F819-W826 HydrophobicContact CD1-CZ3 3.76Å; F819-W826 HydrophobicContact CG-CE3 4.46Å; F819-W826 HydrophobicContact CG-CZ3 4.43Å; F819-I830 HydrophobicContact CB-CD1 4.06Å
820	V	90.8	Very high	94.6	Very high	34 Å²	34	57.6 Å²	57.6	21%	0.206	29%	0.287	C	S	.	.	H	α-helix	trans	-58.5	-38.9	-176.7	170.6	0	0	0	0	112.2	R817 R827 I830	R817-V820 WeakPolarHBondContact O-CB 3.31Å; R817-V820 WeakPolarHBondContact O-CG2 3.28Å; R817-V820 PolarHBondContact O-N 3.12Å; R817-V820 VanDerWaalsContact O-N 3.08Å; V820-R827 HydrophobicContact CG1-CG 4.29Å; V820-R827 WeakPolarHBondContact O-CB 3.47Å; V820-R827 PolarHBondContact O-NH1 3.31Å; V820-R827 PolarHBondContact O-NH2 3.27Å; V820-I830 HydrophobicContact CG2-CD1 3.84Å; V820-I830 HydrophobicContact CG2-CG2 3.9Å
821	D	89.9	Confident	94.4	Very high	128 Å²	128	63.2 Å²	63.2	68%	0.684	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.4	6	178.5	-66.5	-48.3	0	0	0	113.9	F819 R827	F819-D821 VanDerWaalsContact C-N 3.29Å; F819-D821 PolarHBondContact O-N 3.16Å; D821-R827 IonicContact OD1-CZ 2.69Å; D821-R827 IonicContact OD1-NH1 2.69Å; D821-R827 PolarHBondContact OD1-NH1 3.13Å; D821-R827 IonicContact OD1-NH2 3.86Å; D821-R827 PolarHBondContact OD1-NH2 3.22Å
822	T	91.1	Very high	94.3	Very high	89 Å²	89	67.9 Å²	67.9	55%	0.546	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.7	-32.8	177.2	-63.7	0	0	0	0	112.7	D818 F819 W826	D818-T822 PolarHBondContact O-OG1 2.93Å; F819-T822 WeakPolarHBondContact O-CB 3.37Å; F819-T822 PolarHBondContact O-N 3.31Å; F819-T822 VanDerWaalsContact O-N 3.07Å; T822-W826 HydrophobicContact CG2-CE3 3.91Å; T822-W826 HydrophobicContact CG2-CZ3 3.65Å
823	S	93.4	Very high	94.2	Very high	35 Å²	35	69.4 Å²	69.4	25%	0.245	34%	0.341	C	S	.	.			trans	-158.9	134.6	-177.5	168	0	0	0	0	111.1	T825 W826 R827	S823-T825 PolarHBondContact O-N 3.48Å; S823-T825 PolarHBondContact OG-N 3.46Å; S823-W826 PolarHBondContact O-N 2.91Å; S823-W826 VanDerWaalsContact O-N 3.1Å; S823-R827 WeakPolarHBondContact O-CB 3.37Å; S823-R827 PolarHBondContact O-N 3.28Å
824	D	94.1	Very high	94.2	Very high	97 Å²	97	67.6 Å²	67.6	52%	0.519	33%	0.331	S	S	.	.	H	α-helix	trans	-66.1	-24.5	175.8	-70.8	-38.5	0	0	0	113.3	R827 R828	D824-R827 IonicContact OD1-CZ 3.92Å; D824-R827 IonicContact OD1-NE 2.84Å; D824-R827 PolarHBondContact OD1-NE 3.05Å; D824-R827 VanDerWaalsContact OD1-NE 3.08Å; D824-R827 IonicContact OD1-NH2 2.64Å; D824-R828 WeakPolarHBondContact O-CG 3.46Å; D824-R828 PolarHBondContact O-N 2.95Å
825	T	95.4	Very high	94.3	Very high	58 Å²	58	64 Å²	64	36%	0.356	31%	0.312	S	S	.	.	H	α-helix	trans	-67.7	-43.6	171.1	-47.3	0	0	0	0	110.2	E804 S823 R828 I829	E804-T825 HydrophobicContact CG-CG2 3.95Å; E804-T825 WeakPolarHBondContact OE1-CB 3.38Å; E804-T825 WeakPolarHBondContact OE1-CG2 3.35Å; S823-T825 PolarHBondContact O-N 3.48Å; S823-T825 PolarHBondContact OG-N 3.46Å; T825-R828 PolarHBondContact O-N 3Å; T825-I829 HydrophobicContact CG2-CD1 4.29Å; T825-I829 WeakPolarHBondContact O-CG1 3.5Å; T825-I829 PolarHBondContact O-N 3.03Å
826	W	96.6	Very high	94.5	Very high	17 Å²	17	65.4 Å²	65.4	6%	0.064	32%	0.316	C	S	.	.	H	α-helix	trans	-70.3	-38.8	178.5	-65.6	-0.5	0	0	0	111.8	R797 L800 H801 E804 F819 T822 S823 R828 I829 I830	R797-W826 HydrophobicContact CG-CH2 4.32Å; L800-W826 HydrophobicContact CB-CD2 4.2Å; L800-W826 HydrophobicContact CB-CG 4.34Å; L800-W826 HydrophobicContact CB-CZ2 4.35Å; L800-W826 HydrophobicContact CD1-CD2 4.08Å; L800-W826 HydrophobicContact CD1-CE3 4.01Å; L800-W826 HydrophobicContact CD1-CG 4.4Å; L800-W826 HydrophobicContact CD1-CZ3 4.43Å; L800-W826 HydrophobicContact CD2-CB 4.37Å; L800-W826 HydrophobicContact CD2-CG 4.46Å; H801-W826 AromaticContact CE1-CZ2 3.48Å; H801-W826 VanDerWaalsContact CE1-CZ2 3.48Å; H801-W826 WeakPolarHBondContact CE1-CZ2 3.44Å; H801-W826 AromaticContact ND1-CZ2 3.67Å; H801-W826 AromaticContact NE2-CZ2 3.74Å; E804-W826 PolarHBondContact OE2-NE1 3.3Å; F819-W826 HydrophobicContact CB-CE3 3.97Å; F819-W826 HydrophobicContact CB-CZ3 4.4Å; F819-W826 HydrophobicContact CD1-CE3 4.2Å; F819-W826 AromaticContact CD1-CZ3 3.76Å; F819-W826 HydrophobicContact CD1-CZ3 3.76Å; F819-W826 HydrophobicContact CG-CE3 4.46Å; F819-W826 HydrophobicContact CG-CZ3 4.43Å; T822-W826 HydrophobicContact CG2-CE3 3.91Å; T822-W826 HydrophobicContact CG2-CZ3 3.65Å; S823-W826 PolarHBondContact O-N 2.91Å; S823-W826 VanDerWaalsContact O-N 3.1Å; W826-R828 VanDerWaalsContact C-N 3.28Å; W826-R828 PolarHBondContact O-N 3.34Å; W826-I829 PolarHBondContact O-N 3.38Å; W826-I829 VanDerWaalsContact O-N 3.13Å; W826-I830 WeakPolarHBondContact O-CB 3.35Å; W826-I830 VanDerWaalsContact O-CG1 3.25Å; W826-I830 WeakPolarHBondContact O-CG1 3.43Å; W826-I830 PolarHBondContact O-N 2.82Å
827	R	96.6	Very high	94.8	Very high	68 Å²	68	65.8 Å²	65.8	26%	0.257	32%	0.318	S	S	.	.	H	α-helix	trans	-50.1	-48.4	170.2	-167.6	-171.4	-60.4	-76.7	3.4	111.3	V820 D821 S823 D824 I830 Q831	V820-R827 HydrophobicContact CG1-CG 4.29Å; V820-R827 WeakPolarHBondContact O-CB 3.47Å; V820-R827 PolarHBondContact O-NH1 3.31Å; V820-R827 PolarHBondContact O-NH2 3.27Å; D821-R827 IonicContact OD1-CZ 2.69Å; D821-R827 IonicContact OD1-NH1 2.69Å; D821-R827 PolarHBondContact OD1-NH1 3.13Å; D821-R827 IonicContact OD1-NH2 3.86Å; D821-R827 PolarHBondContact OD1-NH2 3.22Å; S823-R827 WeakPolarHBondContact O-CB 3.37Å; S823-R827 PolarHBondContact O-N 3.28Å; D824-R827 IonicContact OD1-CZ 3.92Å; D824-R827 IonicContact OD1-NE 2.84Å; D824-R827 PolarHBondContact OD1-NE 3.05Å; D824-R827 VanDerWaalsContact OD1-NE 3.08Å; D824-R827 IonicContact OD1-NH2 2.64Å; R827-I830 PolarHBondContact O-N 3.08Å; R827-Q831 WeakPolarHBondContact O-CB 3.27Å; R827-Q831 VanDerWaalsContact O-CG 3.22Å; R827-Q831 WeakPolarHBondContact O-CG 3.44Å; R827-Q831 PolarHBondContact O-N 3.18Å
828	R	95.8	Very high	95.1	Very high	134 Å²	134	61 Å²	61	51%	0.506	31%	0.308	S	S	.	.	H	α-helix	trans	-67.5	-42.1	176.2	-69.6	178	-154.7	148.1	11	113.1	D824 T825 W826 I830 Q831 E832	D824-R828 WeakPolarHBondContact O-CG 3.46Å; D824-R828 PolarHBondContact O-N 2.95Å; T825-R828 PolarHBondContact O-N 3Å; W826-R828 VanDerWaalsContact C-N 3.28Å; W826-R828 PolarHBondContact O-N 3.34Å; R828-I830 VanDerWaalsContact C-N 3.28Å; R828-I830 PolarHBondContact O-N 3.39Å; R828-Q831 PolarHBondContact O-N 2.8Å; R828-E832 VanDerWaalsContact O-CB 3.22Å; R828-E832 WeakPolarHBondContact O-CB 3.32Å; R828-E832 WeakPolarHBondContact O-CG 3.43Å; R828-E832 PolarHBondContact O-N 2.57Å
829	I	96.8	Very high	95.4	Very high	0 Å²	0	56 Å²	56	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-58	-43.3	174.6	-67.3	161.8	0	0	0	110.8	L800 A803 E804 I810 T825 W826 R833 L834	L800-I829 HydrophobicContact CD2-CB 4.35Å; L800-I829 HydrophobicContact CD2-CG2 3.91Å; A803-I829 HydrophobicContact CB-CD1 4.27Å; A803-I829 HydrophobicContact CB-CG2 3.88Å; E804-I829 HydrophobicContact CB-CD1 3.77Å; I810-I829 HydrophobicContact CD1-CG2 3.69Å; I810-I829 HydrophobicContact CG1-CG2 4.39Å; T825-I829 HydrophobicContact CG2-CD1 4.29Å; T825-I829 WeakPolarHBondContact O-CG1 3.5Å; T825-I829 PolarHBondContact O-N 3.03Å; W826-I829 PolarHBondContact O-N 3.38Å; W826-I829 VanDerWaalsContact O-N 3.13Å; I829-R833 HydrophobicContact CG2-CB 4.46Å; I829-R833 CarbonylContact O-C 3.52Å; I829-R833 WeakPolarHBondContact O-CA 3.42Å; I829-R833 WeakPolarHBondContact O-CB 3.12Å; I829-R833 PolarHBondContact O-N 2.64Å; I829-L834 PolarHBondContact O-N 2.91Å
830	I	96.3	Very high	95.4	Very high	22 Å²	22	59.3 Å²	59.3	11%	0.113	30%	0.301	C	S	.	.	H	α-helix	trans	-69	-34.3	179.8	-67	165	0	0	0	111.8	L800 N815 L816 F819 V820 W826 R827 R828 L834	L800-I830 HydrophobicContact CD2-CD1 4.18Å; L800-I830 HydrophobicContact CD2-CG1 3.91Å; N815-I830 WeakPolarHBondContact O-CG2 3.4Å; L816-I830 HydrophobicContact CB-CD1 3.89Å; L816-I830 HydrophobicContact CB-CG1 4.07Å; L816-I830 HydrophobicContact CD1-CG1 4.41Å; F819-I830 HydrophobicContact CB-CD1 4.06Å; V820-I830 HydrophobicContact CG2-CD1 3.84Å; V820-I830 HydrophobicContact CG2-CG2 3.9Å; W826-I830 WeakPolarHBondContact O-CB 3.35Å; W826-I830 VanDerWaalsContact O-CG1 3.25Å; W826-I830 WeakPolarHBondContact O-CG1 3.43Å; W826-I830 PolarHBondContact O-N 2.82Å; R827-I830 PolarHBondContact O-N 3.08Å; R828-I830 VanDerWaalsContact C-N 3.28Å; R828-I830 PolarHBondContact O-N 3.39Å; I830-L834 HydrophobicContact CG2-CD1 4.05Å; I830-L834 WeakPolarHBondContact O-CG 3.33Å
831	Q	94.4	Very high	95.4	Very high	119 Å²	119	63 Å²	63	56%	0.556	32%	0.316	S	S	*	.	H	α-helix	trans	-83.6	-31.5	-179.9	-73.7	172.6	-26.7	0	0	114.2	R827 R828	R827-Q831 WeakPolarHBondContact O-CB 3.27Å; R827-Q831 VanDerWaalsContact O-CG 3.22Å; R827-Q831 WeakPolarHBondContact O-CG 3.44Å; R827-Q831 PolarHBondContact O-N 3.18Å; R828-Q831 PolarHBondContact O-N 2.8Å
832	E	95.4	Very high	95.6	Very high	97 Å²	97	58.8 Å²	58.8	45%	0.453	29%	0.293	S	S	.	.	H	α-helix	trans	-117.8	-13.5	-165.9	-56.1	170.5	162.2	0	0	113.5	R828 F861	R828-E832 VanDerWaalsContact O-CB 3.22Å; R828-E832 WeakPolarHBondContact O-CB 3.32Å; R828-E832 WeakPolarHBondContact O-CG 3.43Å; R828-E832 PolarHBondContact O-N 2.57Å; E832-F861 VanDerWaalsContact O-CE2 3.28Å; E832-F861 WeakPolarHBondContact O-CE2 3.48Å
833	R	96.7	Very high	95.8	Very high	32 Å²	32	60.4 Å²	60.4	12%	0.121	29%	0.294	C	S	.	.	S	Bend	trans	-141.5	17.4	-166.3	-73.4	-179.3	-81.7	178.2	-19.6	115.7	D807 I810 I829	D807-R833 IonicContact OD1-CZ 3.74Å; D807-R833 IonicContact OD1-NH1 2.63Å; D807-R833 PolarHBondContact OD1-NH1 3.08Å; D807-R833 IonicContact OD1-NH2 2.72Å; I810-R833 PolarHBondContact N-O 2.84Å; I829-R833 HydrophobicContact CG2-CB 4.46Å; I829-R833 CarbonylContact O-C 3.52Å; I829-R833 WeakPolarHBondContact O-CA 3.42Å; I829-R833 WeakPolarHBondContact O-CB 3.12Å; I829-R833 PolarHBondContact O-N 2.64Å
834	L	97.7	Very high	96	Very high	16 Å²	16	59.6 Å²	59.6	8%	0.084	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	138.8	163.2	-58.6	-171.6	0	0	0	110.3	I810 T812 L816 I829 I830	I810-L834 HydrophobicContact CB-CD2 3.79Å; I810-L834 HydrophobicContact CD1-CD2 4.18Å; I810-L834 HydrophobicContact CG1-CD2 4.46Å; I810-L834 HydrophobicContact CG2-CD2 4.26Å; I810-L834 CarbonylContact O-C 3.58Å; I810-L834 WeakPolarHBondContact O-CA 3.37Å; T812-L834 HydrophobicContact CG2-CD2 4.35Å; L816-L834 HydrophobicContact CD1-CD2 4.13Å; I829-L834 PolarHBondContact O-N 2.91Å; I830-L834 HydrophobicContact CG2-CD1 4.05Å; I830-L834 WeakPolarHBondContact O-CG 3.33Å
835	L	98.3	Very high	96.2	Very high	0 Å²	0	59.6 Å²	59.6	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	100.7	175.9	-177.7	54.2	0	0	0	109.4	F740 I809 I810 V811 T812 I846 P847 P850 L858 F861 L862	F740-L835 HydrophobicContact CE1-CD2 4.01Å; F740-L835 HydrophobicContact CZ-CD2 3.81Å; I809-L835 HydrophobicContact CG2-CB 3.64Å; I809-L835 HydrophobicContact CG2-CD2 4.15Å; I810-L835 PolarHBondContact O-N 3.01Å; V811-L835 WeakPolarHBondContact CA-O 3.3Å; V811-L835 HydrophobicContact CG2-CB 4.32Å; V811-L835 HydrophobicContact CG2-CD2 4.24Å; T812-L835 PolarHBondContact N-O 3.49Å; L835-I846 HydrophobicContact CD1-CB 4.3Å; L835-I846 HydrophobicContact CD2-CD1 4.22Å; L835-I846 HydrophobicContact CG-CG2 4.33Å; L835-P847 HydrophobicContact CD1-CG 4.49Å; L835-P850 HydrophobicContact CD1-CB 3.87Å; L835-P850 HydrophobicContact CD1-CG 3.82Å; L835-L858 HydrophobicContact CD1-CD1 4.17Å; L835-L858 HydrophobicContact CD2-CD1 4.43Å; L835-F861 HydrophobicContact CB-CE1 4.06Å; L835-F861 HydrophobicContact CD1-CE1 4.19Å; L835-F861 HydrophobicContact CD2-CE1 4.35Å; L835-F861 HydrophobicContact CG-CE1 4.44Å; L835-L862 HydrophobicContact CD2-CD2 4.13Å
836	Q	97.8	Very high	96.3	Very high	101 Å²	101	57.9 Å²	57.9	47%	0.472	27%	0.273	S	S	.	.			trans	-71.7	159.4	174.5	-64.3	-174.9	11.7	0	0	111	N813 P847	N813-Q836 VanDerWaalsContact OD1-CA 3.28Å; N813-Q836 WeakPolarHBondContact OD1-CA 3.29Å; N813-Q836 WeakPolarHBondContact OD1-CB 3.43Å; Q836-P847 WeakPolarHBondContact O-CD 3.41Å
837	F	98.4	Very high	96.3	Very high	12 Å²	12	59.1 Å²	59.1	5%	0.053	28%	0.283	C	S	.	.			trans	-149.6	165.8	-175.9	67	-89	0	0	0	111.3	N717 V718 A721 V811 N813 F839 F844 M845 I846	N717-F837 WeakPolarHBondContact OD1-CE1 3.18Å; N717-F837 VanDerWaalsContact OD1-CZ 3.31Å; N717-F837 WeakPolarHBondContact OD1-CZ 3.45Å; V718-F837 HydrophobicContact CB-CZ 4.21Å; V718-F837 HydrophobicContact CG2-CD1 4.4Å; V718-F837 HydrophobicContact CG2-CE1 3.7Å; V718-F837 HydrophobicContact CG2-CE2 4.18Å; V718-F837 HydrophobicContact CG2-CZ 3.59Å; A721-F837 HydrophobicContact CB-CE2 3.66Å; A721-F837 HydrophobicContact CB-CZ 3.98Å; V811-F837 HydrophobicContact CG1-CD1 3.98Å; N813-F837 HydrophobicContact CB-CE1 4.34Å; N813-F837 PolarHBondContact ND2-O 2.98Å; N813-F837 WeakPolarHBondContact OD1-CD1 3.32Å; N813-F837 PolarHBondContact OD1-N 3.25Å; N813-F837 PolarHBondContact OD1-O 3.41Å; F837-F839 HydrophobicContact CD2-CD2 4.09Å; F837-F839 HydrophobicContact CD2-CE2 4.03Å; F837-F839 AromaticContact CE2-CD2 3.86Å; F837-F839 HydrophobicContact CE2-CD2 3.86Å; F837-F839 AromaticContact CE2-CE2 3.7Å; F837-F839 HydrophobicContact CE2-CE2 3.7Å; F837-F844 HydrophobicContact CB-CD2 4.34Å; F837-F844 HydrophobicContact CB-CE2 3.55Å; F837-F844 HydrophobicContact CB-CZ 3.71Å; F837-F844 HydrophobicContact CD1-CE2 4.17Å; F837-F844 AromaticContact CD2-CD2 3.97Å; F837-F844 HydrophobicContact CD2-CD2 3.97Å; F837-F844 AromaticContact CD2-CE2 3.46Å; F837-F844 HydrophobicContact CD2-CE2 3.46Å; F837-F844 VanDerWaalsContact CD2-CE2 3.46Å; F837-F844 HydrophobicContact CD2-CZ 4.42Å; F837-F844 HydrophobicContact CE2-CE2 4.23Å; F837-F844 HydrophobicContact CG-CD2 4.33Å; F837-F844 AromaticContact CG-CE2 3.44Å; F837-F844 HydrophobicContact CG-CE2 3.44Å; F837-F844 VanDerWaalsContact CG-CE2 3.44Å; F837-F844 AromaticContact CG-CZ 3.97Å; F837-F844 HydrophobicContact CG-CZ 3.97Å; F837-M845 CarbonylContact C-O 3.56Å; F837-M845 WeakPolarHBondContact CA-O 3.23Å; F837-M845 WeakPolarHBondContact CB-O 3.48Å; F837-I846 HydrophobicContact CB-CG2 3.83Å
838	T	97.6	Very high	96.3	Very high	77 Å²	77	61 Å²	61	47%	0.472	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	160.8	169.4	-169.3	0	0	0	0	111	M845	T838-M845 HydrophobicContact CG2-CB 3.89Å; T838-M845 PolarHBondContact N-O 3.07Å; T838-M845 PolarHBondContact O-N 3.02Å
839	F	97.2	Very high	96.3	Very high	31 Å²	31	58.6 Å²	58.6	14%	0.136	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	122.7	174.1	-84.9	-77.3	0	0	0	110.1	V718 A721 H722 L735 F837 H843 F844	V718-F839 HydrophobicContact CG1-CE2 4Å; V718-F839 HydrophobicContact CG1-CZ 3.99Å; A721-F839 HydrophobicContact CB-CD2 4.16Å; A721-F839 HydrophobicContact CB-CE2 4.5Å; H722-F839 HydrophobicContact CB-CD1 4.28Å; H722-F839 HydrophobicContact CB-CD2 3.87Å; H722-F839 HydrophobicContact CB-CE1 4.11Å; H722-F839 HydrophobicContact CB-CE2 3.7Å; H722-F839 HydrophobicContact CB-CG 4.15Å; H722-F839 HydrophobicContact CB-CZ 3.82Å; H722-F839 AromaticContact CD2-CD1 3.44Å; H722-F839 VanDerWaalsContact CD2-CD1 3.44Å; H722-F839 WeakPolarHBondContact CD2-CD1 3.46Å; H722-F839 AromaticContact CD2-CE1 3.58Å; H722-F839 AromaticContact CD2-CG 3.92Å; L735-F839 HydrophobicContact CB-CE1 4.48Å; L735-F839 HydrophobicContact CD1-CE1 4.33Å; F837-F839 HydrophobicContact CD2-CD2 4.09Å; F837-F839 HydrophobicContact CD2-CE2 4.03Å; F837-F839 AromaticContact CE2-CD2 3.86Å; F837-F839 HydrophobicContact CE2-CD2 3.86Å; F837-F839 AromaticContact CE2-CE2 3.7Å; F837-F839 HydrophobicContact CE2-CE2 3.7Å; F839-H843 WeakPolarHBondContact CA-O 3.31Å; F839-F844 HydrophobicContact CD1-CB 4.29Å; F839-F844 HydrophobicContact CE1-CB 3.74Å; F839-F844 AromaticContact CE1-CD2 3.91Å; F839-F844 HydrophobicContact CE1-CD2 3.91Å; F839-F844 HydrophobicContact CE1-CG 4.33Å; F839-F844 AromaticContact CE2-CD2 3.86Å; F839-F844 HydrophobicContact CE2-CD2 3.86Å; F839-F844 HydrophobicContact CE2-CE2 4.44Å; F839-F844 HydrophobicContact CZ-CB 4.21Å; F839-F844 AromaticContact CZ-CD2 3.52Å; F839-F844 HydrophobicContact CZ-CD2 3.52Å; F839-F844 HydrophobicContact CZ-CE2 4.38Å; F839-F844 HydrophobicContact CZ-CG 4.32Å
840	V	93.8	Very high	96.2	Very high	78 Å²	78	59.6 Å²	59.6	47%	0.473	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	88.4	169.8	-178.2	0	0	0	0	107.7	D842 H843 M845	V840-D842 PolarHBondContact O-N 3.29Å; V840-H843 HydrophobicContact CB-CB 4.37Å; V840-H843 PolarHBondContact N-O 3.17Å; V840-H843 WeakPolarHBondContact O-CB 3.47Å; V840-H843 PolarHBondContact O-N 2.77Å; V840-H843 VanDerWaalsContact O-N 3.11Å; V840-H843 PolarHBondContact O-ND1 3.13Å; V840-M845 HydrophobicContact CB-SD 4.14Å; V840-M845 HydrophobicContact CG2-SD 3.63Å
841	E	90.4	Very high	96.1	Very high	112 Å²	112	62 Å²	62	52%	0.523	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	55.7	-128.8	-162.4	-52.3	-174.3	158.9	0	0	109	R686 H843	R686-E841 WeakPolarHBondContact CD-OE1 2.78Å; E841-H843 PolarHBondContact O-N 2.98Å
842	D	94.8	Very high	96.1	Very high	39 Å²	39	57.7 Å²	57.7	21%	0.209	30%	0.302	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.4	1.3	179	-57.6	-19.5	0	0	0	113.6	S690 H722 R731 L735 V840 F844	S690-D842 WeakPolarHBondContact CB-OD1 3.37Å; S690-D842 WeakPolarHBondContact CB-OD2 3.15Å; S690-D842 PolarHBondContact OG-OD1 2.91Å; H722-D842 IonicContact CE1-OD1 2.65Å; H722-D842 IonicContact NE2-OD1 3.87Å; H722-D842 PolarHBondContact NE2-OD1 3.43Å; R731-D842 IonicContact CZ-OD2 3.3Å; R731-D842 IonicContact NE-OD1 3.25Å; R731-D842 IonicContact NE-OD2 3.96Å; R731-D842 IonicContact NH2-OD1 3.96Å; R731-D842 IonicContact NH2-OD2 3.92Å; R731-D842 PolarHBondContact NH2-OD2 3.08Å; L735-D842 HydrophobicContact CD1-CB 4.06Å; L735-D842 WeakPolarHBondContact CD1-O 2.96Å; V840-D842 PolarHBondContact O-N 3.29Å; D842-F844 PolarHBondContact O-N 3.31Å
843	H	94.4	Very high	96	Very high	123 Å²	123	61.3 Å²	61.3	57%	0.569	32%	0.316	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84.8	104.4	-179.8	-56.3	86.3	0	0	0	111	F839 V840 E841 M845	F839-H843 WeakPolarHBondContact CA-O 3.31Å; V840-H843 HydrophobicContact CB-CB 4.37Å; V840-H843 PolarHBondContact N-O 3.17Å; V840-H843 WeakPolarHBondContact O-CB 3.47Å; V840-H843 PolarHBondContact O-N 2.77Å; V840-H843 VanDerWaalsContact O-N 3.11Å; V840-H843 PolarHBondContact O-ND1 3.13Å; E841-H843 PolarHBondContact O-N 2.98Å; H843-M845 HydrophobicContact CB-CG 4.41Å; H843-M845 PolarHBondContact O-N 3.39Å
844	F	97.9	Very high	95.8	Very high	19 Å²	19	66.7 Å²	66.7	8%	0.083	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.5	118.1	167.2	-177.9	-102.8	0	0	0	110.1	A736 M739 F740 V811 F837 F839 D842 I846	A736-F844 HydrophobicContact CB-CD1 4.19Å; A736-F844 HydrophobicContact CB-CD2 3.91Å; A736-F844 HydrophobicContact CB-CE1 4.07Å; A736-F844 HydrophobicContact CB-CE2 3.75Å; A736-F844 HydrophobicContact CB-CG 4.12Å; A736-F844 HydrophobicContact CB-CZ 3.85Å; M739-F844 HydrophobicContact CB-CD1 3.95Å; M739-F844 HydrophobicContact CG-CD1 3.95Å; M739-F844 HydrophobicContact SD-CD1 4.39Å; M739-F844 HydrophobicContact SD-CE1 4.49Å; F740-F844 AromaticContact CE2-CE1 3.77Å; F740-F844 HydrophobicContact CE2-CE1 3.77Å; F740-F844 HydrophobicContact CE2-CZ 4.12Å; F740-F844 HydrophobicContact CZ-CE1 4.26Å; V811-F844 HydrophobicContact CG1-CZ 3.93Å; F837-F844 HydrophobicContact CB-CD2 4.34Å; F837-F844 HydrophobicContact CB-CE2 3.55Å; F837-F844 HydrophobicContact CB-CZ 3.71Å; F837-F844 HydrophobicContact CD1-CE2 4.17Å; F837-F844 AromaticContact CD2-CD2 3.97Å; F837-F844 HydrophobicContact CD2-CD2 3.97Å; F837-F844 AromaticContact CD2-CE2 3.46Å; F837-F844 HydrophobicContact CD2-CE2 3.46Å; F837-F844 VanDerWaalsContact CD2-CE2 3.46Å; F837-F844 HydrophobicContact CD2-CZ 4.42Å; F837-F844 HydrophobicContact CE2-CE2 4.23Å; F837-F844 HydrophobicContact CG-CD2 4.33Å; F837-F844 AromaticContact CG-CE2 3.44Å; F837-F844 HydrophobicContact CG-CE2 3.44Å; F837-F844 VanDerWaalsContact CG-CE2 3.44Å; F837-F844 AromaticContact CG-CZ 3.97Å; F837-F844 HydrophobicContact CG-CZ 3.97Å; F839-F844 HydrophobicContact CD1-CB 4.29Å; F839-F844 HydrophobicContact CE1-CB 3.74Å; F839-F844 AromaticContact CE1-CD2 3.91Å; F839-F844 HydrophobicContact CE1-CD2 3.91Å; F839-F844 HydrophobicContact CE1-CG 4.33Å; F839-F844 AromaticContact CE2-CD2 3.86Å; F839-F844 HydrophobicContact CE2-CD2 3.86Å; F839-F844 HydrophobicContact CE2-CE2 4.44Å; F839-F844 HydrophobicContact CZ-CB 4.21Å; F839-F844 AromaticContact CZ-CD2 3.52Å; F839-F844 HydrophobicContact CZ-CD2 3.52Å; F839-F844 HydrophobicContact CZ-CE2 4.38Å; F839-F844 HydrophobicContact CZ-CG 4.32Å; D842-F844 PolarHBondContact O-N 3.31Å; F844-I846 HydrophobicContact CD1-CG2 4.47Å; F844-I846 HydrophobicContact CE1-CG2 3.64Å; F844-I846 HydrophobicContact CZ-CG2 3.84Å
845	M	97.4	Very high	95.6	Very high	97 Å²	97	67.5 Å²	67.5	48%	0.478	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	136.6	-176.9	-63.5	178.6	66.1	0	0	110.6	F837 T838 V840 H843	F837-M845 CarbonylContact C-O 3.56Å; F837-M845 WeakPolarHBondContact CA-O 3.23Å; F837-M845 WeakPolarHBondContact CB-O 3.48Å; T838-M845 HydrophobicContact CG2-CB 3.89Å; T838-M845 PolarHBondContact N-O 3.07Å; T838-M845 PolarHBondContact O-N 3.02Å; V840-M845 HydrophobicContact CB-SD 4.14Å; V840-M845 HydrophobicContact CG2-SD 3.63Å; H843-M845 HydrophobicContact CB-CG 4.41Å; H843-M845 PolarHBondContact O-N 3.39Å
846	I	97.4	Very high	95.4	Very high	22 Å²	22	70.1 Å²	70.1	11%	0.113	38%	0.377	C	S	.	.			trans	-122.1	150.9	174.1	56.3	-178.7	0	0	0	109.1	M739 F740 L835 F837 F844 L858	M739-I846 HydrophobicContact CE-CD1 3.57Å; M739-I846 HydrophobicContact CE-CG1 3.69Å; M739-I846 HydrophobicContact SD-CD1 4.1Å; F740-I846 HydrophobicContact CE1-CD1 4Å; F740-I846 HydrophobicContact CZ-CD1 4.06Å; L835-I846 HydrophobicContact CD1-CB 4.3Å; L835-I846 HydrophobicContact CD2-CD1 4.22Å; L835-I846 HydrophobicContact CG-CG2 4.33Å; F837-I846 HydrophobicContact CB-CG2 3.83Å; F844-I846 HydrophobicContact CD1-CG2 4.47Å; F844-I846 HydrophobicContact CE1-CG2 3.64Å; F844-I846 HydrophobicContact CZ-CG2 3.84Å; I846-L858 HydrophobicContact CD1-CD1 3.84Å; I846-L858 HydrophobicContact CD1-CD2 3.82Å; I846-L858 HydrophobicContact CD1-CG 4.42Å; I846-L858 HydrophobicContact CG1-CD1 4.38Å; I846-L858 HydrophobicContact CG1-CD2 3.86Å
847	P	96.6	Very high	95.3	Very high	42 Å²	42	69.6 Å²	69.6	27%	0.273	37%	0.374	S	S	.	.			trans	-72.2	145.2	-179.5	30.5	-35.7	0	0	0	111.9	L835 Q836 D849	L835-P847 HydrophobicContact CD1-CG 4.49Å; Q836-P847 WeakPolarHBondContact O-CD 3.41Å; P847-D849 PolarHBondContact O-N 3.29Å
848	D	96.3	Very high	95.2	Very high	107 Å²	107	69.1 Å²	69.1	57%	0.572	37%	0.372	S	S	*	.	S	Bend	trans	-72.2	-16	171	-66	-43.3	0	0	0	112.2	H857 L858	D848-H857 WeakPolarHBondContact O-CA 3.26Å; D848-H857 PolarHBondContact O-CD2 3.39Å; D848-H857 VanDerWaalsContact O-CD2 3.24Å; D848-L858 PolarHBondContact O-N 2.9Å
849	D	96.1	Very high	95.1	Very high	84 Å²	84	68.5 Å²	68.5	45%	0.449	37%	0.366	S	S	.	.			trans	-120.9	72.7	175.3	64.1	-37.4	0	0	0	112.9	P847 L851 G852 K853	P847-D849 PolarHBondContact O-N 3.29Å; D849-L851 VanDerWaalsContact C-N 3.27Å; D849-L851 PolarHBondContact O-N 2.63Å; D849-L851 VanDerWaalsContact O-N 3.09Å; D849-G852 WeakPolarHBondContact O-CA 2.99Å; D849-G852 PolarHBondContact O-N 2.65Å; D849-G852 WeakPolarHBondContact OD2-CA 3.07Å; D849-K853 PolarHBondContact OD2-N 3.5Å
850	P	95.9	Very high	95.1	Very high	22 Å²	22	71.3 Å²	71.3	14%	0.143	38%	0.383	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.2	-29.2	-172.3	-29.4	37.6	0	0	0	116.7	L835 L858 F861	L835-P850 HydrophobicContact CD1-CB 3.87Å; L835-P850 HydrophobicContact CD1-CG 3.82Å; P850-L858 HydrophobicContact CG-CB 4.26Å; P850-L858 HydrophobicContact CG-CD1 3.83Å; P850-F861 HydrophobicContact CB-CD1 4.03Å; P850-F861 HydrophobicContact CB-CD2 3.99Å; P850-F861 HydrophobicContact CB-CE1 3.98Å; P850-F861 HydrophobicContact CB-CE2 3.93Å; P850-F861 HydrophobicContact CB-CG 4.04Å; P850-F861 HydrophobicContact CB-CZ 3.92Å; P850-F861 HydrophobicContact CG-CB 4.25Å; P850-F861 HydrophobicContact CG-CD1 3.87Å; P850-F861 HydrophobicContact CG-CD2 4.34Å; P850-F861 HydrophobicContact CG-CE1 4.25Å; P850-F861 HydrophobicContact CG-CG 3.92Å
851	L	94.7	Very high	95.2	Very high	73 Å²	73	68.2 Å²	68.2	38%	0.382	36%	0.363	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.9	20.3	175.7	-54.6	-178.9	0	0	0	112	D849 P856 F861	D849-L851 VanDerWaalsContact C-N 3.27Å; D849-L851 PolarHBondContact O-N 2.63Å; D849-L851 VanDerWaalsContact O-N 3.09Å; L851-P856 HydrophobicContact CD1-CG 4.42Å; L851-F861 HydrophobicContact CD1-CD2 4.45Å; L851-F861 HydrophobicContact CD1-CE2 4.19Å; L851-F861 HydrophobicContact CD2-CE2 4.08Å; L851-F861 HydrophobicContact CG-CD2 4.32Å; L851-F861 HydrophobicContact CG-CE2 3.94Å
852	G	93.2	Very high	95.5	Very high	28 Å²	28	62.9 Å²	62.9	29%	0.289	34%	0.338	S	S	.	.			trans	74.2	-179.8	-175	0	0	0	0	0	114.2	D849 D854 G855	D849-G852 WeakPolarHBondContact O-CA 2.99Å; D849-G852 PolarHBondContact O-N 2.65Å; D849-G852 WeakPolarHBondContact OD2-CA 3.07Å; G852-D854 VanDerWaalsContact C-N 3.26Å; G852-D854 PolarHBondContact O-N 2.95Å; G852-G855 PolarHBondContact O-N 2.9Å
853	K	93.5	Very high	95.5	Very high	173 Å²	173	66.6 Å²	66.6	75%	0.752	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-43	-38.6	-172.2	179.3	177	158.6	-69.5	0	117.1	D849	D849-K853 PolarHBondContact OD2-N 3.5Å
854	D	92.9	Very high	95.5	Very high	144 Å²	144	63.8 Å²	63.8	77%	0.77	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.5	7.8	-174.6	-52.3	-45	0	0	0	112.3	G852	G852-D854 VanDerWaalsContact C-N 3.26Å; G852-D854 PolarHBondContact O-N 2.95Å
855	G	92.5	Very high	94.6	Very high	34 Å²	34	67.6 Å²	67.6	35%	0.351	36%	0.356	S	S	.	.	S	Bend	trans	-93.8	-174.7	173.5	0	0	0	0	0	114.4	G852	G852-G855 PolarHBondContact O-N 2.9Å
856	P	95.1	Very high	92.6	Very high	54 Å²	54	69 Å²	69	35%	0.351	37%	0.366	S	S	.	.			trans	-74	149.7	176.4	32.1	-35.2	0	0	0	112	L851 F861	L851-P856 HydrophobicContact CD1-CG 4.42Å; P856-F861 HydrophobicContact CG-CB 4.14Å; P856-F861 HydrophobicContact CG-CD2 4.01Å
857	H	96.2	Very high	90.1	Very high	90 Å²	90	77.8 Å²	77.8	42%	0.417	40%	0.398	S	S	.	.			trans	-65	148.7	168.3	-177.3	-111.3	0	0	0	110.9	D848 D859 D860 F861	D848-H857 WeakPolarHBondContact O-CA 3.26Å; D848-H857 PolarHBondContact O-CD2 3.39Å; D848-H857 VanDerWaalsContact O-CD2 3.24Å; H857-D859 VanDerWaalsContact C-N 3.26Å; H857-D859 IonicContact CE1-OD2 3.32Å; H857-D859 PolarHBondContact CE1-OD2 3.38Å; H857-D859 VanDerWaalsContact CE1-OD2 3.32Å; H857-D859 PolarHBondContact ND1-N 3.12Å; H857-D859 IonicContact ND1-OD2 3.63Å; H857-D859 PolarHBondContact O-N 2.86Å; H857-D859 VanDerWaalsContact O-N 3.13Å; H857-D860 PolarHBondContact O-N 3.06Å; H857-F861 PolarHBondContact O-N 2.97Å
858	L	96.3	Very high	87.3	Confident	3 Å²	3	87.8 Å²	87.8	2%	0.016	43%	0.43	C	S	.	.	H	α-helix	trans	-48.3	-42.1	-177.6	175.2	64.9	0	0	0	114.1	L835 I846 D848 P850 D860 F861 L862	L835-L858 HydrophobicContact CD1-CD1 4.17Å; L835-L858 HydrophobicContact CD2-CD1 4.43Å; I846-L858 HydrophobicContact CD1-CD1 3.84Å; I846-L858 HydrophobicContact CD1-CD2 3.82Å; I846-L858 HydrophobicContact CD1-CG 4.42Å; I846-L858 HydrophobicContact CG1-CD1 4.38Å; I846-L858 HydrophobicContact CG1-CD2 3.86Å; D848-L858 PolarHBondContact O-N 2.9Å; P850-L858 HydrophobicContact CG-CB 4.26Å; P850-L858 HydrophobicContact CG-CD1 3.83Å; L858-D860 VanDerWaalsContact C-N 3.3Å; L858-D860 PolarHBondContact O-N 2.98Å; L858-F861 PolarHBondContact O-N 3.34Å; L858-L862 HydrophobicContact CD1-CD1 3.64Å; L858-L862 HydrophobicContact CD1-CG 3.96Å; L858-L862 HydrophobicContact CG-CD1 3.84Å; L858-L862 WeakPolarHBondContact O-CB 3.46Å; L858-L862 WeakPolarHBondContact O-CD1 3.37Å; L858-L862 VanDerWaalsContact O-CG 3.23Å; L858-L862 WeakPolarHBondContact O-CG 3.31Å; L858-L862 PolarHBondContact O-N 3.35Å
859	D	95.6	Very high	84.5	Confident	64 Å²	64	88.7 Å²	88.7	34%	0.342	44%	0.439	S	S	.	.	H	α-helix	trans	-65.5	-29.6	179.6	-71	-35.5	0	0	0	113.8	R743 H857 R863	R743-D859 IonicContact CZ-OD1 3.86Å; R743-D859 IonicContact NH1-OD1 3.96Å; R743-D859 IonicContact NH2-OD1 3.72Å; R743-D859 PolarHBondContact NH2-OD1 3.11Å; H857-D859 VanDerWaalsContact C-N 3.26Å; H857-D859 IonicContact CE1-OD2 3.32Å; H857-D859 PolarHBondContact CE1-OD2 3.38Å; H857-D859 VanDerWaalsContact CE1-OD2 3.32Å; H857-D859 PolarHBondContact ND1-N 3.12Å; H857-D859 IonicContact ND1-OD2 3.63Å; H857-D859 PolarHBondContact O-N 2.86Å; H857-D859 VanDerWaalsContact O-N 3.13Å; D859-R863 WeakPolarHBondContact O-CD 3.39Å; D859-R863 VanDerWaalsContact O-CG 3.22Å; D859-R863 WeakPolarHBondContact O-CG 3.45Å; D859-R863 PolarHBondContact O-NE 2.6Å
860	D	95.4	Very high	81.5	Confident	90 Å²	90	89.5 Å²	89.5	48%	0.481	45%	0.451	S	S	.	.	H	α-helix	trans	-89.8	-36.1	176.9	-67.4	-41.6	0	0	0	111.4	H857 L858 L862 R863	H857-D860 PolarHBondContact O-N 3.06Å; L858-D860 VanDerWaalsContact C-N 3.3Å; L858-D860 PolarHBondContact O-N 2.98Å; D860-L862 VanDerWaalsContact C-N 3.27Å; D860-L862 PolarHBondContact O-N 3.18Å; D860-R863 PolarHBondContact O-N 3Å; D860-R863 IonicContact OD1-CZ 2.68Å; D860-R863 IonicContact OD1-NH1 2.99Å; D860-R863 PolarHBondContact OD1-NH1 2.91Å
861	F	96.7	Very high	78.5	Confident	13 Å²	13	94.2 Å²	94.2	6%	0.057	48%	0.482	C	S	.	.	H	α-helix	trans	-53.4	-45.4	169.6	-179.2	-94.3	0	0	0	111.2	R709 I809 E832 L835 P850 L851 P856 H857 L858 R863	R709-F861 WeakPolarHBondContact CD-O 3.37Å; I809-F861 HydrophobicContact CD1-CD1 3.73Å; I809-F861 HydrophobicContact CD1-CE1 3.66Å; I809-F861 WeakPolarHBondContact CD1-O 3.42Å; I809-F861 HydrophobicContact CG1-CD1 4.48Å; I809-F861 HydrophobicContact CG1-CE1 3.97Å; I809-F861 HydrophobicContact CG1-CZ 4.44Å; I809-F861 HydrophobicContact CG2-CE1 3.8Å; I809-F861 HydrophobicContact CG2-CZ 4.35Å; E832-F861 VanDerWaalsContact O-CE2 3.28Å; E832-F861 WeakPolarHBondContact O-CE2 3.48Å; L835-F861 HydrophobicContact CB-CE1 4.06Å; L835-F861 HydrophobicContact CD1-CE1 4.19Å; L835-F861 HydrophobicContact CD2-CE1 4.35Å; L835-F861 HydrophobicContact CG-CE1 4.44Å; P850-F861 HydrophobicContact CB-CD1 4.03Å; P850-F861 HydrophobicContact CB-CD2 3.99Å; P850-F861 HydrophobicContact CB-CE1 3.98Å; P850-F861 HydrophobicContact CB-CE2 3.93Å; P850-F861 HydrophobicContact CB-CG 4.04Å; P850-F861 HydrophobicContact CB-CZ 3.92Å; P850-F861 HydrophobicContact CG-CB 4.25Å; P850-F861 HydrophobicContact CG-CD1 3.87Å; P850-F861 HydrophobicContact CG-CD2 4.34Å; P850-F861 HydrophobicContact CG-CE1 4.25Å; P850-F861 HydrophobicContact CG-CG 3.92Å; L851-F861 HydrophobicContact CD1-CD2 4.45Å; L851-F861 HydrophobicContact CD1-CE2 4.19Å; L851-F861 HydrophobicContact CD2-CE2 4.08Å; L851-F861 HydrophobicContact CG-CD2 4.32Å; L851-F861 HydrophobicContact CG-CE2 3.94Å; P856-F861 HydrophobicContact CG-CB 4.14Å; P856-F861 HydrophobicContact CG-CD2 4.01Å; H857-F861 PolarHBondContact O-N 2.97Å; L858-F861 PolarHBondContact O-N 3.34Å; F861-R863 PolarHBondContact O-N 2.86Å
862	L	96.7	Very high	75.8	Confident	0 Å²	0	96.5 Å²	96.5	0%	0	50%	0.501	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.2	-4	178.1	-69.9	167.3	0	0	0	114.9	L708 R709 I711 F740 I809 L835 L858 D860	L708-L862 CarbonylContact C-O 3.55Å; L708-L862 WeakPolarHBondContact CA-O 3.4Å; L708-L862 HydrophobicContact CD2-CB 4.48Å; R709-L862 PolarHBondContact N-O 3.3Å; I711-L862 HydrophobicContact CD1-CD2 3.62Å; F740-L862 HydrophobicContact CE1-CD2 4.01Å; I809-L862 HydrophobicContact CD1-CD2 3.82Å; I809-L862 HydrophobicContact CD1-CG 4.5Å; L835-L862 HydrophobicContact CD2-CD2 4.13Å; L858-L862 HydrophobicContact CD1-CD1 3.64Å; L858-L862 HydrophobicContact CD1-CG 3.96Å; L858-L862 HydrophobicContact CG-CD1 3.84Å; L858-L862 WeakPolarHBondContact O-CB 3.46Å; L858-L862 WeakPolarHBondContact O-CD1 3.37Å; L858-L862 VanDerWaalsContact O-CG 3.23Å; L858-L862 WeakPolarHBondContact O-CG 3.31Å; L858-L862 PolarHBondContact O-N 3.35Å; D860-L862 VanDerWaalsContact C-N 3.27Å; D860-L862 PolarHBondContact O-N 3.18Å
863	R	95.7	Very high	72.9	Confident	117 Å²	117	103.3 Å²	103.3	44%	0.442	53%	0.53	S	S	.	.	B	Isolated β-bridge	trans	-99.9	146.2	-178.1	-76.9	167.3	-177.9	173.9	-2.8	113	D707 L708 R709 D859 D860 F861	D707-R863 WeakPolarHBondContact O-CA 3.45Å; L708-R863 HydrophobicContact CD2-CG 4.12Å; R709-R863 PolarHBondContact NE-O 2.86Å; D859-R863 WeakPolarHBondContact O-CD 3.39Å; D859-R863 VanDerWaalsContact O-CG 3.22Å; D859-R863 WeakPolarHBondContact O-CG 3.45Å; D859-R863 PolarHBondContact O-NE 2.6Å; D860-R863 PolarHBondContact O-N 3Å; D860-R863 IonicContact OD1-CZ 2.68Å; D860-R863 IonicContact OD1-NH1 2.99Å; D860-R863 PolarHBondContact OD1-NH1 2.91Å; F861-R863 PolarHBondContact O-N 2.86Å
864	K	92.8	Very high	70.1	Confident	63 Å²	63	104.5 Å²	104.5	27%	0.274	54%	0.535	S	S	.	.			trans	-69	127.5	173.5	-74	161.8	169.6	140.3	0	109.3	P706 D707 L708 R709 E747 N866	P706-K864 PolarHBondContact O-NZ 2.79Å; D707-K864 WeakPolarHBondContact O-CB 3.24Å; D707-K864 PolarHBondContact O-N 2.74Å; L708-K864 WeakPolarHBondContact O-CD 3.29Å; L708-K864 WeakPolarHBondContact O-CE 3.31Å; L708-K864 PolarHBondContact O-NZ 2.85Å; R709-K864 HydrophobicContact CG-CG 3.96Å; E747-K864 IonicContact OE1-NZ 2.67Å; E747-K864 IonicContact OE2-NZ 3.92Å; E747-K864 PolarHBondContact OE2-NZ 3.41Å; K864-N866 PolarHBondContact O-N 3.5Å
865	D	80.4	Confident	67.1	Low	99 Å²	99	106.6 Å²	106.6	53%	0.529	54%	0.54	S	S	.	.			trans	-67.9	98.5	173.7	-92	-82.3	0	0	0	110.7	R709 R867	R709-D865 IonicContact NH2-OD2 3.1Å; R709-D865 PolarHBondContact NH2-OD2 3.05Å; D865-R867 PolarHBondContact O-N 3.11Å; D865-R867 IonicContact OD1-NE 3.55Å
866	N	53.9	Low	64.4	Low	128 Å²	128	110.3 Å²	110.3	68%	0.684	56%	0.558	S	S	*	*			trans	-68.9	23.5	173.9	-84.7	-34.7	0	0	0	113.6	D707 K864 R868	D707-N866 PolarHBondContact OD1-ND2 3.3Å; K864-N866 PolarHBondContact O-N 3.5Å; N866-R868 PolarHBondContact O-N 3.36Å
867	R	45	Very low	62.1	Low	206 Å²	206	112.7 Å²	112.7	78%	0.777	57%	0.574	S	S	*	*			trans	-76.1	48.7	178.1	-63.2	-169.1	-175.2	-150.8	-0.9	113.3	D865 V869	D865-R867 PolarHBondContact O-N 3.11Å; D865-R867 IonicContact OD1-NE 3.55Å; R867-V869 PolarHBondContact O-N 3.29Å
868	R	38.3	Very low	59	Low	251 Å²	251	114.8 Å²	114.8	95%	0.947	59%	0.588	S	S	*	*			trans	-78.6	65.5	158.1	-74.6	-167.5	177.4	-168	1.6	110.1	N866	N866-R868 PolarHBondContact O-N 3.36Å
869	V	37.1	Very low	55.7	Low	126 Å²	126	123.6 Å²	123.6	76%	0.764	63%	0.626	S	S	*	*			trans	-105.6	132.5	169.7	-178.3	0	0	0	0	108.2	R867	R867-V869 PolarHBondContact O-N 3.29Å
870	S	32.7	Very low	52.6	Low	101 Å²	101	132.3 Å²	132.3	71%	0.706	66%	0.655	S	S	*	*	P	Polyproline II helix	trans	-56.7	148	-179.2	-53.4	0	0	0	0	112.4
871	P	34.6	Very low	49.3	Very low	122 Å²	122	132.1 Å²	132.1	79%	0.792	67%	0.665	S	S	*	*	P	Polyproline II helix	trans	-63.7	128.3	179	26.3	-34.3	0	0	0	110.9
872	P	38.1	Very low	46.1	Very low	121 Å²	121	136.7 Å²	136.7	79%	0.786	70%	0.699	S	S	*	*	P	Polyproline II helix	trans	-71.4	148.5	172.7	30.2	-33.9	0	0	0	110.9
873	L	32.1	Very low	43	Very low	170 Å²	170	141.2 Å²	141.2	89%	0.89	73%	0.731	S	S	*	*	P	Polyproline II helix	trans	-75	145.7	179	-71.6	164	0	0	0	111.8
874	F	33.5	Very low	40	Very low	198 Å²	198	143.9 Å²	143.9	87%	0.868	75%	0.748	S	S	*	*	P	Polyproline II helix	trans	-69	129.6	176.7	-75.3	-97.5	0	0	0	112.5
875	H	30.7	Very low	37.1	Very low	188 Å²	188	147.4 Å²	147.4	87%	0.87	77%	0.766	S	S	*	*			trans	-152.1	118.4	151.7	-85.3	-66.3	0	0	0	111.3
876	P	35	Very low	34.7	Very low	112 Å²	112	149.1 Å²	149.1	73%	0.727	77%	0.771	S	S	*	*			trans	-103.3	-178.2	164.3	41.2	-33.9	0	0	0	110.9
877	P	48.6	Very low	33.6	Very low	104 Å²	104	150.9 Å²	150.9	68%	0.675	78%	0.775	S	S	*	*			cis	-125.6	178	-8.4	32	-11.5	0	0	0	113.5
878	D	29.4	Very low	32.9	Very low	134 Å²	134	149.4 Å²	149.4	72%	0.717	78%	0.777	S	S	*	*				161.7	160.5	108.2	-96.6	-32.8	0	0	0	116.1
879	F	28	Very low	33.1	Very low	188 Å²	188	143.3 Å²	143.3	83%	0.825	77%	0.77	S	S	*	*			trans	-35.5	148.6	174	-61	-99.8	0	0	0	115.3
880	R	29.3	Very low	32.7	Very low	247 Å²	247	143 Å²	143	93%	0.932	77%	0.767	S	S	*	*				-165.1	171.7	54.1	-146.2	172.4	-166.2	172.5	3.8	112.7
881	A	27.1	Very low	32.4	Very low	86 Å²	86	145 Å²	145	71%	0.711	77%	0.771	S	S	*	*			trans	-91	177	-178.5	0	0	0	0	0	114.7
882	S	30.2	Very low	32	Very low	109 Å²	109	144.1 Å²	144.1	76%	0.762	76%	0.763	S	S	*	*			trans	113.7	96.6	150.3	-58.8	0	0	0	0	118.8
883	S	30.1	Very low	31.5	Very low	96 Å²	96	145.9 Å²	145.9	67%	0.671	76%	0.76	S	S	*	*				65.4	147.5	121.3	69.9	0	0	0	0	122.7
884	Q	33.8	Very low	31.2	Very low	172 Å²	172	143.5 Å²	143.5	80%	0.804	75%	0.753	S	S	*	*			trans	69.6	150.8	153.8	-77.9	177.9	4.3	0	0	116.4
885	Q	31.1	Very low	30.9	Very low	137 Å²	137	141.4 Å²	141.4	64%	0.64	75%	0.75	S	S	*	*			cis	-164	155.6	-22.8	-134.8	-176.7	-14.9	0	0	107.6
886	Q	31.3	Very low	30.7	Very low	136 Å²	136	143.8 Å²	143.8	64%	0.636	75%	0.751	S	S	*	*			trans	65.1	162.9	157.2	-62.3	170.3	17.4	0	0	115.4
887	Q	29.9	Very low	30.5	Very low	165 Å²	165	145.6 Å²	145.6	77%	0.771	76%	0.755	S	S	*	*			cis	-150.4	163.2	-20.2	-118.1	162.4	18.9	0	0	110.2
888	Q	30.6	Very low	30.5	Very low	174 Å²	174	146.4 Å²	146.4	81%	0.813	76%	0.76	S	S	*	*			trans	-65.7	165.7	160.8	-84	179.9	-4.2	0	0	110.8
889	P	41.9	Very low	30.4	Very low	124 Å²	124	144.5 Å²	144.5	81%	0.805	76%	0.763	S	S	*	*			cis	-149.8	-173.7	41.4	42.4	-19.9	0	0	0	118.9
890	V	29.3	Very low	30.6	Very low	118 Å²	118	140.4 Å²	140.4	72%	0.715	76%	0.758	S	S	*	*			trans	-89.5	141.3	-177.9	-178.4	0	0	0	0	111.2
891	N	25.8	Very low	30.7	Very low	144 Å²	144	135.7 Å²	135.7	77%	0.77	75%	0.75	S	S	*	*				175.4	145.5	125.6	-104.5	-23.7	0	0	0	119.1
892	V	27.2	Very low	30.8	Very low	103 Å²	103	138.3 Å²	138.3	62%	0.624	76%	0.758	S	S	*	*			trans	80.8	106.2	132.5	164.6	0	0	0	0	123.1
893	Q	27.1	Very low	30.6	Very low	159 Å²	159	137.2 Å²	137.2	74%	0.743	76%	0.755	S	S	*	*				78.3	121.1	124.7	-65.7	179.1	-3.2	0	0	125.7
894	T	26.3	Very low	30.7	Very low	120 Å²	120	141.3 Å²	141.3	74%	0.736	76%	0.763	S	S	*	*				77.7	133	128.2	57.9	0	0	0	0	125.7
895	L	26.2	Very low	31.1	Very low	153 Å²	153	138.5 Å²	138.5	80%	0.801	76%	0.76	S	S	*	*			trans	69.7	99.9	142.4	-93.4	74.5	0	0	0	123.6
896	R	27.6	Very low	30.8	Very low	239 Å²	239	137.6 Å²	137.6	90%	0.902	76%	0.764	S	S	*	*				64.9	120.5	110.7	-153.4	178.5	-164.2	174.6	5.2	121.9
897	N	31	Very low	30.5	Very low	149 Å²	149	134.8 Å²	134.8	80%	0.797	76%	0.764	S	S	*	*			trans	-65.6	174	168	-60.9	2.2	0	0	0	114.7
898	P	47.3	Very low	30.4	Very low	121 Å²	121	133.8 Å²	133.8	79%	0.786	76%	0.759	S	S	*	*				-145.6	173.1	109.1	39.5	-26.5	0	0	0	117.1
899	A	27	Very low	30.2	Very low	94 Å²	94	136 Å²	136	78%	0.777	76%	0.76	S	S	*	*			trans	76	145.3	160.1	0	0	0	0	0	117.9
900	S	31.7	Very low	29.8	Very low	103 Å²	103	134.9 Å²	134.9	72%	0.72	75%	0.753	S	S	*	*			cis	-177.6	150.9	-6.3	-102.2	0	0	0	0	109.1
901	L	31.7	Very low	29.7	Very low	148 Å²	148	138 Å²	138	78%	0.775	76%	0.759	S	S	*	*			cis	-142.5	-150.3	-10.3	-51.2	94.1	0	0	0	108.5
902	T	30	Very low	30	Very low	141 Å²	141	137.5 Å²	137.5	87%	0.865	77%	0.767	S	S	*	*			trans	74.4	154	168.7	77.2	0	0	0	0	116.3
903	A	25.8	Very low	29.8	Very low	86 Å²	86	136.1 Å²	136.1	71%	0.711	77%	0.773	S	S	*	*			cis	-128.5	159.1	1.3	0	0	0	0	0	112.7
904	H	33	Very low	30.6	Very low	182 Å²	182	134.6 Å²	134.6	84%	0.843	78%	0.778	S	S	*	*			trans	-150.4	170.7	-169.2	-82.6	-19	0	0	0	112.8
905	P	41	Very low	31.1	Very low	112 Å²	112	134.6 Å²	134.6	73%	0.727	78%	0.779	S	S	*	*			cis	-93.1	-169	-3	39.2	-34.2	0	0	0	111.8
906	T	24.8	Very low	31.5	Very low	119 Å²	119	134.4 Å²	134.4	73%	0.73	77%	0.774	S	S	*	*			cis	-153.6	171.4	12	-17.4	0	0	0	0	106.4
907	A	26.3	Very low	31.4	Very low	77 Å²	77	133.7 Å²	133.7	64%	0.636	77%	0.772	S	S	*	*			cis	-156.5	170.3	7.7	0	0	0	0	0	113.7
908	H	26.8	Very low	31.3	Very low	144 Å²	144	133.4 Å²	133.4	67%	0.667	77%	0.765	S	S	*	*			trans	-3.8	137.2	145.7	-54.4	-40.5	0	0	0	119.9
909	W	25.5	Very low	30.7	Very low	221 Å²	221	133.2 Å²	133.2	84%	0.837	76%	0.764	S	S	*	*			cis	-160.9	155.5	-7.2	-94.3	119.3	0	0	0	109.5
910	P	34.8	Very low	31	Very low	100 Å²	100	134.2 Å²	134.2	65%	0.649	76%	0.763	S	S	*	*			trans	-106.6	147.4	162.6	36.2	-33.8	0	0	0	115.5
911	H	27.8	Very low	30.9	Very low	184 Å²	184	140.5 Å²	140.5	85%	0.852	77%	0.771	S	S	*	*			trans	50.2	136.8	157	-64.3	-65.8	0	0	0	124.4
912	S	30.4	Very low	31	Very low	132 Å²	132	145 Å²	145	92%	0.923	78%	0.777	S	S	*	*			trans	89.5	126.3	150	74	0	0	0	0	121.1
913	G	23.5	Very low	31.2	Very low	74 Å²	74	144 Å²	144	76%	0.763	78%	0.777	S	S	*	*			trans	146	123.6	169.1	0	0	0	0	0	115.6
914	P	44.7	Very low	31.9	Very low	128 Å²	128	146 Å²	146	83%	0.831	78%	0.782	S	S	*	*			trans	-87.8	173.8	166.1	37.3	-34.6	0	0	0	111.8
915	P	36.5	Very low	31.9	Very low	119 Å²	119	142.6 Å²	142.6	77%	0.773	78%	0.779	S	S	*	*			cis	-134	-150.3	20.8	44.6	-25.2	0	0	0	115.5
916	E	33.7	Very low	32.1	Very low	150 Å²	150	143.3 Å²	143.3	70%	0.701	78%	0.783	S	S	*	*			trans	-56.2	159.2	-170	-57.1	155.4	104.1	0	0	117.4
917	W	27.1	Very low	32.7	Very low	224 Å²	224	142.9 Å²	142.9	85%	0.848	79%	0.785	S	S	*	*				-173.4	168.2	107.8	-104.3	76.5	0	0	0	111.1
918	H	28	Very low	33.7	Very low	142 Å²	142	145.3 Å²	145.3	66%	0.657	80%	0.795	S	S	*	*			trans	-76.8	158.6	-153	-59.5	-61.3	0	0	0	119
919	P	35.1	Very low	34.5	Very low	118 Å²	118	142.9 Å²	142.9	77%	0.766	80%	0.799	S	S	*	*			trans	-96.3	163.6	-173.3	38.3	-37.9	0	0	0	116
920	P	33.7	Very low	35.9	Very low	115 Å²	115	137.4 Å²	137.4	75%	0.747	79%	0.792	S	S	*	*			trans	-137	122.5	153.4	34.7	-18.5	0	0	0	116.5
921	R	28.2	Very low	37.3	Very low	235 Å²	235	136.7 Å²	136.7	89%	0.887	79%	0.787	S	S	*	*			trans	64.9	104.6	145	-58.7	-176	-176.8	-86	-4.1	122.2
922	R	34.3	Very low	39.5	Very low	242 Å²	242	132.8 Å²	132.8	91%	0.913	78%	0.778	S	S	*	*				29.3	119.6	127.7	-54.2	-177.1	-170.3	-162.2	-0.1	120
923	S	34	Very low	41.8	Very low	121 Å²	121	132.3 Å²	132.3	85%	0.846	76%	0.762	S	S	*	*			trans	-163.1	152.4	134	-82.3	0	0	0	0	111
924	P	41.6	Very low	44.9	Very low	128 Å²	128	129.4 Å²	129.4	83%	0.831	73%	0.728	S	S	*	*	P	Polyproline II helix	trans	-96.7	157.6	-162.8	36.9	-36.5	0	0	0	116.1
925	S	31.5	Very low	47	Very low	110 Å²	110	125.7 Å²	125.7	77%	0.769	71%	0.705	S	S	*	*	P	Polyproline II helix	trans	-89.8	158.5	170	52.8	0	0	0	0	112.7
926	P	46.5	Very low	49.3	Very low	127 Å²	127	125.3 Å²	125.3	83%	0.825	70%	0.702	S	S	*	*	P	Polyproline II helix	trans	-85.2	148.9	-157.8	32.6	-37	0	0	0	116.3
927	S	37.2	Very low	51.9	Low	109 Å²	109	120.4 Å²	120.4	76%	0.762	69%	0.692	S	S	*	*	P	Polyproline II helix	trans	-68.8	152.5	170.2	-48.6	0	0	0	0	112.8
928	P	46.1	Very low	54.8	Low	129 Å²	129	113 Å²	113	84%	0.838	67%	0.667	S	S	*	*	P	Polyproline II helix	trans	-65.9	142.6	170.5	28.9	-34.9	0	0	0	111.5
929	A	44.1	Very low	57.8	Low	92 Å²	92	108 Å²	108	76%	0.76	65%	0.647	S	S	*	*	P	Polyproline II helix	trans	-72.1	147	179.6	0	0	0	0	0	112.2
930	P	56.3	Low	60.5	Low	106 Å²	106	106 Å²	106	69%	0.688	64%	0.635	S	S	*	*	P	Polyproline II helix	trans	-66.9	157.1	176.7	28.8	-35.4	0	0	0	112.3
931	P	63.8	Low	63.3	Low	85 Å²	85	104.7 Å²	104.7	55%	0.552	62%	0.619	S	S	*	*	P	Polyproline II helix	trans	-63.1	148.9	179.4	27.2	-35.6	0	0	0	111.9	Y966	P931-Y966 VanDerWaalsContact O-CD1 3.31Å; P931-Y966 WeakPolarHBondContact O-CD1 3.21Å
932	P	74.2	Confident	66.3	Low	102 Å²	102	94.3 Å²	94.3	66%	0.662	58%	0.581	S	S	*	*	P	Polyproline II helix	trans	-63.3	146	-177.8	25.7	-34.5	0	0	0	112.3	R968	P932-R968 PolarHBondContact O-NH1 3.18Å; P932-R968 PolarHBondContact O-NH2 3.13Å
933	Q	78.4	Confident	69.1	Low	123 Å²	123	86 Å²	86	58%	0.575	55%	0.552	S	S	*	*	P	Polyproline II helix	trans	-55	153.1	176.5	-166.1	173.6	-6.9	0	0	111.8	P965 Y966 R968	Q933-P965 HydrophobicContact CG-CB 4.02Å; Q933-Y966 HydrophobicContact CB-CD1 4.23Å; Q933-Y966 HydrophobicContact CB-CE1 3.9Å; Q933-Y966 HydrophobicContact CG-CE1 4.37Å; Q933-R968 PolarHBondContact O-NH2 3.01Å
934	R	88.8	Confident	72	Confident	12 Å²	12	87.3 Å²	87.3	5%	0.045	54%	0.538	C	S	.	.	P	Polyproline II helix	trans	-68	138	173.2	-66.3	175.6	-56.1	169.8	18.5	110.9	E938 L961 N964 P965 M967 R968	R934-E938 HydrophobicContact CB-CB 4.33Å; R934-L961 VanDerWaalsContact NH1-CD2 3.27Å; R934-L961 PolarHBondContact NH2-O 2.84Å; R934-N964 PolarHBondContact NH2-O 3.46Å; R934-P965 WeakPolarHBondContact CB-O 3.5Å; R934-P965 VanDerWaalsContact CG-O 3.3Å; R934-P965 WeakPolarHBondContact CG-O 3.34Å; R934-P965 PolarHBondContact N-O 3.48Å; R934-P965 PolarHBondContact NE-O 3.07Å; R934-M967 VanDerWaalsContact CD-O 3.26Å; R934-M967 WeakPolarHBondContact CD-O 3.45Å; R934-M967 PolarHBondContact NE-O 2.96Å; R934-M967 PolarHBondContact NH1-O 3.18Å; R934-R968 HydrophobicContact CG-CG 3.72Å
935	S	88.3	Confident	74.4	Confident	50 Å²	50	85.1 Å²	85.1	35%	0.35	52%	0.516	S	S	.	.	P	Polyproline II helix	trans	-66	160.1	170.2	64.4	0	0	0	0	111.7	G937 E938 T939	S935-G937 PolarHBondContact O-N 2.86Å; S935-E938 VanDerWaalsContact CB-OE2 3.26Å; S935-E938 WeakPolarHBondContact CB-OE2 3.41Å; S935-E938 PolarHBondContact N-OE2 2.76Å; S935-E938 PolarHBondContact O-N 2.98Å; S935-E938 WeakPolarHBondContact OG-CG 3.25Å; S935-E938 PolarHBondContact OG-N 2.87Å; S935-E938 PolarHBondContact OG-OE2 2.9Å; S935-T939 WeakPolarHBondContact O-CB 3.17Å; S935-T939 PolarHBondContact O-N 3.49Å; S935-T939 PolarHBondContact O-OG1 3.1Å
936	P	85.2	Confident	77.2	Confident	111 Å²	111	79.9 Å²	79.9	72%	0.721	48%	0.479	S	S	*	.	H	α-helix	trans	-58.9	-29.6	172.3	-25.2	35.5	0	0	0	113.2	S940	P936-S940 WeakPolarHBondContact O-CB 3.29Å; P936-S940 PolarHBondContact O-N 3.24Å; P936-S940 PolarHBondContact O-OG 3.23Å
937	G	87.4	Confident	79.4	Confident	48 Å²	48	76.3 Å²	76.3	50%	0.495	45%	0.449	S	S	.	.	H	α-helix	trans	-67.5	-55.8	176	0	0	0	0	0	112.5	S935 T939 S940 E941	S935-G937 PolarHBondContact O-N 2.86Å; G937-T939 VanDerWaalsContact C-N 3.25Å; G937-T939 PolarHBondContact O-N 2.99Å; G937-S940 PolarHBondContact O-N 2.77Å; G937-S940 VanDerWaalsContact O-N 3.12Å; G937-E941 PolarHBondContact O-N 2.85Å
938	E	88.8	Confident	81.9	Confident	67 Å²	67	76.6 Å²	76.6	31%	0.313	44%	0.443	S	S	.	.	H	α-helix	trans	-55.1	-42.8	174.8	-71.2	162.6	100.9	0	0	111.6	R934 S935 S940 E941 L942 R968	R934-E938 HydrophobicContact CB-CB 4.33Å; S935-E938 VanDerWaalsContact CB-OE2 3.26Å; S935-E938 WeakPolarHBondContact CB-OE2 3.41Å; S935-E938 PolarHBondContact N-OE2 2.76Å; S935-E938 PolarHBondContact O-N 2.98Å; S935-E938 WeakPolarHBondContact OG-CG 3.25Å; S935-E938 PolarHBondContact OG-N 2.87Å; S935-E938 PolarHBondContact OG-OE2 2.9Å; E938-S940 VanDerWaalsContact C-N 3.34Å; E938-S940 PolarHBondContact O-N 3.31Å; E938-E941 PolarHBondContact O-N 2.88Å; E938-L942 WeakPolarHBondContact O-CB 3.13Å; E938-L942 WeakPolarHBondContact O-CG 3.46Å; E938-L942 PolarHBondContact O-N 2.77Å; E938-R968 IonicContact OE1-CZ 3.26Å; E938-R968 VanDerWaalsContact OE1-CZ 3.26Å; E938-R968 IonicContact OE1-NE 2.71Å; E938-R968 PolarHBondContact OE1-NE 2.89Å; E938-R968 IonicContact OE1-NH2 2.95Å; E938-R968 PolarHBondContact OE1-NH2 3.19Å; E938-R968 IonicContact OE2-NH2 3.41Å; E938-R968 PolarHBondContact OE2-NH2 2.71Å
939	T	90.9	Very high	83.8	Confident	38 Å²	38	74.7 Å²	74.7	23%	0.233	42%	0.424	C	S	.	.	H	α-helix	trans	-64.8	-39.4	179.7	-53	0	0	0	0	111.3	S935 G937 K943 L961	S935-T939 WeakPolarHBondContact O-CB 3.17Å; S935-T939 PolarHBondContact O-N 3.49Å; S935-T939 PolarHBondContact O-OG1 3.1Å; G937-T939 VanDerWaalsContact C-N 3.25Å; G937-T939 PolarHBondContact O-N 2.99Å; T939-K943 WeakPolarHBondContact O-CB 3.48Å; T939-K943 PolarHBondContact O-N 3.05Å; T939-L961 HydrophobicContact CG2-CB 4.46Å
940	S	90.9	Very high	86.1	Confident	76 Å²	76	71.9 Å²	71.9	53%	0.531	40%	0.395	S	S	.	.	H	α-helix	trans	-69.3	-34.6	175.8	-58.9	0	0	0	0	112.8	P936 G937 E938 R944	P936-S940 WeakPolarHBondContact O-CB 3.29Å; P936-S940 PolarHBondContact O-N 3.24Å; P936-S940 PolarHBondContact O-OG 3.23Å; G937-S940 PolarHBondContact O-N 2.77Å; G937-S940 VanDerWaalsContact O-N 3.12Å; E938-S940 VanDerWaalsContact C-N 3.34Å; E938-S940 PolarHBondContact O-N 3.31Å; S940-R944 PolarHBondContact O-N 2.9Å
941	E	92.3	Very high	87.4	Confident	87 Å²	87	69.7 Å²	69.7	41%	0.407	38%	0.381	S	S	.	.	H	α-helix	trans	-71.9	-43.8	176.9	-163.4	-170.2	152.3	0	0	111.9	G937 E938 K943 R944 K945	G937-E941 PolarHBondContact O-N 2.85Å; E938-E941 PolarHBondContact O-N 2.88Å; E941-K943 VanDerWaalsContact C-N 3.34Å; E941-R944 PolarHBondContact O-N 2.91Å; E941-K945 WeakPolarHBondContact O-CG 3.44Å; E941-K945 PolarHBondContact O-N 3.33Å; E941-K945 WeakPolarHBondContact OE1-CE 3.44Å; E941-K945 IonicContact OE1-NZ 3.49Å; E941-K945 PolarHBondContact OE1-NZ 3.45Å
942	L	93	Very high	88.6	Confident	17 Å²	17	73.2 Å²	73.2	9%	0.089	40%	0.395	C	S	.	.	H	α-helix	trans	-62.5	-41.5	172.9	-75	166.7	0	0	0	111.3	E938 R944 K945 L946 L961 L970 L973	E938-L942 WeakPolarHBondContact O-CB 3.13Å; E938-L942 WeakPolarHBondContact O-CG 3.46Å; E938-L942 PolarHBondContact O-N 2.77Å; L942-R944 PolarHBondContact O-N 3.36Å; L942-K945 PolarHBondContact O-N 2.94Å; L942-L946 WeakPolarHBondContact O-CB 3.36Å; L942-L946 WeakPolarHBondContact O-CG 3.47Å; L942-L946 PolarHBondContact O-N 3.35Å; L942-L961 HydrophobicContact CB-CD2 4.24Å; L942-L970 HydrophobicContact CD2-CB 4.27Å; L942-L970 HydrophobicContact CD2-CD1 4.46Å; L942-L973 HydrophobicContact CD1-CD1 4.28Å; L942-L973 HydrophobicContact CD2-CD1 4.35Å
943	K	92.8	Very high	89.1	Confident	67 Å²	67	71.5 Å²	71.5	29%	0.291	38%	0.378	S	S	.	.	H	α-helix	trans	-55.6	-47.8	172.1	179	173.2	178.4	150.1	0	112.1	T939 E941 L946 Y947 D958 L961	T939-K943 WeakPolarHBondContact O-CB 3.48Å; T939-K943 PolarHBondContact O-N 3.05Å; E941-K943 VanDerWaalsContact C-N 3.34Å; K943-L946 PolarHBondContact O-N 3.19Å; K943-Y947 VanDerWaalsContact CE-CZ 3.44Å; K943-Y947 VanDerWaalsContact CE-OH 3.22Å; K943-Y947 WeakPolarHBondContact CE-OH 3.34Å; K943-Y947 HydrophobicContact CG-CD1 4.1Å; K943-Y947 HydrophobicContact CG-CE1 3.81Å; K943-Y947 HydrophobicContact CG-CE2 4.43Å; K943-Y947 WeakPolarHBondContact O-CB 3.4Å; K943-Y947 WeakPolarHBondContact O-CD1 3.44Å; K943-Y947 PolarHBondContact O-N 2.95Å; K943-D958 VanDerWaalsContact CD-OD1 3.28Å; K943-D958 WeakPolarHBondContact CD-OD1 3.33Å; K943-D958 WeakPolarHBondContact CE-OD1 3.32Å; K943-D958 IonicContact NZ-OD1 3.22Å; K943-D958 PolarHBondContact NZ-OD1 3.46Å; K943-D958 IonicContact NZ-OD2 3.97Å; K943-D958 PolarHBondContact NZ-OD2 3.02Å; K943-L961 HydrophobicContact CB-CD1 3.63Å; K943-L961 HydrophobicContact CG-CD1 4.29Å
944	R	93.6	Very high	89.6	Confident	149 Å²	149	69.9 Å²	69.9	56%	0.562	37%	0.369	S	S	*	.	H	α-helix	trans	-60	-54	176	-177	-179.7	63.1	-164.5	-4.6	111.3	S940 E941 L942 L946 Y947 D948	S940-R944 PolarHBondContact O-N 2.9Å; E941-R944 PolarHBondContact O-N 2.91Å; L942-R944 PolarHBondContact O-N 3.36Å; R944-L946 VanDerWaalsContact C-N 3.28Å; R944-L946 PolarHBondContact O-N 3.31Å; R944-Y947 CarbonylContact O-C 3.53Å; R944-Y947 WeakPolarHBondContact O-CA 3.49Å; R944-Y947 WeakPolarHBondContact O-CB 3.43Å; R944-Y947 PolarHBondContact O-N 3.48Å; R944-D948 PolarHBondContact O-N 2.96Å; R944-D948 VanDerWaalsContact O-OD2 3.14Å
945	K	92.1	Very high	89.4	Confident	83 Å²	83	76.6 Å²	76.6	36%	0.361	40%	0.401	S	S	.	.	H	α-helix	trans	-59.1	-37.7	-178.2	-66.6	173.5	-177.3	169.1	0	112.6	E941 L942 D948 I949 L970	E941-K945 WeakPolarHBondContact O-CG 3.44Å; E941-K945 PolarHBondContact O-N 3.33Å; E941-K945 WeakPolarHBondContact OE1-CE 3.44Å; E941-K945 IonicContact OE1-NZ 3.49Å; E941-K945 PolarHBondContact OE1-NZ 3.45Å; L942-K945 PolarHBondContact O-N 2.94Å; K945-D948 PolarHBondContact O-N 3.23Å; K945-I949 WeakPolarHBondContact O-CD1 3.27Å; K945-I949 VanDerWaalsContact O-CG1 3.31Å; K945-I949 WeakPolarHBondContact O-CG1 3.43Å; K945-I949 PolarHBondContact O-N 3.46Å; K945-L970 HydrophobicContact CB-CD1 3.41Å; K945-L970 VanDerWaalsContact CB-CD1 3.41Å; K945-L970 HydrophobicContact CD-CD1 4.04Å; K945-L970 HydrophobicContact CG-CD1 4.35Å
946	L	90.8	Very high	89.4	Confident	0 Å²	0	79 Å²	79	0%	0	40%	0.402	C	S	.	.	H	α-helix	trans	-72.6	-33.6	174.3	-69.3	170.6	0	0	0	112.5	L942 K943 R944 D948 I949 F950 I957 L961 L970 L973 S974 L977	L942-L946 WeakPolarHBondContact O-CB 3.36Å; L942-L946 WeakPolarHBondContact O-CG 3.47Å; L942-L946 PolarHBondContact O-N 3.35Å; K943-L946 PolarHBondContact O-N 3.19Å; R944-L946 VanDerWaalsContact C-N 3.28Å; R944-L946 PolarHBondContact O-N 3.31Å; L946-D948 VanDerWaalsContact C-N 3.31Å; L946-I949 PolarHBondContact O-N 3.41Å; L946-F950 HydrophobicContact CD2-CD2 4.42Å; L946-F950 HydrophobicContact CD2-CE2 4.39Å; L946-F950 PolarHBondContact O-N 3.42Å; L946-I957 HydrophobicContact CB-CD1 4.28Å; L946-I957 HydrophobicContact CB-CG1 4.42Å; L946-I957 HydrophobicContact CB-CG2 3.66Å; L946-I957 HydrophobicContact CD1-CG2 3.99Å; L946-I957 HydrophobicContact CG-CG2 4.49Å; L946-L961 HydrophobicContact CD1-CD1 4.34Å; L946-L961 HydrophobicContact CD1-CD2 4.11Å; L946-L961 HydrophobicContact CD1-CG 4.34Å; L946-L970 HydrophobicContact CD2-CD1 4.31Å; L946-L970 HydrophobicContact CD2-CG 3.97Å; L946-L970 HydrophobicContact CG-CD1 4.39Å; L946-L970 HydrophobicContact CG-CG 4.48Å; L946-L973 HydrophobicContact CD1-CB 3.98Å; L946-L973 HydrophobicContact CD1-CD1 4.31Å; L946-S974 WeakPolarHBondContact CD2-OG 3.32Å; L946-L977 HydrophobicContact CD1-CD1 4.39Å; L946-L977 HydrophobicContact CD2-CD1 3.94Å
947	Y	92.8	Very high	89.7	Confident	51 Å²	51	73.7 Å²	73.7	20%	0.2	37%	0.368	C	S	.	.	H	α-helix	trans	-66.6	-31.7	172.6	-83.2	25.4	0	0	0	112.5	K943 R944 I949 P951 K954 I957 D958	K943-Y947 VanDerWaalsContact CE-CZ 3.44Å; K943-Y947 VanDerWaalsContact CE-OH 3.22Å; K943-Y947 WeakPolarHBondContact CE-OH 3.34Å; K943-Y947 HydrophobicContact CG-CD1 4.1Å; K943-Y947 HydrophobicContact CG-CE1 3.81Å; K943-Y947 HydrophobicContact CG-CE2 4.43Å; K943-Y947 WeakPolarHBondContact O-CB 3.4Å; K943-Y947 WeakPolarHBondContact O-CD1 3.44Å; K943-Y947 PolarHBondContact O-N 2.95Å; R944-Y947 CarbonylContact O-C 3.53Å; R944-Y947 WeakPolarHBondContact O-CA 3.49Å; R944-Y947 WeakPolarHBondContact O-CB 3.43Å; R944-Y947 PolarHBondContact O-N 3.48Å; Y947-I949 VanDerWaalsContact C-N 3.34Å; Y947-P951 VanDerWaalsContact O-CA 3.29Å; Y947-P951 WeakPolarHBondContact O-CA 3.44Å; Y947-K954 HydrophobicContact CD1-CG 4.01Å; Y947-K954 HydrophobicContact CD2-CD 3.89Å; Y947-K954 HydrophobicContact CD2-CG 3.93Å; Y947-K954 HydrophobicContact CE1-CB 3.87Å; Y947-K954 HydrophobicContact CE1-CG 3.84Å; Y947-K954 HydrophobicContact CE2-CB 4.13Å; Y947-K954 HydrophobicContact CE2-CD 3.71Å; Y947-K954 HydrophobicContact CE2-CG 3.75Å; Y947-K954 HydrophobicContact CG-CD 4.43Å; Y947-K954 HydrophobicContact CG-CG 4.03Å; Y947-K954 PolarHBondContact OH-O 3.31Å; Y947-I957 HydrophobicContact CD1-CB 4.23Å; Y947-I957 HydrophobicContact CD1-CD1 3.57Å; Y947-I957 HydrophobicContact CD1-CG2 3.91Å; Y947-I957 HydrophobicContact CE1-CB 3.94Å; Y947-I957 HydrophobicContact CE1-CD1 3.99Å; Y947-I957 HydrophobicContact CE1-CG2 3.84Å; Y947-D958 PolarHBondContact OH-OD2 3.12Å
948	D	89.3	Confident	89.8	Confident	116 Å²	116	74.3 Å²	74.3	62%	0.62	36%	0.36	S	S	*	.	H	α-helix	trans	-71.3	-30.3	176.4	-58.7	-34.6	0	0	0	111.6	R944 K945 L946	R944-D948 PolarHBondContact O-N 2.96Å; R944-D948 VanDerWaalsContact O-OD2 3.14Å; K945-D948 PolarHBondContact O-N 3.23Å; L946-D948 VanDerWaalsContact C-N 3.31Å
949	I	87.1	Confident	89.8	Confident	89 Å²	89	78.8 Å²	78.8	46%	0.456	37%	0.374	S	S	.	.	H	α-helix	trans	-89.4	-39.8	179.8	-61.5	163.4	0	0	0	112	K945 L946 Y947 P951 L970	K945-I949 WeakPolarHBondContact O-CD1 3.27Å; K945-I949 VanDerWaalsContact O-CG1 3.31Å; K945-I949 WeakPolarHBondContact O-CG1 3.43Å; K945-I949 PolarHBondContact O-N 3.46Å; L946-I949 PolarHBondContact O-N 3.41Å; Y947-I949 VanDerWaalsContact C-N 3.34Å; I949-P951 VanDerWaalsContact C-CD 3.44Å; I949-P951 WeakPolarHBondContact O-CD 3.48Å; I949-L970 HydrophobicContact CD1-CD1 4.42Å; I949-L970 HydrophobicContact CD1-CD2 3.78Å
950	F	91	Very high	89.8	Confident	33 Å²	33	77.8 Å²	77.8	15%	0.145	37%	0.367	C	S	.	.			trans	-123.9	64.3	-175.4	-57.4	-73.8	0	0	0	111.4	L946 D952 Q953 I957 L977 L978	L946-F950 HydrophobicContact CD2-CD2 4.42Å; L946-F950 HydrophobicContact CD2-CE2 4.39Å; L946-F950 PolarHBondContact O-N 3.42Å; F950-D952 PolarHBondContact O-N 2.87Å; F950-Q953 HydrophobicContact CB-CB 4.2Å; F950-Q953 HydrophobicContact CB-CG 4.48Å; F950-Q953 PolarHBondContact O-N 2.97Å; F950-I957 HydrophobicContact CB-CD1 3.96Å; F950-I957 WeakPolarHBondContact O-CD1 3.05Å; F950-L977 HydrophobicContact CD2-CD1 3.74Å; F950-L977 HydrophobicContact CE2-CB 4.37Å; F950-L977 HydrophobicContact CE2-CD1 3.96Å; F950-L978 HydrophobicContact CE1-CD2 3.96Å; F950-L978 HydrophobicContact CE1-CG 4.26Å; F950-L978 HydrophobicContact CZ-CD1 4.31Å; F950-L978 HydrophobicContact CZ-CD2 4.39Å; F950-L978 HydrophobicContact CZ-CG 4.21Å
951	P	84.6	Confident	89.8	Confident	60 Å²	60	74.5 Å²	74.5	39%	0.39	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61	-24	-169.7	24.4	-35.6	0	0	0	114.5	Y947 I949 K954	Y947-P951 VanDerWaalsContact O-CA 3.29Å; Y947-P951 WeakPolarHBondContact O-CA 3.44Å; I949-P951 VanDerWaalsContact C-CD 3.44Å; I949-P951 WeakPolarHBondContact O-CD 3.48Å; P951-K954 WeakPolarHBondContact O-CE 3.3Å; P951-K954 WeakPolarHBondContact O-CG 3.4Å; P951-K954 PolarHBondContact O-NZ 3.02Å
952	D	87.6	Confident	89.6	Confident	158 Å²	158	73.9 Å²	73.9	85%	0.845	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.8	-18.5	-179.6	-55.2	-52.2	0	0	0	113.1	F950 K954	F950-D952 PolarHBondContact O-N 2.87Å; D952-K954 PolarHBondContact O-N 2.81Å
953	Q	85.8	Confident	89.3	Confident	66 Å²	66	78.3 Å²	78.3	31%	0.308	37%	0.373	S	S	.	.			trans	-96.3	19.9	-172.9	-59.4	-159.7	17.9	0	0	114.4	F950 Q955 R956 I957 L977	F950-Q953 HydrophobicContact CB-CB 4.2Å; F950-Q953 HydrophobicContact CB-CG 4.48Å; F950-Q953 PolarHBondContact O-N 2.97Å; Q953-Q955 VanDerWaalsContact C-N 3.27Å; Q953-Q955 PolarHBondContact O-N 2.71Å; Q953-R956 HydrophobicContact CB-CB 4.3Å; Q953-R956 WeakPolarHBondContact O-CA 3.47Å; Q953-R956 WeakPolarHBondContact O-CB 3.13Å; Q953-R956 PolarHBondContact O-N 3.37Å; Q953-I957 HydrophobicContact CB-CD1 4.43Å; Q953-I957 HydrophobicContact CB-CG1 4.43Å; Q953-I957 WeakPolarHBondContact O-CG1 3.46Å; Q953-I957 PolarHBondContact O-N 3.27Å; Q953-L977 HydrophobicContact CB-CD2 4.43Å; Q953-L977 PolarHBondContact OE1-O 3Å
954	K	88.1	Confident	89.1	Confident	89 Å²	89	77.3 Å²	77.3	39%	0.387	37%	0.37	S	S	.	.	H	α-helix	trans	-46.5	-42.3	-172.7	-68.9	-178	173.3	102.9	0	114.8	Y947 P951 D952 D958	Y947-K954 HydrophobicContact CD1-CG 4.01Å; Y947-K954 HydrophobicContact CD2-CD 3.89Å; Y947-K954 HydrophobicContact CD2-CG 3.93Å; Y947-K954 HydrophobicContact CE1-CB 3.87Å; Y947-K954 HydrophobicContact CE1-CG 3.84Å; Y947-K954 HydrophobicContact CE2-CB 4.13Å; Y947-K954 HydrophobicContact CE2-CD 3.71Å; Y947-K954 HydrophobicContact CE2-CG 3.75Å; Y947-K954 HydrophobicContact CG-CD 4.43Å; Y947-K954 HydrophobicContact CG-CG 4.03Å; Y947-K954 PolarHBondContact OH-O 3.31Å; P951-K954 WeakPolarHBondContact O-CE 3.3Å; P951-K954 WeakPolarHBondContact O-CG 3.4Å; P951-K954 PolarHBondContact O-NZ 3.02Å; D952-K954 PolarHBondContact O-N 2.81Å; K954-D958 PolarHBondContact O-N 3.35Å; K954-D958 VanDerWaalsContact O-N 3.11Å
955	Q	86.1	Confident	88.7	Confident	153 Å²	153	71.7 Å²	71.7	72%	0.715	35%	0.353	S	S	*	.	H	α-helix	trans	-71.2	-28.8	177	-63.3	-172.7	6.9	0	0	114.3	Q953 R959	Q953-Q955 VanDerWaalsContact C-N 3.27Å; Q953-Q955 PolarHBondContact O-N 2.71Å; Q955-R959 WeakPolarHBondContact O-CG 3.28Å; Q955-R959 PolarHBondContact O-N 3.11Å
956	R	87.8	Confident	88.4	Confident	100 Å²	100	73.5 Å²	73.5	38%	0.377	36%	0.359	S	S	.	.	H	α-helix	trans	-74.8	-41.6	175.6	-161.6	-177.3	-174.8	-179.3	8.2	110.3	Q953 D958 R959 I960 L977 G979	Q953-R956 HydrophobicContact CB-CB 4.3Å; Q953-R956 WeakPolarHBondContact O-CA 3.47Å; Q953-R956 WeakPolarHBondContact O-CB 3.13Å; Q953-R956 PolarHBondContact O-N 3.37Å; R956-D958 PolarHBondContact O-N 3.01Å; R956-R959 PolarHBondContact O-N 3.22Å; R956-I960 HydrophobicContact CG-CD1 3.89Å; R956-I960 WeakPolarHBondContact O-CG1 3.4Å; R956-I960 PolarHBondContact O-N 2.62Å; R956-L977 HydrophobicContact CB-CD2 3.94Å; R956-L977 HydrophobicContact CG-CD2 3.94Å; R956-L977 PolarHBondContact NH1-O 3.18Å; R956-G979 PolarHBondContact NH1-O 2.59Å; R956-G979 VanDerWaalsContact NH2-C 3.31Å; R956-G979 PolarHBondContact NH2-O 3.32Å; R956-G979 PolarHBondContact NH2-OXT 2.92Å
957	I	91.8	Very high	88.2	Confident	1 Å²	1	76.3 Å²	76.3	1%	0.005	37%	0.373	C	S	.	.	H	α-helix	trans	-58.8	-46.6	175.6	-60.1	164.8	0	0	0	110.7	L946 Y947 F950 Q953 R959 I960 L961 L977	L946-I957 HydrophobicContact CB-CD1 4.28Å; L946-I957 HydrophobicContact CB-CG1 4.42Å; L946-I957 HydrophobicContact CB-CG2 3.66Å; L946-I957 HydrophobicContact CD1-CG2 3.99Å; L946-I957 HydrophobicContact CG-CG2 4.49Å; Y947-I957 HydrophobicContact CD1-CB 4.23Å; Y947-I957 HydrophobicContact CD1-CD1 3.57Å; Y947-I957 HydrophobicContact CD1-CG2 3.91Å; Y947-I957 HydrophobicContact CE1-CB 3.94Å; Y947-I957 HydrophobicContact CE1-CD1 3.99Å; Y947-I957 HydrophobicContact CE1-CG2 3.84Å; F950-I957 HydrophobicContact CB-CD1 3.96Å; F950-I957 WeakPolarHBondContact O-CD1 3.05Å; Q953-I957 HydrophobicContact CB-CD1 4.43Å; Q953-I957 HydrophobicContact CB-CG1 4.43Å; Q953-I957 WeakPolarHBondContact O-CG1 3.46Å; Q953-I957 PolarHBondContact O-N 3.27Å; I957-R959 VanDerWaalsContact C-N 3.33Å; I957-R959 PolarHBondContact O-N 2.72Å; I957-I960 PolarHBondContact O-N 2.89Å; I957-L961 HydrophobicContact CG2-CD1 3.84Å; I957-L961 HydrophobicContact CG2-CG 4.38Å; I957-L961 WeakPolarHBondContact O-CB 3.35Å; I957-L961 VanDerWaalsContact O-CG 3.31Å; I957-L961 WeakPolarHBondContact O-CG 3.41Å; I957-L961 PolarHBondContact O-N 3.02Å; I957-L977 HydrophobicContact CB-CD2 4.31Å; I957-L977 HydrophobicContact CG1-CD1 3.75Å; I957-L977 HydrophobicContact CG1-CD2 3.5Å; I957-L977 VanDerWaalsContact CG1-CD2 3.5Å; I957-L977 HydrophobicContact CG1-CG 4.29Å
958	D	89.2	Confident	88.1	Confident	61 Å²	61	78.4 Å²	78.4	33%	0.326	38%	0.38	S	S	.	.	H	α-helix	trans	-62.4	-37.3	179.8	-89.8	-10.9	0	0	0	113.3	K943 Y947 K954 R956 S962	K943-D958 VanDerWaalsContact CD-OD1 3.28Å; K943-D958 WeakPolarHBondContact CD-OD1 3.33Å; K943-D958 WeakPolarHBondContact CE-OD1 3.32Å; K943-D958 IonicContact NZ-OD1 3.22Å; K943-D958 PolarHBondContact NZ-OD1 3.46Å; K943-D958 IonicContact NZ-OD2 3.97Å; K943-D958 PolarHBondContact NZ-OD2 3.02Å; Y947-D958 PolarHBondContact OH-OD2 3.12Å; K954-D958 PolarHBondContact O-N 3.35Å; K954-D958 VanDerWaalsContact O-N 3.11Å; R956-D958 PolarHBondContact O-N 3.01Å; D958-S962 PolarHBondContact O-N 3.36Å; D958-S962 PolarHBondContact O-OG 2.88Å
959	R	89.4	Confident	88	Confident	161 Å²	161	76.6 Å²	76.6	61%	0.608	37%	0.37	S	S	*	.	H	α-helix	trans	-68.7	-49.7	173.4	-66.6	176.1	-169.7	-178.3	4.1	111.6	Q955 R956 I957 L961 S962 D963	Q955-R959 WeakPolarHBondContact O-CG 3.28Å; Q955-R959 PolarHBondContact O-N 3.11Å; R956-R959 PolarHBondContact O-N 3.22Å; I957-R959 VanDerWaalsContact C-N 3.33Å; I957-R959 PolarHBondContact O-N 2.72Å; R959-L961 PolarHBondContact O-N 2.84Å; R959-L961 VanDerWaalsContact O-N 3.13Å; R959-S962 WeakPolarHBondContact CA-OG 3.43Å; R959-S962 PolarHBondContact O-N 2.85Å; R959-S962 PolarHBondContact O-OG 2.93Å; R959-D963 VanDerWaalsContact O-CB 3.31Å; R959-D963 WeakPolarHBondContact O-CB 3.35Å; R959-D963 PolarHBondContact O-N 3.41Å; R959-D963 VanDerWaalsContact O-OD1 3.14Å
960	I	90.6	Very high	88	Confident	17 Å²	17	74.1 Å²	74.1	9%	0.087	36%	0.358	C	S	.	.	H	α-helix	trans	-59.8	-32.3	179.8	-72.2	164.2	0	0	0	111.4	R956 I957 N964 L973 L976 L977	R956-I960 HydrophobicContact CG-CD1 3.89Å; R956-I960 WeakPolarHBondContact O-CG1 3.4Å; R956-I960 PolarHBondContact O-N 2.62Å; I957-I960 PolarHBondContact O-N 2.89Å; I960-N964 WeakPolarHBondContact O-CB 3.44Å; I960-N964 PolarHBondContact O-N 2.91Å; I960-N964 VanDerWaalsContact O-N 3.15Å; I960-N964 PolarHBondContact O-ND2 3.14Å; I960-L973 HydrophobicContact CG2-CD2 3.87Å; I960-L976 HydrophobicContact CD1-CB 4.07Å; I960-L976 WeakPolarHBondContact CD1-O 3.35Å; I960-L976 HydrophobicContact CG1-CB 4.37Å; I960-L976 HydrophobicContact CG2-CB 3.86Å; I960-L976 HydrophobicContact CG2-CD1 4Å; I960-L977 HydrophobicContact CD1-CB 4.41Å; I960-L977 HydrophobicContact CD1-CD2 3.63Å; I960-L977 HydrophobicContact CD1-CG 3.66Å
961	L	90.3	Very high	87.7	Confident	6 Å²	6	78.2 Å²	78.2	3%	0.031	38%	0.381	C	S	.	.	H	α-helix	trans	-76.2	-32.3	172.7	-69.2	174.7	0	0	0	114.4	R934 T939 L942 K943 L946 I957 R959 L973	R934-L961 VanDerWaalsContact NH1-CD2 3.27Å; R934-L961 PolarHBondContact NH2-O 2.84Å; T939-L961 HydrophobicContact CG2-CB 4.46Å; L942-L961 HydrophobicContact CB-CD2 4.24Å; K943-L961 HydrophobicContact CB-CD1 3.63Å; K943-L961 HydrophobicContact CG-CD1 4.29Å; L946-L961 HydrophobicContact CD1-CD1 4.34Å; L946-L961 HydrophobicContact CD1-CD2 4.11Å; L946-L961 HydrophobicContact CD1-CG 4.34Å; I957-L961 HydrophobicContact CG2-CD1 3.84Å; I957-L961 HydrophobicContact CG2-CG 4.38Å; I957-L961 WeakPolarHBondContact O-CB 3.35Å; I957-L961 VanDerWaalsContact O-CG 3.31Å; I957-L961 WeakPolarHBondContact O-CG 3.41Å; I957-L961 PolarHBondContact O-N 3.02Å; R959-L961 PolarHBondContact O-N 2.84Å; R959-L961 VanDerWaalsContact O-N 3.13Å; L961-L973 HydrophobicContact CD2-CD1 3.87Å; L961-L973 HydrophobicContact CD2-CD2 4.11Å
962	S	87.3	Confident	87.8	Confident	74 Å²	74	77.3 Å²	77.3	52%	0.517	38%	0.379	S	S	.	.	H	α-helix	trans	-69.5	-40.2	170.7	56	0	0	0	0	112	D958 R959 P965	D958-S962 PolarHBondContact O-N 3.36Å; D958-S962 PolarHBondContact O-OG 2.88Å; R959-S962 WeakPolarHBondContact CA-OG 3.43Å; R959-S962 PolarHBondContact O-N 2.85Å; R959-S962 PolarHBondContact O-OG 2.93Å; S962-P965 WeakPolarHBondContact O-CD 3.38Å
963	D	87.7	Confident	87.8	Confident	111 Å²	111	69.8 Å²	69.8	59%	0.594	34%	0.339	S	S	*	.	H	α-helix	trans	-82.9	-21	-167.8	-55.2	-7.3	0	0	0	111.6	R959 P965	R959-D963 VanDerWaalsContact O-CB 3.31Å; R959-D963 WeakPolarHBondContact O-CB 3.35Å; R959-D963 PolarHBondContact O-N 3.41Å; R959-D963 VanDerWaalsContact O-OD1 3.14Å; D963-P965 VanDerWaalsContact O-CD 3.24Å; D963-P965 WeakPolarHBondContact O-CD 3.36Å
964	N	89.2	Confident	87.8	Confident	45 Å²	45	67.3 Å²	67.3	24%	0.241	33%	0.329	C	S	.	.			trans	-116.8	60.3	176.3	-60.5	-89.9	0	0	0	112	R934 I960 Y966 M967 L973	R934-N964 PolarHBondContact NH2-O 3.46Å; I960-N964 WeakPolarHBondContact O-CB 3.44Å; I960-N964 PolarHBondContact O-N 2.91Å; I960-N964 VanDerWaalsContact O-N 3.15Å; I960-N964 PolarHBondContact O-ND2 3.14Å; N964-Y966 PolarHBondContact O-N 3.37Å; N964-M967 HydrophobicContact CB-CB 3.86Å; N964-M967 HydrophobicContact CB-CE 4.17Å; N964-M967 HydrophobicContact CB-SD 4.31Å; N964-M967 PolarHBondContact O-N 2.78Å; N964-M967 VanDerWaalsContact O-N 3.1Å; N964-M967 WeakPolarHBondContact OD1-CE 3.28Å; N964-L973 HydrophobicContact CB-CD2 4.27Å
965	P	84.6	Confident	87.7	Confident	31 Å²	31	65.1 Å²	65.1	20%	0.201	33%	0.331	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.8	-12.1	-165.7	30.3	-37.4	0	0	0	114.6	Q933 R934 S962 D963	Q933-P965 HydrophobicContact CG-CB 4.02Å; R934-P965 WeakPolarHBondContact CB-O 3.5Å; R934-P965 VanDerWaalsContact CG-O 3.3Å; R934-P965 WeakPolarHBondContact CG-O 3.34Å; R934-P965 PolarHBondContact N-O 3.48Å; R934-P965 PolarHBondContact NE-O 3.07Å; S962-P965 WeakPolarHBondContact O-CD 3.38Å; D963-P965 VanDerWaalsContact O-CD 3.24Å; D963-P965 WeakPolarHBondContact O-CD 3.36Å
966	Y	86.3	Confident	87.6	Confident	121 Å²	121	61.2 Å²	61.2	48%	0.475	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.5	-19.5	176.1	-54.2	-80.5	0	0	0	113.7	P931 Q933 N964 R968	P931-Y966 VanDerWaalsContact O-CD1 3.31Å; P931-Y966 WeakPolarHBondContact O-CD1 3.21Å; Q933-Y966 HydrophobicContact CB-CD1 4.23Å; Q933-Y966 HydrophobicContact CB-CE1 3.9Å; Q933-Y966 HydrophobicContact CG-CE1 4.37Å; N964-Y966 PolarHBondContact O-N 3.37Å; Y966-R968 PolarHBondContact O-N 3.21Å
967	M	85.7	Confident	87.4	Confident	60 Å²	60	56.5 Å²	56.5	30%	0.296	30%	0.297	S	S	.	.			trans	-78.3	114.9	-167.3	-173	-178.6	-67.1	0	0	111.5	R934 N964 A972 L973 L976	R934-M967 VanDerWaalsContact CD-O 3.26Å; R934-M967 WeakPolarHBondContact CD-O 3.45Å; R934-M967 PolarHBondContact NE-O 2.96Å; R934-M967 PolarHBondContact NH1-O 3.18Å; N964-M967 HydrophobicContact CB-CB 3.86Å; N964-M967 HydrophobicContact CB-CE 4.17Å; N964-M967 HydrophobicContact CB-SD 4.31Å; N964-M967 PolarHBondContact O-N 2.78Å; N964-M967 VanDerWaalsContact O-N 3.1Å; N964-M967 WeakPolarHBondContact OD1-CE 3.28Å; M967-A972 HydrophobicContact CG-CB 4.37Å; M967-A972 HydrophobicContact SD-CB 3.78Å; M967-L973 HydrophobicContact CB-CD2 4.26Å; M967-L973 HydrophobicContact CG-CD2 4.11Å; M967-L973 HydrophobicContact CG-CG 4.07Å; M967-L973 HydrophobicContact SD-CD2 3.67Å; M967-L973 HydrophobicContact SD-CG 3.85Å; M967-L976 HydrophobicContact CE-CD1 4Å; M967-L976 HydrophobicContact SD-CD1 3.95Å
968	R	89.9	Confident	86.7	Confident	94 Å²	94	62.4 Å²	62.4	36%	0.355	33%	0.328	S	S	.	.			trans	-102.9	-17.1	-175.2	-73.3	172.5	168	89.5	-4.5	114.9	P932 Q933 R934 E938 Y966 L970	P932-R968 PolarHBondContact O-NH1 3.18Å; P932-R968 PolarHBondContact O-NH2 3.13Å; Q933-R968 PolarHBondContact O-NH2 3.01Å; R934-R968 HydrophobicContact CG-CG 3.72Å; E938-R968 IonicContact OE1-CZ 3.26Å; E938-R968 VanDerWaalsContact OE1-CZ 3.26Å; E938-R968 IonicContact OE1-NE 2.71Å; E938-R968 PolarHBondContact OE1-NE 2.89Å; E938-R968 IonicContact OE1-NH2 2.95Å; E938-R968 PolarHBondContact OE1-NH2 3.19Å; E938-R968 IonicContact OE2-NH2 3.41Å; E938-R968 PolarHBondContact OE2-NH2 2.71Å; Y966-R968 PolarHBondContact O-N 3.21Å; R968-L970 PolarHBondContact O-N 3.42Å
969	D	87.9	Confident	85.4	Confident	78 Å²	78	64.2 Å²	64.2	42%	0.417	36%	0.361	S	S	.	.			trans	-73.5	124	176.5	175	32.8	0	0	0	111	N971 A972 L973	D969-N971 VanDerWaalsContact C-N 3.31Å; D969-N971 PolarHBondContact OD1-N 2.83Å; D969-N971 PolarHBondContact OD1-ND2 3.28Å; D969-N971 WeakPolarHBondContact OD2-CB 3.43Å; D969-A972 HydrophobicContact CB-CB 4.12Å; D969-A972 WeakPolarHBondContact OD2-CB 3.31Å; D969-A972 PolarHBondContact OD2-N 2.86Å; D969-L973 WeakPolarHBondContact O-CD1 3.37Å; D969-L973 VanDerWaalsContact O-CG 3.27Å; D969-L973 WeakPolarHBondContact O-CG 3.34Å; D969-L973 PolarHBondContact O-N 2.87Å
970	L	87.9	Confident	85.2	Confident	38 Å²	38	59.4 Å²	59.4	20%	0.199	35%	0.349	C	S	.	.	H	α-helix	trans	-70.9	-27.6	177.6	-178	142.4	0	0	0	111.8	L942 K945 L946 I949 R968 S974	L942-L970 HydrophobicContact CD2-CB 4.27Å; L942-L970 HydrophobicContact CD2-CD1 4.46Å; K945-L970 HydrophobicContact CB-CD1 3.41Å; K945-L970 VanDerWaalsContact CB-CD1 3.41Å; K945-L970 HydrophobicContact CD-CD1 4.04Å; K945-L970 HydrophobicContact CG-CD1 4.35Å; L946-L970 HydrophobicContact CD2-CD1 4.31Å; L946-L970 HydrophobicContact CD2-CG 3.97Å; L946-L970 HydrophobicContact CG-CD1 4.39Å; L946-L970 HydrophobicContact CG-CG 4.48Å; I949-L970 HydrophobicContact CD1-CD1 4.42Å; I949-L970 HydrophobicContact CD1-CD2 3.78Å; R968-L970 PolarHBondContact O-N 3.42Å; L970-S974 VanDerWaalsContact O-CB 3.29Å; L970-S974 WeakPolarHBondContact O-CB 3.42Å; L970-S974 PolarHBondContact O-N 2.96Å; L970-S974 PolarHBondContact O-OG 3.26Å
971	N	84.6	Confident	84.9	Confident	118 Å²	118	61.6 Å²	61.6	63%	0.631	36%	0.362	S	S	*	.	H	α-helix	trans	-72.2	-46.8	178.5	-54.9	-67.2	0	0	0	110.9	D969 L973 S974 G975	D969-N971 VanDerWaalsContact C-N 3.31Å; D969-N971 PolarHBondContact OD1-N 2.83Å; D969-N971 PolarHBondContact OD1-ND2 3.28Å; D969-N971 WeakPolarHBondContact OD2-CB 3.43Å; N971-L973 PolarHBondContact O-N 2.92Å; N971-S974 CarbonylContact O-C 3.58Å; N971-S974 WeakPolarHBondContact O-CB 3.47Å; N971-S974 PolarHBondContact O-N 2.96Å; N971-S974 VanDerWaalsContact O-N 3.11Å; N971-G975 PolarHBondContact O-N 2.86Å
972	A	86.2	Confident	84.6	Confident	41 Å²	41	64.7 Å²	64.7	34%	0.339	38%	0.381	S	S	.	.	H	α-helix	trans	-56.6	-45.7	171.7	0	0	0	0	0	112.5	M967 D969 S974 G975 L976	M967-A972 HydrophobicContact CG-CB 4.37Å; M967-A972 HydrophobicContact SD-CB 3.78Å; D969-A972 HydrophobicContact CB-CB 4.12Å; D969-A972 WeakPolarHBondContact OD2-CB 3.31Å; D969-A972 PolarHBondContact OD2-N 2.86Å; A972-S974 VanDerWaalsContact C-N 3.29Å; A972-S974 PolarHBondContact O-N 3.43Å; A972-G975 PolarHBondContact O-N 2.73Å; A972-L976 PolarHBondContact O-N 3.24Å; A972-L976 VanDerWaalsContact O-N 3.13Å
973	L	87.9	Confident	84.4	Confident	0 Å²	0	64.1 Å²	64.1	0%	0	37%	0.373	C	S	.	.	H	α-helix	trans	-63.5	-33.8	175.2	-69.2	165.7	0	0	0	112.6	L942 L946 I960 L961 N964 M967 D969 N971 L977	L942-L973 HydrophobicContact CD1-CD1 4.28Å; L942-L973 HydrophobicContact CD2-CD1 4.35Å; L946-L973 HydrophobicContact CD1-CB 3.98Å; L946-L973 HydrophobicContact CD1-CD1 4.31Å; I960-L973 HydrophobicContact CG2-CD2 3.87Å; L961-L973 HydrophobicContact CD2-CD1 3.87Å; L961-L973 HydrophobicContact CD2-CD2 4.11Å; N964-L973 HydrophobicContact CB-CD2 4.27Å; M967-L973 HydrophobicContact CB-CD2 4.26Å; M967-L973 HydrophobicContact CG-CD2 4.11Å; M967-L973 HydrophobicContact CG-CG 4.07Å; M967-L973 HydrophobicContact SD-CD2 3.67Å; M967-L973 HydrophobicContact SD-CG 3.85Å; D969-L973 WeakPolarHBondContact O-CD1 3.37Å; D969-L973 VanDerWaalsContact O-CG 3.27Å; D969-L973 WeakPolarHBondContact O-CG 3.34Å; D969-L973 PolarHBondContact O-N 2.87Å; N971-L973 PolarHBondContact O-N 2.92Å; L973-L977 WeakPolarHBondContact O-CD1 3.41Å; L973-L977 PolarHBondContact O-N 2.77Å
974	S	86.3	Confident	84.2	Confident	15 Å²	15	61.2 Å²	61.2	11%	0.105	36%	0.359	C	S	.	.	H	α-helix	trans	-71.6	-35.2	173.9	-58.7	0	0	0	0	112.3	L946 L970 N971 A972 L976 L977 L978	L946-S974 WeakPolarHBondContact CD2-OG 3.32Å; L970-S974 VanDerWaalsContact O-CB 3.29Å; L970-S974 WeakPolarHBondContact O-CB 3.42Å; L970-S974 PolarHBondContact O-N 2.96Å; L970-S974 PolarHBondContact O-OG 3.26Å; N971-S974 CarbonylContact O-C 3.58Å; N971-S974 WeakPolarHBondContact O-CB 3.47Å; N971-S974 PolarHBondContact O-N 2.96Å; N971-S974 VanDerWaalsContact O-N 3.11Å; A972-S974 VanDerWaalsContact C-N 3.29Å; A972-S974 PolarHBondContact O-N 3.43Å; S974-L976 VanDerWaalsContact C-N 3.34Å; S974-L976 PolarHBondContact O-N 2.79Å; S974-L977 WeakPolarHBondContact O-CB 3.48Å; S974-L977 PolarHBondContact O-N 3.03Å; S974-L977 VanDerWaalsContact O-N 3.12Å; S974-L978 WeakPolarHBondContact O-CG 2.96Å; S974-L978 PolarHBondContact O-N 2.87Å
975	G	84.3	Confident	83.9	Confident	42 Å²	42	62.3 Å²	62.3	43%	0.433	37%	0.367	S	S	.	.	H	α-helix	trans	-60.4	-42.9	172.2	0	0	0	0	0	112.2	N971 A972 L977 L978 G979	N971-G975 PolarHBondContact O-N 2.86Å; A972-G975 PolarHBondContact O-N 2.73Å; G975-L977 PolarHBondContact O-N 2.82Å; G975-L978 PolarHBondContact O-N 3.32Å; G975-L978 VanDerWaalsContact O-N 3.1Å; G975-G979 PolarHBondContact O-N 3.43Å
976	L	85.7	Confident	83.8	Confident	71 Å²	71	64.5 Å²	64.5	37%	0.372	38%	0.379	S	S	.	.	H	α-helix	trans	-65.5	-20.6	174.8	-65.3	175.1	0	0	0	113.8	I960 M967 A972 S974	I960-L976 HydrophobicContact CD1-CB 4.07Å; I960-L976 WeakPolarHBondContact CD1-O 3.35Å; I960-L976 HydrophobicContact CG1-CB 4.37Å; I960-L976 HydrophobicContact CG2-CB 3.86Å; I960-L976 HydrophobicContact CG2-CD1 4Å; M967-L976 HydrophobicContact CE-CD1 4Å; M967-L976 HydrophobicContact SD-CD1 3.95Å; A972-L976 PolarHBondContact O-N 3.24Å; A972-L976 VanDerWaalsContact O-N 3.13Å; S974-L976 VanDerWaalsContact C-N 3.34Å; S974-L976 PolarHBondContact O-N 2.79Å
977	L	82.3	Confident	83.6	Confident	1 Å²	1	60.2 Å²	60.2	1%	0.005	37%	0.371	C	S	.	.	H	α-helix	trans	-84.2	-21.8	173.8	-77	157.5	0	0	0	113.2	L946 F950 Q953 R956 I957 I960 L973 S974 G975	L946-L977 HydrophobicContact CD1-CD1 4.39Å; L946-L977 HydrophobicContact CD2-CD1 3.94Å; F950-L977 HydrophobicContact CD2-CD1 3.74Å; F950-L977 HydrophobicContact CE2-CB 4.37Å; F950-L977 HydrophobicContact CE2-CD1 3.96Å; Q953-L977 HydrophobicContact CB-CD2 4.43Å; Q953-L977 PolarHBondContact OE1-O 3Å; R956-L977 HydrophobicContact CB-CD2 3.94Å; R956-L977 HydrophobicContact CG-CD2 3.94Å; R956-L977 PolarHBondContact NH1-O 3.18Å; I957-L977 HydrophobicContact CB-CD2 4.31Å; I957-L977 HydrophobicContact CG1-CD1 3.75Å; I957-L977 HydrophobicContact CG1-CD2 3.5Å; I957-L977 VanDerWaalsContact CG1-CD2 3.5Å; I957-L977 HydrophobicContact CG1-CG 4.29Å; I960-L977 HydrophobicContact CD1-CB 4.41Å; I960-L977 HydrophobicContact CD1-CD2 3.63Å; I960-L977 HydrophobicContact CD1-CG 3.66Å; L973-L977 WeakPolarHBondContact O-CD1 3.41Å; L973-L977 PolarHBondContact O-N 2.77Å; S974-L977 WeakPolarHBondContact O-CB 3.48Å; S974-L977 PolarHBondContact O-N 3.03Å; S974-L977 VanDerWaalsContact O-N 3.12Å; G975-L977 PolarHBondContact O-N 2.82Å
978	L	77.9	Confident	83.4	Confident	125 Å²	125	60.2 Å²	60.2	65%	0.654	38%	0.378	S	S	*	.	H	α-helix	trans	-99	-19	-177.5	-70	170.8	0	0	0	114	F950 S974 G975	F950-L978 HydrophobicContact CE1-CD2 3.96Å; F950-L978 HydrophobicContact CE1-CG 4.26Å; F950-L978 HydrophobicContact CZ-CD1 4.31Å; F950-L978 HydrophobicContact CZ-CD2 4.39Å; F950-L978 HydrophobicContact CZ-CG 4.21Å; S974-L978 WeakPolarHBondContact O-CG 2.96Å; S974-L978 PolarHBondContact O-N 2.87Å; G975-L978 PolarHBondContact O-N 3.32Å; G975-L978 VanDerWaalsContact O-N 3.1Å
979	G	60.6	Low	82.9	Confident	99 Å²	99	57.1 Å²	57.1	100%	1.021	38%	0.38	S	S	*	.			trans	-82.5	0	165.6	0	0	0	0	0	113.4	R956 G975	R956-G979 PolarHBondContact NH1-O 2.59Å; R956-G979 VanDerWaalsContact NH2-C 3.31Å; R956-G979 PolarHBondContact NH2-O 3.32Å; R956-G979 PolarHBondContact NH2-OXT 2.92Å; G975-G979 PolarHBondContact O-N 3.43Å

Retrieved 979 of 979 residues in 575.1 ms (Link to these results)

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