A0A5K4F690_SCHMA Loading...

ANK_REP_REGION domain-containing protein

AlphaFold DB , UniProt , Accession A0A5K4F690, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,186 aa.

						>A0A5K4F690_SCHMA|A0A5K4F690
MTVDLNRILFSEMLTTTVNRSLTCKSLKLPSTTENLQNNFKSLQLYTIINSYNSIKELWLAHELVTSEHGNMRDEETGNTLLHYLIISIPKFAKQFNDCSMINENQFYPEWASSIVGLVYRLVVCGRCSVNAQNNMGNTVLHLICLLPYTEFLAIHLIRADPEIKNNSGLHVFYHYGEQRAWLVKNLPGLNCGIWNAINREDMIKMDYYLSCWCRTIANQPNGKSLFECSMSTGNYELVKRIDQARNTNELIAAAMALDLNYMENLLSIKIEKEKCQVNKCDRSFDPPRPLTAELAIVYGNKANKAIELLKMYGAVDESSYYESVEQRKMAFINSPFYLQVKTAKTISDLNKAWKLIEYSSFQSNLRRHTDQATYLHYLVERYKSLKHQPHLQRGLIRLMAKLVISGVDLQARDKFGNTALLCAAKLNAITDKNTNSIKANESMPNQIDKEFEREDKVEDGAVLDTVVEIVEETIETVDRNVSLFNPTITDDVEHLVTDKDRNEMSSSKKIPLSMSVSNQSYKSVKNELVHSCMMNVPDFSDQRLISILIQLGSDCSIPCKNGYSVYHENYIPKGAYKIKRNIQSSLLKTSIKRSKGLIDHPGIWPIVDRLIYSVQHHKSIDTINYFCTELENTIKDNLIWLKAKRSGLTVIEWINSLWTHDRCNQWIEEIREKLTNLLQYYVSLTDFVIYSMAGDIQKLKQCLAMGKGQLKAQLHMQKFLVGINNNGRANFITRPLLVSVMEYSTAEVLQLMIQSGANLSEYYSEKEPFGPVAFWSFKNFVSLQHTYEVIKEVPVDLRDSNGSSLFHYATNLFHTIHPKDVNGFRWASLILATILKRGVKIYYRDIWERTARDILNRSRYKLMDNNNVHCETEENFRPFEEEPPDPFELHDITDPETGNLLTAEQLIDRHVAFLASANHLQSMEELILYGYNYIHLANSGPVRFKSARVLAEQKGHHEMISLLDTVDQYRTEMMEVHKTIITGDYHQFLRLVNNKRVIMSRDWRERSLLHLAVLYRRTDFVLQLIELCQELVNYQDCLGRTPFHYAICLPDNRRLFLKIVSKSGGIDKQIKDLRNISIHQYGELYDRKIPEYQNLIHIEKSIKLLESNWPDQTICSSSLKIPNDNDDQLSIKDKDEPDNEQSIIEVIHNTTTKNTENCLIFPIPGAFNAFEVKRIKSIFNWKQRM
					

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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	28.4	Very low	32.3	Very low	214 Å²	214	64.7 Å²	64.7	100%	1.054	34%	0.344	S	S	*	.				0	92	0	-72.4	178	-174.6	0	0	107.8	V3 L190	M1-V3 PolarHBondContact O-N 2.92Å; M1-L190 HydrophobicContact CB-CD2 4.25Å; M1-L190 HydrophobicContact SD-CD2 3.98Å
2	T	25.9	Very low	32	Very low	120 Å²	120	74 Å²	74	74%	0.736	38%	0.384	S	S	*	.			trans	-85.6	94.2	175.9	44.9	0	0	0	0	108.2	D4	T2-D4 PolarHBondContact O-N 3.29Å; T2-D4 VanDerWaalsContact O-N 3.09Å
3	V	30.6	Very low	31.7	Very low	15 Å²	15	70.3 Å²	70.3	9%	0.091	36%	0.364	C	S	.	.			trans	-72.1	94.5	169.8	179.3	0	0	0	0	107.2	M1 L5 F173 H175 L190	M1-V3 PolarHBondContact O-N 2.92Å; V3-L5 PolarHBondContact O-N 3.46Å; V3-L5 VanDerWaalsContact O-N 3.08Å; V3-F173 HydrophobicContact CB-CZ 4.04Å; V3-F173 HydrophobicContact CG1-CE1 4.45Å; V3-F173 HydrophobicContact CG1-CZ 4.03Å; V3-H175 PolarHBondContact O-CE1 3.43Å; V3-H175 PolarHBondContact O-ND1 2.8Å; V3-L190 HydrophobicContact CG2-CD1 3.8Å; V3-L190 HydrophobicContact CG2-CD2 3.81Å; V3-L190 HydrophobicContact CG2-CG 4.24Å
4	D	34.1	Very low	31.5	Very low	12 Å²	12	72.6 Å²	72.6	6%	0.064	38%	0.377	C	S	.	.			trans	-58.7	110.1	173.7	-167.7	-22.3	0	0	0	108.9	T2 N6 R7 R367	T2-D4 PolarHBondContact O-N 3.29Å; T2-D4 VanDerWaalsContact O-N 3.09Å; D4-N6 PolarHBondContact O-N 3.31Å; D4-N6 PolarHBondContact OD1-N 3.48Å; D4-N6 PolarHBondContact OD1-ND2 3.33Å; D4-R7 WeakPolarHBondContact O-CB 3.28Å; D4-R7 PolarHBondContact O-N 3.19Å; D4-R367 IonicContact OD2-NH2 3.16Å
5	L	32.8	Very low	31.3	Very low	11 Å²	11	72.5 Å²	72.5	6%	0.058	38%	0.381	C	S	.	.	G	3₁₀ helix	trans	-72.2	-13.3	-170.1	-112.2	120.7	0	0	0	115.6	V3 R7 I8 F173 H175 W182	V3-L5 PolarHBondContact O-N 3.46Å; V3-L5 VanDerWaalsContact O-N 3.08Å; L5-R7 PolarHBondContact O-N 3.01Å; L5-I8 HydrophobicContact CD2-CD1 3.71Å; L5-I8 HydrophobicContact CD2-CG1 4.43Å; L5-I8 HydrophobicContact CG-CD1 3.82Å; L5-I8 HydrophobicContact CG-CG1 4.48Å; L5-I8 PolarHBondContact O-N 3.45Å; L5-F173 HydrophobicContact CD1-CD1 3.6Å; L5-F173 HydrophobicContact CD1-CE1 3.2Å; L5-F173 HydrophobicContact CD1-CZ 4.37Å; L5-F173 HydrophobicContact CD2-CD1 3.92Å; L5-F173 HydrophobicContact CD2-CE1 4.15Å; L5-F173 HydrophobicContact CG-CD1 3.94Å; L5-F173 HydrophobicContact CG-CE1 3.65Å; L5-H175 HydrophobicContact CD1-CB 3.14Å; L5-W182 HydrophobicContact CB-CH2 3.71Å; L5-W182 HydrophobicContact CB-CZ2 3.97Å; L5-W182 HydrophobicContact CB-CZ3 4.13Å; L5-W182 HydrophobicContact CD1-CD2 4.42Å; L5-W182 HydrophobicContact CD1-CE3 3.55Å; L5-W182 HydrophobicContact CD1-CH2 3.31Å; L5-W182 HydrophobicContact CD1-CZ2 4.23Å; L5-W182 HydrophobicContact CD1-CZ3 2.94Å; L5-W182 HydrophobicContact CD2-CB 4.42Å; L5-W182 HydrophobicContact CD2-CD2 3.17Å; L5-W182 VanDerWaalsContact CD2-CE2 3.49Å; L5-W182 HydrophobicContact CD2-CE3 3.11Å; L5-W182 HydrophobicContact CD2-CG 3.79Å; L5-W182 HydrophobicContact CD2-CH2 3.63Å; L5-W182 HydrophobicContact CD2-CZ2 3.69Å; L5-W182 HydrophobicContact CD2-CZ3 3.39Å; L5-W182 HydrophobicContact CG-CD2 4.26Å; L5-W182 HydrophobicContact CG-CE3 3.83Å; L5-W182 HydrophobicContact CG-CH2 3.7Å; L5-W182 HydrophobicContact CG-CZ2 4.15Å; L5-W182 HydrophobicContact CG-CZ3 3.58Å
6	N	36.2	Very low	30.9	Very low	51 Å²	51	72.6 Å²	72.6	27%	0.273	39%	0.385	S	S	.	.	G	3₁₀ helix	trans	-63.8	-10.3	171.2	-66.3	-61.6	0	0	0	112.2	D4 E178 R413	D4-N6 PolarHBondContact O-N 3.31Å; D4-N6 PolarHBondContact OD1-N 3.48Å; D4-N6 PolarHBondContact OD1-ND2 3.33Å; N6-E178 PolarHBondContact ND2-OE1 2.79Å; N6-R413 PolarHBondContact O-NH2 3.21Å
7	R	37.3	Very low	30.6	Very low	28 Å²	28	73.1 Å²	73.1	11%	0.106	39%	0.392	C	S	.	.	G	3₁₀ helix	trans	-91.7	-6.8	177.5	-65.4	-174.1	177.5	166.2	5.9	115.7	D4 L5 L9 D409 Q411 S647	D4-R7 WeakPolarHBondContact O-CB 3.28Å; D4-R7 PolarHBondContact O-N 3.19Å; L5-R7 PolarHBondContact O-N 3.01Å; R7-L9 PolarHBondContact O-N 3.16Å; R7-D409 IonicContact CZ-OD1 2.68Å; R7-D409 IonicContact CZ-OD2 2.7Å; R7-D409 IonicContact NH1-OD1 2.85Å; R7-D409 PolarHBondContact NH1-OD1 3.41Å; R7-D409 IonicContact NH1-OD2 3.4Å; R7-D409 IonicContact NH2-OD1 2.98Å; R7-D409 PolarHBondContact NH2-OD1 3.48Å; R7-D409 IonicContact NH2-OD2 3.76Å; R7-D409 PolarHBondContact NH2-OD2 3.31Å; R7-Q411 VanDerWaalsContact CZ-CG 3.49Å; R7-Q411 PolarHBondContact NH2-O 3.14Å; R7-Q411 VanDerWaalsContact NH2-O 3.12Å; R7-S647 WeakPolarHBondContact CB-OG 3.36Å; R7-S647 VanDerWaalsContact CD-OG 3.23Å; R7-S647 WeakPolarHBondContact CD-OG 3.37Å
8	I	35.4	Very low	30.5	Very low	18 Å²	18	72.3 Å²	72.3	9%	0.092	39%	0.39	C	S	.	.	G	3₁₀ helix	trans	-81.1	-4.2	-178.1	-61.6	-171.5	0	0	0	112.4	L5 F10 M13 F173 L187	L5-I8 HydrophobicContact CD2-CD1 3.71Å; L5-I8 HydrophobicContact CD2-CG1 4.43Å; L5-I8 HydrophobicContact CG-CD1 3.82Å; L5-I8 HydrophobicContact CG-CG1 4.48Å; L5-I8 PolarHBondContact O-N 3.45Å; I8-F10 VanDerWaalsContact C-N 3.27Å; I8-F10 PolarHBondContact O-N 2.86Å; I8-M13 HydrophobicContact CG2-CB 3.97Å; I8-M13 HydrophobicContact CG2-CE 3.29Å; I8-M13 HydrophobicContact CG2-CG 3.99Å; I8-M13 HydrophobicContact CG2-SD 3.06Å; I8-M13 WeakPolarHBondContact CG2-SD 3.27Å; I8-F173 HydrophobicContact CD1-CD1 4.2Å; I8-F173 HydrophobicContact CD1-CE1 4.02Å; I8-L187 HydrophobicContact CD1-CD1 4.12Å; I8-L187 HydrophobicContact CG2-CD1 4.42Å
9	L	33	Very low	30.5	Very low	80 Å²	80	77.5 Å²	77.5	42%	0.419	42%	0.418	S	S	.	.	G	3₁₀ helix	trans	-72	-4.3	-177.5	-81.9	152.8	0	0	0	115.9	R7 T15	R7-L9 PolarHBondContact O-N 3.16Å; L9-T15 VanDerWaalsContact CD2-CB 3.44Å; L9-T15 HydrophobicContact CD2-CG2 3.79Å; L9-T15 WeakPolarHBondContact CD2-OG1 3.45Å; L9-T15 HydrophobicContact CG-CG2 4.39Å
10	F	30.9	Very low	30.3	Very low	94 Å²	94	86.2 Å²	86.2	41%	0.412	44%	0.444	S	S	.	.	G	3₁₀ helix	trans	-122.1	6.6	-171.7	-86.9	-87.3	0	0	0	117.3	I8 P559	I8-F10 VanDerWaalsContact C-N 3.27Å; I8-F10 PolarHBondContact O-N 2.86Å; F10-P559 VanDerWaalsContact CE2-CD 3.42Å; F10-P559 HydrophobicContact CE2-CG 3.89Å; F10-P559 HydrophobicContact CZ-CG 4.2Å
11	S	30.6	Very low	30.4	Very low	69 Å²	69	86 Å²	86	48%	0.483	45%	0.451	S	S	.	.	S	Bend	trans	-133.3	99.6	167.5	70.4	0	0	0	0	111.3	M13	S11-M13 PolarHBondContact O-N 2.9Å
12	E	29	Very low	30.5	Very low	176 Å²	176	79.5 Å²	79.5	82%	0.822	42%	0.42	S	S	*	.	S	Bend	trans	48.9	12.9	166.8	-63.8	-165.6	145.3	0	0	119.5
13	M	28.3	Very low	30.8	Very low	26 Å²	26	78.7 Å²	78.7	13%	0.128	42%	0.415	C	S	.	.			trans	-92.7	128	178.1	-92.9	-163.7	45.6	0	0	113.3	I8 S11 T15 L183 V184 L187	I8-M13 HydrophobicContact CG2-CB 3.97Å; I8-M13 HydrophobicContact CG2-CE 3.29Å; I8-M13 HydrophobicContact CG2-CG 3.99Å; I8-M13 HydrophobicContact CG2-SD 3.06Å; I8-M13 WeakPolarHBondContact CG2-SD 3.27Å; S11-M13 PolarHBondContact O-N 2.9Å; M13-T15 PolarHBondContact O-N 2.74Å; M13-T15 PolarHBondContact O-OG1 2.8Å; M13-T15 VanDerWaalsContact O-OG1 3.06Å; M13-L183 WeakPolarHBondContact CE-O 3.38Å; M13-V184 HydrophobicContact CE-CB 4.39Å; M13-V184 HydrophobicContact CE-CG2 3.64Å; M13-V184 HydrophobicContact SD-CB 4.06Å; M13-V184 HydrophobicContact SD-CG1 3.72Å; M13-V184 HydrophobicContact SD-CG2 3.72Å; M13-L187 HydrophobicContact SD-CD1 3.65Å; M13-L187 HydrophobicContact SD-CG 4.3Å
14	L	28.8	Very low	31	Very low	102 Å²	102	83.2 Å²	83.2	53%	0.534	45%	0.446	S	S	.	.			trans	-55.8	61.3	-177	-74.1	156.5	0	0	0	115	L170	L14-L170 HydrophobicContact CD1-CD2 4.42Å
15	T	27.8	Very low	31	Very low	71 Å²	71	89.7 Å²	89.7	44%	0.436	47%	0.473	S	S	.	.	S	Bend	trans	-98.6	0.1	175.5	42.8	0	0	0	0	112.9	L9 M13	L9-T15 VanDerWaalsContact CD2-CB 3.44Å; L9-T15 HydrophobicContact CD2-CG2 3.79Å; L9-T15 WeakPolarHBondContact CD2-OG1 3.45Å; L9-T15 HydrophobicContact CG-CG2 4.39Å; M13-T15 PolarHBondContact O-N 2.74Å; M13-T15 PolarHBondContact O-OG1 2.8Å; M13-T15 VanDerWaalsContact O-OG1 3.06Å
16	T	24.9	Very low	31.3	Very low	74 Å²	74	90.3 Å²	90.3	45%	0.454	48%	0.479	S	S	.	.	S	Bend	trans	-132	126.2	164.2	58.9	0	0	0	0	107.3
17	T	26	Very low	31.8	Very low	81 Å²	81	91.6 Å²	91.6	50%	0.497	49%	0.485	S	S	.	.			trans	86	71.5	176.4	77.2	0	0	0	0	118.3
18	V	29.7	Very low	32.2	Very low	60 Å²	60	97 Å²	97	36%	0.364	51%	0.509	S	S	.	.			trans	-123.8	2.5	145.8	-173.7	0	0	0	0	112.4	R20 L22	V18-R20 PolarHBondContact O-N 2.84Å; V18-L22 HydrophobicContact CG1-CB 4.03Å; V18-L22 HydrophobicContact CG1-CD1 3.5Å; V18-L22 HydrophobicContact CG1-CG 4.27Å
19	N	29.1	Very low	32.6	Very low	171 Å²	171	98.7 Å²	98.7	91%	0.914	52%	0.518	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.9	-1.1	174.2	-84.7	-6.3	0	0	0	115.1
20	R	27.5	Very low	32.8	Very low	250 Å²	250	95.7 Å²	95.7	94%	0.943	50%	0.504	S	S	*	.	T	Hydrogen-bonded Turn	trans	-147.5	-1.3	177.5	-71.4	-167.6	175.2	169.7	-2.5	117.6	V18	V18-R20 PolarHBondContact O-N 2.84Å
21	S	31.7	Very low	33.2	Very low	84 Å²	84	94.6 Å²	94.6	59%	0.587	51%	0.508	S	S	*	.	T	Hydrogen-bonded Turn	trans	-124.9	-3.8	-169.2	76.3	0	0	0	0	117.9	T23	S21-T23 PolarHBondContact O-N 3.23Å
22	L	31.5	Very low	33.6	Very low	77 Å²	77	98.2 Å²	98.2	40%	0.403	53%	0.527	S	S	.	.	S	Bend	trans	-87.8	93.2	158.3	-98.2	147.1	0	0	0	106.4	V18 C24 L146	V18-L22 HydrophobicContact CG1-CB 4.03Å; V18-L22 HydrophobicContact CG1-CD1 3.5Å; V18-L22 HydrophobicContact CG1-CG 4.27Å; L22-C24 PolarHBondContact O-N 3.26Å; L22-L146 HydrophobicContact CD1-CD2 4.32Å
23	T	31.2	Very low	34	Very low	102 Å²	102	94.4 Å²	94.4	63%	0.626	52%	0.516	S	S	*	.			trans	-45.3	139.8	-179.2	55.7	0	0	0	0	111	S21 K25 S26	S21-T23 PolarHBondContact O-N 3.23Å; T23-K25 PolarHBondContact O-N 3.48Å; T23-S26 PolarHBondContact O-N 3.39Å
24	C	35.1	Very low	34.2	Very low	111 Å²	111	101.6 Å²	101.6	75%	0.75	55%	0.549	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.8	8.7	-176.5	-72.5	0	0	0	0	116.5	L22 K28	L22-C24 PolarHBondContact O-N 3.26Å; C24-K28 WeakPolarHBondContact O-CG 3.22Å
25	K	33.9	Very low	34.5	Very low	147 Å²	147	104.3 Å²	104.3	64%	0.639	56%	0.564	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.3	-30	175	-68.8	-174.5	177.4	-177.3	0	113.2	T23 L27	T23-K25 PolarHBondContact O-N 3.48Å; K25-L27 PolarHBondContact O-N 3.43Å
26	S	38.6	Very low	34.7	Very low	24 Å²	24	108.8 Å²	108.8	17%	0.168	59%	0.585	C	S	.	*	T	Hydrogen-bonded Turn	trans	-73	-12.7	-176	58.9	0	0	0	0	114.9	T23	T23-S26 PolarHBondContact O-N 3.39Å
27	L	47.4	Very low	35.4	Very low	79 Å²	79	114 Å²	114	41%	0.414	60%	0.604	S	S	.	*	T	Hydrogen-bonded Turn	trans	-122	9.3	-174.9	-67.7	171.8	0	0	0	112.6	K25 L29 L147	K25-L27 PolarHBondContact O-N 3.43Å; L27-L29 PolarHBondContact O-N 3.04Å; L27-L29 VanDerWaalsContact O-N 3.15Å; L27-L147 HydrophobicContact CD1-CD2 4.36Å; L27-L147 HydrophobicContact CD2-CD2 3.61Å; L27-L147 HydrophobicContact CD2-CG 4.44Å
28	K	44.9	Very low	36.3	Very low	141 Å²	141	114 Å²	114	61%	0.613	60%	0.601	S	S	*	*	P	Polyproline II helix	trans	-67.6	116.5	-179.5	-95.8	-178.3	178	-166.1	0	109.9	C24	C24-K28 WeakPolarHBondContact O-CG 3.22Å
29	L	44.9	Very low	37.6	Very low	53 Å²	53	117.4 Å²	117.4	28%	0.277	62%	0.617	S	S	.	*	P	Polyproline II helix	trans	-63.2	145	156.8	-71.1	154.1	0	0	0	108	L27 S31 Y84 I87	L27-L29 PolarHBondContact O-N 3.04Å; L27-L29 VanDerWaalsContact O-N 3.15Å; L29-S31 PolarHBondContact O-N 2.96Å; L29-Y84 HydrophobicContact CD2-CD1 4.35Å; L29-Y84 HydrophobicContact CD2-CE1 4.21Å; L29-I87 HydrophobicContact CD2-CG2 4.29Å
30	P	36.9	Very low	38.9	Very low	18 Å²	18	109.8 Å²	109.8	12%	0.117	58%	0.576	C	S	.	*	P	Polyproline II helix	trans	-56.2	135.2	-177.9	22	-32.1	0	0	0	110.1	Y84	P30-Y84 WeakPolarHBondContact CD-OH 3.41Å; P30-Y84 HydrophobicContact CG-CE1 4.48Å; P30-Y84 WeakPolarHBondContact CG-OH 3.38Å
31	S	40	Very low	40.2	Very low	70 Å²	70	102 Å²	102	49%	0.49	55%	0.549	S	S	.	.	P	Polyproline II helix	trans	-61.5	144.8	178	34.2	0	0	0	0	110.7	L29 T33	L29-S31 PolarHBondContact O-N 2.96Å; S31-T33 PolarHBondContact O-N 3.43Å
32	T	39.5	Very low	41.2	Very low	146 Å²	146	102.1 Å²	102.1	90%	0.896	55%	0.55	S	S	*	.	S	Bend	trans	-69.1	24.5	-179.7	45.3	0	0	0	0	114.1
33	T	36.6	Very low	42.8	Very low	95 Å²	95	100.1 Å²	100.1	58%	0.583	54%	0.539	S	S	*	.			trans	-91.7	116.4	179.2	44.1	0	0	0	0	110	S31 N35	S31-T33 PolarHBondContact O-N 3.43Å; T33-N35 PolarHBondContact O-N 3.33Å; T33-N35 VanDerWaalsContact O-N 3.12Å
34	E	31.9	Very low	44.6	Very low	178 Å²	178	101.7 Å²	101.7	83%	0.832	54%	0.539	S	S	*	.			trans	-53.3	106.2	178.3	-65.6	173.2	152.1	0	0	111.4
35	N	35.4	Very low	46.4	Very low	158 Å²	158	96.5 Å²	96.5	85%	0.845	50%	0.504	S	S	*	.			trans	-128.9	111.6	155.5	-97.5	-18.7	0	0	0	107.7	T33 Q37	T33-N35 PolarHBondContact O-N 3.33Å; T33-N35 VanDerWaalsContact O-N 3.12Å; N35-Q37 VanDerWaalsContact C-N 3.32Å; N35-Q37 PolarHBondContact O-N 3.13Å
36	L	32.7	Very low	48.1	Very low	166 Å²	166	90.2 Å²	90.2	87%	0.869	48%	0.477	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.6	34.5	-154.9	-130.7	138.7	0	0	0	113.1
37	Q	40	Very low	49.7	Very low	182 Å²	182	92.4 Å²	92.4	85%	0.85	49%	0.489	S	S	*	.	T	Hydrogen-bonded Turn	trans	-123.8	-0.8	-172.9	-88.9	176.6	-24.7	0	0	116.8	N35	N35-Q37 VanDerWaalsContact C-N 3.32Å; N35-Q37 PolarHBondContact O-N 3.13Å
38	N	44.8	Very low	50.8	Low	81 Å²	81	90.1 Å²	90.1	43%	0.433	48%	0.477	S	S	.	.			trans	-123	116.3	-179.5	-72.9	-30.6	0	0	0	114.6	F40 E75	N38-F40 PolarHBondContact O-N 3.29Å; N38-E75 PolarHBondContact ND2-OE1 3.38Å; N38-E75 PolarHBondContact ND2-OE2 3.32Å; N38-E75 PolarHBondContact OD1-OE1 3.49Å
39	N	55.5	Low	52.1	Low	133 Å²	133	84 Å²	84	71%	0.711	45%	0.451	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.5	3.5	-175.5	-77.7	-24.6	0	0	0	117	S42	N39-S42 PolarHBondContact O-OG 3.03Å; N39-S42 VanDerWaalsContact O-OG 3.08Å
40	F	58	Low	53.2	Low	11 Å²	11	84 Å²	84	5%	0.048	45%	0.451	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.5	-38.2	-175.5	-159.7	-87.6	0	0	0	112.6	N38 L43 Y46 M72 D74 L81 Y84	N38-F40 PolarHBondContact O-N 3.29Å; F40-L43 WeakPolarHBondContact O-CB 3.44Å; F40-Y46 AromaticContact CD1-CD2 3.87Å; F40-Y46 HydrophobicContact CD1-CD2 3.87Å; F40-Y46 HydrophobicContact CD1-CE2 4.13Å; F40-Y46 HydrophobicContact CD1-CG 4.45Å; F40-Y46 AromaticContact CE1-CD2 3.62Å; F40-Y46 HydrophobicContact CE1-CD2 3.62Å; F40-Y46 AromaticContact CE1-CE2 3.95Å; F40-Y46 HydrophobicContact CE1-CE2 3.95Å; F40-Y46 WeakPolarHBondContact O-CB 3.41Å; F40-M72 HydrophobicContact CB-CE 4.43Å; F40-M72 HydrophobicContact CD2-CB 3.69Å; F40-M72 HydrophobicContact CD2-CE 3.7Å; F40-M72 HydrophobicContact CE2-CB 3.4Å; F40-M72 VanDerWaalsContact CE2-CB 3.4Å; F40-M72 HydrophobicContact CE2-CE 4.33Å; F40-M72 HydrophobicContact CG-CE 4.31Å; F40-D74 HydrophobicContact CD1-CB 4.41Å; F40-L81 HydrophobicContact CE1-CD2 4.04Å; F40-L81 HydrophobicContact CE2-CD2 4.42Å; F40-L81 HydrophobicContact CE2-CG 4.25Å; F40-L81 HydrophobicContact CZ-CD2 3.66Å; F40-L81 HydrophobicContact CZ-CG 3.75Å; F40-Y84 HydrophobicContact CD1-CE2 4.43Å; F40-Y84 AromaticContact CE1-CD2 3.71Å; F40-Y84 HydrophobicContact CE1-CD2 3.71Å; F40-Y84 AromaticContact CE1-CE2 3.65Å; F40-Y84 HydrophobicContact CE1-CE2 3.65Å; F40-Y84 HydrophobicContact CZ-CD2 4.09Å; F40-Y84 HydrophobicContact CZ-CE2 4.23Å
41	K	54.3	Low	54.4	Low	86 Å²	86	85.3 Å²	85.3	37%	0.374	46%	0.461	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.5	-21.5	-178.9	-69.7	-179.3	-178.8	171.7	0	113.5	L43 Y46	K41-L43 VanDerWaalsContact C-N 3.28Å; K41-Y46 HydrophobicContact CB-CD1 4.41Å; K41-Y46 HydrophobicContact CB-CE1 4.29Å; K41-Y46 HydrophobicContact CG-CD1 4.46Å; K41-Y46 HydrophobicContact CG-CE1 3.93Å
42	S	53.1	Low	55.3	Low	87 Å²	87	84.9 Å²	84.9	61%	0.608	45%	0.449	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.4	-9.3	176.6	54.5	0	0	0	0	113.4	N39 Q44	N39-S42 PolarHBondContact O-OG 3.03Å; N39-S42 VanDerWaalsContact O-OG 3.08Å; S42-Q44 PolarHBondContact O-N 3.15Å
43	L	64	Low	56.2	Low	34 Å²	34	83.6 Å²	83.6	18%	0.178	44%	0.436	C	S	.	.			trans	-66.2	120.3	179.1	-157.2	86.9	0	0	0	109.6	F40 K41 L45 Y46 T47 H69 M72 L81	F40-L43 WeakPolarHBondContact O-CB 3.44Å; K41-L43 VanDerWaalsContact C-N 3.28Å; L43-L45 HydrophobicContact CD2-CB 3.74Å; L43-L45 HydrophobicContact CD2-CD2 4.31Å; L43-L45 HydrophobicContact CG-CB 4.25Å; L43-L45 PolarHBondContact O-N 3.43Å; L43-L45 VanDerWaalsContact O-N 3.12Å; L43-Y46 WeakPolarHBondContact O-CA 3.38Å; L43-Y46 WeakPolarHBondContact O-CB 3.45Å; L43-Y46 PolarHBondContact O-N 2.89Å; L43-T47 PolarHBondContact O-N 3.16Å; L43-H69 VanDerWaalsContact CD2-CD2 3.42Å; L43-H69 WeakPolarHBondContact CD2-CD2 3.44Å; L43-M72 HydrophobicContact CD1-CE 3.88Å; L43-M72 HydrophobicContact CD1-SD 3.74Å; L43-M72 HydrophobicContact CD2-CE 4.41Å; L43-M72 HydrophobicContact CD2-SD 4.06Å; L43-L81 HydrophobicContact CD2-CD1 4.15Å; L43-L81 HydrophobicContact CD2-CD2 4.2Å
44	Q	69.7	Low	58	Low	135 Å²	135	80.9 Å²	80.9	63%	0.631	42%	0.421	S	S	*	.	H	α-helix	trans	-50	-41.5	177.2	-75.3	-178.1	-17.4	0	0	111.2	S42 Y46 T47 I48	S42-Q44 PolarHBondContact O-N 3.15Å; Q44-Y46 PolarHBondContact O-N 3.48Å; Q44-T47 WeakPolarHBondContact CA-OG1 3.33Å; Q44-T47 PolarHBondContact O-N 3.41Å; Q44-T47 VanDerWaalsContact O-N 3.16Å; Q44-T47 PolarHBondContact O-OG1 3.48Å; Q44-I48 WeakPolarHBondContact O-CG1 3.27Å; Q44-I48 PolarHBondContact O-N 3.16Å
45	L	72.4	Confident	60.3	Low	3 Å²	3	73.8 Å²	73.8	2%	0.016	39%	0.389	C	S	.	.	H	α-helix	trans	-59.8	-41.6	176.7	-171.1	70.5	0	0	0	113.3	L43 I48 I49 A61 L64 V65 L81 L122	L43-L45 HydrophobicContact CD2-CB 3.74Å; L43-L45 HydrophobicContact CD2-CD2 4.31Å; L43-L45 HydrophobicContact CG-CB 4.25Å; L43-L45 PolarHBondContact O-N 3.43Å; L43-L45 VanDerWaalsContact O-N 3.12Å; L45-I48 PolarHBondContact O-N 3.1Å; L45-I49 HydrophobicContact CD1-CD1 4.44Å; L45-I49 HydrophobicContact CG-CD1 4.03Å; L45-I49 VanDerWaalsContact O-CG1 3.25Å; L45-I49 WeakPolarHBondContact O-CG1 3.37Å; L45-I49 PolarHBondContact O-N 2.96Å; L45-A61 HydrophobicContact CD1-CB 3.61Å; L45-A61 WeakPolarHBondContact CD1-O 3.34Å; L45-L64 HydrophobicContact CD1-CB 4.44Å; L45-V65 HydrophobicContact CD1-CG2 4.32Å; L45-V65 HydrophobicContact CD2-CG2 4.35Å; L45-L81 HydrophobicContact CD2-CD1 3.99Å; L45-L122 HydrophobicContact CD2-CD2 4.15Å
46	Y	69.9	Low	62.5	Low	15 Å²	15	74.3 Å²	74.3	6%	0.059	38%	0.384	C	S	.	.	H	α-helix	trans	-64.8	-42.4	175.2	179	-95	0	0	0	111.1	F40 K41 L43 Q44 I48 I49 N50 Y84	F40-Y46 AromaticContact CD1-CD2 3.87Å; F40-Y46 HydrophobicContact CD1-CD2 3.87Å; F40-Y46 HydrophobicContact CD1-CE2 4.13Å; F40-Y46 HydrophobicContact CD1-CG 4.45Å; F40-Y46 AromaticContact CE1-CD2 3.62Å; F40-Y46 HydrophobicContact CE1-CD2 3.62Å; F40-Y46 AromaticContact CE1-CE2 3.95Å; F40-Y46 HydrophobicContact CE1-CE2 3.95Å; F40-Y46 WeakPolarHBondContact O-CB 3.41Å; K41-Y46 HydrophobicContact CB-CD1 4.41Å; K41-Y46 HydrophobicContact CB-CE1 4.29Å; K41-Y46 HydrophobicContact CG-CD1 4.46Å; K41-Y46 HydrophobicContact CG-CE1 3.93Å; L43-Y46 WeakPolarHBondContact O-CA 3.38Å; L43-Y46 WeakPolarHBondContact O-CB 3.45Å; L43-Y46 PolarHBondContact O-N 2.89Å; Q44-Y46 PolarHBondContact O-N 3.48Å; Y46-I48 VanDerWaalsContact C-N 3.33Å; Y46-I48 PolarHBondContact O-N 3.02Å; Y46-I49 PolarHBondContact O-N 2.88Å; Y46-N50 VanDerWaalsContact O-CB 3.28Å; Y46-N50 WeakPolarHBondContact O-CB 3.22Å; Y46-N50 PolarHBondContact O-N 3.4Å; Y46-Y84 AromaticContact CE2-CD1 3.86Å; Y46-Y84 HydrophobicContact CE2-CD1 3.86Å; Y46-Y84 HydrophobicContact CE2-CD2 4.19Å; Y46-Y84 AromaticContact CE2-CE1 3.84Å; Y46-Y84 HydrophobicContact CE2-CE1 3.84Å; Y46-Y84 HydrophobicContact CE2-CE2 4.18Å; Y46-Y84 HydrophobicContact CE2-CG 4.04Å
47	T	71.2	Confident	64.8	Low	69 Å²	69	68.7 Å²	68.7	42%	0.423	35%	0.353	S	S	.	.	H	α-helix	trans	-63.9	-38.8	176.8	62.8	0	0	0	0	111.7	L43 Q44 N50 S51	L43-T47 PolarHBondContact O-N 3.16Å; Q44-T47 WeakPolarHBondContact CA-OG1 3.33Å; Q44-T47 PolarHBondContact O-N 3.41Å; Q44-T47 VanDerWaalsContact O-N 3.16Å; Q44-T47 PolarHBondContact O-OG1 3.48Å; T47-N50 CarbonylContact O-C 3.49Å; T47-N50 PolarHBondContact O-N 3.3Å; T47-S51 WeakPolarHBondContact O-CA 3.36Å; T47-S51 WeakPolarHBondContact O-CB 3.39Å; T47-S51 PolarHBondContact O-N 3.44Å; T47-S51 PolarHBondContact O-OG 3.44Å
48	I	71.1	Confident	66.9	Low	32 Å²	32	60.6 Å²	60.6	16%	0.164	32%	0.315	C	S	.	.	H	α-helix	trans	-67.9	-47.5	178.5	-66.2	163.7	0	0	0	110.7	Q44 L45 Y46 N50 S51 E57 A61 L64	Q44-I48 WeakPolarHBondContact O-CG1 3.27Å; Q44-I48 PolarHBondContact O-N 3.16Å; L45-I48 PolarHBondContact O-N 3.1Å; Y46-I48 VanDerWaalsContact C-N 3.33Å; Y46-I48 PolarHBondContact O-N 3.02Å; I48-N50 PolarHBondContact O-N 3.18Å; I48-S51 WeakPolarHBondContact CA-OG 3.33Å; I48-S51 PolarHBondContact O-N 2.76Å; I48-S51 PolarHBondContact O-OG 3.22Å; I48-E57 HydrophobicContact CG2-CB 3.92Å; I48-E57 WeakPolarHBondContact CG2-O 3.47Å; I48-A61 HydrophobicContact CB-CB 4.46Å; I48-A61 HydrophobicContact CG2-CB 3.8Å; I48-L64 HydrophobicContact CD1-CD1 3.4Å
49	I	72.1	Confident	68.8	Low	13 Å²	13	58.5 Å²	58.5	7%	0.067	30%	0.301	C	S	.	.	H	α-helix	trans	-61	-30	178.2	-67.3	167.5	0	0	0	111.6	L45 Y46 L85 L118	L45-I49 HydrophobicContact CD1-CD1 4.44Å; L45-I49 HydrophobicContact CG-CD1 4.03Å; L45-I49 VanDerWaalsContact O-CG1 3.25Å; L45-I49 WeakPolarHBondContact O-CG1 3.37Å; L45-I49 PolarHBondContact O-N 2.96Å; Y46-I49 PolarHBondContact O-N 2.88Å; I49-L85 HydrophobicContact CG2-CD1 4.32Å; I49-L118 HydrophobicContact CD1-CD2 4.39Å; I49-L118 HydrophobicContact CG1-CD2 4.28Å
50	N	67.4	Low	70.2	Confident	53 Å²	53	56.5 Å²	56.5	28%	0.283	29%	0.29	S	S	.	.	H	α-helix	trans	-104.8	0.3	-176.5	-159.5	32.5	0	0	0	114.4	Y46 T47 I48 Y52	Y46-N50 VanDerWaalsContact O-CB 3.28Å; Y46-N50 WeakPolarHBondContact O-CB 3.22Å; Y46-N50 PolarHBondContact O-N 3.4Å; T47-N50 CarbonylContact O-C 3.49Å; T47-N50 PolarHBondContact O-N 3.3Å; I48-N50 PolarHBondContact O-N 3.18Å; N50-Y52 WeakPolarHBondContact O-CD2 3.48Å; N50-Y52 WeakPolarHBondContact O-CE2 3.46Å; N50-Y52 PolarHBondContact OD1-OH 3.32Å
51	S	64	Low	71.5	Confident	45 Å²	45	56 Å²	56	32%	0.315	29%	0.288	S	S	.	.	S	Bend	trans	-94.6	-0.4	-178.1	50.3	0	0	0	0	114.5	T47 I48 N53	T47-S51 WeakPolarHBondContact O-CA 3.36Å; T47-S51 WeakPolarHBondContact O-CB 3.39Å; T47-S51 PolarHBondContact O-N 3.44Å; T47-S51 PolarHBondContact O-OG 3.44Å; I48-S51 WeakPolarHBondContact CA-OG 3.33Å; I48-S51 PolarHBondContact O-N 2.76Å; I48-S51 PolarHBondContact O-OG 3.22Å; S51-N53 PolarHBondContact O-N 3.3Å; S51-N53 PolarHBondContact O-ND2 3.18Å; S51-N53 PolarHBondContact O-OD1 3.16Å; S51-N53 VanDerWaalsContact O-OD1 3.12Å
52	Y	58	Low	73.1	Confident	60 Å²	60	52.4 Å²	52.4	24%	0.235	27%	0.273	C	S	.	.			trans	57.6	27.2	159.6	-55.1	-77.3	0	0	0	118.4	N50 K91 Q95	N50-Y52 WeakPolarHBondContact O-CD2 3.48Å; N50-Y52 WeakPolarHBondContact O-CE2 3.46Å; N50-Y52 PolarHBondContact OD1-OH 3.32Å; Y52-K91 HydrophobicContact CD1-CB 4.42Å; Y52-K91 HydrophobicContact CE1-CB 3.81Å; Y52-K91 HydrophobicContact CE1-CD 3.7Å; Y52-K91 HydrophobicContact CE1-CG 4.46Å; Y52-K91 WeakPolarHBondContact OH-CD 3.45Å; Y52-K91 PolarHBondContact OH-NZ 2.83Å; Y52-Q95 PolarHBondContact O-NE2 3.22Å
53	N	59.4	Low	74.6	Confident	119 Å²	119	55 Å²	55	64%	0.636	28%	0.275	S	S	*	.			trans	-110.4	-26.7	-169	-59.1	-41.4	0	0	0	117	S51 E57	S51-N53 PolarHBondContact O-N 3.3Å; S51-N53 PolarHBondContact O-ND2 3.18Å; S51-N53 PolarHBondContact O-OD1 3.16Å; S51-N53 VanDerWaalsContact O-OD1 3.12Å; N53-E57 WeakPolarHBondContact CA-OE2 3.44Å; N53-E57 WeakPolarHBondContact CB-OE1 3.17Å; N53-E57 VanDerWaalsContact CB-OE2 3.32Å; N53-E57 WeakPolarHBondContact CB-OE2 3.4Å; N53-E57 PolarHBondContact N-OE2 3.47Å
54	S	74.3	Confident	75.6	Confident	38 Å²	38	56.7 Å²	56.7	27%	0.266	28%	0.284	S	S	.	.			trans	-164.7	160.2	176.7	67.6	0	0	0	0	117.2	K56 E57 L58	S54-K56 PolarHBondContact O-N 2.91Å; S54-K56 PolarHBondContact OG-N 3.28Å; S54-E57 PolarHBondContact N-OE2 3.44Å; S54-E57 VanDerWaalsContact N-OE2 3.13Å; S54-E57 WeakPolarHBondContact O-CB 3.22Å; S54-E57 PolarHBondContact O-N 2.96Å; S54-E57 VanDerWaalsContact O-N 3.16Å; S54-E57 WeakPolarHBondContact OG-CG 3.47Å; S54-E57 PolarHBondContact OG-N 3.39Å; S54-L58 PolarHBondContact O-N 3.25Å
55	I	79.1	Confident	76.4	Confident	30 Å²	30	50.8 Å²	50.8	15%	0.154	26%	0.257	C	S	.	.	H	α-helix	trans	-58	-33.1	167.8	-63.7	169.9	0	0	0	111.2	E57 L58 W59 F92 F96 E110 W111	I55-E57 VanDerWaalsContact C-N 3.31Å; I55-E57 PolarHBondContact O-N 3.5Å; I55-L58 PolarHBondContact O-N 3.25Å; I55-W59 VanDerWaalsContact O-CD1 3.23Å; I55-W59 PolarHBondContact O-N 3.24Å; I55-F92 HydrophobicContact CG1-CZ 4.39Å; I55-F96 HydrophobicContact CD1-CE1 3.79Å; I55-F96 HydrophobicContact CD1-CZ 3.9Å; I55-F96 HydrophobicContact CG1-CE1 4.16Å; I55-F96 HydrophobicContact CG1-CZ 3.74Å; I55-E110 HydrophobicContact CD1-CB 3.93Å; I55-W111 HydrophobicContact CD1-CB 4.18Å; I55-W111 HydrophobicContact CG1-CB 4.2Å
56	K	82.1	Confident	76.8	Confident	169 Å²	169	53.7 Å²	53.7	74%	0.735	28%	0.275	S	S	*	.	H	α-helix	trans	-62.3	-39.2	176.9	-67.7	-178.6	179.2	178	0	111.8	S54 L58 W59 L60	S54-K56 PolarHBondContact O-N 2.91Å; S54-K56 PolarHBondContact OG-N 3.28Å; K56-L58 VanDerWaalsContact C-N 3.34Å; K56-L58 PolarHBondContact O-N 3.13Å; K56-W59 PolarHBondContact O-N 3.36Å; K56-L60 WeakPolarHBondContact O-CG 3.44Å; K56-L60 PolarHBondContact O-N 2.93Å
57	E	81.2	Confident	77.3	Confident	47 Å²	47	56.2 Å²	56.2	22%	0.22	30%	0.295	C	S	.	.	H	α-helix	trans	-64	-36.9	176.4	-78.1	172	176	0	0	112.5	I48 N53 S54 I55 W59 L60 A61	I48-E57 HydrophobicContact CG2-CB 3.92Å; I48-E57 WeakPolarHBondContact CG2-O 3.47Å; N53-E57 WeakPolarHBondContact CA-OE2 3.44Å; N53-E57 WeakPolarHBondContact CB-OE1 3.17Å; N53-E57 VanDerWaalsContact CB-OE2 3.32Å; N53-E57 WeakPolarHBondContact CB-OE2 3.4Å; N53-E57 PolarHBondContact N-OE2 3.47Å; S54-E57 PolarHBondContact N-OE2 3.44Å; S54-E57 VanDerWaalsContact N-OE2 3.13Å; S54-E57 WeakPolarHBondContact O-CB 3.22Å; S54-E57 PolarHBondContact O-N 2.96Å; S54-E57 VanDerWaalsContact O-N 3.16Å; S54-E57 WeakPolarHBondContact OG-CG 3.47Å; S54-E57 PolarHBondContact OG-N 3.39Å; I55-E57 VanDerWaalsContact C-N 3.31Å; I55-E57 PolarHBondContact O-N 3.5Å; E57-W59 VanDerWaalsContact C-N 3.35Å; E57-L60 WeakPolarHBondContact O-CB 3.23Å; E57-L60 PolarHBondContact O-N 3.12Å; E57-A61 WeakPolarHBondContact O-CB 3.42Å; E57-A61 PolarHBondContact O-N 2.8Å
58	L	83.2	Confident	77.6	Confident	13 Å²	13	60.4 Å²	60.4	7%	0.068	31%	0.31	C	S	.	.	H	α-helix	trans	-66.6	-36.4	175.1	-68.5	178.5	0	0	0	112.5	S54 I55 K56 A61 H62 F92 S114 I115 L118	S54-L58 PolarHBondContact O-N 3.25Å; I55-L58 PolarHBondContact O-N 3.25Å; K56-L58 VanDerWaalsContact C-N 3.34Å; K56-L58 PolarHBondContact O-N 3.13Å; L58-A61 WeakPolarHBondContact O-CB 3.32Å; L58-A61 PolarHBondContact O-N 3.22Å; L58-H62 PolarHBondContact O-N 3.39Å; L58-F92 HydrophobicContact CD1-CD1 4.27Å; L58-F92 HydrophobicContact CD1-CE1 3.42Å; L58-F92 VanDerWaalsContact CD1-CE1 3.42Å; L58-F92 HydrophobicContact CD1-CE2 4.15Å; L58-F92 HydrophobicContact CD1-CZ 3.37Å; L58-F92 HydrophobicContact CG-CZ 4.3Å; L58-S114 WeakPolarHBondContact CD1-OG 3.37Å; L58-I115 HydrophobicContact CD1-CG1 4.13Å; L58-L118 HydrophobicContact CD2-CD2 4.33Å
59	W	86	Confident	77.9	Confident	36 Å²	36	59.6 Å²	59.6	14%	0.136	31%	0.305	C	S	.	.	H	α-helix	trans	-70.7	-34	171.9	-70	114.5	0	0	0	112.6	I55 K56 E57 H62 E63 L258 Y299 K302	I55-W59 VanDerWaalsContact O-CD1 3.23Å; I55-W59 PolarHBondContact O-N 3.24Å; K56-W59 PolarHBondContact O-N 3.36Å; E57-W59 VanDerWaalsContact C-N 3.35Å; W59-H62 HydrophobicContact CE3-CB 4.22Å; W59-H62 WeakPolarHBondContact O-CB 3.18Å; W59-H62 PolarHBondContact O-N 3.25Å; W59-E63 PolarHBondContact O-N 3.46Å; W59-E63 VanDerWaalsContact O-N 3.12Å; W59-L258 HydrophobicContact CH2-CD1 4Å; W59-L258 HydrophobicContact CZ3-CD1 3.9Å; W59-Y299 AromaticContact CH2-CD1 3.96Å; W59-Y299 HydrophobicContact CH2-CD1 3.96Å; W59-Y299 HydrophobicContact CH2-CE1 4.11Å; W59-K302 HydrophobicContact CZ2-CG 4.36Å
60	L	84.7	Confident	77.7	Confident	92 Å²	92	59.5 Å²	59.5	48%	0.482	31%	0.307	S	S	.	.	H	α-helix	trans	-64.2	-41.8	169.8	-71.8	167.8	0	0	0	111.2	K56 E57 H62 E63 L64	K56-L60 WeakPolarHBondContact O-CG 3.44Å; K56-L60 PolarHBondContact O-N 2.93Å; E57-L60 WeakPolarHBondContact O-CB 3.23Å; E57-L60 PolarHBondContact O-N 3.12Å; L60-H62 VanDerWaalsContact C-N 3.26Å; L60-H62 PolarHBondContact O-N 3.49Å; L60-E63 PolarHBondContact O-N 3.43Å; L60-L64 VanDerWaalsContact O-CG 3.32Å; L60-L64 WeakPolarHBondContact O-CG 3.46Å; L60-L64 PolarHBondContact O-N 3.5Å; L60-L64 VanDerWaalsContact O-N 3.13Å
61	A	84	Confident	77.8	Confident	0 Å²	0	64.4 Å²	64.4	0%	0	33%	0.333	C	S	.	.	H	α-helix	trans	-58.9	-40	173	0	0	0	0	0	111.4	L45 I48 E57 L58 E63 L64 V65 L118	L45-A61 HydrophobicContact CD1-CB 3.61Å; L45-A61 WeakPolarHBondContact CD1-O 3.34Å; I48-A61 HydrophobicContact CB-CB 4.46Å; I48-A61 HydrophobicContact CG2-CB 3.8Å; E57-A61 WeakPolarHBondContact O-CB 3.42Å; E57-A61 PolarHBondContact O-N 2.8Å; L58-A61 WeakPolarHBondContact O-CB 3.32Å; L58-A61 PolarHBondContact O-N 3.22Å; A61-E63 PolarHBondContact O-N 3.1Å; A61-L64 PolarHBondContact O-N 3.48Å; A61-V65 VanDerWaalsContact O-CG2 3.3Å; A61-V65 WeakPolarHBondContact O-CG2 3.3Å; A61-V65 PolarHBondContact O-N 3.46Å; A61-L118 HydrophobicContact CB-CD1 4.14Å; A61-L118 HydrophobicContact CB-CD2 4.15Å
62	H	87.7	Confident	78.4	Confident	11 Å²	11	64.1 Å²	64.1	5%	0.051	33%	0.328	C	S	.	.	H	α-helix	trans	-60.3	-42.1	176.2	173.8	-79.5	0	0	0	112.2	L58 W59 L60 L64 G117 L118 R121 A257	L58-H62 PolarHBondContact O-N 3.39Å; W59-H62 HydrophobicContact CE3-CB 4.22Å; W59-H62 WeakPolarHBondContact O-CB 3.18Å; W59-H62 PolarHBondContact O-N 3.25Å; L60-H62 VanDerWaalsContact C-N 3.26Å; L60-H62 PolarHBondContact O-N 3.49Å; H62-L64 PolarHBondContact O-N 3.45Å; H62-G117 PolarHBondContact CD2-O 3.3Å; H62-L118 HydrophobicContact CB-CD1 4.16Å; H62-R121 PolarHBondContact CE1-NH1 3.39Å; H62-R121 VanDerWaalsContact CE1-NH1 3.35Å; H62-R121 WeakPolarHBondContact O-CG 3.5Å; H62-A257 PolarHBondContact CE1-O 3.19Å; H62-A257 PolarHBondContact NE2-O 2.99Å
63	E	85.2	Confident	79.3	Confident	141 Å²	141	66.6 Å²	66.6	66%	0.659	34%	0.336	S	S	*	.	H	α-helix	trans	-69.4	-31.7	177.6	-69.4	178.4	-179.9	0	0	113.2	W59 L60 A61 V65	W59-E63 PolarHBondContact O-N 3.46Å; W59-E63 VanDerWaalsContact O-N 3.12Å; L60-E63 PolarHBondContact O-N 3.43Å; A61-E63 PolarHBondContact O-N 3.1Å; E63-V65 VanDerWaalsContact C-N 3.33Å; E63-V65 PolarHBondContact O-N 3.07Å
64	L	85.6	Confident	80.2	Confident	70 Å²	70	61.6 Å²	61.6	37%	0.366	31%	0.31	S	S	.	.	H	α-helix	trans	-79.3	-8.2	-177.6	-69.5	171.2	0	0	0	114.6	L45 I48 L60 A61 H62 T66 H69	L45-L64 HydrophobicContact CD1-CB 4.44Å; I48-L64 HydrophobicContact CD1-CD1 3.4Å; L60-L64 VanDerWaalsContact O-CG 3.32Å; L60-L64 WeakPolarHBondContact O-CG 3.46Å; L60-L64 PolarHBondContact O-N 3.5Å; L60-L64 VanDerWaalsContact O-N 3.13Å; A61-L64 PolarHBondContact O-N 3.48Å; H62-L64 PolarHBondContact O-N 3.45Å; L64-T66 PolarHBondContact O-N 3.38Å; L64-T66 VanDerWaalsContact O-N 3.1Å; L64-H69 PolarHBondContact O-CE1 2.99Å
65	V	84.9	Confident	80.2	Confident	10 Å²	10	66.2 Å²	66.2	6%	0.061	33%	0.327	C	S	.	.			trans	-68.1	110.9	-178.5	-178.8	0	0	0	0	111.1	L45 A61 E63 L118 R121 L122 C125	L45-V65 HydrophobicContact CD1-CG2 4.32Å; L45-V65 HydrophobicContact CD2-CG2 4.35Å; A61-V65 VanDerWaalsContact O-CG2 3.3Å; A61-V65 WeakPolarHBondContact O-CG2 3.3Å; A61-V65 PolarHBondContact O-N 3.46Å; E63-V65 VanDerWaalsContact C-N 3.33Å; E63-V65 PolarHBondContact O-N 3.07Å; V65-L118 HydrophobicContact CG2-CD1 3.88Å; V65-R121 HydrophobicContact CB-CG 3.79Å; V65-R121 HydrophobicContact CG1-CG 4.22Å; V65-R121 HydrophobicContact CG2-CB 4.43Å; V65-R121 HydrophobicContact CG2-CG 3.95Å; V65-L122 HydrophobicContact CG1-CD2 4.05Å; V65-L122 HydrophobicContact CG2-CD2 4.01Å; V65-L122 HydrophobicContact CG2-CG 4.34Å; V65-C125 HydrophobicContact CG1-CB 4.26Å
66	T	82.5	Confident	80.1	Confident	64 Å²	64	69.9 Å²	69.9	39%	0.393	34%	0.344	S	S	.	.			trans	-104	168.3	168.8	70.3	0	0	0	0	112.1	L64 E68 H69 G126	L64-T66 PolarHBondContact O-N 3.38Å; L64-T66 VanDerWaalsContact O-N 3.1Å; T66-E68 PolarHBondContact O-N 2.99Å; T66-H69 PolarHBondContact N-CE1 3.5Å; T66-H69 VanDerWaalsContact N-CE1 3.32Å; T66-H69 PolarHBondContact N-ND1 3.22Å; T66-H69 PolarHBondContact O-N 3.22Å; T66-H69 PolarHBondContact O-ND1 3.35Å; T66-H69 PolarHBondContact OG1-CE1 3.17Å; T66-H69 PolarHBondContact OG1-ND1 3.49Å; T66-G126 WeakPolarHBondContact O-CA 3.1Å
67	S	79.7	Confident	79.9	Confident	69 Å²	69	63.1 Å²	63.1	48%	0.483	32%	0.316	S	S	.	.	G	3₁₀ helix	trans	-66.5	-13.9	178.7	55.3	0	0	0	0	115.4	H69 C125	S67-H69 PolarHBondContact O-N 2.89Å; S67-C125 VanDerWaalsContact CA-O 3.24Å; S67-C125 WeakPolarHBondContact CA-O 3.41Å
68	E	77.8	Confident	79.9	Confident	157 Å²	157	61 Å²	61	73%	0.734	31%	0.308	S	S	*	.	G	3₁₀ helix	trans	-71.7	-22.8	-179.2	-61.7	-176.2	165.5	0	0	112.4	T66 G70	T66-E68 PolarHBondContact O-N 2.99Å; E68-G70 VanDerWaalsContact C-N 3.28Å; E68-G70 PolarHBondContact O-N 3.08Å
69	H	76.2	Confident	79.9	Confident	15 Å²	15	60.8 Å²	60.8	7%	0.069	31%	0.306	C	S	.	.	G	3₁₀ helix	trans	-69.4	-20.3	-176.7	-63.5	114.2	0	0	0	114.5	L43 L64 T66 S67 N71 M72 L81	L43-H69 VanDerWaalsContact CD2-CD2 3.42Å; L43-H69 WeakPolarHBondContact CD2-CD2 3.44Å; L64-H69 PolarHBondContact O-CE1 2.99Å; T66-H69 PolarHBondContact N-CE1 3.5Å; T66-H69 VanDerWaalsContact N-CE1 3.32Å; T66-H69 PolarHBondContact N-ND1 3.22Å; T66-H69 PolarHBondContact O-N 3.22Å; T66-H69 PolarHBondContact O-ND1 3.35Å; T66-H69 PolarHBondContact OG1-CE1 3.17Å; T66-H69 PolarHBondContact OG1-ND1 3.49Å; S67-H69 PolarHBondContact O-N 2.89Å; H69-N71 VanDerWaalsContact C-N 3.32Å; H69-N71 PolarHBondContact O-N 3.35Å; H69-M72 PolarHBondContact O-N 3.29Å; H69-L81 HydrophobicContact CB-CD1 3.68Å
70	G	68.5	Low	79.9	Confident	10 Å²	10	59.2 Å²	59.2	10%	0.103	30%	0.301	C	S	.	.	G	3₁₀ helix	trans	-62.6	-34.2	-170.7	0	0	0	0	0	115.3	E68 G126	E68-G70 VanDerWaalsContact C-N 3.28Å; E68-G70 PolarHBondContact O-N 3.08Å; G70-G126 WeakPolarHBondContact CA-O 3.45Å; G70-G126 PolarHBondContact N-O 3Å
71	N	69.6	Low	79.8	Confident	156 Å²	156	54.9 Å²	54.9	83%	0.834	28%	0.278	S	S	*	.	G	3₁₀ helix	trans	-95.8	-4.2	-174.5	-67.5	-24.9	0	0	0	113.1	H69 R73	H69-N71 VanDerWaalsContact C-N 3.32Å; H69-N71 PolarHBondContact O-N 3.35Å; N71-R73 PolarHBondContact O-N 2.69Å
72	M	77.3	Confident	80	Confident	40 Å²	40	55 Å²	55	20%	0.197	28%	0.279	C	S	.	.			trans	-75	130.2	-175.7	-59	-169.6	66.4	0	0	110.7	F40 L43 H69	F40-M72 HydrophobicContact CB-CE 4.43Å; F40-M72 HydrophobicContact CD2-CB 3.69Å; F40-M72 HydrophobicContact CD2-CE 3.7Å; F40-M72 HydrophobicContact CE2-CB 3.4Å; F40-M72 VanDerWaalsContact CE2-CB 3.4Å; F40-M72 HydrophobicContact CE2-CE 4.33Å; F40-M72 HydrophobicContact CG-CE 4.31Å; L43-M72 HydrophobicContact CD1-CE 3.88Å; L43-M72 HydrophobicContact CD1-SD 3.74Å; L43-M72 HydrophobicContact CD2-CE 4.41Å; L43-M72 HydrophobicContact CD2-SD 4.06Å; H69-M72 PolarHBondContact O-N 3.29Å
73	R	76.7	Confident	79.9	Confident	111 Å²	111	54.5 Å²	54.5	42%	0.419	28%	0.276	S	S	.	.	B	Isolated β-bridge	trans	-133.4	143.2	173.3	-67.2	-179.2	179.9	-130.6	5.4	109.1	N71 T80 Q133	N71-R73 PolarHBondContact O-N 2.69Å; R73-T80 HydrophobicContact CG-CG2 4.06Å; R73-Q133 PolarHBondContact NH1-O 3.33Å
74	D	77.5	Confident	79.9	Confident	14 Å²	14	48.2 Å²	48.2	8%	0.075	25%	0.247	C	C	.	.			trans	-73.8	128.8	167.7	172.3	37.8	0	0	0	110.1	F40 E76 T77 G78 N79 Y84	F40-D74 HydrophobicContact CD1-CB 4.41Å; D74-E76 PolarHBondContact O-N 3.47Å; D74-T77 WeakPolarHBondContact OD2-CB 3.38Å; D74-T77 WeakPolarHBondContact OD2-CG2 3.49Å; D74-T77 PolarHBondContact OD2-N 3.45Å; D74-T77 PolarHBondContact OD2-OG1 3.31Å; D74-G78 WeakPolarHBondContact O-CA 3.34Å; D74-G78 PolarHBondContact O-N 3.37Å; D74-N79 PolarHBondContact N-O 3.2Å; D74-Y84 HydrophobicContact CB-CE2 3.72Å; D74-Y84 VanDerWaalsContact CG-OH 3.29Å; D74-Y84 PolarHBondContact OD2-OH 3.4Å
75	E	75.2	Confident	79.9	Confident	136 Å²	136	45 Å²	45	64%	0.636	23%	0.23	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.5	-35.1	-175.2	-66.4	-166.9	172.8	0	0	112.7	N38	N38-E75 PolarHBondContact ND2-OE1 3.38Å; N38-E75 PolarHBondContact ND2-OE2 3.32Å; N38-E75 PolarHBondContact OD1-OE1 3.49Å
76	E	76.1	Confident	80	Confident	107 Å²	107	44.5 Å²	44.5	50%	0.5	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.7	-47.2	-177.6	-68.6	-176.6	178	0	0	111.5	D74 N135	D74-E76 PolarHBondContact O-N 3.47Å; E76-N135 PolarHBondContact O-ND2 2.99Å
77	T	77.2	Confident	80.1	Confident	26 Å²	26	42.3 Å²	42.3	16%	0.16	21%	0.213	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101.3	-18.6	-171.5	63.5	0	0	0	0	113.9	D74 N79 N135	D74-T77 WeakPolarHBondContact OD2-CB 3.38Å; D74-T77 WeakPolarHBondContact OD2-CG2 3.49Å; D74-T77 PolarHBondContact OD2-N 3.45Å; D74-T77 PolarHBondContact OD2-OG1 3.31Å; T77-N79 VanDerWaalsContact CB-ND2 3.35Å; T77-N79 WeakPolarHBondContact CB-ND2 3.42Å; T77-N79 PolarHBondContact O-N 2.87Å; T77-N79 VanDerWaalsContact OG1-CB 3.26Å; T77-N79 WeakPolarHBondContact OG1-CB 3.33Å; T77-N79 VanDerWaalsContact OG1-CG 3.27Å; T77-N79 PolarHBondContact OG1-N 3Å; T77-N79 PolarHBondContact OG1-ND2 3.47Å; T77-N135 VanDerWaalsContact C-ND2 3.31Å; T77-N135 WeakPolarHBondContact O-CB 3.28Å; T77-N135 PolarHBondContact O-N 3.19Å
78	G	82.1	Confident	80.2	Confident	4 Å²	4	39.6 Å²	39.6	4%	0.041	19%	0.194	C	C	.	.			trans	71.4	5.7	-169.9	0	0	0	0	0	113.4	D74 N135	D74-G78 WeakPolarHBondContact O-CA 3.34Å; D74-G78 PolarHBondContact O-N 3.37Å; G78-N135 WeakPolarHBondContact CA-OD1 3.31Å; G78-N135 PolarHBondContact N-ND2 3.32Å
79	N	83.6	Confident	80.5	Confident	7 Å²	7	32.2 Å²	32.2	4%	0.037	16%	0.159	C	C	.	.			trans	-70.6	133.5	-177.1	-73.1	-29.5	0	0	0	110.7	D74 T77 H83 Y84 N134	D74-N79 PolarHBondContact N-O 3.2Å; T77-N79 VanDerWaalsContact CB-ND2 3.35Å; T77-N79 WeakPolarHBondContact CB-ND2 3.42Å; T77-N79 PolarHBondContact O-N 2.87Å; T77-N79 VanDerWaalsContact OG1-CB 3.26Å; T77-N79 WeakPolarHBondContact OG1-CB 3.33Å; T77-N79 VanDerWaalsContact OG1-CG 3.27Å; T77-N79 PolarHBondContact OG1-N 3Å; T77-N79 PolarHBondContact OG1-ND2 3.47Å; N79-H83 HydrophobicContact CB-CB 3.72Å; N79-Y84 HydrophobicContact CB-CD2 3.81Å; N79-Y84 HydrophobicContact CB-CE2 3.53Å; N79-N134 VanDerWaalsContact OD1-CB 3.23Å; N79-N134 WeakPolarHBondContact OD1-CB 3.34Å; N79-N134 PolarHBondContact OD1-ND2 3.27Å
80	T	85.2	Confident	80.6	Confident	4 Å²	4	32.3 Å²	32.3	3%	0.025	16%	0.161	C	C	.	.	B	Isolated β-bridge	trans	-81.6	170.7	166.1	66.5	0	0	0	0	110.3	R73 L82 H83 Y84 A132	R73-T80 HydrophobicContact CG-CG2 4.06Å; T80-L82 PolarHBondContact O-N 2.97Å; T80-L82 PolarHBondContact OG1-N 3.11Å; T80-H83 PolarHBondContact N-ND1 2.97Å; T80-H83 WeakPolarHBondContact O-CB 3.27Å; T80-H83 PolarHBondContact O-N 3.44Å; T80-H83 PolarHBondContact OG1-ND1 3.25Å; T80-Y84 WeakPolarHBondContact O-CD2 3.39Å; T80-Y84 PolarHBondContact O-N 3.37Å; T80-Y84 VanDerWaalsContact O-N 3.09Å; T80-A132 HydrophobicContact CG2-CB 3.84Å
81	L	83.9	Confident	81	Confident	0 Å²	0	36.6 Å²	36.6	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-55	-34.7	173.4	-72	165.5	0	0	0	113	F40 L43 L45 H69 Y84 L85 L122	F40-L81 HydrophobicContact CE1-CD2 4.04Å; F40-L81 HydrophobicContact CE2-CD2 4.42Å; F40-L81 HydrophobicContact CE2-CG 4.25Å; F40-L81 HydrophobicContact CZ-CD2 3.66Å; F40-L81 HydrophobicContact CZ-CG 3.75Å; L43-L81 HydrophobicContact CD2-CD1 4.15Å; L43-L81 HydrophobicContact CD2-CD2 4.2Å; L45-L81 HydrophobicContact CD2-CD1 3.99Å; H69-L81 HydrophobicContact CB-CD1 3.68Å; L81-Y84 PolarHBondContact O-N 3.47Å; L81-L85 PolarHBondContact O-N 3.01Å; L81-L122 HydrophobicContact CB-CD2 4.32Å; L81-L122 HydrophobicContact CD1-CD2 4.39Å
82	L	86.7	Confident	81.4	Confident	3 Å²	3	29.8 Å²	29.8	2%	0.016	14%	0.14	C	C	.	.	H	α-helix	trans	-64.1	-40.7	173.9	-74.2	172.3	0	0	0	112.8	T80 Y84 L85 I86 V119 L122 V123 C128 V140	T80-L82 PolarHBondContact O-N 2.97Å; T80-L82 PolarHBondContact OG1-N 3.11Å; L82-Y84 VanDerWaalsContact C-N 3.33Å; L82-L85 PolarHBondContact O-N 3.25Å; L82-I86 WeakPolarHBondContact O-CG1 3.49Å; L82-I86 PolarHBondContact O-N 3.26Å; L82-I86 VanDerWaalsContact O-N 3.13Å; L82-V119 HydrophobicContact CD2-CG1 4.38Å; L82-L122 HydrophobicContact CD2-CB 3.79Å; L82-L122 HydrophobicContact CD2-CD1 3.84Å; L82-L122 HydrophobicContact CD2-CG 4.49Å; L82-L122 HydrophobicContact CG-CB 4.29Å; L82-L122 HydrophobicContact CG-CD1 4.4Å; L82-V123 HydrophobicContact CD1-CG2 3.88Å; L82-V123 HydrophobicContact CD2-CG2 4.28Å; L82-C128 HydrophobicContact CD1-CB 3.53Å; L82-C128 HydrophobicContact CG-CB 3.95Å; L82-V140 HydrophobicContact CB-CG1 3.94Å
83	H	87.4	Confident	81.3	Confident	0 Å²	0	28 Å²	28	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-63.4	-44.2	175.7	-68.3	83.8	0	0	0	110.3	N79 T80 L85 I86 I87 A132 N138 L143	N79-H83 HydrophobicContact CB-CB 3.72Å; T80-H83 PolarHBondContact N-ND1 2.97Å; T80-H83 WeakPolarHBondContact O-CB 3.27Å; T80-H83 PolarHBondContact O-N 3.44Å; T80-H83 PolarHBondContact OG1-ND1 3.25Å; H83-L85 PolarHBondContact O-N 2.79Å; H83-I86 PolarHBondContact O-N 2.94Å; H83-I87 WeakPolarHBondContact O-CB 3.48Å; H83-I87 WeakPolarHBondContact O-CD1 3.32Å; H83-I87 WeakPolarHBondContact O-CG1 3.45Å; H83-I87 PolarHBondContact O-N 3.13Å; H83-A132 PolarHBondContact CE1-O 3.4Å; H83-A132 PolarHBondContact NE2-O 3Å; H83-N138 PolarHBondContact NE2-O 3.19Å; H83-L143 HydrophobicContact CB-CD1 4.06Å
84	Y	83.6	Confident	81.1	Confident	9 Å²	9	29.7 Å²	29.7	4%	0.035	14%	0.142	C	C	.	.	H	α-helix	trans	-61.1	-43.6	177.2	-86.3	-70.4	0	0	0	112.9	L29 P30 F40 Y46 D74 N79 T80 L81 L82 I86 I87 S88	L29-Y84 HydrophobicContact CD2-CD1 4.35Å; L29-Y84 HydrophobicContact CD2-CE1 4.21Å; P30-Y84 WeakPolarHBondContact CD-OH 3.41Å; P30-Y84 HydrophobicContact CG-CE1 4.48Å; P30-Y84 WeakPolarHBondContact CG-OH 3.38Å; F40-Y84 HydrophobicContact CD1-CE2 4.43Å; F40-Y84 AromaticContact CE1-CD2 3.71Å; F40-Y84 HydrophobicContact CE1-CD2 3.71Å; F40-Y84 AromaticContact CE1-CE2 3.65Å; F40-Y84 HydrophobicContact CE1-CE2 3.65Å; F40-Y84 HydrophobicContact CZ-CD2 4.09Å; F40-Y84 HydrophobicContact CZ-CE2 4.23Å; Y46-Y84 AromaticContact CE2-CD1 3.86Å; Y46-Y84 HydrophobicContact CE2-CD1 3.86Å; Y46-Y84 HydrophobicContact CE2-CD2 4.19Å; Y46-Y84 AromaticContact CE2-CE1 3.84Å; Y46-Y84 HydrophobicContact CE2-CE1 3.84Å; Y46-Y84 HydrophobicContact CE2-CE2 4.18Å; Y46-Y84 HydrophobicContact CE2-CG 4.04Å; D74-Y84 HydrophobicContact CB-CE2 3.72Å; D74-Y84 VanDerWaalsContact CG-OH 3.29Å; D74-Y84 PolarHBondContact OD2-OH 3.4Å; N79-Y84 HydrophobicContact CB-CD2 3.81Å; N79-Y84 HydrophobicContact CB-CE2 3.53Å; T80-Y84 WeakPolarHBondContact O-CD2 3.39Å; T80-Y84 PolarHBondContact O-N 3.37Å; T80-Y84 VanDerWaalsContact O-N 3.09Å; L81-Y84 PolarHBondContact O-N 3.47Å; L82-Y84 VanDerWaalsContact C-N 3.33Å; Y84-I86 VanDerWaalsContact C-N 3.34Å; Y84-I86 PolarHBondContact O-N 3.21Å; Y84-I87 PolarHBondContact O-N 3.12Å; Y84-S88 PolarHBondContact O-N 3.05Å; Y84-S88 PolarHBondContact O-OG 3.01Å
85	L	86.1	Confident	80.8	Confident	2 Å²	2	34 Å²	34	1%	0.01	16%	0.162	C	C	.	.	H	α-helix	trans	-58.3	-45.5	175.9	179.8	59.8	0	0	0	111.5	I49 L81 L82 H83 S88 I89 L118 V119 L122	I49-L85 HydrophobicContact CG2-CD1 4.32Å; L81-L85 PolarHBondContact O-N 3.01Å; L82-L85 PolarHBondContact O-N 3.25Å; H83-L85 PolarHBondContact O-N 2.79Å; L85-S88 PolarHBondContact O-N 3.24Å; L85-S88 PolarHBondContact O-OG 3.48Å; L85-I89 VanDerWaalsContact O-CG1 3.3Å; L85-I89 WeakPolarHBondContact O-CG1 3.32Å; L85-L118 HydrophobicContact CD1-CD2 3.8Å; L85-L118 HydrophobicContact CD2-CB 4.21Å; L85-L118 HydrophobicContact CD2-CD2 3.96Å; L85-L118 HydrophobicContact CD2-CG 3.97Å; L85-V119 HydrophobicContact CD2-CG2 3.61Å; L85-L122 HydrophobicContact CD2-CD1 4.05Å
86	I	86.7	Confident	80.5	Confident	1 Å²	1	30.1 Å²	30.1	1%	0.005	14%	0.143	C	C	.	.	H	α-helix	trans	-70.2	-38.2	-179.3	-65.2	175	0	0	0	111.6	L82 H83 Y84 S88 I89 V140 L143 I144 L147 T150 L153 L157	L82-I86 WeakPolarHBondContact O-CG1 3.49Å; L82-I86 PolarHBondContact O-N 3.26Å; L82-I86 VanDerWaalsContact O-N 3.13Å; H83-I86 PolarHBondContact O-N 2.94Å; Y84-I86 VanDerWaalsContact C-N 3.34Å; Y84-I86 PolarHBondContact O-N 3.21Å; I86-S88 PolarHBondContact O-N 3.04Å; I86-I89 PolarHBondContact O-N 3.3Å; I86-V140 HydrophobicContact CD1-CB 3.42Å; I86-V140 VanDerWaalsContact CD1-CB 3.42Å; I86-V140 HydrophobicContact CD1-CG1 3.64Å; I86-L143 HydrophobicContact CG2-CB 3.89Å; I86-I144 HydrophobicContact CD1-CD1 4.49Å; I86-I144 HydrophobicContact CD1-CG1 4.34Å; I86-I144 HydrophobicContact CG2-CG1 4.31Å; I86-L147 HydrophobicContact CG2-CD1 4.02Å; I86-L147 WeakPolarHBondContact O-CD1 3.39Å; I86-T150 HydrophobicContact CG2-CG2 4.14Å; I86-L153 HydrophobicContact CG1-CD1 4.25Å; I86-L157 HydrophobicContact CD1-CD1 3.66Å
87	I	84.5	Confident	79.6	Confident	17 Å²	17	32.7 Å²	32.7	9%	0.087	16%	0.16	C	C	.	.	H	α-helix	trans	-64.5	-28.8	177.3	-69.4	164.8	0	0	0	111.8	L29 H83 Y84 P90 L143 L147	L29-I87 HydrophobicContact CD2-CG2 4.29Å; H83-I87 WeakPolarHBondContact O-CB 3.48Å; H83-I87 WeakPolarHBondContact O-CD1 3.32Å; H83-I87 WeakPolarHBondContact O-CG1 3.45Å; H83-I87 PolarHBondContact O-N 3.13Å; Y84-I87 PolarHBondContact O-N 3.12Å; I87-P90 WeakPolarHBondContact O-CD 3.36Å; I87-L143 HydrophobicContact CD1-CD1 4.06Å; I87-L143 HydrophobicContact CG1-CD1 3.93Å; I87-L147 HydrophobicContact CG1-CD1 4.36Å
88	S	81.9	Confident	78.5	Confident	13 Å²	13	36.6 Å²	36.6	9%	0.091	18%	0.18	C	C	.	.	H	α-helix	trans	-80.7	-20.5	179.9	67.5	0	0	0	0	114.1	Y84 L85 I86 K91 F92	Y84-S88 PolarHBondContact O-N 3.05Å; Y84-S88 PolarHBondContact O-OG 3.01Å; L85-S88 PolarHBondContact O-N 3.24Å; L85-S88 PolarHBondContact O-OG 3.48Å; I86-S88 PolarHBondContact O-N 3.04Å; S88-K91 WeakPolarHBondContact O-CB 3.03Å; S88-K91 PolarHBondContact O-N 3.32Å; S88-F92 PolarHBondContact O-N 3.19Å; S88-F92 VanDerWaalsContact O-N 3.14Å
89	I	84.6	Confident	77	Confident	1 Å²	1	39.2 Å²	39.2	1%	0.005	20%	0.197	C	C	.	.	H	α-helix	trans	-53.5	-49.1	-175.9	-58.8	178.9	0	0	0	113.2	L85 I86 K91 F92 A93 W111 I115 T150 L153	L85-I89 VanDerWaalsContact O-CG1 3.3Å; L85-I89 WeakPolarHBondContact O-CG1 3.32Å; I86-I89 PolarHBondContact O-N 3.3Å; I89-K91 PolarHBondContact O-N 2.67Å; I89-K91 VanDerWaalsContact O-N 3.11Å; I89-F92 PolarHBondContact O-N 3.37Å; I89-F92 VanDerWaalsContact O-N 3.09Å; I89-A93 WeakPolarHBondContact O-CB 3.42Å; I89-A93 PolarHBondContact O-N 3.47Å; I89-W111 HydrophobicContact CG2-CZ3 4.11Å; I89-I115 HydrophobicContact CD1-CD1 4.36Å; I89-I115 HydrophobicContact CD1-CG2 3.81Å; I89-I115 HydrophobicContact CG1-CD1 4.08Å; I89-I115 HydrophobicContact CG1-CG2 4.42Å; I89-I115 HydrophobicContact CG2-CD1 4.37Å; I89-T150 HydrophobicContact CB-CG2 3.89Å; I89-T150 HydrophobicContact CD1-CG2 3.94Å; I89-T150 HydrophobicContact CG1-CG2 4.42Å; I89-T150 HydrophobicContact CG2-CG2 3.99Å; I89-L153 HydrophobicContact CD1-CD1 3.38Å
90	P	78.6	Confident	75.2	Confident	17 Å²	17	42.9 Å²	42.9	11%	0.11	22%	0.223	C	C	.	.	H	α-helix	trans	-59.7	-26.9	-179.2	-26.3	35.6	0	0	0	114.8	I87 K94 L147 P148	I87-P90 WeakPolarHBondContact O-CD 3.36Å; P90-K94 WeakPolarHBondContact O-CG 3.42Å; P90-L147 HydrophobicContact CG-CB 4.01Å; P90-L147 HydrophobicContact CG-CD1 4.47Å; P90-L147 HydrophobicContact CG-CD2 4.17Å; P90-L147 HydrophobicContact CG-CG 4.45Å; P90-P148 HydrophobicContact CB-CG 4.03Å; P90-P148 HydrophobicContact CG-CG 4.23Å
91	K	76.4	Confident	73.4	Confident	101 Å²	101	47.4 Å²	47.4	44%	0.439	25%	0.245	S	C	.	.	H	α-helix	trans	-80.2	-41	176.5	-68.6	-177.7	177.1	-173.6	0	111.1	Y52 S88 I89	Y52-K91 HydrophobicContact CD1-CB 4.42Å; Y52-K91 HydrophobicContact CE1-CB 3.81Å; Y52-K91 HydrophobicContact CE1-CD 3.7Å; Y52-K91 HydrophobicContact CE1-CG 4.46Å; Y52-K91 WeakPolarHBondContact OH-CD 3.45Å; Y52-K91 PolarHBondContact OH-NZ 2.83Å; S88-K91 WeakPolarHBondContact O-CB 3.03Å; S88-K91 PolarHBondContact O-N 3.32Å; I89-K91 PolarHBondContact O-N 2.67Å; I89-K91 VanDerWaalsContact O-N 3.11Å
92	F	77.6	Confident	71.9	Confident	13 Å²	13	49.8 Å²	49.8	6%	0.057	26%	0.257	C	S	.	.	H	α-helix	trans	-68.6	-46.4	179.2	-173.3	-113.5	0	0	0	112	I55 L58 S88 I89 K94 Q95 F96 W111 I115	I55-F92 HydrophobicContact CG1-CZ 4.39Å; L58-F92 HydrophobicContact CD1-CD1 4.27Å; L58-F92 HydrophobicContact CD1-CE1 3.42Å; L58-F92 VanDerWaalsContact CD1-CE1 3.42Å; L58-F92 HydrophobicContact CD1-CE2 4.15Å; L58-F92 HydrophobicContact CD1-CZ 3.37Å; L58-F92 HydrophobicContact CG-CZ 4.3Å; S88-F92 PolarHBondContact O-N 3.19Å; S88-F92 VanDerWaalsContact O-N 3.14Å; I89-F92 PolarHBondContact O-N 3.37Å; I89-F92 VanDerWaalsContact O-N 3.09Å; F92-K94 PolarHBondContact O-N 3.38Å; F92-Q95 WeakPolarHBondContact O-CB 3.47Å; F92-Q95 PolarHBondContact O-N 2.65Å; F92-F96 HydrophobicContact CD1-CE2 4.31Å; F92-F96 HydrophobicContact CD2-CE2 4.31Å; F92-F96 AromaticContact CE1-CE2 3.86Å; F92-F96 HydrophobicContact CE1-CE2 3.86Å; F92-F96 AromaticContact CE2-CE2 3.83Å; F92-F96 HydrophobicContact CE2-CE2 3.83Å; F92-F96 HydrophobicContact CE2-CZ 4.42Å; F92-F96 AromaticContact CZ-CE2 3.58Å; F92-F96 HydrophobicContact CZ-CE2 3.58Å; F92-F96 HydrophobicContact CZ-CZ 4.1Å; F92-W111 HydrophobicContact CD1-CE3 4.13Å; F92-W111 HydrophobicContact CE1-CB 3.7Å; F92-W111 HydrophobicContact CE1-CE3 4.31Å; F92-W111 HydrophobicContact CZ-CB 4.35Å; F92-I115 HydrophobicContact CD1-CD1 4.12Å; F92-I115 HydrophobicContact CE1-CD1 4.39Å
93	A	75.6	Confident	70	Confident	2 Å²	2	54.5 Å²	54.5	2%	0.017	28%	0.283	C	S	.	.	H	α-helix	trans	-58.3	-34.8	179.4	0	0	0	0	0	112.6	I89 Q95 F96 W111 Y149	I89-A93 WeakPolarHBondContact O-CB 3.42Å; I89-A93 PolarHBondContact O-N 3.47Å; A93-Q95 PolarHBondContact O-N 2.86Å; A93-F96 PolarHBondContact O-N 3.16Å; A93-F96 VanDerWaalsContact O-N 3.15Å; A93-W111 HydrophobicContact CB-CH2 4.05Å; A93-W111 HydrophobicContact CB-CZ2 4.36Å; A93-W111 HydrophobicContact CB-CZ3 4.3Å; A93-Y149 HydrophobicContact CB-CD1 4.44Å; A93-Y149 HydrophobicContact CB-CD2 4.03Å; A93-Y149 HydrophobicContact CB-CG 3.88Å
94	K	73.5	Confident	68.3	Low	147 Å²	147	60 Å²	60	64%	0.639	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.5	-17.2	176.5	-76.7	179.1	-179.1	-174.9	0	114.6	P90 F92 Y149	P90-K94 WeakPolarHBondContact O-CG 3.42Å; F92-K94 PolarHBondContact O-N 3.38Å; K94-Y149 HydrophobicContact CG-CE2 4.49Å
95	Q	71.2	Confident	66.8	Low	103 Å²	103	64.9 Å²	64.9	48%	0.481	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.4	-24.6	176.4	-66.6	177.3	-28.7	0	0	112.2	Y52 F92 A93	Y52-Q95 PolarHBondContact O-NE2 3.22Å; F92-Q95 WeakPolarHBondContact O-CB 3.47Å; F92-Q95 PolarHBondContact O-N 2.65Å; A93-Q95 PolarHBondContact O-N 2.86Å
96	F	67.2	Low	65.7	Low	56 Å²	56	69.8 Å²	69.8	25%	0.246	36%	0.358	C	S	.	.	S	Bend	trans	-100.2	112.5	177	-60.2	-85.6	0	0	0	107.1	I55 F92 A93 D98 W111	I55-F96 HydrophobicContact CD1-CE1 3.79Å; I55-F96 HydrophobicContact CD1-CZ 3.9Å; I55-F96 HydrophobicContact CG1-CE1 4.16Å; I55-F96 HydrophobicContact CG1-CZ 3.74Å; F92-F96 HydrophobicContact CD1-CE2 4.31Å; F92-F96 HydrophobicContact CD2-CE2 4.31Å; F92-F96 AromaticContact CE1-CE2 3.86Å; F92-F96 HydrophobicContact CE1-CE2 3.86Å; F92-F96 AromaticContact CE2-CE2 3.83Å; F92-F96 HydrophobicContact CE2-CE2 3.83Å; F92-F96 HydrophobicContact CE2-CZ 4.42Å; F92-F96 AromaticContact CZ-CE2 3.58Å; F92-F96 HydrophobicContact CZ-CE2 3.58Å; F92-F96 HydrophobicContact CZ-CZ 4.1Å; A93-F96 PolarHBondContact O-N 3.16Å; A93-F96 VanDerWaalsContact O-N 3.15Å; F96-D98 PolarHBondContact O-N 3.46Å; F96-W111 HydrophobicContact CD2-CB 4.1Å; F96-W111 HydrophobicContact CD2-CG 4.13Å; F96-W111 HydrophobicContact CE2-CB 4.03Å; F96-W111 HydrophobicContact CG-CB 4.49Å; F96-W111 AromaticContact CG-CD1 3.99Å; F96-W111 HydrophobicContact CG-CG 4.35Å; F96-W111 HydrophobicContact CZ-CB 4.35Å
97	N	57.1	Low	64.8	Low	161 Å²	161	76.6 Å²	76.6	86%	0.861	39%	0.388	S	S	*	.	S	Bend	trans	-61.5	-3.6	179.3	-82.6	-20.6	0	0	0	113.7	C99	N97-C99 VanDerWaalsContact C-N 3.3Å; N97-C99 PolarHBondContact O-N 3.06Å
98	D	55.4	Low	64.4	Low	107 Å²	107	77 Å²	77	57%	0.572	39%	0.388	S	S	*	.			trans	-78.4	76.3	172.1	-68.3	-27.7	0	0	0	111.2	F96	F96-D98 PolarHBondContact O-N 3.46Å
99	C	50.6	Low	64.2	Low	59 Å²	59	77.9 Å²	77.9	40%	0.399	39%	0.394	S	S	.	.			trans	-88.5	18.7	168.6	-76.9	0	0	0	0	112.5	N97 M101 Y149	N97-C99 VanDerWaalsContact C-N 3.3Å; N97-C99 PolarHBondContact O-N 3.06Å; C99-M101 PolarHBondContact O-N 2.98Å; C99-Y149 HydrophobicContact CB-CE1 4.19Å; C99-Y149 VanDerWaalsContact SG-CE1 3.51Å
100	S	45.2	Very low	63.9	Low	84 Å²	84	84.8 Å²	84.8	59%	0.587	43%	0.426	S	S	*	.			trans	-65.2	118.3	174	55.5	0	0	0	0	109	I102	S100-I102 PolarHBondContact O-N 3.08Å
101	M	48.2	Very low	64.1	Low	99 Å²	99	84.9 Å²	84.9	49%	0.488	42%	0.424	S	S	.	.			trans	-48.6	123.7	171.9	-69	-81	121.6	0	0	108.9	C99 N103	C99-M101 PolarHBondContact O-N 2.98Å; M101-N103 PolarHBondContact O-N 3.45Å
102	I	51.7	Low	64.5	Low	50 Å²	50	80 Å²	80	26%	0.256	40%	0.403	S	S	.	.			trans	-59.6	101.6	175.6	-59.3	174.5	0	0	0	106.8	S100 Y108 P109 A112 F152	S100-I102 PolarHBondContact O-N 3.08Å; I102-Y108 HydrophobicContact CD1-CD1 4.21Å; I102-Y108 HydrophobicContact CD1-CE1 4.38Å; I102-Y108 HydrophobicContact CD1-CG 4.42Å; I102-Y108 HydrophobicContact CG2-CD2 4.08Å; I102-Y108 HydrophobicContact CG2-CE2 3.97Å; I102-P109 HydrophobicContact CD1-CG 4.25Å; I102-P109 HydrophobicContact CG1-CG 4.38Å; I102-A112 HydrophobicContact CD1-CB 4.09Å; I102-F152 HydrophobicContact CD1-CB 3.78Å; I102-F152 HydrophobicContact CD1-CD1 4.11Å; I102-F152 HydrophobicContact CD1-CD2 4.4Å; I102-F152 HydrophobicContact CD1-CG 3.85Å
103	N	48	Very low	65	Low	103 Å²	103	79.9 Å²	79.9	55%	0.551	40%	0.404	S	S	*	.			trans	-75.6	146.4	173.7	-78	-33	0	0	0	108.8	M101 N105 Q106	M101-N103 PolarHBondContact O-N 3.45Å; N103-N105 PolarHBondContact O-N 2.81Å; N103-Q106 PolarHBondContact O-N 3.32Å
104	E	50.5	Low	65.5	Low	115 Å²	115	79.8 Å²	79.8	54%	0.537	40%	0.403	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.2	-15.2	-165.8	-66.1	174.5	167.1	0	0	116.4	R289	E104-R289 PolarHBondContact O-NH2 3.47Å
105	N	52.8	Low	66.3	Low	112 Å²	112	72.9 Å²	72.9	60%	0.599	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-126.4	16.4	-176.4	-64.7	-25.2	0	0	0	113.9	N103	N103-N105 PolarHBondContact O-N 2.81Å
106	Q	62	Low	67.1	Low	105 Å²	105	68 Å²	68	49%	0.491	35%	0.35	S	S	.	.	S	Bend	trans	-105.9	145.6	173.6	-77	178.3	-26.6	0	0	110.9	N103	N103-Q106 PolarHBondContact O-N 3.32Å
107	F	68.8	Low	68.2	Low	143 Å²	143	65.3 Å²	65.3	63%	0.627	34%	0.338	S	S	*	.	P	Polyproline II helix	trans	-53	139.9	172.5	-68.6	-81.3	0	0	0	110.3
108	Y	75.1	Confident	69.7	Low	26 Å²	26	57.7 Å²	57.7	10%	0.102	30%	0.297	C	S	.	.	P	Polyproline II helix	trans	-62.9	136.3	174.1	-85.3	-133.6	0	0	0	108.8	I102 A112 S113 V116 F152 H156 I297 V298	I102-Y108 HydrophobicContact CD1-CD1 4.21Å; I102-Y108 HydrophobicContact CD1-CE1 4.38Å; I102-Y108 HydrophobicContact CD1-CG 4.42Å; I102-Y108 HydrophobicContact CG2-CD2 4.08Å; I102-Y108 HydrophobicContact CG2-CE2 3.97Å; Y108-A112 HydrophobicContact CD1-CB 4.05Å; Y108-S113 WeakPolarHBondContact CB-OG 3.49Å; Y108-S113 PolarHBondContact O-OG 3.07Å; Y108-V116 HydrophobicContact CD1-CG2 4.13Å; Y108-V116 HydrophobicContact CE1-CG2 3.86Å; Y108-F152 HydrophobicContact CD1-CD2 4.33Å; Y108-F152 AromaticContact CE1-CD2 3.65Å; Y108-F152 HydrophobicContact CE1-CD2 3.65Å; Y108-F152 HydrophobicContact CE1-CE2 4.28Å; Y108-F152 HydrophobicContact CE1-CG 4.43Å; Y108-H156 AromaticContact CE1-NE2 3.91Å; Y108-H156 AromaticContact CZ-NE2 3.79Å; Y108-H156 PolarHBondContact OH-NE2 2.74Å; Y108-H156 VanDerWaalsContact OH-NE2 3.15Å; Y108-I297 HydrophobicContact CD2-CG2 4.35Å; Y108-I297 PolarHBondContact N-O 2.81Å; Y108-I297 VanDerWaalsContact N-O 3.08Å; Y108-V298 HydrophobicContact CD2-CG2 4.5Å; Y108-V298 HydrophobicContact CE2-CG2 4.37Å
109	P	77.7	Confident	71.4	Confident	32 Å²	32	52.8 Å²	52.8	21%	0.208	27%	0.271	C	S	.	.	P	Polyproline II helix	trans	-61.1	143.8	171.2	26.4	-32.5	0	0	0	108.9	I102 W111 A112 S113	I102-P109 HydrophobicContact CD1-CG 4.25Å; I102-P109 HydrophobicContact CG1-CG 4.38Å; P109-W111 HydrophobicContact CG-CZ2 4.21Å; P109-W111 PolarHBondContact O-N 3.12Å; P109-A112 HydrophobicContact CG-CB 3.81Å; P109-A112 WeakPolarHBondContact O-CA 3.44Å; P109-A112 WeakPolarHBondContact O-CB 3.46Å; P109-A112 PolarHBondContact O-N 3.31Å; P109-S113 PolarHBondContact O-N 3.48Å; P109-S113 VanDerWaalsContact O-N 3.07Å; P109-S113 PolarHBondContact O-OG 2.98Å
110	E	79.3	Confident	73.3	Confident	146 Å²	146	51 Å²	51	68%	0.682	26%	0.256	S	S	*	.	H	α-helix	trans	-52.1	-35.3	-169.8	-66.5	-168.9	161.7	0	0	113.7	I55 S113 S114	I55-E110 HydrophobicContact CD1-CB 3.93Å; E110-S113 WeakPolarHBondContact O-CB 3.2Å; E110-S113 PolarHBondContact O-N 3.4Å; E110-S114 PolarHBondContact O-N 2.9Å; E110-S114 VanDerWaalsContact O-N 3.08Å
111	W	83.3	Confident	75.4	Confident	18 Å²	18	48.9 Å²	48.9	7%	0.068	24%	0.236	C	C	.	.	H	α-helix	trans	-64.4	-42.4	177.2	74.4	-103.8	0	0	0	111.6	I55 I89 F92 A93 F96 P109 S114 I115 F152	I55-W111 HydrophobicContact CD1-CB 4.18Å; I55-W111 HydrophobicContact CG1-CB 4.2Å; I89-W111 HydrophobicContact CG2-CZ3 4.11Å; F92-W111 HydrophobicContact CD1-CE3 4.13Å; F92-W111 HydrophobicContact CE1-CB 3.7Å; F92-W111 HydrophobicContact CE1-CE3 4.31Å; F92-W111 HydrophobicContact CZ-CB 4.35Å; A93-W111 HydrophobicContact CB-CH2 4.05Å; A93-W111 HydrophobicContact CB-CZ2 4.36Å; A93-W111 HydrophobicContact CB-CZ3 4.3Å; F96-W111 HydrophobicContact CD2-CB 4.1Å; F96-W111 HydrophobicContact CD2-CG 4.13Å; F96-W111 HydrophobicContact CE2-CB 4.03Å; F96-W111 HydrophobicContact CG-CB 4.49Å; F96-W111 AromaticContact CG-CD1 3.99Å; F96-W111 HydrophobicContact CG-CG 4.35Å; F96-W111 HydrophobicContact CZ-CB 4.35Å; P109-W111 HydrophobicContact CG-CZ2 4.21Å; P109-W111 PolarHBondContact O-N 3.12Å; W111-S114 PolarHBondContact O-N 3.27Å; W111-S114 PolarHBondContact O-OG 3.44Å; W111-I115 HydrophobicContact CE3-CD1 3.54Å; W111-I115 HydrophobicContact CZ3-CD1 3.65Å; W111-I115 WeakPolarHBondContact O-CG1 3.41Å; W111-I115 PolarHBondContact O-N 3.08Å; W111-F152 AromaticContact CH2-CE1 3.87Å; W111-F152 HydrophobicContact CH2-CE1 3.87Å; W111-F152 HydrophobicContact CH2-CZ 4.49Å; W111-F152 AromaticContact CZ3-CE1 3.98Å; W111-F152 HydrophobicContact CZ3-CE1 3.98Å; W111-F152 HydrophobicContact CZ3-CZ 4.2Å
112	A	85	Confident	77.3	Confident	0 Å²	0	44.2 Å²	44.2	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-69.8	-40.3	177.2	0	0	0	0	0	111	I102 Y108 P109 S114 I115 V116 F152	I102-A112 HydrophobicContact CD1-CB 4.09Å; Y108-A112 HydrophobicContact CD1-CB 4.05Å; P109-A112 HydrophobicContact CG-CB 3.81Å; P109-A112 WeakPolarHBondContact O-CA 3.44Å; P109-A112 WeakPolarHBondContact O-CB 3.46Å; P109-A112 PolarHBondContact O-N 3.31Å; A112-S114 VanDerWaalsContact C-N 3.32Å; A112-S114 PolarHBondContact O-N 2.63Å; A112-I115 PolarHBondContact O-N 3.26Å; A112-I115 VanDerWaalsContact O-N 3.14Å; A112-V116 WeakPolarHBondContact O-CG2 3.41Å; A112-V116 PolarHBondContact O-N 2.92Å; A112-F152 HydrophobicContact CB-CE1 4.36Å; A112-F152 HydrophobicContact CB-CE2 4.05Å; A112-F152 HydrophobicContact CB-CZ 3.92Å
113	S	87	Confident	79	Confident	9 Å²	9	42.6 Å²	42.6	6%	0.063	21%	0.205	C	C	.	.	H	α-helix	trans	-54.5	-47	174.2	-52.1	0	0	0	0	111.8	Y108 P109 E110 I115 V116 G117 V298 Y299	Y108-S113 WeakPolarHBondContact CB-OG 3.49Å; Y108-S113 PolarHBondContact O-OG 3.07Å; P109-S113 PolarHBondContact O-N 3.48Å; P109-S113 VanDerWaalsContact O-N 3.07Å; P109-S113 PolarHBondContact O-OG 2.98Å; E110-S113 WeakPolarHBondContact O-CB 3.2Å; E110-S113 PolarHBondContact O-N 3.4Å; S113-I115 VanDerWaalsContact C-N 3.32Å; S113-I115 PolarHBondContact O-N 3.39Å; S113-V116 PolarHBondContact O-N 3.08Å; S113-G117 PolarHBondContact O-N 3.38Å; S113-V298 WeakPolarHBondContact CB-O 3.47Å; S113-V298 PolarHBondContact OG-O 2.85Å; S113-Y299 WeakPolarHBondContact O-CE1 3.25Å
114	S	86.7	Confident	80.9	Confident	0 Å²	0	38.2 Å²	38.2	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-63.5	-35.6	178.7	70.2	0	0	0	0	113.1	L58 E110 W111 A112 L118	L58-S114 WeakPolarHBondContact CD1-OG 3.37Å; E110-S114 PolarHBondContact O-N 2.9Å; E110-S114 VanDerWaalsContact O-N 3.08Å; W111-S114 PolarHBondContact O-N 3.27Å; W111-S114 PolarHBondContact O-OG 3.44Å; A112-S114 VanDerWaalsContact C-N 3.32Å; A112-S114 PolarHBondContact O-N 2.63Å; S114-L118 WeakPolarHBondContact O-CB 3.41Å; S114-L118 PolarHBondContact O-N 3Å
115	I	88.7	Confident	82.6	Confident	3 Å²	3	34 Å²	34	2%	0.015	17%	0.165	C	C	.	.	H	α-helix	trans	-68.1	-47	175.6	-66.6	166	0	0	0	110.8	L58 I89 F92 W111 A112 S113 G117 L118 V119 F152 L153	L58-I115 HydrophobicContact CD1-CG1 4.13Å; I89-I115 HydrophobicContact CD1-CD1 4.36Å; I89-I115 HydrophobicContact CD1-CG2 3.81Å; I89-I115 HydrophobicContact CG1-CD1 4.08Å; I89-I115 HydrophobicContact CG1-CG2 4.42Å; I89-I115 HydrophobicContact CG2-CD1 4.37Å; F92-I115 HydrophobicContact CD1-CD1 4.12Å; F92-I115 HydrophobicContact CE1-CD1 4.39Å; W111-I115 HydrophobicContact CE3-CD1 3.54Å; W111-I115 HydrophobicContact CZ3-CD1 3.65Å; W111-I115 WeakPolarHBondContact O-CG1 3.41Å; W111-I115 PolarHBondContact O-N 3.08Å; A112-I115 PolarHBondContact O-N 3.26Å; A112-I115 VanDerWaalsContact O-N 3.14Å; S113-I115 VanDerWaalsContact C-N 3.32Å; S113-I115 PolarHBondContact O-N 3.39Å; I115-G117 VanDerWaalsContact C-N 3.32Å; I115-G117 PolarHBondContact O-N 3.32Å; I115-L118 PolarHBondContact O-N 3.1Å; I115-V119 HydrophobicContact CG2-CG2 4.37Å; I115-V119 WeakPolarHBondContact O-CG2 3.09Å; I115-V119 PolarHBondContact O-N 3.14Å; I115-F152 HydrophobicContact CG2-CZ 4.44Å; I115-L153 HydrophobicContact CG2-CD1 4.37Å; I115-L153 HydrophobicContact CG2-CD2 4.36Å
116	V	89.5	Confident	84	Confident	0 Å²	0	28.7 Å²	28.7	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-58	-47.4	177.6	178.5	0	0	0	0	110.1	Y108 A112 S113 L118 V119 Y120 F152 L153 M256 V298	Y108-V116 HydrophobicContact CD1-CG2 4.13Å; Y108-V116 HydrophobicContact CE1-CG2 3.86Å; A112-V116 WeakPolarHBondContact O-CG2 3.41Å; A112-V116 PolarHBondContact O-N 2.92Å; S113-V116 PolarHBondContact O-N 3.08Å; V116-L118 VanDerWaalsContact C-N 3.34Å; V116-L118 PolarHBondContact O-N 3.32Å; V116-V119 WeakPolarHBondContact O-CB 3.43Å; V116-V119 PolarHBondContact O-N 2.96Å; V116-Y120 HydrophobicContact CG1-CD2 3.79Å; V116-Y120 HydrophobicContact CG1-CE2 3.69Å; V116-Y120 WeakPolarHBondContact O-CD2 3.42Å; V116-Y120 PolarHBondContact O-N 3.04Å; V116-F152 HydrophobicContact CG2-CD2 4.23Å; V116-F152 HydrophobicContact CG2-CE2 3.76Å; V116-L153 HydrophobicContact CG2-CD2 4.1Å; V116-M256 HydrophobicContact CG1-CE 4.24Å; V116-V298 HydrophobicContact CB-CG1 4.13Å; V116-V298 HydrophobicContact CG1-CG1 3.88Å; V116-V298 HydrophobicContact CG2-CG1 4.5Å
117	G	89.3	Confident	85	Confident	0 Å²	0	32.6 Å²	32.6	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-56.3	-46.9	176.7	0	0	0	0	0	112.5	H62 S113 I115 Y120 R121 Y299	H62-G117 PolarHBondContact CD2-O 3.3Å; S113-G117 PolarHBondContact O-N 3.38Å; I115-G117 VanDerWaalsContact C-N 3.32Å; I115-G117 PolarHBondContact O-N 3.32Å; G117-Y120 PolarHBondContact O-N 3.38Å; G117-R121 WeakPolarHBondContact O-CB 3.19Å; G117-R121 PolarHBondContact O-N 2.93Å; G117-Y299 WeakPolarHBondContact CA-OH 3.19Å; G117-Y299 PolarHBondContact N-OH 3.24Å
118	L	89	Confident	85.7	Confident	0 Å²	0	26 Å²	26	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-65.8	-37.8	179.1	-172.6	61.4	0	0	0	112.5	I49 L58 A61 H62 V65 L85 S114 I115 V116 R121 L122	I49-L118 HydrophobicContact CD1-CD2 4.39Å; I49-L118 HydrophobicContact CG1-CD2 4.28Å; L58-L118 HydrophobicContact CD2-CD2 4.33Å; A61-L118 HydrophobicContact CB-CD1 4.14Å; A61-L118 HydrophobicContact CB-CD2 4.15Å; H62-L118 HydrophobicContact CB-CD1 4.16Å; V65-L118 HydrophobicContact CG2-CD1 3.88Å; L85-L118 HydrophobicContact CD1-CD2 3.8Å; L85-L118 HydrophobicContact CD2-CB 4.21Å; L85-L118 HydrophobicContact CD2-CD2 3.96Å; L85-L118 HydrophobicContact CD2-CG 3.97Å; S114-L118 WeakPolarHBondContact O-CB 3.41Å; S114-L118 PolarHBondContact O-N 3Å; I115-L118 PolarHBondContact O-N 3.1Å; V116-L118 VanDerWaalsContact C-N 3.34Å; V116-L118 PolarHBondContact O-N 3.32Å; L118-R121 PolarHBondContact O-N 2.61Å; L118-L122 HydrophobicContact CD1-CG 4.48Å; L118-L122 HydrophobicContact CG-CD1 4.25Å; L118-L122 WeakPolarHBondContact O-CB 3.35Å; L118-L122 WeakPolarHBondContact O-CG 3.38Å; L118-L122 PolarHBondContact O-N 3.43Å
119	V	90.1	Very high	86.1	Confident	4 Å²	4	26 Å²	26	2%	0.024	12%	0.122	C	C	.	.	H	α-helix	trans	-58.8	-51.9	173.8	168	0	0	0	0	110.6	L82 L85 I115 V116 R121 L122 V123 L153 L157	L82-V119 HydrophobicContact CD2-CG1 4.38Å; L85-V119 HydrophobicContact CD2-CG2 3.61Å; I115-V119 HydrophobicContact CG2-CG2 4.37Å; I115-V119 WeakPolarHBondContact O-CG2 3.09Å; I115-V119 PolarHBondContact O-N 3.14Å; V116-V119 WeakPolarHBondContact O-CB 3.43Å; V116-V119 PolarHBondContact O-N 2.96Å; V119-R121 VanDerWaalsContact C-N 3.33Å; V119-R121 PolarHBondContact O-N 2.91Å; V119-L122 PolarHBondContact O-N 3.03Å; V119-V123 WeakPolarHBondContact O-CG2 3.42Å; V119-V123 PolarHBondContact O-N 3.39Å; V119-V123 VanDerWaalsContact O-N 3.11Å; V119-L153 HydrophobicContact CG2-CD2 4.43Å; V119-L157 HydrophobicContact CG1-CD2 3.69Å; V119-L157 HydrophobicContact CG1-CG 4.48Å
120	Y	90.7	Very high	86.5	Confident	22 Å²	22	25.8 Å²	25.8	9%	0.086	12%	0.12	C	C	.	.	H	α-helix	trans	-63.9	-38.9	178.4	-81.7	-83.3	0	0	0	112	V116 G117 V123 V124 H156 R159 M256	V116-Y120 HydrophobicContact CG1-CD2 3.79Å; V116-Y120 HydrophobicContact CG1-CE2 3.69Å; V116-Y120 WeakPolarHBondContact O-CD2 3.42Å; V116-Y120 PolarHBondContact O-N 3.04Å; G117-Y120 PolarHBondContact O-N 3.38Å; Y120-V123 PolarHBondContact O-N 3.43Å; Y120-V124 WeakPolarHBondContact O-CB 3.18Å; Y120-V124 VanDerWaalsContact O-CG2 3.32Å; Y120-V124 WeakPolarHBondContact O-CG2 3.34Å; Y120-V124 PolarHBondContact O-N 3.31Å; Y120-H156 HydrophobicContact CE2-CB 4.08Å; Y120-H156 AromaticContact CE2-ND1 3.51Å; Y120-H156 AromaticContact CZ-ND1 3.8Å; Y120-H156 PolarHBondContact OH-ND1 3.15Å; Y120-H156 VanDerWaalsContact OH-ND1 3.12Å; Y120-R159 PolarHBondContact OH-NH1 3.12Å; Y120-M256 HydrophobicContact CD1-CB 3.53Å; Y120-M256 HydrophobicContact CD1-CG 4.45Å; Y120-M256 HydrophobicContact CD2-CB 3.79Å; Y120-M256 HydrophobicContact CD2-CE 4.19Å; Y120-M256 HydrophobicContact CE1-CB 3.68Å; Y120-M256 HydrophobicContact CE1-CG 4.11Å; Y120-M256 HydrophobicContact CE2-CB 3.94Å; Y120-M256 HydrophobicContact CE2-CE 3.52Å; Y120-M256 HydrophobicContact CE2-CG 4.36Å; Y120-M256 HydrophobicContact CG-CB 3.59Å
121	R	89.7	Confident	86.9	Confident	40 Å²	40	19.2 Å²	19.2	15%	0.151	9%	0.09	C	C	.	.	H	α-helix	trans	-63.2	-44	177.5	-162.5	76.7	170.6	-154.1	-1.4	112.7	H62 V65 G117 L118 V119 V123 C125 G126 A257 L258	H62-R121 PolarHBondContact CE1-NH1 3.39Å; H62-R121 VanDerWaalsContact CE1-NH1 3.35Å; H62-R121 WeakPolarHBondContact O-CG 3.5Å; V65-R121 HydrophobicContact CB-CG 3.79Å; V65-R121 HydrophobicContact CG1-CG 4.22Å; V65-R121 HydrophobicContact CG2-CB 4.43Å; V65-R121 HydrophobicContact CG2-CG 3.95Å; G117-R121 WeakPolarHBondContact O-CB 3.19Å; G117-R121 PolarHBondContact O-N 2.93Å; L118-R121 PolarHBondContact O-N 2.61Å; V119-R121 VanDerWaalsContact C-N 3.33Å; V119-R121 PolarHBondContact O-N 2.91Å; R121-V123 VanDerWaalsContact C-N 3.29Å; R121-V123 PolarHBondContact O-N 3.41Å; R121-C125 VanDerWaalsContact CD-SG 3.52Å; R121-C125 HydrophobicContact CG-CB 4.4Å; R121-C125 PolarHBondContact NE-SG 3.45Å; R121-C125 WeakPolarHBondContact O-CA 3.42Å; R121-C125 WeakPolarHBondContact O-CB 3.27Å; R121-C125 PolarHBondContact O-N 3.36Å; R121-G126 PolarHBondContact O-N 2.93Å; R121-A257 WeakPolarHBondContact CD-O 3.4Å; R121-A257 PolarHBondContact NH1-O 3.25Å; R121-L258 PolarHBondContact NH1-O 3.35Å
122	L	88	Confident	87	Confident	0 Å²	0	18.5 Å²	18.5	0%	0	9%	0.087	C	C	.	.	H	α-helix	trans	-62.4	-35.9	174.9	-76.8	171.4	0	0	0	112.3	L45 V65 L81 L82 L85 L118 V119 G126 R127 C128	L45-L122 HydrophobicContact CD2-CD2 4.15Å; V65-L122 HydrophobicContact CG1-CD2 4.05Å; V65-L122 HydrophobicContact CG2-CD2 4.01Å; V65-L122 HydrophobicContact CG2-CG 4.34Å; L81-L122 HydrophobicContact CB-CD2 4.32Å; L81-L122 HydrophobicContact CD1-CD2 4.39Å; L82-L122 HydrophobicContact CD2-CB 3.79Å; L82-L122 HydrophobicContact CD2-CD1 3.84Å; L82-L122 HydrophobicContact CD2-CG 4.49Å; L82-L122 HydrophobicContact CG-CB 4.29Å; L82-L122 HydrophobicContact CG-CD1 4.4Å; L85-L122 HydrophobicContact CD2-CD1 4.05Å; L118-L122 HydrophobicContact CD1-CG 4.48Å; L118-L122 HydrophobicContact CG-CD1 4.25Å; L118-L122 WeakPolarHBondContact O-CB 3.35Å; L118-L122 WeakPolarHBondContact O-CG 3.38Å; L118-L122 PolarHBondContact O-N 3.43Å; V119-L122 PolarHBondContact O-N 3.03Å; L122-G126 CarbonylContact O-C 3.47Å; L122-G126 WeakPolarHBondContact O-CA 3.43Å; L122-G126 PolarHBondContact O-N 2.88Å; L122-R127 PolarHBondContact O-N 2.86Å; L122-R127 VanDerWaalsContact O-N 3.13Å; L122-C128 WeakPolarHBondContact O-CB 3.35Å; L122-C128 PolarHBondContact O-N 3.43Å
123	V	88	Confident	87.1	Confident	17 Å²	17	21.8 Å²	21.8	10%	0.103	10%	0.103	C	C	.	.	H	α-helix	trans	-76.2	-46	178.6	172	0	0	0	0	111.6	L82 V119 Y120 R121 R127 V130 R215	L82-V123 HydrophobicContact CD1-CG2 3.88Å; L82-V123 HydrophobicContact CD2-CG2 4.28Å; V119-V123 WeakPolarHBondContact O-CG2 3.42Å; V119-V123 PolarHBondContact O-N 3.39Å; V119-V123 VanDerWaalsContact O-N 3.11Å; Y120-V123 PolarHBondContact O-N 3.43Å; R121-V123 VanDerWaalsContact C-N 3.29Å; R121-V123 PolarHBondContact O-N 3.41Å; V123-R127 WeakPolarHBondContact O-CA 3.46Å; V123-R127 PolarHBondContact O-N 3.03Å; V123-V130 HydrophobicContact CG1-CG2 4.09Å; V123-V130 HydrophobicContact CG2-CG2 3.64Å; V123-R215 PolarHBondContact O-NH1 3.21Å
124	V	87.4	Confident	87.1	Confident	11 Å²	11	22 Å²	22	7%	0.067	10%	0.103	C	C	.	.	H	α-helix	trans	-80.1	-60.9	-174.5	177.9	0	0	0	0	111.5	Y120 A253 A257 Y262	Y120-V124 WeakPolarHBondContact O-CB 3.18Å; Y120-V124 VanDerWaalsContact O-CG2 3.32Å; Y120-V124 WeakPolarHBondContact O-CG2 3.34Å; Y120-V124 PolarHBondContact O-N 3.31Å; V124-A253 HydrophobicContact CG2-CB 3.88Å; V124-A257 HydrophobicContact CB-CB 4.11Å; V124-A257 HydrophobicContact CG2-CB 4.17Å; V124-Y262 HydrophobicContact CG1-CD1 4.13Å; V124-Y262 HydrophobicContact CG1-CE1 4.16Å
125	C	86.5	Confident	87	Confident	26 Å²	26	26.5 Å²	26.5	18%	0.176	13%	0.128	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.3	-43.8	-178.3	-52.6	0	0	0	0	111	V65 S67 R121 R127 D259	V65-C125 HydrophobicContact CG1-CB 4.26Å; S67-C125 VanDerWaalsContact CA-O 3.24Å; S67-C125 WeakPolarHBondContact CA-O 3.41Å; R121-C125 VanDerWaalsContact CD-SG 3.52Å; R121-C125 HydrophobicContact CG-CB 4.4Å; R121-C125 PolarHBondContact NE-SG 3.45Å; R121-C125 WeakPolarHBondContact O-CA 3.42Å; R121-C125 WeakPolarHBondContact O-CB 3.27Å; R121-C125 PolarHBondContact O-N 3.36Å; C125-R127 VanDerWaalsContact C-N 3.32Å; C125-R127 PolarHBondContact O-N 3.18Å; C125-D259 PolarHBondContact SG-OD2 3.08Å
126	G	81.6	Confident	86.5	Confident	0 Å²	0	30.5 Å²	30.5	0%	0	15%	0.147	C	C	.	.	S	Bend	trans	-72.3	-19.9	-178.8	0	0	0	0	0	114.4	T66 G70 R121 L122 C128	T66-G126 WeakPolarHBondContact O-CA 3.1Å; G70-G126 WeakPolarHBondContact CA-O 3.45Å; G70-G126 PolarHBondContact N-O 3Å; R121-G126 PolarHBondContact O-N 2.93Å; L122-G126 CarbonylContact O-C 3.47Å; L122-G126 WeakPolarHBondContact O-CA 3.43Å; L122-G126 PolarHBondContact O-N 2.88Å; G126-C128 PolarHBondContact O-N 3.44Å
127	R	84	Confident	86.3	Confident	187 Å²	187	30.6 Å²	30.6	71%	0.706	15%	0.148	S	C	*	.			trans	58.6	25.7	-174.6	-54.7	-175.2	177.3	-178.9	-0.2	114.3	L122 V123 C125 S129	L122-R127 PolarHBondContact O-N 2.86Å; L122-R127 VanDerWaalsContact O-N 3.13Å; V123-R127 WeakPolarHBondContact O-CA 3.46Å; V123-R127 PolarHBondContact O-N 3.03Å; C125-R127 VanDerWaalsContact C-N 3.32Å; C125-R127 PolarHBondContact O-N 3.18Å; R127-S129 PolarHBondContact O-N 3.13Å
128	C	83.3	Confident	86.1	Confident	6 Å²	6	31 Å²	31	4%	0.041	15%	0.15	C	C	.	.			trans	-67.4	129.1	174	-66.1	0	0	0	0	111	L82 L122 G126 V130	L82-C128 HydrophobicContact CD1-CB 3.53Å; L82-C128 HydrophobicContact CG-CB 3.95Å; L122-C128 WeakPolarHBondContact O-CB 3.35Å; L122-C128 PolarHBondContact O-N 3.43Å; G126-C128 PolarHBondContact O-N 3.44Å; C128-V130 PolarHBondContact O-N 3.25Å
129	S	84.5	Confident	86	Confident	26 Å²	26	31 Å²	31	18%	0.182	15%	0.151	C	C	.	.			trans	-74.8	122	174.2	-174	0	0	0	0	111.1	R127 N131 A132 N219	R127-S129 PolarHBondContact O-N 3.13Å; S129-N131 PolarHBondContact O-N 3.05Å; S129-A132 VanDerWaalsContact O-CB 3.3Å; S129-A132 WeakPolarHBondContact O-CB 3.13Å; S129-A132 PolarHBondContact O-N 3.36Å; S129-N219 PolarHBondContact OG-O 3.27Å
130	V	84.9	Confident	85.9	Confident	27 Å²	27	31 Å²	31	16%	0.164	15%	0.15	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.7	-25.9	176.5	-164.8	0	0	0	0	111.6	V123 C128 A132 V140 L157 A160	V123-V130 HydrophobicContact CG1-CG2 4.09Å; V123-V130 HydrophobicContact CG2-CG2 3.64Å; C128-V130 PolarHBondContact O-N 3.25Å; V130-A132 VanDerWaalsContact C-N 3.31Å; V130-A132 PolarHBondContact O-N 2.99Å; V130-V140 HydrophobicContact CG1-CG2 3.44Å; V130-V140 VanDerWaalsContact CG1-CG2 3.44Å; V130-V140 WeakPolarHBondContact O-CG2 3.44Å; V130-L157 HydrophobicContact CG1-CD2 3.92Å; V130-A160 HydrophobicContact CB-CB 4.16Å; V130-A160 HydrophobicContact CG1-CB 3.61Å
131	N	87.1	Confident	85.6	Confident	8 Å²	8	30.1 Å²	30.1	4%	0.043	15%	0.147	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.2	4.4	178.4	-72.3	-16	0	0	0	113.2	S129 Q133 A160 D161 I164 W195 P221	S129-N131 PolarHBondContact O-N 3.05Å; N131-Q133 PolarHBondContact O-N 3.09Å; N131-A160 WeakPolarHBondContact OD1-CB 3.36Å; N131-D161 PolarHBondContact OD1-N 3.25Å; N131-I164 HydrophobicContact CB-CD1 3.67Å; N131-W195 PolarHBondContact ND2-NE1 3.01Å; N131-P221 HydrophobicContact CB-CG 4.21Å; N131-P221 VanDerWaalsContact O-CG 3.3Å; N131-P221 WeakPolarHBondContact O-CG 3.37Å
132	A	86.1	Confident	85.5	Confident	2 Å²	2	28.3 Å²	28.3	2%	0.017	14%	0.14	C	C	.	.			trans	-61.1	131.9	175.7	0	0	0	0	0	110.3	T80 H83 S129 V130	T80-A132 HydrophobicContact CG2-CB 3.84Å; H83-A132 PolarHBondContact CE1-O 3.4Å; H83-A132 PolarHBondContact NE2-O 3Å; S129-A132 VanDerWaalsContact O-CB 3.3Å; S129-A132 WeakPolarHBondContact O-CB 3.13Å; S129-A132 PolarHBondContact O-N 3.36Å; V130-A132 VanDerWaalsContact C-N 3.31Å; V130-A132 PolarHBondContact O-N 2.99Å
133	Q	87.7	Confident	85.3	Confident	70 Å²	70	28.3 Å²	28.3	33%	0.327	14%	0.14	S	C	.	.			trans	-96.3	139.7	171.5	-66.4	179.9	-70.6	0	0	109.8	R73 N131 G137 N138 T139 I164 K165	R73-Q133 PolarHBondContact NH1-O 3.33Å; N131-Q133 PolarHBondContact O-N 3.09Å; Q133-G137 PolarHBondContact NE2-O 3.36Å; Q133-N138 WeakPolarHBondContact CA-O 3.34Å; Q133-T139 HydrophobicContact CG-CG2 3.78Å; Q133-I164 HydrophobicContact CG-CG2 3.95Å; Q133-I164 VanDerWaalsContact NE2-CG2 3.28Å; Q133-K165 PolarHBondContact NE2-O 2.9Å
134	N	86.7	Confident	85.2	Confident	12 Å²	12	27.8 Å²	27.8	6%	0.064	14%	0.137	C	C	.	.			trans	-78.1	-178.3	166.3	73.6	6.3	0	0	0	111.5	N79 M136 G137 N138	N79-N134 VanDerWaalsContact OD1-CB 3.23Å; N79-N134 WeakPolarHBondContact OD1-CB 3.34Å; N79-N134 PolarHBondContact OD1-ND2 3.27Å; N134-M136 PolarHBondContact O-N 2.8Å; N134-M136 WeakPolarHBondContact OD1-CA 3.32Å; N134-M136 WeakPolarHBondContact OD1-CB 3.36Å; N134-M136 PolarHBondContact OD1-N 3.42Å; N134-G137 PolarHBondContact O-N 3.31Å; N134-G137 PolarHBondContact OD1-N 2.82Å; N134-N138 PolarHBondContact N-O 3.45Å; N134-N138 PolarHBondContact OD1-N 2.81Å; N134-N138 VanDerWaalsContact OD1-N 3.07Å; N134-N138 PolarHBondContact OD1-O 2.91Å
135	N	85.3	Confident	84.9	Confident	96 Å²	96	29 Å²	29	51%	0.513	15%	0.146	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-15.7	-177.1	-69.3	-10.2	0	0	0	113.7	E76 T77 G78 N167	E76-N135 PolarHBondContact O-ND2 2.99Å; T77-N135 VanDerWaalsContact C-ND2 3.31Å; T77-N135 WeakPolarHBondContact O-CB 3.28Å; T77-N135 PolarHBondContact O-N 3.19Å; G78-N135 WeakPolarHBondContact CA-OD1 3.31Å; G78-N135 PolarHBondContact N-ND2 3.32Å; N135-N167 PolarHBondContact O-ND2 3.47Å; N135-N167 VanDerWaalsContact O-ND2 3.16Å
136	M	78.1	Confident	84.6	Confident	86 Å²	86	30.3 Å²	30.3	42%	0.424	15%	0.151	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95	3	176.4	-63.6	-71.9	175.8	0	0	113.4	N134 N138 N167	N134-M136 PolarHBondContact O-N 2.8Å; N134-M136 WeakPolarHBondContact OD1-CA 3.32Å; N134-M136 WeakPolarHBondContact OD1-CB 3.36Å; N134-M136 PolarHBondContact OD1-N 3.42Å; M136-N138 PolarHBondContact O-N 3.25Å; M136-N167 VanDerWaalsContact O-CB 3.3Å; M136-N167 WeakPolarHBondContact O-CB 2.91Å; M136-N167 PolarHBondContact O-N 3.44Å; M136-N167 VanDerWaalsContact O-N 3.16Å; M136-N167 PolarHBondContact O-ND2 3Å
137	G	83.8	Confident	84.5	Confident	2 Å²	2	31.2 Å²	31.2	2%	0.021	16%	0.155	C	C	.	.	S	Bend	trans	76.8	3	-175.3	0	0	0	0	0	113.7	Q133 N134 N166 N167	Q133-G137 PolarHBondContact NE2-O 3.36Å; N134-G137 PolarHBondContact O-N 3.31Å; N134-G137 PolarHBondContact OD1-N 2.82Å; G137-N166 VanDerWaalsContact O-CA 3.25Å; G137-N166 WeakPolarHBondContact O-CA 3.46Å; G137-N166 WeakPolarHBondContact O-CB 3.38Å; G137-N167 WeakPolarHBondContact CA-OD1 3.24Å
138	N	85.3	Confident	84.2	Confident	8 Å²	8	25.6 Å²	25.6	4%	0.043	14%	0.143	C	C	.	.			trans	-77.9	131.6	179.8	-67.9	-38.1	0	0	0	109.6	H83 Q133 N134 M136 H142 L143 N166	H83-N138 PolarHBondContact NE2-O 3.19Å; Q133-N138 WeakPolarHBondContact CA-O 3.34Å; N134-N138 PolarHBondContact N-O 3.45Å; N134-N138 PolarHBondContact OD1-N 2.81Å; N134-N138 VanDerWaalsContact OD1-N 3.07Å; N134-N138 PolarHBondContact OD1-O 2.91Å; M136-N138 PolarHBondContact O-N 3.25Å; N138-H142 HydrophobicContact CB-CB 3.94Å; N138-L143 HydrophobicContact CB-CD2 4.5Å; N138-N166 VanDerWaalsContact OD1-CB 3.31Å; N138-N166 WeakPolarHBondContact OD1-CB 3.41Å; N138-N166 PolarHBondContact OD1-ND2 3.06Å
139	T	87.9	Confident	83.9	Confident	2 Å²	2	28.6 Å²	28.6	1%	0.012	15%	0.154	C	C	.	.			trans	-89.4	172.5	163.5	67.3	0	0	0	0	110	Q133 L141 H142 L143 I164	Q133-T139 HydrophobicContact CG-CG2 3.78Å; T139-L141 PolarHBondContact O-N 3.44Å; T139-L141 PolarHBondContact OG1-N 2.9Å; T139-H142 PolarHBondContact N-ND1 3.44Å; T139-H142 VanDerWaalsContact N-ND1 3.14Å; T139-H142 WeakPolarHBondContact O-CB 3.36Å; T139-H142 PolarHBondContact O-N 3.49Å; T139-H142 PolarHBondContact OG1-ND1 3.17Å; T139-L143 PolarHBondContact O-N 3.13Å; T139-I164 HydrophobicContact CG2-CB 4.22Å; T139-I164 HydrophobicContact CG2-CD1 4.19Å; T139-I164 HydrophobicContact CG2-CG2 3.75Å
140	V	87.1	Confident	83.7	Confident	2 Å²	2	27.4 Å²	27.4	1%	0.012	15%	0.145	C	C	.	.	H	α-helix	trans	-56.3	-34.5	173.2	-68	0	0	0	0	113.6	L82 I86 V130 H142 L143 I144 L157	L82-V140 HydrophobicContact CB-CG1 3.94Å; I86-V140 HydrophobicContact CD1-CB 3.42Å; I86-V140 VanDerWaalsContact CD1-CB 3.42Å; I86-V140 HydrophobicContact CD1-CG1 3.64Å; V130-V140 HydrophobicContact CG1-CG2 3.44Å; V130-V140 VanDerWaalsContact CG1-CG2 3.44Å; V130-V140 WeakPolarHBondContact O-CG2 3.44Å; V140-H142 VanDerWaalsContact C-N 3.31Å; V140-H142 PolarHBondContact O-N 3.32Å; V140-L143 PolarHBondContact O-N 2.92Å; V140-I144 WeakPolarHBondContact O-CG1 3.36Å; V140-I144 PolarHBondContact O-N 3.31Å; V140-L157 HydrophobicContact CB-CD1 4.03Å; V140-L157 HydrophobicContact CG2-CD1 3.85Å
141	L	85.5	Confident	83.3	Confident	4 Å²	4	30.4 Å²	30.4	2%	0.021	16%	0.157	C	C	.	.	H	α-helix	trans	-63.8	-36.1	174.7	-83	177.2	0	0	0	112	T139 C145 L157 A160 V172	T139-L141 PolarHBondContact O-N 3.44Å; T139-L141 PolarHBondContact OG1-N 2.9Å; L141-C145 PolarHBondContact O-N 3.45Å; L141-C145 PolarHBondContact O-SG 2.71Å; L141-C145 VanDerWaalsContact O-SG 3.42Å; L141-L157 HydrophobicContact CD2-CB 4.06Å; L141-A160 HydrophobicContact CD1-CB 3.67Å; L141-A160 HydrophobicContact CG-CB 4.18Å; L141-V172 HydrophobicContact CB-CB 4.48Å; L141-V172 HydrophobicContact CB-CG2 4.01Å
142	H	86.1	Confident	83	Confident	2 Å²	2	31.1 Å²	31.1	1%	0.009	16%	0.16	C	C	.	.	H	α-helix	trans	-66.4	-41.6	174.3	-65.5	82.9	0	0	0	111	N138 T139 V140 C145 L146 I164 L170 L183	N138-H142 HydrophobicContact CB-CB 3.94Å; T139-H142 PolarHBondContact N-ND1 3.44Å; T139-H142 VanDerWaalsContact N-ND1 3.14Å; T139-H142 WeakPolarHBondContact O-CB 3.36Å; T139-H142 PolarHBondContact O-N 3.49Å; T139-H142 PolarHBondContact OG1-ND1 3.17Å; V140-H142 VanDerWaalsContact C-N 3.31Å; V140-H142 PolarHBondContact O-N 3.32Å; H142-C145 PolarHBondContact O-N 3Å; H142-L146 WeakPolarHBondContact O-CD1 2.89Å; H142-L146 VanDerWaalsContact O-CG 3.25Å; H142-L146 WeakPolarHBondContact O-CG 3.37Å; H142-L146 PolarHBondContact O-N 2.91Å; H142-I164 PolarHBondContact CE1-O 3.23Å; H142-I164 PolarHBondContact NE2-O 3.18Å; H142-L170 PolarHBondContact NE2-O 3.1Å; H142-L170 VanDerWaalsContact NE2-O 3.16Å; H142-L183 HydrophobicContact CB-CD2 4.47Å
143	L	84.7	Confident	83	Confident	1 Å²	1	31 Å²	31	1%	0.005	16%	0.159	C	C	.	.	H	α-helix	trans	-64.7	-39.1	180	-66.7	-179.2	0	0	0	112.2	H83 I86 I87 N138 T139 V140 C145 L146 L147	H83-L143 HydrophobicContact CB-CD1 4.06Å; I86-L143 HydrophobicContact CG2-CB 3.89Å; I87-L143 HydrophobicContact CD1-CD1 4.06Å; I87-L143 HydrophobicContact CG1-CD1 3.93Å; N138-L143 HydrophobicContact CB-CD2 4.5Å; T139-L143 PolarHBondContact O-N 3.13Å; V140-L143 PolarHBondContact O-N 2.92Å; L143-C145 VanDerWaalsContact C-N 3.26Å; L143-C145 PolarHBondContact O-N 2.92Å; L143-L146 PolarHBondContact O-N 3.31Å; L143-L147 HydrophobicContact CB-CD1 4.34Å; L143-L147 WeakPolarHBondContact O-CB 2.94Å; L143-L147 WeakPolarHBondContact O-CG 3.28Å; L143-L147 PolarHBondContact O-N 2.97Å
144	I	85.5	Confident	82.7	Confident	5 Å²	5	27.7 Å²	27.7	3%	0.026	14%	0.144	C	C	.	.	H	α-helix	trans	-57.8	-40.5	175.9	-73.2	164.3	0	0	0	111.8	I86 V140 L146 T150 L153 A154 L157	I86-I144 HydrophobicContact CD1-CD1 4.49Å; I86-I144 HydrophobicContact CD1-CG1 4.34Å; I86-I144 HydrophobicContact CG2-CG1 4.31Å; V140-I144 WeakPolarHBondContact O-CG1 3.36Å; V140-I144 PolarHBondContact O-N 3.31Å; I144-L146 VanDerWaalsContact C-N 3.27Å; I144-L146 PolarHBondContact O-N 3.02Å; I144-T150 WeakPolarHBondContact CA-OG1 3.43Å; I144-T150 WeakPolarHBondContact CG2-O 3.48Å; I144-T150 PolarHBondContact O-OG1 3.18Å; I144-L153 HydrophobicContact CD1-CB 3.64Å; I144-L153 HydrophobicContact CG1-CB 4.11Å; I144-A154 HydrophobicContact CG2-CB 4.36Å; I144-L157 HydrophobicContact CD1-CB 3.92Å; I144-L157 HydrophobicContact CD1-CD1 3.35Å; I144-L157 HydrophobicContact CD1-CG 4.04Å; I144-L157 HydrophobicContact CG1-CD1 4.45Å
145	C	80.8	Confident	82.4	Confident	38 Å²	38	28 Å²	28	26%	0.257	15%	0.146	S	C	.	.	H	α-helix	trans	-74.4	-17.4	178.4	-62.5	0	0	0	0	113.4	L141 H142 L143 A181 L183	L141-C145 PolarHBondContact O-N 3.45Å; L141-C145 PolarHBondContact O-SG 2.71Å; L141-C145 VanDerWaalsContact O-SG 3.42Å; H142-C145 PolarHBondContact O-N 3Å; L143-C145 VanDerWaalsContact C-N 3.26Å; L143-C145 PolarHBondContact O-N 2.92Å; C145-A181 VanDerWaalsContact SG-CB 3.5Å; C145-L183 HydrophobicContact CB-CD1 4.14Å; C145-L183 HydrophobicContact CB-CD2 4.43Å; C145-L183 HydrophobicContact CB-CG 3.76Å
146	L	80.7	Confident	82.4	Confident	53 Å²	53	23.8 Å²	23.8	28%	0.277	12%	0.123	S	C	.	.	H	α-helix	trans	-99	-21.5	-175.9	-71.4	170	0	0	0	113.3	L22 H142 L143 I144 L183	L22-L146 HydrophobicContact CD1-CD2 4.32Å; H142-L146 WeakPolarHBondContact O-CD1 2.89Å; H142-L146 VanDerWaalsContact O-CG 3.25Å; H142-L146 WeakPolarHBondContact O-CG 3.37Å; H142-L146 PolarHBondContact O-N 2.91Å; L143-L146 PolarHBondContact O-N 3.31Å; I144-L146 VanDerWaalsContact C-N 3.27Å; I144-L146 PolarHBondContact O-N 3.02Å; L146-L183 HydrophobicContact CD1-CD1 4.39Å; L146-L183 HydrophobicContact CD2-CD1 3.53Å; L146-L183 HydrophobicContact CG-CD1 3.75Å
147	L	80.4	Confident	82.6	Confident	19 Å²	19	20.1 Å²	20.1	10%	0.099	11%	0.105	C	C	.	.	S	Bend	trans	-106.8	144.4	-173.3	-66.4	174.8	0	0	0	111.2	L27 I86 I87 P90 L143 T150	L27-L147 HydrophobicContact CD1-CD2 4.36Å; L27-L147 HydrophobicContact CD2-CD2 3.61Å; L27-L147 HydrophobicContact CD2-CG 4.44Å; I86-L147 HydrophobicContact CG2-CD1 4.02Å; I86-L147 WeakPolarHBondContact O-CD1 3.39Å; I87-L147 HydrophobicContact CG1-CD1 4.36Å; P90-L147 HydrophobicContact CG-CB 4.01Å; P90-L147 HydrophobicContact CG-CD1 4.47Å; P90-L147 HydrophobicContact CG-CD2 4.17Å; P90-L147 HydrophobicContact CG-CG 4.45Å; L143-L147 HydrophobicContact CB-CD1 4.34Å; L143-L147 WeakPolarHBondContact O-CB 2.94Å; L143-L147 WeakPolarHBondContact O-CG 3.28Å; L143-L147 PolarHBondContact O-N 2.97Å; L147-T150 HydrophobicContact CB-CG2 3.93Å; L147-T150 PolarHBondContact O-OG1 2.99Å
148	P	77.2	Confident	81.9	Confident	68 Å²	68	21 Å²	21	44%	0.442	11%	0.109	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.5	156.7	172.8	32	-34.3	0	0	0	110.7	P90 T150	P90-P148 HydrophobicContact CB-CG 4.03Å; P90-P148 HydrophobicContact CG-CG 4.23Å; P148-T150 PolarHBondContact O-N 3.15Å; P148-T150 VanDerWaalsContact O-N 3.14Å
149	Y	75.6	Confident	81.1	Confident	70 Å²	70	22.8 Å²	22.8	28%	0.275	12%	0.115	S	C	.	.	T	Hydrogen-bonded Turn	trans	65	4.7	178.9	-45	-74.1	0	0	0	115.9	A93 K94 C99 F152	A93-Y149 HydrophobicContact CB-CD1 4.44Å; A93-Y149 HydrophobicContact CB-CD2 4.03Å; A93-Y149 HydrophobicContact CB-CG 3.88Å; K94-Y149 HydrophobicContact CG-CE2 4.49Å; C99-Y149 HydrophobicContact CB-CE1 4.19Å; C99-Y149 VanDerWaalsContact SG-CE1 3.51Å; Y149-F152 VanDerWaalsContact O-CD1 3.29Å; Y149-F152 WeakPolarHBondContact O-CD1 3.33Å; Y149-F152 WeakPolarHBondContact O-CE1 3.09Å
150	T	81.4	Confident	80.4	Confident	0 Å²	0	23 Å²	23	0%	0	12%	0.117	C	C	.	.			trans	-98.2	-4.4	179.8	50.2	0	0	0	0	113.8	I86 I89 I144 L147 P148 F152 L153	I86-T150 HydrophobicContact CG2-CG2 4.14Å; I89-T150 HydrophobicContact CB-CG2 3.89Å; I89-T150 HydrophobicContact CD1-CG2 3.94Å; I89-T150 HydrophobicContact CG1-CG2 4.42Å; I89-T150 HydrophobicContact CG2-CG2 3.99Å; I144-T150 WeakPolarHBondContact CA-OG1 3.43Å; I144-T150 WeakPolarHBondContact CG2-O 3.48Å; I144-T150 PolarHBondContact O-OG1 3.18Å; L147-T150 HydrophobicContact CB-CG2 3.93Å; L147-T150 PolarHBondContact O-OG1 2.99Å; P148-T150 PolarHBondContact O-N 3.15Å; P148-T150 VanDerWaalsContact O-N 3.14Å; T150-F152 PolarHBondContact O-N 3.06Å; T150-L153 WeakPolarHBondContact O-CB 3.44Å; T150-L153 PolarHBondContact O-N 3.21Å
151	E	75.7	Confident	79.9	Confident	90 Å²	90	23.8 Å²	23.8	42%	0.421	12%	0.121	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.6	-36.7	-172.9	-61.8	-179.4	-167.7	0	0	113	L153 A154	E151-L153 PolarHBondContact O-N 2.88Å; E151-A154 WeakPolarHBondContact O-CB 3.33Å; E151-A154 PolarHBondContact O-N 2.82Å
152	F	80.9	Confident	79.6	Confident	23 Å²	23	24.1 Å²	24.1	10%	0.101	12%	0.124	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-25.1	179.5	74.5	-94.2	0	0	0	113.6	I102 Y108 W111 A112 I115 V116 Y149 T150 A154	I102-F152 HydrophobicContact CD1-CB 3.78Å; I102-F152 HydrophobicContact CD1-CD1 4.11Å; I102-F152 HydrophobicContact CD1-CD2 4.4Å; I102-F152 HydrophobicContact CD1-CG 3.85Å; Y108-F152 HydrophobicContact CD1-CD2 4.33Å; Y108-F152 AromaticContact CE1-CD2 3.65Å; Y108-F152 HydrophobicContact CE1-CD2 3.65Å; Y108-F152 HydrophobicContact CE1-CE2 4.28Å; Y108-F152 HydrophobicContact CE1-CG 4.43Å; W111-F152 AromaticContact CH2-CE1 3.87Å; W111-F152 HydrophobicContact CH2-CE1 3.87Å; W111-F152 HydrophobicContact CH2-CZ 4.49Å; W111-F152 AromaticContact CZ3-CE1 3.98Å; W111-F152 HydrophobicContact CZ3-CE1 3.98Å; W111-F152 HydrophobicContact CZ3-CZ 4.2Å; A112-F152 HydrophobicContact CB-CE1 4.36Å; A112-F152 HydrophobicContact CB-CE2 4.05Å; A112-F152 HydrophobicContact CB-CZ 3.92Å; I115-F152 HydrophobicContact CG2-CZ 4.44Å; V116-F152 HydrophobicContact CG2-CD2 4.23Å; V116-F152 HydrophobicContact CG2-CE2 3.76Å; Y149-F152 VanDerWaalsContact O-CD1 3.29Å; Y149-F152 WeakPolarHBondContact O-CD1 3.33Å; Y149-F152 WeakPolarHBondContact O-CE1 3.09Å; T150-F152 PolarHBondContact O-N 3.06Å; F152-A154 PolarHBondContact O-N 3.48Å
153	L	85.9	Confident	79.2	Confident	0 Å²	0	27 Å²	27	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-73.8	-11.3	176.7	-68.5	174.6	0	0	0	112.7	I86 I89 I115 V116 V119 I144 T150 E151 I155 H156 L157	I86-L153 HydrophobicContact CG1-CD1 4.25Å; I89-L153 HydrophobicContact CD1-CD1 3.38Å; I115-L153 HydrophobicContact CG2-CD1 4.37Å; I115-L153 HydrophobicContact CG2-CD2 4.36Å; V116-L153 HydrophobicContact CG2-CD2 4.1Å; V119-L153 HydrophobicContact CG2-CD2 4.43Å; I144-L153 HydrophobicContact CD1-CB 3.64Å; I144-L153 HydrophobicContact CG1-CB 4.11Å; T150-L153 WeakPolarHBondContact O-CB 3.44Å; T150-L153 PolarHBondContact O-N 3.21Å; E151-L153 PolarHBondContact O-N 2.88Å; L153-I155 VanDerWaalsContact C-N 3.32Å; L153-I155 PolarHBondContact O-N 2.9Å; L153-H156 PolarHBondContact O-N 2.96Å; L153-H156 VanDerWaalsContact O-N 3.16Å; L153-L157 WeakPolarHBondContact O-CB 3.32Å; L153-L157 PolarHBondContact O-N 2.9Å
154	A	82.1	Confident	79	Confident	1 Å²	1	28.5 Å²	28.5	1%	0.008	15%	0.145	C	C	.	.	H	α-helix	trans	-59.2	-42.4	-179.9	0	0	0	0	0	111.8	I144 E151 F152 H156 L157 I158 Y174 A181	I144-A154 HydrophobicContact CG2-CB 4.36Å; E151-A154 WeakPolarHBondContact O-CB 3.33Å; E151-A154 PolarHBondContact O-N 2.82Å; F152-A154 PolarHBondContact O-N 3.48Å; A154-H156 VanDerWaalsContact C-N 3.32Å; A154-H156 PolarHBondContact O-N 2.95Å; A154-L157 PolarHBondContact O-N 3.2Å; A154-I158 VanDerWaalsContact O-CB 3.26Å; A154-I158 WeakPolarHBondContact O-CB 3.48Å; A154-I158 PolarHBondContact O-N 3.46Å; A154-Y174 HydrophobicContact CB-CD2 4.11Å; A154-Y174 HydrophobicContact CB-CE2 3.78Å; A154-A181 HydrophobicContact CB-CB 4.21Å
155	I	80.4	Confident	78.9	Confident	19 Å²	19	34.1 Å²	34.1	10%	0.097	17%	0.169	C	C	.	.	H	α-helix	trans	-62	-38.9	176.4	-67.4	161.9	0	0	0	111.7	L153 I158 Y174 Q179 F285	L153-I155 VanDerWaalsContact C-N 3.32Å; L153-I155 PolarHBondContact O-N 2.9Å; I155-I158 WeakPolarHBondContact O-CG2 3.34Å; I155-Y174 VanDerWaalsContact CG1-OH 3.27Å; I155-Y174 WeakPolarHBondContact CG1-OH 3.47Å; I155-Q179 HydrophobicContact CD1-CB 3.82Å; I155-Q179 HydrophobicContact CD1-CG 4.22Å; I155-Q179 HydrophobicContact CG1-CB 3.79Å; I155-Q179 HydrophobicContact CG1-CG 4.26Å; I155-F285 HydrophobicContact CG2-CZ 4.09Å
156	H	84.4	Confident	79	Confident	7 Å²	7	33 Å²	33	3%	0.032	16%	0.16	C	C	.	.	H	α-helix	trans	-79.5	-33.5	-176.5	-65.4	-66.9	0	0	0	112.6	Y108 Y120 L153 A154 E294	Y108-H156 AromaticContact CE1-NE2 3.91Å; Y108-H156 AromaticContact CZ-NE2 3.79Å; Y108-H156 PolarHBondContact OH-NE2 2.74Å; Y108-H156 VanDerWaalsContact OH-NE2 3.15Å; Y120-H156 HydrophobicContact CE2-CB 4.08Å; Y120-H156 AromaticContact CE2-ND1 3.51Å; Y120-H156 AromaticContact CZ-ND1 3.8Å; Y120-H156 PolarHBondContact OH-ND1 3.15Å; Y120-H156 VanDerWaalsContact OH-ND1 3.12Å; L153-H156 PolarHBondContact O-N 2.96Å; L153-H156 VanDerWaalsContact O-N 3.16Å; A154-H156 VanDerWaalsContact C-N 3.32Å; A154-H156 PolarHBondContact O-N 2.95Å; H156-E294 IonicContact CE1-OE1 3.71Å; H156-E294 PolarHBondContact CE1-OE1 3.21Å
157	L	82.7	Confident	79.1	Confident	8 Å²	8	36.1 Å²	36.1	4%	0.042	18%	0.178	C	C	.	.	H	α-helix	trans	-99.6	-8.4	-175.9	-67.8	-172	0	0	0	114.8	I86 V119 V130 V140 L141 I144 L153 A154 R159 A160	I86-L157 HydrophobicContact CD1-CD1 3.66Å; V119-L157 HydrophobicContact CG1-CD2 3.69Å; V119-L157 HydrophobicContact CG1-CG 4.48Å; V130-L157 HydrophobicContact CG1-CD2 3.92Å; V140-L157 HydrophobicContact CB-CD1 4.03Å; V140-L157 HydrophobicContact CG2-CD1 3.85Å; L141-L157 HydrophobicContact CD2-CB 4.06Å; I144-L157 HydrophobicContact CD1-CB 3.92Å; I144-L157 HydrophobicContact CD1-CD1 3.35Å; I144-L157 HydrophobicContact CD1-CG 4.04Å; I144-L157 HydrophobicContact CG1-CD1 4.45Å; L153-L157 WeakPolarHBondContact O-CB 3.32Å; L153-L157 PolarHBondContact O-N 2.9Å; A154-L157 PolarHBondContact O-N 3.2Å; L157-R159 PolarHBondContact O-N 3.5Å; L157-A160 WeakPolarHBondContact O-CB 3.49Å; L157-A160 PolarHBondContact O-N 3.39Å
158	I	68.9	Low	78.7	Confident	22 Å²	22	38.5 Å²	38.5	11%	0.113	20%	0.196	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.3	-18.7	176.2	-173.4	160.8	0	0	0	114.3	A154 I155 A160 Y174 Y176	A154-I158 VanDerWaalsContact O-CB 3.26Å; A154-I158 WeakPolarHBondContact O-CB 3.48Å; A154-I158 PolarHBondContact O-N 3.46Å; I155-I158 WeakPolarHBondContact O-CG2 3.34Å; I158-A160 PolarHBondContact O-N 3.22Å; I158-Y174 HydrophobicContact CD1-CD1 2.8Å; I158-Y174 HydrophobicContact CD1-CD2 3.64Å; I158-Y174 HydrophobicContact CD1-CE1 3.2Å; I158-Y174 HydrophobicContact CD1-CE2 4.01Å; I158-Y174 HydrophobicContact CD1-CG 3.01Å; I158-Y174 HydrophobicContact CG1-CD1 4.24Å; I158-Y174 HydrophobicContact CG1-CG 4.23Å; I158-Y176 HydrophobicContact CD1-CE1 3.92Å; I158-Y176 HydrophobicContact CD1-CE2 4.4Å
159	R	69.6	Low	78.7	Confident	44 Å²	44	36.4 Å²	36.4	17%	0.166	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.7	-3	174.3	-58	174.6	176	134.7	1.5	112.2	Y120 L157 C212 W213 D282	Y120-R159 PolarHBondContact OH-NH1 3.12Å; L157-R159 PolarHBondContact O-N 3.5Å; R159-C212 PolarHBondContact NE-O 3.47Å; R159-C212 PolarHBondContact NH2-O 3.05Å; R159-W213 WeakPolarHBondContact CD-O 2.86Å; R159-W213 PolarHBondContact NE-O 2.73Å; R159-D282 IonicContact NH2-OD2 2.71Å; R159-D282 PolarHBondContact NH2-OD2 3.11Å
160	A	72.5	Confident	78.8	Confident	7 Å²	7	33.9 Å²	33.9	6%	0.058	18%	0.178	C	C	.	.	S	Bend	trans	-80.4	175.3	165.9	0	0	0	0	0	113.1	V130 N131 L141 L157 I158 P162	V130-A160 HydrophobicContact CB-CB 4.16Å; V130-A160 HydrophobicContact CG1-CB 3.61Å; N131-A160 WeakPolarHBondContact OD1-CB 3.36Å; L141-A160 HydrophobicContact CD1-CB 3.67Å; L141-A160 HydrophobicContact CG-CB 4.18Å; L157-A160 WeakPolarHBondContact O-CB 3.49Å; L157-A160 PolarHBondContact O-N 3.39Å; I158-A160 PolarHBondContact O-N 3.22Å; A160-P162 WeakPolarHBondContact O-CD 3.31Å
161	D	77.9	Confident	78.7	Confident	18 Å²	18	35.1 Å²	35.1	10%	0.096	18%	0.184	C	C	.	.			trans	-85.8	109.3	-178.8	-168.9	-3.2	0	0	0	111.7	N131 E163 I164	N131-D161 PolarHBondContact OD1-N 3.25Å; D161-E163 PolarHBondContact O-N 3.06Å; D161-E163 PolarHBondContact OD1-N 3.13Å; D161-E163 VanDerWaalsContact OD1-N 3.1Å; D161-I164 HydrophobicContact CB-CD1 3.87Å; D161-I164 HydrophobicContact CB-CG1 3.96Å
162	P	78.1	Confident	78.8	Confident	12 Å²	12	31 Å²	31	8%	0.078	16%	0.164	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72	-15.8	-180	30.9	-35.3	0	0	0	113.2	A160 I164 H171 V172	A160-P162 WeakPolarHBondContact O-CD 3.31Å; P162-I164 VanDerWaalsContact C-N 3.35Å; P162-H171 WeakPolarHBondContact O-CB 3.39Å; P162-V172 VanDerWaalsContact CB-O 3.3Å; P162-V172 WeakPolarHBondContact CB-O 3.32Å; P162-V172 PolarHBondContact O-N 2.99Å; P162-V172 VanDerWaalsContact O-N 3.15Å
163	E	78.3	Confident	78.5	Confident	62 Å²	62	30.4 Å²	30.4	29%	0.29	16%	0.162	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.4	-12.7	-176.6	-68.5	-165.9	158.7	0	0	113.9	D161 K165 N191 N196 R200	D161-E163 PolarHBondContact O-N 3.06Å; D161-E163 PolarHBondContact OD1-N 3.13Å; D161-E163 VanDerWaalsContact OD1-N 3.1Å; E163-K165 PolarHBondContact O-N 3.33Å; E163-K165 VanDerWaalsContact O-N 3.16Å; E163-N191 WeakPolarHBondContact CG-O 3.46Å; E163-N196 PolarHBondContact OE1-ND2 2.87Å; E163-N196 VanDerWaalsContact OE2-CB 3.26Å; E163-N196 WeakPolarHBondContact OE2-CB 3.5Å; E163-N196 PolarHBondContact OE2-ND2 3.32Å; E163-R200 IonicContact OE1-NH2 2.73Å
164	I	81.2	Confident	77.9	Confident	33 Å²	33	31 Å²	31	17%	0.169	16%	0.164	C	C	.	.			trans	-61.1	121.3	177.7	-62.7	174.9	0	0	0	108.5	N131 Q133 T139 H142 D161 P162	N131-I164 HydrophobicContact CB-CD1 3.67Å; Q133-I164 HydrophobicContact CG-CG2 3.95Å; Q133-I164 VanDerWaalsContact NE2-CG2 3.28Å; T139-I164 HydrophobicContact CG2-CB 4.22Å; T139-I164 HydrophobicContact CG2-CD1 4.19Å; T139-I164 HydrophobicContact CG2-CG2 3.75Å; H142-I164 PolarHBondContact CE1-O 3.23Å; H142-I164 PolarHBondContact NE2-O 3.18Å; D161-I164 HydrophobicContact CB-CD1 3.87Å; D161-I164 HydrophobicContact CB-CG1 3.96Å; P162-I164 VanDerWaalsContact C-N 3.35Å
165	K	82.5	Confident	77.2	Confident	123 Å²	123	31.9 Å²	31.9	54%	0.535	17%	0.168	S	C	.	.			trans	-90.3	137.3	177.6	-67.4	176.8	-175.1	178.7	0	110.5	Q133 E163 L170 H171	Q133-K165 PolarHBondContact NE2-O 2.9Å; E163-K165 PolarHBondContact O-N 3.33Å; E163-K165 VanDerWaalsContact O-N 3.16Å; K165-L170 CarbonylContact C-O 3.51Å; K165-L170 VanDerWaalsContact CA-O 3.24Å; K165-L170 WeakPolarHBondContact CA-O 3.29Å; K165-H171 HydrophobicContact CG-CB 4.11Å
166	N	81.8	Confident	76.6	Confident	13 Å²	13	34 Å²	34	7%	0.07	18%	0.175	C	C	.	.			trans	-75	175.6	166.9	73.7	6	0	0	0	112.3	G137 N138 S168 G169 L170	G137-N166 VanDerWaalsContact O-CA 3.25Å; G137-N166 WeakPolarHBondContact O-CA 3.46Å; G137-N166 WeakPolarHBondContact O-CB 3.38Å; N138-N166 VanDerWaalsContact OD1-CB 3.31Å; N138-N166 WeakPolarHBondContact OD1-CB 3.41Å; N138-N166 PolarHBondContact OD1-ND2 3.06Å; N166-S168 PolarHBondContact O-N 2.92Å; N166-S168 WeakPolarHBondContact OD1-CA 3.48Å; N166-S168 WeakPolarHBondContact OD1-CB 3.41Å; N166-S168 PolarHBondContact OD1-N 3.49Å; N166-G169 PolarHBondContact O-N 3.29Å; N166-G169 PolarHBondContact OD1-N 2.93Å; N166-L170 PolarHBondContact N-O 3.44Å; N166-L170 WeakPolarHBondContact OD1-CB 3.23Å; N166-L170 PolarHBondContact OD1-N 3.32Å; N166-L170 PolarHBondContact OD1-O 3.29Å
167	N	83.7	Confident	75.5	Confident	120 Å²	120	36.2 Å²	36.2	64%	0.642	20%	0.199	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.6	-12.2	-179.1	-65.3	-4.1	0	0	0	113.3	N135 M136 G137	N135-N167 PolarHBondContact O-ND2 3.47Å; N135-N167 VanDerWaalsContact O-ND2 3.16Å; M136-N167 VanDerWaalsContact O-CB 3.3Å; M136-N167 WeakPolarHBondContact O-CB 2.91Å; M136-N167 PolarHBondContact O-N 3.44Å; M136-N167 VanDerWaalsContact O-N 3.16Å; M136-N167 PolarHBondContact O-ND2 3Å; G137-N167 WeakPolarHBondContact CA-OD1 3.24Å
168	S	73.2	Confident	74.4	Confident	68 Å²	68	38.1 Å²	38.1	48%	0.476	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.2	1.1	174.7	-56.6	0	0	0	0	113.6	N166 L170	N166-S168 PolarHBondContact O-N 2.92Å; N166-S168 WeakPolarHBondContact OD1-CA 3.48Å; N166-S168 WeakPolarHBondContact OD1-CB 3.41Å; N166-S168 PolarHBondContact OD1-N 3.49Å; S168-L170 VanDerWaalsContact C-N 3.27Å; S168-L170 PolarHBondContact O-N 3.1Å
169	G	75.6	Confident	74.3	Confident	24 Å²	24	38.5 Å²	38.5	25%	0.247	21%	0.209	C	C	.	.	S	Bend	trans	74.1	14.1	-176.1	0	0	0	0	0	114.3	N166	N166-G169 PolarHBondContact O-N 3.29Å; N166-G169 PolarHBondContact OD1-N 2.93Å
170	L	77.8	Confident	74.2	Confident	18 Å²	18	42.3 Å²	42.3	9%	0.094	22%	0.224	C	C	.	.			trans	-85.2	143.2	174.7	-57.2	172.6	0	0	0	109.4	L14 H142 K165 N166 S168 L183 V184 K185	L14-L170 HydrophobicContact CD1-CD2 4.42Å; H142-L170 PolarHBondContact NE2-O 3.1Å; H142-L170 VanDerWaalsContact NE2-O 3.16Å; K165-L170 CarbonylContact C-O 3.51Å; K165-L170 VanDerWaalsContact CA-O 3.24Å; K165-L170 WeakPolarHBondContact CA-O 3.29Å; N166-L170 PolarHBondContact N-O 3.44Å; N166-L170 WeakPolarHBondContact OD1-CB 3.23Å; N166-L170 PolarHBondContact OD1-N 3.32Å; N166-L170 PolarHBondContact OD1-O 3.29Å; S168-L170 VanDerWaalsContact C-N 3.27Å; S168-L170 PolarHBondContact O-N 3.1Å; L170-L183 HydrophobicContact CB-CD2 4.3Å; L170-L183 HydrophobicContact CD1-CD1 4.48Å; L170-V184 WeakPolarHBondContact CA-O 3.49Å; L170-K185 HydrophobicContact CD2-CB 3.86Å; L170-K185 HydrophobicContact CD2-CD 4.41Å; L170-K185 HydrophobicContact CD2-CG 4.31Å
171	H	79.9	Confident	74.3	Confident	26 Å²	26	42.9 Å²	42.9	12%	0.12	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	172.7	171.2	64.6	-72.4	0	0	0	109.1	P162 K165 V184	P162-H171 WeakPolarHBondContact O-CB 3.39Å; K165-H171 HydrophobicContact CG-CB 4.11Å; H171-V184 PolarHBondContact N-O 2.84Å; H171-V184 PolarHBondContact ND1-O 2.81Å; H171-V184 VanDerWaalsContact ND1-O 3.1Å; H171-V184 PolarHBondContact O-N 3.47Å
172	V	77.7	Confident	74.1	Confident	2 Å²	2	45.1 Å²	45.1	1%	0.012	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	130.9	-173.3	177.9	0	0	0	0	110.7	L141 P162 A181 W182 L183	L141-V172 HydrophobicContact CB-CB 4.48Å; L141-V172 HydrophobicContact CB-CG2 4.01Å; P162-V172 VanDerWaalsContact CB-O 3.3Å; P162-V172 WeakPolarHBondContact CB-O 3.32Å; P162-V172 PolarHBondContact O-N 2.99Å; P162-V172 VanDerWaalsContact O-N 3.15Å; V172-A181 HydrophobicContact CG1-CB 3.83Å; V172-W182 CarbonylContact C-O 3.58Å; V172-W182 WeakPolarHBondContact CA-O 3.27Å; V172-L183 HydrophobicContact CG2-CD2 3.89Å
173	F	75.3	Confident	74	Confident	12 Å²	12	46.3 Å²	46.3	5%	0.053	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	123	168.7	-175.8	-101.6	0	0	0	108.7	V3 L5 I8 A181 W182 V184 L190 N191	V3-F173 HydrophobicContact CB-CZ 4.04Å; V3-F173 HydrophobicContact CG1-CE1 4.45Å; V3-F173 HydrophobicContact CG1-CZ 4.03Å; L5-F173 HydrophobicContact CD1-CD1 3.6Å; L5-F173 HydrophobicContact CD1-CE1 3.2Å; L5-F173 HydrophobicContact CD1-CZ 4.37Å; L5-F173 HydrophobicContact CD2-CD1 3.92Å; L5-F173 HydrophobicContact CD2-CE1 4.15Å; L5-F173 HydrophobicContact CG-CD1 3.94Å; L5-F173 HydrophobicContact CG-CE1 3.65Å; I8-F173 HydrophobicContact CD1-CD1 4.2Å; I8-F173 HydrophobicContact CD1-CE1 4.02Å; F173-A181 CarbonylContact O-C 3.29Å; F173-A181 VanDerWaalsContact O-CA 3.28Å; F173-A181 WeakPolarHBondContact O-CA 3.21Å; F173-W182 HydrophobicContact CD1-CE3 4.3Å; F173-W182 PolarHBondContact N-O 3.12Å; F173-W182 PolarHBondContact O-N 3.1Å; F173-V184 HydrophobicContact CB-CB 4.39Å; F173-V184 HydrophobicContact CB-CG2 3.36Å; F173-V184 HydrophobicContact CG-CG2 4.29Å; F173-L190 HydrophobicContact CE2-CB 4.39Å; F173-N191 WeakPolarHBondContact CA-ND2 3.15Å; F173-N191 HydrophobicContact CD2-CB 4.22Å; F173-N191 WeakPolarHBondContact CD2-ND2 3.3Å; F173-N191 WeakPolarHBondContact CD2-OD1 3.3Å; F173-N191 HydrophobicContact CE2-CB 4.48Å; F173-N191 WeakPolarHBondContact CE2-ND2 3.47Å; F173-N191 WeakPolarHBondContact CE2-OD1 3.29Å; F173-N191 WeakPolarHBondContact CG-ND2 3.29Å
174	Y	72.9	Confident	73.5	Confident	13 Å²	13	43.4 Å²	43.4	5%	0.051	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	148.3	171.2	178.1	-89.4	0	0	0	111.9	A154 I155 I158 Y176 Q179 R180 A181 N191	A154-Y174 HydrophobicContact CB-CD2 4.11Å; A154-Y174 HydrophobicContact CB-CE2 3.78Å; I155-Y174 VanDerWaalsContact CG1-OH 3.27Å; I155-Y174 WeakPolarHBondContact CG1-OH 3.47Å; I158-Y174 HydrophobicContact CD1-CD1 2.8Å; I158-Y174 HydrophobicContact CD1-CD2 3.64Å; I158-Y174 HydrophobicContact CD1-CE1 3.2Å; I158-Y174 HydrophobicContact CD1-CE2 4.01Å; I158-Y174 HydrophobicContact CD1-CG 3.01Å; I158-Y174 HydrophobicContact CG1-CD1 4.24Å; I158-Y174 HydrophobicContact CG1-CG 4.23Å; Y174-Y176 HydrophobicContact CD1-CD1 4.25Å; Y174-Y176 HydrophobicContact CD1-CD2 4.26Å; Y174-Y176 HydrophobicContact CD1-CE1 4.35Å; Y174-Y176 HydrophobicContact CD1-CE2 4.36Å; Y174-Y176 HydrophobicContact CD1-CG 4.18Å; Y174-Y176 AromaticContact CE1-CD1 3.75Å; Y174-Y176 HydrophobicContact CE1-CD1 3.75Å; Y174-Y176 HydrophobicContact CE1-CE1 4.05Å; Y174-Y176 AromaticContact CE1-CG 3.99Å; Y174-Y176 HydrophobicContact CE1-CG 3.99Å; Y174-Q179 VanDerWaalsContact CE2-C 3.41Å; Y174-Q179 WeakPolarHBondContact CE2-O 3.43Å; Y174-Q179 WeakPolarHBondContact OH-CA 3.5Å; Y174-R180 VanDerWaalsContact CA-O 3.27Å; Y174-R180 WeakPolarHBondContact CA-O 3.33Å; Y174-R180 VanDerWaalsContact CD2-C 3.4Å; Y174-R180 WeakPolarHBondContact CD2-O 3.33Å; Y174-R180 VanDerWaalsContact CG-O 3.29Å; Y174-A181 HydrophobicContact CD2-CB 4.03Å; Y174-N191 PolarHBondContact N-ND2 3.29Å; Y174-N191 PolarHBondContact O-ND2 3.07Å
175	H	67	Low	72.9	Confident	19 Å²	19	47.2 Å²	47.2	9%	0.088	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	114.2	175.3	-167.6	63.3	0	0	0	111.9	V3 L5 G177 E178 Q179 R180 W182	V3-H175 PolarHBondContact O-CE1 3.43Å; V3-H175 PolarHBondContact O-ND1 2.8Å; L5-H175 HydrophobicContact CD1-CB 3.14Å; H175-G177 PolarHBondContact O-N 2.8Å; H175-E178 PolarHBondContact CD2-N 3.36Å; H175-E178 PolarHBondContact O-N 3.46Å; H175-Q179 WeakPolarHBondContact O-CA 3.06Å; H175-Q179 PolarHBondContact O-N 3.12Å; H175-R180 PolarHBondContact N-O 3.3Å; H175-W182 HydrophobicContact CB-CH2 4.12Å; H175-W182 HydrophobicContact CB-CZ3 3.71Å
176	Y	66.8	Low	71.9	Confident	64 Å²	64	47.2 Å²	47.2	25%	0.251	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.4	-30.4	177.8	-66.3	-84.4	0	0	0	113.1	I158 Y174 Y208 Y209	I158-Y176 HydrophobicContact CD1-CE1 3.92Å; I158-Y176 HydrophobicContact CD1-CE2 4.4Å; Y174-Y176 HydrophobicContact CD1-CD1 4.25Å; Y174-Y176 HydrophobicContact CD1-CD2 4.26Å; Y174-Y176 HydrophobicContact CD1-CE1 4.35Å; Y174-Y176 HydrophobicContact CD1-CE2 4.36Å; Y174-Y176 HydrophobicContact CD1-CG 4.18Å; Y174-Y176 AromaticContact CE1-CD1 3.75Å; Y174-Y176 HydrophobicContact CE1-CD1 3.75Å; Y174-Y176 HydrophobicContact CE1-CE1 4.05Å; Y174-Y176 AromaticContact CE1-CG 3.99Å; Y174-Y176 HydrophobicContact CE1-CG 3.99Å; Y176-Y208 HydrophobicContact CE1-CE1 4.37Å; Y176-Y209 VanDerWaalsContact OH-CE1 3.25Å; Y176-Y209 WeakPolarHBondContact OH-CE1 3.3Å
177	G	61.7	Low	70.8	Confident	52 Å²	52	49.9 Å²	49.9	54%	0.536	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.7	-28.5	-178.9	0	0	0	0	0	115.7	H175	H175-G177 PolarHBondContact O-N 2.8Å
178	E	60.6	Low	69.3	Low	48 Å²	48	47.9 Å²	47.9	22%	0.224	26%	0.256	C	S	.	.	T	Hydrogen-bonded Turn	trans	-107.9	-1.8	177.6	-72.8	178.9	177.3	0	0	111.4	N6 H175 R180 W182	N6-E178 PolarHBondContact ND2-OE1 2.79Å; H175-E178 PolarHBondContact CD2-N 3.36Å; H175-E178 PolarHBondContact O-N 3.46Å; E178-R180 HydrophobicContact CB-CB 4.44Å; E178-R180 VanDerWaalsContact O-CG 3.31Å; E178-R180 WeakPolarHBondContact O-CG 3.49Å; E178-R180 PolarHBondContact O-N 3.09Å; E178-R180 VanDerWaalsContact O-N 3.08Å; E178-W182 HydrophobicContact CB-CH2 4.35Å; E178-W182 VanDerWaalsContact OE2-CH2 3.23Å; E178-W182 WeakPolarHBondContact OE2-CH2 3.35Å; E178-W182 WeakPolarHBondContact OE2-CZ2 3.38Å
179	Q	67.3	Low	68.2	Low	30 Å²	30	48 Å²	48	14%	0.14	27%	0.269	C	S	.	.	T	Hydrogen-bonded Turn	trans	50.7	33.2	-177.9	-58.1	-172.7	-18.7	0	0	114.4	I155 Y174 H175 F285	I155-Q179 HydrophobicContact CD1-CB 3.82Å; I155-Q179 HydrophobicContact CD1-CG 4.22Å; I155-Q179 HydrophobicContact CG1-CB 3.79Å; I155-Q179 HydrophobicContact CG1-CG 4.26Å; Y174-Q179 VanDerWaalsContact CE2-C 3.41Å; Y174-Q179 WeakPolarHBondContact CE2-O 3.43Å; Y174-Q179 WeakPolarHBondContact OH-CA 3.5Å; H175-Q179 WeakPolarHBondContact O-CA 3.06Å; H175-Q179 PolarHBondContact O-N 3.12Å; Q179-F285 VanDerWaalsContact NE2-CD1 3.29Å
180	R	67.4	Low	67.2	Low	124 Å²	124	50.6 Å²	50.6	47%	0.468	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	151.6	-173.9	-81.3	170.1	179	-145.7	-9.4	111.4	Y174 H175 E178 W182	Y174-R180 VanDerWaalsContact CA-O 3.27Å; Y174-R180 WeakPolarHBondContact CA-O 3.33Å; Y174-R180 VanDerWaalsContact CD2-C 3.4Å; Y174-R180 WeakPolarHBondContact CD2-O 3.33Å; Y174-R180 VanDerWaalsContact CG-O 3.29Å; H175-R180 PolarHBondContact N-O 3.3Å; E178-R180 HydrophobicContact CB-CB 4.44Å; E178-R180 VanDerWaalsContact O-CG 3.31Å; E178-R180 WeakPolarHBondContact O-CG 3.49Å; E178-R180 PolarHBondContact O-N 3.09Å; E178-R180 VanDerWaalsContact O-N 3.08Å; R180-W182 HydrophobicContact CB-CE3 4.39Å; R180-W182 HydrophobicContact CB-CH2 3.26Å; R180-W182 HydrophobicContact CB-CZ2 3.56Å; R180-W182 HydrophobicContact CB-CZ3 3.67Å; R180-W182 HydrophobicContact CG-CH2 4.46Å; R180-W182 HydrophobicContact CG-CZ2 4.49Å; R180-W182 WeakPolarHBondContact O-CZ3 3.48Å
181	A	72.9	Confident	66.2	Low	19 Å²	19	51.4 Å²	51.4	16%	0.157	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	145.1	177.1	0	0	0	0	0	111	C145 A154 V172 F173 Y174	C145-A181 VanDerWaalsContact SG-CB 3.5Å; A154-A181 HydrophobicContact CB-CB 4.21Å; V172-A181 HydrophobicContact CG1-CB 3.83Å; F173-A181 CarbonylContact O-C 3.29Å; F173-A181 VanDerWaalsContact O-CA 3.28Å; F173-A181 WeakPolarHBondContact O-CA 3.21Å; Y174-A181 HydrophobicContact CD2-CB 4.03Å
182	W	75.3	Confident	65.4	Low	65 Å²	65	50.3 Å²	50.3	25%	0.246	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	155.4	177.1	-60.6	-94.7	0	0	0	110.9	L5 V172 F173 H175 E178 R180	L5-W182 HydrophobicContact CB-CH2 3.71Å; L5-W182 HydrophobicContact CB-CZ2 3.97Å; L5-W182 HydrophobicContact CB-CZ3 4.13Å; L5-W182 HydrophobicContact CD1-CD2 4.42Å; L5-W182 HydrophobicContact CD1-CE3 3.55Å; L5-W182 HydrophobicContact CD1-CH2 3.31Å; L5-W182 HydrophobicContact CD1-CZ2 4.23Å; L5-W182 HydrophobicContact CD1-CZ3 2.94Å; L5-W182 HydrophobicContact CD2-CB 4.42Å; L5-W182 HydrophobicContact CD2-CD2 3.17Å; L5-W182 VanDerWaalsContact CD2-CE2 3.49Å; L5-W182 HydrophobicContact CD2-CE3 3.11Å; L5-W182 HydrophobicContact CD2-CG 3.79Å; L5-W182 HydrophobicContact CD2-CH2 3.63Å; L5-W182 HydrophobicContact CD2-CZ2 3.69Å; L5-W182 HydrophobicContact CD2-CZ3 3.39Å; L5-W182 HydrophobicContact CG-CD2 4.26Å; L5-W182 HydrophobicContact CG-CE3 3.83Å; L5-W182 HydrophobicContact CG-CH2 3.7Å; L5-W182 HydrophobicContact CG-CZ2 4.15Å; L5-W182 HydrophobicContact CG-CZ3 3.58Å; V172-W182 CarbonylContact C-O 3.58Å; V172-W182 WeakPolarHBondContact CA-O 3.27Å; F173-W182 HydrophobicContact CD1-CE3 4.3Å; F173-W182 PolarHBondContact N-O 3.12Å; F173-W182 PolarHBondContact O-N 3.1Å; H175-W182 HydrophobicContact CB-CH2 4.12Å; H175-W182 HydrophobicContact CB-CZ3 3.71Å; E178-W182 HydrophobicContact CB-CH2 4.35Å; E178-W182 VanDerWaalsContact OE2-CH2 3.23Å; E178-W182 WeakPolarHBondContact OE2-CH2 3.35Å; E178-W182 WeakPolarHBondContact OE2-CZ2 3.38Å; R180-W182 HydrophobicContact CB-CE3 4.39Å; R180-W182 HydrophobicContact CB-CH2 3.26Å; R180-W182 HydrophobicContact CB-CZ2 3.56Å; R180-W182 HydrophobicContact CB-CZ3 3.67Å; R180-W182 HydrophobicContact CG-CH2 4.46Å; R180-W182 HydrophobicContact CG-CZ2 4.49Å; R180-W182 WeakPolarHBondContact O-CZ3 3.48Å
183	L	75.1	Confident	65.3	Low	37 Å²	37	50.4 Å²	50.4	19%	0.194	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	131.7	171.2	-72.8	170	0	0	0	111	M13 H142 C145 L146 L170 V172	M13-L183 WeakPolarHBondContact CE-O 3.38Å; H142-L183 HydrophobicContact CB-CD2 4.47Å; C145-L183 HydrophobicContact CB-CD1 4.14Å; C145-L183 HydrophobicContact CB-CD2 4.43Å; C145-L183 HydrophobicContact CB-CG 3.76Å; L146-L183 HydrophobicContact CD1-CD1 4.39Å; L146-L183 HydrophobicContact CD2-CD1 3.53Å; L146-L183 HydrophobicContact CG-CD1 3.75Å; L170-L183 HydrophobicContact CB-CD2 4.3Å; L170-L183 HydrophobicContact CD1-CD1 4.48Å; V172-L183 HydrophobicContact CG2-CD2 3.89Å
184	V	68.5	Low	65.7	Low	1 Å²	1	50.2 Å²	50.2	1%	0.006	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	143	-173.3	176	0	0	0	0	110.8	M13 L170 H171 F173 L187	M13-V184 HydrophobicContact CE-CB 4.39Å; M13-V184 HydrophobicContact CE-CG2 3.64Å; M13-V184 HydrophobicContact SD-CB 4.06Å; M13-V184 HydrophobicContact SD-CG1 3.72Å; M13-V184 HydrophobicContact SD-CG2 3.72Å; L170-V184 WeakPolarHBondContact CA-O 3.49Å; H171-V184 PolarHBondContact N-O 2.84Å; H171-V184 PolarHBondContact ND1-O 2.81Å; H171-V184 VanDerWaalsContact ND1-O 3.1Å; H171-V184 PolarHBondContact O-N 3.47Å; F173-V184 HydrophobicContact CB-CB 4.39Å; F173-V184 HydrophobicContact CB-CG2 3.36Å; F173-V184 HydrophobicContact CG-CG2 4.29Å; V184-L187 HydrophobicContact CB-CD1 4.37Å; V184-L187 HydrophobicContact CG1-CB 3.51Å; V184-L187 HydrophobicContact CG1-CD1 3.31Å; V184-L187 HydrophobicContact CG1-CG 3.45Å; V184-L187 VanDerWaalsContact CG1-CG 3.45Å; V184-L187 HydrophobicContact CG2-CD1 4.15Å
185	K	67.7	Low	66.2	Low	114 Å²	114	50 Å²	50	50%	0.496	28%	0.276	S	S	.	.	S	Bend	trans	-117	131.9	169.3	-158.8	173.2	-178.2	175.6	0	109.5	L170 L187	L170-K185 HydrophobicContact CD2-CB 3.86Å; L170-K185 HydrophobicContact CD2-CD 4.41Å; L170-K185 HydrophobicContact CD2-CG 4.31Å; K185-L187 VanDerWaalsContact C-N 3.3Å; K185-L187 PolarHBondContact O-N 3.08Å; K185-L187 VanDerWaalsContact O-N 3.15Å
186	N	61.1	Low	66.9	Low	123 Å²	123	49.8 Å²	49.8	66%	0.658	28%	0.276	S	S	*	.	S	Bend	trans	53.7	32	170.1	-58.9	-15.6	0	0	0	116.6	P188	N186-P188 WeakPolarHBondContact O-CD 3.33Å
187	L	59.3	Low	67.7	Low	69 Å²	69	46.8 Å²	46.8	36%	0.361	26%	0.264	S	S	.	.			trans	-83	111.3	165.3	-83.3	174.5	0	0	0	109.6	I8 M13 V184 K185	I8-L187 HydrophobicContact CD1-CD1 4.12Å; I8-L187 HydrophobicContact CG2-CD1 4.42Å; M13-L187 HydrophobicContact SD-CD1 3.65Å; M13-L187 HydrophobicContact SD-CG 4.3Å; V184-L187 HydrophobicContact CB-CD1 4.37Å; V184-L187 HydrophobicContact CG1-CB 3.51Å; V184-L187 HydrophobicContact CG1-CD1 3.31Å; V184-L187 HydrophobicContact CG1-CG 3.45Å; V184-L187 VanDerWaalsContact CG1-CG 3.45Å; V184-L187 HydrophobicContact CG2-CD1 4.15Å; K185-L187 VanDerWaalsContact C-N 3.3Å; K185-L187 PolarHBondContact O-N 3.08Å; K185-L187 VanDerWaalsContact O-N 3.15Å
188	P	52.1	Low	68.9	Low	78 Å²	78	44.3 Å²	44.3	51%	0.506	24%	0.238	S	C	.	.			trans	-75.2	129.7	170.6	30.1	-32	0	0	0	110.2	N186	N186-P188 WeakPolarHBondContact O-CD 3.33Å
189	G	50.8	Low	70.1	Confident	71 Å²	71	46.6 Å²	46.6	73%	0.732	25%	0.252	S	S	*	.	S	Bend	trans	115	0.9	142.5	0	0	0	0	0	121.4
190	L	53.2	Low	70.9	Confident	77 Å²	77	52 Å²	52	40%	0.403	27%	0.271	S	S	.	.	S	Bend	trans	-128.8	-13	-171.2	-87.3	142.4	0	0	0	119.9	M1 V3 F173	M1-L190 HydrophobicContact CB-CD2 4.25Å; M1-L190 HydrophobicContact SD-CD2 3.98Å; V3-L190 HydrophobicContact CG2-CD1 3.8Å; V3-L190 HydrophobicContact CG2-CD2 3.81Å; V3-L190 HydrophobicContact CG2-CG 4.24Å; F173-L190 HydrophobicContact CE2-CB 4.39Å
191	N	57.3	Low	71.8	Confident	35 Å²	35	50.3 Å²	50.3	19%	0.187	27%	0.268	C	S	.	.			trans	-122.7	89.9	-178.6	-80.4	12.7	0	0	0	113.4	E163 F173 Y174	E163-N191 WeakPolarHBondContact CG-O 3.46Å; F173-N191 WeakPolarHBondContact CA-ND2 3.15Å; F173-N191 HydrophobicContact CD2-CB 4.22Å; F173-N191 WeakPolarHBondContact CD2-ND2 3.3Å; F173-N191 WeakPolarHBondContact CD2-OD1 3.3Å; F173-N191 HydrophobicContact CE2-CB 4.48Å; F173-N191 WeakPolarHBondContact CE2-ND2 3.47Å; F173-N191 WeakPolarHBondContact CE2-OD1 3.29Å; F173-N191 WeakPolarHBondContact CG-ND2 3.29Å; Y174-N191 PolarHBondContact N-ND2 3.29Å; Y174-N191 PolarHBondContact O-ND2 3.07Å
192	C	64.2	Low	72.4	Confident	4 Å²	4	51.6 Å²	51.6	3%	0.027	27%	0.273	C	S	.	.			trans	-81.6	131.1	165.3	53.3	0	0	0	0	109.7	N196 K205 Y209	C192-N196 HydrophobicContact CB-CB 4.32Å; C192-K205 WeakPolarHBondContact SG-CD 3.43Å; C192-K205 WeakPolarHBondContact SG-CE 3.17Å; C192-K205 PolarHBondContact SG-NZ 2.82Å; C192-Y209 VanDerWaalsContact O-CE2 3.28Å; C192-Y209 WeakPolarHBondContact O-CE2 3.39Å; C192-Y209 PolarHBondContact O-OH 2.92Å
193	G	75.6	Confident	72.9	Confident	4 Å²	4	50.9 Å²	50.9	4%	0.041	27%	0.273	C	S	.	.			trans	-73.3	175.1	161.1	0	0	0	0	0	111.8	W195 N196 A197	G193-W195 PolarHBondContact O-N 3.17Å; G193-N196 PolarHBondContact O-N 3.04Å; G193-A197 WeakPolarHBondContact O-CB 3.41Å; G193-A197 PolarHBondContact O-N 2.99Å
194	I	82.7	Confident	73.4	Confident	8 Å²	8	55.9 Å²	55.9	4%	0.041	30%	0.298	C	S	.	.	H	α-helix	trans	-58.7	-38.4	173.4	-167.9	169.2	0	0	0	111.9	A197 I198 Y209 L210 C214 L226	I194-A197 PolarHBondContact O-N 3.12Å; I194-I198 HydrophobicContact CG1-CD1 4.29Å; I194-I198 WeakPolarHBondContact O-CG1 3.41Å; I194-I198 PolarHBondContact O-N 3.13Å; I194-Y209 HydrophobicContact CB-CD2 4Å; I194-Y209 HydrophobicContact CB-CG 4.22Å; I194-Y209 HydrophobicContact CG1-CD2 4.41Å; I194-L210 HydrophobicContact CD1-CD2 4.03Å; I194-C214 HydrophobicContact CD1-CB 3.77Å; I194-L226 HydrophobicContact CD1-CD2 4.35Å
195	W	84.4	Confident	74.1	Confident	7 Å²	7	59.2 Å²	59.2	3%	0.027	31%	0.313	C	S	.	.	H	α-helix	trans	-61.3	-46	177.1	-65.3	95.8	0	0	0	112.2	N131 G193 I198 N199 A218 Q220 L226 C229	N131-W195 PolarHBondContact ND2-NE1 3.01Å; G193-W195 PolarHBondContact O-N 3.17Å; W195-I198 PolarHBondContact O-N 3.32Å; W195-N199 VanDerWaalsContact O-CG 3.3Å; W195-N199 PolarHBondContact O-N 3.24Å; W195-N199 PolarHBondContact O-ND2 3.48Å; W195-A218 WeakPolarHBondContact CH2-O 3.36Å; W195-A218 HydrophobicContact CZ2-CB 4Å; W195-Q220 HydrophobicContact CD2-CG 4.08Å; W195-Q220 HydrophobicContact CE3-CG 3.82Å; W195-Q220 VanDerWaalsContact CE3-NE2 3.25Å; W195-Q220 HydrophobicContact CH2-CB 4.44Å; W195-Q220 HydrophobicContact CH2-CG 3.68Å; W195-Q220 HydrophobicContact CZ2-CG 3.95Å; W195-Q220 HydrophobicContact CZ3-CG 3.61Å; W195-L226 HydrophobicContact CD2-CD1 3.64Å; W195-L226 HydrophobicContact CE3-CD1 3.56Å; W195-L226 HydrophobicContact CG-CD1 4.41Å; W195-L226 VanDerWaalsContact CH2-CA 3.47Å; W195-L226 HydrophobicContact CH2-CB 3.75Å; W195-L226 HydrophobicContact CH2-CD1 3.72Å; W195-L226 HydrophobicContact CH2-CG 4.37Å; W195-L226 HydrophobicContact CZ2-CB 4.23Å; W195-L226 HydrophobicContact CZ2-CD1 3.78Å; W195-L226 HydrophobicContact CZ3-CB 4.11Å; W195-L226 HydrophobicContact CZ3-CD1 3.6Å; W195-L226 HydrophobicContact CZ3-CG 4.46Å; W195-C229 HydrophobicContact CE3-CB 4.37Å; W195-C229 HydrophobicContact CZ3-CB 4.03Å
196	N	81.8	Confident	75	Confident	16 Å²	16	53.8 Å²	53.8	9%	0.086	29%	0.289	C	S	.	.	H	α-helix	trans	-73	-32.5	177.4	-176.6	35.7	0	0	0	112.4	E163 C192 G193 I198 N199 R200	E163-N196 PolarHBondContact OE1-ND2 2.87Å; E163-N196 VanDerWaalsContact OE2-CB 3.26Å; E163-N196 WeakPolarHBondContact OE2-CB 3.5Å; E163-N196 PolarHBondContact OE2-ND2 3.32Å; C192-N196 HydrophobicContact CB-CB 4.32Å; G193-N196 PolarHBondContact O-N 3.04Å; N196-I198 VanDerWaalsContact C-N 3.29Å; N196-I198 PolarHBondContact O-N 3.37Å; N196-N199 PolarHBondContact O-N 3.13Å; N196-R200 PolarHBondContact ND2-NE 2.84Å; N196-R200 VanDerWaalsContact ND2-NE 3.13Å; N196-R200 PolarHBondContact ND2-NH2 3.12Å; N196-R200 WeakPolarHBondContact O-CB 3.45Å; N196-R200 WeakPolarHBondContact O-CG 3.4Å; N196-R200 PolarHBondContact O-N 2.97Å; N196-R200 PolarHBondContact OD1-NE 2.88Å
197	A	83.5	Confident	76.2	Confident	0 Å²	0	50.7 Å²	50.7	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-60.7	-40.1	171.3	0	0	0	0	0	111.4	G193 I194 R200 E201 D202 K205 M206 Y209	G193-A197 WeakPolarHBondContact O-CB 3.41Å; G193-A197 PolarHBondContact O-N 2.99Å; I194-A197 PolarHBondContact O-N 3.12Å; A197-R200 PolarHBondContact O-N 3.21Å; A197-E201 PolarHBondContact O-N 3.2Å; A197-E201 VanDerWaalsContact O-N 3.11Å; A197-D202 PolarHBondContact O-N 3.14Å; A197-K205 HydrophobicContact CB-CB 4.03Å; A197-M206 HydrophobicContact CB-CB 4.43Å; A197-Y209 HydrophobicContact CB-CD2 4.23Å; A197-Y209 HydrophobicContact CB-CE2 4.2Å
198	I	86.4	Confident	77.4	Confident	0 Å²	0	51.3 Å²	51.3	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-65.6	-48	173.7	-68.6	165.7	0	0	0	111	I194 W195 N196 R200 E201 M206 L226 T233 L238 I242	I194-I198 HydrophobicContact CG1-CD1 4.29Å; I194-I198 WeakPolarHBondContact O-CG1 3.41Å; I194-I198 PolarHBondContact O-N 3.13Å; W195-I198 PolarHBondContact O-N 3.32Å; N196-I198 VanDerWaalsContact C-N 3.29Å; N196-I198 PolarHBondContact O-N 3.37Å; I198-R200 PolarHBondContact O-N 3.17Å; I198-E201 PolarHBondContact O-N 3.09Å; I198-M206 HydrophobicContact CG1-CG 4.18Å; I198-L226 HydrophobicContact CD1-CD1 3.39Å; I198-L226 HydrophobicContact CD1-CD2 4.38Å; I198-L226 HydrophobicContact CD1-CG 3.8Å; I198-T233 HydrophobicContact CG2-CG2 4.2Å; I198-L238 HydrophobicContact CG1-CD2 4.36Å; I198-L238 HydrophobicContact CG2-CD2 4.04Å; I198-I242 HydrophobicContact CD1-CD1 3.79Å; I198-I242 HydrophobicContact CG1-CD1 4.26Å
199	N	84.8	Confident	79	Confident	96 Å²	96	48.5 Å²	48.5	51%	0.513	25%	0.25	S	S	.	.	H	α-helix	trans	-62.5	-28.8	179.7	-69.7	-17.4	0	0	0	113.4	W195 N196	W195-N199 VanDerWaalsContact O-CG 3.3Å; W195-N199 PolarHBondContact O-N 3.24Å; W195-N199 PolarHBondContact O-ND2 3.48Å; N196-N199 PolarHBondContact O-N 3.13Å
200	R	84.6	Confident	80.7	Confident	143 Å²	143	45.4 Å²	45.4	54%	0.54	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.5	-2.2	175.7	-67.2	-179	-173	-177	6.6	113.6	E163 N196 A197 I198 D202	E163-R200 IonicContact OE1-NH2 2.73Å; N196-R200 PolarHBondContact ND2-NE 2.84Å; N196-R200 VanDerWaalsContact ND2-NE 3.13Å; N196-R200 PolarHBondContact ND2-NH2 3.12Å; N196-R200 WeakPolarHBondContact O-CB 3.45Å; N196-R200 WeakPolarHBondContact O-CG 3.4Å; N196-R200 PolarHBondContact O-N 2.97Å; N196-R200 PolarHBondContact OD1-NE 2.88Å; A197-R200 PolarHBondContact O-N 3.21Å; I198-R200 PolarHBondContact O-N 3.17Å; R200-D202 HydrophobicContact CB-CB 4.43Å; R200-D202 PolarHBondContact O-N 3.11Å
201	E	86.6	Confident	82.3	Confident	89 Å²	89	42.1 Å²	42.1	42%	0.416	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.6	32.7	-172	-57.4	-176.5	-152.2	0	0	113.5	A197 I198 M203 N235 L238	A197-E201 PolarHBondContact O-N 3.2Å; A197-E201 VanDerWaalsContact O-N 3.11Å; I198-E201 PolarHBondContact O-N 3.09Å; E201-M203 PolarHBondContact O-N 3.07Å; E201-N235 PolarHBondContact OE2-ND2 3.28Å; E201-N235 VanDerWaalsContact OE2-ND2 3.11Å; E201-L238 HydrophobicContact CG-CD1 4.46Å
202	D	85.3	Confident	83.5	Confident	46 Å²	46	40.8 Å²	40.8	25%	0.246	19%	0.193	C	C	.	.			trans	-81.6	84.2	-179.9	-167.2	-30.5	0	0	0	110.1	A197 R200 I204 K205 M206	A197-D202 PolarHBondContact O-N 3.14Å; R200-D202 HydrophobicContact CB-CB 4.43Å; R200-D202 PolarHBondContact O-N 3.11Å; D202-I204 PolarHBondContact O-N 3.18Å; D202-I204 PolarHBondContact OD1-N 3.35Å; D202-K205 HydrophobicContact CB-CB 4.44Å; D202-K205 HydrophobicContact CB-CD 4.49Å; D202-K205 VanDerWaalsContact CG-CD 3.47Å; D202-K205 PolarHBondContact O-N 3.35Å; D202-K205 PolarHBondContact OD1-N 3.38Å; D202-K205 WeakPolarHBondContact OD2-CD 3.43Å; D202-K205 IonicContact OD2-NZ 3.99Å; D202-M206 WeakPolarHBondContact O-CB 3.4Å; D202-M206 PolarHBondContact O-N 3.05Å
203	M	85.7	Confident	84.6	Confident	50 Å²	50	40.9 Å²	40.9	25%	0.246	19%	0.193	C	C	.	.	H	α-helix	trans	-56.6	-34.6	-177	-67.7	-63.8	-67.5	0	0	113.2	E201 M206 D207 E237 L238 R241	E201-M203 PolarHBondContact O-N 3.07Å; M203-M206 HydrophobicContact CE-CE 4.17Å; M203-M206 PolarHBondContact O-N 2.86Å; M203-M206 HydrophobicContact SD-CE 4.14Å; M203-D207 WeakPolarHBondContact O-CB 3.37Å; M203-D207 PolarHBondContact O-N 3.34Å; M203-E237 HydrophobicContact CE-CG 4.17Å; M203-L238 HydrophobicContact SD-CB 3.85Å; M203-L238 HydrophobicContact SD-CD1 4.22Å; M203-L238 HydrophobicContact SD-CG 4.11Å; M203-R241 HydrophobicContact CE-CG 4.01Å
204	I	86	Confident	85.1	Confident	143 Å²	143	41 Å²	41	73%	0.733	19%	0.193	S	C	*	.	H	α-helix	trans	-68.7	-49.1	-176.8	-61	173.8	0	0	0	110.3	D202 M206 Y208	D202-I204 PolarHBondContact O-N 3.18Å; D202-I204 PolarHBondContact OD1-N 3.35Å; I204-M206 VanDerWaalsContact C-N 3.33Å; I204-Y208 WeakPolarHBondContact O-CB 3.27Å; I204-Y208 PolarHBondContact O-N 3.13Å
205	K	82.1	Confident	85.2	Confident	70 Å²	70	43 Å²	43	30%	0.304	20%	0.2	S	C	.	.	H	α-helix	trans	-67.8	-36.1	176	-88.4	141.3	157.3	-161.6	0	111.9	C192 A197 D202 Y208 Y209	C192-K205 WeakPolarHBondContact SG-CD 3.43Å; C192-K205 WeakPolarHBondContact SG-CE 3.17Å; C192-K205 PolarHBondContact SG-NZ 2.82Å; A197-K205 HydrophobicContact CB-CB 4.03Å; D202-K205 HydrophobicContact CB-CB 4.44Å; D202-K205 HydrophobicContact CB-CD 4.49Å; D202-K205 VanDerWaalsContact CG-CD 3.47Å; D202-K205 PolarHBondContact O-N 3.35Å; D202-K205 PolarHBondContact OD1-N 3.38Å; D202-K205 WeakPolarHBondContact OD2-CD 3.43Å; D202-K205 IonicContact OD2-NZ 3.99Å; K205-Y208 WeakPolarHBondContact O-CB 3.45Å; K205-Y208 PolarHBondContact O-N 3.45Å; K205-Y209 HydrophobicContact CB-CD2 4.44Å; K205-Y209 HydrophobicContact CB-CE2 4.04Å; K205-Y209 WeakPolarHBondContact O-CD2 3.41Å; K205-Y209 VanDerWaalsContact O-CG 3.3Å; K205-Y209 PolarHBondContact O-N 3.49Å
206	M	86.9	Confident	85.2	Confident	0 Å²	0	43 Å²	43	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-62.6	-50	176.1	-169.6	-82.8	-90.9	0	0	111.3	A197 I198 D202 M203 I204 Y208 Y209 L210 L238 R241 I242	A197-M206 HydrophobicContact CB-CB 4.43Å; I198-M206 HydrophobicContact CG1-CG 4.18Å; D202-M206 WeakPolarHBondContact O-CB 3.4Å; D202-M206 PolarHBondContact O-N 3.05Å; M203-M206 HydrophobicContact CE-CE 4.17Å; M203-M206 PolarHBondContact O-N 2.86Å; M203-M206 HydrophobicContact SD-CE 4.14Å; I204-M206 VanDerWaalsContact C-N 3.33Å; M206-Y208 VanDerWaalsContact C-N 3.3Å; M206-Y208 PolarHBondContact O-N 3.3Å; M206-Y209 PolarHBondContact O-N 3.44Å; M206-Y209 VanDerWaalsContact O-N 3.17Å; M206-L210 HydrophobicContact CE-CD1 4.4Å; M206-L210 WeakPolarHBondContact O-CG 3.46Å; M206-L210 PolarHBondContact O-N 3.34Å; M206-L210 HydrophobicContact SD-CD1 3.25Å; M206-L210 WeakPolarHBondContact SD-CD1 3.42Å; M206-L210 HydrophobicContact SD-CG 3.75Å; M206-L238 HydrophobicContact CE-CB 4.49Å; M206-L238 HydrophobicContact CE-CG 3.89Å; M206-R241 HydrophobicContact CE-CB 3.73Å; M206-I242 HydrophobicContact CE-CG1 4.13Å; M206-I242 HydrophobicContact SD-CG1 4.18Å
207	D	87.1	Confident	85.4	Confident	59 Å²	59	45.8 Å²	45.8	32%	0.316	22%	0.215	S	C	.	.	H	α-helix	trans	-59.4	-40	174.5	-86.3	-17.6	0	0	0	111.4	M203 S211 R241	M203-D207 WeakPolarHBondContact O-CB 3.37Å; M203-D207 PolarHBondContact O-N 3.34Å; D207-S211 WeakPolarHBondContact O-CB 3.44Å; D207-S211 PolarHBondContact O-N 3.09Å; D207-S211 PolarHBondContact O-OG 2.56Å; D207-R241 IonicContact OD1-NH1 3.85Å; D207-R241 PolarHBondContact OD1-NH1 2.94Å; D207-R241 IonicContact OD2-CZ 2.73Å; D207-R241 IonicContact OD2-NH1 3.81Å; D207-R241 PolarHBondContact OD2-NH1 3.15Å
208	Y	84.9	Confident	85.3	Confident	82 Å²	82	47 Å²	47	32%	0.322	23%	0.226	S	C	.	.	H	α-helix	trans	-60.3	-48.2	174.2	177.9	-100.1	0	0	0	111.6	Y176 I204 K205 M206 S211 C212	Y176-Y208 HydrophobicContact CE1-CE1 4.37Å; I204-Y208 WeakPolarHBondContact O-CB 3.27Å; I204-Y208 PolarHBondContact O-N 3.13Å; K205-Y208 WeakPolarHBondContact O-CB 3.45Å; K205-Y208 PolarHBondContact O-N 3.45Å; M206-Y208 VanDerWaalsContact C-N 3.3Å; M206-Y208 PolarHBondContact O-N 3.3Å; Y208-S211 WeakPolarHBondContact CA-OG 3.5Å; Y208-S211 CarbonylContact O-C 3.6Å; Y208-S211 WeakPolarHBondContact O-CA 3.21Å; Y208-S211 WeakPolarHBondContact O-CB 3.38Å; Y208-S211 PolarHBondContact O-N 2.68Å; Y208-S211 VanDerWaalsContact O-N 3.08Å; Y208-S211 PolarHBondContact O-OG 2.67Å; Y208-C212 PolarHBondContact O-N 3.25Å; Y208-C212 PolarHBondContact O-SG 3.2Å
209	Y	85.4	Confident	85	Confident	18 Å²	18	51.2 Å²	51.2	7%	0.071	25%	0.248	C	C	.	.	H	α-helix	trans	-66.2	-40.4	178.6	-67.6	-42.1	0	0	0	113.2	Y176 C192 I194 A197 K205 M206 S211 C212 C214	Y176-Y209 VanDerWaalsContact OH-CE1 3.25Å; Y176-Y209 WeakPolarHBondContact OH-CE1 3.3Å; C192-Y209 VanDerWaalsContact O-CE2 3.28Å; C192-Y209 WeakPolarHBondContact O-CE2 3.39Å; C192-Y209 PolarHBondContact O-OH 2.92Å; I194-Y209 HydrophobicContact CB-CD2 4Å; I194-Y209 HydrophobicContact CB-CG 4.22Å; I194-Y209 HydrophobicContact CG1-CD2 4.41Å; A197-Y209 HydrophobicContact CB-CD2 4.23Å; A197-Y209 HydrophobicContact CB-CE2 4.2Å; K205-Y209 HydrophobicContact CB-CD2 4.44Å; K205-Y209 HydrophobicContact CB-CE2 4.04Å; K205-Y209 WeakPolarHBondContact O-CD2 3.41Å; K205-Y209 VanDerWaalsContact O-CG 3.3Å; K205-Y209 PolarHBondContact O-N 3.49Å; M206-Y209 PolarHBondContact O-N 3.44Å; M206-Y209 VanDerWaalsContact O-N 3.17Å; Y209-S211 PolarHBondContact O-N 3.32Å; Y209-C212 CarbonylContact O-C 3.55Å; Y209-C212 PolarHBondContact O-N 3.45Å; Y209-C214 VanDerWaalsContact O-CB 3.3Å; Y209-C214 WeakPolarHBondContact O-CB 3.33Å; Y209-C214 PolarHBondContact O-N 3Å; Y209-C214 PolarHBondContact O-SG 3.5Å
210	L	87.2	Confident	84.6	Confident	6 Å²	6	48.4 Å²	48.4	3%	0.031	23%	0.232	C	C	.	.	H	α-helix	trans	-62.5	-29.9	171.7	-69.9	-176.7	0	0	0	112.1	I194 M206 T216 I242 A245 N249	I194-L210 HydrophobicContact CD1-CD2 4.03Å; M206-L210 HydrophobicContact CE-CD1 4.4Å; M206-L210 WeakPolarHBondContact O-CG 3.46Å; M206-L210 PolarHBondContact O-N 3.34Å; M206-L210 HydrophobicContact SD-CD1 3.25Å; M206-L210 WeakPolarHBondContact SD-CD1 3.42Å; M206-L210 HydrophobicContact SD-CG 3.75Å; L210-T216 HydrophobicContact CD2-CG2 4.03Å; L210-I242 HydrophobicContact CD1-CG1 4.4Å; L210-A245 HydrophobicContact CB-CB 4.34Å; L210-A245 HydrophobicContact CD1-CB 3.87Å; L210-A245 HydrophobicContact CD2-CB 4.01Å; L210-A245 HydrophobicContact CG-CB 4.31Å; L210-N249 PolarHBondContact O-ND2 3.37Å; L210-N249 VanDerWaalsContact O-ND2 3.08Å
211	S	86.4	Confident	83.9	Confident	9 Å²	9	45 Å²	45	6%	0.063	23%	0.228	C	C	.	.	H	α-helix	trans	-78.6	-18.5	173	79.8	0	0	0	0	114.4	D207 Y208 Y209 W213 R283	D207-S211 WeakPolarHBondContact O-CB 3.44Å; D207-S211 PolarHBondContact O-N 3.09Å; D207-S211 PolarHBondContact O-OG 2.56Å; Y208-S211 WeakPolarHBondContact CA-OG 3.5Å; Y208-S211 CarbonylContact O-C 3.6Å; Y208-S211 WeakPolarHBondContact O-CA 3.21Å; Y208-S211 WeakPolarHBondContact O-CB 3.38Å; Y208-S211 PolarHBondContact O-N 2.68Å; Y208-S211 VanDerWaalsContact O-N 3.08Å; Y208-S211 PolarHBondContact O-OG 2.67Å; Y209-S211 PolarHBondContact O-N 3.32Å; S211-W213 PolarHBondContact O-N 3.01Å; S211-R283 PolarHBondContact O-N 3.49Å
212	C	82.6	Confident	83.3	Confident	6 Å²	6	45.6 Å²	45.6	4%	0.041	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.8	22.8	172	-58.7	0	0	0	0	112.6	R159 Y208 Y209 C214 D282	R159-C212 PolarHBondContact NE-O 3.47Å; R159-C212 PolarHBondContact NH2-O 3.05Å; Y208-C212 PolarHBondContact O-N 3.25Å; Y208-C212 PolarHBondContact O-SG 3.2Å; Y209-C212 CarbonylContact O-C 3.55Å; Y209-C212 PolarHBondContact O-N 3.45Å; C212-C214 VanDerWaalsContact C-N 3.28Å; C212-C214 PolarHBondContact O-N 2.8Å; C212-D282 WeakPolarHBondContact CA-OD1 3.19Å
213	W	87.1	Confident	82.8	Confident	6 Å²	6	45.8 Å²	45.8	2%	0.023	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	57.6	31.8	179.4	-54.4	-24.1	0	0	0	115	R159 S211 R215 I252 K280 D282 R289 L291 E294	R159-W213 WeakPolarHBondContact CD-O 2.86Å; R159-W213 PolarHBondContact NE-O 2.73Å; S211-W213 PolarHBondContact O-N 3.01Å; W213-R215 PolarHBondContact O-N 3.34Å; W213-I252 HydrophobicContact CB-CD1 4.09Å; W213-I252 HydrophobicContact CB-CG2 3.93Å; W213-I252 HydrophobicContact CD2-CD1 3.95Å; W213-I252 HydrophobicContact CD2-CG1 4.43Å; W213-I252 HydrophobicContact CD2-CG2 3.85Å; W213-I252 HydrophobicContact CE3-CG2 3.83Å; W213-I252 HydrophobicContact CG-CD1 3.53Å; W213-I252 HydrophobicContact CG-CG1 4.38Å; W213-I252 HydrophobicContact CG-CG2 3.97Å; W213-K280 WeakPolarHBondContact CZ2-O 3.24Å; W213-K280 PolarHBondContact NE1-O 3.17Å; W213-K280 VanDerWaalsContact NE1-O 3.12Å; W213-D282 HydrophobicContact CD2-CB 3.65Å; W213-D282 VanDerWaalsContact CE2-N 3.32Å; W213-D282 HydrophobicContact CE3-CB 3.69Å; W213-D282 HydrophobicContact CG-CB 4.4Å; W213-D282 HydrophobicContact CH2-CB 3.69Å; W213-D282 HydrophobicContact CZ2-CB 3.68Å; W213-D282 HydrophobicContact CZ3-CB 3.69Å; W213-R289 VanDerWaalsContact CH2-O 3.29Å; W213-R289 WeakPolarHBondContact CH2-O 3.24Å; W213-R289 VanDerWaalsContact CZ2-O 3.3Å; W213-R289 WeakPolarHBondContact CZ2-O 3.25Å; W213-L291 HydrophobicContact CH2-CB 4.25Å; W213-L291 HydrophobicContact CH2-CD1 4.41Å; W213-L291 HydrophobicContact CZ2-CB 4.35Å; W213-L291 HydrophobicContact CZ3-CD1 4.45Å; W213-E294 HydrophobicContact CH2-CB 4.3Å; W213-E294 HydrophobicContact CZ3-CB 4.1Å; W213-E294 HydrophobicContact CZ3-CG 4.13Å
214	C	85.5	Confident	82.6	Confident	6 Å²	6	48.6 Å²	48.6	4%	0.041	26%	0.258	C	S	.	.			trans	-60.2	128	171.7	-73.5	0	0	0	0	110.9	I194 Y209 C212 N249	I194-C214 HydrophobicContact CD1-CB 3.77Å; Y209-C214 VanDerWaalsContact O-CB 3.3Å; Y209-C214 WeakPolarHBondContact O-CB 3.33Å; Y209-C214 PolarHBondContact O-N 3Å; Y209-C214 PolarHBondContact O-SG 3.5Å; C212-C214 VanDerWaalsContact C-N 3.28Å; C212-C214 PolarHBondContact O-N 2.8Å; C214-N249 PolarHBondContact O-ND2 3.42Å
215	R	85.8	Confident	82.6	Confident	50 Å²	50	43 Å²	43	19%	0.189	23%	0.231	C	C	.	.			trans	-61.5	138.5	179.2	-167.9	-179.8	179.8	-158.8	1.1	110.8	V123 W213 I217 E250 A253	V123-R215 PolarHBondContact O-NH1 3.21Å; W213-R215 PolarHBondContact O-N 3.34Å; R215-I217 WeakPolarHBondContact CD-O 3.49Å; R215-I217 PolarHBondContact NE-O 3.21Å; R215-I217 VanDerWaalsContact NE-O 3.1Å; R215-I217 PolarHBondContact NH1-O 3.32Å; R215-E250 WeakPolarHBondContact CG-OE1 3.3Å; R215-E250 IonicContact CZ-OE2 2.68Å; R215-E250 IonicContact NE-OE1 3.39Å; R215-E250 IonicContact NE-OE2 3.87Å; R215-E250 PolarHBondContact NE-OE2 3.16Å; R215-E250 IonicContact NH2-OE2 3.92Å; R215-A253 HydrophobicContact CG-CB 4.38Å
216	T	84.1	Confident	82.7	Confident	7 Å²	7	39.7 Å²	39.7	4%	0.043	22%	0.217	C	C	.	.	S	Bend	trans	-96.6	-32.8	-176.7	60.3	0	0	0	0	112.4	L210 A218 L226 I242 A245 R246 N249 E250	L210-T216 HydrophobicContact CD2-CG2 4.03Å; T216-A218 VanDerWaalsContact C-N 3.3Å; T216-A218 PolarHBondContact O-N 2.98Å; T216-A218 VanDerWaalsContact O-N 3.12Å; T216-L226 WeakPolarHBondContact O-CB 3.46Å; T216-I242 HydrophobicContact CG2-CG2 4.5Å; T216-A245 HydrophobicContact CG2-CB 4.42Å; T216-R246 WeakPolarHBondContact OG1-CA 3.49Å; T216-N249 HydrophobicContact CG2-CB 4.16Å; T216-E250 PolarHBondContact N-OE1 2.96Å; T216-E250 PolarHBondContact OG1-OE1 3.21Å; T216-E250 VanDerWaalsContact OG1-OE1 3.04Å
217	I	84.5	Confident	82.6	Confident	75 Å²	75	42.2 Å²	42.2	39%	0.385	23%	0.228	S	C	.	.	S	Bend	trans	-86.2	77.8	172.4	-54.4	-179	0	0	0	107.7	R215 R246 E250	R215-I217 WeakPolarHBondContact CD-O 3.49Å; R215-I217 PolarHBondContact NE-O 3.21Å; R215-I217 VanDerWaalsContact NE-O 3.1Å; R215-I217 PolarHBondContact NH1-O 3.32Å; I217-R246 HydrophobicContact CG1-CG 4.46Å; I217-E250 HydrophobicContact CB-CG 4.4Å; I217-E250 HydrophobicContact CD1-CG 3.6Å; I217-E250 HydrophobicContact CG1-CG 3.75Å; I217-E250 PolarHBondContact N-OE1 3.35Å
218	A	82.2	Confident	82.6	Confident	27 Å²	27	44.3 Å²	44.3	22%	0.223	24%	0.236	C	C	.	.			trans	-128.2	137.4	177.1	0	0	0	0	0	110.3	W195 T216 L226	W195-A218 WeakPolarHBondContact CH2-O 3.36Å; W195-A218 HydrophobicContact CZ2-CB 4Å; T216-A218 VanDerWaalsContact C-N 3.3Å; T216-A218 PolarHBondContact O-N 2.98Å; T216-A218 VanDerWaalsContact O-N 3.12Å; A218-L226 PolarHBondContact O-N 3.49Å
219	N	80.5	Confident	82.6	Confident	87 Å²	87	40.7 Å²	40.7	47%	0.465	22%	0.223	S	C	.	.	B	Isolated β-bridge	trans	-110.6	133.1	177.9	-65.1	-10.7	0	0	0	110	S129 K224	S129-N219 PolarHBondContact OG-O 3.27Å; N219-K224 WeakPolarHBondContact CA-O 3.46Å
220	Q	75.7	Confident	82.7	Confident	38 Å²	38	39.9 Å²	39.9	18%	0.178	22%	0.22	C	C	.	.			trans	-67.4	159.4	166	-85.4	-174	-5.2	0	0	110.4	W195 N222 G223 K224	W195-Q220 HydrophobicContact CD2-CG 4.08Å; W195-Q220 HydrophobicContact CE3-CG 3.82Å; W195-Q220 VanDerWaalsContact CE3-NE2 3.25Å; W195-Q220 HydrophobicContact CH2-CB 4.44Å; W195-Q220 HydrophobicContact CH2-CG 3.68Å; W195-Q220 HydrophobicContact CZ2-CG 3.95Å; W195-Q220 HydrophobicContact CZ3-CG 3.61Å; Q220-N222 WeakPolarHBondContact CB-OD1 3.44Å; Q220-N222 PolarHBondContact O-N 3.43Å; Q220-N222 PolarHBondContact OE1-ND2 3.5Å; Q220-G223 PolarHBondContact O-N 3.16Å; Q220-K224 PolarHBondContact N-O 3.33Å
221	P	70.9	Confident	82.7	Confident	71 Å²	71	44.7 Å²	44.7	46%	0.461	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57	-21.3	175.5	-25.6	34.9	0	0	0	114.3	N131 G223	N131-P221 HydrophobicContact CB-CG 4.21Å; N131-P221 VanDerWaalsContact O-CG 3.3Å; N131-P221 WeakPolarHBondContact O-CG 3.37Å; P221-G223 PolarHBondContact O-N 3.4Å
222	N	73.2	Confident	82.8	Confident	101 Å²	101	48.5 Å²	48.5	54%	0.54	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.4	1	174.6	63.1	13.6	0	0	0	113.8	Q220 K224	Q220-N222 WeakPolarHBondContact CB-OD1 3.44Å; Q220-N222 PolarHBondContact O-N 3.43Å; Q220-N222 PolarHBondContact OE1-ND2 3.5Å; N222-K224 VanDerWaalsContact C-N 3.32Å; N222-K224 PolarHBondContact O-N 2.89Å; N222-K224 WeakPolarHBondContact OD1-CB 3.36Å; N222-K224 PolarHBondContact OD1-N 3.21Å
223	G	75.1	Confident	83	Confident	50 Å²	50	49.8 Å²	49.8	52%	0.515	28%	0.278	S	S	.	.	S	Bend	trans	86.7	-12.8	-179.3	0	0	0	0	0	115.2	Q220 P221 S225	Q220-G223 PolarHBondContact O-N 3.16Å; P221-G223 PolarHBondContact O-N 3.4Å; G223-S225 PolarHBondContact O-N 3.37Å
224	K	81.5	Confident	83	Confident	109 Å²	109	52.8 Å²	52.8	47%	0.474	31%	0.31	S	S	.	.			trans	-69.5	131.5	-180	-65.9	-173.8	176.6	-174.8	0	111	N219 Q220 N222 E228	N219-K224 WeakPolarHBondContact CA-O 3.46Å; Q220-K224 PolarHBondContact N-O 3.33Å; N222-K224 VanDerWaalsContact C-N 3.32Å; N222-K224 PolarHBondContact O-N 2.89Å; N222-K224 WeakPolarHBondContact OD1-CB 3.36Å; N222-K224 PolarHBondContact OD1-N 3.21Å; K224-E228 WeakPolarHBondContact CA-OE2 3.5Å
225	S	85.4	Confident	83.1	Confident	25 Å²	25	54.5 Å²	54.5	18%	0.175	32%	0.319	C	S	.	.	B	Isolated β-bridge	trans	-76.9	156.3	174	69.8	0	0	0	0	111.3	G223 F227 E228 C229	G223-S225 PolarHBondContact O-N 3.37Å; S225-F227 PolarHBondContact O-N 3.23Å; S225-E228 PolarHBondContact N-OE2 3.22Å; S225-E228 VanDerWaalsContact N-OE2 3.15Å; S225-E228 PolarHBondContact O-N 2.89Å; S225-E228 VanDerWaalsContact O-N 3.14Å; S225-E228 WeakPolarHBondContact OG-CB 3.27Å; S225-E228 VanDerWaalsContact OG-CG 3.27Å; S225-E228 WeakPolarHBondContact OG-CG 3.49Å; S225-E228 PolarHBondContact OG-N 3.12Å; S225-E228 VanDerWaalsContact OG-N 3.07Å; S225-C229 PolarHBondContact O-N 3.07Å
226	L	84.7	Confident	83.3	Confident	1 Å²	1	60.7 Å²	60.7	1%	0.005	34%	0.344	C	S	.	.	H	α-helix	trans	-54.1	-36.5	173.1	-169	72.9	0	0	0	111.4	I194 W195 I198 T216 A218 C229 S230	I194-L226 HydrophobicContact CD1-CD2 4.35Å; W195-L226 HydrophobicContact CD2-CD1 3.64Å; W195-L226 HydrophobicContact CE3-CD1 3.56Å; W195-L226 HydrophobicContact CG-CD1 4.41Å; W195-L226 VanDerWaalsContact CH2-CA 3.47Å; W195-L226 HydrophobicContact CH2-CB 3.75Å; W195-L226 HydrophobicContact CH2-CD1 3.72Å; W195-L226 HydrophobicContact CH2-CG 4.37Å; W195-L226 HydrophobicContact CZ2-CB 4.23Å; W195-L226 HydrophobicContact CZ2-CD1 3.78Å; W195-L226 HydrophobicContact CZ3-CB 4.11Å; W195-L226 HydrophobicContact CZ3-CD1 3.6Å; W195-L226 HydrophobicContact CZ3-CG 4.46Å; I198-L226 HydrophobicContact CD1-CD1 3.39Å; I198-L226 HydrophobicContact CD1-CD2 4.38Å; I198-L226 HydrophobicContact CD1-CG 3.8Å; T216-L226 WeakPolarHBondContact O-CB 3.46Å; A218-L226 PolarHBondContact O-N 3.49Å; L226-C229 PolarHBondContact O-N 2.89Å; L226-S230 PolarHBondContact O-N 3.46Å; L226-S230 PolarHBondContact O-OG 2.92Å
227	F	85.6	Confident	83.5	Confident	53 Å²	53	63.5 Å²	63.5	23%	0.232	36%	0.356	C	S	.	.	H	α-helix	trans	-68.9	-44.1	178.2	-165.4	-110	0	0	0	112.2	S225 C229 S230 M231 V239 I242 D243	S225-F227 PolarHBondContact O-N 3.23Å; F227-C229 VanDerWaalsContact C-N 3.35Å; F227-C229 PolarHBondContact O-N 3.32Å; F227-S230 WeakPolarHBondContact CA-OG 3.37Å; F227-S230 PolarHBondContact O-N 2.96Å; F227-S230 PolarHBondContact O-OG 3.49Å; F227-M231 HydrophobicContact CD1-CE 3.94Å; F227-M231 HydrophobicContact CD1-SD 3.93Å; F227-M231 HydrophobicContact CE1-CE 3.13Å; F227-M231 HydrophobicContact CE1-CG 4.46Å; F227-M231 HydrophobicContact CE1-SD 3.76Å; F227-M231 HydrophobicContact CZ-CE 3.57Å; F227-M231 WeakPolarHBondContact O-CG 3.25Å; F227-M231 PolarHBondContact O-N 3.34Å; F227-V239 HydrophobicContact CD2-CG1 4.28Å; F227-V239 HydrophobicContact CE2-CG1 3.5Å; F227-V239 HydrophobicContact CZ-CG1 3.77Å; F227-I242 HydrophobicContact CD2-CG2 4.42Å; F227-D243 HydrophobicContact CE2-CB 4.27Å
228	E	86.5	Confident	83.7	Confident	103 Å²	103	60 Å²	60	48%	0.481	34%	0.338	S	S	.	.	H	α-helix	trans	-62.5	-40.8	173.3	-75.3	163.9	-164.7	0	0	112.1	K224 S225 S230 M231 S232	K224-E228 WeakPolarHBondContact CA-OE2 3.5Å; S225-E228 PolarHBondContact N-OE2 3.22Å; S225-E228 VanDerWaalsContact N-OE2 3.15Å; S225-E228 PolarHBondContact O-N 2.89Å; S225-E228 VanDerWaalsContact O-N 3.14Å; S225-E228 WeakPolarHBondContact OG-CB 3.27Å; S225-E228 VanDerWaalsContact OG-CG 3.27Å; S225-E228 WeakPolarHBondContact OG-CG 3.49Å; S225-E228 PolarHBondContact OG-N 3.12Å; S225-E228 VanDerWaalsContact OG-N 3.07Å; E228-S230 VanDerWaalsContact C-N 3.33Å; E228-S230 PolarHBondContact O-N 2.94Å; E228-M231 PolarHBondContact O-N 2.9Å; E228-S232 PolarHBondContact O-N 3.42Å
229	C	85.4	Confident	84	Confident	7 Å²	7	59.6 Å²	59.6	5%	0.047	33%	0.333	C	S	.	.	H	α-helix	trans	-60.6	-43.4	173.2	-77.5	0	0	0	0	111.3	W195 S225 L226 F227 S232	W195-C229 HydrophobicContact CE3-CB 4.37Å; W195-C229 HydrophobicContact CZ3-CB 4.03Å; S225-C229 PolarHBondContact O-N 3.07Å; L226-C229 PolarHBondContact O-N 2.89Å; F227-C229 VanDerWaalsContact C-N 3.35Å; F227-C229 PolarHBondContact O-N 3.32Å; C229-S232 PolarHBondContact O-N 3.13Å; C229-S232 PolarHBondContact O-OG 2.68Å
230	S	86.9	Confident	84.4	Confident	0 Å²	0	59 Å²	59	0%	0	33%	0.326	C	S	.	.	H	α-helix	trans	-65.6	-36.4	175.2	70.1	0	0	0	0	113.6	L226 F227 E228 S232 T233 L238 V239	L226-S230 PolarHBondContact O-N 3.46Å; L226-S230 PolarHBondContact O-OG 2.92Å; F227-S230 WeakPolarHBondContact CA-OG 3.37Å; F227-S230 PolarHBondContact O-N 2.96Å; F227-S230 PolarHBondContact O-OG 3.49Å; E228-S230 VanDerWaalsContact C-N 3.33Å; E228-S230 PolarHBondContact O-N 2.94Å; S230-S232 VanDerWaalsContact C-N 3.28Å; S230-S232 PolarHBondContact O-N 3.46Å; S230-T233 PolarHBondContact O-N 2.87Å; S230-T233 PolarHBondContact O-OG1 3.4Å; S230-L238 VanDerWaalsContact CB-CD2 3.41Å; S230-V239 WeakPolarHBondContact O-CG2 3.19Å
231	M	88	Confident	84.9	Confident	107 Å²	107	61.4 Å²	61.4	53%	0.527	33%	0.334	S	S	.	.	H	α-helix	trans	-67	-33.4	175.1	-76.5	179.9	155.5	0	0	111.7	F227 E228 T233 G234 V239	F227-M231 HydrophobicContact CD1-CE 3.94Å; F227-M231 HydrophobicContact CD1-SD 3.93Å; F227-M231 HydrophobicContact CE1-CE 3.13Å; F227-M231 HydrophobicContact CE1-CG 4.46Å; F227-M231 HydrophobicContact CE1-SD 3.76Å; F227-M231 HydrophobicContact CZ-CE 3.57Å; F227-M231 WeakPolarHBondContact O-CG 3.25Å; F227-M231 PolarHBondContact O-N 3.34Å; E228-M231 PolarHBondContact O-N 2.9Å; M231-T233 PolarHBondContact O-N 3.45Å; M231-G234 PolarHBondContact O-N 3.17Å; M231-G234 VanDerWaalsContact O-N 3.11Å; M231-V239 HydrophobicContact CE-CG1 4.47Å; M231-V239 HydrophobicContact CG-CG1 4.29Å; M231-V239 HydrophobicContact CG-CG2 4.19Å
232	S	87.5	Confident	85.7	Confident	89 Å²	89	58 Å²	58	62%	0.622	31%	0.312	S	S	*	.	H	α-helix	trans	-68	-17.9	-179.9	73.9	0	0	0	0	114.5	E228 C229 S230 G234	E228-S232 PolarHBondContact O-N 3.42Å; C229-S232 PolarHBondContact O-N 3.13Å; C229-S232 PolarHBondContact O-OG 2.68Å; S230-S232 VanDerWaalsContact C-N 3.28Å; S230-S232 PolarHBondContact O-N 3.46Å; S232-G234 VanDerWaalsContact C-N 3.33Å
233	T	87.6	Confident	86.4	Confident	34 Å²	34	56.9 Å²	56.9	21%	0.209	31%	0.306	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.3	-18.6	173.1	68	0	0	0	0	112.6	I198 S230 M231 N235	I198-T233 HydrophobicContact CG2-CG2 4.2Å; S230-T233 PolarHBondContact O-N 2.87Å; S230-T233 PolarHBondContact O-OG1 3.4Å; M231-T233 PolarHBondContact O-N 3.45Å; T233-N235 PolarHBondContact O-N 3.35Å; T233-N235 PolarHBondContact OG1-N 3.43Å
234	G	86.2	Confident	87	Confident	68 Å²	68	59.7 Å²	59.7	70%	0.701	31%	0.305	S	S	*	.			trans	76	1.7	-177.3	0	0	0	0	0	114.9	M231 S232 Y236	M231-G234 PolarHBondContact O-N 3.17Å; M231-G234 VanDerWaalsContact O-N 3.11Å; S232-G234 VanDerWaalsContact C-N 3.33Å; G234-Y236 PolarHBondContact O-N 3.22Å
235	N	88.7	Confident	87.3	Confident	43 Å²	43	54.8 Å²	54.8	23%	0.23	29%	0.285	C	S	.	.			trans	-87.1	101.4	-178.2	-170.1	-32.9	0	0	0	111.4	E201 T233 E237 L238 V239	E201-N235 PolarHBondContact OE2-ND2 3.28Å; E201-N235 VanDerWaalsContact OE2-ND2 3.11Å; T233-N235 PolarHBondContact O-N 3.35Å; T233-N235 PolarHBondContact OG1-N 3.43Å; N235-E237 PolarHBondContact O-N 3.24Å; N235-E237 PolarHBondContact OD1-N 2.93Å; N235-L238 HydrophobicContact CB-CB 3.92Å; N235-L238 WeakPolarHBondContact O-CB 3.44Å; N235-L238 PolarHBondContact O-N 2.88Å; N235-L238 PolarHBondContact OD1-N 2.93Å; N235-V239 WeakPolarHBondContact O-CG2 3.43Å; N235-V239 PolarHBondContact O-N 2.64Å
236	Y	88.7	Confident	87.4	Confident	180 Å²	180	56.7 Å²	56.7	71%	0.706	29%	0.289	S	S	*	.	H	α-helix	trans	-59.6	-40.3	-176.8	175.7	-99.4	0	0	0	113.8	G234 L238 V239 K240	G234-Y236 PolarHBondContact O-N 3.22Å; Y236-L238 VanDerWaalsContact C-N 3.32Å; Y236-L238 PolarHBondContact O-N 3.43Å; Y236-V239 PolarHBondContact O-N 3.06Å; Y236-K240 HydrophobicContact CE1-CD 4Å; Y236-K240 WeakPolarHBondContact O-CB 3.49Å; Y236-K240 PolarHBondContact O-N 2.95Å
237	E	88.3	Confident	87.7	Confident	66 Å²	66	58.1 Å²	58.1	31%	0.308	30%	0.296	S	S	.	.	H	α-helix	trans	-68.1	-36.8	-178.3	-175	61.3	-158.3	0	0	110.8	M203 N235 K240 R241	M203-E237 HydrophobicContact CE-CG 4.17Å; N235-E237 PolarHBondContact O-N 3.24Å; N235-E237 PolarHBondContact OD1-N 2.93Å; E237-K240 PolarHBondContact O-N 3.05Å; E237-K240 IonicContact OE1-NZ 3.13Å; E237-K240 IonicContact OE2-NZ 3.06Å; E237-K240 PolarHBondContact OE2-NZ 3.08Å; E237-K240 VanDerWaalsContact OE2-NZ 3.16Å; E237-R241 WeakPolarHBondContact O-CG 3.33Å; E237-R241 PolarHBondContact O-N 2.93Å; E237-R241 IonicContact OE1-CZ 3.65Å; E237-R241 IonicContact OE1-NE 3.96Å; E237-R241 PolarHBondContact OE1-NE 3.19Å; E237-R241 VanDerWaalsContact OE1-NE 3.1Å; E237-R241 IonicContact OE1-NH2 3.07Å
238	L	88.3	Confident	87.9	Confident	0 Å²	0	55.8 Å²	55.8	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-60.1	-48.7	173.8	-172.2	156	0	0	0	111.4	I198 E201 M203 M206 S230 N235 Y236 K240 R241 I242	I198-L238 HydrophobicContact CG1-CD2 4.36Å; I198-L238 HydrophobicContact CG2-CD2 4.04Å; E201-L238 HydrophobicContact CG-CD1 4.46Å; M203-L238 HydrophobicContact SD-CB 3.85Å; M203-L238 HydrophobicContact SD-CD1 4.22Å; M203-L238 HydrophobicContact SD-CG 4.11Å; M206-L238 HydrophobicContact CE-CB 4.49Å; M206-L238 HydrophobicContact CE-CG 3.89Å; S230-L238 VanDerWaalsContact CB-CD2 3.41Å; N235-L238 HydrophobicContact CB-CB 3.92Å; N235-L238 WeakPolarHBondContact O-CB 3.44Å; N235-L238 PolarHBondContact O-N 2.88Å; N235-L238 PolarHBondContact OD1-N 2.93Å; Y236-L238 VanDerWaalsContact C-N 3.32Å; Y236-L238 PolarHBondContact O-N 3.43Å; L238-K240 PolarHBondContact O-N 3.32Å; L238-R241 PolarHBondContact O-N 2.89Å; L238-I242 HydrophobicContact CD2-CD1 3.7Å; L238-I242 WeakPolarHBondContact O-CG1 3.45Å; L238-I242 PolarHBondContact O-N 3.07Å
239	V	88.9	Confident	88.1	Confident	19 Å²	19	50.9 Å²	50.9	12%	0.115	26%	0.264	C	S	.	.	H	α-helix	trans	-61.9	-44.7	178.5	177.3	0	0	0	0	111.2	F227 S230 M231 N235 Y236 R241 I242 D243	F227-V239 HydrophobicContact CD2-CG1 4.28Å; F227-V239 HydrophobicContact CE2-CG1 3.5Å; F227-V239 HydrophobicContact CZ-CG1 3.77Å; S230-V239 WeakPolarHBondContact O-CG2 3.19Å; M231-V239 HydrophobicContact CE-CG1 4.47Å; M231-V239 HydrophobicContact CG-CG1 4.29Å; M231-V239 HydrophobicContact CG-CG2 4.19Å; N235-V239 WeakPolarHBondContact O-CG2 3.43Å; N235-V239 PolarHBondContact O-N 2.64Å; Y236-V239 PolarHBondContact O-N 3.06Å; V239-R241 VanDerWaalsContact C-N 3.35Å; V239-R241 PolarHBondContact O-N 2.94Å; V239-I242 PolarHBondContact O-N 3.48Å; V239-D243 PolarHBondContact O-N 3.33Å
240	K	88.6	Confident	88.4	Confident	75 Å²	75	50.6 Å²	50.6	33%	0.326	26%	0.262	S	S	.	.	H	α-helix	trans	-60	-41.5	178.6	177.4	-176	164.8	-157.4	0	112.5	Y236 E237 L238 D243 Q244	Y236-K240 HydrophobicContact CE1-CD 4Å; Y236-K240 WeakPolarHBondContact O-CB 3.49Å; Y236-K240 PolarHBondContact O-N 2.95Å; E237-K240 PolarHBondContact O-N 3.05Å; E237-K240 IonicContact OE1-NZ 3.13Å; E237-K240 IonicContact OE2-NZ 3.06Å; E237-K240 PolarHBondContact OE2-NZ 3.08Å; E237-K240 VanDerWaalsContact OE2-NZ 3.16Å; L238-K240 PolarHBondContact O-N 3.32Å; K240-D243 PolarHBondContact O-N 3.31Å; K240-Q244 VanDerWaalsContact O-CG 3.27Å; K240-Q244 WeakPolarHBondContact O-CG 3.43Å; K240-Q244 PolarHBondContact O-N 3.24Å
241	R	86.9	Confident	88.6	Confident	88 Å²	88	50.7 Å²	50.7	33%	0.332	26%	0.262	S	S	.	.	H	α-helix	trans	-65.6	-40.1	178.1	-71.8	-72.6	-174.8	123.8	-1.5	112.6	M203 M206 D207 E237 L238 V239 Q244 A245	M203-R241 HydrophobicContact CE-CG 4.01Å; M206-R241 HydrophobicContact CE-CB 3.73Å; D207-R241 IonicContact OD1-NH1 3.85Å; D207-R241 PolarHBondContact OD1-NH1 2.94Å; D207-R241 IonicContact OD2-CZ 2.73Å; D207-R241 IonicContact OD2-NH1 3.81Å; D207-R241 PolarHBondContact OD2-NH1 3.15Å; E237-R241 WeakPolarHBondContact O-CG 3.33Å; E237-R241 PolarHBondContact O-N 2.93Å; E237-R241 IonicContact OE1-CZ 3.65Å; E237-R241 IonicContact OE1-NE 3.96Å; E237-R241 PolarHBondContact OE1-NE 3.19Å; E237-R241 VanDerWaalsContact OE1-NE 3.1Å; E237-R241 IonicContact OE1-NH2 3.07Å; L238-R241 PolarHBondContact O-N 2.89Å; V239-R241 VanDerWaalsContact C-N 3.35Å; V239-R241 PolarHBondContact O-N 2.94Å; R241-Q244 PolarHBondContact O-N 3.14Å; R241-A245 PolarHBondContact O-N 2.64Å; R241-A245 VanDerWaalsContact O-N 3.17Å
242	I	87.7	Confident	88.8	Confident	1 Å²	1	46 Å²	46	1%	0.005	24%	0.239	C	C	.	.	H	α-helix	trans	-64.4	-43.3	174.9	-67.1	170.7	0	0	0	110.5	I198 M206 L210 T216 F227 L238 V239 A245 R246	I198-I242 HydrophobicContact CD1-CD1 3.79Å; I198-I242 HydrophobicContact CG1-CD1 4.26Å; M206-I242 HydrophobicContact CE-CG1 4.13Å; M206-I242 HydrophobicContact SD-CG1 4.18Å; L210-I242 HydrophobicContact CD1-CG1 4.4Å; T216-I242 HydrophobicContact CG2-CG2 4.5Å; F227-I242 HydrophobicContact CD2-CG2 4.42Å; L238-I242 HydrophobicContact CD2-CD1 3.7Å; L238-I242 WeakPolarHBondContact O-CG1 3.45Å; L238-I242 PolarHBondContact O-N 3.07Å; V239-I242 PolarHBondContact O-N 3.48Å; I242-A245 PolarHBondContact O-N 3.48Å; I242-R246 PolarHBondContact O-N 3.47Å; I242-R246 VanDerWaalsContact O-N 3.13Å
243	D	87.9	Confident	88.9	Confident	76 Å²	76	42 Å²	42	41%	0.406	21%	0.212	S	C	.	.	H	α-helix	trans	-61.9	-44.2	177.9	-165.8	61.5	0	0	0	111.9	F227 V239 K240 A245 R246	F227-D243 HydrophobicContact CE2-CB 4.27Å; V239-D243 PolarHBondContact O-N 3.33Å; K240-D243 PolarHBondContact O-N 3.31Å; D243-A245 VanDerWaalsContact C-N 3.29Å; D243-A245 PolarHBondContact O-N 3.19Å; D243-R246 WeakPolarHBondContact O-CB 3.39Å; D243-R246 PolarHBondContact O-N 2.86Å; D243-R246 VanDerWaalsContact O-N 3.12Å; D243-R246 IonicContact OD1-CZ 3.59Å; D243-R246 IonicContact OD1-NE 3.22Å; D243-R246 IonicContact OD1-NH1 2.74Å; D243-R246 PolarHBondContact OD1-NH1 2.93Å; D243-R246 IonicContact OD1-NH2 3.47Å; D243-R246 PolarHBondContact OD1-NH2 3.48Å; D243-R246 VanDerWaalsContact OD1-NH2 3.13Å
244	Q	87.2	Confident	89.1	Confident	109 Å²	109	40.4 Å²	40.4	51%	0.509	20%	0.202	S	C	.	.	H	α-helix	trans	-61.5	-33	175.3	-74.2	174	-13.5	0	0	113.6	K240 R241	K240-Q244 VanDerWaalsContact O-CG 3.27Å; K240-Q244 WeakPolarHBondContact O-CG 3.43Å; K240-Q244 PolarHBondContact O-N 3.24Å; R241-Q244 PolarHBondContact O-N 3.14Å
245	A	87.7	Confident	89.4	Confident	6 Å²	6	37.2 Å²	37.2	5%	0.05	17%	0.168	C	C	.	.	H	α-helix	trans	-83.3	-13	178.1	0	0	0	0	0	113.4	L210 T216 R241 I242 D243 T248 N249	L210-A245 HydrophobicContact CB-CB 4.34Å; L210-A245 HydrophobicContact CD1-CB 3.87Å; L210-A245 HydrophobicContact CD2-CB 4.01Å; L210-A245 HydrophobicContact CG-CB 4.31Å; T216-A245 HydrophobicContact CG2-CB 4.42Å; R241-A245 PolarHBondContact O-N 2.64Å; R241-A245 VanDerWaalsContact O-N 3.17Å; I242-A245 PolarHBondContact O-N 3.48Å; D243-A245 VanDerWaalsContact C-N 3.29Å; D243-A245 PolarHBondContact O-N 3.19Å; A245-T248 PolarHBondContact O-N 2.98Å; A245-N249 WeakPolarHBondContact O-CB 3.48Å; A245-N249 PolarHBondContact O-N 3.02Å
246	R	89.3	Confident	89.6	Confident	65 Å²	65	35.2 Å²	35.2	25%	0.245	16%	0.158	C	C	.	.	H	α-helix	trans	-54.1	-63.7	-169.1	-177.6	-175.8	-72	147	4.7	112.8	T216 I217 I242 D243 T248 N249 E250	T216-R246 WeakPolarHBondContact OG1-CA 3.49Å; I217-R246 HydrophobicContact CG1-CG 4.46Å; I242-R246 PolarHBondContact O-N 3.47Å; I242-R246 VanDerWaalsContact O-N 3.13Å; D243-R246 WeakPolarHBondContact O-CB 3.39Å; D243-R246 PolarHBondContact O-N 2.86Å; D243-R246 VanDerWaalsContact O-N 3.12Å; D243-R246 IonicContact OD1-CZ 3.59Å; D243-R246 IonicContact OD1-NE 3.22Å; D243-R246 IonicContact OD1-NH1 2.74Å; D243-R246 PolarHBondContact OD1-NH1 2.93Å; D243-R246 IonicContact OD1-NH2 3.47Å; D243-R246 PolarHBondContact OD1-NH2 3.48Å; D243-R246 VanDerWaalsContact OD1-NH2 3.13Å; R246-T248 VanDerWaalsContact C-N 3.3Å; R246-T248 PolarHBondContact O-N 3.1Å; R246-N249 PolarHBondContact O-N 3.43Å; R246-E250 WeakPolarHBondContact O-CG 3.35Å; R246-E250 PolarHBondContact O-N 3.49Å
247	N	89.5	Confident	89.7	Confident	32 Å²	32	26.7 Å²	26.7	17%	0.171	12%	0.124	C	C	.	.	H	α-helix	trans	-64.2	-37.2	-172.6	-65.5	-6.8	0	0	0	112.1	L251 E274 C276	N247-L251 WeakPolarHBondContact O-CB 3.15Å; N247-L251 PolarHBondContact O-N 3.38Å; N247-E274 WeakPolarHBondContact ND2-CB 3.26Å; N247-E274 PolarHBondContact ND2-O 3.31Å; N247-C276 PolarHBondContact O-SG 2.99Å
248	T	90.7	Very high	89.9	Confident	4 Å²	4	24.8 Å²	24.8	3%	0.025	12%	0.116	C	C	.	.	H	α-helix	trans	-66.7	-47.3	178.6	-56.7	0	0	0	0	111.6	A245 R246 L251 I252 Q277 K280	A245-T248 PolarHBondContact O-N 2.98Å; R246-T248 VanDerWaalsContact C-N 3.3Å; R246-T248 PolarHBondContact O-N 3.1Å; T248-L251 WeakPolarHBondContact O-CB 3.34Å; T248-L251 PolarHBondContact O-N 3.15Å; T248-I252 HydrophobicContact CG2-CD1 4.25Å; T248-I252 WeakPolarHBondContact O-CD1 3.35Å; T248-I252 WeakPolarHBondContact O-CG1 3.48Å; T248-I252 PolarHBondContact O-N 2.86Å; T248-I252 VanDerWaalsContact O-N 3.13Å; T248-Q277 HydrophobicContact CG2-CB 4.02Å; T248-Q277 WeakPolarHBondContact CG2-O 3.26Å; T248-Q277 PolarHBondContact OG1-N 3.35Å; T248-K280 HydrophobicContact CG2-CB 4.03Å; T248-K280 HydrophobicContact CG2-CD 3.79Å
249	N	90.4	Very high	90	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-73.7	-30	-178.3	-71.1	18.1	0	0	0	112.1	L210 C214 T216 A245 R246 I252 A253	L210-N249 PolarHBondContact O-ND2 3.37Å; L210-N249 VanDerWaalsContact O-ND2 3.08Å; C214-N249 PolarHBondContact O-ND2 3.42Å; T216-N249 HydrophobicContact CG2-CB 4.16Å; A245-N249 WeakPolarHBondContact O-CB 3.48Å; A245-N249 PolarHBondContact O-N 3.02Å; R246-N249 PolarHBondContact O-N 3.43Å; N249-I252 PolarHBondContact O-N 2.86Å; N249-A253 PolarHBondContact O-N 3.03Å
250	E	90.7	Very high	90.1	Very high	1 Å²	1	27.8 Å²	27.8	1%	0.005	13%	0.131	C	C	.	.	H	α-helix	trans	-71.1	-35	170.1	-65.5	-48.7	124.9	0	0	112.5	R215 T216 I217 R246 I252 A253 A254 L266	R215-E250 WeakPolarHBondContact CG-OE1 3.3Å; R215-E250 IonicContact CZ-OE2 2.68Å; R215-E250 IonicContact NE-OE1 3.39Å; R215-E250 IonicContact NE-OE2 3.87Å; R215-E250 PolarHBondContact NE-OE2 3.16Å; R215-E250 IonicContact NH2-OE2 3.92Å; T216-E250 PolarHBondContact N-OE1 2.96Å; T216-E250 PolarHBondContact OG1-OE1 3.21Å; T216-E250 VanDerWaalsContact OG1-OE1 3.04Å; I217-E250 HydrophobicContact CB-CG 4.4Å; I217-E250 HydrophobicContact CD1-CG 3.6Å; I217-E250 HydrophobicContact CG1-CG 3.75Å; I217-E250 PolarHBondContact N-OE1 3.35Å; R246-E250 WeakPolarHBondContact O-CG 3.35Å; R246-E250 PolarHBondContact O-N 3.49Å; E250-I252 VanDerWaalsContact C-N 3.29Å; E250-I252 PolarHBondContact O-N 3.14Å; E250-A253 PolarHBondContact O-N 3.34Å; E250-A254 VanDerWaalsContact O-CB 3.31Å; E250-A254 WeakPolarHBondContact O-CB 3.37Å; E250-A254 PolarHBondContact O-N 3.03Å; E250-L266 HydrophobicContact CB-CD1 4.1Å
251	L	91.8	Very high	90.2	Very high	2 Å²	2	29.5 Å²	29.5	1%	0.01	14%	0.144	C	C	.	.	H	α-helix	trans	-59.1	-43.9	171.9	173.7	67.5	0	0	0	110.7	N247 T248 A254 A255 M263 L266 L267 C276 L310	N247-L251 WeakPolarHBondContact O-CB 3.15Å; N247-L251 PolarHBondContact O-N 3.38Å; T248-L251 WeakPolarHBondContact O-CB 3.34Å; T248-L251 PolarHBondContact O-N 3.15Å; L251-A254 PolarHBondContact O-N 3.27Å; L251-A255 WeakPolarHBondContact O-CB 3.14Å; L251-A255 PolarHBondContact O-N 3.47Å; L251-M263 HydrophobicContact CD1-CB 4.08Å; L251-M263 HydrophobicContact CD1-CG 4.15Å; L251-L266 HydrophobicContact CB-CD1 4.11Å; L251-L266 HydrophobicContact CD1-CB 4.33Å; L251-L267 HydrophobicContact CD1-CD1 4.21Å; L251-L267 HydrophobicContact CD1-CD2 4.13Å; L251-L267 HydrophobicContact CD1-CG 3.84Å; L251-L267 HydrophobicContact CD2-CD2 3.66Å; L251-L267 HydrophobicContact CD2-CG 4.31Å; L251-C276 HydrophobicContact CD2-CB 3.63Å; L251-L310 HydrophobicContact CD2-CD2 4.3Å
252	I	91.6	Very high	90.4	Very high	7 Å²	7	28.3 Å²	28.3	4%	0.036	14%	0.14	C	C	.	.	H	α-helix	trans	-62.1	-45.9	176.1	-67.9	152.9	0	0	0	110.8	W213 T248 N249 E250 A254 A255 M256 L291	W213-I252 HydrophobicContact CB-CD1 4.09Å; W213-I252 HydrophobicContact CB-CG2 3.93Å; W213-I252 HydrophobicContact CD2-CD1 3.95Å; W213-I252 HydrophobicContact CD2-CG1 4.43Å; W213-I252 HydrophobicContact CD2-CG2 3.85Å; W213-I252 HydrophobicContact CE3-CG2 3.83Å; W213-I252 HydrophobicContact CG-CD1 3.53Å; W213-I252 HydrophobicContact CG-CG1 4.38Å; W213-I252 HydrophobicContact CG-CG2 3.97Å; T248-I252 HydrophobicContact CG2-CD1 4.25Å; T248-I252 WeakPolarHBondContact O-CD1 3.35Å; T248-I252 WeakPolarHBondContact O-CG1 3.48Å; T248-I252 PolarHBondContact O-N 2.86Å; T248-I252 VanDerWaalsContact O-N 3.13Å; N249-I252 PolarHBondContact O-N 2.86Å; E250-I252 VanDerWaalsContact C-N 3.29Å; E250-I252 PolarHBondContact O-N 3.14Å; I252-A254 PolarHBondContact O-N 3Å; I252-A255 PolarHBondContact O-N 3.23Å; I252-M256 WeakPolarHBondContact O-CG 3.4Å; I252-M256 PolarHBondContact O-N 3.02Å; I252-L291 HydrophobicContact CG1-CD1 4.38Å; I252-L291 HydrophobicContact CG1-CD2 4.04Å; I252-L291 HydrophobicContact CG2-CD1 4.05Å
253	A	90.1	Very high	90.7	Very high	7 Å²	7	28.2 Å²	28.2	6%	0.058	14%	0.14	C	C	.	.	H	α-helix	trans	-63.3	-39.9	177.4	0	0	0	0	0	112.3	V124 R215 N249 E250 M256 A257	V124-A253 HydrophobicContact CG2-CB 3.88Å; R215-A253 HydrophobicContact CG-CB 4.38Å; N249-A253 PolarHBondContact O-N 3.03Å; E250-A253 PolarHBondContact O-N 3.34Å; A253-M256 PolarHBondContact O-N 3.2Å; A253-A257 WeakPolarHBondContact O-CB 3.23Å; A253-A257 PolarHBondContact O-N 3.44Å
254	A	92.4	Very high	90.7	Very high	0 Å²	0	29 Å²	29	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-64.5	-41.9	175.5	0	0	0	0	0	112	E250 L251 I252 A257 L258 D259 Y262 M263	E250-A254 VanDerWaalsContact O-CB 3.31Å; E250-A254 WeakPolarHBondContact O-CB 3.37Å; E250-A254 PolarHBondContact O-N 3.03Å; L251-A254 PolarHBondContact O-N 3.27Å; I252-A254 PolarHBondContact O-N 3Å; A254-A257 CarbonylContact O-C 3.57Å; A254-A257 PolarHBondContact O-N 2.96Å; A254-L258 PolarHBondContact O-N 3.31Å; A254-L258 VanDerWaalsContact O-N 3.08Å; A254-D259 PolarHBondContact O-N 2.8Å; A254-Y262 HydrophobicContact CB-CD1 3.47Å; A254-Y262 VanDerWaalsContact CB-CD1 3.47Å; A254-Y262 HydrophobicContact CB-CE1 4.12Å; A254-Y262 HydrophobicContact CB-CG 4.07Å; A254-M263 HydrophobicContact CB-CG 3.93Å
255	A	92.8	Very high	90.8	Very high	0 Å²	0	29 Å²	29	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-63.3	-45.8	175.4	0	0	0	0	0	111.7	L251 I252 A257 L258 M263 L291 L295	L251-A255 WeakPolarHBondContact O-CB 3.14Å; L251-A255 PolarHBondContact O-N 3.47Å; I252-A255 PolarHBondContact O-N 3.23Å; A255-A257 VanDerWaalsContact C-N 3.26Å; A255-A257 PolarHBondContact O-N 3Å; A255-L258 PolarHBondContact O-N 2.82Å; A255-M263 VanDerWaalsContact CA-SD 3.55Å; A255-M263 HydrophobicContact CB-CE 3.74Å; A255-M263 HydrophobicContact CB-CG 4.44Å; A255-M263 HydrophobicContact CB-SD 3.9Å; A255-L291 HydrophobicContact CB-CD1 4.31Å; A255-L291 HydrophobicContact CB-CD2 3.97Å; A255-L291 HydrophobicContact CB-CG 4.49Å; A255-L295 HydrophobicContact CB-CD1 4.25Å; A255-L295 HydrophobicContact CB-CD2 4.4Å
256	M	91.6	Very high	90.9	Very high	2 Å²	2	29.3 Å²	29.3	1%	0.01	15%	0.145	C	C	.	.	H	α-helix	trans	-65.1	-29	174.2	-68.2	-61.8	-70.8	0	0	112.4	V116 Y120 I252 A253 L258 E294 L295 V298 Y299	V116-M256 HydrophobicContact CG1-CE 4.24Å; Y120-M256 HydrophobicContact CD1-CB 3.53Å; Y120-M256 HydrophobicContact CD1-CG 4.45Å; Y120-M256 HydrophobicContact CD2-CB 3.79Å; Y120-M256 HydrophobicContact CD2-CE 4.19Å; Y120-M256 HydrophobicContact CE1-CB 3.68Å; Y120-M256 HydrophobicContact CE1-CG 4.11Å; Y120-M256 HydrophobicContact CE2-CB 3.94Å; Y120-M256 HydrophobicContact CE2-CE 3.52Å; Y120-M256 HydrophobicContact CE2-CG 4.36Å; Y120-M256 HydrophobicContact CG-CB 3.59Å; I252-M256 WeakPolarHBondContact O-CG 3.4Å; I252-M256 PolarHBondContact O-N 3.02Å; A253-M256 PolarHBondContact O-N 3.2Å; M256-L258 VanDerWaalsContact C-N 3.26Å; M256-L258 PolarHBondContact O-N 3.02Å; M256-E294 HydrophobicContact CE-CG 4.28Å; M256-E294 HydrophobicContact SD-CG 3.96Å; M256-L295 HydrophobicContact SD-CD2 4.05Å; M256-V298 HydrophobicContact CE-CG2 4.44Å; M256-Y299 PolarHBondContact O-OH 2.81Å; M256-Y299 HydrophobicContact SD-CE2 4.38Å
257	A	91.3	Very high	90.8	Very high	0 Å²	0	26.9 Å²	26.9	0%	0	14%	0.137	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.9	-3.6	172.4	0	0	0	0	0	113.7	H62 R121 V124 A253 A254 A255 D259	H62-A257 PolarHBondContact CE1-O 3.19Å; H62-A257 PolarHBondContact NE2-O 2.99Å; R121-A257 WeakPolarHBondContact CD-O 3.4Å; R121-A257 PolarHBondContact NH1-O 3.25Å; V124-A257 HydrophobicContact CB-CB 4.11Å; V124-A257 HydrophobicContact CG2-CB 4.17Å; A253-A257 WeakPolarHBondContact O-CB 3.23Å; A253-A257 PolarHBondContact O-N 3.44Å; A254-A257 CarbonylContact O-C 3.57Å; A254-A257 PolarHBondContact O-N 2.96Å; A255-A257 VanDerWaalsContact C-N 3.26Å; A255-A257 PolarHBondContact O-N 3Å; A257-D259 PolarHBondContact O-N 3.2Å
258	L	91.8	Very high	90.7	Very high	26 Å²	26	28.3 Å²	28.3	14%	0.136	15%	0.15	C	C	.	.	T	Hydrogen-bonded Turn	trans	50.3	39.9	-171.9	-60.1	173.3	0	0	0	112.4	W59 R121 A254 A255 M256 L260 Y299 A303 A306	W59-L258 HydrophobicContact CH2-CD1 4Å; W59-L258 HydrophobicContact CZ3-CD1 3.9Å; R121-L258 PolarHBondContact NH1-O 3.35Å; A254-L258 PolarHBondContact O-N 3.31Å; A254-L258 VanDerWaalsContact O-N 3.08Å; A255-L258 PolarHBondContact O-N 2.82Å; M256-L258 VanDerWaalsContact C-N 3.26Å; M256-L258 PolarHBondContact O-N 3.02Å; L258-L260 PolarHBondContact O-N 3.01Å; L258-Y299 HydrophobicContact CD1-CD1 4.13Å; L258-Y299 HydrophobicContact CD1-CD2 4.4Å; L258-Y299 HydrophobicContact CD1-CE1 4.25Å; L258-Y299 HydrophobicContact CD1-CE2 4.49Å; L258-Y299 HydrophobicContact CD1-CG 4.22Å; L258-Y299 HydrophobicContact CD2-CD2 4.11Å; L258-Y299 HydrophobicContact CD2-CE2 4.31Å; L258-Y299 HydrophobicContact CG-CD2 4.4Å; L258-Y299 HydrophobicContact CG-CE2 4.26Å; L258-A303 HydrophobicContact CD2-CB 4.22Å; L258-A306 HydrophobicContact CD2-CB 4.3Å
259	D	91.3	Very high	90.4	Very high	28 Å²	28	30 Å²	30	15%	0.15	16%	0.158	C	C	.	.			trans	-95	83.9	174.9	-169.7	-15.6	0	0	0	110.2	C125 A254 A257 N261 Y262 M263	C125-D259 PolarHBondContact SG-OD2 3.08Å; A254-D259 PolarHBondContact O-N 2.8Å; A257-D259 PolarHBondContact O-N 3.2Å; D259-N261 VanDerWaalsContact C-N 3.28Å; D259-N261 PolarHBondContact O-N 3.48Å; D259-N261 PolarHBondContact OD1-N 3.13Å; D259-Y262 PolarHBondContact O-N 3.31Å; D259-Y262 PolarHBondContact OD1-N 2.83Å; D259-Y262 VanDerWaalsContact OD1-N 3.13Å; D259-M263 WeakPolarHBondContact O-CG 3.5Å; D259-M263 PolarHBondContact O-N 3.48Å
260	L	91.1	Very high	89.7	Confident	54 Å²	54	39.6 Å²	39.6	28%	0.283	20%	0.2	S	C	.	.	H	α-helix	trans	-59	-37.9	-176.8	-61.1	176.1	0	0	0	112.5	L258 Y262 M263 E264 K305 A306	L258-L260 PolarHBondContact O-N 3.01Å; L260-Y262 VanDerWaalsContact C-N 3.35Å; L260-Y262 PolarHBondContact O-N 2.91Å; L260-M263 HydrophobicContact CD2-SD 4.19Å; L260-M263 PolarHBondContact O-N 3.38Å; L260-E264 WeakPolarHBondContact O-CG 3.26Å; L260-E264 PolarHBondContact O-N 3.05Å; L260-K305 HydrophobicContact CD1-CB 3.86Å; L260-K305 HydrophobicContact CD1-CD 4Å; L260-K305 HydrophobicContact CD2-CB 4.22Å; L260-A306 HydrophobicContact CD2-CB 3.83Å
261	N	91.2	Very high	89.1	Confident	112 Å²	112	44 Å²	44	60%	0.599	22%	0.222	S	C	*	.	H	α-helix	trans	-64.5	-42.6	179	-66.7	-26.3	0	0	0	110.8	D259 E264 N265	D259-N261 VanDerWaalsContact C-N 3.28Å; D259-N261 PolarHBondContact O-N 3.48Å; D259-N261 PolarHBondContact OD1-N 3.13Å; N261-E264 PolarHBondContact O-N 2.99Å; N261-N265 VanDerWaalsContact O-CG 3.23Å; N261-N265 PolarHBondContact O-N 3.5Å; N261-N265 VanDerWaalsContact O-N 3.1Å; N261-N265 PolarHBondContact O-ND2 3.45Å; N261-N265 VanDerWaalsContact O-ND2 3.16Å
262	Y	91.1	Very high	88	Confident	62 Å²	62	52.3 Å²	52.3	24%	0.243	26%	0.261	C	S	.	.	H	α-helix	trans	-69.5	-36.8	177.9	-170.1	-152.2	0	0	0	112	V124 A254 D259 L260 N265 L266	V124-Y262 HydrophobicContact CG1-CD1 4.13Å; V124-Y262 HydrophobicContact CG1-CE1 4.16Å; A254-Y262 HydrophobicContact CB-CD1 3.47Å; A254-Y262 VanDerWaalsContact CB-CD1 3.47Å; A254-Y262 HydrophobicContact CB-CE1 4.12Å; A254-Y262 HydrophobicContact CB-CG 4.07Å; D259-Y262 PolarHBondContact O-N 3.31Å; D259-Y262 PolarHBondContact OD1-N 2.83Å; D259-Y262 VanDerWaalsContact OD1-N 3.13Å; L260-Y262 VanDerWaalsContact C-N 3.35Å; L260-Y262 PolarHBondContact O-N 2.91Å; Y262-N265 PolarHBondContact O-N 3.02Å; Y262-L266 HydrophobicContact CD2-CD1 4.14Å; Y262-L266 HydrophobicContact CD2-CG 4.12Å; Y262-L266 HydrophobicContact CE1-CD1 4.22Å; Y262-L266 HydrophobicContact CE2-CD1 3.83Å; Y262-L266 HydrophobicContact CE2-CD2 4.13Å; Y262-L266 HydrophobicContact CE2-CG 3.85Å; Y262-L266 HydrophobicContact CG-CD1 4.48Å; Y262-L266 WeakPolarHBondContact O-CG 3.33Å; Y262-L266 PolarHBondContact O-N 3.01Å; Y262-L266 VanDerWaalsContact O-N 3.11Å
263	M	92.3	Very high	86.9	Confident	0 Å²	0	61.5 Å²	61.5	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-60.7	-48	172.5	-66.3	173.2	71.3	0	0	112.1	L251 A254 A255 D259 L260 N265 L266 L267 A306 L309 L310	L251-M263 HydrophobicContact CD1-CB 4.08Å; L251-M263 HydrophobicContact CD1-CG 4.15Å; A254-M263 HydrophobicContact CB-CG 3.93Å; A255-M263 VanDerWaalsContact CA-SD 3.55Å; A255-M263 HydrophobicContact CB-CE 3.74Å; A255-M263 HydrophobicContact CB-CG 4.44Å; A255-M263 HydrophobicContact CB-SD 3.9Å; D259-M263 WeakPolarHBondContact O-CG 3.5Å; D259-M263 PolarHBondContact O-N 3.48Å; L260-M263 HydrophobicContact CD2-SD 4.19Å; L260-M263 PolarHBondContact O-N 3.38Å; M263-N265 VanDerWaalsContact C-N 3.31Å; M263-N265 PolarHBondContact O-N 3.44Å; M263-L266 PolarHBondContact O-N 2.73Å; M263-L266 VanDerWaalsContact O-N 3.16Å; M263-L267 WeakPolarHBondContact O-CB 3.43Å; M263-L267 WeakPolarHBondContact O-CG 3.06Å; M263-L267 PolarHBondContact O-N 3.25Å; M263-A306 HydrophobicContact CE-CB 3.99Å; M263-A306 HydrophobicContact SD-CB 4.01Å; M263-L309 HydrophobicContact CB-CD2 3.6Å; M263-L309 HydrophobicContact CE-CD2 4.12Å; M263-L310 HydrophobicContact CE-CD1 4.07Å; M263-L310 HydrophobicContact CE-CD2 3.99Å; M263-L310 HydrophobicContact CE-CG 3.75Å
264	E	89.4	Confident	86.1	Confident	93 Å²	93	65.5 Å²	65.5	44%	0.435	32%	0.318	S	S	.	.	H	α-helix	trans	-59.2	-42.1	178.2	-79	-179.9	-171.5	0	0	112	L260 N261 L266 L267 S268 L309	L260-E264 WeakPolarHBondContact O-CG 3.26Å; L260-E264 PolarHBondContact O-N 3.05Å; N261-E264 PolarHBondContact O-N 2.99Å; E264-L266 VanDerWaalsContact C-N 3.34Å; E264-L266 PolarHBondContact O-N 2.98Å; E264-L267 PolarHBondContact O-N 3.15Å; E264-S268 VanDerWaalsContact O-CB 3.22Å; E264-S268 WeakPolarHBondContact O-CB 3.49Å; E264-S268 PolarHBondContact O-N 3.03Å; E264-S268 PolarHBondContact O-OG 2.9Å; E264-L309 HydrophobicContact CG-CD1 3.6Å; E264-L309 HydrophobicContact CG-CD2 3.8Å; E264-L309 HydrophobicContact CG-CG 4.34Å
265	N	89.8	Confident	85.5	Confident	107 Å²	107	72.2 Å²	72.2	57%	0.572	35%	0.347	S	S	*	.	H	α-helix	trans	-62.4	-39.1	176.2	-72	-26.9	0	0	0	112.5	N261 Y262 M263 S268 I269	N261-N265 VanDerWaalsContact O-CG 3.23Å; N261-N265 PolarHBondContact O-N 3.5Å; N261-N265 VanDerWaalsContact O-N 3.1Å; N261-N265 PolarHBondContact O-ND2 3.45Å; N261-N265 VanDerWaalsContact O-ND2 3.16Å; Y262-N265 PolarHBondContact O-N 3.02Å; M263-N265 VanDerWaalsContact C-N 3.31Å; M263-N265 PolarHBondContact O-N 3.44Å; N265-S268 PolarHBondContact O-OG 2.7Å; N265-I269 WeakPolarHBondContact O-CG1 3.37Å
266	L	88.5	Confident	85	Confident	13 Å²	13	72.7 Å²	72.7	7%	0.068	35%	0.351	C	S	.	.	H	α-helix	trans	-76.8	-34.9	178.8	-71.6	173.6	0	0	0	113	E250 L251 Y262 M263 E264 I269 C276	E250-L266 HydrophobicContact CB-CD1 4.1Å; L251-L266 HydrophobicContact CB-CD1 4.11Å; L251-L266 HydrophobicContact CD1-CB 4.33Å; Y262-L266 HydrophobicContact CD2-CD1 4.14Å; Y262-L266 HydrophobicContact CD2-CG 4.12Å; Y262-L266 HydrophobicContact CE1-CD1 4.22Å; Y262-L266 HydrophobicContact CE2-CD1 3.83Å; Y262-L266 HydrophobicContact CE2-CD2 4.13Å; Y262-L266 HydrophobicContact CE2-CG 3.85Å; Y262-L266 HydrophobicContact CG-CD1 4.48Å; Y262-L266 WeakPolarHBondContact O-CG 3.33Å; Y262-L266 PolarHBondContact O-N 3.01Å; Y262-L266 VanDerWaalsContact O-N 3.11Å; M263-L266 PolarHBondContact O-N 2.73Å; M263-L266 VanDerWaalsContact O-N 3.16Å; E264-L266 VanDerWaalsContact C-N 3.34Å; E264-L266 PolarHBondContact O-N 2.98Å; L266-I269 HydrophobicContact CD2-CD1 4.26Å; L266-I269 WeakPolarHBondContact O-CG1 3.43Å; L266-C276 PolarHBondContact O-SG 3.37Å; L266-C276 VanDerWaalsContact O-SG 3.37Å
267	L	88	Confident	84.7	Confident	14 Å²	14	78.3 Å²	78.3	7%	0.073	38%	0.377	C	S	.	.	H	α-helix	trans	-76.5	-28.8	179.5	-72.3	170.4	0	0	0	112.8	L251 M263 E264 I269 V278 L309 L310 Y313	L251-L267 HydrophobicContact CD1-CD1 4.21Å; L251-L267 HydrophobicContact CD1-CD2 4.13Å; L251-L267 HydrophobicContact CD1-CG 3.84Å; L251-L267 HydrophobicContact CD2-CD2 3.66Å; L251-L267 HydrophobicContact CD2-CG 4.31Å; M263-L267 WeakPolarHBondContact O-CB 3.43Å; M263-L267 WeakPolarHBondContact O-CG 3.06Å; M263-L267 PolarHBondContact O-N 3.25Å; E264-L267 PolarHBondContact O-N 3.15Å; L267-I269 VanDerWaalsContact C-N 3.28Å; L267-I269 PolarHBondContact O-N 3.15Å; L267-V278 HydrophobicContact CD2-CG2 3.81Å; L267-L309 HydrophobicContact CD1-CD2 3.72Å; L267-L309 HydrophobicContact CD1-CG 3.95Å; L267-L310 HydrophobicContact CD1-CD2 4.5Å; L267-Y313 HydrophobicContact CB-CD1 3.94Å; L267-Y313 HydrophobicContact CB-CD2 4.15Å; L267-Y313 HydrophobicContact CB-CE1 3.93Å; L267-Y313 HydrophobicContact CB-CE2 4.14Å; L267-Y313 HydrophobicContact CB-CG 4.04Å; L267-Y313 HydrophobicContact CD1-CD2 3.98Å; L267-Y313 HydrophobicContact CD1-CE2 4.43Å; L267-Y313 HydrophobicContact CD1-CG 4.26Å; L267-Y313 HydrophobicContact CD2-CD1 4.48Å; L267-Y313 HydrophobicContact CD2-CG 4.18Å; L267-Y313 HydrophobicContact CG-CG 4.39Å; L267-Y313 VanDerWaalsContact O-CE1 3.27Å; L267-Y313 WeakPolarHBondContact O-CE1 3.37Å
268	S	86.5	Confident	84.4	Confident	63 Å²	63	79.4 Å²	79.4	44%	0.441	38%	0.384	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.6	-3.4	179.8	58.6	0	0	0	0	114.9	E264 N265 K270	E264-S268 VanDerWaalsContact O-CB 3.22Å; E264-S268 WeakPolarHBondContact O-CB 3.49Å; E264-S268 PolarHBondContact O-N 3.03Å; E264-S268 PolarHBondContact O-OG 2.9Å; N265-S268 PolarHBondContact O-OG 2.7Å; S268-K270 PolarHBondContact O-N 2.99Å
269	I	84.6	Confident	84.2	Confident	40 Å²	40	82.3 Å²	82.3	21%	0.205	40%	0.399	C	S	.	.			trans	-62.1	119.1	177.9	-61.3	174.6	0	0	0	110.3	N265 L266 L267 I271 E274	N265-I269 WeakPolarHBondContact O-CG1 3.37Å; L266-I269 HydrophobicContact CD2-CD1 4.26Å; L266-I269 WeakPolarHBondContact O-CG1 3.43Å; L267-I269 VanDerWaalsContact C-N 3.28Å; L267-I269 PolarHBondContact O-N 3.15Å; I269-I271 HydrophobicContact CG2-CB 4.22Å; I269-E274 HydrophobicContact CG2-CB 3.74Å
270	K	76.5	Confident	83.9	Confident	201 Å²	201	83.3 Å²	83.3	87%	0.874	40%	0.402	S	S	*	.			trans	-84.5	-16.5	-178.2	-65.1	-175	179.6	179.6	0	114.2	S268 E272	S268-K270 PolarHBondContact O-N 2.99Å; K270-E272 PolarHBondContact O-N 3.42Å
271	I	77.2	Confident	83.7	Confident	92 Å²	92	82.8 Å²	82.8	47%	0.472	40%	0.403	S	S	.	.			trans	-74	115.8	-177.1	-61.9	170.8	0	0	0	108.6	I269 K273 E274 K275	I269-I271 HydrophobicContact CG2-CB 4.22Å; I271-K273 VanDerWaalsContact C-N 3.27Å; I271-K273 HydrophobicContact CG2-CB 4.31Å; I271-K273 PolarHBondContact O-N 2.91Å; I271-E274 HydrophobicContact CB-CB 4.09Å; I271-E274 HydrophobicContact CB-CG 4.35Å; I271-E274 HydrophobicContact CG2-CB 4.14Å; I271-E274 HydrophobicContact CG2-CG 3.98Å; I271-E274 CarbonylContact O-C 3.27Å; I271-E274 WeakPolarHBondContact O-CA 3.19Å; I271-E274 PolarHBondContact O-N 3.46Å; I271-K275 PolarHBondContact O-N 2.87Å
272	E	69.5	Low	83.5	Confident	177 Å²	177	77.5 Å²	77.5	83%	0.827	37%	0.374	S	S	*	.	G	3₁₀ helix	trans	-55.8	-39.7	-175.8	-70.5	-174	160.9	0	0	113.4	K270 E274 K275	K270-E272 PolarHBondContact O-N 3.42Å; E272-E274 PolarHBondContact O-N 2.95Å; E272-K275 WeakPolarHBondContact O-CB 3.31Å; E272-K275 PolarHBondContact O-N 3.17Å
273	K	67.4	Low	83.2	Confident	200 Å²	200	82.7 Å²	82.7	87%	0.87	39%	0.394	S	S	*	.	G	3₁₀ helix	trans	-64.2	-24.2	178.1	-68.7	-175	178.9	178.8	0	113.4	I271	I271-K273 VanDerWaalsContact C-N 3.27Å; I271-K273 HydrophobicContact CG2-CB 4.31Å; I271-K273 PolarHBondContact O-N 2.91Å
274	E	73.3	Confident	82.5	Confident	91 Å²	91	83.9 Å²	83.9	43%	0.425	40%	0.402	S	S	.	.	G	3₁₀ helix	trans	-106.4	0	-177.2	-68.4	179.4	-167.5	0	0	111.9	N247 I269 I271 E272 C276	N247-E274 WeakPolarHBondContact ND2-CB 3.26Å; N247-E274 PolarHBondContact ND2-O 3.31Å; I269-E274 HydrophobicContact CG2-CB 3.74Å; I271-E274 HydrophobicContact CB-CB 4.09Å; I271-E274 HydrophobicContact CB-CG 4.35Å; I271-E274 HydrophobicContact CG2-CB 4.14Å; I271-E274 HydrophobicContact CG2-CG 3.98Å; I271-E274 CarbonylContact O-C 3.27Å; I271-E274 WeakPolarHBondContact O-CA 3.19Å; I271-E274 PolarHBondContact O-N 3.46Å; E272-E274 PolarHBondContact O-N 2.95Å; E274-C276 PolarHBondContact O-N 3.34Å
275	K	80	Confident	81.9	Confident	141 Å²	141	80.3 Å²	80.3	61%	0.613	39%	0.385	S	S	*	.			trans	-67.5	129.6	-177.1	-167.2	175.3	-178.2	179.6	0	110.2	I271 E272	I271-K275 PolarHBondContact O-N 2.87Å; E272-K275 WeakPolarHBondContact O-CB 3.31Å; E272-K275 PolarHBondContact O-N 3.17Å
276	C	83.5	Confident	81	Confident	11 Å²	11	80.2 Å²	80.2	7%	0.074	39%	0.385	C	S	.	.			trans	-64.6	135.2	178.3	-62.5	0	0	0	0	111.4	N247 L251 L266 E274 V278	N247-C276 PolarHBondContact O-SG 2.99Å; L251-C276 HydrophobicContact CD2-CB 3.63Å; L266-C276 PolarHBondContact O-SG 3.37Å; L266-C276 VanDerWaalsContact O-SG 3.37Å; E274-C276 PolarHBondContact O-N 3.34Å; C276-V278 PolarHBondContact O-N 3.3Å
277	Q	85.3	Confident	80.6	Confident	119 Å²	119	80.5 Å²	80.5	56%	0.556	39%	0.387	S	S	*	.			trans	-85.4	86.6	172.9	-63.9	178.1	6.1	0	0	109.8	T248 N279 K280	T248-Q277 HydrophobicContact CG2-CB 4.02Å; T248-Q277 WeakPolarHBondContact CG2-O 3.26Å; T248-Q277 PolarHBondContact OG1-N 3.35Å; Q277-N279 PolarHBondContact O-N 2.96Å; Q277-K280 HydrophobicContact CB-CB 4.29Å; Q277-K280 WeakPolarHBondContact O-CB 3.18Å; Q277-K280 PolarHBondContact O-N 3.45Å; Q277-K280 VanDerWaalsContact O-N 3.17Å
278	V	85.2	Confident	80.5	Confident	24 Å²	24	82.9 Å²	82.9	15%	0.145	40%	0.404	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.4	-30.5	-173.7	-170.6	0	0	0	0	113	L267 C276 K280 L310 A315	L267-V278 HydrophobicContact CD2-CG2 3.81Å; C276-V278 PolarHBondContact O-N 3.3Å; V278-K280 VanDerWaalsContact C-N 3.34Å; V278-K280 PolarHBondContact O-N 2.95Å; V278-L310 HydrophobicContact CG1-CB 4.47Å; V278-L310 HydrophobicContact CG1-CD2 3.93Å; V278-A315 HydrophobicContact CG1-CB 3.6Å
279	N	86.2	Confident	80.5	Confident	86 Å²	86	80.4 Å²	80.4	46%	0.46	38%	0.384	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91	14.2	-177.7	-66.3	-34.7	0	0	0	114.5	Q277 C281 G314 A315 V316	Q277-N279 PolarHBondContact O-N 2.96Å; N279-C281 PolarHBondContact O-N 2.87Å; N279-G314 PolarHBondContact ND2-O 2.86Å; N279-G314 PolarHBondContact OD1-O 3.48Å; N279-A315 VanDerWaalsContact OD1-CA 3.27Å; N279-A315 WeakPolarHBondContact OD1-CA 3.42Å; N279-V316 PolarHBondContact OD1-N 3.31Å
280	K	86.4	Confident	80.7	Confident	50 Å²	50	79.2 Å²	79.2	22%	0.217	38%	0.379	C	S	.	.			trans	-73.2	112.6	178.4	-170.1	168	-175.8	-179	0	110.5	W213 T248 Q277 V278	W213-K280 WeakPolarHBondContact CZ2-O 3.24Å; W213-K280 PolarHBondContact NE1-O 3.17Å; W213-K280 VanDerWaalsContact NE1-O 3.12Å; T248-K280 HydrophobicContact CG2-CB 4.03Å; T248-K280 HydrophobicContact CG2-CD 3.79Å; Q277-K280 HydrophobicContact CB-CB 4.29Å; Q277-K280 WeakPolarHBondContact O-CB 3.18Å; Q277-K280 PolarHBondContact O-N 3.45Å; Q277-K280 VanDerWaalsContact O-N 3.17Å; V278-K280 VanDerWaalsContact C-N 3.34Å; V278-K280 PolarHBondContact O-N 2.95Å
281	C	86.8	Confident	81.4	Confident	43 Å²	43	70 Å²	70	29%	0.291	34%	0.34	S	S	.	.			trans	-84.8	151.5	179.5	-59.3	0	0	0	0	112.5	N279 R283 P288 R289	N279-C281 PolarHBondContact O-N 2.87Å; C281-R283 PolarHBondContact O-N 3.25Å; C281-P288 HydrophobicContact CB-CB 3.65Å; C281-R289 CarbonylContact C-O 3.51Å; C281-R289 VanDerWaalsContact CA-O 3.29Å; C281-R289 WeakPolarHBondContact CA-O 3.04Å
282	D	86.6	Confident	82	Confident	0 Å²	0	65.8 Å²	65.8	0%	0	32%	0.318	C	S	.	.	B	Isolated β-bridge	trans	-74.3	115.9	173.4	-165.7	-22.6	0	0	0	109.5	R159 C212 W213 S284 F285 P288 R289	R159-D282 IonicContact NH2-OD2 2.71Å; R159-D282 PolarHBondContact NH2-OD2 3.11Å; C212-D282 WeakPolarHBondContact CA-OD1 3.19Å; W213-D282 HydrophobicContact CD2-CB 3.65Å; W213-D282 VanDerWaalsContact CE2-N 3.32Å; W213-D282 HydrophobicContact CE3-CB 3.69Å; W213-D282 HydrophobicContact CG-CB 4.4Å; W213-D282 HydrophobicContact CH2-CB 3.69Å; W213-D282 HydrophobicContact CZ2-CB 3.68Å; W213-D282 HydrophobicContact CZ3-CB 3.69Å; D282-S284 VanDerWaalsContact C-N 3.26Å; D282-S284 PolarHBondContact O-N 2.66Å; D282-S284 VanDerWaalsContact OD1-CB 3.24Å; D282-S284 WeakPolarHBondContact OD1-CB 3.36Å; D282-S284 PolarHBondContact OD1-N 2.97Å; D282-S284 PolarHBondContact OD1-OG 3.28Å; D282-S284 PolarHBondContact OD2-OG 3.28Å; D282-S284 VanDerWaalsContact OD2-OG 3.13Å; D282-F285 HydrophobicContact CB-CD2 4.1Å; D282-P288 VanDerWaalsContact O-CA 3.23Å; D282-P288 WeakPolarHBondContact O-CA 3.27Å; D282-R289 PolarHBondContact N-O 3.11Å; D282-R289 PolarHBondContact O-N 3.48Å; D282-R289 VanDerWaalsContact O-N 3.09Å
283	R	84.3	Confident	82.9	Confident	172 Å²	172	57.3 Å²	57.3	65%	0.649	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.6	-0.7	179.1	-65.2	-168.7	177.7	175.5	-4.3	114	S211 C281	S211-R283 PolarHBondContact O-N 3.49Å; C281-R283 PolarHBondContact O-N 3.25Å
284	S	77.1	Confident	83.9	Confident	25 Å²	25	48 Å²	48	18%	0.175	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.5	-18.8	172.6	66.9	0	0	0	0	112.7	D282	D282-S284 VanDerWaalsContact C-N 3.26Å; D282-S284 PolarHBondContact O-N 2.66Å; D282-S284 VanDerWaalsContact OD1-CB 3.24Å; D282-S284 WeakPolarHBondContact OD1-CB 3.36Å; D282-S284 PolarHBondContact OD1-N 2.97Å; D282-S284 PolarHBondContact OD1-OG 3.28Å; D282-S284 PolarHBondContact OD2-OG 3.28Å; D282-S284 VanDerWaalsContact OD2-OG 3.13Å
285	F	77.3	Confident	84.7	Confident	17 Å²	17	43.7 Å²	43.7	8%	0.075	22%	0.218	C	C	.	.	S	Bend	trans	-100.7	149.3	173.5	-61.8	-93	0	0	0	111	I155 Q179 D282 P287 P288 R289	I155-F285 HydrophobicContact CG2-CZ 4.09Å; Q179-F285 VanDerWaalsContact NE2-CD1 3.29Å; D282-F285 HydrophobicContact CB-CD2 4.1Å; F285-P287 CarbonylContact C-O 3.2Å; F285-P287 VanDerWaalsContact C-O 3.29Å; F285-P287 WeakPolarHBondContact CB-O 3.3Å; F285-P287 CarbonylContact O-C 3.6Å; F285-P287 VanDerWaalsContact O-C 3.28Å; F285-P288 WeakPolarHBondContact O-CA 3.4Å; F285-R289 HydrophobicContact CB-CB 4.09Å; F285-R289 HydrophobicContact CD2-CB 3.96Å; F285-R289 VanDerWaalsContact CE1-CZ 3.42Å; F285-R289 HydrophobicContact CG-CB 4.11Å
286	D	71.7	Confident	85.1	Confident	106 Å²	106	37.3 Å²	37.3	57%	0.567	19%	0.191	S	C	*	.	S	Bend	trans	-127	104.5	172.7	179.1	21.7	0	0	0	108.5	R328	D286-R328 IonicContact OD1-NE 2.67Å; D286-R328 PolarHBondContact OD1-NE 3.29Å; D286-R328 IonicContact OD2-CZ 3.49Å; D286-R328 IonicContact OD2-NE 3.99Å; D286-R328 PolarHBondContact OD2-NE 3.23Å; D286-R328 IonicContact OD2-NH2 3.33Å; D286-R328 PolarHBondContact OD2-NH2 3.36Å
287	P	80.1	Confident	85.3	Confident	19 Å²	19	37.3 Å²	37.3	12%	0.123	19%	0.191	C	C	.	.	S	Bend	cis	-72.9	157.1	7.6	31.2	-35.9	0	0	0	113.5	F285 R289 Y321 V325	F285-P287 CarbonylContact C-O 3.2Å; F285-P287 VanDerWaalsContact C-O 3.29Å; F285-P287 WeakPolarHBondContact CB-O 3.3Å; F285-P287 CarbonylContact O-C 3.6Å; F285-P287 VanDerWaalsContact O-C 3.28Å; P287-R289 PolarHBondContact O-N 3.38Å; P287-Y321 HydrophobicContact CG-CD2 4.36Å; P287-Y321 HydrophobicContact CG-CE2 3.98Å; P287-V325 HydrophobicContact CG-CB 4.43Å; P287-V325 HydrophobicContact CG-CG2 3.66Å
288	P	84.1	Confident	85.3	Confident	64 Å²	64	31.6 Å²	31.6	42%	0.416	16%	0.164	S	C	.	.	P	Polyproline II helix	trans	-55.9	130.6	177.4	-25.9	34.7	0	0	0	112.2	C281 D282 F285	C281-P288 HydrophobicContact CB-CB 3.65Å; D282-P288 VanDerWaalsContact O-CA 3.23Å; D282-P288 WeakPolarHBondContact O-CA 3.27Å; F285-P288 WeakPolarHBondContact O-CA 3.4Å
289	R	86.5	Confident	85.5	Confident	10 Å²	10	31 Å²	31	4%	0.038	16%	0.159	C	C	.	.	B	Isolated β-bridge	trans	-92.7	125.4	-171.6	-173.4	179.8	-72.9	-171.1	-2.7	111.6	E104 W213 C281 D282 F285 P287 A293 E294 Y321	E104-R289 PolarHBondContact O-NH2 3.47Å; W213-R289 VanDerWaalsContact CH2-O 3.29Å; W213-R289 WeakPolarHBondContact CH2-O 3.24Å; W213-R289 VanDerWaalsContact CZ2-O 3.3Å; W213-R289 WeakPolarHBondContact CZ2-O 3.25Å; C281-R289 CarbonylContact C-O 3.51Å; C281-R289 VanDerWaalsContact CA-O 3.29Å; C281-R289 WeakPolarHBondContact CA-O 3.04Å; D282-R289 PolarHBondContact N-O 3.11Å; D282-R289 PolarHBondContact O-N 3.48Å; D282-R289 VanDerWaalsContact O-N 3.09Å; F285-R289 HydrophobicContact CB-CB 4.09Å; F285-R289 HydrophobicContact CD2-CB 3.96Å; F285-R289 VanDerWaalsContact CE1-CZ 3.42Å; F285-R289 HydrophobicContact CG-CB 4.11Å; P287-R289 PolarHBondContact O-N 3.38Å; R289-A293 HydrophobicContact CG-CB 4.27Å; R289-E294 WeakPolarHBondContact CD-OE2 3.47Å; R289-E294 HydrophobicContact CG-CB 4.47Å; R289-E294 IonicContact CZ-OE2 3.65Å; R289-E294 IonicContact NE-OE2 3.51Å; R289-E294 IonicContact NH1-OE2 2.9Å; R289-E294 PolarHBondContact NH1-OE2 2.87Å; R289-Y321 HydrophobicContact CB-CE2 3.87Å; R289-Y321 HydrophobicContact CG-CE1 4.12Å; R289-Y321 HydrophobicContact CG-CE2 4.03Å; R289-Y321 PolarHBondContact NE-OH 2.99Å
290	P	90.3	Very high	85.4	Confident	15 Å²	15	28 Å²	28	10%	0.097	15%	0.148	C	C	.	.	P	Polyproline II helix	trans	-74.9	156.5	174.8	30.3	-33	0	0	0	111.7	T292 A293 E294 Y321	P290-T292 VanDerWaalsContact C-N 3.28Å; P290-T292 PolarHBondContact O-N 3.29Å; P290-A293 HydrophobicContact CG-CB 3.75Å; P290-A293 PolarHBondContact O-N 3.32Å; P290-E294 PolarHBondContact O-N 3.36Å; P290-E294 VanDerWaalsContact O-N 3.09Å; P290-Y321 VanDerWaalsContact CD-CD2 3.4Å; P290-Y321 HydrophobicContact CG-CD2 4.41Å; P290-Y321 HydrophobicContact CG-CG 4.11Å
291	L	89.9	Confident	85.4	Confident	8 Å²	8	32.3 Å²	32.3	4%	0.042	17%	0.174	C	C	.	.	H	α-helix	trans	-61.5	-35.3	-178.5	-178.6	60.1	0	0	0	112.7	W213 I252 A255 E294 L295 L310	W213-L291 HydrophobicContact CH2-CB 4.25Å; W213-L291 HydrophobicContact CH2-CD1 4.41Å; W213-L291 HydrophobicContact CZ2-CB 4.35Å; W213-L291 HydrophobicContact CZ3-CD1 4.45Å; I252-L291 HydrophobicContact CG1-CD1 4.38Å; I252-L291 HydrophobicContact CG1-CD2 4.04Å; I252-L291 HydrophobicContact CG2-CD1 4.05Å; A255-L291 HydrophobicContact CB-CD1 4.31Å; A255-L291 HydrophobicContact CB-CD2 3.97Å; A255-L291 HydrophobicContact CB-CG 4.49Å; L291-E294 PolarHBondContact O-N 3.42Å; L291-L295 HydrophobicContact CD1-CD1 4.47Å; L291-L295 HydrophobicContact CD1-CG 4.26Å; L291-L295 HydrophobicContact CG-CD1 4.19Å; L291-L295 HydrophobicContact CG-CG 4.43Å; L291-L295 WeakPolarHBondContact O-CB 3.34Å; L291-L295 VanDerWaalsContact O-CG 3.28Å; L291-L295 WeakPolarHBondContact O-CG 3.38Å; L291-L295 PolarHBondContact O-N 3.29Å; L291-L310 HydrophobicContact CD2-CD1 3.68Å; L291-L310 HydrophobicContact CD2-CD2 4.03Å; L291-L310 HydrophobicContact CG-CD1 3.94Å
292	T	90	Very high	85.3	Confident	3 Å²	3	36.7 Å²	36.7	2%	0.018	19%	0.188	C	C	.	.	H	α-helix	trans	-59.6	-50.3	175.8	43	0	0	0	0	111.6	P290 E294 L295 A296 I307 A315 V316	P290-T292 VanDerWaalsContact C-N 3.28Å; P290-T292 PolarHBondContact O-N 3.29Å; T292-E294 PolarHBondContact O-N 3.41Å; T292-L295 PolarHBondContact O-N 3.46Å; T292-A296 WeakPolarHBondContact O-CB 3.34Å; T292-A296 PolarHBondContact O-N 3.46Å; T292-I307 HydrophobicContact CG2-CG2 4.36Å; T292-A315 HydrophobicContact CG2-CB 3.83Å; T292-V316 PolarHBondContact OG1-O 3.03Å
293	A	88.7	Confident	85.4	Confident	0 Å²	0	36.7 Å²	36.7	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-63.3	-40.4	176.6	0	0	0	0	0	112.7	R289 P290 A296 I297 E318 Y321	R289-A293 HydrophobicContact CG-CB 4.27Å; P290-A293 HydrophobicContact CG-CB 3.75Å; P290-A293 PolarHBondContact O-N 3.32Å; A293-A296 PolarHBondContact O-N 3.46Å; A293-I297 WeakPolarHBondContact O-CB 3.44Å; A293-I297 WeakPolarHBondContact O-CD1 3.39Å; A293-I297 WeakPolarHBondContact O-CG1 3.49Å; A293-I297 PolarHBondContact O-N 2.65Å; A293-E318 HydrophobicContact CB-CB 4.04Å; A293-Y321 HydrophobicContact CB-CD1 3.57Å; A293-Y321 HydrophobicContact CB-CE1 4.01Å; A293-Y321 HydrophobicContact CB-CG 4.16Å
294	E	88.3	Confident	85.7	Confident	4 Å²	4	31.9 Å²	31.9	2%	0.019	18%	0.175	C	C	.	.	H	α-helix	trans	-61.5	-45.6	176.2	-177.2	67.1	-173.7	0	0	111.7	H156 W213 M256 R289 P290 L291 T292 A296 I297 V298	H156-E294 IonicContact CE1-OE1 3.71Å; H156-E294 PolarHBondContact CE1-OE1 3.21Å; W213-E294 HydrophobicContact CH2-CB 4.3Å; W213-E294 HydrophobicContact CZ3-CB 4.1Å; W213-E294 HydrophobicContact CZ3-CG 4.13Å; M256-E294 HydrophobicContact CE-CG 4.28Å; M256-E294 HydrophobicContact SD-CG 3.96Å; R289-E294 WeakPolarHBondContact CD-OE2 3.47Å; R289-E294 HydrophobicContact CG-CB 4.47Å; R289-E294 IonicContact CZ-OE2 3.65Å; R289-E294 IonicContact NE-OE2 3.51Å; R289-E294 IonicContact NH1-OE2 2.9Å; R289-E294 PolarHBondContact NH1-OE2 2.87Å; P290-E294 PolarHBondContact O-N 3.36Å; P290-E294 VanDerWaalsContact O-N 3.09Å; L291-E294 PolarHBondContact O-N 3.42Å; T292-E294 PolarHBondContact O-N 3.41Å; E294-A296 PolarHBondContact O-N 3.27Å; E294-I297 PolarHBondContact O-N 3.38Å; E294-V298 HydrophobicContact CG-CG2 4.35Å; E294-V298 WeakPolarHBondContact O-CB 3.49Å; E294-V298 VanDerWaalsContact O-CG2 3.27Å; E294-V298 WeakPolarHBondContact O-CG2 3.4Å; E294-V298 PolarHBondContact O-N 3.19Å; E294-V298 WeakPolarHBondContact OE1-CG2 3.01Å
295	L	90.7	Very high	86.3	Confident	0 Å²	0	37.8 Å²	37.8	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-62.8	-41.3	177.5	-72.1	174.6	0	0	0	112.1	A255 M256 L291 T292 Y299 A303 A306 I307 L310	A255-L295 HydrophobicContact CB-CD1 4.25Å; A255-L295 HydrophobicContact CB-CD2 4.4Å; M256-L295 HydrophobicContact SD-CD2 4.05Å; L291-L295 HydrophobicContact CD1-CD1 4.47Å; L291-L295 HydrophobicContact CD1-CG 4.26Å; L291-L295 HydrophobicContact CG-CD1 4.19Å; L291-L295 HydrophobicContact CG-CG 4.43Å; L291-L295 WeakPolarHBondContact O-CB 3.34Å; L291-L295 VanDerWaalsContact O-CG 3.28Å; L291-L295 WeakPolarHBondContact O-CG 3.38Å; L291-L295 PolarHBondContact O-N 3.29Å; T292-L295 PolarHBondContact O-N 3.46Å; L295-Y299 HydrophobicContact CD2-CD2 3.89Å; L295-Y299 HydrophobicContact CD2-CE2 3.98Å; L295-Y299 WeakPolarHBondContact O-CB 3.25Å; L295-Y299 PolarHBondContact O-N 3.06Å; L295-A303 HydrophobicContact CB-CB 3.85Å; L295-A306 HydrophobicContact CD1-CB 4.29Å; L295-I307 HydrophobicContact CB-CD1 4.14Å; L295-I307 HydrophobicContact CB-CG1 4.02Å; L295-I307 HydrophobicContact CD1-CG1 4.1Å; L295-L310 HydrophobicContact CD1-CD1 3.6Å
296	A	88.5	Confident	87	Confident	7 Å²	7	37 Å²	37	6%	0.058	20%	0.195	C	C	.	.	H	α-helix	trans	-64.1	-45.4	176.6	0	0	0	0	0	111.9	T292 A293 E294 G300 I307	T292-A296 WeakPolarHBondContact O-CB 3.34Å; T292-A296 PolarHBondContact O-N 3.46Å; A293-A296 PolarHBondContact O-N 3.46Å; E294-A296 PolarHBondContact O-N 3.27Å; A296-G300 VanDerWaalsContact O-CA 3.23Å; A296-G300 WeakPolarHBondContact O-CA 3.24Å; A296-G300 PolarHBondContact O-N 3.12Å; A296-I307 HydrophobicContact CB-CD1 4.26Å
297	I	86.6	Confident	87.8	Confident	11 Å²	11	32.5 Å²	32.5	6%	0.056	17%	0.17	C	C	.	.	H	α-helix	trans	-65.4	-41.9	179.4	-68.7	164.7	0	0	0	111.5	Y108 A293 E294 Y321	Y108-I297 HydrophobicContact CD2-CG2 4.35Å; Y108-I297 PolarHBondContact N-O 2.81Å; Y108-I297 VanDerWaalsContact N-O 3.08Å; A293-I297 WeakPolarHBondContact O-CB 3.44Å; A293-I297 WeakPolarHBondContact O-CD1 3.39Å; A293-I297 WeakPolarHBondContact O-CG1 3.49Å; A293-I297 PolarHBondContact O-N 2.65Å; E294-I297 PolarHBondContact O-N 3.38Å; I297-Y321 HydrophobicContact CD1-CE1 4.42Å
298	V	86.8	Confident	88.3	Confident	0 Å²	0	37.3 Å²	37.3	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-81.4	-41.8	-174.4	176	0	0	0	0	112.3	Y108 S113 V116 M256 E294	Y108-V298 HydrophobicContact CD2-CG2 4.5Å; Y108-V298 HydrophobicContact CE2-CG2 4.37Å; S113-V298 WeakPolarHBondContact CB-O 3.47Å; S113-V298 PolarHBondContact OG-O 2.85Å; V116-V298 HydrophobicContact CB-CG1 4.13Å; V116-V298 HydrophobicContact CG1-CG1 3.88Å; V116-V298 HydrophobicContact CG2-CG1 4.5Å; M256-V298 HydrophobicContact CE-CG2 4.44Å; E294-V298 HydrophobicContact CG-CG2 4.35Å; E294-V298 WeakPolarHBondContact O-CB 3.49Å; E294-V298 VanDerWaalsContact O-CG2 3.27Å; E294-V298 WeakPolarHBondContact O-CG2 3.4Å; E294-V298 PolarHBondContact O-N 3.19Å; E294-V298 WeakPolarHBondContact OE1-CG2 3.01Å
299	Y	89.5	Confident	88.6	Confident	12 Å²	12	34.9 Å²	34.9	5%	0.047	17%	0.174	C	C	.	.	H	α-helix	trans	-115.9	-13.4	-170.3	-61.9	-60.5	0	0	0	114.7	W59 S113 G117 M256 L258 L295 N301 K302 A303	W59-Y299 AromaticContact CH2-CD1 3.96Å; W59-Y299 HydrophobicContact CH2-CD1 3.96Å; W59-Y299 HydrophobicContact CH2-CE1 4.11Å; S113-Y299 WeakPolarHBondContact O-CE1 3.25Å; G117-Y299 WeakPolarHBondContact CA-OH 3.19Å; G117-Y299 PolarHBondContact N-OH 3.24Å; M256-Y299 PolarHBondContact O-OH 2.81Å; M256-Y299 HydrophobicContact SD-CE2 4.38Å; L258-Y299 HydrophobicContact CD1-CD1 4.13Å; L258-Y299 HydrophobicContact CD1-CD2 4.4Å; L258-Y299 HydrophobicContact CD1-CE1 4.25Å; L258-Y299 HydrophobicContact CD1-CE2 4.49Å; L258-Y299 HydrophobicContact CD1-CG 4.22Å; L258-Y299 HydrophobicContact CD2-CD2 4.11Å; L258-Y299 HydrophobicContact CD2-CE2 4.31Å; L258-Y299 HydrophobicContact CG-CD2 4.4Å; L258-Y299 HydrophobicContact CG-CE2 4.26Å; L295-Y299 HydrophobicContact CD2-CD2 3.89Å; L295-Y299 HydrophobicContact CD2-CE2 3.98Å; L295-Y299 WeakPolarHBondContact O-CB 3.25Å; L295-Y299 PolarHBondContact O-N 3.06Å; Y299-N301 PolarHBondContact O-N 3.42Å; Y299-K302 WeakPolarHBondContact O-CB 3.47Å; Y299-K302 PolarHBondContact O-N 3.38Å; Y299-A303 HydrophobicContact CD2-CB 4.27Å; Y299-A303 HydrophobicContact CG-CB 4.46Å
300	G	84.5	Confident	88.8	Confident	22 Å²	22	34.4 Å²	34.4	23%	0.227	17%	0.173	C	C	.	.	G	3₁₀ helix	trans	50.5	-132.2	-172.5	0	0	0	0	0	111.8	A296 K302 A303	A296-G300 VanDerWaalsContact O-CA 3.23Å; A296-G300 WeakPolarHBondContact O-CA 3.24Å; A296-G300 PolarHBondContact O-N 3.12Å; G300-K302 PolarHBondContact O-N 3.07Å; G300-A303 PolarHBondContact O-N 2.75Å
301	N	84.6	Confident	88.7	Confident	140 Å²	140	37.9 Å²	37.9	75%	0.749	19%	0.186	S	C	*	.	G	3₁₀ helix	trans	-56.8	-23.8	-177.3	-65.2	-23.2	0	0	0	114.5	Y299 A303 N304	Y299-N301 PolarHBondContact O-N 3.42Å; N301-A303 PolarHBondContact O-N 3.31Å; N301-N304 VanDerWaalsContact O-CG 3.25Å; N301-N304 PolarHBondContact O-N 3.47Å; N301-N304 PolarHBondContact O-ND2 2.92Å
302	K	86.5	Confident	88.6	Confident	135 Å²	135	44.2 Å²	44.2	59%	0.587	22%	0.217	S	C	*	.	G	3₁₀ helix	trans	-66.3	-24.9	179.1	-77.6	-74.3	-171.8	172.3	0	112.9	W59 Y299 G300	W59-K302 HydrophobicContact CZ2-CG 4.36Å; Y299-K302 WeakPolarHBondContact O-CB 3.47Å; Y299-K302 PolarHBondContact O-N 3.38Å; G300-K302 PolarHBondContact O-N 3.07Å
303	A	88.8	Confident	88.4	Confident	0 Å²	0	49.4 Å²	49.4	0%	0	24%	0.237	C	C	.	.	G	3₁₀ helix	trans	-89.6	-0.7	178.9	0	0	0	0	0	114.4	L258 L295 Y299 G300 N301 K305 A306 I307	L258-A303 HydrophobicContact CD2-CB 4.22Å; L295-A303 HydrophobicContact CB-CB 3.85Å; Y299-A303 HydrophobicContact CD2-CB 4.27Å; Y299-A303 HydrophobicContact CG-CB 4.46Å; G300-A303 PolarHBondContact O-N 2.75Å; N301-A303 PolarHBondContact O-N 3.31Å; A303-K305 VanDerWaalsContact C-N 3.3Å; A303-K305 PolarHBondContact O-N 3.16Å; A303-K305 VanDerWaalsContact O-N 3.16Å; A303-A306 CarbonylContact O-C 3.6Å; A303-A306 WeakPolarHBondContact O-CA 3.31Å; A303-A306 WeakPolarHBondContact O-CB 3.31Å; A303-A306 PolarHBondContact O-N 3.42Å; A303-I307 HydrophobicContact CB-CD1 4.03Å; A303-I307 HydrophobicContact CB-CG1 4.26Å; A303-I307 WeakPolarHBondContact O-CG1 3.43Å; A303-I307 PolarHBondContact O-N 2.9Å
304	N	89.2	Confident	88.3	Confident	72 Å²	72	51.5 Å²	51.5	39%	0.385	26%	0.259	S	S	.	.	H	α-helix	trans	-51.9	-45.2	-173.9	-72.7	-3.4	0	0	0	113.2	N301 A306 I307 E308	N301-N304 VanDerWaalsContact O-CG 3.25Å; N301-N304 PolarHBondContact O-N 3.47Å; N301-N304 PolarHBondContact O-ND2 2.92Å; N304-A306 VanDerWaalsContact C-N 3.33Å; N304-A306 PolarHBondContact O-N 3.02Å; N304-I307 PolarHBondContact O-N 2.99Å; N304-E308 WeakPolarHBondContact O-CB 3.2Å; N304-E308 VanDerWaalsContact O-CG 3.28Å; N304-E308 WeakPolarHBondContact O-CG 3.23Å; N304-E308 PolarHBondContact O-N 3.17Å
305	K	90.3	Very high	88.1	Confident	149 Å²	149	52 Å²	52	65%	0.648	26%	0.264	S	S	*	.	H	α-helix	trans	-61.9	-39.4	176.8	-66.9	-175.7	178	-177.1	0	112.9	L260 A303 L309	L260-K305 HydrophobicContact CD1-CB 3.86Å; L260-K305 HydrophobicContact CD1-CD 4Å; L260-K305 HydrophobicContact CD2-CB 4.22Å; A303-K305 VanDerWaalsContact C-N 3.3Å; A303-K305 PolarHBondContact O-N 3.16Å; A303-K305 VanDerWaalsContact O-N 3.16Å; K305-L309 WeakPolarHBondContact O-CB 3.48Å; K305-L309 PolarHBondContact O-N 3.09Å
306	A	90.9	Very high	87.6	Confident	1 Å²	1	55.3 Å²	55.3	1%	0.008	28%	0.284	C	S	.	.	H	α-helix	trans	-70	-40.4	177.6	0	0	0	0	0	111.1	L258 L260 M263 L295 A303 N304 L309 L310	L258-A306 HydrophobicContact CD2-CB 4.3Å; L260-A306 HydrophobicContact CD2-CB 3.83Å; M263-A306 HydrophobicContact CE-CB 3.99Å; M263-A306 HydrophobicContact SD-CB 4.01Å; L295-A306 HydrophobicContact CD1-CB 4.29Å; A303-A306 CarbonylContact O-C 3.6Å; A303-A306 WeakPolarHBondContact O-CA 3.31Å; A303-A306 WeakPolarHBondContact O-CB 3.31Å; A303-A306 PolarHBondContact O-N 3.42Å; N304-A306 VanDerWaalsContact C-N 3.33Å; N304-A306 PolarHBondContact O-N 3.02Å; A306-L309 PolarHBondContact O-N 2.82Å; A306-L310 VanDerWaalsContact O-CG 3.27Å; A306-L310 WeakPolarHBondContact O-CG 3.34Å; A306-L310 PolarHBondContact O-N 3.46Å
307	I	89.9	Confident	87.2	Confident	11 Å²	11	58.1 Å²	58.1	6%	0.056	30%	0.298	C	S	.	.	H	α-helix	trans	-66.1	-44.7	176.5	-65.8	170.1	0	0	0	110.7	T292 L295 A296 A303 N304 L309 L310 K311	T292-I307 HydrophobicContact CG2-CG2 4.36Å; L295-I307 HydrophobicContact CB-CD1 4.14Å; L295-I307 HydrophobicContact CB-CG1 4.02Å; L295-I307 HydrophobicContact CD1-CG1 4.1Å; A296-I307 HydrophobicContact CB-CD1 4.26Å; A303-I307 HydrophobicContact CB-CD1 4.03Å; A303-I307 HydrophobicContact CB-CG1 4.26Å; A303-I307 WeakPolarHBondContact O-CG1 3.43Å; A303-I307 PolarHBondContact O-N 2.9Å; N304-I307 PolarHBondContact O-N 2.99Å; I307-L309 VanDerWaalsContact C-N 3.34Å; I307-L309 PolarHBondContact O-N 3.48Å; I307-L310 PolarHBondContact O-N 2.89Å; I307-K311 HydrophobicContact CG2-CD 4Å; I307-K311 HydrophobicContact CG2-CG 4.35Å; I307-K311 WeakPolarHBondContact O-CB 3.26Å; I307-K311 WeakPolarHBondContact O-CG 3.44Å; I307-K311 PolarHBondContact O-N 3.02Å
308	E	89.7	Confident	87	Confident	120 Å²	120	59.7 Å²	59.7	56%	0.561	31%	0.305	S	S	*	.	H	α-helix	trans	-58.7	-45.3	174.5	-76.6	170.6	-173.5	0	0	111.2	N304 L310 K311 M312	N304-E308 WeakPolarHBondContact O-CB 3.2Å; N304-E308 VanDerWaalsContact O-CG 3.28Å; N304-E308 WeakPolarHBondContact O-CG 3.23Å; N304-E308 PolarHBondContact O-N 3.17Å; E308-L310 PolarHBondContact O-N 3.3Å; E308-K311 PolarHBondContact O-N 2.77Å; E308-M312 WeakPolarHBondContact O-CG 3.27Å; E308-M312 PolarHBondContact O-N 2.93Å
309	L	90.7	Very high	86.8	Confident	12 Å²	12	62.6 Å²	62.6	6%	0.063	33%	0.326	C	S	.	.	H	α-helix	trans	-59.1	-46.7	174.8	-166	83.9	0	0	0	111.6	M263 E264 L267 K305 A306 I307 K311 M312 Y313	M263-L309 HydrophobicContact CB-CD2 3.6Å; M263-L309 HydrophobicContact CE-CD2 4.12Å; E264-L309 HydrophobicContact CG-CD1 3.6Å; E264-L309 HydrophobicContact CG-CD2 3.8Å; E264-L309 HydrophobicContact CG-CG 4.34Å; L267-L309 HydrophobicContact CD1-CD2 3.72Å; L267-L309 HydrophobicContact CD1-CG 3.95Å; K305-L309 WeakPolarHBondContact O-CB 3.48Å; K305-L309 PolarHBondContact O-N 3.09Å; A306-L309 PolarHBondContact O-N 2.82Å; I307-L309 VanDerWaalsContact C-N 3.34Å; I307-L309 PolarHBondContact O-N 3.48Å; L309-K311 PolarHBondContact O-N 3.01Å; L309-M312 HydrophobicContact CB-CE 4.47Å; L309-M312 HydrophobicContact CD1-CE 3.76Å; L309-M312 PolarHBondContact O-N 3.22Å; L309-Y313 WeakPolarHBondContact O-CD2 2.96Å; L309-Y313 PolarHBondContact O-N 3.14Å
310	L	90.4	Very high	86.5	Confident	1 Å²	1	64.4 Å²	64.4	1%	0.005	34%	0.34	C	S	.	.	H	α-helix	trans	-63.1	-42.1	177.4	-71.5	168	0	0	0	111.9	L251 M263 L267 V278 L291 L295 A306 I307 E308 Y313 G314 A315	L251-L310 HydrophobicContact CD2-CD2 4.3Å; M263-L310 HydrophobicContact CE-CD1 4.07Å; M263-L310 HydrophobicContact CE-CD2 3.99Å; M263-L310 HydrophobicContact CE-CG 3.75Å; L267-L310 HydrophobicContact CD1-CD2 4.5Å; V278-L310 HydrophobicContact CG1-CB 4.47Å; V278-L310 HydrophobicContact CG1-CD2 3.93Å; L291-L310 HydrophobicContact CD2-CD1 3.68Å; L291-L310 HydrophobicContact CD2-CD2 4.03Å; L291-L310 HydrophobicContact CG-CD1 3.94Å; L295-L310 HydrophobicContact CD1-CD1 3.6Å; A306-L310 VanDerWaalsContact O-CG 3.27Å; A306-L310 WeakPolarHBondContact O-CG 3.34Å; A306-L310 PolarHBondContact O-N 3.46Å; I307-L310 PolarHBondContact O-N 2.89Å; E308-L310 PolarHBondContact O-N 3.3Å; L310-Y313 CarbonylContact O-C 3.51Å; L310-Y313 PolarHBondContact O-N 2.82Å; L310-Y313 VanDerWaalsContact O-N 3.15Å; L310-G314 PolarHBondContact O-N 2.97Å; L310-A315 VanDerWaalsContact C-CB 3.43Å; L310-A315 HydrophobicContact CB-CB 3.79Å; L310-A315 WeakPolarHBondContact O-CB 3.28Å; L310-A315 PolarHBondContact O-N 3.34Å
311	K	88.2	Confident	86.5	Confident	88 Å²	88	64 Å²	64	38%	0.383	33%	0.332	S	S	.	.	H	α-helix	trans	-62.6	-41	177.3	-76.4	180	174.3	-173.4	0	111.8	I307 E308 L309 Y313 G314 D317	I307-K311 HydrophobicContact CG2-CD 4Å; I307-K311 HydrophobicContact CG2-CG 4.35Å; I307-K311 WeakPolarHBondContact O-CB 3.26Å; I307-K311 WeakPolarHBondContact O-CG 3.44Å; I307-K311 PolarHBondContact O-N 3.02Å; E308-K311 PolarHBondContact O-N 2.77Å; L309-K311 PolarHBondContact O-N 3.01Å; K311-Y313 PolarHBondContact O-N 3.02Å; K311-G314 PolarHBondContact O-N 3.29Å; K311-D317 WeakPolarHBondContact CE-OD1 3.25Å; K311-D317 IonicContact NZ-OD1 3.73Å; K311-D317 PolarHBondContact NZ-OD1 3.11Å
312	M	88.2	Confident	86.5	Confident	141 Å²	141	61.5 Å²	61.5	70%	0.695	31%	0.312	S	S	*	.	H	α-helix	trans	-58.1	-29.3	174.7	-74.7	-167.9	-65.6	0	0	113.1	E308 L309	E308-M312 WeakPolarHBondContact O-CG 3.27Å; E308-M312 PolarHBondContact O-N 2.93Å; L309-M312 HydrophobicContact CB-CE 4.47Å; L309-M312 HydrophobicContact CD1-CE 3.76Å; L309-M312 PolarHBondContact O-N 3.22Å
313	Y	86.6	Confident	86.4	Confident	111 Å²	111	61.2 Å²	61.2	44%	0.435	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.6	14.9	178.2	-74.6	-97.1	0	0	0	113.8	L267 L309 L310 K311	L267-Y313 HydrophobicContact CB-CD1 3.94Å; L267-Y313 HydrophobicContact CB-CD2 4.15Å; L267-Y313 HydrophobicContact CB-CE1 3.93Å; L267-Y313 HydrophobicContact CB-CE2 4.14Å; L267-Y313 HydrophobicContact CB-CG 4.04Å; L267-Y313 HydrophobicContact CD1-CD2 3.98Å; L267-Y313 HydrophobicContact CD1-CE2 4.43Å; L267-Y313 HydrophobicContact CD1-CG 4.26Å; L267-Y313 HydrophobicContact CD2-CD1 4.48Å; L267-Y313 HydrophobicContact CD2-CG 4.18Å; L267-Y313 HydrophobicContact CG-CG 4.39Å; L267-Y313 VanDerWaalsContact O-CE1 3.27Å; L267-Y313 WeakPolarHBondContact O-CE1 3.37Å; L309-Y313 WeakPolarHBondContact O-CD2 2.96Å; L309-Y313 PolarHBondContact O-N 3.14Å; L310-Y313 CarbonylContact O-C 3.51Å; L310-Y313 PolarHBondContact O-N 2.82Å; L310-Y313 VanDerWaalsContact O-N 3.15Å; K311-Y313 PolarHBondContact O-N 3.02Å
314	G	84.9	Confident	86.1	Confident	45 Å²	45	63.5 Å²	63.5	46%	0.464	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	94.8	22.5	169.9	0	0	0	0	0	116.1	N279 L310 K311	N279-G314 PolarHBondContact ND2-O 2.86Å; N279-G314 PolarHBondContact OD1-O 3.48Å; L310-G314 PolarHBondContact O-N 2.97Å; K311-G314 PolarHBondContact O-N 3.29Å
315	A	85	Confident	85.8	Confident	14 Å²	14	61.1 Å²	61.1	12%	0.116	32%	0.317	C	S	.	.	P	Polyproline II helix	trans	-65.2	136.6	171.2	0	0	0	0	0	112.2	V278 N279 T292 L310	V278-A315 HydrophobicContact CG1-CB 3.6Å; N279-A315 VanDerWaalsContact OD1-CA 3.27Å; N279-A315 WeakPolarHBondContact OD1-CA 3.42Å; T292-A315 HydrophobicContact CG2-CB 3.83Å; L310-A315 VanDerWaalsContact C-CB 3.43Å; L310-A315 HydrophobicContact CB-CB 3.79Å; L310-A315 WeakPolarHBondContact O-CB 3.28Å; L310-A315 PolarHBondContact O-N 3.34Å
316	V	80.8	Confident	85.4	Confident	70 Å²	70	58 Å²	58	42%	0.424	31%	0.305	S	S	.	.	P	Polyproline II helix	trans	-68.3	143.4	173.8	-177.5	0	0	0	0	110.8	N279 T292	N279-V316 PolarHBondContact OD1-N 3.31Å; T292-V316 PolarHBondContact OG1-O 3.03Å
317	D	79.4	Confident	85.1	Confident	65 Å²	65	64.3 Å²	64.3	35%	0.348	33%	0.334	S	S	.	.	P	Polyproline II helix	trans	-69.8	147.8	174	-169.4	55.1	0	0	0	112.3	K311 S319 S320	K311-D317 WeakPolarHBondContact CE-OD1 3.25Å; K311-D317 IonicContact NZ-OD1 3.73Å; K311-D317 PolarHBondContact NZ-OD1 3.11Å; D317-S319 VanDerWaalsContact C-N 3.26Å; D317-S319 PolarHBondContact O-N 3.37Å; D317-S319 WeakPolarHBondContact OD2-CB 3.49Å; D317-S319 PolarHBondContact OD2-N 3.09Å; D317-S319 PolarHBondContact OD2-OG 3.1Å; D317-S320 PolarHBondContact O-OG 3.45Å
318	E	82.1	Confident	84.7	Confident	45 Å²	45	66.8 Å²	66.8	21%	0.21	34%	0.343	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.2	-17.5	-175.6	54.6	-151.9	-142.3	0	0	114.5	A293 S320 Y321 Y322	A293-E318 HydrophobicContact CB-CB 4.04Å; E318-S320 PolarHBondContact O-N 3.19Å; E318-Y321 WeakPolarHBondContact O-CB 3.29Å; E318-Y321 PolarHBondContact O-N 3.03Å; E318-Y322 HydrophobicContact CB-CD2 4.25Å; E318-Y322 HydrophobicContact CB-CE2 3.79Å; E318-Y322 HydrophobicContact CG-CD2 4.43Å; E318-Y322 HydrophobicContact CG-CE2 3.86Å; E318-Y322 WeakPolarHBondContact O-CD2 3.49Å; E318-Y322 PolarHBondContact O-N 3.41Å; E318-Y322 VanDerWaalsContact O-N 3.13Å
319	S	83.5	Confident	84.2	Confident	61 Å²	61	65.2 Å²	65.2	43%	0.427	33%	0.334	S	S	.	.	H	α-helix	trans	-49.9	-51	176.5	43.9	0	0	0	0	113.4	D317 Y321 Y322 E323	D317-S319 VanDerWaalsContact C-N 3.26Å; D317-S319 PolarHBondContact O-N 3.37Å; D317-S319 WeakPolarHBondContact OD2-CB 3.49Å; D317-S319 PolarHBondContact OD2-N 3.09Å; D317-S319 PolarHBondContact OD2-OG 3.1Å; S319-Y321 PolarHBondContact O-N 3.37Å; S319-Y322 PolarHBondContact O-N 3.1Å; S319-E323 PolarHBondContact O-N 3.29Å
320	S	81.9	Confident	84	Confident	50 Å²	50	66.9 Å²	66.9	35%	0.35	34%	0.342	S	S	.	.	H	α-helix	trans	-59.9	-31.4	178.1	66.3	0	0	0	0	114	D317 E318 S324	D317-S320 PolarHBondContact O-OG 3.45Å; E318-S320 PolarHBondContact O-N 3.19Å; S320-S324 WeakPolarHBondContact O-CB 3.47Å; S320-S324 PolarHBondContact O-N 3.44Å; S320-S324 VanDerWaalsContact O-N 3.1Å; S320-S324 PolarHBondContact O-OG 3.08Å
321	Y	84.7	Confident	83.8	Confident	14 Å²	14	67.9 Å²	67.9	6%	0.055	35%	0.351	C	S	.	.	H	α-helix	trans	-72	-46	176.5	169.3	-105.3	0	0	0	110.8	P287 R289 P290 A293 I297 E318 S319 E323 S324 V325	P287-Y321 HydrophobicContact CG-CD2 4.36Å; P287-Y321 HydrophobicContact CG-CE2 3.98Å; R289-Y321 HydrophobicContact CB-CE2 3.87Å; R289-Y321 HydrophobicContact CG-CE1 4.12Å; R289-Y321 HydrophobicContact CG-CE2 4.03Å; R289-Y321 PolarHBondContact NE-OH 2.99Å; P290-Y321 VanDerWaalsContact CD-CD2 3.4Å; P290-Y321 HydrophobicContact CG-CD2 4.41Å; P290-Y321 HydrophobicContact CG-CG 4.11Å; A293-Y321 HydrophobicContact CB-CD1 3.57Å; A293-Y321 HydrophobicContact CB-CE1 4.01Å; A293-Y321 HydrophobicContact CB-CG 4.16Å; I297-Y321 HydrophobicContact CD1-CE1 4.42Å; E318-Y321 WeakPolarHBondContact O-CB 3.29Å; E318-Y321 PolarHBondContact O-N 3.03Å; S319-Y321 PolarHBondContact O-N 3.37Å; Y321-E323 VanDerWaalsContact C-N 3.32Å; Y321-E323 PolarHBondContact O-N 2.51Å; Y321-S324 CarbonylContact O-C 2.9Å; Y321-S324 WeakPolarHBondContact O-CA 3.1Å; Y321-S324 WeakPolarHBondContact O-CB 3.3Å; Y321-S324 PolarHBondContact O-N 2.99Å; Y321-S324 VanDerWaalsContact O-N 3.1Å; Y321-V325 HydrophobicContact CD1-CG2 4.19Å; Y321-V325 HydrophobicContact CD2-CG2 4.18Å; Y321-V325 HydrophobicContact CE1-CG2 3.74Å; Y321-V325 HydrophobicContact CE2-CG2 3.72Å; Y321-V325 HydrophobicContact CG-CG2 4.4Å; Y321-V325 VanDerWaalsContact CZ-CG2 3.47Å; Y321-V325 WeakPolarHBondContact O-CG2 3.38Å; Y321-V325 PolarHBondContact O-N 3.34Å
322	Y	84.2	Confident	83.9	Confident	87 Å²	87	63.8 Å²	63.8	34%	0.341	33%	0.333	S	S	.	.	H	α-helix	trans	-62.9	-38.3	177.4	-67.3	-62.1	0	0	0	112.2	E318 S319 S324 V325 E326	E318-Y322 HydrophobicContact CB-CD2 4.25Å; E318-Y322 HydrophobicContact CB-CE2 3.79Å; E318-Y322 HydrophobicContact CG-CD2 4.43Å; E318-Y322 HydrophobicContact CG-CE2 3.86Å; E318-Y322 WeakPolarHBondContact O-CD2 3.49Å; E318-Y322 PolarHBondContact O-N 3.41Å; E318-Y322 VanDerWaalsContact O-N 3.13Å; S319-Y322 PolarHBondContact O-N 3.1Å; Y322-S324 PolarHBondContact O-N 2.87Å; Y322-V325 PolarHBondContact O-N 3.06Å; Y322-E326 PolarHBondContact O-N 2.92Å
323	E	84.3	Confident	83.9	Confident	128 Å²	128	59.2 Å²	59.2	60%	0.598	31%	0.311	S	S	*	.	H	α-helix	trans	-59.3	-45.7	170.4	-71.6	178.5	-177.3	0	0	111.8	S319 Y321 V325 E326 Q327	S319-E323 PolarHBondContact O-N 3.29Å; Y321-E323 VanDerWaalsContact C-N 3.32Å; Y321-E323 PolarHBondContact O-N 2.51Å; E323-V325 VanDerWaalsContact C-N 3.33Å; E323-V325 PolarHBondContact O-N 3.4Å; E323-E326 PolarHBondContact O-N 3.32Å; E323-Q327 VanDerWaalsContact O-CG 3.31Å; E323-Q327 WeakPolarHBondContact O-CG 3.22Å; E323-Q327 PolarHBondContact O-N 3.36Å
324	S	83.7	Confident	84.1	Confident	48 Å²	48	58.9 Å²	58.9	34%	0.336	32%	0.317	S	S	.	.	H	α-helix	trans	-63.6	-36.8	177.4	-59.9	0	0	0	0	112.5	S320 Y321 Y322 R328	S320-S324 WeakPolarHBondContact O-CB 3.47Å; S320-S324 PolarHBondContact O-N 3.44Å; S320-S324 VanDerWaalsContact O-N 3.1Å; S320-S324 PolarHBondContact O-OG 3.08Å; Y321-S324 CarbonylContact O-C 2.9Å; Y321-S324 WeakPolarHBondContact O-CA 3.1Å; Y321-S324 WeakPolarHBondContact O-CB 3.3Å; Y321-S324 PolarHBondContact O-N 2.99Å; Y321-S324 VanDerWaalsContact O-N 3.1Å; Y322-S324 PolarHBondContact O-N 2.87Å; S324-R328 WeakPolarHBondContact O-CB 3.5Å; S324-R328 PolarHBondContact O-N 3.27Å
325	V	82	Confident	84.4	Confident	22 Å²	22	57.2 Å²	57.2	13%	0.133	30%	0.297	C	S	.	.	H	α-helix	trans	-65.1	-45.4	175.9	170.2	0	0	0	0	110.5	P287 Y321 Y322 E323 R328 K329	P287-V325 HydrophobicContact CG-CB 4.43Å; P287-V325 HydrophobicContact CG-CG2 3.66Å; Y321-V325 HydrophobicContact CD1-CG2 4.19Å; Y321-V325 HydrophobicContact CD2-CG2 4.18Å; Y321-V325 HydrophobicContact CE1-CG2 3.74Å; Y321-V325 HydrophobicContact CE2-CG2 3.72Å; Y321-V325 HydrophobicContact CG-CG2 4.4Å; Y321-V325 VanDerWaalsContact CZ-CG2 3.47Å; Y321-V325 WeakPolarHBondContact O-CG2 3.38Å; Y321-V325 PolarHBondContact O-N 3.34Å; Y322-V325 PolarHBondContact O-N 3.06Å; E323-V325 VanDerWaalsContact C-N 3.33Å; E323-V325 PolarHBondContact O-N 3.4Å; V325-R328 PolarHBondContact O-N 3.5Å; V325-K329 WeakPolarHBondContact O-CB 3.49Å; V325-K329 PolarHBondContact O-N 3.46Å
326	E	82.1	Confident	84.7	Confident	84 Å²	84	60.7 Å²	60.7	39%	0.393	32%	0.319	S	S	.	.	H	α-helix	trans	-67.4	-39.8	178.7	-164.9	59.2	-152.7	0	0	111.4	Y322 E323 R328 K329 M330	Y322-E326 PolarHBondContact O-N 2.92Å; E323-E326 PolarHBondContact O-N 3.32Å; E326-R328 VanDerWaalsContact C-N 3.33Å; E326-R328 PolarHBondContact O-N 3.1Å; E326-K329 PolarHBondContact O-N 3.23Å; E326-K329 IonicContact OE1-NZ 3.28Å; E326-K329 PolarHBondContact OE1-NZ 3.46Å; E326-K329 WeakPolarHBondContact OE2-CD 3.28Å; E326-K329 IonicContact OE2-NZ 3.26Å; E326-K329 PolarHBondContact OE2-NZ 3Å; E326-M330 WeakPolarHBondContact O-CG 2.94Å; E326-M330 PolarHBondContact O-N 3.23Å; E326-M330 WeakPolarHBondContact OE1-CE 3.38Å
327	Q	84	Confident	85.3	Confident	133 Å²	133	57.5 Å²	57.5	62%	0.621	30%	0.3	S	S	*	.	H	α-helix	trans	-58.4	-44	170.9	-73.3	177.1	10.8	0	0	111.8	E323 M330 A331	E323-Q327 VanDerWaalsContact O-CG 3.31Å; E323-Q327 WeakPolarHBondContact O-CG 3.22Å; E323-Q327 PolarHBondContact O-N 3.36Å; Q327-M330 CarbonylContact O-C 3.55Å; Q327-M330 PolarHBondContact O-N 2.86Å; Q327-A331 PolarHBondContact O-N 3.11Å
328	R	81.6	Confident	86	Confident	64 Å²	64	55.6 Å²	55.6	24%	0.242	29%	0.288	C	S	.	.	H	α-helix	trans	-65.6	-41.4	179.2	-173.2	59.6	173.5	162.7	1	112.1	D286 S324 V325 E326 M330 A331	D286-R328 IonicContact OD1-NE 2.67Å; D286-R328 PolarHBondContact OD1-NE 3.29Å; D286-R328 IonicContact OD2-CZ 3.49Å; D286-R328 IonicContact OD2-NE 3.99Å; D286-R328 PolarHBondContact OD2-NE 3.23Å; D286-R328 IonicContact OD2-NH2 3.33Å; D286-R328 PolarHBondContact OD2-NH2 3.36Å; S324-R328 WeakPolarHBondContact O-CB 3.5Å; S324-R328 PolarHBondContact O-N 3.27Å; V325-R328 PolarHBondContact O-N 3.5Å; E326-R328 VanDerWaalsContact C-N 3.33Å; E326-R328 PolarHBondContact O-N 3.1Å; R328-M330 VanDerWaalsContact C-N 3.3Å; R328-M330 PolarHBondContact O-N 3.01Å; R328-A331 WeakPolarHBondContact O-CB 3.48Å; R328-A331 PolarHBondContact O-N 3.36Å
329	K	80.3	Confident	86.5	Confident	87 Å²	87	57.2 Å²	57.2	38%	0.378	30%	0.297	S	S	.	.	H	α-helix	trans	-62.5	-36.8	175.4	-175.9	-175.4	167.2	-157.2	0	112	V325 E326 H369	V325-K329 WeakPolarHBondContact O-CB 3.49Å; V325-K329 PolarHBondContact O-N 3.46Å; E326-K329 PolarHBondContact O-N 3.23Å; E326-K329 IonicContact OE1-NZ 3.28Å; E326-K329 PolarHBondContact OE1-NZ 3.46Å; E326-K329 WeakPolarHBondContact OE2-CD 3.28Å; E326-K329 IonicContact OE2-NZ 3.26Å; E326-K329 PolarHBondContact OE2-NZ 3Å; K329-H369 HydrophobicContact CG-CB 3.6Å; K329-H369 WeakPolarHBondContact O-CB 3.34Å; K329-H369 PolarHBondContact O-ND1 3.02Å
330	M	85.7	Confident	86.9	Confident	46 Å²	46	56.3 Å²	56.3	23%	0.227	29%	0.286	C	S	.	.	H	α-helix	trans	-87.3	-7.4	177.1	-62.5	-57	157	0	0	114.1	E326 Q327 R328 F332 I333 N334 H369	E326-M330 WeakPolarHBondContact O-CG 2.94Å; E326-M330 PolarHBondContact O-N 3.23Å; E326-M330 WeakPolarHBondContact OE1-CE 3.38Å; Q327-M330 CarbonylContact O-C 3.55Å; Q327-M330 PolarHBondContact O-N 2.86Å; R328-M330 VanDerWaalsContact C-N 3.3Å; R328-M330 PolarHBondContact O-N 3.01Å; M330-F332 VanDerWaalsContact C-N 3.26Å; M330-F332 PolarHBondContact O-N 3.11Å; M330-F332 VanDerWaalsContact O-N 3.12Å; M330-I333 PolarHBondContact O-N 3.26Å; M330-N334 WeakPolarHBondContact O-CB 3.38Å; M330-N334 PolarHBondContact O-N 3.49Å; M330-H369 VanDerWaalsContact SD-CE1 3.57Å
331	A	87.2	Confident	87.5	Confident	23 Å²	23	54 Å²	54	19%	0.19	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.3	-34.6	-173.6	0	0	0	0	0	114.2	Q327 R328 S335 L366	Q327-A331 PolarHBondContact O-N 3.11Å; R328-A331 WeakPolarHBondContact O-CB 3.48Å; R328-A331 PolarHBondContact O-N 3.36Å; A331-S335 WeakPolarHBondContact O-CB 3.44Å; A331-S335 PolarHBondContact O-N 3.35Å; A331-L366 HydrophobicContact CB-CD1 4.5Å; A331-L366 HydrophobicContact CB-CD2 3.84Å
332	F	89.3	Confident	87.8	Confident	1 Å²	1	58.8 Å²	58.8	0%	0.004	29%	0.291	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.1	-48.7	176.7	-177	-84.5	0	0	0	112.1	M330 S335 Y338 L366 R367 R368 Y375	M330-F332 VanDerWaalsContact C-N 3.26Å; M330-F332 PolarHBondContact O-N 3.11Å; M330-F332 VanDerWaalsContact O-N 3.12Å; F332-S335 VanDerWaalsContact O-CB 3.31Å; F332-S335 WeakPolarHBondContact O-CB 3.45Å; F332-S335 PolarHBondContact O-N 3Å; F332-S335 PolarHBondContact O-OG 3.48Å; F332-Y338 HydrophobicContact CD1-CD2 4.07Å; F332-Y338 HydrophobicContact CD1-CE2 4.48Å; F332-Y338 HydrophobicContact CD1-CG 4.47Å; F332-Y338 AromaticContact CE1-CD2 3.47Å; F332-Y338 HydrophobicContact CE1-CD2 3.47Å; F332-Y338 VanDerWaalsContact CE1-CD2 3.47Å; F332-Y338 AromaticContact CE1-CE2 3.86Å; F332-Y338 HydrophobicContact CE1-CE2 3.86Å; F332-Y338 HydrophobicContact CE1-CG 4.26Å; F332-Y338 HydrophobicContact CZ-CD2 4.27Å; F332-Y338 VanDerWaalsContact O-CB 3.26Å; F332-Y338 WeakPolarHBondContact O-CB 3.22Å; F332-L366 HydrophobicContact CB-CB 4.49Å; F332-L366 HydrophobicContact CD2-CB 4.02Å; F332-R367 WeakPolarHBondContact CB-O 3.28Å; F332-R368 HydrophobicContact CD1-CB 3.76Å; F332-R368 HydrophobicContact CD1-CG 4.11Å; F332-R368 HydrophobicContact CE1-CB 3.85Å; F332-R368 HydrophobicContact CE1-CG 4.26Å; F332-R368 HydrophobicContact CG-CB 4.12Å; F332-R368 HydrophobicContact CZ-CB 4.29Å; F332-Y375 HydrophobicContact CD2-CD1 4.07Å; F332-Y375 AromaticContact CD2-CE1 3.62Å; F332-Y375 HydrophobicContact CD2-CE1 3.62Å; F332-Y375 AromaticContact CD2-CZ 3.89Å; F332-Y375 HydrophobicContact CE1-CD1 4.47Å; F332-Y375 HydrophobicContact CE1-CE1 4.37Å; F332-Y375 AromaticContact CE2-CD1 3.25Å; F332-Y375 HydrophobicContact CE2-CD1 3.25Å; F332-Y375 HydrophobicContact CE2-CD2 4.37Å; F332-Y375 AromaticContact CE2-CE1 3.28Å; F332-Y375 HydrophobicContact CE2-CE1 3.28Å; F332-Y375 HydrophobicContact CE2-CE2 4.41Å; F332-Y375 AromaticContact CE2-CG 3.82Å; F332-Y375 HydrophobicContact CE2-CG 3.82Å; F332-Y375 AromaticContact CE2-CZ 3.9Å; F332-Y375 HydrophobicContact CG-CE1 4.31Å; F332-Y375 AromaticContact CZ-CD1 3.5Å; F332-Y375 HydrophobicContact CZ-CD1 3.5Å; F332-Y375 VanDerWaalsContact CZ-CD1 3.5Å; F332-Y375 AromaticContact CZ-CE1 3.71Å; F332-Y375 HydrophobicContact CZ-CE1 3.71Å; F332-Y375 HydrophobicContact CZ-CG 4.34Å
333	I	89.3	Confident	88.2	Confident	45 Å²	45	58.8 Å²	58.8	23%	0.231	30%	0.3	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.3	-34.3	-176.5	-62.3	178.4	0	0	0	110.5	M330 S335 Y338 L339 H369	M330-I333 PolarHBondContact O-N 3.26Å; I333-S335 PolarHBondContact O-N 2.65Å; I333-Y338 HydrophobicContact CB-CE1 4.38Å; I333-Y338 HydrophobicContact CG2-CD1 4.33Å; I333-Y338 HydrophobicContact CG2-CE1 3.9Å; I333-Y338 WeakPolarHBondContact O-CD1 3.32Å; I333-L339 WeakPolarHBondContact O-CD2 3.43Å; I333-H369 VanDerWaalsContact CD1-CE1 3.4Å; I333-H369 WeakPolarHBondContact CD1-CE1 3.47Å
334	N	89.7	Confident	88.5	Confident	105 Å²	105	52.9 Å²	52.9	56%	0.561	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.2	-2.7	175.4	-65.3	-10.4	0	0	0	112.6	M330	M330-N334 WeakPolarHBondContact O-CB 3.38Å; M330-N334 PolarHBondContact O-N 3.49Å
335	S	91.4	Very high	88.7	Confident	9 Å²	9	58.6 Å²	58.6	6%	0.063	29%	0.292	C	S	.	.			trans	-64.9	135.8	179.4	72.8	0	0	0	0	110.4	A331 F332 I333 F337 Y338 L339 Y375	A331-S335 WeakPolarHBondContact O-CB 3.44Å; A331-S335 PolarHBondContact O-N 3.35Å; F332-S335 VanDerWaalsContact O-CB 3.31Å; F332-S335 WeakPolarHBondContact O-CB 3.45Å; F332-S335 PolarHBondContact O-N 3Å; F332-S335 PolarHBondContact O-OG 3.48Å; I333-S335 PolarHBondContact O-N 2.65Å; S335-F337 PolarHBondContact O-N 2.72Å; S335-F337 VanDerWaalsContact O-N 3.15Å; S335-Y338 PolarHBondContact O-N 3.1Å; S335-Y338 VanDerWaalsContact O-N 3.15Å; S335-Y338 WeakPolarHBondContact OG-CB 3.49Å; S335-Y338 PolarHBondContact OG-N 2.65Å; S335-Y338 VanDerWaalsContact OG-N 3.1Å; S335-L339 PolarHBondContact O-N 2.85Å; S335-L339 VanDerWaalsContact O-N 3.11Å; S335-Y375 VanDerWaalsContact CB-OH 3.24Å; S335-Y375 WeakPolarHBondContact CB-OH 3.33Å; S335-Y375 PolarHBondContact OG-OH 2.86Å; S335-Y375 VanDerWaalsContact OG-OH 3.06Å
336	P	92.2	Very high	88.9	Confident	88 Å²	88	59.8 Å²	59.8	57%	0.571	30%	0.299	S	S	*	.	H	α-helix	trans	-55.5	-35.6	176.6	-27.3	34.7	0	0	0	112.3	Q340 L356	P336-Q340 WeakPolarHBondContact O-CB 3.48Å; P336-Q340 PolarHBondContact O-N 2.77Å; P336-L356 HydrophobicContact CB-CD1 4.04Å; P336-L356 HydrophobicContact CB-CD2 4.17Å; P336-L356 WeakPolarHBondContact O-CD1 3.44Å
337	F	93.4	Very high	89.1	Confident	3 Å²	3	58.4 Å²	58.4	1%	0.013	29%	0.294	C	S	.	.	H	α-helix	trans	-64	-49.8	178	178.2	-99.4	0	0	0	112.2	S335 Q340 V341 A353 I357 F362 Y375 L379 L399 L403	S335-F337 PolarHBondContact O-N 2.72Å; S335-F337 VanDerWaalsContact O-N 3.15Å; F337-Q340 PolarHBondContact O-N 2.86Å; F337-V341 HydrophobicContact CD2-CG2 4.42Å; F337-V341 HydrophobicContact CE1-CG2 4.19Å; F337-V341 HydrophobicContact CE2-CG2 3.98Å; F337-V341 HydrophobicContact CZ-CG2 3.86Å; F337-V341 WeakPolarHBondContact O-CG2 3.24Å; F337-V341 PolarHBondContact O-N 2.94Å; F337-A353 HydrophobicContact CD2-CB 4.22Å; F337-A353 WeakPolarHBondContact CD2-O 3.33Å; F337-A353 HydrophobicContact CE2-CB 4.08Å; F337-I357 HydrophobicContact CD2-CD1 4.37Å; F337-I357 HydrophobicContact CD2-CG1 3.93Å; F337-I357 HydrophobicContact CE2-CD1 3.7Å; F337-I357 HydrophobicContact CE2-CG1 3.78Å; F337-I357 HydrophobicContact CZ-CD1 4.31Å; F337-F362 HydrophobicContact CB-CD2 4.23Å; F337-F362 HydrophobicContact CB-CE2 3.84Å; F337-F362 HydrophobicContact CD1-CE2 4.12Å; F337-F362 HydrophobicContact CD2-CE2 4.27Å; F337-F362 AromaticContact CG-CE2 3.8Å; F337-F362 HydrophobicContact CG-CE2 3.8Å; F337-Y375 AromaticContact CD1-CD1 3.63Å; F337-Y375 HydrophobicContact CD1-CD1 3.63Å; F337-Y375 AromaticContact CD1-CE1 3.79Å; F337-Y375 HydrophobicContact CD1-CE1 3.79Å; F337-Y375 HydrophobicContact CD1-CG 4.09Å; F337-Y375 AromaticContact CE1-CD1 3.83Å; F337-Y375 HydrophobicContact CE1-CD1 3.83Å; F337-Y375 HydrophobicContact CE1-CE1 4.45Å; F337-Y375 HydrophobicContact CE1-CG 4.04Å; F337-L379 HydrophobicContact CZ-CD2 4.43Å; F337-L399 HydrophobicContact CE2-CD2 4.35Å; F337-L403 HydrophobicContact CE1-CD1 4.17Å; F337-L403 HydrophobicContact CE1-CD2 4.28Å; F337-L403 HydrophobicContact CZ-CD1 3.99Å; F337-L403 HydrophobicContact CZ-CD2 4.03Å; F337-L403 HydrophobicContact CZ-CG 4.23Å
338	Y	92.7	Very high	89.2	Confident	24 Å²	24	54.2 Å²	54.2	9%	0.094	28%	0.279	C	S	.	.	H	α-helix	trans	-60.7	-47.7	178.8	173	-94	0	0	0	111.5	F332 I333 S335 Q340 V341 K342 Y378	F332-Y338 HydrophobicContact CD1-CD2 4.07Å; F332-Y338 HydrophobicContact CD1-CE2 4.48Å; F332-Y338 HydrophobicContact CD1-CG 4.47Å; F332-Y338 AromaticContact CE1-CD2 3.47Å; F332-Y338 HydrophobicContact CE1-CD2 3.47Å; F332-Y338 VanDerWaalsContact CE1-CD2 3.47Å; F332-Y338 AromaticContact CE1-CE2 3.86Å; F332-Y338 HydrophobicContact CE1-CE2 3.86Å; F332-Y338 HydrophobicContact CE1-CG 4.26Å; F332-Y338 HydrophobicContact CZ-CD2 4.27Å; F332-Y338 VanDerWaalsContact O-CB 3.26Å; F332-Y338 WeakPolarHBondContact O-CB 3.22Å; I333-Y338 HydrophobicContact CB-CE1 4.38Å; I333-Y338 HydrophobicContact CG2-CD1 4.33Å; I333-Y338 HydrophobicContact CG2-CE1 3.9Å; I333-Y338 WeakPolarHBondContact O-CD1 3.32Å; S335-Y338 PolarHBondContact O-N 3.1Å; S335-Y338 VanDerWaalsContact O-N 3.15Å; S335-Y338 WeakPolarHBondContact OG-CB 3.49Å; S335-Y338 PolarHBondContact OG-N 2.65Å; S335-Y338 VanDerWaalsContact OG-N 3.1Å; Y338-Q340 VanDerWaalsContact C-N 3.35Å; Y338-Q340 PolarHBondContact O-N 3.3Å; Y338-V341 PolarHBondContact O-N 3.44Å; Y338-K342 HydrophobicContact CE1-CD 3.83Å; Y338-K342 VanDerWaalsContact O-CB 3.29Å; Y338-K342 WeakPolarHBondContact O-CB 3.38Å; Y338-K342 PolarHBondContact O-N 3.48Å; Y338-Y378 AromaticContact CD2-CD1 3.89Å; Y338-Y378 HydrophobicContact CD2-CD1 3.89Å; Y338-Y378 HydrophobicContact CD2-CD2 4.39Å; Y338-Y378 AromaticContact CD2-CE1 3.6Å; Y338-Y378 HydrophobicContact CD2-CE1 3.6Å; Y338-Y378 HydrophobicContact CD2-CE2 4.16Å; Y338-Y378 HydrophobicContact CD2-CG 4.26Å; Y338-Y378 AromaticContact CD2-CZ 3.75Å; Y338-Y378 HydrophobicContact CE2-CD1 4.17Å; Y338-Y378 AromaticContact CE2-CD2 3.86Å; Y338-Y378 HydrophobicContact CE2-CD2 3.86Å; Y338-Y378 AromaticContact CE2-CE1 3.8Å; Y338-Y378 HydrophobicContact CE2-CE1 3.8Å; Y338-Y378 AromaticContact CE2-CE2 3.48Å; Y338-Y378 HydrophobicContact CE2-CE2 3.48Å; Y338-Y378 VanDerWaalsContact CE2-CE2 3.48Å; Y338-Y378 HydrophobicContact CE2-CG 4.18Å; Y338-Y378 AromaticContact CE2-CZ 3.44Å; Y338-Y378 VanDerWaalsContact CE2-CZ 3.44Å
339	L	92.6	Very high	89.7	Confident	79 Å²	79	52.5 Å²	52.5	41%	0.414	28%	0.275	S	S	.	.	H	α-helix	trans	-60.3	-45.3	-179.9	-67.9	173.5	0	0	0	111.2	I333 S335 V341 K342 T343	I333-L339 WeakPolarHBondContact O-CD2 3.43Å; S335-L339 PolarHBondContact O-N 2.85Å; S335-L339 VanDerWaalsContact O-N 3.11Å; L339-V341 PolarHBondContact O-N 3.16Å; L339-K342 PolarHBondContact O-N 3.45Å; L339-T343 WeakPolarHBondContact O-CG2 3.45Å; L339-T343 PolarHBondContact O-N 3.4Å; L339-T343 PolarHBondContact O-OG1 2.87Å
340	Q	93.8	Very high	90.2	Very high	43 Å²	43	48.6 Å²	48.6	20%	0.201	26%	0.258	C	S	.	.	H	α-helix	trans	-63.4	-41.5	178.6	-173.3	59.8	36	0	0	112.5	P336 F337 Y338 T343 A344 D349 K352 A353 L356	P336-Q340 WeakPolarHBondContact O-CB 3.48Å; P336-Q340 PolarHBondContact O-N 2.77Å; F337-Q340 PolarHBondContact O-N 2.86Å; Y338-Q340 VanDerWaalsContact C-N 3.35Å; Y338-Q340 PolarHBondContact O-N 3.3Å; Q340-T343 PolarHBondContact O-OG1 3.31Å; Q340-A344 WeakPolarHBondContact O-CB 3.46Å; Q340-A344 PolarHBondContact O-N 3.43Å; Q340-D349 PolarHBondContact NE2-O 2.9Å; Q340-D349 VanDerWaalsContact NE2-O 3.08Å; Q340-K352 HydrophobicContact CG-CB 4.11Å; Q340-A353 HydrophobicContact CB-CB 4.28Å; Q340-A353 HydrophobicContact CG-CB 3.83Å; Q340-L356 HydrophobicContact CB-CD1 3.95Å; Q340-L356 HydrophobicContact CG-CD1 4.3Å
341	V	92.9	Very high	90.5	Very high	0 Å²	0	48.3 Å²	48.3	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-71.7	-33.9	177.1	174.4	0	0	0	0	111.8	F337 Y338 L339 A353 Y378 L379 L396 L399	F337-V341 HydrophobicContact CD2-CG2 4.42Å; F337-V341 HydrophobicContact CE1-CG2 4.19Å; F337-V341 HydrophobicContact CE2-CG2 3.98Å; F337-V341 HydrophobicContact CZ-CG2 3.86Å; F337-V341 WeakPolarHBondContact O-CG2 3.24Å; F337-V341 PolarHBondContact O-N 2.94Å; Y338-V341 PolarHBondContact O-N 3.44Å; L339-V341 PolarHBondContact O-N 3.16Å; V341-A353 HydrophobicContact CG2-CB 3.63Å; V341-Y378 HydrophobicContact CB-CE1 4.09Å; V341-Y378 HydrophobicContact CG1-CD1 4.5Å; V341-Y378 HydrophobicContact CG1-CE1 3.72Å; V341-L379 HydrophobicContact CG1-CD2 3.75Å; V341-L379 HydrophobicContact CG2-CD2 4.39Å; V341-L396 HydrophobicContact CG1-CD2 4.3Å; V341-L399 HydrophobicContact CG2-CD1 4.39Å
342	K	92.1	Very high	90.7	Very high	116 Å²	116	52 Å²	52	50%	0.504	27%	0.27	S	S	.	.	H	α-helix	trans	-63.9	-43.8	176.4	-174.6	179.1	177.4	-178.4	0	111.3	Y338 L339 Y378	Y338-K342 HydrophobicContact CE1-CD 3.83Å; Y338-K342 VanDerWaalsContact O-CB 3.29Å; Y338-K342 WeakPolarHBondContact O-CB 3.38Å; Y338-K342 PolarHBondContact O-N 3.48Å; L339-K342 PolarHBondContact O-N 3.45Å; K342-Y378 VanDerWaalsContact CA-OH 3.26Å; K342-Y378 WeakPolarHBondContact CA-OH 3.48Å; K342-Y378 WeakPolarHBondContact CB-OH 3.49Å; K342-Y378 PolarHBondContact N-OH 3.08Å
343	T	91.6	Very high	90.9	Very high	87 Å²	87	52 Å²	52	53%	0.534	27%	0.269	S	S	.	.	H	α-helix	trans	-85	-11.9	-178.5	58.3	0	0	0	0	113.7	L339 Q340 K345	L339-T343 WeakPolarHBondContact O-CG2 3.45Å; L339-T343 PolarHBondContact O-N 3.4Å; L339-T343 PolarHBondContact O-OG1 2.87Å; Q340-T343 PolarHBondContact O-OG1 3.31Å; T343-K345 PolarHBondContact O-N 2.91Å
344	A	90.8	Very high	91.1	Very high	3 Å²	3	51.6 Å²	51.6	3%	0.025	27%	0.265	C	S	.	.			trans	-59.3	120.9	-178.3	0	0	0	0	0	112.5	Q340 D349 L350 R382	Q340-A344 WeakPolarHBondContact O-CB 3.46Å; Q340-A344 PolarHBondContact O-N 3.43Å; A344-D349 HydrophobicContact CB-CB 3.61Å; A344-L350 HydrophobicContact CB-CD2 3.54Å; A344-L350 HydrophobicContact CB-CG 4.08Å; A344-R382 PolarHBondContact O-NH2 2.73Å
345	K	87.4	Confident	91.2	Very high	168 Å²	168	52.7 Å²	52.7	73%	0.73	27%	0.265	S	S	*	.			trans	-115.6	-16.7	171.2	-64.3	-179.2	-177.7	-179.3	0	112.4	T343 D349	T343-K345 PolarHBondContact O-N 2.91Å; K345-D349 PolarHBondContact N-OD2 3.14Å
346	T	86.9	Confident	91.3	Very high	47 Å²	47	54.1 Å²	54.1	29%	0.288	27%	0.272	S	S	.	.	S	Bend	trans	-121.8	163.5	-173.1	62.1	0	0	0	0	111.1	S348 D349 L350 E882	T346-S348 VanDerWaalsContact C-N 3.3Å; T346-D349 PolarHBondContact N-OD2 3.31Å; T346-D349 PolarHBondContact O-N 2.85Å; T346-D349 PolarHBondContact OG1-N 3.06Å; T346-D349 VanDerWaalsContact OG1-N 3.11Å; T346-D349 PolarHBondContact OG1-OD2 3.15Å; T346-L350 PolarHBondContact O-N 2.88Å; T346-E882 WeakPolarHBondContact CB-OE1 3.3Å
347	I	85.9	Confident	91.3	Very high	56 Å²	56	50.5 Å²	50.5	29%	0.287	25%	0.247	S	C	.	.	H	α-helix	trans	-70.8	-31.8	175.1	-162.9	64.5	0	0	0	110.7	D349 L350 N351 E882	I347-D349 VanDerWaalsContact C-N 3.33Å; I347-D349 PolarHBondContact O-N 3.02Å; I347-L350 HydrophobicContact CD1-CD1 4.22Å; I347-L350 CarbonylContact O-C 3.29Å; I347-L350 PolarHBondContact O-N 2.79Å; I347-L350 VanDerWaalsContact O-N 3.16Å; I347-N351 PolarHBondContact O-N 3.34Å; I347-E882 PolarHBondContact N-OE1 3.12Å; I347-E882 VanDerWaalsContact N-OE1 3.1Å
348	S	87.1	Confident	91	Very high	44 Å²	44	55.2 Å²	55.2	31%	0.308	27%	0.269	S	S	.	.	H	α-helix	trans	-60.1	-38.8	172.3	178.3	0	0	0	0	112.6	T346 L350 N351 K352 E882	T346-S348 VanDerWaalsContact C-N 3.3Å; S348-L350 VanDerWaalsContact C-N 3.3Å; S348-L350 PolarHBondContact O-N 3.15Å; S348-N351 WeakPolarHBondContact O-CA 3.44Å; S348-N351 WeakPolarHBondContact O-CB 3.44Å; S348-N351 PolarHBondContact O-N 2.84Å; S348-N351 VanDerWaalsContact O-N 3.12Å; S348-K352 WeakPolarHBondContact O-CG 3.4Å; S348-K352 PolarHBondContact O-N 2.87Å; S348-E882 WeakPolarHBondContact CB-OE2 3.48Å; S348-E882 PolarHBondContact N-OE2 3.02Å
349	D	91.1	Very high	90.8	Very high	29 Å²	29	60.7 Å²	60.7	16%	0.155	29%	0.291	C	S	.	.	H	α-helix	trans	-64.8	-36.3	175.2	-65.3	-36.2	0	0	0	112.5	Q340 A344 K345 T346 I347 K352 A353	Q340-D349 PolarHBondContact NE2-O 2.9Å; Q340-D349 VanDerWaalsContact NE2-O 3.08Å; A344-D349 HydrophobicContact CB-CB 3.61Å; K345-D349 PolarHBondContact N-OD2 3.14Å; T346-D349 PolarHBondContact N-OD2 3.31Å; T346-D349 PolarHBondContact O-N 2.85Å; T346-D349 PolarHBondContact OG1-N 3.06Å; T346-D349 VanDerWaalsContact OG1-N 3.11Å; T346-D349 PolarHBondContact OG1-OD2 3.15Å; I347-D349 VanDerWaalsContact C-N 3.33Å; I347-D349 PolarHBondContact O-N 3.02Å; D349-K352 WeakPolarHBondContact O-CB 3.42Å; D349-K352 PolarHBondContact O-N 3.45Å; D349-K352 IonicContact OD1-NZ 3.07Å; D349-K352 PolarHBondContact OD1-NZ 3.08Å; D349-A353 PolarHBondContact O-N 3.26Å; D349-A353 VanDerWaalsContact O-N 3.08Å
350	L	92	Very high	90.3	Very high	4 Å²	4	63.3 Å²	63.3	2%	0.021	32%	0.316	C	S	.	.	H	α-helix	trans	-71.1	-32.7	172.6	-62.8	-179	0	0	0	111.8	A344 T346 I347 S348 K352 A353 W354 L392 L396 L399	A344-L350 HydrophobicContact CB-CD2 3.54Å; A344-L350 HydrophobicContact CB-CG 4.08Å; T346-L350 PolarHBondContact O-N 2.88Å; I347-L350 HydrophobicContact CD1-CD1 4.22Å; I347-L350 CarbonylContact O-C 3.29Å; I347-L350 PolarHBondContact O-N 2.79Å; I347-L350 VanDerWaalsContact O-N 3.16Å; S348-L350 VanDerWaalsContact C-N 3.3Å; S348-L350 PolarHBondContact O-N 3.15Å; L350-K352 VanDerWaalsContact C-N 3.34Å; L350-A353 WeakPolarHBondContact O-CB 3.34Å; L350-A353 PolarHBondContact O-N 3.01Å; L350-W354 WeakPolarHBondContact O-CB 3.24Å; L350-W354 PolarHBondContact O-N 3.16Å; L350-L392 HydrophobicContact CD1-CD2 3.99Å; L350-L396 HydrophobicContact CD1-CD2 4.42Å; L350-L396 HydrophobicContact CD1-CG 4.42Å; L350-L396 HydrophobicContact CD2-CD2 4.03Å; L350-L399 HydrophobicContact CB-CD1 4.06Å; L350-L399 HydrophobicContact CD2-CD1 3.76Å; L350-L399 HydrophobicContact CG-CD1 4.38Å
351	N	90.9	Very high	89.9	Confident	40 Å²	40	65.8 Å²	65.8	21%	0.214	34%	0.338	C	S	.	.	H	α-helix	trans	-63	-39.4	170.7	-71.4	-28.8	0	0	0	111.3	I347 S348 W354 K355 R398	I347-N351 PolarHBondContact O-N 3.34Å; S348-N351 WeakPolarHBondContact O-CA 3.44Å; S348-N351 WeakPolarHBondContact O-CB 3.44Å; S348-N351 PolarHBondContact O-N 2.84Å; S348-N351 VanDerWaalsContact O-N 3.12Å; N351-W354 WeakPolarHBondContact O-CB 3.43Å; N351-W354 PolarHBondContact O-N 3.27Å; N351-K355 WeakPolarHBondContact O-CG 3.34Å; N351-K355 PolarHBondContact O-N 3.44Å; N351-R398 VanDerWaalsContact OD1-CZ 3.26Å; N351-R398 PolarHBondContact OD1-NH1 3.44Å; N351-R398 PolarHBondContact OD1-NH2 2.9Å
352	K	92.1	Very high	89.7	Confident	102 Å²	102	67.5 Å²	67.5	44%	0.443	35%	0.345	S	S	.	.	H	α-helix	trans	-62.2	-44.7	172.7	-65.6	169.5	-164.7	158.3	0	110.8	Q340 S348 D349 L350 W354 K355 L356	Q340-K352 HydrophobicContact CG-CB 4.11Å; S348-K352 WeakPolarHBondContact O-CG 3.4Å; S348-K352 PolarHBondContact O-N 2.87Å; D349-K352 WeakPolarHBondContact O-CB 3.42Å; D349-K352 PolarHBondContact O-N 3.45Å; D349-K352 IonicContact OD1-NZ 3.07Å; D349-K352 PolarHBondContact OD1-NZ 3.08Å; L350-K352 VanDerWaalsContact C-N 3.34Å; K352-W354 VanDerWaalsContact C-N 3.28Å; K352-W354 PolarHBondContact O-N 2.99Å; K352-K355 PolarHBondContact O-N 3.34Å; K352-L356 WeakPolarHBondContact O-CG 2.93Å; K352-L356 PolarHBondContact O-N 3.36Å
353	A	93.3	Very high	89.4	Confident	0 Å²	0	66.2 Å²	66.2	0%	0	34%	0.341	C	S	.	.	H	α-helix	trans	-60.6	-37.7	174.4	0	0	0	0	0	112.4	F337 Q340 V341 D349 L350 L356 L399	F337-A353 HydrophobicContact CD2-CB 4.22Å; F337-A353 WeakPolarHBondContact CD2-O 3.33Å; F337-A353 HydrophobicContact CE2-CB 4.08Å; Q340-A353 HydrophobicContact CB-CB 4.28Å; Q340-A353 HydrophobicContact CG-CB 3.83Å; V341-A353 HydrophobicContact CG2-CB 3.63Å; D349-A353 PolarHBondContact O-N 3.26Å; D349-A353 VanDerWaalsContact O-N 3.08Å; L350-A353 WeakPolarHBondContact O-CB 3.34Å; L350-A353 PolarHBondContact O-N 3.01Å; A353-L356 WeakPolarHBondContact O-CB 3.37Å; A353-L356 PolarHBondContact O-N 3.04Å; A353-L399 HydrophobicContact CB-CD1 4.36Å; A353-L399 HydrophobicContact CB-CD2 4.39Å
354	W	93.5	Very high	89.1	Confident	37 Å²	37	63.6 Å²	63.6	14%	0.14	33%	0.326	C	S	.	.	H	α-helix	trans	-62.1	-44.5	176.8	-172.8	101.9	0	0	0	111.5	L350 N351 K352 L356 I357 E358 L399 K402 A694	L350-W354 WeakPolarHBondContact O-CB 3.24Å; L350-W354 PolarHBondContact O-N 3.16Å; N351-W354 WeakPolarHBondContact O-CB 3.43Å; N351-W354 PolarHBondContact O-N 3.27Å; K352-W354 VanDerWaalsContact C-N 3.28Å; K352-W354 PolarHBondContact O-N 2.99Å; W354-L356 VanDerWaalsContact C-N 3.29Å; W354-L356 PolarHBondContact O-N 3.5Å; W354-I357 WeakPolarHBondContact O-CB 3.48Å; W354-I357 PolarHBondContact O-N 3.32Å; W354-E358 WeakPolarHBondContact CH2-OE1 3.37Å; W354-E358 VanDerWaalsContact CZ3-CD 3.46Å; W354-E358 HydrophobicContact CZ3-CG 4.2Å; W354-E358 VanDerWaalsContact CZ3-OE1 3.27Å; W354-E358 WeakPolarHBondContact CZ3-OE1 3.06Å; W354-L399 HydrophobicContact CB-CD2 3.67Å; W354-L399 HydrophobicContact CG-CD2 4.26Å; W354-K402 HydrophobicContact CZ2-CD 3.83Å; W354-K402 VanDerWaalsContact CZ2-NZ 3.32Å; W354-A694 PolarHBondContact NE1-O 2.89Å
355	K	92.4	Very high	88.9	Confident	127 Å²	127	68.6 Å²	68.6	55%	0.552	35%	0.353	S	S	*	.	H	α-helix	trans	-62.9	-34.8	177.7	-70.2	178.4	-178.5	-178.7	0	112.3	N351 K352 I357 E358	N351-K355 WeakPolarHBondContact O-CG 3.34Å; N351-K355 PolarHBondContact O-N 3.44Å; K352-K355 PolarHBondContact O-N 3.34Å; K355-I357 PolarHBondContact O-N 3.16Å; K355-E358 PolarHBondContact O-N 2.71Å; K355-E358 VanDerWaalsContact O-N 3.08Å
356	L	92.8	Very high	88.8	Confident	40 Å²	40	61.3 Å²	61.3	21%	0.209	32%	0.322	C	S	.	.	H	α-helix	trans	-60.4	-28.3	178.4	-69.9	171.1	0	0	0	113.4	P336 Q340 K352 A353 W354 E358 Y359	P336-L356 HydrophobicContact CB-CD1 4.04Å; P336-L356 HydrophobicContact CB-CD2 4.17Å; P336-L356 WeakPolarHBondContact O-CD1 3.44Å; Q340-L356 HydrophobicContact CB-CD1 3.95Å; Q340-L356 HydrophobicContact CG-CD1 4.3Å; K352-L356 WeakPolarHBondContact O-CG 2.93Å; K352-L356 PolarHBondContact O-N 3.36Å; A353-L356 WeakPolarHBondContact O-CB 3.37Å; A353-L356 PolarHBondContact O-N 3.04Å; W354-L356 VanDerWaalsContact C-N 3.29Å; W354-L356 PolarHBondContact O-N 3.5Å; L356-E358 PolarHBondContact O-N 3.09Å; L356-Y359 HydrophobicContact CD2-CD2 3.93Å; L356-Y359 HydrophobicContact CD2-CE2 3.86Å; L356-Y359 PolarHBondContact O-N 2.91Å
357	I	91.3	Very high	88.8	Confident	12 Å²	12	63 Å²	63	6%	0.062	32%	0.323	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.9	-24.8	179	-60	167.2	0	0	0	111.5	F337 W354 K355 Y359 F362 L399 K402 L403	F337-I357 HydrophobicContact CD2-CD1 4.37Å; F337-I357 HydrophobicContact CD2-CG1 3.93Å; F337-I357 HydrophobicContact CE2-CD1 3.7Å; F337-I357 HydrophobicContact CE2-CG1 3.78Å; F337-I357 HydrophobicContact CZ-CD1 4.31Å; W354-I357 WeakPolarHBondContact O-CB 3.48Å; W354-I357 PolarHBondContact O-N 3.32Å; K355-I357 PolarHBondContact O-N 3.16Å; I357-Y359 VanDerWaalsContact C-N 3.35Å; I357-F362 HydrophobicContact CB-CD1 4.45Å; I357-F362 HydrophobicContact CG1-CE1 4.41Å; I357-F362 HydrophobicContact CG1-CE2 4.34Å; I357-F362 HydrophobicContact CG1-CZ 4.24Å; I357-F362 HydrophobicContact CG2-CD1 3.99Å; I357-F362 HydrophobicContact CG2-CE1 3.96Å; I357-L399 HydrophobicContact CD1-CD2 4.16Å; I357-K402 HydrophobicContact CB-CG 4.37Å; I357-K402 HydrophobicContact CD1-CB 4.21Å; I357-K402 HydrophobicContact CD1-CG 3.87Å; I357-K402 HydrophobicContact CG2-CG 4.1Å; I357-L403 HydrophobicContact CD1-CD2 3.68Å; I357-L403 HydrophobicContact CD1-CG 4.02Å; I357-L403 HydrophobicContact CG1-CD2 4.04Å
358	E	87.5	Confident	88.9	Confident	102 Å²	102	61.7 Å²	61.7	48%	0.477	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.3	-17.4	-178.4	-57.7	-163.2	142.9	0	0	113.3	W354 K355 L356 K402	W354-E358 WeakPolarHBondContact CH2-OE1 3.37Å; W354-E358 VanDerWaalsContact CZ3-CD 3.46Å; W354-E358 HydrophobicContact CZ3-CG 4.2Å; W354-E358 VanDerWaalsContact CZ3-OE1 3.27Å; W354-E358 WeakPolarHBondContact CZ3-OE1 3.06Å; K355-E358 PolarHBondContact O-N 2.71Å; K355-E358 VanDerWaalsContact O-N 3.08Å; L356-E358 PolarHBondContact O-N 3.09Å; E358-K402 IonicContact OE1-NZ 3.18Å; E358-K402 PolarHBondContact OE1-NZ 3.42Å
359	Y	88.1	Confident	88.6	Confident	138 Å²	138	62.4 Å²	62.4	54%	0.541	31%	0.313	S	S	.	.	S	Bend	trans	-71.1	140.9	178	-63	-47.4	0	0	0	111.4	L356 I357 S361 F362	L356-Y359 HydrophobicContact CD2-CD2 3.93Å; L356-Y359 HydrophobicContact CD2-CE2 3.86Å; L356-Y359 PolarHBondContact O-N 2.91Å; I357-Y359 VanDerWaalsContact C-N 3.35Å; Y359-S361 PolarHBondContact O-N 3.11Å; Y359-S361 VanDerWaalsContact O-N 3.1Å; Y359-F362 WeakPolarHBondContact O-CB 3.49Å; Y359-F362 PolarHBondContact O-N 3.44Å
360	S	83	Confident	88.2	Confident	134 Å²	134	64.9 Å²	64.9	94%	0.937	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.8	-19.5	177.3	54.2	0	0	0	0	113.7	F362	S360-F362 VanDerWaalsContact C-N 3.3Å
361	S	85.7	Confident	87.8	Confident	95 Å²	95	65.6 Å²	65.6	66%	0.664	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.1	-13.4	175.2	55.6	0	0	0	0	113.8	Y359 Q363	Y359-S361 PolarHBondContact O-N 3.11Å; Y359-S361 VanDerWaalsContact O-N 3.1Å; S361-Q363 PolarHBondContact O-N 3.16Å
362	F	87.8	Confident	87.5	Confident	37 Å²	37	67.8 Å²	67.8	16%	0.162	34%	0.342	C	S	.	.			trans	-71.3	119	-179.1	-179.1	-104.1	0	0	0	111.5	F337 I357 Y359 S360 Y375 L403	F337-F362 HydrophobicContact CB-CD2 4.23Å; F337-F362 HydrophobicContact CB-CE2 3.84Å; F337-F362 HydrophobicContact CD1-CE2 4.12Å; F337-F362 HydrophobicContact CD2-CE2 4.27Å; F337-F362 AromaticContact CG-CE2 3.8Å; F337-F362 HydrophobicContact CG-CE2 3.8Å; I357-F362 HydrophobicContact CB-CD1 4.45Å; I357-F362 HydrophobicContact CG1-CE1 4.41Å; I357-F362 HydrophobicContact CG1-CE2 4.34Å; I357-F362 HydrophobicContact CG1-CZ 4.24Å; I357-F362 HydrophobicContact CG2-CD1 3.99Å; I357-F362 HydrophobicContact CG2-CE1 3.96Å; Y359-F362 WeakPolarHBondContact O-CB 3.49Å; Y359-F362 PolarHBondContact O-N 3.44Å; S360-F362 VanDerWaalsContact C-N 3.3Å; F362-Y375 HydrophobicContact CE2-CD2 4.4Å; F362-Y375 HydrophobicContact CE2-CE2 4.02Å; F362-Y375 HydrophobicContact CZ-CD2 4.01Å; F362-Y375 AromaticContact CZ-CE2 3.99Å; F362-Y375 HydrophobicContact CZ-CE2 3.99Å; F362-L403 HydrophobicContact CE1-CD2 3.96Å; F362-L403 HydrophobicContact CE2-CD2 4.48Å; F362-L403 HydrophobicContact CZ-CD2 3.49Å; F362-L403 VanDerWaalsContact CZ-CD2 3.49Å
363	Q	86.3	Confident	87.3	Confident	89 Å²	89	63 Å²	63	42%	0.416	32%	0.32	S	S	.	.			trans	-101.4	101.9	178.3	-65	-174.6	-7.7	0	0	110.7	S361 N365 L366 Y375	S361-Q363 PolarHBondContact O-N 3.16Å; Q363-N365 VanDerWaalsContact C-N 3.25Å; Q363-N365 PolarHBondContact O-N 3.41Å; Q363-L366 HydrophobicContact CB-CD1 3.81Å; Q363-L366 HydrophobicContact CB-CG 3.8Å; Q363-Y375 WeakPolarHBondContact O-CE2 3.5Å
364	S	85.9	Confident	87.2	Confident	31 Å²	31	63.3 Å²	63.3	22%	0.217	32%	0.323	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.2	-16.3	-176.8	58.5	0	0	0	0	114.8
365	N	85.2	Confident	87.2	Confident	109 Å²	109	61.6 Å²	61.6	58%	0.583	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.1	1	-175.6	65.6	-25.3	0	0	0	114.6	Q363	Q363-N365 VanDerWaalsContact C-N 3.25Å; Q363-N365 PolarHBondContact O-N 3.41Å
366	L	87.1	Confident	87.2	Confident	15 Å²	15	55.6 Å²	55.6	8%	0.079	29%	0.29	C	S	.	.			trans	-62.2	141.8	177.2	-73.7	173.2	0	0	0	111.6	A331 F332 Q363 Y375	A331-L366 HydrophobicContact CB-CD1 4.5Å; A331-L366 HydrophobicContact CB-CD2 3.84Å; F332-L366 HydrophobicContact CB-CB 4.49Å; F332-L366 HydrophobicContact CD2-CB 4.02Å; Q363-L366 HydrophobicContact CB-CD1 3.81Å; Q363-L366 HydrophobicContact CB-CG 3.8Å; L366-Y375 HydrophobicContact CB-CE2 4.06Å; L366-Y375 VanDerWaalsContact CD1-OH 3.27Å; L366-Y375 WeakPolarHBondContact CD1-OH 3.18Å
367	R	86.6	Confident	87.3	Confident	81 Å²	81	53.8 Å²	53.8	31%	0.306	28%	0.281	S	S	.	.	B	Isolated β-bridge	trans	-123.5	142.8	177.5	-67.2	-177.2	177	-107.5	11.3	110.7	D4 F332 H369 Q372 A373 T374 R413	D4-R367 IonicContact OD2-NH2 3.16Å; F332-R367 WeakPolarHBondContact CB-O 3.28Å; R367-H369 PolarHBondContact O-N 3.37Å; R367-Q372 PolarHBondContact NH1-O 3.38Å; R367-A373 WeakPolarHBondContact CA-O 3.43Å; R367-T374 HydrophobicContact CG-CG2 4.46Å; R367-R413 PolarHBondContact NH1-O 2.94Å
368	R	86.5	Confident	87.3	Confident	30 Å²	30	54 Å²	54	11%	0.113	28%	0.281	C	S	.	.			trans	-68.1	126.5	175	-173.7	168.7	59.6	-164.6	-3.3	109.4	F332 T370 D371 Q372 A373 E381	F332-R368 HydrophobicContact CD1-CB 3.76Å; F332-R368 HydrophobicContact CD1-CG 4.11Å; F332-R368 HydrophobicContact CE1-CB 3.85Å; F332-R368 HydrophobicContact CE1-CG 4.26Å; F332-R368 HydrophobicContact CG-CB 4.12Å; F332-R368 HydrophobicContact CZ-CB 4.29Å; R368-T370 VanDerWaalsContact C-N 3.26Å; R368-T370 WeakPolarHBondContact CG-OG1 3.48Å; R368-T370 PolarHBondContact O-N 3.45Å; R368-D371 IonicContact CZ-OD1 2.71Å; R368-D371 IonicContact CZ-OD2 3.28Å; R368-D371 IonicContact NE-OD1 3.29Å; R368-D371 PolarHBondContact NE-OD1 2.65Å; R368-D371 IonicContact NE-OD2 2.65Å; R368-D371 IonicContact NH2-OD1 3.75Å; R368-D371 PolarHBondContact NH2-OD1 3.12Å; R368-D371 IonicContact NH2-OD2 3.38Å; R368-D371 PolarHBondContact NH2-OD2 3.25Å; R368-Q372 WeakPolarHBondContact O-CA 3.26Å; R368-Q372 PolarHBondContact O-N 3.06Å; R368-A373 HydrophobicContact CB-CB 4.31Å; R368-A373 PolarHBondContact N-O 3.25Å; R368-E381 IonicContact CZ-OE1 3.88Å; R368-E381 IonicContact CZ-OE2 3.75Å; R368-E381 IonicContact NH1-OE2 3.76Å; R368-E381 PolarHBondContact NH1-OE2 3.45Å; R368-E381 IonicContact NH2-OE1 2.98Å; R368-E381 PolarHBondContact NH2-OE1 2.98Å; R368-E381 IonicContact NH2-OE2 3.1Å; R368-E381 PolarHBondContact NH2-OE2 3.08Å
369	H	81.9	Confident	87.6	Confident	59 Å²	59	49.2 Å²	49.2	27%	0.273	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.3	-25.3	-172.1	67.8	-95.4	0	0	0	114.5	K329 M330 I333 R367	K329-H369 HydrophobicContact CG-CB 3.6Å; K329-H369 WeakPolarHBondContact O-CB 3.34Å; K329-H369 PolarHBondContact O-ND1 3.02Å; M330-H369 VanDerWaalsContact SD-CE1 3.57Å; I333-H369 VanDerWaalsContact CD1-CE1 3.4Å; I333-H369 WeakPolarHBondContact CD1-CE1 3.47Å; R367-H369 PolarHBondContact O-N 3.37Å
370	T	82.9	Confident	87.8	Confident	80 Å²	80	42.7 Å²	42.7	49%	0.491	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.8	-42	-176.5	54	0	0	0	0	112.7	R368	R368-T370 VanDerWaalsContact C-N 3.26Å; R368-T370 WeakPolarHBondContact CG-OG1 3.48Å; R368-T370 PolarHBondContact O-N 3.45Å
371	D	83.9	Confident	88.2	Confident	19 Å²	19	39.7 Å²	39.7	10%	0.102	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	-139.6	9.4	-169.7	70.8	-21.5	0	0	0	114.1	R368 A373 K415 F416	R368-D371 IonicContact CZ-OD1 2.71Å; R368-D371 IonicContact CZ-OD2 3.28Å; R368-D371 IonicContact NE-OD1 3.29Å; R368-D371 PolarHBondContact NE-OD1 2.65Å; R368-D371 IonicContact NE-OD2 2.65Å; R368-D371 IonicContact NH2-OD1 3.75Å; R368-D371 PolarHBondContact NH2-OD1 3.12Å; R368-D371 IonicContact NH2-OD2 3.38Å; R368-D371 PolarHBondContact NH2-OD2 3.25Å; D371-A373 PolarHBondContact O-N 3.39Å; D371-A373 VanDerWaalsContact O-N 3.12Å; D371-A373 WeakPolarHBondContact OD1-CB 3.4Å; D371-A373 PolarHBondContact OD1-N 2.9Å; D371-A373 WeakPolarHBondContact OD2-CB 3.32Å; D371-K415 VanDerWaalsContact O-CB 3.24Å; D371-K415 WeakPolarHBondContact O-CB 3.43Å; D371-K415 PolarHBondContact O-N 2.91Å; D371-F416 HydrophobicContact CB-CE2 4.19Å
372	Q	84.2	Confident	88.5	Confident	87 Å²	87	38 Å²	38	41%	0.407	18%	0.183	S	C	.	.			trans	59.6	18.6	-179.9	-62.7	-65.6	-29.5	0	0	114.5	R367 R368	R367-Q372 PolarHBondContact NH1-O 3.38Å; R368-Q372 WeakPolarHBondContact O-CA 3.26Å; R368-Q372 PolarHBondContact O-N 3.06Å
373	A	87.5	Confident	88.7	Confident	0 Å²	0	36.7 Å²	36.7	0%	0	18%	0.177	C	C	.	.			trans	-64.8	138.5	176.6	0	0	0	0	0	111.5	R367 R368 D371 H377	R367-A373 WeakPolarHBondContact CA-O 3.43Å; R368-A373 HydrophobicContact CB-CB 4.31Å; R368-A373 PolarHBondContact N-O 3.25Å; D371-A373 PolarHBondContact O-N 3.39Å; D371-A373 VanDerWaalsContact O-N 3.12Å; D371-A373 WeakPolarHBondContact OD1-CB 3.4Å; D371-A373 PolarHBondContact OD1-N 2.9Å; D371-A373 WeakPolarHBondContact OD2-CB 3.32Å; A373-H377 HydrophobicContact CB-CB 3.82Å
374	T	91.5	Very high	88.7	Confident	8 Å²	8	34.7 Å²	34.7	5%	0.049	17%	0.167	C	C	.	.	B	Isolated β-bridge	trans	-84.7	170.5	172.1	68.2	0	0	0	0	111.2	R367 L376 H377 Y378 A412	R367-T374 HydrophobicContact CG-CG2 4.46Å; T374-L376 PolarHBondContact O-N 3.19Å; T374-L376 VanDerWaalsContact O-N 3.15Å; T374-L376 PolarHBondContact OG1-N 3.21Å; T374-H377 PolarHBondContact N-ND1 3.39Å; T374-H377 WeakPolarHBondContact O-CB 3.39Å; T374-H377 PolarHBondContact O-N 3.24Å; T374-H377 PolarHBondContact OG1-ND1 3.31Å; T374-Y378 PolarHBondContact O-N 3Å; T374-Y378 VanDerWaalsContact O-N 3.14Å; T374-A412 HydrophobicContact CG2-CB 3.57Å
375	Y	93.4	Very high	88.8	Confident	1 Å²	1	36.6 Å²	36.6	0%	0.004	18%	0.181	C	C	.	.	H	α-helix	trans	-54.3	-34.5	173.7	-69.3	-57.3	0	0	0	113.2	F332 S335 F337 F362 Q363 L366 Y378 L379	F332-Y375 HydrophobicContact CD2-CD1 4.07Å; F332-Y375 AromaticContact CD2-CE1 3.62Å; F332-Y375 HydrophobicContact CD2-CE1 3.62Å; F332-Y375 AromaticContact CD2-CZ 3.89Å; F332-Y375 HydrophobicContact CE1-CD1 4.47Å; F332-Y375 HydrophobicContact CE1-CE1 4.37Å; F332-Y375 AromaticContact CE2-CD1 3.25Å; F332-Y375 HydrophobicContact CE2-CD1 3.25Å; F332-Y375 HydrophobicContact CE2-CD2 4.37Å; F332-Y375 AromaticContact CE2-CE1 3.28Å; F332-Y375 HydrophobicContact CE2-CE1 3.28Å; F332-Y375 HydrophobicContact CE2-CE2 4.41Å; F332-Y375 AromaticContact CE2-CG 3.82Å; F332-Y375 HydrophobicContact CE2-CG 3.82Å; F332-Y375 AromaticContact CE2-CZ 3.9Å; F332-Y375 HydrophobicContact CG-CE1 4.31Å; F332-Y375 AromaticContact CZ-CD1 3.5Å; F332-Y375 HydrophobicContact CZ-CD1 3.5Å; F332-Y375 VanDerWaalsContact CZ-CD1 3.5Å; F332-Y375 AromaticContact CZ-CE1 3.71Å; F332-Y375 HydrophobicContact CZ-CE1 3.71Å; F332-Y375 HydrophobicContact CZ-CG 4.34Å; S335-Y375 VanDerWaalsContact CB-OH 3.24Å; S335-Y375 WeakPolarHBondContact CB-OH 3.33Å; S335-Y375 PolarHBondContact OG-OH 2.86Å; S335-Y375 VanDerWaalsContact OG-OH 3.06Å; F337-Y375 AromaticContact CD1-CD1 3.63Å; F337-Y375 HydrophobicContact CD1-CD1 3.63Å; F337-Y375 AromaticContact CD1-CE1 3.79Å; F337-Y375 HydrophobicContact CD1-CE1 3.79Å; F337-Y375 HydrophobicContact CD1-CG 4.09Å; F337-Y375 AromaticContact CE1-CD1 3.83Å; F337-Y375 HydrophobicContact CE1-CD1 3.83Å; F337-Y375 HydrophobicContact CE1-CE1 4.45Å; F337-Y375 HydrophobicContact CE1-CG 4.04Å; F362-Y375 HydrophobicContact CE2-CD2 4.4Å; F362-Y375 HydrophobicContact CE2-CE2 4.02Å; F362-Y375 HydrophobicContact CZ-CD2 4.01Å; F362-Y375 AromaticContact CZ-CE2 3.99Å; F362-Y375 HydrophobicContact CZ-CE2 3.99Å; Q363-Y375 WeakPolarHBondContact O-CE2 3.5Å; L366-Y375 HydrophobicContact CB-CE2 4.06Å; L366-Y375 VanDerWaalsContact CD1-OH 3.27Å; L366-Y375 WeakPolarHBondContact CD1-OH 3.18Å; Y375-Y378 PolarHBondContact O-N 3.13Å; Y375-L379 WeakPolarHBondContact O-CG 3.34Å; Y375-L379 PolarHBondContact O-N 3.44Å
376	L	93.1	Very high	88.8	Confident	1 Å²	1	32 Å²	32	1%	0.005	16%	0.156	C	C	.	.	H	α-helix	trans	-66.5	-39.5	178.4	-173.3	64.7	0	0	0	112.3	T374 Y378 L379 V380 M400 V408 L410 A420 L549	T374-L376 PolarHBondContact O-N 3.19Å; T374-L376 VanDerWaalsContact O-N 3.15Å; T374-L376 PolarHBondContact OG1-N 3.21Å; L376-Y378 VanDerWaalsContact C-N 3.34Å; L376-L379 PolarHBondContact O-N 3.02Å; L376-V380 WeakPolarHBondContact O-CG2 3.36Å; L376-V380 PolarHBondContact O-N 2.98Å; L376-V380 VanDerWaalsContact O-N 3.08Å; L376-M400 HydrophobicContact CD1-CB 3.96Å; L376-M400 HydrophobicContact CD1-CG 3.85Å; L376-V408 HydrophobicContact CB-CG1 4.08Å; L376-L410 HydrophobicContact CD2-CD2 3.83Å; L376-A420 HydrophobicContact CB-CB 4.4Å; L376-A420 HydrophobicContact CD2-CB 3.75Å; L376-A420 HydrophobicContact CG-CB 3.71Å; L376-L549 HydrophobicContact CD1-CD2 4.45Å
377	H	93.1	Very high	88.4	Confident	2 Å²	2	38.8 Å²	38.8	1%	0.009	19%	0.185	C	C	.	.	H	α-helix	trans	-61.6	-45.9	173.7	-66.7	83.2	0	0	0	110.4	A373 T374 L379 V380 E381 A412 N418 T419 A420	A373-H377 HydrophobicContact CB-CB 3.82Å; T374-H377 PolarHBondContact N-ND1 3.39Å; T374-H377 WeakPolarHBondContact O-CB 3.39Å; T374-H377 PolarHBondContact O-N 3.24Å; T374-H377 PolarHBondContact OG1-ND1 3.31Å; H377-L379 PolarHBondContact O-N 2.75Å; H377-V380 WeakPolarHBondContact O-CB 3.31Å; H377-V380 PolarHBondContact O-N 2.78Å; H377-V380 VanDerWaalsContact O-N 3.15Å; H377-E381 WeakPolarHBondContact O-CG 3.46Å; H377-E381 PolarHBondContact O-N 2.91Å; H377-A412 PolarHBondContact CE1-O 3Å; H377-A412 VanDerWaalsContact CE1-O 3.24Å; H377-N418 PolarHBondContact NE2-O 2.89Å; H377-N418 VanDerWaalsContact NE2-O 3.15Å; H377-T419 VanDerWaalsContact NE2-C 3.31Å; H377-A420 PolarHBondContact NE2-N 3.34Å; H377-A420 VanDerWaalsContact NE2-N 3.11Å
378	Y	93	Very high	88	Confident	17 Å²	17	42.2 Å²	42.2	7%	0.067	20%	0.204	C	C	.	.	H	α-helix	trans	-61.2	-41.8	177.4	175.2	-113.9	0	0	0	112.8	Y338 V341 K342 T374 Y375 L376 V380 E381 R382	Y338-Y378 AromaticContact CD2-CD1 3.89Å; Y338-Y378 HydrophobicContact CD2-CD1 3.89Å; Y338-Y378 HydrophobicContact CD2-CD2 4.39Å; Y338-Y378 AromaticContact CD2-CE1 3.6Å; Y338-Y378 HydrophobicContact CD2-CE1 3.6Å; Y338-Y378 HydrophobicContact CD2-CE2 4.16Å; Y338-Y378 HydrophobicContact CD2-CG 4.26Å; Y338-Y378 AromaticContact CD2-CZ 3.75Å; Y338-Y378 HydrophobicContact CE2-CD1 4.17Å; Y338-Y378 AromaticContact CE2-CD2 3.86Å; Y338-Y378 HydrophobicContact CE2-CD2 3.86Å; Y338-Y378 AromaticContact CE2-CE1 3.8Å; Y338-Y378 HydrophobicContact CE2-CE1 3.8Å; Y338-Y378 AromaticContact CE2-CE2 3.48Å; Y338-Y378 HydrophobicContact CE2-CE2 3.48Å; Y338-Y378 VanDerWaalsContact CE2-CE2 3.48Å; Y338-Y378 HydrophobicContact CE2-CG 4.18Å; Y338-Y378 AromaticContact CE2-CZ 3.44Å; Y338-Y378 VanDerWaalsContact CE2-CZ 3.44Å; V341-Y378 HydrophobicContact CB-CE1 4.09Å; V341-Y378 HydrophobicContact CG1-CD1 4.5Å; V341-Y378 HydrophobicContact CG1-CE1 3.72Å; K342-Y378 VanDerWaalsContact CA-OH 3.26Å; K342-Y378 WeakPolarHBondContact CA-OH 3.48Å; K342-Y378 WeakPolarHBondContact CB-OH 3.49Å; K342-Y378 PolarHBondContact N-OH 3.08Å; T374-Y378 PolarHBondContact O-N 3Å; T374-Y378 VanDerWaalsContact O-N 3.14Å; Y375-Y378 PolarHBondContact O-N 3.13Å; L376-Y378 VanDerWaalsContact C-N 3.34Å; Y378-V380 VanDerWaalsContact C-N 3.31Å; Y378-V380 PolarHBondContact O-N 3.08Å; Y378-E381 WeakPolarHBondContact O-CB 3.34Å; Y378-E381 PolarHBondContact O-N 2.92Å; Y378-R382 WeakPolarHBondContact O-CB 3.48Å; Y378-R382 PolarHBondContact O-N 3.41Å
379	L	93.8	Very high	87.8	Confident	0 Å²	0	44.7 Å²	44.7	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-64.2	-36.2	175.1	-66.5	-167.9	0	0	0	112.2	F337 V341 Y375 L376 H377 R382 Y383 L396 L399 M400 L403	F337-L379 HydrophobicContact CZ-CD2 4.43Å; V341-L379 HydrophobicContact CG1-CD2 3.75Å; V341-L379 HydrophobicContact CG2-CD2 4.39Å; Y375-L379 WeakPolarHBondContact O-CG 3.34Å; Y375-L379 PolarHBondContact O-N 3.44Å; L376-L379 PolarHBondContact O-N 3.02Å; H377-L379 PolarHBondContact O-N 2.75Å; L379-R382 PolarHBondContact O-N 3.38Å; L379-Y383 VanDerWaalsContact O-CB 3.26Å; L379-Y383 WeakPolarHBondContact O-CB 3.3Å; L379-Y383 PolarHBondContact O-N 3.34Å; L379-L396 HydrophobicContact CD2-CD2 4.03Å; L379-L399 HydrophobicContact CD1-CB 3.87Å; L379-M400 VanDerWaalsContact C-CE 3.41Å; L379-M400 HydrophobicContact CB-CE 3.66Å; L379-M400 HydrophobicContact CB-CG 3.95Å; L379-M400 HydrophobicContact CD1-CB 4.42Å; L379-M400 HydrophobicContact CD1-CG 3.69Å; L379-M400 WeakPolarHBondContact O-CE 3.02Å; L379-L403 HydrophobicContact CD1-CD1 3.45Å; L379-L403 VanDerWaalsContact CD1-CD1 3.45Å; L379-L403 HydrophobicContact CD1-CG 4.41Å; L379-L403 HydrophobicContact CG-CD1 4.1Å
380	V	92.3	Very high	87.8	Confident	1 Å²	1	44.5 Å²	44.5	1%	0.006	22%	0.221	C	C	.	.	H	α-helix	trans	-66.3	-43	175.1	165	0	0	0	0	110.9	L376 H377 Y378 Y383 K384 M400 A420 C423 A424 L545 L549	L376-V380 WeakPolarHBondContact O-CG2 3.36Å; L376-V380 PolarHBondContact O-N 2.98Å; L376-V380 VanDerWaalsContact O-N 3.08Å; H377-V380 WeakPolarHBondContact O-CB 3.31Å; H377-V380 PolarHBondContact O-N 2.78Å; H377-V380 VanDerWaalsContact O-N 3.15Å; Y378-V380 VanDerWaalsContact C-N 3.31Å; Y378-V380 PolarHBondContact O-N 3.08Å; V380-Y383 PolarHBondContact O-N 3.47Å; V380-K384 HydrophobicContact CG1-CD 4.31Å; V380-K384 WeakPolarHBondContact O-CG 3.34Å; V380-K384 PolarHBondContact O-N 3.1Å; V380-M400 HydrophobicContact CB-CE 4.46Å; V380-M400 HydrophobicContact CG2-CE 3.82Å; V380-A420 HydrophobicContact CG2-CB 4.32Å; V380-C423 HydrophobicContact CG1-CB 4.11Å; V380-A424 HydrophobicContact CG1-CB 3.86Å; V380-L545 HydrophobicContact CG1-CD2 4.11Å; V380-L549 HydrophobicContact CG2-CD1 4.19Å
381	E	90.7	Very high	87.7	Confident	71 Å²	71	43.5 Å²	43.5	33%	0.332	21%	0.211	S	C	.	.	H	α-helix	trans	-58.8	-48.8	172.8	-71.1	168.3	-170.9	0	0	111.1	R368 H377 Y378 Y383 K384 S385	R368-E381 IonicContact CZ-OE1 3.88Å; R368-E381 IonicContact CZ-OE2 3.75Å; R368-E381 IonicContact NH1-OE2 3.76Å; R368-E381 PolarHBondContact NH1-OE2 3.45Å; R368-E381 IonicContact NH2-OE1 2.98Å; R368-E381 PolarHBondContact NH2-OE1 2.98Å; R368-E381 IonicContact NH2-OE2 3.1Å; R368-E381 PolarHBondContact NH2-OE2 3.08Å; H377-E381 WeakPolarHBondContact O-CG 3.46Å; H377-E381 PolarHBondContact O-N 2.91Å; Y378-E381 WeakPolarHBondContact O-CB 3.34Å; Y378-E381 PolarHBondContact O-N 2.92Å; E381-Y383 PolarHBondContact O-N 2.86Å; E381-K384 PolarHBondContact O-N 3.5Å; E381-S385 PolarHBondContact O-N 3.05Å
382	R	91.1	Very high	87.9	Confident	61 Å²	61	42.7 Å²	42.7	23%	0.23	21%	0.206	C	C	.	.	H	α-helix	trans	-61.3	-44.2	178.2	-169.1	67.9	177	133.9	-3.7	111.2	A344 Y378 L379 K384 S385 L386 L396	A344-R382 PolarHBondContact O-NH2 2.73Å; Y378-R382 WeakPolarHBondContact O-CB 3.48Å; Y378-R382 PolarHBondContact O-N 3.41Å; L379-R382 PolarHBondContact O-N 3.38Å; R382-K384 VanDerWaalsContact C-N 3.31Å; R382-K384 PolarHBondContact O-N 3.11Å; R382-S385 PolarHBondContact NH1-OG 2.92Å; R382-S385 WeakPolarHBondContact O-CB 3.39Å; R382-S385 PolarHBondContact O-N 3.23Å; R382-S385 VanDerWaalsContact O-N 3.11Å; R382-S385 PolarHBondContact O-OG 2.97Å; R382-L386 HydrophobicContact CG-CD1 4.15Å; R382-L386 WeakPolarHBondContact O-CG 3.26Å; R382-L386 PolarHBondContact O-N 3.14Å; R382-L386 VanDerWaalsContact O-N 3.1Å; R382-L396 HydrophobicContact CB-CD1 4.15Å; R382-L396 HydrophobicContact CG-CD1 3.94Å; R382-L396 HydrophobicContact CG-CD2 4.41Å
383	Y	91.8	Very high	88.1	Confident	8 Å²	8	39.6 Å²	39.6	3%	0.031	19%	0.192	C	C	.	.	H	α-helix	trans	-57.2	-44.4	176.8	178.6	-75.6	0	0	0	111.6	L379 V380 E381 S385 L386 Q393 L396 I397 D542 L545	L379-Y383 VanDerWaalsContact O-CB 3.26Å; L379-Y383 WeakPolarHBondContact O-CB 3.3Å; L379-Y383 PolarHBondContact O-N 3.34Å; V380-Y383 PolarHBondContact O-N 3.47Å; E381-Y383 PolarHBondContact O-N 2.86Å; Y383-S385 VanDerWaalsContact C-N 3.34Å; Y383-S385 PolarHBondContact O-N 3.45Å; Y383-L386 PolarHBondContact O-N 3.15Å; Y383-Q393 HydrophobicContact CD1-CG 4.5Å; Y383-Q393 HydrophobicContact CD2-CB 3.79Å; Y383-Q393 HydrophobicContact CD2-CG 3.95Å; Y383-Q393 WeakPolarHBondContact CD2-O 3.45Å; Y383-Q393 HydrophobicContact CE1-CG 4.45Å; Y383-Q393 HydrophobicContact CE2-CB 3.49Å; Y383-Q393 VanDerWaalsContact CE2-CB 3.49Å; Y383-Q393 HydrophobicContact CE2-CG 3.92Å; Y383-Q393 WeakPolarHBondContact CE2-O 3.15Å; Y383-Q393 HydrophobicContact CG-CG 4.25Å; Y383-Q393 PolarHBondContact O-NE2 3.27Å; Y383-L396 HydrophobicContact CD2-CB 4.49Å; Y383-I397 HydrophobicContact CD2-CG1 4.36Å; Y383-I397 HydrophobicContact CE2-CD1 3.79Å; Y383-I397 HydrophobicContact CE2-CG1 3.97Å; Y383-D542 WeakPolarHBondContact CE1-OD2 3.13Å; Y383-D542 PolarHBondContact OH-OD2 3.38Å; Y383-L545 HydrophobicContact CD1-CD1 4.33Å; Y383-L545 HydrophobicContact CD1-CD2 3.64Å; Y383-L545 HydrophobicContact CD1-CG 4.39Å; Y383-L545 HydrophobicContact CD2-CD1 4.39Å; Y383-L545 HydrophobicContact CE1-CB 4.04Å; Y383-L545 HydrophobicContact CE1-CD1 4.43Å; Y383-L545 HydrophobicContact CE1-CD2 3.96Å; Y383-L545 HydrophobicContact CE1-CG 4.37Å; Y383-L545 HydrophobicContact CE2-CD1 4.46Å; Y383-L545 HydrophobicContact CG-CD1 4.33Å; Y383-L545 HydrophobicContact CG-CD2 4.23Å
384	K	87.3	Confident	88.1	Confident	47 Å²	47	40.7 Å²	40.7	20%	0.204	20%	0.196	C	C	.	.	H	α-helix	trans	-67.3	-33.9	177.7	-67.6	173.9	80.2	-172.6	0	112.4	V380 E381 R382 L386 C423 K426 N428	V380-K384 HydrophobicContact CG1-CD 4.31Å; V380-K384 WeakPolarHBondContact O-CG 3.34Å; V380-K384 PolarHBondContact O-N 3.1Å; E381-K384 PolarHBondContact O-N 3.5Å; R382-K384 VanDerWaalsContact C-N 3.31Å; R382-K384 PolarHBondContact O-N 3.11Å; K384-L386 VanDerWaalsContact C-N 3.28Å; K384-L386 PolarHBondContact O-N 3.2Å; K384-C423 PolarHBondContact NZ-O 2.99Å; K384-K426 PolarHBondContact NZ-O 3.36Å; K384-N428 WeakPolarHBondContact CE-OD1 3.48Å; K384-N428 PolarHBondContact NZ-OD1 3.19Å
385	S	87.2	Confident	88	Confident	72 Å²	72	40.5 Å²	40.5	50%	0.503	20%	0.195	S	C	.	.	H	α-helix	trans	-66.9	-28.4	175.1	77.4	0	0	0	0	113.1	E381 R382 Y383 K387	E381-S385 PolarHBondContact O-N 3.05Å; R382-S385 PolarHBondContact NH1-OG 2.92Å; R382-S385 WeakPolarHBondContact O-CB 3.39Å; R382-S385 PolarHBondContact O-N 3.23Å; R382-S385 VanDerWaalsContact O-N 3.11Å; R382-S385 PolarHBondContact O-OG 2.97Å; Y383-S385 VanDerWaalsContact C-N 3.34Å; Y383-S385 PolarHBondContact O-N 3.45Å; S385-K387 VanDerWaalsContact C-N 3.33Å; S385-K387 PolarHBondContact O-N 3.32Å
386	L	85.7	Confident	88	Confident	13 Å²	13	40.5 Å²	40.5	7%	0.068	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.1	33.2	-176.1	-63.8	179.9	0	0	0	113.4	R382 Y383 K384 H388 Q389 L392 Q393 L396	R382-L386 HydrophobicContact CG-CD1 4.15Å; R382-L386 WeakPolarHBondContact O-CG 3.26Å; R382-L386 PolarHBondContact O-N 3.14Å; R382-L386 VanDerWaalsContact O-N 3.1Å; Y383-L386 PolarHBondContact O-N 3.15Å; K384-L386 VanDerWaalsContact C-N 3.28Å; K384-L386 PolarHBondContact O-N 3.2Å; L386-H388 PolarHBondContact O-N 3.37Å; L386-H388 VanDerWaalsContact O-N 3.12Å; L386-Q389 HydrophobicContact CB-CB 4.42Å; L386-Q389 CarbonylContact O-C 3.51Å; L386-Q389 PolarHBondContact O-N 3.06Å; L386-L392 HydrophobicContact CD1-CB 3.76Å; L386-L392 HydrophobicContact CD1-CD1 4.07Å; L386-L392 HydrophobicContact CD2-CD1 4.45Å; L386-Q393 HydrophobicContact CB-CG 4.05Å; L386-Q393 WeakPolarHBondContact O-CG 3.35Å; L386-Q393 PolarHBondContact O-NE2 3.3Å; L386-L396 HydrophobicContact CD1-CD1 3.83Å
387	K	79.7	Confident	88	Confident	157 Å²	157	40.5 Å²	40.5	68%	0.683	20%	0.195	S	C	*	.	T	Hydrogen-bonded Turn	trans	-54.8	-33.5	-176.5	-171.8	-178.9	176.5	-173.3	0	113.6	S385	S385-K387 VanDerWaalsContact C-N 3.33Å; S385-K387 PolarHBondContact O-N 3.32Å
388	H	78	Confident	88	Confident	153 Å²	153	41 Å²	41	71%	0.708	20%	0.197	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87.9	-1.2	179.5	-59	-79.1	0	0	0	113.6	L386 P390	L386-H388 PolarHBondContact O-N 3.37Å; L386-H388 VanDerWaalsContact O-N 3.12Å; H388-P390 VanDerWaalsContact C-CD 3.49Å; H388-P390 WeakPolarHBondContact O-CD 3.42Å
389	Q	82	Confident	88.1	Confident	81 Å²	81	40.2 Å²	40.2	38%	0.379	19%	0.194	S	C	.	.			trans	-124.4	73.1	-177	-69	-178.4	-23.3	0	0	110.9	L386 H391 L392 Q393	L386-Q389 HydrophobicContact CB-CB 4.42Å; L386-Q389 CarbonylContact O-C 3.51Å; L386-Q389 PolarHBondContact O-N 3.06Å; Q389-H391 PolarHBondContact O-N 2.99Å; Q389-H391 VanDerWaalsContact O-N 3.15Å; Q389-L392 HydrophobicContact CB-CB 4.42Å; Q389-L392 HydrophobicContact CB-CD1 4.33Å; Q389-L392 HydrophobicContact CB-CG 4.49Å; Q389-L392 PolarHBondContact O-N 2.97Å; Q389-L392 VanDerWaalsContact O-N 3.17Å; Q389-L392 VanDerWaalsContact OE1-CD1 3.25Å; Q389-Q393 PolarHBondContact O-N 2.9Å; Q389-Q393 VanDerWaalsContact O-N 3.14Å
390	P	81.7	Confident	88.1	Confident	56 Å²	56	40.2 Å²	40.2	36%	0.364	19%	0.194	S	C	.	.	H	α-helix	trans	-66.4	-19.1	-172.4	27.7	-36.9	0	0	0	113.8	H388 R394	H388-P390 VanDerWaalsContact C-CD 3.49Å; H388-P390 WeakPolarHBondContact O-CD 3.42Å; P390-R394 WeakPolarHBondContact O-CG 3.36Å; P390-R394 PolarHBondContact O-N 3.39Å; P390-R394 PolarHBondContact O-NH1 2.83Å
391	H	81.7	Confident	88.2	Confident	59 Å²	59	40.2 Å²	40.2	27%	0.273	19%	0.194	S	C	.	.	H	α-helix	trans	-74	-42.6	174.7	58.1	-84.4	0	0	0	111.5	Q389 R394 G395 P879	Q389-H391 PolarHBondContact O-N 2.99Å; Q389-H391 VanDerWaalsContact O-N 3.15Å; H391-R394 WeakPolarHBondContact O-CB 3.47Å; H391-R394 PolarHBondContact O-N 3.45Å; H391-G395 PolarHBondContact O-N 2.92Å; H391-P879 HydrophobicContact CB-CG 4.08Å
392	L	87.1	Confident	88.4	Confident	2 Å²	2	37.4 Å²	37.4	1%	0.01	18%	0.181	C	C	.	.	H	α-helix	trans	-69.5	-37.7	174.5	-66.7	-178.6	0	0	0	112.1	L350 L386 Q389 R394 G395 L396	L350-L392 HydrophobicContact CD1-CD2 3.99Å; L386-L392 HydrophobicContact CD1-CB 3.76Å; L386-L392 HydrophobicContact CD1-CD1 4.07Å; L386-L392 HydrophobicContact CD2-CD1 4.45Å; Q389-L392 HydrophobicContact CB-CB 4.42Å; Q389-L392 HydrophobicContact CB-CD1 4.33Å; Q389-L392 HydrophobicContact CB-CG 4.49Å; Q389-L392 PolarHBondContact O-N 2.97Å; Q389-L392 VanDerWaalsContact O-N 3.17Å; Q389-L392 VanDerWaalsContact OE1-CD1 3.25Å; L392-R394 PolarHBondContact O-N 3.15Å; L392-G395 PolarHBondContact O-N 3.08Å; L392-G395 VanDerWaalsContact O-N 3.09Å; L392-L396 WeakPolarHBondContact O-CG 3.48Å; L392-L396 PolarHBondContact O-N 3.11Å
393	Q	89.2	Confident	88.4	Confident	22 Å²	22	34.5 Å²	34.5	10%	0.103	17%	0.17	C	C	.	.	H	α-helix	trans	-53.7	-40.9	173.2	-78.6	-172.2	-34.9	0	0	112.2	Y383 L386 Q389 L396 I397	Y383-Q393 HydrophobicContact CD1-CG 4.5Å; Y383-Q393 HydrophobicContact CD2-CB 3.79Å; Y383-Q393 HydrophobicContact CD2-CG 3.95Å; Y383-Q393 WeakPolarHBondContact CD2-O 3.45Å; Y383-Q393 HydrophobicContact CE1-CG 4.45Å; Y383-Q393 HydrophobicContact CE2-CB 3.49Å; Y383-Q393 VanDerWaalsContact CE2-CB 3.49Å; Y383-Q393 HydrophobicContact CE2-CG 3.92Å; Y383-Q393 WeakPolarHBondContact CE2-O 3.15Å; Y383-Q393 HydrophobicContact CG-CG 4.25Å; Y383-Q393 PolarHBondContact O-NE2 3.27Å; L386-Q393 HydrophobicContact CB-CG 4.05Å; L386-Q393 WeakPolarHBondContact O-CG 3.35Å; L386-Q393 PolarHBondContact O-NE2 3.3Å; Q389-Q393 PolarHBondContact O-N 2.9Å; Q389-Q393 VanDerWaalsContact O-N 3.14Å; Q393-L396 PolarHBondContact O-N 3.1Å; Q393-I397 WeakPolarHBondContact O-CG1 3.34Å; Q393-I397 PolarHBondContact O-N 3.24Å
394	R	87.4	Confident	88.4	Confident	23 Å²	23	34.3 Å²	34.3	9%	0.087	17%	0.169	C	C	.	.	H	α-helix	trans	-66.7	-42.7	175	-74.1	174	171.4	88.1	-4.2	112.8	P390 H391 L392 L396 I397 R398 E743 Y744	P390-R394 WeakPolarHBondContact O-CG 3.36Å; P390-R394 PolarHBondContact O-N 3.39Å; P390-R394 PolarHBondContact O-NH1 2.83Å; H391-R394 WeakPolarHBondContact O-CB 3.47Å; H391-R394 PolarHBondContact O-N 3.45Å; L392-R394 PolarHBondContact O-N 3.15Å; R394-L396 VanDerWaalsContact C-N 3.27Å; R394-L396 PolarHBondContact O-N 3.47Å; R394-I397 WeakPolarHBondContact O-CB 3.37Å; R394-I397 PolarHBondContact O-N 3.44Å; R394-I397 VanDerWaalsContact O-N 3.15Å; R394-R398 PolarHBondContact O-N 3.17Å; R394-E743 WeakPolarHBondContact CB-O 3.35Å; R394-E743 WeakPolarHBondContact CD-O 3.06Å; R394-E743 IonicContact CZ-OE2 3.61Å; R394-E743 IonicContact NE-OE2 3.38Å; R394-E743 PolarHBondContact NE-OE2 3.12Å; R394-E743 IonicContact NH2-OE2 3.51Å; R394-E743 PolarHBondContact NH2-OE2 3.19Å; R394-Y744 HydrophobicContact CB-CD1 3.98Å; R394-Y744 HydrophobicContact CB-CE1 4.48Å; R394-Y744 HydrophobicContact CG-CD1 3.87Å; R394-Y744 HydrophobicContact CG-CE1 3.91Å
395	G	89.2	Confident	88.6	Confident	3 Å²	3	33.2 Å²	33.2	3%	0.031	17%	0.166	C	C	.	.	H	α-helix	trans	-59.3	-37	173.2	0	0	0	0	0	113.2	H391 L392 R398 L399	H391-G395 PolarHBondContact O-N 2.92Å; L392-G395 PolarHBondContact O-N 3.08Å; L392-G395 VanDerWaalsContact O-N 3.09Å; G395-R398 PolarHBondContact O-N 3.04Å; G395-L399 PolarHBondContact O-N 3.17Å
396	L	93.4	Very high	88.7	Confident	1 Å²	1	31.8 Å²	31.8	1%	0.005	16%	0.156	C	C	.	.	H	α-helix	trans	-67	-36.4	175	-67.9	174.4	0	0	0	112.5	V341 L350 L379 R382 Y383 L386 L392 Q393 R394 R398 L399 M400	V341-L396 HydrophobicContact CG1-CD2 4.3Å; L350-L396 HydrophobicContact CD1-CD2 4.42Å; L350-L396 HydrophobicContact CD1-CG 4.42Å; L350-L396 HydrophobicContact CD2-CD2 4.03Å; L379-L396 HydrophobicContact CD2-CD2 4.03Å; R382-L396 HydrophobicContact CB-CD1 4.15Å; R382-L396 HydrophobicContact CG-CD1 3.94Å; R382-L396 HydrophobicContact CG-CD2 4.41Å; Y383-L396 HydrophobicContact CD2-CB 4.49Å; L386-L396 HydrophobicContact CD1-CD1 3.83Å; L392-L396 WeakPolarHBondContact O-CG 3.48Å; L392-L396 PolarHBondContact O-N 3.11Å; Q393-L396 PolarHBondContact O-N 3.1Å; R394-L396 VanDerWaalsContact C-N 3.27Å; R394-L396 PolarHBondContact O-N 3.47Å; L396-R398 VanDerWaalsContact C-N 3.32Å; L396-R398 PolarHBondContact O-N 2.92Å; L396-L399 HydrophobicContact CD2-CD1 4.29Å; L396-L399 WeakPolarHBondContact O-CB 3.41Å; L396-L399 PolarHBondContact O-N 3.09Å; L396-L399 VanDerWaalsContact O-N 3.17Å; L396-M400 VanDerWaalsContact O-CG 3.31Å; L396-M400 WeakPolarHBondContact O-CG 3.41Å; L396-M400 PolarHBondContact O-N 3.28Å
397	I	92.8	Very high	88.8	Confident	2 Å²	2	33.8 Å²	33.8	1%	0.01	18%	0.179	C	C	.	.	H	α-helix	trans	-59.9	-43.3	175.6	-71.1	160.9	0	0	0	110.8	Y383 Q393 R394 L399 M400 A401 I548 M693 Y744	Y383-I397 HydrophobicContact CD2-CG1 4.36Å; Y383-I397 HydrophobicContact CE2-CD1 3.79Å; Y383-I397 HydrophobicContact CE2-CG1 3.97Å; Q393-I397 WeakPolarHBondContact O-CG1 3.34Å; Q393-I397 PolarHBondContact O-N 3.24Å; R394-I397 WeakPolarHBondContact O-CB 3.37Å; R394-I397 PolarHBondContact O-N 3.44Å; R394-I397 VanDerWaalsContact O-N 3.15Å; I397-L399 VanDerWaalsContact C-N 3.35Å; I397-L399 PolarHBondContact O-N 3.43Å; I397-M400 WeakPolarHBondContact O-CB 2.9Å; I397-M400 PolarHBondContact O-N 3.35Å; I397-A401 PolarHBondContact O-N 2.85Å; I397-I548 HydrophobicContact CD1-CD1 3.37Å; I397-I548 HydrophobicContact CG1-CD1 3.81Å; I397-I548 HydrophobicContact CG2-CD1 4.03Å; I397-I548 HydrophobicContact CG2-CG2 4.03Å; I397-M693 HydrophobicContact CG2-CE 4.26Å; I397-Y744 HydrophobicContact CB-CD1 4.16Å; I397-Y744 HydrophobicContact CB-CE1 4.49Å; I397-Y744 HydrophobicContact CB-CG 4.43Å; I397-Y744 HydrophobicContact CD1-CD1 3.97Å; I397-Y744 HydrophobicContact CD1-CE1 3.5Å; I397-Y744 VanDerWaalsContact CD1-CE1 3.5Å; I397-Y744 HydrophobicContact CG2-CD1 4.02Å; I397-Y744 HydrophobicContact CG2-CD2 4Å; I397-Y744 HydrophobicContact CG2-CE1 4.31Å; I397-Y744 HydrophobicContact CG2-CE2 4.28Å; I397-Y744 HydrophobicContact CG2-CG 3.88Å
398	R	93.7	Very high	89.1	Confident	12 Å²	12	26.6 Å²	26.6	5%	0.045	15%	0.149	C	C	.	.	H	α-helix	trans	-61.4	-41.7	174.5	-177.6	-179.4	59	177.4	0.8	112.2	N351 R394 G395 L396 A401 K402 M693 A694 Y744 T746	N351-R398 VanDerWaalsContact OD1-CZ 3.26Å; N351-R398 PolarHBondContact OD1-NH1 3.44Å; N351-R398 PolarHBondContact OD1-NH2 2.9Å; R394-R398 PolarHBondContact O-N 3.17Å; G395-R398 PolarHBondContact O-N 3.04Å; L396-R398 VanDerWaalsContact C-N 3.32Å; L396-R398 PolarHBondContact O-N 2.92Å; R398-A401 PolarHBondContact O-N 3.17Å; R398-K402 PolarHBondContact O-N 3.29Å; R398-M693 WeakPolarHBondContact CG-O 3.42Å; R398-A694 WeakPolarHBondContact CG-O 3.31Å; R398-Y744 WeakPolarHBondContact CB-O 3.5Å; R398-Y744 WeakPolarHBondContact CD-O 3.42Å; R398-T746 VanDerWaalsContact NH1-CG2 3.33Å
399	L	93.8	Very high	89.4	Confident	0 Å²	0	21.8 Å²	21.8	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-63.9	-40.6	174.5	-76	172.5	0	0	0	112.3	F337 V341 L350 A353 W354 I357 L379 G395 L396 I397 A401 K402 L403	F337-L399 HydrophobicContact CE2-CD2 4.35Å; V341-L399 HydrophobicContact CG2-CD1 4.39Å; L350-L399 HydrophobicContact CB-CD1 4.06Å; L350-L399 HydrophobicContact CD2-CD1 3.76Å; L350-L399 HydrophobicContact CG-CD1 4.38Å; A353-L399 HydrophobicContact CB-CD1 4.36Å; A353-L399 HydrophobicContact CB-CD2 4.39Å; W354-L399 HydrophobicContact CB-CD2 3.67Å; W354-L399 HydrophobicContact CG-CD2 4.26Å; I357-L399 HydrophobicContact CD1-CD2 4.16Å; L379-L399 HydrophobicContact CD1-CB 3.87Å; G395-L399 PolarHBondContact O-N 3.17Å; L396-L399 HydrophobicContact CD2-CD1 4.29Å; L396-L399 WeakPolarHBondContact O-CB 3.41Å; L396-L399 PolarHBondContact O-N 3.09Å; L396-L399 VanDerWaalsContact O-N 3.17Å; I397-L399 VanDerWaalsContact C-N 3.35Å; I397-L399 PolarHBondContact O-N 3.43Å; L399-A401 VanDerWaalsContact C-N 3.34Å; L399-A401 PolarHBondContact O-N 3.14Å; L399-K402 PolarHBondContact O-N 2.86Å; L399-L403 WeakPolarHBondContact O-CB 3.46Å; L399-L403 WeakPolarHBondContact O-CG 3.23Å; L399-L403 PolarHBondContact O-N 2.68Å
400	M	95.1	Very high	89.7	Confident	0 Å²	0	18.2 Å²	18.2	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-59.1	-46.1	174.5	-68.1	173.8	-176.2	0	0	110.8	L376 L379 V380 L396 I397 K402 L403 V404 L545 L552	L376-M400 HydrophobicContact CD1-CB 3.96Å; L376-M400 HydrophobicContact CD1-CG 3.85Å; L379-M400 VanDerWaalsContact C-CE 3.41Å; L379-M400 HydrophobicContact CB-CE 3.66Å; L379-M400 HydrophobicContact CB-CG 3.95Å; L379-M400 HydrophobicContact CD1-CB 4.42Å; L379-M400 HydrophobicContact CD1-CG 3.69Å; L379-M400 WeakPolarHBondContact O-CE 3.02Å; V380-M400 HydrophobicContact CB-CE 4.46Å; V380-M400 HydrophobicContact CG2-CE 3.82Å; L396-M400 VanDerWaalsContact O-CG 3.31Å; L396-M400 WeakPolarHBondContact O-CG 3.41Å; L396-M400 PolarHBondContact O-N 3.28Å; I397-M400 WeakPolarHBondContact O-CB 2.9Å; I397-M400 PolarHBondContact O-N 3.35Å; M400-K402 PolarHBondContact O-N 2.99Å; M400-L403 PolarHBondContact O-N 2.86Å; M400-V404 VanDerWaalsContact O-CG2 3.24Å; M400-V404 WeakPolarHBondContact O-CG2 3.47Å; M400-V404 PolarHBondContact O-N 2.88Å; M400-L545 HydrophobicContact CE-CD1 4.14Å; M400-L545 HydrophobicContact SD-CD1 4.09Å; M400-L552 HydrophobicContact CB-CD1 4.29Å
401	A	94	Very high	90	Very high	1 Å²	1	15.6 Å²	15.6	1%	0.008	9%	0.094	C	C	.	.	H	α-helix	trans	-61.2	-43.8	176.5	0	0	0	0	0	112.1	I397 R398 L399 V404 I405 L552 M693 A694	I397-A401 PolarHBondContact O-N 2.85Å; R398-A401 PolarHBondContact O-N 3.17Å; L399-A401 VanDerWaalsContact C-N 3.34Å; L399-A401 PolarHBondContact O-N 3.14Å; A401-V404 PolarHBondContact O-N 3.48Å; A401-I405 WeakPolarHBondContact O-CD1 3.44Å; A401-I405 VanDerWaalsContact O-CG1 3.29Å; A401-I405 WeakPolarHBondContact O-CG1 3.47Å; A401-I405 PolarHBondContact O-N 3.2Å; A401-I405 VanDerWaalsContact O-N 3.08Å; A401-L552 HydrophobicContact CB-CD2 4.08Å; A401-M693 HydrophobicContact CB-CB 4.37Å; A401-A694 HydrophobicContact CB-CB 3.83Å
402	K	94.3	Very high	90.2	Very high	12 Å²	12	12.9 Å²	12.9	5%	0.052	8%	0.082	C	C	.	.	H	α-helix	trans	-64.2	-42	176.6	-172.9	70.2	174.7	-159	0	112.6	W354 I357 E358 R398 L399 M400 V404 I405 S406 A694 D696	W354-K402 HydrophobicContact CZ2-CD 3.83Å; W354-K402 VanDerWaalsContact CZ2-NZ 3.32Å; I357-K402 HydrophobicContact CB-CG 4.37Å; I357-K402 HydrophobicContact CD1-CB 4.21Å; I357-K402 HydrophobicContact CD1-CG 3.87Å; I357-K402 HydrophobicContact CG2-CG 4.1Å; E358-K402 IonicContact OE1-NZ 3.18Å; E358-K402 PolarHBondContact OE1-NZ 3.42Å; R398-K402 PolarHBondContact O-N 3.29Å; L399-K402 PolarHBondContact O-N 2.86Å; M400-K402 PolarHBondContact O-N 2.99Å; K402-V404 VanDerWaalsContact C-N 3.33Å; K402-V404 PolarHBondContact O-N 3.38Å; K402-I405 WeakPolarHBondContact O-CB 3.49Å; K402-I405 PolarHBondContact O-N 3.1Å; K402-S406 PolarHBondContact O-N 2.86Å; K402-A694 HydrophobicContact CB-CB 4.39Å; K402-D696 IonicContact NZ-OD2 2.7Å; K402-D696 PolarHBondContact NZ-OD2 3.2Å
403	L	92.6	Very high	90.1	Very high	0 Å²	0	13.8 Å²	13.8	0%	0	9%	0.085	C	C	.	.	H	α-helix	trans	-60.9	-42.5	176.3	-79.2	-176.7	0	0	0	112	F337 I357 F362 L379 L399 M400 I405 S406 G407 V408	F337-L403 HydrophobicContact CE1-CD1 4.17Å; F337-L403 HydrophobicContact CE1-CD2 4.28Å; F337-L403 HydrophobicContact CZ-CD1 3.99Å; F337-L403 HydrophobicContact CZ-CD2 4.03Å; F337-L403 HydrophobicContact CZ-CG 4.23Å; I357-L403 HydrophobicContact CD1-CD2 3.68Å; I357-L403 HydrophobicContact CD1-CG 4.02Å; I357-L403 HydrophobicContact CG1-CD2 4.04Å; F362-L403 HydrophobicContact CE1-CD2 3.96Å; F362-L403 HydrophobicContact CE2-CD2 4.48Å; F362-L403 HydrophobicContact CZ-CD2 3.49Å; F362-L403 VanDerWaalsContact CZ-CD2 3.49Å; L379-L403 HydrophobicContact CD1-CD1 3.45Å; L379-L403 VanDerWaalsContact CD1-CD1 3.45Å; L379-L403 HydrophobicContact CD1-CG 4.41Å; L379-L403 HydrophobicContact CG-CD1 4.1Å; L399-L403 WeakPolarHBondContact O-CB 3.46Å; L399-L403 WeakPolarHBondContact O-CG 3.23Å; L399-L403 PolarHBondContact O-N 2.68Å; M400-L403 PolarHBondContact O-N 2.86Å; L403-I405 VanDerWaalsContact C-N 3.34Å; L403-I405 PolarHBondContact O-N 3.28Å; L403-S406 WeakPolarHBondContact CA-OG 3.46Å; L403-S406 PolarHBondContact O-N 3.25Å; L403-S406 VanDerWaalsContact O-N 3.09Å; L403-S406 PolarHBondContact O-OG 3.28Å; L403-G407 PolarHBondContact O-N 3.48Å; L403-V408 HydrophobicContact CB-CB 4.39Å; L403-V408 HydrophobicContact CB-CG2 3.89Å; L403-V408 HydrophobicContact CD2-CG2 4.08Å; L403-V408 HydrophobicContact CG-CG2 4.45Å; L403-V408 WeakPolarHBondContact O-CB 3.22Å; L403-V408 WeakPolarHBondContact O-CG2 3.49Å; L403-V408 PolarHBondContact O-N 3.4Å
404	V	91.8	Very high	89.8	Confident	4 Å²	4	13.4 Å²	13.4	2%	0.024	8%	0.084	C	C	.	.	H	α-helix	trans	-63.2	-41.4	177.5	168.2	0	0	0	0	111.1	M400 A401 K402 S406 G407 L410 L552 W641	M400-V404 VanDerWaalsContact O-CG2 3.24Å; M400-V404 WeakPolarHBondContact O-CG2 3.47Å; M400-V404 PolarHBondContact O-N 2.88Å; A401-V404 PolarHBondContact O-N 3.48Å; K402-V404 VanDerWaalsContact C-N 3.33Å; K402-V404 PolarHBondContact O-N 3.38Å; V404-S406 VanDerWaalsContact C-N 3.29Å; V404-S406 PolarHBondContact O-N 3.05Å; V404-G407 PolarHBondContact O-N 3.45Å; V404-L410 HydrophobicContact CG1-CD1 3.72Å; V404-L410 HydrophobicContact CG1-CD2 4.25Å; V404-L410 HydrophobicContact CG1-CG 4.05Å; V404-L410 HydrophobicContact CG2-CD1 4.43Å; V404-L410 HydrophobicContact CG2-CD2 3.47Å; V404-L410 VanDerWaalsContact CG2-CD2 3.47Å; V404-L410 HydrophobicContact CG2-CG 3.89Å; V404-L552 HydrophobicContact CG2-CD1 4.25Å; V404-W641 HydrophobicContact CG1-CE3 3.58Å; V404-W641 HydrophobicContact CG1-CH2 4.13Å; V404-W641 HydrophobicContact CG1-CZ3 3.23Å
405	I	91.4	Very high	89.5	Confident	25 Å²	25	18.3 Å²	18.3	13%	0.128	11%	0.106	C	C	.	.	H	α-helix	trans	-62.6	-35.3	172.6	-65.4	160.3	0	0	0	111.8	A401 K402 L403 G407 I690 Y691 A694 K699	A401-I405 WeakPolarHBondContact O-CD1 3.44Å; A401-I405 VanDerWaalsContact O-CG1 3.29Å; A401-I405 WeakPolarHBondContact O-CG1 3.47Å; A401-I405 PolarHBondContact O-N 3.2Å; A401-I405 VanDerWaalsContact O-N 3.08Å; K402-I405 WeakPolarHBondContact O-CB 3.49Å; K402-I405 PolarHBondContact O-N 3.1Å; L403-I405 VanDerWaalsContact C-N 3.34Å; L403-I405 PolarHBondContact O-N 3.28Å; I405-G407 PolarHBondContact O-N 3.37Å; I405-I690 HydrophobicContact CD1-CG2 3.69Å; I405-I690 HydrophobicContact CG1-CG2 3.65Å; I405-Y691 HydrophobicContact CD1-CD1 3.72Å; I405-Y691 HydrophobicContact CD1-CE1 4.11Å; I405-Y691 HydrophobicContact CG1-CD1 4.23Å; I405-Y691 HydrophobicContact CG1-CE1 4.12Å; I405-Y691 HydrophobicContact CG2-CE1 4.19Å; I405-A694 HydrophobicContact CD1-CB 3.31Å; I405-K699 HydrophobicContact CG2-CD 4.25Å
406	S	89.3	Confident	88.8	Confident	42 Å²	42	23.9 Å²	23.9	29%	0.294	13%	0.129	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.4	-4.4	178.1	77.7	0	0	0	0	114.3	K402 L403 V404	K402-S406 PolarHBondContact O-N 2.86Å; L403-S406 WeakPolarHBondContact CA-OG 3.46Å; L403-S406 PolarHBondContact O-N 3.25Å; L403-S406 VanDerWaalsContact O-N 3.09Å; L403-S406 PolarHBondContact O-OG 3.28Å; V404-S406 VanDerWaalsContact C-N 3.29Å; V404-S406 PolarHBondContact O-N 3.05Å
407	G	86.1	Confident	88	Confident	54 Å²	54	23.9 Å²	23.9	56%	0.557	13%	0.13	S	C	*	.	T	Hydrogen-bonded Turn	trans	97.1	16.6	175.7	0	0	0	0	0	115.3	L403 V404 I405 D409	L403-G407 PolarHBondContact O-N 3.48Å; V404-G407 PolarHBondContact O-N 3.45Å; I405-G407 PolarHBondContact O-N 3.37Å; G407-D409 PolarHBondContact O-N 3.19Å
408	V	87.2	Confident	87.6	Confident	7 Å²	7	24 Å²	24	4%	0.042	13%	0.131	C	C	.	.			trans	-60.6	131.2	168.7	175.9	0	0	0	0	109.4	L376 L403 L410	L376-V408 HydrophobicContact CB-CG1 4.08Å; L403-V408 HydrophobicContact CB-CB 4.39Å; L403-V408 HydrophobicContact CB-CG2 3.89Å; L403-V408 HydrophobicContact CD2-CG2 4.08Å; L403-V408 HydrophobicContact CG-CG2 4.45Å; L403-V408 WeakPolarHBondContact O-CB 3.22Å; L403-V408 WeakPolarHBondContact O-CG2 3.49Å; L403-V408 PolarHBondContact O-N 3.4Å; V408-L410 PolarHBondContact O-N 3.09Å; V408-L410 VanDerWaalsContact O-N 3.14Å
409	D	84.5	Confident	87.3	Confident	51 Å²	51	23.6 Å²	23.6	27%	0.273	13%	0.129	S	C	.	.			trans	-73.6	107.4	-178.2	-174.5	18.8	0	0	0	112	R7 G407 Q411 A412	R7-D409 IonicContact CZ-OD1 2.68Å; R7-D409 IonicContact CZ-OD2 2.7Å; R7-D409 IonicContact NH1-OD1 2.85Å; R7-D409 PolarHBondContact NH1-OD1 3.41Å; R7-D409 IonicContact NH1-OD2 3.4Å; R7-D409 IonicContact NH2-OD1 2.98Å; R7-D409 PolarHBondContact NH2-OD1 3.48Å; R7-D409 IonicContact NH2-OD2 3.76Å; R7-D409 PolarHBondContact NH2-OD2 3.31Å; G407-D409 PolarHBondContact O-N 3.19Å; D409-Q411 VanDerWaalsContact C-N 3.27Å; D409-Q411 PolarHBondContact O-N 3.19Å; D409-Q411 PolarHBondContact OD1-N 2.64Å; D409-A412 HydrophobicContact CB-CB 4.13Å; D409-A412 WeakPolarHBondContact O-CB 3.07Å; D409-A412 PolarHBondContact O-N 3.38Å
410	L	87.3	Confident	87	Confident	6 Å²	6	23.6 Å²	23.6	3%	0.031	13%	0.129	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.5	-34.3	-178.6	-83.7	161.6	0	0	0	114.1	L376 V404 V408 L552 A644	L376-L410 HydrophobicContact CD2-CD2 3.83Å; V404-L410 HydrophobicContact CG1-CD1 3.72Å; V404-L410 HydrophobicContact CG1-CD2 4.25Å; V404-L410 HydrophobicContact CG1-CG 4.05Å; V404-L410 HydrophobicContact CG2-CD1 4.43Å; V404-L410 HydrophobicContact CG2-CD2 3.47Å; V404-L410 VanDerWaalsContact CG2-CD2 3.47Å; V404-L410 HydrophobicContact CG2-CG 3.89Å; V408-L410 PolarHBondContact O-N 3.09Å; V408-L410 VanDerWaalsContact O-N 3.14Å; L410-L552 WeakPolarHBondContact CD1-O 3.27Å; L410-L552 HydrophobicContact CD2-CB 4.03Å; L410-A644 HydrophobicContact CD1-CB 3.82Å
411	Q	87.9	Confident	86.8	Confident	2 Å²	2	23.7 Å²	23.7	1%	0.009	13%	0.129	C	C	.	.	T	Hydrogen-bonded Turn	trans	-106	21.2	-179.4	-2.4	-80.4	25.4	0	0	112.7	R7 D409 G553 S554 D555 I558	R7-Q411 VanDerWaalsContact CZ-CG 3.49Å; R7-Q411 PolarHBondContact NH2-O 3.14Å; R7-Q411 VanDerWaalsContact NH2-O 3.12Å; D409-Q411 VanDerWaalsContact C-N 3.27Å; D409-Q411 PolarHBondContact O-N 3.19Å; D409-Q411 PolarHBondContact OD1-N 2.64Å; Q411-G553 PolarHBondContact NE2-O 3.5Å; Q411-S554 VanDerWaalsContact OE1-CA 3.26Å; Q411-D555 VanDerWaalsContact NE2-CB 3.34Å; Q411-D555 VanDerWaalsContact OE1-N 3.08Å; Q411-I558 HydrophobicContact CB-CD1 3.51Å; Q411-I558 HydrophobicContact CG-CD1 3.98Å
412	A	86	Confident	86.4	Confident	1 Å²	1	23.8 Å²	23.8	1%	0.008	13%	0.13	C	C	.	.			trans	-59.3	145.1	168.9	0	0	0	0	0	109.5	T374 H377 D409	T374-A412 HydrophobicContact CG2-CB 3.57Å; H377-A412 PolarHBondContact CE1-O 3Å; H377-A412 VanDerWaalsContact CE1-O 3.24Å; D409-A412 HydrophobicContact CB-CB 4.13Å; D409-A412 WeakPolarHBondContact O-CB 3.07Å; D409-A412 PolarHBondContact O-N 3.38Å
413	R	84.8	Confident	86	Confident	22 Å²	22	24 Å²	24	8%	0.083	13%	0.133	C	C	.	.			trans	-104.8	145.6	174.6	-66.1	-177.4	179.4	176.6	-0.2	111.5	N6 R367 G417 N418 T419 P559	N6-R413 PolarHBondContact O-NH2 3.21Å; R367-R413 PolarHBondContact NH1-O 2.94Å; R413-G417 WeakPolarHBondContact CD-O 3.47Å; R413-N418 CarbonylContact C-O 3.54Å; R413-N418 VanDerWaalsContact CA-O 3.3Å; R413-N418 WeakPolarHBondContact CA-O 3.49Å; R413-T419 HydrophobicContact CG-CG2 4.22Å; R413-P559 PolarHBondContact NH2-O 3.21Å
414	D	83.9	Confident	85.8	Confident	13 Å²	13	24 Å²	24	7%	0.07	13%	0.133	C	C	.	.			trans	-75.4	178.1	165.5	70.5	12.5	0	0	0	111.5	F416 G417 N418	D414-F416 PolarHBondContact O-N 2.96Å; D414-F416 VanDerWaalsContact O-N 3.1Å; D414-F416 VanDerWaalsContact OD1-CA 3.24Å; D414-F416 WeakPolarHBondContact OD1-CA 3.37Å; D414-F416 WeakPolarHBondContact OD1-CB 3.21Å; D414-F416 PolarHBondContact OD1-N 3.3Å; D414-G417 PolarHBondContact O-N 2.76Å; D414-G417 PolarHBondContact OD1-N 2.82Å; D414-N418 PolarHBondContact N-O 2.61Å; D414-N418 PolarHBondContact OD1-N 3.26Å; D414-N418 PolarHBondContact OD1-ND2 3.29Å; D414-N418 WeakPolarHBondContact OD2-CB 3.38Å; D414-N418 PolarHBondContact OD2-ND2 2.84Å
415	K	79.9	Confident	85.4	Confident	126 Å²	126	24.1 Å²	24.1	55%	0.548	13%	0.134	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.1	-25.7	176	-177.7	178.6	179.9	-179.9	0	112.5	D371 K561	D371-K415 VanDerWaalsContact O-CB 3.24Å; D371-K415 WeakPolarHBondContact O-CB 3.43Å; D371-K415 PolarHBondContact O-N 2.91Å; K415-K561 WeakPolarHBondContact O-CE 3.28Å; K415-K561 PolarHBondContact O-NZ 3.02Å
416	F	76	Confident	84.7	Confident	120 Å²	120	27 Å²	27	53%	0.526	15%	0.146	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.9	-1.5	178.3	-50	-75	0	0	0	113	D371 D414 N418 K561	D371-F416 HydrophobicContact CB-CE2 4.19Å; D414-F416 PolarHBondContact O-N 2.96Å; D414-F416 VanDerWaalsContact O-N 3.1Å; D414-F416 VanDerWaalsContact OD1-CA 3.24Å; D414-F416 WeakPolarHBondContact OD1-CA 3.37Å; D414-F416 WeakPolarHBondContact OD1-CB 3.21Å; D414-F416 PolarHBondContact OD1-N 3.3Å; F416-N418 VanDerWaalsContact C-N 3.34Å; F416-N418 WeakPolarHBondContact CB-ND2 3.32Å; F416-K561 WeakPolarHBondContact O-CB 3.24Å
417	G	75.8	Confident	83.6	Confident	1 Å²	1	29.7 Å²	29.7	1%	0.01	16%	0.157	C	C	.	.	S	Bend	trans	80.7	6.8	-177.1	0	0	0	0	0	114.9	R413 D414 C560	R413-G417 WeakPolarHBondContact CD-O 3.47Å; D414-G417 PolarHBondContact O-N 2.76Å; D414-G417 PolarHBondContact OD1-N 2.82Å; G417-C560 WeakPolarHBondContact O-CA 3.47Å
418	N	83.6	Confident	82.1	Confident	6 Å²	6	32.6 Å²	32.6	3%	0.032	16%	0.159	C	C	.	.			trans	-78.2	139.5	177.8	-45.4	-58	0	0	0	109.7	H377 R413 D414 F416 L422 K426	H377-N418 PolarHBondContact NE2-O 2.89Å; H377-N418 VanDerWaalsContact NE2-O 3.15Å; R413-N418 CarbonylContact C-O 3.54Å; R413-N418 VanDerWaalsContact CA-O 3.3Å; R413-N418 WeakPolarHBondContact CA-O 3.49Å; D414-N418 PolarHBondContact N-O 2.61Å; D414-N418 PolarHBondContact OD1-N 3.26Å; D414-N418 PolarHBondContact OD1-ND2 3.29Å; D414-N418 WeakPolarHBondContact OD2-CB 3.38Å; D414-N418 PolarHBondContact OD2-ND2 2.84Å; F416-N418 VanDerWaalsContact C-N 3.34Å; F416-N418 WeakPolarHBondContact CB-ND2 3.32Å; N418-L422 HydrophobicContact CB-CB 3.98Å; N418-K426 PolarHBondContact ND2-NZ 2.96Å; N418-K426 VanDerWaalsContact OD1-CE 3.31Å; N418-K426 WeakPolarHBondContact OD1-CE 3.19Å; N418-K426 PolarHBondContact OD1-NZ 3.37Å
419	T	88.1	Confident	79.6	Confident	2 Å²	2	36.1 Å²	36.1	1%	0.012	19%	0.189	C	C	.	.			trans	-83.2	165	162.1	58.5	0	0	0	0	109.8	H377 R413 L421 L422 C423 I558	H377-T419 VanDerWaalsContact NE2-C 3.31Å; R413-T419 HydrophobicContact CG-CG2 4.22Å; T419-L421 PolarHBondContact O-N 2.87Å; T419-L421 VanDerWaalsContact O-N 3.14Å; T419-L422 WeakPolarHBondContact O-CA 3.19Å; T419-L422 WeakPolarHBondContact O-CB 3.34Å; T419-L422 PolarHBondContact O-N 3.2Å; T419-L422 PolarHBondContact OG1-N 3.06Å; T419-C423 PolarHBondContact O-N 3.03Å; T419-I558 HydrophobicContact CG2-CB 4.49Å; T419-I558 HydrophobicContact CG2-CG2 3.89Å
420	A	88.5	Confident	77.1	Confident	0 Å²	0	41.9 Å²	41.9	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-55.3	-34.4	174.9	0	0	0	0	0	112.2	L376 H377 V380 C423 A424	L376-A420 HydrophobicContact CB-CB 4.4Å; L376-A420 HydrophobicContact CD2-CB 3.75Å; L376-A420 HydrophobicContact CG-CB 3.71Å; H377-A420 PolarHBondContact NE2-N 3.34Å; H377-A420 VanDerWaalsContact NE2-N 3.11Å; V380-A420 HydrophobicContact CG2-CB 4.32Å; A420-C423 PolarHBondContact O-N 2.87Å; A420-A424 PolarHBondContact O-N 3.12Å
421	L	89.4	Confident	74.3	Confident	2 Å²	2	46.7 Å²	46.7	1%	0.01	25%	0.248	C	C	.	.	H	α-helix	trans	-60.4	-45.3	172.4	-179.2	70.7	0	0	0	112.6	T419 A424 A425 I546 L549 I550 C556 V566	T419-L421 PolarHBondContact O-N 2.87Å; T419-L421 VanDerWaalsContact O-N 3.14Å; L421-A424 WeakPolarHBondContact O-CB 3.41Å; L421-A424 PolarHBondContact O-N 3.12Å; L421-A425 WeakPolarHBondContact O-CB 3.45Å; L421-A425 PolarHBondContact O-N 3.02Å; L421-I546 HydrophobicContact CD1-CG2 3.98Å; L421-L549 HydrophobicContact CB-CD1 4.4Å; L421-L549 HydrophobicContact CD1-CB 3.81Å; L421-L549 HydrophobicContact CD1-CD1 4.26Å; L421-I550 HydrophobicContact CD1-CG1 4.34Å; L421-C556 HydrophobicContact CD2-CB 4.24Å; L421-C556 VanDerWaalsContact CD2-SG 3.53Å; L421-V566 HydrophobicContact CD2-CB 4.41Å; L421-V566 HydrophobicContact CD2-CG2 4.22Å; L421-V566 HydrophobicContact CG-CG2 4.13Å
422	L	86.3	Confident	71.4	Confident	3 Å²	3	52.2 Å²	52.2	2%	0.016	28%	0.278	C	S	.	.	H	α-helix	trans	-67.1	-38	176.5	-77.3	163.7	0	0	0	111.5	N418 T419 A424 A425 K426 C560 V566	N418-L422 HydrophobicContact CB-CB 3.98Å; T419-L422 WeakPolarHBondContact O-CA 3.19Å; T419-L422 WeakPolarHBondContact O-CB 3.34Å; T419-L422 PolarHBondContact O-N 3.2Å; T419-L422 PolarHBondContact OG1-N 3.06Å; L422-A424 VanDerWaalsContact C-N 3.32Å; L422-A424 PolarHBondContact O-N 3.25Å; L422-A425 PolarHBondContact O-N 3.46Å; L422-K426 WeakPolarHBondContact O-CG 3.23Å; L422-K426 PolarHBondContact O-N 3.34Å; L422-C560 HydrophobicContact CD1-CB 4Å; L422-V566 HydrophobicContact CD2-CG2 4.02Å
423	C	86.5	Confident	68.6	Low	16 Å²	16	61.8 Å²	61.8	11%	0.108	32%	0.319	C	S	.	.	H	α-helix	trans	-62.6	-37.8	174.1	-67.5	0	0	0	0	112.5	V380 K384 T419 A420	V380-C423 HydrophobicContact CG1-CB 4.11Å; K384-C423 PolarHBondContact NZ-O 2.99Å; T419-C423 PolarHBondContact O-N 3.03Å; A420-C423 PolarHBondContact O-N 2.87Å
424	A	86.8	Confident	65.9	Low	2 Å²	2	68.2 Å²	68.2	2%	0.017	36%	0.355	C	S	.	.	H	α-helix	trans	-65.9	-40.3	173.8	0	0	0	0	0	112.3	V380 A420 L421 L422 L545 I546 L549	V380-A424 HydrophobicContact CG1-CB 3.86Å; A420-A424 PolarHBondContact O-N 3.12Å; L421-A424 WeakPolarHBondContact O-CB 3.41Å; L421-A424 PolarHBondContact O-N 3.12Å; L422-A424 VanDerWaalsContact C-N 3.32Å; L422-A424 PolarHBondContact O-N 3.25Å; A424-L545 HydrophobicContact CB-CD2 3.56Å; A424-L545 HydrophobicContact CB-CG 3.85Å; A424-I546 HydrophobicContact CB-CG1 4.49Å; A424-L549 HydrophobicContact CB-CD1 3.63Å
425	A	83.7	Confident	63.3	Low	5 Å²	5	72.4 Å²	72.4	4%	0.041	38%	0.381	C	S	.	.	H	α-helix	trans	-79.4	-18.2	-177.1	0	0	0	0	0	114.5	L421 L422 S541 I546 V566 I579	L421-A425 WeakPolarHBondContact O-CB 3.45Å; L421-A425 PolarHBondContact O-N 3.02Å; L422-A425 PolarHBondContact O-N 3.46Å; A425-S541 VanDerWaalsContact O-CB 3.28Å; A425-S541 WeakPolarHBondContact O-CB 3.42Å; A425-I546 HydrophobicContact CB-CD1 3.8Å; A425-I546 HydrophobicContact CB-CG1 4.27Å; A425-V566 HydrophobicContact CB-CG2 3.92Å; A425-I579 HydrophobicContact CB-CD1 3.62Å; A425-I579 HydrophobicContact CB-CG1 3.62Å; A425-I579 WeakPolarHBondContact O-CD1 3.45Å
426	K	78	Confident	60.7	Low	86 Å²	86	73.8 Å²	73.8	37%	0.374	40%	0.395	S	S	.	.	S	Bend	trans	-70.5	130.8	177.2	-80.4	178.5	-178.9	-176.6	0	111.2	K384 N418 L422 I579	K384-K426 PolarHBondContact NZ-O 3.36Å; N418-K426 PolarHBondContact ND2-NZ 2.96Å; N418-K426 VanDerWaalsContact OD1-CE 3.31Å; N418-K426 WeakPolarHBondContact OD1-CE 3.19Å; N418-K426 PolarHBondContact OD1-NZ 3.37Å; L422-K426 WeakPolarHBondContact O-CG 3.23Å; L422-K426 PolarHBondContact O-N 3.34Å; K426-I579 HydrophobicContact CB-CD1 4.43Å; K426-I579 HydrophobicContact CG-CD1 3.82Å
427	L	66.2	Low	58.5	Low	99 Å²	99	72.8 Å²	72.8	52%	0.518	40%	0.402	S	S	.	.			trans	-69.7	143.7	171.8	-69.6	165.5	0	0	0	110.7	A429 D539	L427-A429 PolarHBondContact O-N 2.77Å; L427-D539 WeakPolarHBondContact CD1-O 3.35Å; L427-D539 HydrophobicContact CD2-CB 4.24Å; L427-D539 WeakPolarHBondContact CD2-O 3.5Å
428	N	54	Low	56.3	Low	114 Å²	114	80.9 Å²	80.9	61%	0.61	44%	0.444	S	S	*	.	S	Bend	trans	-70.3	18.7	-177.8	-72.9	-5.6	0	0	0	114.4	K384	K384-N428 WeakPolarHBondContact CE-OD1 3.48Å; K384-N428 PolarHBondContact NZ-OD1 3.19Å
429	A	34.7	Very low	53.7	Low	82 Å²	82	89.5 Å²	89.5	68%	0.678	48%	0.481	S	S	*	.			trans	-120.9	50.1	-166.2	0	0	0	0	0	114.8	L427	L427-A429 PolarHBondContact O-N 2.77Å
430	I	31.6	Very low	50.7	Low	171 Å²	171	93.3 Å²	93.3	88%	0.877	51%	0.513	S	S	*	.	S	Bend	trans	-127	9.9	160.2	-57.8	179.6	0	0	0	111.6
431	T	28.2	Very low	47.8	Very low	108 Å²	108	100.3 Å²	100.3	66%	0.663	55%	0.55	S	S	*	*	S	Bend	trans	-114	134.6	162.4	49.9	0	0	0	0	107
432	D	27.2	Very low	45	Very low	118 Å²	118	108.4 Å²	108.4	63%	0.631	59%	0.588	S	S	*	*	S	Bend	trans	82.5	49	177.4	-52.4	-32	0	0	0	119.5	T435	D432-T435 PolarHBondContact OD1-OG1 3.12Å
433	K	28.6	Very low	42.3	Very low	202 Å²	202	113.2 Å²	113.2	88%	0.878	62%	0.622	S	S	*	*	S	Bend	trans	-122.9	6.6	153.1	-77.5	-166.9	177	-179.1	0	116.3
434	N	27.5	Very low	39.2	Very low	157 Å²	157	120.8 Å²	120.8	84%	0.84	66%	0.658	S	S	*	*	S	Bend	trans	-117.4	7.2	170.9	-79.1	-3.3	0	0	0	114.7
435	T	28.5	Very low	36.3	Very low	100 Å²	100	125.4 Å²	125.4	61%	0.613	69%	0.688	S	S	*	*	S	Bend	trans	-109.3	20	178.7	38.6	0	0	0	0	113.6	D432	D432-T435 PolarHBondContact OD1-OG1 3.12Å
436	N	26.6	Very low	33.3	Very low	156 Å²	156	132.4 Å²	132.4	83%	0.834	72%	0.724	S	S	*	*	S	Bend	trans	-117.9	59.4	170.4	-78.8	-25.3	0	0	0	110.9
437	S	29.1	Very low	30.8	Very low	98 Å²	98	137.1 Å²	137.1	69%	0.685	75%	0.748	S	S	*	*			trans	-149.2	5.6	164.9	62.2	0	0	0	0	115.8	K439	S437-K439 PolarHBondContact O-N 3.14Å
438	I	29.9	Very low	28.9	Very low	171 Å²	171	139.9 Å²	139.9	88%	0.877	76%	0.761	S	S	*	*	S	Bend	trans	-97.7	92.6	164.4	-58	178.8	0	0	0	107.2
439	K	28.2	Very low	27.7	Very low	187 Å²	187	141 Å²	141	81%	0.813	77%	0.768	S	S	*	*			trans	-57.8	141.1	176.8	-69.7	169.4	172.3	174.5	0	110.9	S437	S437-K439 PolarHBondContact O-N 3.14Å
440	A	26.2	Very low	27.3	Very low	83 Å²	83	147.1 Å²	147.1	69%	0.686	78%	0.779	S	S	*	*			trans	38.3	105	131.4	0	0	0	0	0	116.6
441	N	27.6	Very low	27.1	Very low	147 Å²	147	147 Å²	147	79%	0.786	77%	0.774	S	S	*	*				-176.7	147.8	113.4	-89.3	-13.4	0	0	0	110.3
442	E	29	Very low	27	Very low	171 Å²	171	152 Å²	152	80%	0.799	79%	0.787	S	S	*	*			trans	85	90.9	157.5	-68.1	163.8	-157.3	0	0	119
443	S	29.7	Very low	26.9	Very low	105 Å²	105	154.5 Å²	154.5	73%	0.734	80%	0.795	S	S	*	*				31	113.2	120.6	52.7	0	0	0	0	120
444	M	22.1	Very low	26.9	Very low	175 Å²	175	155.7 Å²	155.7	86%	0.862	79%	0.794	S	S	*	*			trans	14.7	149.8	130.8	-76.5	-88.5	145.1	0	0	119.7
445	P	25	Very low	27	Very low	99 Å²	99	157.1 Å²	157.1	64%	0.643	80%	0.796	S	S	*	*			cis	-139	171.6	9.8	37.5	-16.9	0	0	0	116.2
446	N	22.5	Very low	26.8	Very low	151 Å²	151	159.9 Å²	159.9	81%	0.807	81%	0.807	S	S	*	*			trans	42.8	131	151.6	-68	-20.3	0	0	0	122.2
447	Q	25.3	Very low	27	Very low	186 Å²	186	161.3 Å²	161.3	87%	0.869	81%	0.806	S	S	*	*			trans	107	146.4	170.3	-65	176.8	-13.7	0	0	113.4
448	I	26.5	Very low	26.9	Very low	156 Å²	156	162 Å²	162	80%	0.8	81%	0.805	S	S	*	*			trans	96.8	104.5	-163.6	-54.8	162.5	0	0	0	110.8
449	D	28.4	Very low	26.9	Very low	139 Å²	139	161.8 Å²	161.8	74%	0.743	80%	0.801	S	S	*	*			cis	-146.2	121.3	10.3	-77.1	-40.1	0	0	0	110.9
450	K	25.5	Very low	26.9	Very low	210 Å²	210	160.6 Å²	160.6	91%	0.913	80%	0.803	S	S	*	*			trans	-111.7	91.6	157.5	-86.9	-173.5	174.7	-178.1	0	106.7
451	E	26.8	Very low	26.9	Very low	168 Å²	168	160.3 Å²	160.3	79%	0.785	81%	0.809	S	S	*	*			trans	-149.2	104	162.3	-66.7	-173.1	165.9	0	0	104.8
452	F	26.2	Very low	26.9	Very low	212 Å²	212	158 Å²	158	93%	0.93	81%	0.81	S	S	*	*				-155.2	95.1	85.1	-97.3	-95.5	0	0	0	109.1
453	E	26.7	Very low	26.7	Very low	172 Å²	172	156.1 Å²	156.1	80%	0.804	81%	0.81	S	S	*	*	S	Bend	trans	-143.7	128.6	151.8	-83.3	-168.1	173.8	0	0	106.7
454	R	26.6	Very low	26.7	Very low	227 Å²	227	159 Å²	159	86%	0.857	82%	0.816	S	S	*	*			trans	81.9	109.3	177.5	-45.3	174.6	-161.8	-179.3	3.4	114.8
455	E	29.5	Very low	26.8	Very low	186 Å²	186	157.1 Å²	157.1	87%	0.869	81%	0.81	S	S	*	*				-179.3	119.7	89.1	-89.6	-177.9	174.2	0	0	109.9
456	D	25.9	Very low	26.9	Very low	158 Å²	158	157.9 Å²	157.9	85%	0.845	81%	0.813	S	S	*	*			trans	-60.1	128.2	152.4	-73.8	-49.8	0	0	0	108.5
457	K	29.8	Very low	27.1	Very low	187 Å²	187	157.5 Å²	157.5	81%	0.813	82%	0.815	S	S	*	*				151.4	117.2	127.1	-83.8	176.6	-177.7	-179.9	0	112.8
458	V	28.1	Very low	27.2	Very low	112 Å²	112	153.5 Å²	153.5	68%	0.679	80%	0.803	S	S	*	*				85.8	123.9	126.4	179.3	0	0	0	0	118.7
459	E	29.6	Very low	27.1	Very low	166 Å²	166	154.2 Å²	154.2	78%	0.776	80%	0.803	S	S	*	*			trans	87.3	101.3	148	-80.7	158.6	-157.1	0	0	121.5
460	D	26.9	Very low	27.1	Very low	163 Å²	163	155.6 Å²	155.6	87%	0.872	81%	0.809	S	S	*	*				51.9	117.5	119.4	-71.7	-9.1	0	0	0	121
461	G	26.1	Very low	27	Very low	77 Å²	77	151.9 Å²	151.9	79%	0.794	80%	0.804	S	S	*	*				109.3	133.7	124.8	0	0	0	0	0	117.7
462	A	28.6	Very low	27	Very low	99 Å²	99	153.2 Å²	153.2	82%	0.818	81%	0.81	S	S	*	*			trans	87	91.8	161.6	0	0	0	0	0	118.7
463	V	25.3	Very low	27	Very low	130 Å²	130	151.8 Å²	151.8	79%	0.788	81%	0.806	S	S	*	*			trans	-3.8	120	133.8	-175.5	0	0	0	0	115.5
464	L	28.5	Very low	26.9	Very low	166 Å²	166	150.4 Å²	150.4	87%	0.869	81%	0.81	S	S	*	*			trans	-145.5	115.5	148.1	-124.6	113.3	0	0	0	110
465	D	25.2	Very low	26.9	Very low	136 Å²	136	147.1 Å²	147.1	73%	0.727	81%	0.807	S	S	*	*			trans	-56.8	162.7	160.3	-77.9	-47.2	0	0	0	111.3
466	T	26.7	Very low	26.8	Very low	115 Å²	115	146.5 Å²	146.5	71%	0.706	81%	0.805	S	S	*	*			trans	96.3	84.3	167.2	59.4	0	0	0	0	119.6
467	V	27.4	Very low	26.8	Very low	143 Å²	143	145.9 Å²	145.9	87%	0.867	81%	0.807	S	S	*	*			trans	-157.6	91.4	130.7	-175.1	0	0	0	0	104.9
468	V	25.9	Very low	26.6	Very low	102 Å²	102	143.2 Å²	143.2	62%	0.618	81%	0.806	S	S	*	*				48.2	102.3	56.4	-170.4	0	0	0	0	114.3
469	E	26.2	Very low	26.5	Very low	170 Å²	170	144.7 Å²	144.7	79%	0.794	81%	0.81	S	S	*	*			trans	75	140.7	151	-70.8	169.6	171.5	0	0	119.7
470	I	26.5	Very low	26.2	Very low	168 Å²	168	148 Å²	148	86%	0.862	82%	0.815	S	S	*	*	S	Bend	trans	87.8	89.9	-175.6	-46	157.8	0	0	0	111.5
471	V	25.3	Very low	26.1	Very low	133 Å²	133	147.2 Å²	147.2	81%	0.806	81%	0.811	S	S	*	*	S	Bend		-153.8	89.7	60.6	179	0	0	0	0	109.4
472	E	25.9	Very low	26.2	Very low	195 Å²	195	150.4 Å²	150.4	91%	0.911	82%	0.815	S	S	*	*			trans	-125	85.9	157.2	-82.2	-165.9	156.3	0	0	107.1
473	E	26.4	Very low	26	Very low	182 Å²	182	149.9 Å²	149.9	85%	0.85	81%	0.805	S	S	*	*			trans	-166	84.4	167.7	-116	179.8	-164	0	0	109.8
474	T	24	Very low	25.9	Very low	144 Å²	144	150.2 Å²	150.2	88%	0.883	80%	0.802	S	S	*	*	S	Bend	trans	-167.1	49.8	145	52.4	0	0	0	0	109.5
475	I	27.3	Very low	25.8	Very low	158 Å²	158	151 Å²	151	81%	0.81	80%	0.798	S	S	*	*	S	Bend	trans	-139.6	125.7	157.4	-56.7	-178.3	0	0	0	103.9
476	E	27.5	Very low	25.7	Very low	173 Å²	173	151.8 Å²	151.8	81%	0.808	80%	0.803	S	S	*	*	S	Bend	trans	82.3	91.5	-177	-46.6	-164.6	157.4	0	0	116.2
477	T	24.8	Very low	25.7	Very low	145 Å²	145	151.6 Å²	151.6	89%	0.89	80%	0.803	S	S	*	*			trans	173.2	62.5	141.8	35.9	0	0	0	0	113.4
478	V	26	Very low	25.4	Very low	131 Å²	131	150.5 Å²	150.5	79%	0.794	80%	0.797	S	S	*	*	S	Bend	trans	-162.9	115.6	153.6	-173.1	0	0	0	0	105.1
479	D	25.7	Very low	25.5	Very low	142 Å²	142	152.7 Å²	152.7	76%	0.759	80%	0.804	S	S	*	*			cis	-134.1	121.5	9.2	-84.4	-47.3	0	0	0	108.4
480	R	24.3	Very low	25.3	Very low	235 Å²	235	149.8 Å²	149.8	89%	0.887	80%	0.798	S	S	*	*			trans	-98.8	136.3	147	-82.5	-176.8	179.4	166.9	3.6	105.8
481	N	24.3	Very low	25.3	Very low	148 Å²	148	147.9 Å²	147.9	79%	0.791	79%	0.79	S	S	*	*			trans	96.2	92.1	-169.1	-49.5	-21.2	0	0	0	109.7
482	V	28.6	Very low	25.3	Very low	144 Å²	144	148.3 Å²	148.3	87%	0.873	79%	0.787	S	S	*	*				-141.3	129.4	72.3	174.1	0	0	0	0	111.7
483	S	24	Very low	25.4	Very low	88 Å²	88	145.1 Å²	145.1	62%	0.615	78%	0.781	S	S	*	*			trans	-57.4	163.9	171.9	51.3	0	0	0	0	115.5
484	L	24.5	Very low	25.4	Very low	137 Å²	137	144 Å²	144	72%	0.717	78%	0.776	S	S	*	*			trans	95.3	89.5	156.8	-63.3	148.1	0	0	0	117
485	F	25.4	Very low	25.5	Very low	182 Å²	182	144.4 Å²	144.4	80%	0.798	77%	0.767	S	S	*	*				160	105	102.2	-95	-76.5	0	0	0	110.6
486	N	22.2	Very low	25.5	Very low	153 Å²	153	144.3 Å²	144.3	82%	0.818	77%	0.767	S	S	*	*			trans	-86.6	150.8	138.5	-93.7	-15.6	0	0	0	105.6
487	P	27.1	Very low	25.3	Very low	110 Å²	110	141.4 Å²	141.4	71%	0.714	76%	0.761	S	S	*	*				-151.8	165	68.2	35.2	-12.2	0	0	0	117.4
488	T	22.7	Very low	25.3	Very low	121 Å²	121	139.9 Å²	139.9	74%	0.742	75%	0.752	S	S	*	*			trans	-38.9	152.3	154	43.6	0	0	0	0	115.6
489	I	26.3	Very low	25.3	Very low	148 Å²	148	139.6 Å²	139.6	76%	0.759	75%	0.746	S	S	*	*			trans	159	95	145.7	-82.7	156.3	0	0	0	105.3
490	T	23.2	Very low	25.3	Very low	109 Å²	109	140.5 Å²	140.5	67%	0.669	74%	0.743	S	S	*	*				68	138.8	98.2	63.2	0	0	0	0	115.2
491	D	26	Very low	25.4	Very low	128 Å²	128	135.5 Å²	135.5	68%	0.684	73%	0.734	S	S	*	*			trans	85.5	101.1	154.2	-51.3	-22.4	0	0	0	119.4
492	D	25.3	Very low	25.5	Very low	142 Å²	142	138.8 Å²	138.8	76%	0.759	74%	0.735	S	S	*	*				85	148.8	116.3	-62.4	-17.8	0	0	0	122.2
493	V	29	Very low	25.3	Very low	127 Å²	127	138.3 Å²	138.3	77%	0.77	73%	0.728	S	S	*	*			trans	94.5	78.5	159.4	-157.3	0	0	0	0	116.2
494	E	25.4	Very low	25.4	Very low	159 Å²	159	141.5 Å²	141.5	74%	0.743	73%	0.733	S	S	*	*				34.1	131.6	111.7	-72.5	-168	159.6	0	0	120.6
495	H	26.4	Very low	25.4	Very low	152 Å²	152	143 Å²	143	70%	0.704	74%	0.738	S	S	*	*			trans	63.6	110.4	135.5	-81	-68.6	0	0	0	119.7
496	L	26.6	Very low	25.5	Very low	156 Å²	156	139.5 Å²	139.5	82%	0.817	74%	0.736	S	S	*	*				165	106.7	105.5	-89.9	144.4	0	0	0	111.3
497	V	23.5	Very low	25.7	Very low	112 Å²	112	137.3 Å²	137.3	68%	0.679	73%	0.733	S	S	*	*				22.3	137.8	121.9	-176.5	0	0	0	0	118.7
498	T	24.6	Very low	25.6	Very low	114 Å²	114	137.3 Å²	137.3	70%	0.699	74%	0.736	S	S	*	*			trans	90.2	118.2	151.6	43.9	0	0	0	0	121.5
499	D	25.6	Very low	25.7	Very low	124 Å²	124	141.1 Å²	141.1	66%	0.663	74%	0.742	S	S	*	*				73.2	116	128.1	-73.8	3.8	0	0	0	121.6
500	K	26.3	Very low	25.8	Very low	162 Å²	162	144.1 Å²	144.1	70%	0.704	75%	0.75	S	S	*	*				71.8	121.2	126	-69.9	-179.9	-178.9	168.1	0	118.6
501	D	26.2	Very low	25.9	Very low	129 Å²	129	146.8 Å²	146.8	69%	0.69	76%	0.758	S	S	*	*				74.2	134.2	129.2	-67	-20.9	0	0	0	119.1
502	R	27.3	Very low	25.7	Very low	218 Å²	218	146 Å²	146	82%	0.823	76%	0.76	S	S	*	*			trans	86.5	107.7	148.4	-70.6	160.5	-173.8	-157.8	1.2	117.9
503	N	24.8	Very low	25.7	Very low	133 Å²	133	147 Å²	147	71%	0.711	77%	0.765	S	S	*	*				64.7	114.3	118.2	-71.3	11.4	0	0	0	119.2
504	E	25	Very low	25.4	Very low	156 Å²	156	145.9 Å²	145.9	73%	0.729	76%	0.762	S	S	*	*				87.8	119	121.6	-71.8	179.6	162.5	0	0	119.6
505	M	24.8	Very low	25.4	Very low	167 Å²	167	146.1 Å²	146.1	82%	0.823	77%	0.765	S	S	*	*			trans	69.8	104.1	133.4	-75.1	178.5	156.5	0	0	118.3
506	S	27.3	Very low	25.3	Very low	109 Å²	109	143 Å²	143	76%	0.762	76%	0.761	S	S	*	*				166.8	103.8	106.1	46.6	0	0	0	0	108.7
507	S	25.9	Very low	25.1	Very low	108 Å²	108	141.8 Å²	141.8	76%	0.755	76%	0.76	S	S	*	*				75.7	102.7	99.4	72.7	0	0	0	0	114.9
508	S	24.8	Very low	25.1	Very low	110 Å²	110	140.9 Å²	140.9	77%	0.769	76%	0.758	S	S	*	*				159.8	140.5	109.5	56.2	0	0	0	0	111.1
509	K	25.8	Very low	25.1	Very low	201 Å²	201	141.5 Å²	141.5	87%	0.874	76%	0.757	S	S	*	*			trans	79.2	72.5	173.8	-56.8	-179.4	177.8	177.6	0	118.1
510	K	27.6	Very low	25.2	Very low	210 Å²	210	142.7 Å²	142.7	91%	0.913	76%	0.758	S	S	*	*			trans	-143.3	128.8	140	-78.1	-166.1	178.1	173.2	0	110.3
511	I	26.2	Very low	25.2	Very low	166 Å²	166	141 Å²	141	85%	0.851	77%	0.767	S	S	*	*			trans	-61.9	139.4	-177.8	-67.1	154.1	0	0	0	110.3
512	P	22.3	Very low	25.1	Very low	110 Å²	110	144.4 Å²	144.4	71%	0.714	77%	0.772	S	S	*	*			trans	-96.6	147.2	-175.8	37	-31.1	0	0	0	112.1
513	L	25.2	Very low	25.1	Very low	165 Å²	165	144 Å²	144	86%	0.864	78%	0.776	S	S	*	*			trans	-145.3	87.4	157.1	-91	168.5	0	0	0	109.5
514	S	22.7	Very low	25	Very low	103 Å²	103	142.6 Å²	142.6	72%	0.72	78%	0.777	S	S	*	*			trans	-69.4	141	142.1	52.5	0	0	0	0	108.8
515	M	25.6	Very low	25.2	Very low	163 Å²	163	142.3 Å²	142.3	80%	0.803	79%	0.785	S	S	*	*			trans	171.8	110.3	152.4	-100.2	167.1	73.8	0	0	110.5
516	S	23.3	Very low	25.1	Very low	88 Å²	88	143 Å²	143	62%	0.615	78%	0.784	S	S	*	*				68.4	113.1	105	67.4	0	0	0	0	114
517	V	23.3	Very low	25	Very low	130 Å²	130	144.1 Å²	144.1	79%	0.788	78%	0.781	S	S	*	*				46.7	116.8	90.6	-174.3	0	0	0	0	113.1
518	S	22.7	Very low	24.9	Very low	92 Å²	92	147 Å²	147	64%	0.643	78%	0.783	S	S	*	*			trans	59.8	124.8	157.1	62.7	0	0	0	0	120.4
519	N	25.7	Very low	25	Very low	127 Å²	127	149.9 Å²	149.9	68%	0.679	79%	0.789	S	S	*	*				178.1	112.8	115.5	-87.1	-20	0	0	0	111.1
520	Q	26	Very low	24.8	Very low	149 Å²	149	147.5 Å²	147.5	70%	0.696	79%	0.79	S	S	*	*				75.1	99	107	-65.7	177	-20.5	0	0	115.3	Y522	Q520-Y522 HydrophobicContact CB-CD2 4.36Å; Q520-Y522 HydrophobicContact CG-CD2 3.91Å; Q520-Y522 HydrophobicContact CG-CE2 4.18Å
521	S	26.5	Very low	24.7	Very low	127 Å²	127	145.8 Å²	145.8	89%	0.888	79%	0.785	S	S	*	*			trans	-120.7	83	132.3	53.9	0	0	0	0	108
522	Y	24.7	Very low	24.7	Very low	201 Å²	201	142.7 Å²	142.7	79%	0.788	78%	0.778	S	S	*	*			trans	-75	118.2	166.7	-90.9	-96.9	0	0	0	108.3	Q520	Q520-Y522 HydrophobicContact CB-CD2 4.36Å; Q520-Y522 HydrophobicContact CG-CD2 3.91Å; Q520-Y522 HydrophobicContact CG-CE2 4.18Å
523	K	27	Very low	24.7	Very low	209 Å²	209	143.3 Å²	143.3	91%	0.909	78%	0.784	S	S	*	*			trans	-110.7	117.7	144.8	-94.9	-176.3	176.8	179.5	0	107.3
524	S	23.1	Very low	24.7	Very low	104 Å²	104	143 Å²	143	73%	0.727	78%	0.78	S	S	*	*			trans	-52.3	127.7	-177.3	51.8	0	0	0	0	114.3
525	V	27.8	Very low	24.8	Very low	149 Å²	149	146 Å²	146	90%	0.903	79%	0.785	S	S	*	*			trans	-140.2	119.3	136.6	-176.3	0	0	0	0	106.8
526	K	23.4	Very low	25	Very low	183 Å²	183	146 Å²	146	80%	0.796	79%	0.788	S	S	*	*			trans	-75.4	162.7	177.2	-71.6	176.4	169.2	179.3	0	110.7
527	N	24.8	Very low	25.4	Very low	132 Å²	132	146.4 Å²	146.4	71%	0.706	79%	0.786	S	S	*	*			trans	94.8	95.7	164.8	-59	2.2	0	0	0	113.8
528	E	23.7	Very low	26.2	Very low	168 Å²	168	144.4 Å²	144.4	79%	0.785	78%	0.776	S	S	*	*				85.3	101.2	87.7	-83	174.7	175.5	0	0	110.7
529	L	27.3	Very low	27.3	Very low	171 Å²	171	146.8 Å²	146.8	90%	0.895	78%	0.782	S	S	*	*			trans	166.5	132.2	133.7	-84.3	158.3	0	0	0	109.6	H531	L529-H531 PolarHBondContact O-N 3.17Å
530	V	22.9	Very low	28.8	Very low	151 Å²	151	143.6 Å²	143.6	92%	0.915	76%	0.762	S	S	*	*			trans	-63.2	111.1	-167.6	178.1	0	0	0	0	111.7
531	H	25.3	Very low	30.6	Very low	173 Å²	173	137.2 Å²	137.2	80%	0.801	73%	0.734	S	S	*	*			trans	-120.4	122.2	170.8	-116.8	-75.4	0	0	0	111.6	L529	L529-H531 PolarHBondContact O-N 3.17Å
532	S	25.6	Very low	32.8	Very low	101 Å²	101	134.1 Å²	134.1	71%	0.706	71%	0.707	S	S	*	*			trans	-42.4	130.6	169.7	169.9	0	0	0	0	112.3	M534	S532-M534 PolarHBondContact O-N 3.15Å
533	C	22.7	Very low	35.4	Very low	124 Å²	124	125.4 Å²	125.4	84%	0.838	67%	0.674	S	S	*	*			trans	-56.9	95.4	-174.8	-164.4	0	0	0	0	112.3
534	M	25.1	Very low	38	Very low	157 Å²	157	117.6 Å²	117.6	77%	0.773	64%	0.639	S	S	*	*			trans	-85.4	116.5	167.8	-66.1	-168.8	102.9	0	0	109.2	S532 N536	S532-M534 PolarHBondContact O-N 3.15Å; M534-N536 PolarHBondContact O-N 2.91Å
535	M	25.4	Very low	41	Very low	168 Å²	168	112.7 Å²	112.7	83%	0.828	60%	0.604	S	S	*	*			trans	-61.1	116.2	160.7	-74.4	-82	-168.1	0	0	107.7	V537	M535-V537 PolarHBondContact O-N 3.44Å
536	N	28.3	Very low	43.8	Very low	161 Å²	161	105.6 Å²	105.6	86%	0.861	56%	0.561	S	S	*	*			trans	-60.5	96.3	171.8	-82.5	-17	0	0	0	109.5	M534	M534-N536 PolarHBondContact O-N 2.91Å
537	V	32.4	Very low	46.8	Very low	97 Å²	97	97.5 Å²	97.5	59%	0.588	53%	0.527	S	S	*	.	P	Polyproline II helix	trans	-68	124.8	173.2	178.4	0	0	0	0	107.4	M535 F540	M535-V537 PolarHBondContact O-N 3.44Å; V537-F540 HydrophobicContact CG1-CD2 4.04Å; V537-F540 HydrophobicContact CG1-CE2 3.55Å
538	P	39.2	Very low	49.8	Very low	89 Å²	89	91.3 Å²	91.3	58%	0.578	50%	0.495	S	S	*	.	P	Polyproline II helix	trans	-55.4	143.1	179.2	-21.3	29.6	0	0	0	111.1	F540	P538-F540 HydrophobicContact CB-CE2 4.31Å; P538-F540 HydrophobicContact CB-CZ 4.29Å; P538-F540 HydrophobicContact CG-CZ 4.35Å; P538-F540 WeakPolarHBondContact O-CD2 3.34Å; P538-F540 WeakPolarHBondContact O-CE2 3.46Å; P538-F540 PolarHBondContact O-N 3.15Å
539	D	46.6	Very low	53	Low	142 Å²	142	83.3 Å²	83.3	76%	0.759	46%	0.457	S	S	*	.	P	Polyproline II helix	trans	-55.2	117.5	170.9	-80.5	-33.9	0	0	0	109.2	L427	L427-D539 WeakPolarHBondContact CD1-O 3.35Å; L427-D539 HydrophobicContact CD2-CB 4.24Å; L427-D539 WeakPolarHBondContact CD2-O 3.5Å
540	F	56.6	Low	55.9	Low	59 Å²	59	75.2 Å²	75.2	26%	0.259	42%	0.415	S	S	.	.	P	Polyproline II helix	trans	-92.8	142.9	175.2	-73.9	-80.3	0	0	0	109.9	V537 P538 P573 I724	V537-F540 HydrophobicContact CG1-CD2 4.04Å; V537-F540 HydrophobicContact CG1-CE2 3.55Å; P538-F540 HydrophobicContact CB-CE2 4.31Å; P538-F540 HydrophobicContact CB-CZ 4.29Å; P538-F540 HydrophobicContact CG-CZ 4.35Å; P538-F540 WeakPolarHBondContact O-CD2 3.34Å; P538-F540 WeakPolarHBondContact O-CE2 3.46Å; P538-F540 PolarHBondContact O-N 3.15Å; F540-P573 HydrophobicContact CD1-CG 4.43Å; F540-P573 HydrophobicContact CE1-CG 3.47Å; F540-P573 VanDerWaalsContact CE1-CG 3.47Å; F540-P573 HydrophobicContact CE2-CG 3.65Å; F540-P573 HydrophobicContact CZ-CB 4.47Å; F540-P573 HydrophobicContact CZ-CG 3.05Å; F540-I724 HydrophobicContact CD1-CD1 4.2Å; F540-I724 HydrophobicContact CD2-CD1 3.57Å; F540-I724 HydrophobicContact CE1-CD1 4.41Å; F540-I724 HydrophobicContact CE2-CD1 3.82Å; F540-I724 HydrophobicContact CG-CD1 3.84Å; F540-I724 HydrophobicContact CZ-CD1 4.29Å
541	S	63.6	Low	59.1	Low	15 Å²	15	68.4 Å²	68.4	11%	0.105	37%	0.373	C	S	.	.	P	Polyproline II helix	trans	-58	151.1	165.7	53.7	0	0	0	0	110	A425 Q543 I546	A425-S541 VanDerWaalsContact O-CB 3.28Å; A425-S541 WeakPolarHBondContact O-CB 3.42Å; S541-Q543 WeakPolarHBondContact O-CG 3.43Å; S541-Q543 PolarHBondContact O-N 3.37Å; S541-Q543 PolarHBondContact O-NE2 3.2Å; S541-Q543 PolarHBondContact OG-NE2 3.02Å; S541-I546 WeakPolarHBondContact OG-CD1 3.38Å
542	D	73.2	Confident	62.3	Low	62 Å²	62	60.1 Å²	60.1	33%	0.332	34%	0.335	S	S	.	.			trans	-58.8	100.3	179.5	-172.3	-12.1	0	0	0	110.6	Y383 R544 L545 I546	Y383-D542 WeakPolarHBondContact CE1-OD2 3.13Å; Y383-D542 PolarHBondContact OH-OD2 3.38Å; D542-R544 PolarHBondContact O-N 3.14Å; D542-R544 VanDerWaalsContact OD1-CB 3.23Å; D542-R544 WeakPolarHBondContact OD1-CB 3.45Å; D542-R544 PolarHBondContact OD1-N 2.92Å; D542-L545 HydrophobicContact CB-CB 4.2Å; D542-L545 PolarHBondContact O-N 3.2Å; D542-L545 PolarHBondContact OD1-N 3.39Å; D542-I546 WeakPolarHBondContact O-CG1 3.12Å; D542-I546 PolarHBondContact O-N 3.34Å
543	Q	78.8	Confident	65.3	Low	19 Å²	19	55.4 Å²	55.4	9%	0.089	30%	0.301	C	S	.	.	H	α-helix	trans	-64.3	-28.6	-177.2	-61.8	-64.2	-58.7	0	0	111.5	S541 I546 S547 Y577 L721	S541-Q543 WeakPolarHBondContact O-CG 3.43Å; S541-Q543 PolarHBondContact O-N 3.37Å; S541-Q543 PolarHBondContact O-NE2 3.2Å; S541-Q543 PolarHBondContact OG-NE2 3.02Å; Q543-I546 PolarHBondContact O-N 3.16Å; Q543-S547 WeakPolarHBondContact O-CB 3.4Å; Q543-S547 PolarHBondContact O-N 3.33Å; Q543-Y577 PolarHBondContact NE2-O 3.09Å; Q543-Y577 VanDerWaalsContact OE1-CD2 3.24Å; Q543-L721 HydrophobicContact CB-CD2 3.62Å; Q543-L721 HydrophobicContact CB-CG 4.28Å; Q543-L721 HydrophobicContact CG-CD2 4.06Å
544	R	81.2	Confident	68.5	Low	45 Å²	45	49.6 Å²	49.6	17%	0.17	26%	0.263	C	S	.	.	H	α-helix	trans	-67.1	-47.9	178.1	-173.6	179.2	-71.3	-147.1	-7.4	109.8	D542 I546 S547 I548 E743 E766	D542-R544 PolarHBondContact O-N 3.14Å; D542-R544 VanDerWaalsContact OD1-CB 3.23Å; D542-R544 WeakPolarHBondContact OD1-CB 3.45Å; D542-R544 PolarHBondContact OD1-N 2.92Å; R544-I546 VanDerWaalsContact C-N 3.32Å; R544-I546 PolarHBondContact O-N 3.15Å; R544-S547 PolarHBondContact O-N 3.21Å; R544-S547 PolarHBondContact O-OG 3.04Å; R544-I548 HydrophobicContact CG-CD1 4.08Å; R544-I548 VanDerWaalsContact O-CG1 3.32Å; R544-I548 WeakPolarHBondContact O-CG1 3.37Å; R544-I548 PolarHBondContact O-N 2.88Å; R544-E743 IonicContact NH1-OE2 2.85Å; R544-E743 PolarHBondContact NH1-OE2 3.47Å; R544-E766 IonicContact NH2-OE1 3.45Å; R544-E766 PolarHBondContact NH2-OE1 3.21Å
545	L	87.5	Confident	71.3	Confident	1 Å²	1	42.3 Å²	42.3	1%	0.005	23%	0.227	C	C	.	.	H	α-helix	trans	-60.1	-41.9	176.8	-177.6	62.1	0	0	0	111.9	V380 Y383 M400 A424 D542 I548 L549	V380-L545 HydrophobicContact CG1-CD2 4.11Å; Y383-L545 HydrophobicContact CD1-CD1 4.33Å; Y383-L545 HydrophobicContact CD1-CD2 3.64Å; Y383-L545 HydrophobicContact CD1-CG 4.39Å; Y383-L545 HydrophobicContact CD2-CD1 4.39Å; Y383-L545 HydrophobicContact CE1-CB 4.04Å; Y383-L545 HydrophobicContact CE1-CD1 4.43Å; Y383-L545 HydrophobicContact CE1-CD2 3.96Å; Y383-L545 HydrophobicContact CE1-CG 4.37Å; Y383-L545 HydrophobicContact CE2-CD1 4.46Å; Y383-L545 HydrophobicContact CG-CD1 4.33Å; Y383-L545 HydrophobicContact CG-CD2 4.23Å; M400-L545 HydrophobicContact CE-CD1 4.14Å; M400-L545 HydrophobicContact SD-CD1 4.09Å; A424-L545 HydrophobicContact CB-CD2 3.56Å; A424-L545 HydrophobicContact CB-CG 3.85Å; D542-L545 HydrophobicContact CB-CB 4.2Å; D542-L545 PolarHBondContact O-N 3.2Å; D542-L545 PolarHBondContact OD1-N 3.39Å; L545-I548 PolarHBondContact O-N 2.9Å; L545-L549 HydrophobicContact CG-CD1 4.41Å; L545-L549 WeakPolarHBondContact O-CG 3.45Å; L545-L549 PolarHBondContact O-N 3.38Å
546	I	86.3	Confident	74.1	Confident	0 Å²	0	34.4 Å²	34.4	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-60.9	-46.3	175.9	-63.9	170.7	0	0	0	110.7	L421 A424 A425 S541 D542 Q543 R544 I548 L549 I550 V566 Y577	L421-I546 HydrophobicContact CD1-CG2 3.98Å; A424-I546 HydrophobicContact CB-CG1 4.49Å; A425-I546 HydrophobicContact CB-CD1 3.8Å; A425-I546 HydrophobicContact CB-CG1 4.27Å; S541-I546 WeakPolarHBondContact OG-CD1 3.38Å; D542-I546 WeakPolarHBondContact O-CG1 3.12Å; D542-I546 PolarHBondContact O-N 3.34Å; Q543-I546 PolarHBondContact O-N 3.16Å; R544-I546 VanDerWaalsContact C-N 3.32Å; R544-I546 PolarHBondContact O-N 3.15Å; I546-I548 VanDerWaalsContact C-N 3.3Å; I546-I548 PolarHBondContact O-N 3.34Å; I546-L549 PolarHBondContact O-N 3.44Å; I546-I550 HydrophobicContact CG2-CD1 3.91Å; I546-I550 WeakPolarHBondContact O-CG1 3.34Å; I546-I550 PolarHBondContact O-N 3.45Å; I546-V566 HydrophobicContact CG2-CG1 4.42Å; I546-Y577 HydrophobicContact CB-CD2 4.12Å; I546-Y577 HydrophobicContact CG2-CD1 4.26Å; I546-Y577 HydrophobicContact CG2-CD2 3.63Å; I546-Y577 HydrophobicContact CG2-CE2 4.22Å; I546-Y577 HydrophobicContact CG2-CG 3.66Å
547	S	85.5	Confident	76.5	Confident	12 Å²	12	27 Å²	27	8%	0.084	15%	0.149	C	C	.	.	H	α-helix	trans	-62.1	-37	179.1	72.5	0	0	0	0	112.8	Q543 R544 I550 Q551	Q543-S547 WeakPolarHBondContact O-CB 3.4Å; Q543-S547 PolarHBondContact O-N 3.33Å; R544-S547 PolarHBondContact O-N 3.21Å; R544-S547 PolarHBondContact O-OG 3.04Å; S547-I550 PolarHBondContact O-N 3.02Å; S547-Q551 WeakPolarHBondContact O-CB 3.24Å; S547-Q551 PolarHBondContact O-N 3.08Å
548	I	88.3	Confident	78.6	Confident	3 Å²	3	22.9 Å²	22.9	2%	0.015	12%	0.124	C	C	.	.	H	α-helix	trans	-66.6	-44.8	176.9	-69.1	164.8	0	0	0	110.7	I397 R544 L545 I546 I550 Q551 L552 M693	I397-I548 HydrophobicContact CD1-CD1 3.37Å; I397-I548 HydrophobicContact CG1-CD1 3.81Å; I397-I548 HydrophobicContact CG2-CD1 4.03Å; I397-I548 HydrophobicContact CG2-CG2 4.03Å; R544-I548 HydrophobicContact CG-CD1 4.08Å; R544-I548 VanDerWaalsContact O-CG1 3.32Å; R544-I548 WeakPolarHBondContact O-CG1 3.37Å; R544-I548 PolarHBondContact O-N 2.88Å; L545-I548 PolarHBondContact O-N 2.9Å; I546-I548 VanDerWaalsContact C-N 3.3Å; I546-I548 PolarHBondContact O-N 3.34Å; I548-I550 VanDerWaalsContact C-N 3.29Å; I548-I550 PolarHBondContact O-N 3.49Å; I548-Q551 CarbonylContact O-C 3.49Å; I548-Q551 WeakPolarHBondContact O-CB 3.33Å; I548-Q551 PolarHBondContact O-N 3Å; I548-Q551 VanDerWaalsContact O-N 3.11Å; I548-L552 HydrophobicContact CG2-CD1 4.23Å; I548-L552 HydrophobicContact CG2-CG 4.5Å; I548-L552 WeakPolarHBondContact O-CG 3.29Å; I548-L552 PolarHBondContact O-N 3.35Å; I548-M693 HydrophobicContact CG2-CE 4.43Å
549	L	91.2	Very high	80.3	Confident	0 Å²	0	19.6 Å²	19.6	0%	0	10%	0.102	C	C	.	.	H	α-helix	trans	-63.5	-37.2	177.2	-68.9	173.1	0	0	0	111.6	L376 V380 L421 A424 L545 I546 L552 G553 S554	L376-L549 HydrophobicContact CD1-CD2 4.45Å; V380-L549 HydrophobicContact CG2-CD1 4.19Å; L421-L549 HydrophobicContact CB-CD1 4.4Å; L421-L549 HydrophobicContact CD1-CB 3.81Å; L421-L549 HydrophobicContact CD1-CD1 4.26Å; A424-L549 HydrophobicContact CB-CD1 3.63Å; L545-L549 HydrophobicContact CG-CD1 4.41Å; L545-L549 WeakPolarHBondContact O-CG 3.45Å; L545-L549 PolarHBondContact O-N 3.38Å; I546-L549 PolarHBondContact O-N 3.44Å; L549-L552 HydrophobicContact CD2-CD1 4.36Å; L549-L552 PolarHBondContact O-N 3.38Å; L549-G553 PolarHBondContact O-N 2.84Å; L549-S554 VanDerWaalsContact O-CB 3.23Å; L549-S554 WeakPolarHBondContact O-CB 3.44Å; L549-S554 PolarHBondContact O-N 3.14Å; L549-S554 PolarHBondContact O-OG 3.39Å
550	I	88.3	Confident	81.6	Confident	1 Å²	1	13.4 Å²	13.4	1%	0.005	7%	0.07	C	C	.	.	H	α-helix	trans	-63.1	-43.3	171.7	-66.2	165.9	0	0	0	110.8	L421 I546 S547 I548 L552 G553 Y577 P602 I640	L421-I550 HydrophobicContact CD1-CG1 4.34Å; I546-I550 HydrophobicContact CG2-CD1 3.91Å; I546-I550 WeakPolarHBondContact O-CG1 3.34Å; I546-I550 PolarHBondContact O-N 3.45Å; S547-I550 PolarHBondContact O-N 3.02Å; I548-I550 VanDerWaalsContact C-N 3.29Å; I548-I550 PolarHBondContact O-N 3.49Å; I550-L552 VanDerWaalsContact C-N 3.32Å; I550-L552 PolarHBondContact O-N 2.77Å; I550-G553 WeakPolarHBondContact O-CA 3.44Å; I550-G553 PolarHBondContact O-N 3Å; I550-Y577 HydrophobicContact CD1-CD1 4.28Å; I550-Y577 HydrophobicContact CD1-CE1 3.69Å; I550-Y577 HydrophobicContact CD1-CE2 4.4Å; I550-P602 HydrophobicContact CD1-CB 4.09Å; I550-P602 HydrophobicContact CD1-CG 4.15Å; I550-I640 HydrophobicContact CG2-CD1 4.17Å; I550-I640 WeakPolarHBondContact O-CG2 3.29Å
551	Q	90	Very high	82.3	Confident	7 Å²	7	17.4 Å²	17.4	3%	0.033	9%	0.087	C	C	.	.	H	α-helix	trans	-62.1	-37	176.1	178.9	170.3	51.5	0	0	112.4	S547 I548 G553 N638 I640 W641 M693 M717	S547-Q551 WeakPolarHBondContact O-CB 3.24Å; S547-Q551 PolarHBondContact O-N 3.08Å; I548-Q551 CarbonylContact O-C 3.49Å; I548-Q551 WeakPolarHBondContact O-CB 3.33Å; I548-Q551 PolarHBondContact O-N 3Å; I548-Q551 VanDerWaalsContact O-N 3.11Å; Q551-G553 PolarHBondContact O-N 2.93Å; Q551-N638 WeakPolarHBondContact CG-O 3.44Å; Q551-N638 PolarHBondContact NE2-O 2.63Å; Q551-N638 VanDerWaalsContact NE2-O 3.1Å; Q551-I640 CarbonylContact O-C 3.47Å; Q551-I640 WeakPolarHBondContact O-CA 3.14Å; Q551-W641 PolarHBondContact O-N 2.97Å; Q551-M693 PolarHBondContact OE1-SD 3.05Å; Q551-M693 VanDerWaalsContact OE1-SD 3.34Å; Q551-M717 PolarHBondContact NE2-SD 3.33Å
552	L	91.9	Very high	82.4	Confident	0 Å²	0	21.9 Å²	21.9	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-69	-13.6	173.2	-65.8	173.5	0	0	0	113	M400 A401 V404 L410 I548 L549 I550 I690	M400-L552 HydrophobicContact CB-CD1 4.29Å; A401-L552 HydrophobicContact CB-CD2 4.08Å; V404-L552 HydrophobicContact CG2-CD1 4.25Å; L410-L552 WeakPolarHBondContact CD1-O 3.27Å; L410-L552 HydrophobicContact CD2-CB 4.03Å; I548-L552 HydrophobicContact CG2-CD1 4.23Å; I548-L552 HydrophobicContact CG2-CG 4.5Å; I548-L552 WeakPolarHBondContact O-CG 3.29Å; I548-L552 PolarHBondContact O-N 3.35Å; L549-L552 HydrophobicContact CD2-CD1 4.36Å; L549-L552 PolarHBondContact O-N 3.38Å; I550-L552 VanDerWaalsContact C-N 3.32Å; I550-L552 PolarHBondContact O-N 2.77Å; L552-I690 HydrophobicContact CD2-CD1 4.48Å; L552-I690 HydrophobicContact CD2-CG1 4.44Å
553	G	89.4	Confident	82.2	Confident	1 Å²	1	19.9 Å²	19.9	1%	0.01	10%	0.104	C	C	.	.	T	Hydrogen-bonded Turn	trans	104.4	19.9	175.9	0	0	0	0	0	115.2	Q411 L549 I550 Q551 W605	Q411-G553 PolarHBondContact NE2-O 3.5Å; L549-G553 PolarHBondContact O-N 2.84Å; I550-G553 WeakPolarHBondContact O-CA 3.44Å; I550-G553 PolarHBondContact O-N 3Å; Q551-G553 PolarHBondContact O-N 2.93Å; G553-W605 PolarHBondContact O-NE1 3.37Å
554	S	88.7	Confident	82	Confident	3 Å²	3	23 Å²	23	2%	0.021	12%	0.115	C	C	.	.			trans	-62.7	136.6	174.5	-69.6	0	0	0	0	112.5	Q411 L549	Q411-S554 VanDerWaalsContact OE1-CA 3.26Å; L549-S554 VanDerWaalsContact O-CB 3.23Å; L549-S554 WeakPolarHBondContact O-CB 3.44Å; L549-S554 PolarHBondContact O-N 3.14Å; L549-S554 PolarHBondContact O-OG 3.39Å
555	D	85.4	Confident	81.9	Confident	3 Å²	3	21 Å²	21	2%	0.016	11%	0.108	C	C	.	.			trans	-89.2	115.7	-179.6	-172.6	-9.9	0	0	0	111	Q411 S557 I558 W605 R646	Q411-D555 VanDerWaalsContact NE2-CB 3.34Å; Q411-D555 VanDerWaalsContact OE1-N 3.08Å; D555-S557 VanDerWaalsContact C-N 3.32Å; D555-S557 WeakPolarHBondContact OD1-CB 3.5Å; D555-S557 PolarHBondContact OD1-N 3.35Å; D555-S557 PolarHBondContact OD1-OG 2.79Å; D555-S557 PolarHBondContact OD2-OG 3.49Å; D555-I558 HydrophobicContact CB-CD1 3.7Å; D555-I558 HydrophobicContact CB-CG1 3.94Å; D555-W605 HydrophobicContact CB-CB 4.15Å; D555-W605 HydrophobicContact CB-CG 3.95Å; D555-W605 WeakPolarHBondContact OD2-CB 3.42Å; D555-R646 WeakPolarHBondContact OD2-CD 3.39Å; D555-R646 IonicContact OD2-NH1 2.99Å; D555-R646 PolarHBondContact OD2-NH1 3.32Å
556	C	84	Confident	81.6	Confident	2 Å²	2	21 Å²	21	1%	0.014	11%	0.108	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78	-15.3	-179.3	-60.2	0	0	0	0	113.5	L421 I558 V566 H601 P602	L421-C556 HydrophobicContact CD2-CB 4.24Å; L421-C556 VanDerWaalsContact CD2-SG 3.53Å; C556-I558 VanDerWaalsContact C-N 3.31Å; C556-V566 HydrophobicContact CB-CB 4.45Å; C556-H601 HydrophobicContact CB-CB 4.33Å; C556-H601 PolarHBondContact O-ND1 3.29Å; C556-P602 HydrophobicContact CB-CG 4.1Å; C556-P602 VanDerWaalsContact CB-O 3.29Å; C556-P602 WeakPolarHBondContact CB-O 3.33Å; C556-P602 PolarHBondContact SG-O 3.06Å
557	S	77.4	Confident	81.1	Confident	7 Å²	7	21.3 Å²	21.3	5%	0.049	11%	0.11	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.2	-20.2	-179.7	68.6	0	0	0	0	113.2	D555 P559	D555-S557 VanDerWaalsContact C-N 3.32Å; D555-S557 WeakPolarHBondContact OD1-CB 3.5Å; D555-S557 PolarHBondContact OD1-N 3.35Å; D555-S557 PolarHBondContact OD1-OG 2.79Å; D555-S557 PolarHBondContact OD2-OG 3.49Å; S557-P559 WeakPolarHBondContact O-CD 3.24Å
558	I	77.2	Confident	80.7	Confident	10 Å²	10	23.1 Å²	23.1	5%	0.051	12%	0.116	C	C	.	.			trans	-73.3	111.9	-176.3	-61.4	180	0	0	0	109.7	Q411 T419 D555 C556	Q411-I558 HydrophobicContact CB-CD1 3.51Å; Q411-I558 HydrophobicContact CG-CD1 3.98Å; T419-I558 HydrophobicContact CG2-CB 4.49Å; T419-I558 HydrophobicContact CG2-CG2 3.89Å; D555-I558 HydrophobicContact CB-CD1 3.7Å; D555-I558 HydrophobicContact CB-CG1 3.94Å; C556-I558 VanDerWaalsContact C-N 3.31Å
559	P	74.3	Confident	79.9	Confident	20 Å²	20	23.5 Å²	23.5	13%	0.13	12%	0.118	C	C	.	.			trans	-84.1	157.7	179.8	34.8	-33.6	0	0	0	111.9	F10 R413 S557 Y564	F10-P559 VanDerWaalsContact CE2-CD 3.42Å; F10-P559 HydrophobicContact CE2-CG 3.89Å; F10-P559 HydrophobicContact CZ-CG 4.2Å; R413-P559 PolarHBondContact NH2-O 3.21Å; S557-P559 WeakPolarHBondContact O-CD 3.24Å; P559-Y564 CarbonylContact C-O 3.28Å; P559-Y564 WeakPolarHBondContact CA-O 3.47Å
560	C	73.8	Confident	78.8	Confident	12 Å²	12	27 Å²	27	8%	0.081	14%	0.137	C	C	.	.			trans	-71.7	174	166.7	74.2	0	0	0	0	112.1	G417 L422 N562 G563 Y564	G417-C560 WeakPolarHBondContact O-CA 3.47Å; L422-C560 HydrophobicContact CD1-CB 4Å; C560-N562 PolarHBondContact O-N 2.71Å; C560-N562 VanDerWaalsContact O-N 3.08Å; C560-N562 PolarHBondContact SG-N 3.36Å; C560-N562 VanDerWaalsContact SG-N 3.41Å; C560-G563 PolarHBondContact O-N 3.16Å; C560-Y564 PolarHBondContact N-O 3.15Å; C560-Y564 PolarHBondContact SG-N 3.49Å; C560-Y564 VanDerWaalsContact SG-N 3.38Å
561	K	71.6	Confident	77.8	Confident	142 Å²	142	35.4 Å²	35.4	62%	0.617	17%	0.17	S	C	*	.	T	Hydrogen-bonded Turn	trans	-52.9	-31.5	175.5	-77.2	179.6	178.9	-176.2	0	113.2	K415 F416 G563	K415-K561 WeakPolarHBondContact O-CE 3.28Å; K415-K561 PolarHBondContact O-NZ 3.02Å; F416-K561 WeakPolarHBondContact O-CB 3.24Å; K561-G563 VanDerWaalsContact C-N 3.29Å; K561-G563 PolarHBondContact O-N 2.84Å
562	N	66.4	Low	76.5	Confident	109 Å²	109	41.6 Å²	41.6	58%	0.583	20%	0.202	S	C	*	.	T	Hydrogen-bonded Turn	trans	-85.7	3.8	179.3	-63.5	-4.1	0	0	0	113.8	C560 Y564 R581	C560-N562 PolarHBondContact O-N 2.71Å; C560-N562 VanDerWaalsContact O-N 3.08Å; C560-N562 PolarHBondContact SG-N 3.36Å; C560-N562 VanDerWaalsContact SG-N 3.41Å; N562-Y564 HydrophobicContact CB-CD2 3.68Å; N562-Y564 HydrophobicContact CB-CE2 3.8Å; N562-R581 PolarHBondContact O-NE 2.74Å
563	G	69.5	Low	75.2	Confident	20 Å²	20	42.2 Å²	42.2	21%	0.206	21%	0.206	C	C	.	.	S	Bend	trans	83.9	11.9	178.5	0	0	0	0	0	114.9	C560 K561 N582	C560-G563 PolarHBondContact O-N 3.16Å; K561-G563 VanDerWaalsContact C-N 3.29Å; K561-G563 PolarHBondContact O-N 2.84Å; G563-N582 WeakPolarHBondContact O-CB 3.33Å; G563-N582 PolarHBondContact O-N 3.11Å
564	Y	74.5	Confident	74.3	Confident	85 Å²	85	47.4 Å²	47.4	33%	0.333	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	136.8	-179.7	-67.8	-96.7	0	0	0	112.4	P559 C560 N562 I579 K580 R581	P559-Y564 CarbonylContact C-O 3.28Å; P559-Y564 WeakPolarHBondContact CA-O 3.47Å; C560-Y564 PolarHBondContact N-O 3.15Å; C560-Y564 PolarHBondContact SG-N 3.49Å; C560-Y564 VanDerWaalsContact SG-N 3.38Å; N562-Y564 HydrophobicContact CB-CD2 3.68Å; N562-Y564 HydrophobicContact CB-CE2 3.8Å; Y564-I579 HydrophobicContact CD1-CG2 3.8Å; Y564-I579 HydrophobicContact CG-CG2 4.08Å; Y564-K580 WeakPolarHBondContact CA-O 3.03Å; Y564-R581 HydrophobicContact CD1-CB 3.99Å; Y564-R581 HydrophobicContact CE1-CB 3.81Å; Y564-R581 HydrophobicContact CE1-CG 4.48Å; Y564-R581 HydrophobicContact CE2-CG 4.32Å; Y564-R581 HydrophobicContact CG-CB 4.44Å
565	S	78.7	Confident	73.4	Confident	3 Å²	3	47.9 Å²	47.9	2%	0.021	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	164.9	177.3	49	0	0	0	0	111.4	I579 K580 H601	S565-I579 WeakPolarHBondContact O-CA 3.45Å; S565-K580 PolarHBondContact N-O 3.42Å; S565-K580 PolarHBondContact O-N 3.04Å; S565-K580 VanDerWaalsContact O-N 3.15Å; S565-H601 PolarHBondContact OG-CE1 3.5Å
566	V	80.6	Confident	72.8	Confident	1 Å²	1	47.8 Å²	47.8	1%	0.006	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89	132.2	-179.8	-178.1	0	0	0	0	109.7	L421 L422 A425 I546 C556 Y577 K578 H601	L421-V566 HydrophobicContact CD2-CB 4.41Å; L421-V566 HydrophobicContact CD2-CG2 4.22Å; L421-V566 HydrophobicContact CG-CG2 4.13Å; L422-V566 HydrophobicContact CD2-CG2 4.02Å; A425-V566 HydrophobicContact CB-CG2 3.92Å; I546-V566 HydrophobicContact CG2-CG1 4.42Å; C556-V566 HydrophobicContact CB-CB 4.45Å; V566-Y577 HydrophobicContact CG1-CD1 4.45Å; V566-K578 WeakPolarHBondContact CA-O 3.47Å; V566-H601 PolarHBondContact O-ND1 3.31Å
567	Y	76.7	Confident	72.6	Confident	7 Å²	7	47.9 Å²	47.9	3%	0.027	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	161.8	-179.4	69.4	-73.4	0	0	0	110.5	E569 K578 I579 K580	Y567-E569 HydrophobicContact CE2-CB 4.35Å; Y567-E569 PolarHBondContact OH-OE2 3.31Å; Y567-K578 WeakPolarHBondContact CD1-O 3.24Å; Y567-K578 HydrophobicContact CE1-CB 3.96Å; Y567-K578 HydrophobicContact CE1-CG 4.25Å; Y567-K578 WeakPolarHBondContact CE1-O 3.2Å; Y567-K578 PolarHBondContact N-O 3.37Å; Y567-K578 PolarHBondContact O-N 3.45Å; Y567-K578 VanDerWaalsContact OH-CB 3.31Å; Y567-K578 WeakPolarHBondContact OH-CB 3.32Å; Y567-K578 WeakPolarHBondContact OH-CD 3.37Å; Y567-K578 VanDerWaalsContact OH-CG 3.24Å; Y567-K578 WeakPolarHBondContact OH-CG 3.33Å; Y567-I579 VanDerWaalsContact CE1-C 3.43Å; Y567-K580 HydrophobicContact CD1-CB 3.58Å; Y567-K580 HydrophobicContact CD1-CD 4.25Å; Y567-K580 HydrophobicContact CD1-CG 4.09Å; Y567-K580 HydrophobicContact CD2-CD 4.25Å; Y567-K580 HydrophobicContact CE1-CB 3.15Å; Y567-K580 HydrophobicContact CE1-CD 3.52Å; Y567-K580 HydrophobicContact CE1-CG 3.21Å; Y567-K580 HydrophobicContact CE2-CD 3.52Å; Y567-K580 HydrophobicContact CE2-CG 4.18Å; Y567-K580 WeakPolarHBondContact OH-CD 3.14Å; Y567-K580 WeakPolarHBondContact OH-CE 3.49Å; Y567-K580 WeakPolarHBondContact OH-CG 3.06Å; Y567-K580 PolarHBondContact OH-NZ 3.29Å
568	H	75.8	Confident	72.5	Confident	49 Å²	49	52.4 Å²	52.4	23%	0.227	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	127.1	170.1	-81.2	-69.8	0	0	0	111.3	N570 G575 Y577 D600 P602	H568-N570 PolarHBondContact O-N 2.95Å; H568-G575 PolarHBondContact ND1-O 3.21Å; H568-Y577 AromaticContact CE1-CD1 3.86Å; H568-Y577 AromaticContact CE1-CE1 3.11Å; H568-Y577 WeakPolarHBondContact CE1-CE1 3.13Å; H568-Y577 AromaticContact CE1-CZ 3.61Å; H568-Y577 AromaticContact ND1-CD1 3.89Å; H568-Y577 AromaticContact ND1-CE1 3.61Å; H568-Y577 AromaticContact NE2-CE1 3.57Å; H568-D600 PolarHBondContact N-O 3.22Å; H568-P602 WeakPolarHBondContact NE2-CB 3.32Å
569	E	72.3	Confident	72.4	Confident	12 Å²	12	53.7 Å²	53.7	6%	0.056	26%	0.259	C	S	.	.			trans	-71.3	118.8	177	-170.6	56.7	-97.3	0	0	111.1	Y567 Y571 K574 G575 A576 K580	Y567-E569 HydrophobicContact CE2-CB 4.35Å; Y567-E569 PolarHBondContact OH-OE2 3.31Å; E569-Y571 VanDerWaalsContact C-N 3.31Å; E569-Y571 VanDerWaalsContact CG-O 3.28Å; E569-Y571 WeakPolarHBondContact CG-O 3.47Å; E569-Y571 PolarHBondContact OE1-N 3.39Å; E569-K574 CarbonylContact O-C 3.4Å; E569-K574 WeakPolarHBondContact O-CA 3.43Å; E569-G575 PolarHBondContact O-N 2.86Å; E569-A576 WeakPolarHBondContact CB-O 3.22Å; E569-A576 PolarHBondContact N-O 3.08Å; E569-K580 VanDerWaalsContact CD-NZ 3.3Å; E569-K580 IonicContact OE1-NZ 3.91Å; E569-K580 PolarHBondContact OE1-NZ 3.01Å; E569-K580 WeakPolarHBondContact OE2-CE 3.25Å; E569-K580 IonicContact OE2-NZ 2.81Å; E569-K580 PolarHBondContact OE2-NZ 3.46Å
570	N	69	Low	72.1	Confident	74 Å²	74	56.7 Å²	56.7	40%	0.396	27%	0.27	S	S	.	.	S	Bend	trans	-78.7	-21.5	178.2	-74.3	-27.4	0	0	0	112	H568	H568-N570 PolarHBondContact O-N 2.95Å
571	Y	67.2	Low	71.6	Confident	176 Å²	176	63.6 Å²	63.6	69%	0.69	29%	0.294	S	S	*	.	S	Bend	trans	-103.6	-179.8	179.3	-59.8	-77.7	0	0	0	111.9	E569 P573 K574	E569-Y571 VanDerWaalsContact C-N 3.31Å; E569-Y571 VanDerWaalsContact CG-O 3.28Å; E569-Y571 WeakPolarHBondContact CG-O 3.47Å; E569-Y571 PolarHBondContact OE1-N 3.39Å; Y571-P573 CarbonylContact O-C 3.55Å; Y571-K574 WeakPolarHBondContact O-CA 3.3Å; Y571-K574 PolarHBondContact O-N 3.1Å
572	I	61.9	Low	71	Confident	137 Å²	137	57.6 Å²	57.6	70%	0.703	27%	0.269	S	S	*	.	S	Bend	trans	-72.1	123.8	-173.9	-60.9	179.6	0	0	0	110
573	P	64.8	Low	70.2	Confident	14 Å²	14	58.5 Å²	58.5	9%	0.091	27%	0.273	C	S	.	.	S	Bend	cis	-84.8	119.9	3.7	29.3	-28.1	0	0	0	114.4	F540 Y571 G575 A576 I724 G728	F540-P573 HydrophobicContact CD1-CG 4.43Å; F540-P573 HydrophobicContact CE1-CG 3.47Å; F540-P573 VanDerWaalsContact CE1-CG 3.47Å; F540-P573 HydrophobicContact CE2-CG 3.65Å; F540-P573 HydrophobicContact CZ-CB 4.47Å; F540-P573 HydrophobicContact CZ-CG 3.05Å; Y571-P573 CarbonylContact O-C 3.55Å; P573-G575 PolarHBondContact O-N 3.16Å; P573-A576 HydrophobicContact CG-CB 4.14Å; P573-A576 WeakPolarHBondContact O-CB 3.38Å; P573-A576 PolarHBondContact O-N 2.93Å; P573-I724 HydrophobicContact CB-CB 4.49Å; P573-I724 HydrophobicContact CB-CD1 3.89Å; P573-I724 HydrophobicContact CB-CG1 4.12Å; P573-I724 HydrophobicContact CB-CG2 3.55Å; P573-I724 HydrophobicContact CG-CD1 3.68Å; P573-I724 HydrophobicContact CG-CG1 4.45Å; P573-I724 HydrophobicContact CG-CG2 4.4Å; P573-G728 CarbonylContact C-O 3.54Å; P573-G728 WeakPolarHBondContact CA-O 3.29Å
574	K	69.4	Low	69.1	Low	109 Å²	109	62.5 Å²	62.5	47%	0.474	29%	0.286	S	S	.	.	B	Isolated β-bridge	trans	-71.9	128.1	-168.9	-177.6	174.1	-179.8	168.2	0	111.1	E569 Y571 G728 R729 A730	E569-K574 CarbonylContact O-C 3.4Å; E569-K574 WeakPolarHBondContact O-CA 3.43Å; Y571-K574 WeakPolarHBondContact O-CA 3.3Å; Y571-K574 PolarHBondContact O-N 3.1Å; K574-G728 PolarHBondContact N-O 3.4Å; K574-R729 HydrophobicContact CB-CG 4.33Å; K574-A730 VanDerWaalsContact O-CB 3.3Å; K574-A730 WeakPolarHBondContact O-CB 3.47Å; K574-A730 PolarHBondContact O-N 3.48Å
575	G	69.9	Low	67.2	Low	14 Å²	14	62.8 Å²	62.8	14%	0.144	30%	0.3	C	S	.	.	T	Hydrogen-bonded Turn	trans	92.1	-9.8	178.4	0	0	0	0	0	114.6	H568 E569 P573	H568-G575 PolarHBondContact ND1-O 3.21Å; E569-G575 PolarHBondContact O-N 2.86Å; P573-G575 PolarHBondContact O-N 3.16Å
576	A	74.5	Confident	65	Low	0 Å²	0	67.7 Å²	67.7	0%	0	33%	0.334	C	S	.	.			trans	-67.9	149.9	174.5	0	0	0	0	0	111.1	E569 P573 I724	E569-A576 WeakPolarHBondContact CB-O 3.22Å; E569-A576 PolarHBondContact N-O 3.08Å; P573-A576 HydrophobicContact CG-CB 4.14Å; P573-A576 WeakPolarHBondContact O-CB 3.38Å; P573-A576 PolarHBondContact O-N 2.93Å; A576-I724 HydrophobicContact CB-CD1 4.11Å; A576-I724 HydrophobicContact CB-CG1 4.49Å
577	Y	78.1	Confident	62.7	Low	5 Å²	5	73.6 Å²	73.6	2%	0.02	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	130.2	171.8	-56.8	-67.7	0	0	0	110	Q543 I546 I550 V566 H568 P602 L721	Q543-Y577 PolarHBondContact NE2-O 3.09Å; Q543-Y577 VanDerWaalsContact OE1-CD2 3.24Å; I546-Y577 HydrophobicContact CB-CD2 4.12Å; I546-Y577 HydrophobicContact CG2-CD1 4.26Å; I546-Y577 HydrophobicContact CG2-CD2 3.63Å; I546-Y577 HydrophobicContact CG2-CE2 4.22Å; I546-Y577 HydrophobicContact CG2-CG 3.66Å; I550-Y577 HydrophobicContact CD1-CD1 4.28Å; I550-Y577 HydrophobicContact CD1-CE1 3.69Å; I550-Y577 HydrophobicContact CD1-CE2 4.4Å; V566-Y577 HydrophobicContact CG1-CD1 4.45Å; H568-Y577 AromaticContact CE1-CD1 3.86Å; H568-Y577 AromaticContact CE1-CE1 3.11Å; H568-Y577 WeakPolarHBondContact CE1-CE1 3.13Å; H568-Y577 AromaticContact CE1-CZ 3.61Å; H568-Y577 AromaticContact ND1-CD1 3.89Å; H568-Y577 AromaticContact ND1-CE1 3.61Å; H568-Y577 AromaticContact NE2-CE1 3.57Å; Y577-P602 HydrophobicContact CD1-CG 3.8Å; Y577-P602 HydrophobicContact CE1-CB 3.84Å; Y577-P602 HydrophobicContact CE1-CG 3.6Å; Y577-L721 HydrophobicContact CD2-CD2 4.05Å; Y577-L721 HydrophobicContact CE2-CD2 3.88Å
578	K	75.1	Confident	60.7	Low	101 Å²	101	75.4 Å²	75.4	44%	0.439	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	161.5	175.8	-175.8	167.1	175.4	-179.5	0	110.2	V566 Y567	V566-K578 WeakPolarHBondContact CA-O 3.47Å; Y567-K578 WeakPolarHBondContact CD1-O 3.24Å; Y567-K578 HydrophobicContact CE1-CB 3.96Å; Y567-K578 HydrophobicContact CE1-CG 4.25Å; Y567-K578 WeakPolarHBondContact CE1-O 3.2Å; Y567-K578 PolarHBondContact N-O 3.37Å; Y567-K578 PolarHBondContact O-N 3.45Å; Y567-K578 VanDerWaalsContact OH-CB 3.31Å; Y567-K578 WeakPolarHBondContact OH-CB 3.32Å; Y567-K578 WeakPolarHBondContact OH-CD 3.37Å; Y567-K578 VanDerWaalsContact OH-CG 3.24Å; Y567-K578 WeakPolarHBondContact OH-CG 3.33Å
579	I	75.8	Confident	58.7	Low	37 Å²	37	81.4 Å²	81.4	19%	0.19	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	125.7	174.5	-55.1	-179.7	0	0	0	109.5	A425 K426 Y564 S565 Y567	A425-I579 HydrophobicContact CB-CD1 3.62Å; A425-I579 HydrophobicContact CB-CG1 3.62Å; A425-I579 WeakPolarHBondContact O-CD1 3.45Å; K426-I579 HydrophobicContact CB-CD1 4.43Å; K426-I579 HydrophobicContact CG-CD1 3.82Å; Y564-I579 HydrophobicContact CD1-CG2 3.8Å; Y564-I579 HydrophobicContact CG-CG2 4.08Å; S565-I579 WeakPolarHBondContact O-CA 3.45Å; Y567-I579 VanDerWaalsContact CE1-C 3.43Å
580	K	69	Low	56.7	Low	83 Å²	83	87.3 Å²	87.3	36%	0.361	44%	0.438	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	151.9	173.3	-92.9	173.8	-169.4	150.3	0	108.6	Y564 S565 Y567 E569 N582	Y564-K580 WeakPolarHBondContact CA-O 3.03Å; S565-K580 PolarHBondContact N-O 3.42Å; S565-K580 PolarHBondContact O-N 3.04Å; S565-K580 VanDerWaalsContact O-N 3.15Å; Y567-K580 HydrophobicContact CD1-CB 3.58Å; Y567-K580 HydrophobicContact CD1-CD 4.25Å; Y567-K580 HydrophobicContact CD1-CG 4.09Å; Y567-K580 HydrophobicContact CD2-CD 4.25Å; Y567-K580 HydrophobicContact CE1-CB 3.15Å; Y567-K580 HydrophobicContact CE1-CD 3.52Å; Y567-K580 HydrophobicContact CE1-CG 3.21Å; Y567-K580 HydrophobicContact CE2-CD 3.52Å; Y567-K580 HydrophobicContact CE2-CG 4.18Å; Y567-K580 WeakPolarHBondContact OH-CD 3.14Å; Y567-K580 WeakPolarHBondContact OH-CE 3.49Å; Y567-K580 WeakPolarHBondContact OH-CG 3.06Å; Y567-K580 PolarHBondContact OH-NZ 3.29Å; E569-K580 VanDerWaalsContact CD-NZ 3.3Å; E569-K580 IonicContact OE1-NZ 3.91Å; E569-K580 PolarHBondContact OE1-NZ 3.01Å; E569-K580 WeakPolarHBondContact OE2-CE 3.25Å; E569-K580 IonicContact OE2-NZ 2.81Å; E569-K580 PolarHBondContact OE2-NZ 3.46Å; K580-N582 PolarHBondContact O-N 3.15Å
581	R	62.6	Low	54.8	Low	157 Å²	157	86.3 Å²	86.3	59%	0.592	44%	0.437	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72.3	123.5	171	-161.5	170.4	-176.3	164.1	-1.7	108.6	N562 Y564 I583	N562-R581 PolarHBondContact O-NE 2.74Å; Y564-R581 HydrophobicContact CD1-CB 3.99Å; Y564-R581 HydrophobicContact CE1-CB 3.81Å; Y564-R581 HydrophobicContact CE1-CG 4.48Å; Y564-R581 HydrophobicContact CE2-CG 4.32Å; Y564-R581 HydrophobicContact CG-CB 4.44Å; R581-I583 PolarHBondContact O-N 3.18Å
582	N	59.7	Low	53.2	Low	16 Å²	16	83.9 Å²	83.9	9%	0.086	43%	0.434	C	S	.	.			trans	-70.9	112.4	171.4	-167.9	-3.6	0	0	0	108.2	G563 K580 Q584	G563-N582 WeakPolarHBondContact O-CB 3.33Å; G563-N582 PolarHBondContact O-N 3.11Å; K580-N582 PolarHBondContact O-N 3.15Å; N582-Q584 PolarHBondContact ND2-OE1 3.47Å; N582-Q584 PolarHBondContact O-N 3.2Å; N582-Q584 VanDerWaalsContact OD1-CB 3.23Å; N582-Q584 WeakPolarHBondContact OD1-CB 3.23Å; N582-Q584 VanDerWaalsContact OD1-CG 3.25Å; N582-Q584 WeakPolarHBondContact OD1-CG 3.13Å; N582-Q584 PolarHBondContact OD1-N 3.16Å; N582-Q584 PolarHBondContact OD1-OE1 3.02Å
583	I	48.2	Very low	51.8	Low	129 Å²	129	87.3 Å²	87.3	66%	0.662	44%	0.444	S	S	*	.			trans	-77.6	9.6	179	-61.5	171.8	0	0	0	111.1	R581 S585	R581-I583 PolarHBondContact O-N 3.18Å; I583-S585 PolarHBondContact O-N 3.49Å; I583-S585 VanDerWaalsContact O-N 3.11Å
584	Q	46.8	Very low	50	Low	104 Å²	104	98.2 Å²	98.2	49%	0.486	48%	0.483	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.2	75.9	177.2	-69.7	178.2	-19.2	0	0	112.9	N582 L588	N582-Q584 PolarHBondContact ND2-OE1 3.47Å; N582-Q584 PolarHBondContact O-N 3.2Å; N582-Q584 VanDerWaalsContact OD1-CB 3.23Å; N582-Q584 WeakPolarHBondContact OD1-CB 3.23Å; N582-Q584 VanDerWaalsContact OD1-CG 3.25Å; N582-Q584 WeakPolarHBondContact OD1-CG 3.13Å; N582-Q584 PolarHBondContact OD1-N 3.16Å; N582-Q584 PolarHBondContact OD1-OE1 3.02Å; Q584-L588 HydrophobicContact CG-CD1 3.52Å
585	S	35.9	Very low	48.1	Very low	90 Å²	90	96 Å²	96	63%	0.629	48%	0.481	S	S	*	.	T	Hydrogen-bonded Turn	trans	-151.6	9.7	159.5	64.3	0	0	0	0	117.1	I583	I583-S585 PolarHBondContact O-N 3.49Å; I583-S585 VanDerWaalsContact O-N 3.11Å
586	S	32.1	Very low	46.1	Very low	106 Å²	106	106.1 Å²	106.1	74%	0.741	52%	0.521	S	S	*	.	T	Hydrogen-bonded Turn	trans	-153	-12.3	172.6	57.7	0	0	0	0	118.3
587	L	31.7	Very low	44.2	Very low	126 Å²	126	108.8 Å²	108.8	66%	0.66	55%	0.549	S	S	*	.	S	Bend	trans	-121	1.3	-168.6	-80.2	159.7	0	0	0	116.8
588	L	34	Very low	42.5	Very low	45 Å²	45	112.7 Å²	112.7	24%	0.236	57%	0.569	C	S	.	*			trans	-109.5	10.5	-165.7	-91.5	155.8	0	0	0	116.8	Q584 T590 I592 L598	Q584-L588 HydrophobicContact CG-CD1 3.52Å; L588-T590 PolarHBondContact O-N 3.45Å; L588-I592 HydrophobicContact CD2-CG1 4.08Å; L588-L598 HydrophobicContact CD1-CD2 4.31Å
589	K	34.9	Very low	41.4	Very low	175 Å²	175	110.2 Å²	110.2	76%	0.761	56%	0.561	S	S	*	*	S	Bend	trans	-72.8	-7.5	173.1	-85.4	-177.7	176.8	176	0	114.3
590	T	29.8	Very low	40.7	Very low	136 Å²	136	111.9 Å²	111.9	83%	0.834	57%	0.57	S	S	*	*	S	Bend	trans	-129.3	-6.3	-173.9	44.8	0	0	0	0	116	L588	L588-T590 PolarHBondContact O-N 3.45Å
591	S	29.2	Very low	40.8	Very low	53 Å²	53	109.2 Å²	109.2	37%	0.371	56%	0.559	S	S	.	*			trans	-121.1	4.2	-165.7	46	0	0	0	0	116.6	K593 R594	S591-K593 PolarHBondContact O-N 2.73Å; S591-R594 PolarHBondContact O-N 3.37Å
592	I	32.9	Very low	41.4	Very low	125 Å²	125	102.1 Å²	102.1	64%	0.641	53%	0.533	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.8	-7	-178.1	-66.3	172.1	0	0	0	113.8	L588	L588-I592 HydrophobicContact CD2-CG1 4.08Å
593	K	32.4	Very low	42.4	Very low	209 Å²	209	101.5 Å²	101.5	91%	0.909	53%	0.531	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.3	-4.1	176.6	-77.6	-175.2	175.9	179.2	0	115.7	S591	S591-K593 PolarHBondContact O-N 2.73Å
594	R	27.2	Very low	44.3	Very low	243 Å²	243	95.5 Å²	95.5	92%	0.917	50%	0.5	S	S	*	.	S	Bend	trans	-133.7	2.2	-169.7	-77.4	-172.4	177.9	171	-0.1	119.8	S591	S591-R594 PolarHBondContact O-N 3.37Å
595	S	29.5	Very low	46.2	Very low	61 Å²	61	90.6 Å²	90.6	43%	0.427	48%	0.477	S	S	.	.			trans	-115.3	95	-176.2	59.8	0	0	0	0	114.3	G597	S595-G597 PolarHBondContact O-N 2.81Å
596	K	29.1	Very low	48.5	Very low	228 Å²	228	86.7 Å²	86.7	99%	0.991	45%	0.449	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.1	38.1	165.9	-82.1	-178.9	169.5	177.8	0	113.5
597	G	33.3	Very low	50.9	Low	56 Å²	56	82 Å²	82	58%	0.577	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	-164.6	25.1	-168.7	0	0	0	0	0	119.7	S595	S595-G597 PolarHBondContact O-N 2.81Å
598	L	43.1	Very low	53.4	Low	86 Å²	86	76 Å²	76	45%	0.45	39%	0.385	S	S	.	.			trans	-110.5	112.7	-176.8	-100.4	86.4	0	0	0	113.7	L588	L588-L598 HydrophobicContact CD1-CD2 4.31Å
599	I	51.6	Low	55.6	Low	50 Å²	50	75.9 Å²	75.9	26%	0.256	38%	0.384	S	S	.	.			trans	48.8	98.4	158.8	-44.7	174.8	0	0	0	115.9	H601 R610	I599-H601 WeakPolarHBondContact CG2-NE2 3.23Å; I599-H601 PolarHBondContact O-N 3.43Å; I599-R610 PolarHBondContact O-NH2 2.94Å; I599-R610 VanDerWaalsContact O-NH2 3.09Å
600	D	62.7	Low	57.9	Low	72 Å²	72	71 Å²	71	39%	0.385	36%	0.361	S	S	.	.			trans	-91.4	99.1	170	-69.6	-36.5	0	0	0	110.2	H568 R610	H568-D600 PolarHBondContact N-O 3.22Å; D600-R610 IonicContact OD1-CZ 3.52Å; D600-R610 IonicContact OD1-NH1 2.86Å; D600-R610 PolarHBondContact OD1-NH1 3.38Å; D600-R610 IonicContact OD1-NH2 3.53Å; D600-R610 PolarHBondContact OD1-NH2 3.41Å
601	H	69.3	Low	60.2	Low	27 Å²	27	64.7 Å²	64.7	13%	0.125	32%	0.322	C	S	.	.			trans	-72.2	125.5	169	-70.9	-58.2	0	0	0	109.5	C556 S565 V566 I599 P606	C556-H601 HydrophobicContact CB-CB 4.33Å; C556-H601 PolarHBondContact O-ND1 3.29Å; S565-H601 PolarHBondContact OG-CE1 3.5Å; V566-H601 PolarHBondContact O-ND1 3.31Å; I599-H601 WeakPolarHBondContact CG2-NE2 3.23Å; I599-H601 PolarHBondContact O-N 3.43Å; H601-P606 HydrophobicContact CB-CB 3.81Å; H601-P606 HydrophobicContact CB-CG 3.43Å; H601-P606 VanDerWaalsContact CB-CG 3.43Å
602	P	76.9	Confident	62.5	Low	7 Å²	7	62.8 Å²	62.8	5%	0.045	31%	0.307	C	S	.	.			trans	-68.2	160.8	174.6	13.4	-14.4	0	0	0	112.7	I550 C556 H568 Y577	I550-P602 HydrophobicContact CD1-CB 4.09Å; I550-P602 HydrophobicContact CD1-CG 4.15Å; C556-P602 HydrophobicContact CB-CG 4.1Å; C556-P602 VanDerWaalsContact CB-O 3.29Å; C556-P602 WeakPolarHBondContact CB-O 3.33Å; C556-P602 PolarHBondContact SG-O 3.06Å; H568-P602 WeakPolarHBondContact NE2-CB 3.32Å; Y577-P602 HydrophobicContact CD1-CG 3.8Å; Y577-P602 HydrophobicContact CE1-CB 3.84Å; Y577-P602 HydrophobicContact CE1-CG 3.6Å
603	G	80.7	Confident	64.6	Low	4 Å²	4	61.6 Å²	61.6	4%	0.041	30%	0.296	C	S	.	.	S	Bend	trans	96.9	-178.4	171.3	0	0	0	0	0	113.9
604	I	87.7	Confident	66.8	Low	3 Å²	3	51.7 Å²	51.7	2%	0.015	25%	0.253	C	S	.	.	H	α-helix	trans	-77.5	-41.1	-170	-168.4	159.5	0	0	0	113.3	I607 V608 L631 I635 I640 L642 V651	I604-I607 PolarHBondContact O-N 2.68Å; I604-V608 HydrophobicContact CG1-CG2 4.01Å; I604-V608 WeakPolarHBondContact O-CG2 3.32Å; I604-V608 PolarHBondContact O-N 3.17Å; I604-L631 HydrophobicContact CD1-CD1 3.91Å; I604-L631 HydrophobicContact CG1-CD1 3.53Å; I604-I635 HydrophobicContact CD1-CD1 4.18Å; I604-I635 HydrophobicContact CD1-CG1 4.09Å; I604-I640 HydrophobicContact CB-CD1 4.28Å; I604-I640 HydrophobicContact CG2-CG2 4.12Å; I604-L642 HydrophobicContact CD1-CD2 3.26Å; I604-V651 HydrophobicContact CD1-CG1 4.24Å; I604-V651 HydrophobicContact CD1-CG2 4.08Å; I604-V651 HydrophobicContact CG1-CG2 4.35Å; I604-V651 HydrophobicContact CG2-CG2 4.2Å
605	W	86.2	Confident	69.1	Low	1 Å²	1	40.2 Å²	40.2	0%	0.004	21%	0.21	C	C	.	.	H	α-helix	trans	-61.7	-45.6	-171.9	-62	107.3	0	0	0	114.4	G553 D555 I607 V608 D609 A644 R646 V651 W654	G553-W605 PolarHBondContact O-NE1 3.37Å; D555-W605 HydrophobicContact CB-CB 4.15Å; D555-W605 HydrophobicContact CB-CG 3.95Å; D555-W605 WeakPolarHBondContact OD2-CB 3.42Å; W605-I607 VanDerWaalsContact C-N 3.26Å; W605-I607 PolarHBondContact O-N 2.99Å; W605-V608 PolarHBondContact O-N 3.24Å; W605-D609 PolarHBondContact O-N 2.87Å; W605-A644 WeakPolarHBondContact CZ2-O 3.5Å; W605-R646 HydrophobicContact CD2-CB 4.08Å; W605-R646 HydrophobicContact CE3-CB 3.92Å; W605-R646 HydrophobicContact CE3-CG 4.48Å; W605-R646 HydrophobicContact CH2-CB 3.37Å; W605-R646 HydrophobicContact CZ2-CB 3.55Å; W605-R646 HydrophobicContact CZ3-CB 3.57Å; W605-R646 HydrophobicContact CZ3-CG 4.49Å; W605-V651 HydrophobicContact CD2-CG2 4.43Å; W605-V651 HydrophobicContact CE3-CG2 4.24Å; W605-V651 HydrophobicContact CH2-CB 4.37Å; W605-V651 HydrophobicContact CH2-CG2 3.51Å; W605-V651 HydrophobicContact CZ2-CG2 3.71Å; W605-V651 HydrophobicContact CZ3-CG2 3.8Å; W605-W654 HydrophobicContact CZ3-CE3 4.44Å
606	P	83.5	Confident	71.2	Confident	8 Å²	8	42.1 Å²	42.1	5%	0.052	21%	0.212	C	C	.	.	H	α-helix	trans	-61	-33.7	177.5	-20.8	31.5	0	0	0	113.4	H601 R610	H601-P606 HydrophobicContact CB-CB 3.81Å; H601-P606 HydrophobicContact CB-CG 3.43Å; H601-P606 VanDerWaalsContact CB-CG 3.43Å; P606-R610 VanDerWaalsContact O-CG 3.26Å; P606-R610 WeakPolarHBondContact O-CG 3.49Å; P606-R610 PolarHBondContact O-N 2.88Å; P606-R610 VanDerWaalsContact O-N 3.12Å
607	I	84.1	Confident	73.4	Confident	6 Å²	6	35.5 Å²	35.5	3%	0.031	18%	0.184	C	C	.	.	H	α-helix	trans	-72.3	-43.5	178.6	-60.8	168.1	0	0	0	110	I604 W605 D609 R610 L611 E630 L631 T634	I604-I607 PolarHBondContact O-N 2.68Å; W605-I607 VanDerWaalsContact C-N 3.26Å; W605-I607 PolarHBondContact O-N 2.99Å; I607-D609 VanDerWaalsContact C-N 3.32Å; I607-D609 PolarHBondContact O-N 2.97Å; I607-R610 PolarHBondContact O-N 3.04Å; I607-L611 WeakPolarHBondContact O-CB 3.29Å; I607-L611 PolarHBondContact O-N 3.46Å; I607-E630 HydrophobicContact CD1-CG 4.04Å; I607-E630 HydrophobicContact CG1-CG 4.47Å; I607-E630 HydrophobicContact CG2-CB 4.48Å; I607-L631 HydrophobicContact CG2-CB 3.94Å; I607-L631 HydrophobicContact CG2-CD1 4.35Å; I607-T634 HydrophobicContact CD1-CG2 3.91Å; I607-T634 WeakPolarHBondContact CD1-OG1 3.33Å
608	V	83.9	Confident	75.2	Confident	2 Å²	2	38.7 Å²	38.7	1%	0.012	18%	0.184	C	C	.	.	H	α-helix	trans	-59.7	-43.9	176.1	171.8	0	0	0	0	110.6	I604 W605 L611 I612 L631 V651 I655	I604-V608 HydrophobicContact CG1-CG2 4.01Å; I604-V608 WeakPolarHBondContact O-CG2 3.32Å; I604-V608 PolarHBondContact O-N 3.17Å; W605-V608 PolarHBondContact O-N 3.24Å; V608-L611 PolarHBondContact O-N 2.77Å; V608-I612 HydrophobicContact CG1-CD1 3.64Å; V608-I612 HydrophobicContact CG1-CG1 4.45Å; V608-I612 WeakPolarHBondContact O-CD1 3.32Å; V608-I612 VanDerWaalsContact O-CG1 3.28Å; V608-I612 WeakPolarHBondContact O-CG1 3.48Å; V608-I612 PolarHBondContact O-N 3.39Å; V608-L631 HydrophobicContact CG2-CD1 4.03Å; V608-V651 HydrophobicContact CG2-CG1 3.79Å; V608-I655 HydrophobicContact CG1-CG1 4.26Å
609	D	80.6	Confident	76.9	Confident	41 Å²	41	38.5 Å²	38.5	22%	0.219	18%	0.179	C	C	.	.	H	α-helix	trans	-62.6	-44.7	176.8	-68.8	-25.4	0	0	0	112.2	W605 I607 L611 I612 Y613 R646	W605-D609 PolarHBondContact O-N 2.87Å; I607-D609 VanDerWaalsContact C-N 3.32Å; I607-D609 PolarHBondContact O-N 2.97Å; D609-L611 VanDerWaalsContact C-N 3.3Å; D609-L611 PolarHBondContact O-N 3.29Å; D609-I612 PolarHBondContact O-N 3.38Å; D609-Y613 VanDerWaalsContact O-CB 3.3Å; D609-Y613 WeakPolarHBondContact O-CB 3.35Å; D609-Y613 PolarHBondContact O-N 3.03Å; D609-R646 IonicContact OD1-CZ 2.99Å; D609-R646 IonicContact OD1-NH1 2.65Å; D609-R646 PolarHBondContact OD1-NH1 3.09Å; D609-R646 IonicContact OD1-NH2 2.52Å; D609-R646 PolarHBondContact OD1-NH2 3.48Å; D609-R646 IonicContact OD2-CZ 3.89Å; D609-R646 IonicContact OD2-NH1 3.51Å; D609-R646 PolarHBondContact OD2-NH1 2.94Å; D609-R646 IonicContact OD2-NH2 2.68Å
610	R	81.3	Confident	78.3	Confident	74 Å²	74	39.2 Å²	39.2	28%	0.279	19%	0.189	S	C	.	.	H	α-helix	trans	-63.2	-36.4	175.5	-72.7	172.5	-175.7	-174.6	-0.9	112.1	I599 D600 P606 I607 S614 F627	I599-R610 PolarHBondContact O-NH2 2.94Å; I599-R610 VanDerWaalsContact O-NH2 3.09Å; D600-R610 IonicContact OD1-CZ 3.52Å; D600-R610 IonicContact OD1-NH1 2.86Å; D600-R610 PolarHBondContact OD1-NH1 3.38Å; D600-R610 IonicContact OD1-NH2 3.53Å; D600-R610 PolarHBondContact OD1-NH2 3.41Å; P606-R610 VanDerWaalsContact O-CG 3.26Å; P606-R610 WeakPolarHBondContact O-CG 3.49Å; P606-R610 PolarHBondContact O-N 2.88Å; P606-R610 VanDerWaalsContact O-N 3.12Å; I607-R610 PolarHBondContact O-N 3.04Å; R610-S614 WeakPolarHBondContact O-CB 3.35Å; R610-S614 PolarHBondContact O-N 3.33Å; R610-S614 PolarHBondContact O-OG 3.31Å; R610-F627 HydrophobicContact CB-CD1 4.24Å; R610-F627 HydrophobicContact CB-CE1 3.91Å; R610-F627 HydrophobicContact CB-CE2 4.38Å; R610-F627 HydrophobicContact CB-CZ 3.99Å; R610-F627 HydrophobicContact CG-CE1 4.48Å
611	L	79.9	Confident	79.1	Confident	2 Å²	2	39.2 Å²	39.2	1%	0.01	19%	0.188	C	C	.	.	H	α-helix	trans	-67.9	-49.3	177.7	-177	141	0	0	0	110.9	I607 V608 D609 Y613 S614 V615 F627 L675	I607-L611 WeakPolarHBondContact O-CB 3.29Å; I607-L611 PolarHBondContact O-N 3.46Å; V608-L611 PolarHBondContact O-N 2.77Å; D609-L611 VanDerWaalsContact C-N 3.3Å; D609-L611 PolarHBondContact O-N 3.29Å; L611-Y613 VanDerWaalsContact C-N 3.35Å; L611-Y613 PolarHBondContact O-N 2.63Å; L611-S614 WeakPolarHBondContact O-CB 3.42Å; L611-S614 PolarHBondContact O-N 2.92Å; L611-S614 VanDerWaalsContact O-N 3.1Å; L611-V615 WeakPolarHBondContact O-CG2 3.3Å; L611-V615 PolarHBondContact O-N 2.96Å; L611-F627 HydrophobicContact CB-CB 4.16Å; L611-F627 HydrophobicContact CD1-CB 4.04Å; L611-F627 HydrophobicContact CG-CB 4.46Å; L611-L675 HydrophobicContact CD1-CD1 4.02Å; L611-L675 HydrophobicContact CD1-CD2 4.19Å; L611-L675 HydrophobicContact CD2-CD1 3.58Å; L611-L675 HydrophobicContact CG-CD1 4.42Å
612	I	77.4	Confident	79.7	Confident	13 Å²	13	43.5 Å²	43.5	7%	0.067	21%	0.212	C	C	.	.	H	α-helix	trans	-57.1	-49.5	175.9	-70.3	157.9	0	0	0	110.3	V608 D609 S614 V615 Q616 L658	V608-I612 HydrophobicContact CG1-CD1 3.64Å; V608-I612 HydrophobicContact CG1-CG1 4.45Å; V608-I612 WeakPolarHBondContact O-CD1 3.32Å; V608-I612 VanDerWaalsContact O-CG1 3.28Å; V608-I612 WeakPolarHBondContact O-CG1 3.48Å; V608-I612 PolarHBondContact O-N 3.39Å; D609-I612 PolarHBondContact O-N 3.38Å; I612-S614 VanDerWaalsContact C-N 3.25Å; I612-S614 PolarHBondContact O-N 3.1Å; I612-V615 PolarHBondContact O-N 3.22Å; I612-V615 VanDerWaalsContact O-N 3.13Å; I612-Q616 HydrophobicContact CG2-CG 4.27Å; I612-Q616 WeakPolarHBondContact O-CG 3.32Å; I612-Q616 PolarHBondContact O-N 3.2Å; I612-L658 HydrophobicContact CB-CD1 4.48Å; I612-L658 HydrophobicContact CD1-CD1 3.41Å; I612-L658 VanDerWaalsContact CD1-CD1 3.41Å; I612-L658 HydrophobicContact CG1-CD1 3.91Å; I612-L658 HydrophobicContact CG2-CD1 3.77Å
613	Y	76.2	Confident	80	Confident	100 Å²	100	45.2 Å²	45.2	39%	0.392	22%	0.222	S	C	.	.	H	α-helix	trans	-56.6	-40.9	176.7	179.1	-89.9	0	0	0	112	D609 L611 V615 H617	D609-Y613 VanDerWaalsContact O-CB 3.3Å; D609-Y613 WeakPolarHBondContact O-CB 3.35Å; D609-Y613 PolarHBondContact O-N 3.03Å; L611-Y613 VanDerWaalsContact C-N 3.35Å; L611-Y613 PolarHBondContact O-N 2.63Å; Y613-V615 VanDerWaalsContact C-N 3.34Å; Y613-V615 PolarHBondContact O-N 2.69Å; Y613-H617 AromaticContact CD1-CD2 3.99Å; Y613-H617 AromaticContact CD2-CD2 3.44Å; Y613-H617 VanDerWaalsContact CD2-CD2 3.44Å; Y613-H617 WeakPolarHBondContact CD2-CD2 3.4Å; Y613-H617 AromaticContact CD2-NE2 3.62Å; Y613-H617 AromaticContact CE1-CD2 3.72Å; Y613-H617 AromaticContact CE2-CD2 3.14Å; Y613-H617 WeakPolarHBondContact CE2-CD2 3.46Å; Y613-H617 AromaticContact CE2-NE2 3.1Å; Y613-H617 WeakPolarHBondContact CE2-NE2 3.48Å; Y613-H617 AromaticContact CG-CD2 3.85Å; Y613-H617 AromaticContact CZ-CD2 3.27Å; Y613-H617 AromaticContact CZ-NE2 3.58Å; Y613-H617 WeakPolarHBondContact O-CB 3.36Å; Y613-H617 PolarHBondContact O-CD2 2.95Å; Y613-H617 VanDerWaalsContact O-CD2 3.28Å; Y613-H617 PolarHBondContact O-N 2.99Å; Y613-H617 VanDerWaalsContact O-N 3.09Å
614	S	78.5	Confident	80	Confident	1 Å²	1	45 Å²	45	1%	0.007	22%	0.22	C	C	.	.	H	α-helix	trans	-67.9	-34.3	180	-60.7	0	0	0	0	112.5	R610 L611 I612 H618 K619 F627	R610-S614 WeakPolarHBondContact O-CB 3.35Å; R610-S614 PolarHBondContact O-N 3.33Å; R610-S614 PolarHBondContact O-OG 3.31Å; L611-S614 WeakPolarHBondContact O-CB 3.42Å; L611-S614 PolarHBondContact O-N 2.92Å; L611-S614 VanDerWaalsContact O-N 3.1Å; I612-S614 VanDerWaalsContact C-N 3.25Å; I612-S614 PolarHBondContact O-N 3.1Å; S614-H618 PolarHBondContact O-N 2.99Å; S614-K619 WeakPolarHBondContact O-CB 3.41Å; S614-K619 PolarHBondContact O-N 2.94Å; S614-F627 WeakPolarHBondContact OG-CE2 3.41Å
615	V	75.8	Confident	79.8	Confident	3 Å²	3	47.8 Å²	47.8	2%	0.018	24%	0.235	C	C	.	.	H	α-helix	trans	-72.3	-48	174.8	175.5	0	0	0	0	110.9	L611 I612 Y613 H617 H618 I624 I668	L611-V615 WeakPolarHBondContact O-CG2 3.3Å; L611-V615 PolarHBondContact O-N 2.96Å; I612-V615 PolarHBondContact O-N 3.22Å; I612-V615 VanDerWaalsContact O-N 3.13Å; Y613-V615 VanDerWaalsContact C-N 3.34Å; Y613-V615 PolarHBondContact O-N 2.69Å; V615-H617 VanDerWaalsContact C-N 3.27Å; V615-H617 PolarHBondContact O-N 2.87Å; V615-H618 PolarHBondContact O-N 3.25Å; V615-H618 VanDerWaalsContact O-N 3.13Å; V615-I624 HydrophobicContact CG2-CD1 4.12Å; V615-I624 HydrophobicContact CG2-CG1 4.37Å; V615-I668 HydrophobicContact CG1-CG1 4.44Å; V615-I668 HydrophobicContact CG1-CG2 4.46Å
616	Q	73.5	Confident	79.8	Confident	100 Å²	100	54.4 Å²	54.4	47%	0.467	26%	0.261	S	S	.	.	H	α-helix	trans	-60.4	-34.1	-179.7	-74.5	177.2	-29	0	0	113.1	I612	I612-Q616 HydrophobicContact CG2-CG 4.27Å; I612-Q616 WeakPolarHBondContact O-CG 3.32Å; I612-Q616 PolarHBondContact O-N 3.2Å
617	H	75.2	Confident	79.9	Confident	90 Å²	90	55.1 Å²	55.1	42%	0.417	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.9	17.6	178.7	-68	-67	0	0	0	114.2	Y613 V615 K619	Y613-H617 AromaticContact CD1-CD2 3.99Å; Y613-H617 AromaticContact CD2-CD2 3.44Å; Y613-H617 VanDerWaalsContact CD2-CD2 3.44Å; Y613-H617 WeakPolarHBondContact CD2-CD2 3.4Å; Y613-H617 AromaticContact CD2-NE2 3.62Å; Y613-H617 AromaticContact CE1-CD2 3.72Å; Y613-H617 AromaticContact CE2-CD2 3.14Å; Y613-H617 WeakPolarHBondContact CE2-CD2 3.46Å; Y613-H617 AromaticContact CE2-NE2 3.1Å; Y613-H617 WeakPolarHBondContact CE2-NE2 3.48Å; Y613-H617 AromaticContact CG-CD2 3.85Å; Y613-H617 AromaticContact CZ-CD2 3.27Å; Y613-H617 AromaticContact CZ-NE2 3.58Å; Y613-H617 WeakPolarHBondContact O-CB 3.36Å; Y613-H617 PolarHBondContact O-CD2 2.95Å; Y613-H617 VanDerWaalsContact O-CD2 3.28Å; Y613-H617 PolarHBondContact O-N 2.99Å; Y613-H617 VanDerWaalsContact O-N 3.09Å; V615-H617 VanDerWaalsContact C-N 3.27Å; V615-H617 PolarHBondContact O-N 2.87Å; H617-K619 VanDerWaalsContact C-N 3.27Å; H617-K619 PolarHBondContact O-N 3.11Å; H617-K619 VanDerWaalsContact O-N 3.16Å
618	H	71.8	Confident	79.9	Confident	123 Å²	123	55.4 Å²	55.4	57%	0.569	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	48	44.7	176.9	-58.1	-67.4	0	0	0	113.9	S614 V615	S614-H618 PolarHBondContact O-N 2.99Å; V615-H618 PolarHBondContact O-N 3.25Å; V615-H618 VanDerWaalsContact O-N 3.13Å
619	K	78.2	Confident	80	Confident	81 Å²	81	58.7 Å²	58.7	35%	0.352	29%	0.286	S	S	.	.			trans	-66.5	164.6	173.7	-67.5	-165.8	-176.4	173.5	0	111	S614 H617 T623	S614-K619 WeakPolarHBondContact O-CB 3.41Å; S614-K619 PolarHBondContact O-N 2.94Å; H617-K619 VanDerWaalsContact C-N 3.27Å; H617-K619 PolarHBondContact O-N 3.11Å; H617-K619 VanDerWaalsContact O-N 3.16Å; K619-T623 HydrophobicContact CB-CG2 4.42Å; K619-T623 HydrophobicContact CD-CG2 4.09Å
620	S	80.3	Confident	80.4	Confident	65 Å²	65	58.8 Å²	58.8	46%	0.455	29%	0.285	S	S	.	.			trans	-56.3	146.5	-179.3	67	0	0	0	0	112.4	D622 T623 I624	S620-D622 PolarHBondContact O-N 3.28Å; S620-D622 VanDerWaalsContact O-N 3.14Å; S620-T623 WeakPolarHBondContact O-CB 3.4Å; S620-T623 PolarHBondContact O-N 3.45Å; S620-T623 PolarHBondContact OG-N 3.22Å; S620-T623 PolarHBondContact OG-OG1 3.07Å; S620-I624 PolarHBondContact O-N 3.35Å
621	I	79.9	Confident	80.7	Confident	73 Å²	73	55.3 Å²	55.3	37%	0.374	27%	0.272	S	S	.	.	H	α-helix	trans	-52.1	-35.7	175.3	-167.2	75.8	0	0	0	112	T623 I624 N625 W667	I621-T623 VanDerWaalsContact C-N 3.33Å; I621-T623 PolarHBondContact O-N 2.74Å; I621-I624 PolarHBondContact O-N 2.95Å; I621-N625 WeakPolarHBondContact O-CB 3.18Å; I621-N625 PolarHBondContact O-N 3.21Å; I621-N625 PolarHBondContact O-ND2 3.26Å; I621-W667 HydrophobicContact CD1-CZ2 3.6Å
622	D	82.9	Confident	81.1	Confident	117 Å²	117	57.8 Å²	57.8	63%	0.626	28%	0.284	S	S	*	.	H	α-helix	trans	-64.2	-38.1	177.9	-59.6	-34.7	0	0	0	112.1	S620 Y626	S620-D622 PolarHBondContact O-N 3.28Å; S620-D622 VanDerWaalsContact O-N 3.14Å; D622-Y626 VanDerWaalsContact O-CB 3.28Å; D622-Y626 WeakPolarHBondContact O-CB 3.27Å; D622-Y626 PolarHBondContact O-N 2.91Å
623	T	83.1	Confident	81.6	Confident	42 Å²	42	61 Å²	61	26%	0.258	30%	0.301	S	S	.	.	H	α-helix	trans	-67.1	-40.7	177.2	-54	0	0	0	0	110.7	K619 S620 I621 Y626 F627	K619-T623 HydrophobicContact CB-CG2 4.42Å; K619-T623 HydrophobicContact CD-CG2 4.09Å; S620-T623 WeakPolarHBondContact O-CB 3.4Å; S620-T623 PolarHBondContact O-N 3.45Å; S620-T623 PolarHBondContact OG-N 3.22Å; S620-T623 PolarHBondContact OG-OG1 3.07Å; I621-T623 VanDerWaalsContact C-N 3.33Å; I621-T623 PolarHBondContact O-N 2.74Å; T623-Y626 WeakPolarHBondContact O-CB 3.42Å; T623-Y626 PolarHBondContact O-N 2.79Å; T623-F627 HydrophobicContact CG2-CD2 4.03Å; T623-F627 HydrophobicContact CG2-CE2 3.64Å; T623-F627 WeakPolarHBondContact O-CD2 3.44Å; T623-F627 PolarHBondContact O-N 3.42Å; T623-F627 VanDerWaalsContact O-N 3.14Å
624	I	79.7	Confident	82.2	Confident	1 Å²	1	57 Å²	57	1%	0.005	29%	0.287	C	S	.	.	H	α-helix	trans	-67.5	-47.5	177.5	-65	167.4	0	0	0	110.1	V615 S620 I621 Y626 F627 C628 W667 I671	V615-I624 HydrophobicContact CG2-CD1 4.12Å; V615-I624 HydrophobicContact CG2-CG1 4.37Å; S620-I624 PolarHBondContact O-N 3.35Å; I621-I624 PolarHBondContact O-N 2.95Å; I624-Y626 VanDerWaalsContact C-N 3.28Å; I624-Y626 PolarHBondContact O-N 3.34Å; I624-F627 PolarHBondContact O-N 3.49Å; I624-F627 VanDerWaalsContact O-N 3.17Å; I624-C628 PolarHBondContact O-N 3.48Å; I624-C628 PolarHBondContact O-SG 2.9Å; I624-W667 HydrophobicContact CD1-CH2 3.37Å; I624-W667 HydrophobicContact CD1-CZ2 3.56Å; I624-W667 HydrophobicContact CD1-CZ3 4.47Å; I624-I671 HydrophobicContact CD1-CD1 4.19Å; I624-I671 HydrophobicContact CG2-CD1 4.16Å; I624-I671 HydrophobicContact CG2-CG2 4.38Å
625	N	83.9	Confident	82.7	Confident	61 Å²	61	57 Å²	57	33%	0.326	29%	0.287	S	S	.	.	H	α-helix	trans	-59.9	-38.7	176.3	-78.9	-34.6	0	0	0	111.9	I621 C628 T629 K674	I621-N625 WeakPolarHBondContact O-CB 3.18Å; I621-N625 PolarHBondContact O-N 3.21Å; I621-N625 PolarHBondContact O-ND2 3.26Å; N625-C628 WeakPolarHBondContact O-CB 3.39Å; N625-C628 PolarHBondContact O-N 3.49Å; N625-T629 WeakPolarHBondContact O-CG2 3.4Å; N625-T629 PolarHBondContact O-N 3.41Å; N625-T629 PolarHBondContact O-OG1 3.28Å; N625-K674 PolarHBondContact OD1-NZ 2.92Å
626	Y	86.5	Confident	83.2	Confident	139 Å²	139	59.7 Å²	59.7	55%	0.545	30%	0.298	S	S	.	.	H	α-helix	trans	-56.7	-52.5	172.9	173.5	-90.4	0	0	0	111.2	D622 T623 I624 C628 T629 E630	D622-Y626 VanDerWaalsContact O-CB 3.28Å; D622-Y626 WeakPolarHBondContact O-CB 3.27Å; D622-Y626 PolarHBondContact O-N 2.91Å; T623-Y626 WeakPolarHBondContact O-CB 3.42Å; T623-Y626 PolarHBondContact O-N 2.79Å; I624-Y626 VanDerWaalsContact C-N 3.28Å; I624-Y626 PolarHBondContact O-N 3.34Å; Y626-C628 VanDerWaalsContact C-N 3.33Å; Y626-C628 PolarHBondContact O-N 2.83Å; Y626-T629 PolarHBondContact O-N 2.78Å; Y626-T629 VanDerWaalsContact O-N 3.15Å; Y626-T629 PolarHBondContact O-OG1 3.01Å; Y626-E630 VanDerWaalsContact CE1-OE2 3.23Å; Y626-E630 WeakPolarHBondContact CE1-OE2 3.31Å; Y626-E630 PolarHBondContact O-N 3.28Å
627	F	84.5	Confident	83.8	Confident	24 Å²	24	55.9 Å²	55.9	11%	0.105	28%	0.281	C	S	.	.	H	α-helix	trans	-66.1	-32.9	178.6	-70.9	-57.6	0	0	0	113.2	R610 L611 S614 T623 I624 E630 L631	R610-F627 HydrophobicContact CB-CD1 4.24Å; R610-F627 HydrophobicContact CB-CE1 3.91Å; R610-F627 HydrophobicContact CB-CE2 4.38Å; R610-F627 HydrophobicContact CB-CZ 3.99Å; R610-F627 HydrophobicContact CG-CE1 4.48Å; L611-F627 HydrophobicContact CB-CB 4.16Å; L611-F627 HydrophobicContact CD1-CB 4.04Å; L611-F627 HydrophobicContact CG-CB 4.46Å; S614-F627 WeakPolarHBondContact OG-CE2 3.41Å; T623-F627 HydrophobicContact CG2-CD2 4.03Å; T623-F627 HydrophobicContact CG2-CE2 3.64Å; T623-F627 WeakPolarHBondContact O-CD2 3.44Å; T623-F627 PolarHBondContact O-N 3.42Å; T623-F627 VanDerWaalsContact O-N 3.14Å; I624-F627 PolarHBondContact O-N 3.49Å; I624-F627 VanDerWaalsContact O-N 3.17Å; F627-E630 VanDerWaalsContact CD1-OE2 3.3Å; F627-E630 WeakPolarHBondContact CD1-OE2 3.26Å; F627-E630 PolarHBondContact O-N 3.23Å; F627-L631 VanDerWaalsContact O-CB 3.3Å; F627-L631 WeakPolarHBondContact O-CB 3.39Å; F627-L631 PolarHBondContact O-N 3.24Å
628	C	84.6	Confident	84.1	Confident	11 Å²	11	52.6 Å²	52.6	7%	0.074	27%	0.267	C	S	.	.	H	α-helix	trans	-61.2	-44	171.3	-67.6	0	0	0	0	111.7	I624 N625 Y626 L631 E632	I624-C628 PolarHBondContact O-N 3.48Å; I624-C628 PolarHBondContact O-SG 2.9Å; N625-C628 WeakPolarHBondContact O-CB 3.39Å; N625-C628 PolarHBondContact O-N 3.49Å; Y626-C628 VanDerWaalsContact C-N 3.33Å; Y626-C628 PolarHBondContact O-N 2.83Å; C628-L631 PolarHBondContact O-N 3.03Å; C628-E632 PolarHBondContact O-N 3.39Å; C628-E632 VanDerWaalsContact O-N 3.09Å
629	T	86.9	Confident	84.9	Confident	71 Å²	71	47 Å²	47	44%	0.436	24%	0.241	S	C	.	.	H	α-helix	trans	-68.9	-36.5	176.3	59.2	0	0	0	0	112.3	N625 Y626 E632 N633	N625-T629 WeakPolarHBondContact O-CG2 3.4Å; N625-T629 PolarHBondContact O-N 3.41Å; N625-T629 PolarHBondContact O-OG1 3.28Å; Y626-T629 PolarHBondContact O-N 2.78Å; Y626-T629 VanDerWaalsContact O-N 3.15Å; Y626-T629 PolarHBondContact O-OG1 3.01Å; T629-E632 PolarHBondContact O-N 3.4Å; T629-N633 WeakPolarHBondContact O-CB 3.39Å; T629-N633 PolarHBondContact O-N 3.5Å; T629-N633 PolarHBondContact O-ND2 3.42Å; T629-N633 VanDerWaalsContact O-ND2 3.09Å
630	E	87.3	Confident	85.5	Confident	44 Å²	44	43.2 Å²	43.2	21%	0.206	23%	0.225	C	C	.	.	H	α-helix	trans	-65	-40.4	175.5	-164.9	-178.5	175.1	0	0	111.4	I607 Y626 F627 N633 T634	I607-E630 HydrophobicContact CD1-CG 4.04Å; I607-E630 HydrophobicContact CG1-CG 4.47Å; I607-E630 HydrophobicContact CG2-CB 4.48Å; Y626-E630 VanDerWaalsContact CE1-OE2 3.23Å; Y626-E630 WeakPolarHBondContact CE1-OE2 3.31Å; Y626-E630 PolarHBondContact O-N 3.28Å; F627-E630 VanDerWaalsContact CD1-OE2 3.3Å; F627-E630 WeakPolarHBondContact CD1-OE2 3.26Å; F627-E630 PolarHBondContact O-N 3.23Å; E630-N633 PolarHBondContact O-N 3.39Å; E630-T634 WeakPolarHBondContact O-CB 3.49Å; E630-T634 PolarHBondContact O-N 2.83Å; E630-T634 PolarHBondContact O-OG1 3.5Å
631	L	88	Confident	86.1	Confident	1 Å²	1	41.2 Å²	41.2	1%	0.005	21%	0.207	C	C	.	.	H	α-helix	trans	-59.9	-50.3	174.2	-179.9	64.4	0	0	0	111.1	I604 I607 V608 F627 C628 N633 T634 I635 L675 L679	I604-L631 HydrophobicContact CD1-CD1 3.91Å; I604-L631 HydrophobicContact CG1-CD1 3.53Å; I607-L631 HydrophobicContact CG2-CB 3.94Å; I607-L631 HydrophobicContact CG2-CD1 4.35Å; V608-L631 HydrophobicContact CG2-CD1 4.03Å; F627-L631 VanDerWaalsContact O-CB 3.3Å; F627-L631 WeakPolarHBondContact O-CB 3.39Å; F627-L631 PolarHBondContact O-N 3.24Å; C628-L631 PolarHBondContact O-N 3.03Å; L631-N633 PolarHBondContact O-N 2.69Å; L631-T634 PolarHBondContact O-N 3.26Å; L631-I635 HydrophobicContact CD1-CD1 4.4Å; L631-I635 HydrophobicContact CG-CD1 4.26Å; L631-I635 WeakPolarHBondContact O-CG1 3.32Å; L631-I635 PolarHBondContact O-N 3.24Å; L631-L675 HydrophobicContact CD2-CD2 3.88Å; L631-L679 HydrophobicContact CD2-CD2 4.31Å
632	E	88.5	Confident	86.6	Confident	54 Å²	54	37.8 Å²	37.8	25%	0.252	19%	0.19	S	C	.	.	H	α-helix	trans	-61.9	-44.3	178.8	-165.2	-173.5	167.4	0	0	112	C628 T629 T634 I635 K636 L678 Y682	C628-E632 PolarHBondContact O-N 3.39Å; C628-E632 VanDerWaalsContact O-N 3.09Å; T629-E632 PolarHBondContact O-N 3.4Å; E632-T634 VanDerWaalsContact C-N 3.32Å; E632-T634 PolarHBondContact O-N 3.36Å; E632-I635 PolarHBondContact O-N 2.83Å; E632-K636 WeakPolarHBondContact O-CG 3.25Å; E632-K636 PolarHBondContact O-N 3.24Å; E632-K636 WeakPolarHBondContact OE1-CE 3.44Å; E632-K636 IonicContact OE1-NZ 3.46Å; E632-K636 PolarHBondContact OE1-NZ 2.74Å; E632-L678 HydrophobicContact CB-CD1 4.22Å; E632-L678 HydrophobicContact CG-CD1 4.29Å; E632-Y682 HydrophobicContact CG-CE2 4.02Å; E632-Y682 PolarHBondContact OE1-OH 2.96Å; E632-Y682 VanDerWaalsContact OE1-OH 3.11Å
633	N	88.4	Confident	86.9	Confident	79 Å²	79	36.2 Å²	36.2	42%	0.422	18%	0.177	S	C	.	.	H	α-helix	trans	-62.2	-40.3	176.8	-70.5	-28	0	0	0	111.5	T629 E630 L631 I635 K636 D637	T629-N633 WeakPolarHBondContact O-CB 3.39Å; T629-N633 PolarHBondContact O-N 3.5Å; T629-N633 PolarHBondContact O-ND2 3.42Å; T629-N633 VanDerWaalsContact O-ND2 3.09Å; E630-N633 PolarHBondContact O-N 3.39Å; L631-N633 PolarHBondContact O-N 2.69Å; N633-I635 VanDerWaalsContact C-N 3.33Å; N633-I635 PolarHBondContact O-N 3.01Å; N633-K636 PolarHBondContact O-N 2.85Å; N633-D637 VanDerWaalsContact O-CB 3.25Å; N633-D637 WeakPolarHBondContact O-CB 3.37Å; N633-D637 PolarHBondContact O-N 3.35Å
634	T	88	Confident	87.2	Confident	17 Å²	17	34.3 Å²	34.3	10%	0.104	17%	0.165	C	C	.	.	H	α-helix	trans	-66.9	-35.9	179.5	-58.3	0	0	0	0	112.1	I607 E630 L631 E632 N638 I640	I607-T634 HydrophobicContact CD1-CG2 3.91Å; I607-T634 WeakPolarHBondContact CD1-OG1 3.33Å; E630-T634 WeakPolarHBondContact O-CB 3.49Å; E630-T634 PolarHBondContact O-N 2.83Å; E630-T634 PolarHBondContact O-OG1 3.5Å; L631-T634 PolarHBondContact O-N 3.26Å; E632-T634 VanDerWaalsContact C-N 3.32Å; E632-T634 PolarHBondContact O-N 3.36Å; T634-N638 PolarHBondContact O-N 3.23Å; T634-I640 HydrophobicContact CG2-CD1 3.87Å
635	I	89.4	Confident	87.4	Confident	0 Å²	0	39.3 Å²	39.3	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-66.7	-44.6	172.6	-64.4	165.5	0	0	0	110.2	I604 L631 E632 N633 L639 L642 L678 L679 Y682 T686	I604-I635 HydrophobicContact CD1-CD1 4.18Å; I604-I635 HydrophobicContact CD1-CG1 4.09Å; L631-I635 HydrophobicContact CD1-CD1 4.4Å; L631-I635 HydrophobicContact CG-CD1 4.26Å; L631-I635 WeakPolarHBondContact O-CG1 3.32Å; L631-I635 PolarHBondContact O-N 3.24Å; E632-I635 PolarHBondContact O-N 2.83Å; N633-I635 VanDerWaalsContact C-N 3.33Å; N633-I635 PolarHBondContact O-N 3.01Å; I635-L639 WeakPolarHBondContact O-CA 3.5Å; I635-L639 PolarHBondContact O-N 3.25Å; I635-L642 HydrophobicContact CD1-CD2 4.09Å; I635-L642 HydrophobicContact CG1-CD2 4.28Å; I635-L678 HydrophobicContact CD1-CD2 4.46Å; I635-L679 HydrophobicContact CD1-CD2 3.71Å; I635-Y682 HydrophobicContact CG2-CD1 3.7Å; I635-Y682 HydrophobicContact CG2-CD2 4.21Å; I635-Y682 HydrophobicContact CG2-CE1 4.26Å; I635-Y682 HydrophobicContact CG2-CG 3.69Å; I635-T686 HydrophobicContact CG2-CG2 4.48Å
636	K	86.2	Confident	87	Confident	61 Å²	61	37 Å²	37	27%	0.265	17%	0.174	S	C	.	.	H	α-helix	trans	-66.5	-36.6	177.3	-71.4	178	-173.8	168	0	113.3	E632 N633 Y682 Q718	E632-K636 WeakPolarHBondContact O-CG 3.25Å; E632-K636 PolarHBondContact O-N 3.24Å; E632-K636 WeakPolarHBondContact OE1-CE 3.44Å; E632-K636 IonicContact OE1-NZ 3.46Å; E632-K636 PolarHBondContact OE1-NZ 2.74Å; N633-K636 PolarHBondContact O-N 2.85Å; K636-Y682 WeakPolarHBondContact CE-OH 3.49Å; K636-Y682 HydrophobicContact CG-CE1 4.33Å; K636-Q718 PolarHBondContact O-N 3.07Å
637	D	85.2	Confident	86.1	Confident	19 Å²	19	31.4 Å²	31.4	10%	0.102	16%	0.155	C	C	.	.	H	α-helix	trans	-64.2	-41.9	-177.2	-79.7	-19.4	0	0	0	111.9	N633 M717 Q718 K719	N633-D637 VanDerWaalsContact O-CB 3.25Å; N633-D637 WeakPolarHBondContact O-CB 3.37Å; N633-D637 PolarHBondContact O-N 3.35Å; D637-M717 CarbonylContact O-C 3.59Å; D637-Q718 PolarHBondContact O-N 3.22Å; D637-K719 HydrophobicContact CB-CB 4.13Å; D637-K719 HydrophobicContact CB-CD 4.3Å; D637-K719 HydrophobicContact CB-CG 4.29Å; D637-K719 PolarHBondContact O-N 3.2Å; D637-K719 VanDerWaalsContact O-N 3.14Å; D637-K719 IonicContact OD1-NZ 3.74Å; D637-K719 WeakPolarHBondContact OD2-CD 3.37Å; D637-K719 VanDerWaalsContact OD2-CE 3.3Å; D637-K719 WeakPolarHBondContact OD2-CE 3.35Å; D637-K719 IonicContact OD2-NZ 3.57Å; D637-K719 PolarHBondContact OD2-NZ 3.47Å
638	N	82.5	Confident	85.6	Confident	22 Å²	22	32.3 Å²	32.3	12%	0.118	17%	0.171	C	C	.	.	H	α-helix	trans	-122.2	-10.1	-170	-63.4	-50.3	0	0	0	115.1	Q551 T634 I640	Q551-N638 WeakPolarHBondContact CG-O 3.44Å; Q551-N638 PolarHBondContact NE2-O 2.63Å; Q551-N638 VanDerWaalsContact NE2-O 3.1Å; T634-N638 PolarHBondContact O-N 3.23Å; N638-I640 VanDerWaalsContact C-N 3.34Å; N638-I640 HydrophobicContact CB-CD1 4.23Å; N638-I640 HydrophobicContact CB-CG1 3.69Å; N638-I640 PolarHBondContact O-N 2.97Å
639	L	88.6	Confident	85.3	Confident	6 Å²	6	34.6 Å²	34.6	3%	0.031	18%	0.182	C	C	.	.			trans	52	47.9	-173.7	-59.9	173.1	0	0	0	113	I635 V689 L715 M717	I635-L639 WeakPolarHBondContact O-CA 3.5Å; I635-L639 PolarHBondContact O-N 3.25Å; L639-V689 HydrophobicContact CB-CG1 4.4Å; L639-V689 HydrophobicContact CB-CG2 4.09Å; L639-V689 HydrophobicContact CD1-CG2 3.8Å; L639-V689 HydrophobicContact CG-CG2 4.46Å; L639-L715 HydrophobicContact CD1-CB 4.1Å; L639-M717 HydrophobicContact CD1-CG 4.04Å; L639-M717 HydrophobicContact CG-CG 4.41Å
640	I	90.1	Very high	85.3	Confident	1 Å²	1	32 Å²	32	1%	0.005	17%	0.166	C	C	.	.			trans	-64	138	-173.8	-56.8	176.2	0	0	0	111.7	I550 Q551 I604 T634 N638 L642 T686	I550-I640 HydrophobicContact CG2-CD1 4.17Å; I550-I640 WeakPolarHBondContact O-CG2 3.29Å; Q551-I640 CarbonylContact O-C 3.47Å; Q551-I640 WeakPolarHBondContact O-CA 3.14Å; I604-I640 HydrophobicContact CB-CD1 4.28Å; I604-I640 HydrophobicContact CG2-CG2 4.12Å; T634-I640 HydrophobicContact CG2-CD1 3.87Å; N638-I640 VanDerWaalsContact C-N 3.34Å; N638-I640 HydrophobicContact CB-CD1 4.23Å; N638-I640 HydrophobicContact CB-CG1 3.69Å; N638-I640 PolarHBondContact O-N 2.97Å; I640-L642 PolarHBondContact O-N 2.95Å; I640-T686 WeakPolarHBondContact O-CB 3.22Å; I640-T686 WeakPolarHBondContact O-CG2 3.25Å
641	W	93	Very high	85.2	Confident	22 Å²	22	30 Å²	30	8%	0.083	16%	0.156	C	C	.	.			trans	-61.5	118.1	174.5	-154.4	24.9	0	0	0	113.6	V404 Q551 K643 A644 D687 I690	V404-W641 HydrophobicContact CG1-CE3 3.58Å; V404-W641 HydrophobicContact CG1-CH2 4.13Å; V404-W641 HydrophobicContact CG1-CZ3 3.23Å; Q551-W641 PolarHBondContact O-N 2.97Å; W641-K643 HydrophobicContact CD2-CB 4.13Å; W641-K643 HydrophobicContact CH2-CB 4.38Å; W641-K643 HydrophobicContact CZ2-CB 3.75Å; W641-A644 HydrophobicContact CB-CB 4.37Å; W641-A644 HydrophobicContact CE3-CB 3.97Å; W641-D687 PolarHBondContact NE1-OD1 3.44Å; W641-I690 HydrophobicContact CB-CD1 3.1Å; W641-I690 HydrophobicContact CD2-CD1 3.54Å; W641-I690 HydrophobicContact CE3-CD1 4.29Å; W641-I690 HydrophobicContact CG-CD1 2.98Å; W641-I690 HydrophobicContact CG-CG1 4.41Å
642	L	90.8	Very high	85.1	Confident	2 Å²	2	31 Å²	31	1%	0.01	16%	0.162	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.7	-18.5	178.4	-61.5	-176.1	0	0	0	113.7	I604 I635 I640 A644 L679 V683 T686	I604-L642 HydrophobicContact CD1-CD2 3.26Å; I635-L642 HydrophobicContact CD1-CD2 4.09Å; I635-L642 HydrophobicContact CG1-CD2 4.28Å; I640-L642 PolarHBondContact O-N 2.95Å; L642-A644 VanDerWaalsContact C-N 3.33Å; L642-L679 HydrophobicContact CD1-CB 4.42Å; L642-L679 HydrophobicContact CD1-CD2 4.1Å; L642-L679 WeakPolarHBondContact CD1-O 3.47Å; L642-L679 HydrophobicContact CD2-CD2 4.17Å; L642-V683 HydrophobicContact CB-CG2 4.3Å; L642-V683 HydrophobicContact CD1-CG2 4.1Å; L642-T686 HydrophobicContact CG-CG2 4.35Å
643	K	90	Very high	84.9	Confident	84 Å²	84	32.5 Å²	32.5	37%	0.365	17%	0.169	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.1	-0.3	175.6	-70	-177.5	176.6	164.9	0	113.8	W641 K645 T650 D687	W641-K643 HydrophobicContact CD2-CB 4.13Å; W641-K643 HydrophobicContact CH2-CB 4.38Å; W641-K643 HydrophobicContact CZ2-CB 3.75Å; K643-K645 PolarHBondContact O-N 3.42Å; K643-T650 HydrophobicContact CB-CG2 4.47Å; K643-D687 WeakPolarHBondContact CD-OD1 3.46Å; K643-D687 WeakPolarHBondContact CE-OD2 3.49Å; K643-D687 IonicContact NZ-OD1 3.96Å; K643-D687 IonicContact NZ-OD2 3.73Å; K643-D687 PolarHBondContact NZ-OD2 3.28Å
644	A	88.1	Confident	84.5	Confident	1 Å²	1	30.5 Å²	30.5	1%	0.008	16%	0.155	C	C	.	.			trans	-57	134.6	167.4	0	0	0	0	0	109.2	L410 W605 W641 L642	L410-A644 HydrophobicContact CD1-CB 3.82Å; W605-A644 WeakPolarHBondContact CZ2-O 3.5Å; W641-A644 HydrophobicContact CB-CB 4.37Å; W641-A644 HydrophobicContact CE3-CB 3.97Å; L642-A644 VanDerWaalsContact C-N 3.33Å
645	K	84.5	Confident	84.1	Confident	106 Å²	106	29.8 Å²	29.8	46%	0.461	15%	0.151	S	C	.	.			trans	-100.9	131.7	-174.9	-67.4	-177.5	172.2	-162.7	0	111	K643 G648 L649 T650	K643-K645 PolarHBondContact O-N 3.42Å; K645-G648 WeakPolarHBondContact CD-O 3.09Å; K645-L649 CarbonylContact C-O 3.57Å; K645-L649 VanDerWaalsContact CA-O 3.29Å; K645-L649 WeakPolarHBondContact CA-O 3.46Å; K645-T650 HydrophobicContact CG-CG2 4.1Å
646	R	76.1	Confident	83.6	Confident	14 Å²	14	31.8 Å²	31.8	5%	0.053	16%	0.162	C	C	.	.	B	Isolated β-bridge	trans	-108.7	124.4	161.7	-167.9	174.7	73.7	170.1	0.7	108	D555 W605 D609 G648 L649 W654	D555-R646 WeakPolarHBondContact OD2-CD 3.39Å; D555-R646 IonicContact OD2-NH1 2.99Å; D555-R646 PolarHBondContact OD2-NH1 3.32Å; W605-R646 HydrophobicContact CD2-CB 4.08Å; W605-R646 HydrophobicContact CE3-CB 3.92Å; W605-R646 HydrophobicContact CE3-CG 4.48Å; W605-R646 HydrophobicContact CH2-CB 3.37Å; W605-R646 HydrophobicContact CZ2-CB 3.55Å; W605-R646 HydrophobicContact CZ3-CB 3.57Å; W605-R646 HydrophobicContact CZ3-CG 4.49Å; D609-R646 IonicContact OD1-CZ 2.99Å; D609-R646 IonicContact OD1-NH1 2.65Å; D609-R646 PolarHBondContact OD1-NH1 3.09Å; D609-R646 IonicContact OD1-NH2 2.52Å; D609-R646 PolarHBondContact OD1-NH2 3.48Å; D609-R646 IonicContact OD2-CZ 3.89Å; D609-R646 IonicContact OD2-NH1 3.51Å; D609-R646 PolarHBondContact OD2-NH1 2.94Å; D609-R646 IonicContact OD2-NH2 2.68Å; R646-G648 PolarHBondContact O-N 3.45Å; R646-G648 VanDerWaalsContact O-N 3.14Å; R646-L649 PolarHBondContact N-O 2.64Å; R646-L649 PolarHBondContact O-N 3.18Å; R646-L649 VanDerWaalsContact O-O 3.06Å; R646-W654 HydrophobicContact CB-CE3 4.37Å; R646-W654 HydrophobicContact CB-CZ3 4.21Å; R646-W654 HydrophobicContact CG-CZ3 4.17Å; R646-W654 WeakPolarHBondContact O-CZ3 3.46Å
647	S	67.8	Low	82.9	Confident	21 Å²	21	30.9 Å²	30.9	15%	0.147	16%	0.163	C	C	.	.	T	Hydrogen-bonded Turn	trans	50.2	34.6	-174.1	-46.9	0	0	0	0	114.7	R7 L649	R7-S647 WeakPolarHBondContact CB-OG 3.36Å; R7-S647 VanDerWaalsContact CD-OG 3.23Å; R7-S647 WeakPolarHBondContact CD-OG 3.37Å; S647-L649 VanDerWaalsContact C-N 3.32Å; S647-L649 PolarHBondContact O-N 3.27Å
648	G	72.8	Confident	81.9	Confident	42 Å²	42	33.1 Å²	33.1	43%	0.433	18%	0.175	S	C	.	.	T	Hydrogen-bonded Turn	trans	86.3	-6.4	-179.6	0	0	0	0	0	115.4	K645 R646	K645-G648 WeakPolarHBondContact CD-O 3.09Å; R646-G648 PolarHBondContact O-N 3.45Å; R646-G648 VanDerWaalsContact O-N 3.14Å
649	L	79.9	Confident	81.1	Confident	59 Å²	59	33.2 Å²	33.2	31%	0.309	17%	0.173	S	C	.	.	B	Isolated β-bridge	trans	-108.5	138.4	178.5	-58.6	173.5	0	0	0	110.8	K645 R646 S647 E653 W654	K645-L649 CarbonylContact C-O 3.57Å; K645-L649 VanDerWaalsContact CA-O 3.29Å; K645-L649 WeakPolarHBondContact CA-O 3.46Å; R646-L649 PolarHBondContact N-O 2.64Å; R646-L649 PolarHBondContact O-N 3.18Å; R646-L649 VanDerWaalsContact O-O 3.06Å; S647-L649 VanDerWaalsContact C-N 3.32Å; S647-L649 PolarHBondContact O-N 3.27Å; L649-E653 WeakPolarHBondContact CA-OE2 3.46Å; L649-E653 HydrophobicContact CB-CB 4.15Å; L649-E653 HydrophobicContact CD2-CB 4.12Å; L649-W654 HydrophobicContact CB-CE3 4.05Å; L649-W654 HydrophobicContact CD1-CE3 4.13Å
650	T	86.1	Confident	79.6	Confident	17 Å²	17	37 Å²	37	10%	0.104	20%	0.197	C	C	.	.			trans	-72.1	167.9	167.7	61.8	0	0	0	0	111.1	K643 K645 I652 E653 W654	K643-T650 HydrophobicContact CB-CG2 4.47Å; K645-T650 HydrophobicContact CG-CG2 4.1Å; T650-I652 PolarHBondContact O-N 2.99Å; T650-E653 WeakPolarHBondContact CG2-OE2 3.42Å; T650-E653 PolarHBondContact N-OE2 3.42Å; T650-E653 PolarHBondContact O-N 3.25Å; T650-E653 WeakPolarHBondContact OG1-CB 3.38Å; T650-E653 VanDerWaalsContact OG1-CD 3.27Å; T650-E653 VanDerWaalsContact OG1-CG 3.24Å; T650-E653 WeakPolarHBondContact OG1-CG 3.41Å; T650-E653 PolarHBondContact OG1-N 3.33Å; T650-E653 PolarHBondContact OG1-OE2 2.94Å; T650-W654 VanDerWaalsContact O-CB 3.27Å; T650-W654 WeakPolarHBondContact O-CB 3.45Å; T650-W654 PolarHBondContact O-N 2.85Å
651	V	85.1	Confident	77.9	Confident	1 Å²	1	43.4 Å²	43.4	1%	0.006	23%	0.227	C	C	.	.	H	α-helix	trans	-57.3	-39.8	177.5	177.9	0	0	0	0	111.6	I604 W605 V608 W654 I655 L679	I604-V651 HydrophobicContact CD1-CG1 4.24Å; I604-V651 HydrophobicContact CD1-CG2 4.08Å; I604-V651 HydrophobicContact CG1-CG2 4.35Å; I604-V651 HydrophobicContact CG2-CG2 4.2Å; W605-V651 HydrophobicContact CD2-CG2 4.43Å; W605-V651 HydrophobicContact CE3-CG2 4.24Å; W605-V651 HydrophobicContact CH2-CB 4.37Å; W605-V651 HydrophobicContact CH2-CG2 3.51Å; W605-V651 HydrophobicContact CZ2-CG2 3.71Å; W605-V651 HydrophobicContact CZ3-CG2 3.8Å; V608-V651 HydrophobicContact CG2-CG1 3.79Å; V651-W654 PolarHBondContact O-N 3.15Å; V651-I655 HydrophobicContact CG1-CD1 3.89Å; V651-I655 WeakPolarHBondContact O-CB 3.27Å; V651-I655 VanDerWaalsContact O-CG1 3.26Å; V651-I655 WeakPolarHBondContact O-CG1 3.37Å; V651-I655 PolarHBondContact O-N 3.25Å; V651-L679 HydrophobicContact CG1-CD1 3.95Å
652	I	85.8	Confident	75.8	Confident	23 Å²	23	48.2 Å²	48.2	12%	0.118	25%	0.254	C	S	.	.	H	α-helix	trans	-69.3	-44.8	179.6	-63.5	172.4	0	0	0	111	T650 W654 I655 N656 T676 L679 V683	T650-I652 PolarHBondContact O-N 2.99Å; I652-W654 VanDerWaalsContact C-N 3.31Å; I652-W654 PolarHBondContact O-N 3.32Å; I652-I655 PolarHBondContact O-N 3.16Å; I652-N656 WeakPolarHBondContact O-CB 3.35Å; I652-N656 PolarHBondContact O-N 2.97Å; I652-N656 PolarHBondContact O-ND2 3.02Å; I652-T676 HydrophobicContact CG2-CG2 4.42Å; I652-L679 HydrophobicContact CD1-CB 3.97Å; I652-L679 HydrophobicContact CG1-CB 3.77Å; I652-L679 HydrophobicContact CG1-CD1 3.96Å; I652-V683 HydrophobicContact CD1-CG2 3.48Å; I652-V683 VanDerWaalsContact CD1-CG2 3.48Å
653	E	84.6	Confident	73.9	Confident	86 Å²	86	59.9 Å²	59.9	40%	0.402	30%	0.298	S	S	.	.	H	α-helix	trans	-63.8	-39.8	176.3	-71	164.3	161.7	0	0	111.1	L649 T650 N656 S657	L649-E653 WeakPolarHBondContact CA-OE2 3.46Å; L649-E653 HydrophobicContact CB-CB 4.15Å; L649-E653 HydrophobicContact CD2-CB 4.12Å; T650-E653 WeakPolarHBondContact CG2-OE2 3.42Å; T650-E653 PolarHBondContact N-OE2 3.42Å; T650-E653 PolarHBondContact O-N 3.25Å; T650-E653 WeakPolarHBondContact OG1-CB 3.38Å; T650-E653 VanDerWaalsContact OG1-CD 3.27Å; T650-E653 VanDerWaalsContact OG1-CG 3.24Å; T650-E653 WeakPolarHBondContact OG1-CG 3.41Å; T650-E653 PolarHBondContact OG1-N 3.33Å; T650-E653 PolarHBondContact OG1-OE2 2.94Å; E653-N656 PolarHBondContact O-N 2.83Å; E653-S657 VanDerWaalsContact O-CB 3.31Å; E653-S657 WeakPolarHBondContact O-CB 3.45Å; E653-S657 PolarHBondContact O-N 2.82Å; E653-S657 PolarHBondContact O-OG 2.69Å
654	W	80.8	Confident	71.9	Confident	36 Å²	36	61 Å²	61	14%	0.136	32%	0.315	C	S	.	.	H	α-helix	trans	-61	-51	177.5	-166	-72.2	0	0	0	111.3	W605 R646 L649 T650 V651 I652 N656 S657 L658	W605-W654 HydrophobicContact CZ3-CE3 4.44Å; R646-W654 HydrophobicContact CB-CE3 4.37Å; R646-W654 HydrophobicContact CB-CZ3 4.21Å; R646-W654 HydrophobicContact CG-CZ3 4.17Å; R646-W654 WeakPolarHBondContact O-CZ3 3.46Å; L649-W654 HydrophobicContact CB-CE3 4.05Å; L649-W654 HydrophobicContact CD1-CE3 4.13Å; T650-W654 VanDerWaalsContact O-CB 3.27Å; T650-W654 WeakPolarHBondContact O-CB 3.45Å; T650-W654 PolarHBondContact O-N 2.85Å; V651-W654 PolarHBondContact O-N 3.15Å; I652-W654 VanDerWaalsContact C-N 3.31Å; I652-W654 PolarHBondContact O-N 3.32Å; W654-N656 VanDerWaalsContact C-N 3.3Å; W654-N656 PolarHBondContact O-N 3.29Å; W654-S657 PolarHBondContact O-N 2.87Å; W654-S657 PolarHBondContact O-OG 3.12Å; W654-L658 PolarHBondContact O-N 3.31Å
655	I	78.5	Confident	70.6	Confident	3 Å²	3	64.5 Å²	64.5	2%	0.015	33%	0.334	C	S	.	.	H	α-helix	trans	-57.8	-43.3	176.8	-74.2	170.2	0	0	0	110.9	V608 V651 I652 W659 L679	V608-I655 HydrophobicContact CG1-CG1 4.26Å; V651-I655 HydrophobicContact CG1-CD1 3.89Å; V651-I655 WeakPolarHBondContact O-CB 3.27Å; V651-I655 VanDerWaalsContact O-CG1 3.26Å; V651-I655 WeakPolarHBondContact O-CG1 3.37Å; V651-I655 PolarHBondContact O-N 3.25Å; I652-I655 PolarHBondContact O-N 3.16Å; I655-W659 HydrophobicContact CB-CZ3 4.47Å; I655-W659 HydrophobicContact CG2-CE3 3.78Å; I655-W659 HydrophobicContact CG2-CH2 3.59Å; I655-W659 HydrophobicContact CG2-CZ3 3.09Å; I655-L679 HydrophobicContact CD1-CD1 3.4Å; I655-L679 VanDerWaalsContact CD1-CD1 3.4Å
656	N	78.6	Confident	69.9	Low	41 Å²	41	67 Å²	67	22%	0.219	35%	0.347	C	S	.	.	H	α-helix	trans	-68	-37.8	177.9	-80.5	-52.2	0	0	0	113.7	I652 E653 W654 L658 R672	I652-N656 WeakPolarHBondContact O-CB 3.35Å; I652-N656 PolarHBondContact O-N 2.97Å; I652-N656 PolarHBondContact O-ND2 3.02Å; E653-N656 PolarHBondContact O-N 2.83Å; W654-N656 VanDerWaalsContact C-N 3.3Å; W654-N656 PolarHBondContact O-N 3.29Å; N656-L658 VanDerWaalsContact C-N 3.32Å; N656-L658 PolarHBondContact O-N 3.31Å; N656-R672 PolarHBondContact OD1-NE 3.5Å; N656-R672 PolarHBondContact OD1-NH2 3.29Å
657	S	71.2	Confident	69.8	Low	43 Å²	43	70 Å²	70	30%	0.301	36%	0.358	S	S	.	.	H	α-helix	trans	-67.7	-29.9	-175.1	69.5	0	0	0	0	113.8	E653 W654 T660	E653-S657 VanDerWaalsContact O-CB 3.31Å; E653-S657 WeakPolarHBondContact O-CB 3.45Å; E653-S657 PolarHBondContact O-N 2.82Å; E653-S657 PolarHBondContact O-OG 2.69Å; W654-S657 PolarHBondContact O-N 2.87Å; W654-S657 PolarHBondContact O-OG 3.12Å; S657-T660 PolarHBondContact O-OG1 3.2Å
658	L	65.4	Low	70	Confident	65 Å²	65	70 Å²	70	34%	0.34	36%	0.356	S	S	.	.	H	α-helix	trans	-81.4	-16.6	-174.2	-71.5	171.8	0	0	0	113.7	I612 W654 N656	I612-L658 HydrophobicContact CB-CD1 4.48Å; I612-L658 HydrophobicContact CD1-CD1 3.41Å; I612-L658 VanDerWaalsContact CD1-CD1 3.41Å; I612-L658 HydrophobicContact CG1-CD1 3.91Å; I612-L658 HydrophobicContact CG2-CD1 3.77Å; W654-L658 PolarHBondContact O-N 3.31Å; N656-L658 VanDerWaalsContact C-N 3.32Å; N656-L658 PolarHBondContact O-N 3.31Å
659	W	65.7	Low	70.1	Confident	25 Å²	25	72.1 Å²	72.1	10%	0.095	36%	0.355	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.7	4.6	-174.3	-67.9	-33.1	0	0	0	114.5	I655 H661 I668 I671 R672 L675	I655-W659 HydrophobicContact CB-CZ3 4.47Å; I655-W659 HydrophobicContact CG2-CE3 3.78Å; I655-W659 HydrophobicContact CG2-CH2 3.59Å; I655-W659 HydrophobicContact CG2-CZ3 3.09Å; W659-H661 VanDerWaalsContact C-N 3.29Å; W659-H661 PolarHBondContact O-N 2.91Å; W659-I668 HydrophobicContact CD2-CG2 4.38Å; W659-I668 HydrophobicContact CG-CG2 4.16Å; W659-I671 HydrophobicContact CH2-CG2 4.3Å; W659-I671 HydrophobicContact CZ2-CG2 4.43Å; W659-R672 HydrophobicContact CD2-CB 4.17Å; W659-R672 HydrophobicContact CD2-CG 4.39Å; W659-R672 HydrophobicContact CE3-CB 3.29Å; W659-R672 VanDerWaalsContact CE3-CD 3.42Å; W659-R672 HydrophobicContact CE3-CG 3.26Å; W659-R672 HydrophobicContact CH2-CB 3.88Å; W659-R672 HydrophobicContact CH2-CG 4.47Å; W659-R672 HydrophobicContact CZ3-CB 3.12Å; W659-R672 HydrophobicContact CZ3-CG 3.31Å; W659-L675 HydrophobicContact CH2-CD1 3.88Å
660	T	57.3	Low	70	Confident	85 Å²	85	74.3 Å²	74.3	52%	0.521	36%	0.364	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.7	-4.4	-173.7	54.7	0	0	0	0	115.7	S657	S657-T660 PolarHBondContact O-OG1 3.2Å
661	H	53.4	Low	69.7	Low	136 Å²	136	74.2 Å²	74.2	63%	0.63	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109.4	-16.4	-170.3	-71	-57.5	0	0	0	116.2	W659	W659-H661 VanDerWaalsContact C-N 3.29Å; W659-H661 PolarHBondContact O-N 2.91Å
662	D	50.3	Low	69.6	Low	123 Å²	123	77.1 Å²	77.1	66%	0.658	37%	0.373	S	S	*	.			trans	-106	92.1	178.5	-93.1	-21.8	0	0	0	111.6	C664	D662-C664 PolarHBondContact O-N 3.42Å
663	R	48.9	Very low	69.4	Low	246 Å²	246	82 Å²	82	93%	0.928	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.9	16.8	177.3	-68	-169.4	-172.6	-171.1	2.9	114.7
664	C	49.1	Very low	69.4	Low	108 Å²	108	83.3 Å²	83.3	73%	0.73	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-126.6	3.6	-161.1	-75.3	0	0	0	0	118.3	D662	D662-C664 PolarHBondContact O-N 3.42Å
665	N	61	Low	69.6	Low	75 Å²	75	81.7 Å²	81.7	40%	0.401	39%	0.394	S	S	.	.			trans	-133.7	103.4	178.8	-76.8	-38.7	0	0	0	113.4	W667 I668	N665-W667 PolarHBondContact O-N 3.09Å; N665-W667 VanDerWaalsContact O-N 3.13Å; N665-I668 HydrophobicContact CB-CB 4.38Å; N665-I668 HydrophobicContact CB-CD1 3.83Å; N665-I668 HydrophobicContact CB-CG1 3.87Å; N665-I668 PolarHBondContact O-N 3.27Å
666	Q	68.9	Low	70	Confident	158 Å²	158	83 Å²	83	74%	0.738	40%	0.402	S	S	*	.	H	α-helix	trans	-50.3	-36.7	174.3	-175.6	174.3	-4.9	0	0	112.8	I668 E669 E670	Q666-I668 VanDerWaalsContact C-N 3.33Å; Q666-I668 PolarHBondContact O-N 3.24Å; Q666-E669 PolarHBondContact O-N 2.74Å; Q666-E670 PolarHBondContact O-N 3.05Å; Q666-E670 VanDerWaalsContact O-N 3.1Å
667	W	74.2	Confident	70.4	Confident	78 Å²	78	85.7 Å²	85.7	30%	0.295	42%	0.416	S	S	.	.	H	α-helix	trans	-60.8	-34.1	177.2	178.1	58.5	0	0	0	114.7	I621 I624 N665 I671	I621-W667 HydrophobicContact CD1-CZ2 3.6Å; I624-W667 HydrophobicContact CD1-CH2 3.37Å; I624-W667 HydrophobicContact CD1-CZ2 3.56Å; I624-W667 HydrophobicContact CD1-CZ3 4.47Å; N665-W667 PolarHBondContact O-N 3.09Å; N665-W667 VanDerWaalsContact O-N 3.13Å; W667-I671 HydrophobicContact CD2-CD1 3.95Å; W667-I671 VanDerWaalsContact CE2-CD1 3.44Å; W667-I671 HydrophobicContact CE3-CD1 4.48Å; W667-I671 HydrophobicContact CG-CD1 4.44Å; W667-I671 HydrophobicContact CH2-CD1 4.22Å; W667-I671 HydrophobicContact CZ2-CD1 3.62Å; W667-I671 WeakPolarHBondContact O-CG1 3.33Å; W667-I671 PolarHBondContact O-N 3.5Å
668	I	71.9	Confident	71.1	Confident	19 Å²	19	85.2 Å²	85.2	10%	0.097	41%	0.41	C	S	.	.	H	α-helix	trans	-73.8	-39.4	179.7	-63.3	179.1	0	0	0	110	V615 W659 N665 Q666 E670 I671 R672	V615-I668 HydrophobicContact CG1-CG1 4.44Å; V615-I668 HydrophobicContact CG1-CG2 4.46Å; W659-I668 HydrophobicContact CD2-CG2 4.38Å; W659-I668 HydrophobicContact CG-CG2 4.16Å; N665-I668 HydrophobicContact CB-CB 4.38Å; N665-I668 HydrophobicContact CB-CD1 3.83Å; N665-I668 HydrophobicContact CB-CG1 3.87Å; N665-I668 PolarHBondContact O-N 3.27Å; Q666-I668 VanDerWaalsContact C-N 3.33Å; Q666-I668 PolarHBondContact O-N 3.24Å; I668-E670 VanDerWaalsContact C-N 3.34Å; I668-I671 PolarHBondContact O-N 2.66Å; I668-R672 VanDerWaalsContact O-CB 3.31Å; I668-R672 WeakPolarHBondContact O-CB 3.49Å; I668-R672 PolarHBondContact O-N 3.37Å
669	E	74.9	Confident	72.3	Confident	87 Å²	87	82.2 Å²	82.2	41%	0.407	39%	0.394	S	S	.	.	H	α-helix	trans	-63.8	-38.5	174.5	-73.5	-62	148.7	0	0	111.8	Q666 R672 E673	Q666-E669 PolarHBondContact O-N 2.74Å; E669-R672 WeakPolarHBondContact O-CB 3.34Å; E669-R672 PolarHBondContact O-N 3.17Å; E669-R672 IonicContact OE1-NH1 2.85Å; E669-R672 PolarHBondContact OE1-NH1 3.46Å; E669-R672 IonicContact OE2-NH1 3.93Å; E669-R672 PolarHBondContact OE2-NH1 3.31Å; E669-E673 WeakPolarHBondContact O-CB 3.35Å; E669-E673 PolarHBondContact O-N 3.46Å
670	E	79.2	Confident	73.4	Confident	106 Å²	106	86.2 Å²	86.2	50%	0.495	41%	0.414	S	S	.	.	H	α-helix	trans	-62.3	-44.2	174	-72.1	174.6	-172	0	0	112.6	Q666 I668 R672 K674	Q666-E670 PolarHBondContact O-N 3.05Å; Q666-E670 VanDerWaalsContact O-N 3.1Å; I668-E670 VanDerWaalsContact C-N 3.34Å; E670-R672 VanDerWaalsContact C-N 3.3Å; E670-R672 PolarHBondContact O-N 2.9Å; E670-K674 VanDerWaalsContact O-CB 3.28Å; E670-K674 WeakPolarHBondContact O-CB 3.34Å; E670-K674 PolarHBondContact O-N 2.92Å
671	I	79.7	Confident	74.9	Confident	14 Å²	14	87 Å²	87	7%	0.072	41%	0.408	C	S	.	.	H	α-helix	trans	-63.6	-40.8	175.8	-71.1	165.5	0	0	0	110.4	I624 W659 W667 I668 K674 L675	I624-I671 HydrophobicContact CD1-CD1 4.19Å; I624-I671 HydrophobicContact CG2-CD1 4.16Å; I624-I671 HydrophobicContact CG2-CG2 4.38Å; W659-I671 HydrophobicContact CH2-CG2 4.3Å; W659-I671 HydrophobicContact CZ2-CG2 4.43Å; W667-I671 HydrophobicContact CD2-CD1 3.95Å; W667-I671 VanDerWaalsContact CE2-CD1 3.44Å; W667-I671 HydrophobicContact CE3-CD1 4.48Å; W667-I671 HydrophobicContact CG-CD1 4.44Å; W667-I671 HydrophobicContact CH2-CD1 4.22Å; W667-I671 HydrophobicContact CZ2-CD1 3.62Å; W667-I671 WeakPolarHBondContact O-CG1 3.33Å; W667-I671 PolarHBondContact O-N 3.5Å; I668-I671 PolarHBondContact O-N 2.66Å; I671-K674 PolarHBondContact O-N 2.87Å; I671-L675 HydrophobicContact CG2-CD1 3.75Å; I671-L675 WeakPolarHBondContact O-CB 3.46Å; I671-L675 WeakPolarHBondContact O-CG 3.46Å; I671-L675 PolarHBondContact O-N 2.86Å
672	R	81.4	Confident	76.7	Confident	62 Å²	62	81.4 Å²	81.4	23%	0.234	38%	0.382	C	S	.	.	H	α-helix	trans	-61.2	-50.1	178.1	170.8	175.7	-175.6	-152.2	-2	112.6	N656 W659 I668 E669 E670 K674 L675 T676	N656-R672 PolarHBondContact OD1-NE 3.5Å; N656-R672 PolarHBondContact OD1-NH2 3.29Å; W659-R672 HydrophobicContact CD2-CB 4.17Å; W659-R672 HydrophobicContact CD2-CG 4.39Å; W659-R672 HydrophobicContact CE3-CB 3.29Å; W659-R672 VanDerWaalsContact CE3-CD 3.42Å; W659-R672 HydrophobicContact CE3-CG 3.26Å; W659-R672 HydrophobicContact CH2-CB 3.88Å; W659-R672 HydrophobicContact CH2-CG 4.47Å; W659-R672 HydrophobicContact CZ3-CB 3.12Å; W659-R672 HydrophobicContact CZ3-CG 3.31Å; I668-R672 VanDerWaalsContact O-CB 3.31Å; I668-R672 WeakPolarHBondContact O-CB 3.49Å; I668-R672 PolarHBondContact O-N 3.37Å; E669-R672 WeakPolarHBondContact O-CB 3.34Å; E669-R672 PolarHBondContact O-N 3.17Å; E669-R672 IonicContact OE1-NH1 2.85Å; E669-R672 PolarHBondContact OE1-NH1 3.46Å; E669-R672 IonicContact OE2-NH1 3.93Å; E669-R672 PolarHBondContact OE2-NH1 3.31Å; E670-R672 VanDerWaalsContact C-N 3.3Å; E670-R672 PolarHBondContact O-N 2.9Å; R672-K674 VanDerWaalsContact C-N 3.33Å; R672-L675 PolarHBondContact O-N 3.06Å; R672-T676 VanDerWaalsContact O-CB 3.31Å; R672-T676 WeakPolarHBondContact O-CB 3.46Å; R672-T676 PolarHBondContact O-N 3.27Å; R672-T676 PolarHBondContact O-OG1 2.58Å
673	E	83.2	Confident	78.6	Confident	125 Å²	125	76.2 Å²	76.2	58%	0.584	36%	0.355	S	S	*	.	H	α-helix	trans	-61.7	-45.9	178.7	-170.2	-178.6	173.5	0	0	110	E669 L675 T676 N677	E669-E673 WeakPolarHBondContact O-CB 3.35Å; E669-E673 PolarHBondContact O-N 3.46Å; E673-L675 PolarHBondContact O-N 2.96Å; E673-T676 PolarHBondContact O-N 2.82Å; E673-N677 VanDerWaalsContact O-CB 3.28Å; E673-N677 WeakPolarHBondContact O-CB 3.48Å; E673-N677 PolarHBondContact O-N 3.32Å; E673-N677 PolarHBondContact O-ND2 3.31Å
674	K	84.3	Confident	80.6	Confident	115 Å²	115	66.1 Å²	66.1	50%	0.5	32%	0.322	S	S	.	.	H	α-helix	trans	-56.9	-47.1	176.2	-175.9	179.5	179	-178.5	0	112.6	N625 E670 I671 R672 L678	N625-K674 PolarHBondContact OD1-NZ 2.92Å; E670-K674 VanDerWaalsContact O-CB 3.28Å; E670-K674 WeakPolarHBondContact O-CB 3.34Å; E670-K674 PolarHBondContact O-N 2.92Å; I671-K674 PolarHBondContact O-N 2.87Å; R672-K674 VanDerWaalsContact C-N 3.33Å; K674-L678 WeakPolarHBondContact O-CB 3.47Å; K674-L678 PolarHBondContact O-N 3.07Å
675	L	85	Confident	82.7	Confident	2 Å²	2	61.3 Å²	61.3	1%	0.01	29%	0.289	C	S	.	.	H	α-helix	trans	-70.5	-40.2	180	-79.4	166.2	0	0	0	112.6	L611 L631 W659 I671 R672 E673 N677 L678 L679	L611-L675 HydrophobicContact CD1-CD1 4.02Å; L611-L675 HydrophobicContact CD1-CD2 4.19Å; L611-L675 HydrophobicContact CD2-CD1 3.58Å; L611-L675 HydrophobicContact CG-CD1 4.42Å; L631-L675 HydrophobicContact CD2-CD2 3.88Å; W659-L675 HydrophobicContact CH2-CD1 3.88Å; I671-L675 HydrophobicContact CG2-CD1 3.75Å; I671-L675 WeakPolarHBondContact O-CB 3.46Å; I671-L675 WeakPolarHBondContact O-CG 3.46Å; I671-L675 PolarHBondContact O-N 2.86Å; R672-L675 PolarHBondContact O-N 3.06Å; E673-L675 PolarHBondContact O-N 2.96Å; L675-N677 VanDerWaalsContact C-N 3.35Å; L675-L678 PolarHBondContact O-N 2.81Å; L675-L679 WeakPolarHBondContact O-CB 3.2Å; L675-L679 WeakPolarHBondContact O-CG 3.03Å; L675-L679 PolarHBondContact O-N 3.07Å
676	T	86	Confident	84.2	Confident	30 Å²	30	57.8 Å²	57.8	18%	0.184	27%	0.27	C	S	.	.	H	α-helix	trans	-63	-44.8	176.8	-55.3	0	0	0	0	110.2	I652 R672 E673 L679 Q680	I652-T676 HydrophobicContact CG2-CG2 4.42Å; R672-T676 VanDerWaalsContact O-CB 3.31Å; R672-T676 WeakPolarHBondContact O-CB 3.46Å; R672-T676 PolarHBondContact O-N 3.27Å; R672-T676 PolarHBondContact O-OG1 2.58Å; E673-T676 PolarHBondContact O-N 2.82Å; T676-L679 PolarHBondContact O-N 3.19Å; T676-Q680 WeakPolarHBondContact O-CB 3.44Å; T676-Q680 PolarHBondContact O-N 3.47Å
677	N	86.8	Confident	85.3	Confident	97 Å²	97	50.7 Å²	50.7	52%	0.519	24%	0.237	S	C	.	.	H	α-helix	trans	-62.8	-42.7	176	-72.3	-20.5	0	0	0	112.2	E673 L675 Y681	E673-N677 VanDerWaalsContact O-CB 3.28Å; E673-N677 WeakPolarHBondContact O-CB 3.48Å; E673-N677 PolarHBondContact O-N 3.32Å; E673-N677 PolarHBondContact O-ND2 3.31Å; L675-N677 VanDerWaalsContact C-N 3.35Å; N677-Y681 PolarHBondContact O-N 2.95Å
678	L	87.4	Confident	86.3	Confident	34 Å²	34	47 Å²	47	18%	0.178	22%	0.223	C	C	.	.	H	α-helix	trans	-60.9	-50.4	175.7	-175.2	153.9	0	0	0	111.2	E632 I635 K674 L675 Y681 Y682	E632-L678 HydrophobicContact CB-CD1 4.22Å; E632-L678 HydrophobicContact CG-CD1 4.29Å; I635-L678 HydrophobicContact CD1-CD2 4.46Å; K674-L678 WeakPolarHBondContact O-CB 3.47Å; K674-L678 PolarHBondContact O-N 3.07Å; L675-L678 PolarHBondContact O-N 2.81Å; L678-Y681 WeakPolarHBondContact O-CB 3.22Å; L678-Y681 PolarHBondContact O-N 3.05Å; L678-Y682 HydrophobicContact CD2-CD2 4.15Å; L678-Y682 HydrophobicContact CD2-CE2 4.14Å; L678-Y682 HydrophobicContact CG-CE2 4.42Å; L678-Y682 VanDerWaalsContact O-CD2 3.24Å; L678-Y682 WeakPolarHBondContact O-CD2 2.93Å
679	L	89.4	Confident	87.3	Confident	1 Å²	1	46.1 Å²	46.1	1%	0.005	22%	0.219	C	C	.	.	H	α-helix	trans	-66.9	-42.5	-178.4	-69.5	173.4	0	0	0	111.7	L631 I635 L642 V651 I652 I655 L675 T676 Y681 Y682 V683	L631-L679 HydrophobicContact CD2-CD2 4.31Å; I635-L679 HydrophobicContact CD1-CD2 3.71Å; L642-L679 HydrophobicContact CD1-CB 4.42Å; L642-L679 HydrophobicContact CD1-CD2 4.1Å; L642-L679 WeakPolarHBondContact CD1-O 3.47Å; L642-L679 HydrophobicContact CD2-CD2 4.17Å; V651-L679 HydrophobicContact CG1-CD1 3.95Å; I652-L679 HydrophobicContact CD1-CB 3.97Å; I652-L679 HydrophobicContact CG1-CB 3.77Å; I652-L679 HydrophobicContact CG1-CD1 3.96Å; I655-L679 HydrophobicContact CD1-CD1 3.4Å; I655-L679 VanDerWaalsContact CD1-CD1 3.4Å; L675-L679 WeakPolarHBondContact O-CB 3.2Å; L675-L679 WeakPolarHBondContact O-CG 3.03Å; L675-L679 PolarHBondContact O-N 3.07Å; T676-L679 PolarHBondContact O-N 3.19Å; L679-Y681 PolarHBondContact O-N 3.09Å; L679-Y682 PolarHBondContact O-N 3.46Å; L679-V683 WeakPolarHBondContact O-CG2 3.33Å; L679-V683 PolarHBondContact O-N 3.27Å; L679-V683 VanDerWaalsContact O-N 3.07Å
680	Q	88.9	Confident	88.2	Confident	110 Å²	110	42 Å²	42	51%	0.514	20%	0.199	S	C	.	.	H	α-helix	trans	-59.3	-34.6	179.7	-169.8	62.1	36.5	0	0	112.3	T676 Y682 V683	T676-Q680 WeakPolarHBondContact O-CB 3.44Å; T676-Q680 PolarHBondContact O-N 3.47Å; Q680-Y682 VanDerWaalsContact C-N 3.34Å; Q680-Y682 PolarHBondContact O-N 3.1Å; Q680-V683 PolarHBondContact O-N 3.24Å
681	Y	88.8	Confident	88.9	Confident	101 Å²	101	38.2 Å²	38.2	40%	0.396	18%	0.181	S	C	.	.	H	α-helix	trans	-59	-43.8	173.1	175.8	-92.2	0	0	0	112.2	N677 L678 L679 L685	N677-Y681 PolarHBondContact O-N 2.95Å; L678-Y681 WeakPolarHBondContact O-CB 3.22Å; L678-Y681 PolarHBondContact O-N 3.05Å; L679-Y681 PolarHBondContact O-N 3.09Å; Y681-L685 HydrophobicContact CD1-CD1 4.46Å; Y681-L685 HydrophobicContact CE1-CD1 3.93Å
682	Y	91.2	Very high	89.6	Confident	18 Å²	18	37.5 Å²	37.5	7%	0.071	18%	0.177	C	C	.	.	H	α-helix	trans	-82	-17.5	-177.5	-72	-74.8	0	0	0	114.5	E632 I635 K636 L678 L679 Q680 S684 L685 T686	E632-Y682 HydrophobicContact CG-CE2 4.02Å; E632-Y682 PolarHBondContact OE1-OH 2.96Å; E632-Y682 VanDerWaalsContact OE1-OH 3.11Å; I635-Y682 HydrophobicContact CG2-CD1 3.7Å; I635-Y682 HydrophobicContact CG2-CD2 4.21Å; I635-Y682 HydrophobicContact CG2-CE1 4.26Å; I635-Y682 HydrophobicContact CG2-CG 3.69Å; K636-Y682 WeakPolarHBondContact CE-OH 3.49Å; K636-Y682 HydrophobicContact CG-CE1 4.33Å; L678-Y682 HydrophobicContact CD2-CD2 4.15Å; L678-Y682 HydrophobicContact CD2-CE2 4.14Å; L678-Y682 HydrophobicContact CG-CE2 4.42Å; L678-Y682 VanDerWaalsContact O-CD2 3.24Å; L678-Y682 WeakPolarHBondContact O-CD2 2.93Å; L679-Y682 PolarHBondContact O-N 3.46Å; Q680-Y682 VanDerWaalsContact C-N 3.34Å; Q680-Y682 PolarHBondContact O-N 3.1Å; Y682-S684 VanDerWaalsContact C-N 3.31Å; Y682-S684 PolarHBondContact O-N 3.35Å; Y682-L685 HydrophobicContact CD1-CD1 4.04Å; Y682-L685 HydrophobicContact CE1-CD1 4.42Å; Y682-L685 PolarHBondContact O-N 3Å; Y682-L685 VanDerWaalsContact O-N 3.1Å; Y682-T686 WeakPolarHBondContact O-CG2 2.9Å; Y682-T686 PolarHBondContact O-N 2.95Å; Y682-T686 PolarHBondContact O-OG1 3.43Å
683	V	91.4	Very high	90.2	Very high	15 Å²	15	34.6 Å²	34.6	9%	0.091	17%	0.166	C	C	.	.	H	α-helix	trans	-54.3	-48.9	178.3	172.5	0	0	0	0	110.8	L642 I652 L679 Q680 L685 T686 D687	L642-V683 HydrophobicContact CB-CG2 4.3Å; L642-V683 HydrophobicContact CD1-CG2 4.1Å; I652-V683 HydrophobicContact CD1-CG2 3.48Å; I652-V683 VanDerWaalsContact CD1-CG2 3.48Å; L679-V683 WeakPolarHBondContact O-CG2 3.33Å; L679-V683 PolarHBondContact O-N 3.27Å; L679-V683 VanDerWaalsContact O-N 3.07Å; Q680-V683 PolarHBondContact O-N 3.24Å; V683-L685 VanDerWaalsContact C-N 3.25Å; V683-L685 PolarHBondContact O-N 3.12Å; V683-T686 PolarHBondContact O-N 3.29Å; V683-T686 PolarHBondContact O-OG1 3.44Å; V683-D687 WeakPolarHBondContact O-CB 3.31Å; V683-D687 PolarHBondContact O-N 2.94Å
684	S	89.5	Confident	90.6	Very high	34 Å²	34	28.6 Å²	28.6	24%	0.238	14%	0.138	C	C	.	.	H	α-helix	trans	-66.4	-25.3	-178.4	72.3	0	0	0	0	114.1	Y682 F688 K712	Y682-S684 VanDerWaalsContact C-N 3.31Å; Y682-S684 PolarHBondContact O-N 3.35Å; S684-F688 PolarHBondContact O-N 3.37Å; S684-K712 WeakPolarHBondContact O-CE 3.44Å
685	L	92.7	Very high	91	Very high	7 Å²	7	23.3 Å²	23.3	4%	0.037	12%	0.116	C	C	.	.	H	α-helix	trans	-83	-43.3	179.4	-57.5	-178.4	0	0	0	111	Y681 Y682 V683 F688 V689 L711 K712 L715	Y681-L685 HydrophobicContact CD1-CD1 4.46Å; Y681-L685 HydrophobicContact CE1-CD1 3.93Å; Y682-L685 HydrophobicContact CD1-CD1 4.04Å; Y682-L685 HydrophobicContact CE1-CD1 4.42Å; Y682-L685 PolarHBondContact O-N 3Å; Y682-L685 VanDerWaalsContact O-N 3.1Å; V683-L685 VanDerWaalsContact C-N 3.25Å; V683-L685 PolarHBondContact O-N 3.12Å; L685-F688 WeakPolarHBondContact O-CB 3.42Å; L685-F688 PolarHBondContact O-N 3.21Å; L685-V689 VanDerWaalsContact O-CG2 3.31Å; L685-V689 WeakPolarHBondContact O-CG2 3.11Å; L685-V689 PolarHBondContact O-N 2.87Å; L685-L711 HydrophobicContact CD1-CD2 4.07Å; L685-L711 HydrophobicContact CD2-CD2 3.39Å; L685-L711 HydrophobicContact CG-CD2 4.39Å; L685-K712 HydrophobicContact CD2-CG 3.73Å; L685-L715 HydrophobicContact CB-CD1 4.15Å; L685-L715 HydrophobicContact CD1-CD2 4.32Å; L685-L715 HydrophobicContact CD2-CD1 4.5Å
686	T	93.2	Very high	91.4	Very high	0 Å²	0	23.5 Å²	23.5	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-71.8	-33.6	179.8	57.2	0	0	0	0	112	I635 I640 L642 Y682 V683 V689 I690	I635-T686 HydrophobicContact CG2-CG2 4.48Å; I640-T686 WeakPolarHBondContact O-CB 3.22Å; I640-T686 WeakPolarHBondContact O-CG2 3.25Å; L642-T686 HydrophobicContact CG-CG2 4.35Å; Y682-T686 WeakPolarHBondContact O-CG2 2.9Å; Y682-T686 PolarHBondContact O-N 2.95Å; Y682-T686 PolarHBondContact O-OG1 3.43Å; V683-T686 PolarHBondContact O-N 3.29Å; V683-T686 PolarHBondContact O-OG1 3.44Å; T686-V689 PolarHBondContact O-N 3.1Å; T686-I690 PolarHBondContact O-N 2.98Å
687	D	93.1	Very high	91.7	Very high	10 Å²	10	23.9 Å²	23.9	5%	0.053	12%	0.118	C	C	.	.	H	α-helix	trans	-61.5	-45.7	168.5	-83.6	-3.4	0	0	0	111.5	W641 K643 V683 V689 I690 Y691	W641-D687 PolarHBondContact NE1-OD1 3.44Å; K643-D687 WeakPolarHBondContact CD-OD1 3.46Å; K643-D687 WeakPolarHBondContact CE-OD2 3.49Å; K643-D687 IonicContact NZ-OD1 3.96Å; K643-D687 IonicContact NZ-OD2 3.73Å; K643-D687 PolarHBondContact NZ-OD2 3.28Å; V683-D687 WeakPolarHBondContact O-CB 3.31Å; V683-D687 PolarHBondContact O-N 2.94Å; D687-V689 VanDerWaalsContact C-N 3.34Å; D687-V689 PolarHBondContact O-N 3.46Å; D687-I690 PolarHBondContact O-N 3.15Å; D687-Y691 HydrophobicContact CB-CD2 4.26Å; D687-Y691 HydrophobicContact CB-CE2 3.72Å; D687-Y691 WeakPolarHBondContact O-CD2 3.19Å; D687-Y691 PolarHBondContact O-N 2.94Å
688	F	94.1	Very high	91.9	Very high	1 Å²	1	26.2 Å²	26.2	0%	0.004	13%	0.125	C	C	.	.	H	α-helix	trans	-58.9	-44.7	177.4	-179.8	-90.6	0	0	0	111.9	S684 L685 I690 S692 L700 C703 L704 K712 L715 L737	S684-F688 PolarHBondContact O-N 3.37Å; L685-F688 WeakPolarHBondContact O-CB 3.42Å; L685-F688 PolarHBondContact O-N 3.21Å; F688-I690 PolarHBondContact O-N 3.34Å; F688-S692 VanDerWaalsContact O-CB 3.3Å; F688-S692 WeakPolarHBondContact O-CB 3.1Å; F688-S692 PolarHBondContact O-N 3.03Å; F688-S692 PolarHBondContact O-OG 3.3Å; F688-L700 HydrophobicContact CD2-CD1 3.37Å; F688-L700 HydrophobicContact CD2-CG 4.47Å; F688-L700 HydrophobicContact CE2-CD1 3.31Å; F688-L700 HydrophobicContact CE2-CG 4.1Å; F688-L700 HydrophobicContact CG-CD1 4.06Å; F688-L700 HydrophobicContact CZ-CD1 3.95Å; F688-C703 HydrophobicContact CD2-CB 4.19Å; F688-L704 HydrophobicContact CD2-CD2 4.38Å; F688-L704 HydrophobicContact CE2-CD1 4.49Å; F688-L704 HydrophobicContact CE2-CD2 3.62Å; F688-L704 HydrophobicContact CE2-CG 3.93Å; F688-L704 HydrophobicContact CZ-CD2 4.4Å; F688-K712 HydrophobicContact CB-CD 4.27Å; F688-K712 HydrophobicContact CB-CG 4.27Å; F688-K712 HydrophobicContact CD1-CB 3.78Å; F688-K712 HydrophobicContact CD1-CG 4.39Å; F688-K712 HydrophobicContact CD2-CB 3.89Å; F688-K712 HydrophobicContact CD2-CD 3.91Å; F688-K712 HydrophobicContact CD2-CG 4.23Å; F688-K712 HydrophobicContact CE1-CB 3.86Å; F688-K712 WeakPolarHBondContact CE1-O 3.44Å; F688-K712 HydrophobicContact CE2-CB 3.97Å; F688-K712 HydrophobicContact CG-CB 3.8Å; F688-K712 HydrophobicContact CG-CD 4.12Å; F688-K712 HydrophobicContact CG-CG 4.04Å; F688-K712 HydrophobicContact CZ-CB 3.95Å; F688-L715 HydrophobicContact CD1-CD1 4.35Å; F688-L737 HydrophobicContact CD1-CD2 3.96Å; F688-L737 HydrophobicContact CE1-CD2 3.87Å
689	V	93.5	Very high	92.2	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-56.5	-49.8	176.8	170.2	0	0	0	0	110.8	L639 L685 T686 D687 S692 M693 L715 L737	L639-V689 HydrophobicContact CB-CG1 4.4Å; L639-V689 HydrophobicContact CB-CG2 4.09Å; L639-V689 HydrophobicContact CD1-CG2 3.8Å; L639-V689 HydrophobicContact CG-CG2 4.46Å; L685-V689 VanDerWaalsContact O-CG2 3.31Å; L685-V689 WeakPolarHBondContact O-CG2 3.11Å; L685-V689 PolarHBondContact O-N 2.87Å; T686-V689 PolarHBondContact O-N 3.1Å; D687-V689 VanDerWaalsContact C-N 3.34Å; D687-V689 PolarHBondContact O-N 3.46Å; V689-S692 PolarHBondContact O-N 2.68Å; V689-S692 PolarHBondContact O-OG 3.01Å; V689-M693 HydrophobicContact CG1-SD 4.08Å; V689-M693 WeakPolarHBondContact O-CG 3.44Å; V689-M693 PolarHBondContact O-N 3.1Å; V689-L715 HydrophobicContact CG2-CD1 3.85Å; V689-L737 HydrophobicContact CB-CD1 4.38Å; V689-L737 HydrophobicContact CB-CD2 4.49Å; V689-L737 HydrophobicContact CG1-CD1 3.89Å; V689-L737 HydrophobicContact CG2-CD1 4.2Å; V689-L737 HydrophobicContact CG2-CD2 3.85Å
690	I	93.2	Very high	92.3	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-74.1	-38.4	-174.9	-76.5	169.6	0	0	0	113.1	I405 L552 W641 T686 D687 F688 S692 M693 A694	I405-I690 HydrophobicContact CD1-CG2 3.69Å; I405-I690 HydrophobicContact CG1-CG2 3.65Å; L552-I690 HydrophobicContact CD2-CD1 4.48Å; L552-I690 HydrophobicContact CD2-CG1 4.44Å; W641-I690 HydrophobicContact CB-CD1 3.1Å; W641-I690 HydrophobicContact CD2-CD1 3.54Å; W641-I690 HydrophobicContact CE3-CD1 4.29Å; W641-I690 HydrophobicContact CG-CD1 2.98Å; W641-I690 HydrophobicContact CG-CG1 4.41Å; T686-I690 PolarHBondContact O-N 2.98Å; D687-I690 PolarHBondContact O-N 3.15Å; F688-I690 PolarHBondContact O-N 3.34Å; I690-S692 VanDerWaalsContact C-N 3.25Å; I690-S692 PolarHBondContact O-N 3.49Å; I690-M693 PolarHBondContact O-N 3.42Å; I690-A694 VanDerWaalsContact O-CB 3.24Å; I690-A694 WeakPolarHBondContact O-CB 3.49Å; I690-A694 PolarHBondContact O-N 2.9Å
691	Y	94.6	Very high	92.5	Very high	26 Å²	26	28.4 Å²	28.4	10%	0.102	13%	0.132	C	C	.	.	H	α-helix	trans	-64	-35.5	173.5	-58	-33.3	0	0	0	111.4	I405 D687 A694 G695 D696 K699 C703	I405-Y691 HydrophobicContact CD1-CD1 3.72Å; I405-Y691 HydrophobicContact CD1-CE1 4.11Å; I405-Y691 HydrophobicContact CG1-CD1 4.23Å; I405-Y691 HydrophobicContact CG1-CE1 4.12Å; I405-Y691 HydrophobicContact CG2-CE1 4.19Å; D687-Y691 HydrophobicContact CB-CD2 4.26Å; D687-Y691 HydrophobicContact CB-CE2 3.72Å; D687-Y691 WeakPolarHBondContact O-CD2 3.19Å; D687-Y691 PolarHBondContact O-N 2.94Å; Y691-A694 PolarHBondContact O-N 3.13Å; Y691-G695 PolarHBondContact O-N 2.89Å; Y691-D696 PolarHBondContact O-N 3.23Å; Y691-D696 VanDerWaalsContact O-N 3.09Å; Y691-K699 HydrophobicContact CD1-CB 3.89Å; Y691-K699 HydrophobicContact CD1-CD 3.82Å; Y691-K699 HydrophobicContact CD2-CB 3.67Å; Y691-K699 HydrophobicContact CE1-CB 4.16Å; Y691-K699 HydrophobicContact CE1-CD 3.51Å; Y691-K699 HydrophobicContact CE1-CG 4.45Å; Y691-K699 HydrophobicContact CE2-CB 3.94Å; Y691-K699 HydrophobicContact CE2-CD 4.48Å; Y691-K699 HydrophobicContact CG-CB 3.65Å; Y691-K699 HydrophobicContact CG-CD 4.45Å; Y691-C703 WeakPolarHBondContact CD2-SG 3.14Å; Y691-C703 VanDerWaalsContact CE2-SG 3.5Å
692	S	94.4	Very high	92.7	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-65.7	-41.7	173.5	78.7	0	0	0	0	112.3	F688 V689 I690 G695 S745	F688-S692 VanDerWaalsContact O-CB 3.3Å; F688-S692 WeakPolarHBondContact O-CB 3.1Å; F688-S692 PolarHBondContact O-N 3.03Å; F688-S692 PolarHBondContact O-OG 3.3Å; V689-S692 PolarHBondContact O-N 2.68Å; V689-S692 PolarHBondContact O-OG 3.01Å; I690-S692 VanDerWaalsContact C-N 3.25Å; I690-S692 PolarHBondContact O-N 3.49Å; S692-G695 PolarHBondContact O-N 3.28Å; S692-S745 VanDerWaalsContact O-CB 3.25Å; S692-S745 WeakPolarHBondContact O-CB 3.37Å; S692-S745 PolarHBondContact O-OG 3.23Å
693	M	92.8	Very high	92.6	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-70.6	-33.5	176.9	-71.1	176.9	68.6	0	0	113.1	I397 R398 A401 I548 Q551 V689 I690 G695 Y744	I397-M693 HydrophobicContact CG2-CE 4.26Å; R398-M693 WeakPolarHBondContact CG-O 3.42Å; A401-M693 HydrophobicContact CB-CB 4.37Å; I548-M693 HydrophobicContact CG2-CE 4.43Å; Q551-M693 PolarHBondContact OE1-SD 3.05Å; Q551-M693 VanDerWaalsContact OE1-SD 3.34Å; V689-M693 HydrophobicContact CG1-SD 4.08Å; V689-M693 WeakPolarHBondContact O-CG 3.44Å; V689-M693 PolarHBondContact O-N 3.1Å; I690-M693 PolarHBondContact O-N 3.42Å; M693-G695 VanDerWaalsContact C-N 3.3Å; M693-Y744 HydrophobicContact CE-CD2 4.1Å; M693-Y744 HydrophobicContact CE-CE2 4.27Å
694	A	92.9	Very high	92.5	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-78.1	-12.5	179.8	0	0	0	0	0	113.7	W354 R398 A401 K402 I405 I690 Y691 D696	W354-A694 PolarHBondContact NE1-O 2.89Å; R398-A694 WeakPolarHBondContact CG-O 3.31Å; A401-A694 HydrophobicContact CB-CB 3.83Å; K402-A694 HydrophobicContact CB-CB 4.39Å; I405-A694 HydrophobicContact CD1-CB 3.31Å; I690-A694 VanDerWaalsContact O-CB 3.24Å; I690-A694 WeakPolarHBondContact O-CB 3.49Å; I690-A694 PolarHBondContact O-N 2.9Å; Y691-A694 PolarHBondContact O-N 3.13Å; A694-D696 VanDerWaalsContact C-N 3.33Å
695	G	92.7	Very high	92.5	Very high	4 Å²	4	32 Å²	32	4%	0.041	17%	0.165	C	C	.	.	T	Hydrogen-bonded Turn	trans	74.2	20.8	-175	0	0	0	0	0	113.6	Y691 S692 M693 I697 S745	Y691-G695 PolarHBondContact O-N 2.89Å; S692-G695 PolarHBondContact O-N 3.28Å; M693-G695 VanDerWaalsContact C-N 3.3Å; G695-I697 PolarHBondContact O-N 3.02Å; G695-S745 WeakPolarHBondContact CA-OG 3.26Å
696	D	92.3	Very high	92.3	Very high	5 Å²	5	38.6 Å²	38.6	3%	0.027	20%	0.197	C	C	.	.			trans	-89.8	85	-175.9	-164.7	-39.8	0	0	0	110.8	K402 Y691 A694 Q698 K699 L700	K402-D696 IonicContact NZ-OD2 2.7Å; K402-D696 PolarHBondContact NZ-OD2 3.2Å; Y691-D696 PolarHBondContact O-N 3.23Å; Y691-D696 VanDerWaalsContact O-N 3.09Å; A694-D696 VanDerWaalsContact C-N 3.33Å; D696-Q698 VanDerWaalsContact C-N 3.26Å; D696-Q698 PolarHBondContact O-N 3.41Å; D696-Q698 PolarHBondContact OD1-N 3.32Å; D696-K699 HydrophobicContact CB-CB 4.37Å; D696-K699 PolarHBondContact O-N 3.08Å; D696-K699 WeakPolarHBondContact OD1-CG 3.43Å; D696-K699 PolarHBondContact OD1-N 2.66Å; D696-K699 VanDerWaalsContact OD1-N 3.1Å; D696-L700 VanDerWaalsContact O-CB 3.32Å; D696-L700 WeakPolarHBondContact O-CB 3.3Å; D696-L700 PolarHBondContact O-N 3.34Å
697	I	92.6	Very high	92	Very high	39 Å²	39	40.1 Å²	40.1	20%	0.2	21%	0.213	C	C	.	.	H	α-helix	trans	-60.2	-36.6	-175.2	-62.1	159.9	0	0	0	111.7	G695 L700 K701 E748 V749 L752	G695-I697 PolarHBondContact O-N 3.02Å; I697-L700 PolarHBondContact O-N 3.11Å; I697-K701 HydrophobicContact CG2-CD 4.13Å; I697-K701 HydrophobicContact CG2-CG 4.33Å; I697-K701 WeakPolarHBondContact O-CB 3.47Å; I697-K701 WeakPolarHBondContact O-CG 3.47Å; I697-K701 PolarHBondContact O-N 3.3Å; I697-E748 HydrophobicContact CD1-CB 3.48Å; I697-E748 VanDerWaalsContact CD1-CB 3.48Å; I697-E748 HydrophobicContact CD1-CG 4.21Å; I697-E748 WeakPolarHBondContact CD1-OE2 3.28Å; I697-E748 HydrophobicContact CG1-CB 4.36Å; I697-V749 HydrophobicContact CD1-CG2 4.4Å; I697-V749 HydrophobicContact CG1-CG2 3.44Å; I697-V749 VanDerWaalsContact CG1-CG2 3.44Å; I697-L752 HydrophobicContact CG2-CD2 4.48Å
698	Q	92.4	Very high	91.7	Very high	145 Å²	145	45 Å²	45	68%	0.678	23%	0.234	S	C	*	.	H	α-helix	trans	-65.8	-49.4	-177.8	-65.8	-174.3	-2.2	0	0	110.8	D696 L700 K701 Q702	D696-Q698 VanDerWaalsContact C-N 3.26Å; D696-Q698 PolarHBondContact O-N 3.41Å; D696-Q698 PolarHBondContact OD1-N 3.32Å; Q698-L700 VanDerWaalsContact C-N 3.29Å; Q698-L700 PolarHBondContact O-N 3.09Å; Q698-K701 PolarHBondContact O-N 3.15Å; Q698-Q702 WeakPolarHBondContact O-CG 3.28Å; Q698-Q702 PolarHBondContact O-N 2.73Å; Q698-Q702 VanDerWaalsContact O-N 3.09Å
699	K	92.2	Very high	91.3	Very high	66 Å²	66	45.9 Å²	45.9	29%	0.287	24%	0.243	S	C	.	.	H	α-helix	trans	-66	-34.4	175.8	-67.7	-174.2	-175.8	-179.4	0	112	I405 Y691 D696 Q702 C703	I405-K699 HydrophobicContact CG2-CD 4.25Å; Y691-K699 HydrophobicContact CD1-CB 3.89Å; Y691-K699 HydrophobicContact CD1-CD 3.82Å; Y691-K699 HydrophobicContact CD2-CB 3.67Å; Y691-K699 HydrophobicContact CE1-CB 4.16Å; Y691-K699 HydrophobicContact CE1-CD 3.51Å; Y691-K699 HydrophobicContact CE1-CG 4.45Å; Y691-K699 HydrophobicContact CE2-CB 3.94Å; Y691-K699 HydrophobicContact CE2-CD 4.48Å; Y691-K699 HydrophobicContact CG-CB 3.65Å; Y691-K699 HydrophobicContact CG-CD 4.45Å; D696-K699 HydrophobicContact CB-CB 4.37Å; D696-K699 PolarHBondContact O-N 3.08Å; D696-K699 WeakPolarHBondContact OD1-CG 3.43Å; D696-K699 PolarHBondContact OD1-N 2.66Å; D696-K699 VanDerWaalsContact OD1-N 3.1Å; K699-Q702 WeakPolarHBondContact O-CB 3.34Å; K699-Q702 PolarHBondContact O-N 3.2Å; K699-C703 PolarHBondContact O-N 2.86Å
700	L	92.4	Very high	91.2	Very high	1 Å²	1	52 Å²	52	1%	0.005	27%	0.272	C	S	.	.	H	α-helix	trans	-64.3	-44.4	176	-166.7	65.4	0	0	0	112.2	F688 D696 I697 Q698 Q702 C703 L704 V749 L752	F688-L700 HydrophobicContact CD2-CD1 3.37Å; F688-L700 HydrophobicContact CD2-CG 4.47Å; F688-L700 HydrophobicContact CE2-CD1 3.31Å; F688-L700 HydrophobicContact CE2-CG 4.1Å; F688-L700 HydrophobicContact CG-CD1 4.06Å; F688-L700 HydrophobicContact CZ-CD1 3.95Å; D696-L700 VanDerWaalsContact O-CB 3.32Å; D696-L700 WeakPolarHBondContact O-CB 3.3Å; D696-L700 PolarHBondContact O-N 3.34Å; I697-L700 PolarHBondContact O-N 3.11Å; Q698-L700 VanDerWaalsContact C-N 3.29Å; Q698-L700 PolarHBondContact O-N 3.09Å; L700-Q702 VanDerWaalsContact C-N 3.33Å; L700-Q702 PolarHBondContact O-N 3.07Å; L700-C703 WeakPolarHBondContact O-CB 3.41Å; L700-C703 PolarHBondContact O-N 3Å; L700-C703 VanDerWaalsContact O-N 3.17Å; L700-L704 WeakPolarHBondContact O-CG 3.34Å; L700-L704 PolarHBondContact O-N 3.26Å; L700-V749 HydrophobicContact CD2-CB 4.33Å; L700-V749 HydrophobicContact CD2-CG1 3.6Å; L700-V749 HydrophobicContact CD2-CG2 4.17Å; L700-L752 HydrophobicContact CD2-CD2 4.02Å; L700-L752 HydrophobicContact CG-CD2 4.22Å
701	K	93.1	Very high	91.1	Very high	125 Å²	125	55.5 Å²	55.5	54%	0.543	29%	0.29	S	S	.	.	H	α-helix	trans	-59.6	-42.2	173.2	-76.2	178.3	178.2	179.9	0	111.6	I697 Q698 C703 L704 A705 L752	I697-K701 HydrophobicContact CG2-CD 4.13Å; I697-K701 HydrophobicContact CG2-CG 4.33Å; I697-K701 WeakPolarHBondContact O-CB 3.47Å; I697-K701 WeakPolarHBondContact O-CG 3.47Å; I697-K701 PolarHBondContact O-N 3.3Å; Q698-K701 PolarHBondContact O-N 3.15Å; K701-C703 PolarHBondContact O-N 3.24Å; K701-L704 PolarHBondContact O-N 2.98Å; K701-A705 WeakPolarHBondContact O-CB 3.43Å; K701-A705 PolarHBondContact O-N 3.32Å; K701-L752 HydrophobicContact CG-CD2 3.74Å
702	Q	91.8	Very high	91	Very high	119 Å²	119	54.4 Å²	54.4	56%	0.556	29%	0.286	S	S	*	.	H	α-helix	trans	-61	-43.7	173.9	-68.6	170.8	5	0	0	111.6	Q698 K699 L700 L704 A705 M706	Q698-Q702 WeakPolarHBondContact O-CG 3.28Å; Q698-Q702 PolarHBondContact O-N 2.73Å; Q698-Q702 VanDerWaalsContact O-N 3.09Å; K699-Q702 WeakPolarHBondContact O-CB 3.34Å; K699-Q702 PolarHBondContact O-N 3.2Å; L700-Q702 VanDerWaalsContact C-N 3.33Å; L700-Q702 PolarHBondContact O-N 3.07Å; Q702-L704 VanDerWaalsContact C-N 3.35Å; Q702-L704 PolarHBondContact O-N 3.36Å; Q702-A705 PolarHBondContact O-N 2.88Å; Q702-M706 WeakPolarHBondContact O-CG 3.39Å; Q702-M706 PolarHBondContact O-N 3.18Å
703	C	89.8	Confident	90.8	Very high	7 Å²	7	54.5 Å²	54.5	5%	0.047	29%	0.287	C	S	.	.	H	α-helix	trans	-62.5	-39.3	175.3	-79	0	0	0	0	112.7	F688 Y691 K699 L700 K701 M706 K712	F688-C703 HydrophobicContact CD2-CB 4.19Å; Y691-C703 WeakPolarHBondContact CD2-SG 3.14Å; Y691-C703 VanDerWaalsContact CE2-SG 3.5Å; K699-C703 PolarHBondContact O-N 2.86Å; L700-C703 WeakPolarHBondContact O-CB 3.41Å; L700-C703 PolarHBondContact O-N 3Å; L700-C703 VanDerWaalsContact O-N 3.17Å; K701-C703 PolarHBondContact O-N 3.24Å; C703-M706 PolarHBondContact O-N 3.09Å; C703-K712 PolarHBondContact O-NZ 3.23Å
704	L	89.5	Confident	90.8	Very high	29 Å²	29	58.1 Å²	58.1	15%	0.152	30%	0.304	C	S	.	.	H	α-helix	trans	-68.5	-37.1	176.6	-71.8	170	0	0	0	112	F688 L700 K701 Q702 M706 G707 L752 S756	F688-L704 HydrophobicContact CD2-CD2 4.38Å; F688-L704 HydrophobicContact CE2-CD1 4.49Å; F688-L704 HydrophobicContact CE2-CD2 3.62Å; F688-L704 HydrophobicContact CE2-CG 3.93Å; F688-L704 HydrophobicContact CZ-CD2 4.4Å; L700-L704 WeakPolarHBondContact O-CG 3.34Å; L700-L704 PolarHBondContact O-N 3.26Å; K701-L704 PolarHBondContact O-N 2.98Å; Q702-L704 VanDerWaalsContact C-N 3.35Å; Q702-L704 PolarHBondContact O-N 3.36Å; L704-M706 PolarHBondContact O-N 3.41Å; L704-G707 PolarHBondContact O-N 2.92Å; L704-L752 HydrophobicContact CD1-CD1 4.02Å; L704-L752 HydrophobicContact CD1-CD2 3.83Å; L704-L752 HydrophobicContact CD1-CG 3.72Å; L704-S756 VanDerWaalsContact CD1-OG 3.29Å; L704-S756 WeakPolarHBondContact CD1-OG 3.03Å
705	A	89.8	Confident	90.8	Very high	89 Å²	89	59 Å²	59	74%	0.736	31%	0.309	S	S	*	.	H	α-helix	trans	-61.6	-25.3	175	0	0	0	0	0	113.1	K701 Q702 G707	K701-A705 WeakPolarHBondContact O-CB 3.43Å; K701-A705 PolarHBondContact O-N 3.32Å; Q702-A705 PolarHBondContact O-N 2.88Å; A705-G707 PolarHBondContact O-N 3.47Å
706	M	87.7	Confident	90.7	Very high	144 Å²	144	61.4 Å²	61.4	71%	0.709	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.6	2.8	172.5	-62.2	177	-177.6	0	0	114	Q702 C703 L704	Q702-M706 WeakPolarHBondContact O-CG 3.39Å; Q702-M706 PolarHBondContact O-N 3.18Å; C703-M706 PolarHBondContact O-N 3.09Å; L704-M706 PolarHBondContact O-N 3.41Å
707	G	87.8	Confident	90.6	Very high	33 Å²	33	61.6 Å²	61.6	34%	0.34	32%	0.319	S	S	.	.	S	Bend	trans	88.1	179.5	176.8	0	0	0	0	0	114.9	L704 A705 G709 K712	L704-G707 PolarHBondContact O-N 2.92Å; A705-G707 PolarHBondContact O-N 3.47Å; G707-G709 VanDerWaalsContact C-N 3.34Å; G707-G709 PolarHBondContact O-N 2.93Å; G707-K712 PolarHBondContact O-NZ 3.35Å
708	K	86.1	Confident	90.3	Very high	113 Å²	113	64 Å²	64	49%	0.491	33%	0.329	S	S	.	.			trans	59.6	34.9	-175.8	-57.4	178.4	179.2	173.1	0	114.3	Q710 L711 K712	K708-Q710 PolarHBondContact O-N 3.26Å; K708-L711 HydrophobicContact CB-CB 4.37Å; K708-L711 PolarHBondContact O-N 3.5Å; K708-K712 WeakPolarHBondContact O-CB 3.41Å; K708-K712 WeakPolarHBondContact O-CG 3.31Å; K708-K712 PolarHBondContact O-N 3.4Å
709	G	86.8	Confident	89.8	Confident	19 Å²	19	61.8 Å²	61.8	20%	0.196	32%	0.318	C	S	.	.	H	α-helix	trans	-53.4	-49.4	-178.5	0	0	0	0	0	113.5	G707 L711 K712 A713 S756	G707-G709 VanDerWaalsContact C-N 3.34Å; G707-G709 PolarHBondContact O-N 2.93Å; G709-L711 PolarHBondContact O-N 3.18Å; G709-K712 WeakPolarHBondContact O-CB 3.44Å; G709-K712 PolarHBondContact O-N 3.47Å; G709-A713 WeakPolarHBondContact O-CB 3.08Å; G709-A713 PolarHBondContact O-N 3.06Å; G709-S756 CarbonylContact C-O 3.56Å
710	Q	89.7	Confident	89.4	Confident	128 Å²	128	59.1 Å²	59.1	60%	0.598	31%	0.306	S	S	*	.	H	α-helix	trans	-60.4	-45.3	179	-170.9	178.8	9.7	0	0	112.8	K708 K712 A713 Q714 S756	K708-Q710 PolarHBondContact O-N 3.26Å; Q710-K712 VanDerWaalsContact C-N 3.33Å; Q710-K712 PolarHBondContact O-N 2.93Å; Q710-A713 PolarHBondContact O-N 3.45Å; Q710-Q714 WeakPolarHBondContact O-CB 3.38Å; Q710-Q714 WeakPolarHBondContact O-CG 3.09Å; Q710-Q714 PolarHBondContact O-N 3.29Å; Q710-Q714 VanDerWaalsContact O-N 3.1Å; Q710-S756 VanDerWaalsContact CA-O 3.31Å; Q710-S756 WeakPolarHBondContact CA-O 3.28Å; Q710-S756 PolarHBondContact N-O 2.94Å
711	L	91.3	Very high	88.8	Confident	73 Å²	73	59.4 Å²	59.4	38%	0.382	31%	0.308	S	S	.	.	H	α-helix	trans	-64.4	-38.7	177.6	179.9	148.5	0	0	0	111.6	L685 K708 G709 Q714 L715	L685-L711 HydrophobicContact CD1-CD2 4.07Å; L685-L711 HydrophobicContact CD2-CD2 3.39Å; L685-L711 HydrophobicContact CG-CD2 4.39Å; K708-L711 HydrophobicContact CB-CB 4.37Å; K708-L711 PolarHBondContact O-N 3.5Å; G709-L711 PolarHBondContact O-N 3.18Å; L711-Q714 PolarHBondContact O-N 2.96Å; L711-L715 HydrophobicContact CD2-CD2 4.42Å; L711-L715 WeakPolarHBondContact O-CG 3.46Å
712	K	92.3	Very high	88	Confident	3 Å²	3	55.2 Å²	55.2	1%	0.013	29%	0.292	C	S	.	.	H	α-helix	trans	-66.4	-41.8	175.9	-77	168.5	174.3	161	0	112	S684 L685 F688 C703 G707 K708 G709 Q710 Q714 L715	S684-K712 WeakPolarHBondContact O-CE 3.44Å; L685-K712 HydrophobicContact CD2-CG 3.73Å; F688-K712 HydrophobicContact CB-CD 4.27Å; F688-K712 HydrophobicContact CB-CG 4.27Å; F688-K712 HydrophobicContact CD1-CB 3.78Å; F688-K712 HydrophobicContact CD1-CG 4.39Å; F688-K712 HydrophobicContact CD2-CB 3.89Å; F688-K712 HydrophobicContact CD2-CD 3.91Å; F688-K712 HydrophobicContact CD2-CG 4.23Å; F688-K712 HydrophobicContact CE1-CB 3.86Å; F688-K712 WeakPolarHBondContact CE1-O 3.44Å; F688-K712 HydrophobicContact CE2-CB 3.97Å; F688-K712 HydrophobicContact CG-CB 3.8Å; F688-K712 HydrophobicContact CG-CD 4.12Å; F688-K712 HydrophobicContact CG-CG 4.04Å; F688-K712 HydrophobicContact CZ-CB 3.95Å; C703-K712 PolarHBondContact O-NZ 3.23Å; G707-K712 PolarHBondContact O-NZ 3.35Å; K708-K712 WeakPolarHBondContact O-CB 3.41Å; K708-K712 WeakPolarHBondContact O-CG 3.31Å; K708-K712 PolarHBondContact O-N 3.4Å; G709-K712 WeakPolarHBondContact O-CB 3.44Å; G709-K712 PolarHBondContact O-N 3.47Å; Q710-K712 VanDerWaalsContact C-N 3.33Å; Q710-K712 PolarHBondContact O-N 2.93Å; K712-Q714 VanDerWaalsContact C-N 3.26Å; K712-Q714 PolarHBondContact O-N 2.97Å; K712-L715 WeakPolarHBondContact O-CD1 3.14Å; K712-L715 WeakPolarHBondContact O-CG 3.14Å
713	A	90.2	Very high	87.1	Confident	3 Å²	3	50.9 Å²	50.9	3%	0.025	28%	0.28	C	S	.	.	H	α-helix	trans	-69.5	-21.8	179	0	0	0	0	0	113.4	G709 Q710 M753 A758	G709-A713 WeakPolarHBondContact O-CB 3.08Å; G709-A713 PolarHBondContact O-N 3.06Å; Q710-A713 PolarHBondContact O-N 3.45Å; A713-M753 HydrophobicContact CB-CG 4.2Å; A713-M753 WeakPolarHBondContact O-CE 3.48Å; A713-A758 HydrophobicContact CB-CB 4.22Å
714	Q	92.7	Very high	86.3	Confident	76 Å²	76	53 Å²	53	36%	0.355	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.8	26.2	-178.8	-62	-178.2	1.8	0	0	113.1	Q710 L711 K712 H716 G757	Q710-Q714 WeakPolarHBondContact O-CB 3.38Å; Q710-Q714 WeakPolarHBondContact O-CG 3.09Å; Q710-Q714 PolarHBondContact O-N 3.29Å; Q710-Q714 VanDerWaalsContact O-N 3.1Å; L711-Q714 PolarHBondContact O-N 2.96Å; K712-Q714 VanDerWaalsContact C-N 3.26Å; K712-Q714 PolarHBondContact O-N 2.97Å; Q714-H716 PolarHBondContact O-CE1 2.91Å; Q714-H716 PolarHBondContact O-ND1 3.17Å; Q714-H716 VanDerWaalsContact O-ND1 3.08Å; Q714-G757 WeakPolarHBondContact CG-O 3.3Å; Q714-G757 PolarHBondContact NE2-O 2.7Å
715	L	93.1	Very high	85.5	Confident	19 Å²	19	53.2 Å²	53.2	10%	0.099	29%	0.291	C	S	.	.			trans	-70.9	146.5	176.4	-71.4	172.3	0	0	0	112	L639 L685 F688 V689 L711 K712 L737	L639-L715 HydrophobicContact CD1-CB 4.1Å; L685-L715 HydrophobicContact CB-CD1 4.15Å; L685-L715 HydrophobicContact CD1-CD2 4.32Å; L685-L715 HydrophobicContact CD2-CD1 4.5Å; F688-L715 HydrophobicContact CD1-CD1 4.35Å; V689-L715 HydrophobicContact CG2-CD1 3.85Å; L711-L715 HydrophobicContact CD2-CD2 4.42Å; L711-L715 WeakPolarHBondContact O-CG 3.46Å; K712-L715 WeakPolarHBondContact O-CD1 3.14Å; K712-L715 WeakPolarHBondContact O-CG 3.14Å; L715-L737 HydrophobicContact CB-CB 4.26Å; L715-L737 HydrophobicContact CB-CD2 4.29Å; L715-L737 HydrophobicContact CD1-CD2 4.43Å; L715-L737 WeakPolarHBondContact O-CB 3.32Å; L715-L737 PolarHBondContact O-N 3.45Å
716	H	92.4	Very high	84.6	Confident	54 Å²	54	54.5 Å²	54.5	25%	0.25	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	140.8	175.9	-57.3	83.4	0	0	0	111.7	Q714 T734 R735 E762	Q714-H716 PolarHBondContact O-CE1 2.91Å; Q714-H716 PolarHBondContact O-ND1 3.17Å; Q714-H716 VanDerWaalsContact O-ND1 3.08Å; H716-T734 HydrophobicContact CB-CG2 3.63Å; H716-R735 CarbonylContact C-O 3.58Å; H716-R735 WeakPolarHBondContact CA-O 3.37Å; H716-E762 IonicContact CD2-OE1 3.48Å; H716-E762 PolarHBondContact CD2-OE1 3.16Å; H716-E762 IonicContact CE1-OE1 3.83Å; H716-E762 IonicContact CE1-OE2 3.77Å; H716-E762 IonicContact NE2-OE1 2.66Å; H716-E762 PolarHBondContact NE2-OE1 3.29Å; H716-E762 IonicContact NE2-OE2 2.89Å; H716-E762 PolarHBondContact NE2-OE2 3.42Å
717	M	89.6	Confident	84	Confident	9 Å²	9	50 Å²	50	4%	0.044	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	109.5	161	-66.1	178.9	-114.3	0	0	108.1	Q551 D637 L639 K719 F720 T734 R735 S740	Q551-M717 PolarHBondContact NE2-SD 3.33Å; D637-M717 CarbonylContact O-C 3.59Å; L639-M717 HydrophobicContact CD1-CG 4.04Å; L639-M717 HydrophobicContact CG-CG 4.41Å; M717-K719 VanDerWaalsContact C-N 3.27Å; M717-K719 PolarHBondContact O-N 3.1Å; M717-F720 HydrophobicContact SD-CD2 4.24Å; M717-T734 CarbonylContact O-C 3.43Å; M717-T734 WeakPolarHBondContact O-CA 3.45Å; M717-R735 PolarHBondContact N-O 3.38Å; M717-R735 PolarHBondContact O-N 3.19Å; M717-S740 WeakPolarHBondContact CE-OG 3.29Å
718	Q	86.5	Confident	83.1	Confident	88 Å²	88	49 Å²	49	41%	0.411	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.5	-24.8	-173.6	-57.7	-177.4	-7.4	0	0	113.2	K636 D637	K636-Q718 PolarHBondContact O-N 3.07Å; D637-Q718 PolarHBondContact O-N 3.22Å
719	K	82	Confident	82.5	Confident	100 Å²	100	48.3 Å²	48.3	44%	0.435	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	69.9	178	-70.2	-173.8	-169	147.9	0	111.9	D637 M717 F732	D637-K719 HydrophobicContact CB-CB 4.13Å; D637-K719 HydrophobicContact CB-CD 4.3Å; D637-K719 HydrophobicContact CB-CG 4.29Å; D637-K719 PolarHBondContact O-N 3.2Å; D637-K719 VanDerWaalsContact O-N 3.14Å; D637-K719 IonicContact OD1-NZ 3.74Å; D637-K719 WeakPolarHBondContact OD2-CD 3.37Å; D637-K719 VanDerWaalsContact OD2-CE 3.3Å; D637-K719 WeakPolarHBondContact OD2-CE 3.35Å; D637-K719 IonicContact OD2-NZ 3.57Å; D637-K719 PolarHBondContact OD2-NZ 3.47Å; M717-K719 VanDerWaalsContact C-N 3.27Å; M717-K719 PolarHBondContact O-N 3.1Å; K719-F732 HydrophobicContact CB-CB 4.38Å; K719-F732 HydrophobicContact CB-CD1 3.94Å; K719-F732 HydrophobicContact CB-CG 4.35Å; K719-F732 HydrophobicContact CG-CB 4.5Å
720	F	82.3	Confident	81.9	Confident	10 Å²	10	48 Å²	48	4%	0.044	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	122.1	169.8	-174.8	-99.7	0	0	0	110.9	M717 V722 F732 I733 R735	M717-F720 HydrophobicContact SD-CD2 4.24Å; F720-V722 HydrophobicContact CD1-CG2 4.28Å; F720-V722 PolarHBondContact O-N 2.75Å; F720-F732 CarbonylContact O-C 3.59Å; F720-F732 VanDerWaalsContact O-CA 3.28Å; F720-F732 WeakPolarHBondContact O-CA 3.4Å; F720-I733 HydrophobicContact CB-CG1 4.35Å; F720-I733 WeakPolarHBondContact CB-O 3.2Å; F720-I733 HydrophobicContact CD1-CG1 4.28Å; F720-I733 PolarHBondContact N-O 3Å; F720-I733 PolarHBondContact O-N 3.25Å; F720-R735 HydrophobicContact CB-CB 3.6Å; F720-R735 HydrophobicContact CD1-CB 4.31Å; F720-R735 HydrophobicContact CD2-CB 4.41Å; F720-R735 VanDerWaalsContact CD2-CD 3.49Å; F720-R735 HydrophobicContact CG-CB 3.87Å; F720-R735 VanDerWaalsContact CG-CD 3.5Å; F720-R735 HydrophobicContact CG-CG 4.34Å
721	L	79.8	Confident	81.4	Confident	6 Å²	6	45.4 Å²	45.4	3%	0.031	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	110.3	179.5	-179.6	54.1	0	0	0	110.8	Q543 Y577 A730 F732	Q543-L721 HydrophobicContact CB-CD2 3.62Å; Q543-L721 HydrophobicContact CB-CG 4.28Å; Q543-L721 HydrophobicContact CG-CD2 4.06Å; Y577-L721 HydrophobicContact CD2-CD2 4.05Å; Y577-L721 HydrophobicContact CE2-CD2 3.88Å; L721-A730 HydrophobicContact CD1-CB 3.58Å; L721-F732 HydrophobicContact CB-CD1 4.07Å; L721-F732 HydrophobicContact CB-CE1 3.84Å; L721-F732 HydrophobicContact CD1-CD1 4.29Å; L721-F732 HydrophobicContact CD1-CE1 3.95Å; L721-F732 HydrophobicContact CD1-CZ 4.16Å; L721-F732 HydrophobicContact CG-CE1 4.34Å
722	V	76.5	Confident	81	Confident	37 Å²	37	45.4 Å²	45.4	22%	0.224	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	-37.4	179.8	-176.7	0	0	0	0	111.7	F720 N731 I733 E766	F720-V722 HydrophobicContact CD1-CG2 4.28Å; F720-V722 PolarHBondContact O-N 2.75Å; V722-N731 PolarHBondContact N-O 3.08Å; V722-I733 HydrophobicContact CG2-CB 4.13Å; V722-I733 HydrophobicContact CG2-CD1 3.36Å; V722-I733 HydrophobicContact CG2-CG1 3.41Å; V722-I733 VanDerWaalsContact CG2-CG1 3.41Å; V722-I733 HydrophobicContact CG2-CG2 3.75Å; V722-E766 HydrophobicContact CB-CG 4.37Å; V722-E766 HydrophobicContact CG1-CG 3.56Å; V722-E766 HydrophobicContact CG2-CG 3.9Å
723	G	73	Confident	80.7	Confident	28 Å²	28	46.4 Å²	46.4	29%	0.289	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	164.9	-165.2	-174.3	0	0	0	0	0	111.3	A730 N731	G723-A730 WeakPolarHBondContact O-CA 3.36Å; G723-N731 PolarHBondContact O-N 2.96Å
724	I	73.4	Confident	80.7	Confident	51 Å²	51	50.1 Å²	50.1	26%	0.262	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	124.9	178.1	-65.4	161.3	0	0	0	107.3	F540 P573 A576 R729	F540-I724 HydrophobicContact CD1-CD1 4.2Å; F540-I724 HydrophobicContact CD2-CD1 3.57Å; F540-I724 HydrophobicContact CE1-CD1 4.41Å; F540-I724 HydrophobicContact CE2-CD1 3.82Å; F540-I724 HydrophobicContact CG-CD1 3.84Å; F540-I724 HydrophobicContact CZ-CD1 4.29Å; P573-I724 HydrophobicContact CB-CB 4.49Å; P573-I724 HydrophobicContact CB-CD1 3.89Å; P573-I724 HydrophobicContact CB-CG1 4.12Å; P573-I724 HydrophobicContact CB-CG2 3.55Å; P573-I724 HydrophobicContact CG-CD1 3.68Å; P573-I724 HydrophobicContact CG-CG1 4.45Å; P573-I724 HydrophobicContact CG-CG2 4.4Å; A576-I724 HydrophobicContact CB-CD1 4.11Å; A576-I724 HydrophobicContact CB-CG1 4.49Å; I724-R729 WeakPolarHBondContact CA-O 3.45Å
725	N	72.6	Confident	80.6	Confident	34 Å²	34	46.5 Å²	46.5	18%	0.182	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	167.3	175.7	62.3	33.4	0	0	0	111.7	N727 G728 R729 A1170	N725-N727 PolarHBondContact O-N 3.26Å; N725-N727 WeakPolarHBondContact OD1-CB 3.31Å; N725-N727 PolarHBondContact OD1-N 2.96Å; N725-G728 WeakPolarHBondContact O-CA 3.44Å; N725-G728 PolarHBondContact O-N 3.47Å; N725-G728 PolarHBondContact OD1-N 2.89Å; N725-R729 PolarHBondContact N-O 2.99Å; N725-R729 PolarHBondContact ND2-O 2.68Å; N725-R729 PolarHBondContact OD1-N 2.91Å; N725-R729 PolarHBondContact OD1-O 3.35Å; N725-A1170 WeakPolarHBondContact ND2-CB 3.35Å
726	N	72.1	Confident	80.6	Confident	117 Å²	117	45.8 Å²	45.8	63%	0.626	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.8	-20	-178.3	-61.6	3.3	0	0	0	114.2	G728 A1167	N726-G728 PolarHBondContact O-N 3.28Å; N726-A1167 WeakPolarHBondContact ND2-CA 3.36Å; N726-A1167 WeakPolarHBondContact ND2-CB 3.3Å
727	N	73.4	Confident	80.6	Confident	49 Å²	49	43.2 Å²	43.2	26%	0.262	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.5	6.3	176.5	-60.3	-6.6	0	0	0	112.4	N725	N725-N727 PolarHBondContact O-N 3.26Å; N725-N727 WeakPolarHBondContact OD1-CB 3.31Å; N725-N727 PolarHBondContact OD1-N 2.96Å
728	G	68.8	Low	80.8	Confident	11 Å²	11	43 Å²	43	11%	0.113	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	trans	56.9	53.6	-172.2	0	0	0	0	0	111.6	P573 K574 N725 N726	P573-G728 CarbonylContact C-O 3.54Å; P573-G728 WeakPolarHBondContact CA-O 3.29Å; K574-G728 PolarHBondContact N-O 3.4Å; N725-G728 WeakPolarHBondContact O-CA 3.44Å; N725-G728 PolarHBondContact O-N 3.47Å; N725-G728 PolarHBondContact OD1-N 2.89Å; N726-G728 PolarHBondContact O-N 3.28Å
729	R	74.5	Confident	81.1	Confident	99 Å²	99	38.9 Å²	38.9	37%	0.374	21%	0.207	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	137.5	166.4	-59.7	-177.4	177.3	160.9	2	108.8	K574 I724 N725 N731 A1170	K574-R729 HydrophobicContact CB-CG 4.33Å; I724-R729 WeakPolarHBondContact CA-O 3.45Å; N725-R729 PolarHBondContact N-O 2.99Å; N725-R729 PolarHBondContact ND2-O 2.68Å; N725-R729 PolarHBondContact OD1-N 2.91Å; N725-R729 PolarHBondContact OD1-O 3.35Å; R729-N731 PolarHBondContact O-N 3.06Å; R729-A1170 PolarHBondContact NH1-O 3.45Å; R729-A1170 VanDerWaalsContact NH1-O 3.14Å
730	A	74.8	Confident	81.6	Confident	13 Å²	13	34.1 Å²	34.1	11%	0.107	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-55.2	124.8	168.2	0	0	0	0	0	109.4	K574 L721 G723 F732	K574-A730 VanDerWaalsContact O-CB 3.3Å; K574-A730 WeakPolarHBondContact O-CB 3.47Å; K574-A730 PolarHBondContact O-N 3.48Å; L721-A730 HydrophobicContact CD1-CB 3.58Å; G723-A730 WeakPolarHBondContact O-CA 3.36Å; A730-F732 HydrophobicContact CB-CD2 4.25Å; A730-F732 HydrophobicContact CB-CE2 3.48Å; A730-F732 VanDerWaalsContact CB-CE2 3.48Å; A730-F732 HydrophobicContact CB-CZ 3.74Å
731	N	79.4	Confident	82.1	Confident	74 Å²	74	33.7 Å²	33.7	40%	0.396	18%	0.184	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	115.4	176.1	-168.8	25.4	0	0	0	108.6	V722 G723 R729	V722-N731 PolarHBondContact N-O 3.08Å; G723-N731 PolarHBondContact O-N 2.96Å; R729-N731 PolarHBondContact O-N 3.06Å
732	F	82.1	Confident	82.7	Confident	72 Å²	72	33.5 Å²	33.5	32%	0.316	18%	0.183	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	134.3	178.6	-62.7	-82	0	0	0	109.6	K719 F720 L721 A730	K719-F732 HydrophobicContact CB-CB 4.38Å; K719-F732 HydrophobicContact CB-CD1 3.94Å; K719-F732 HydrophobicContact CB-CG 4.35Å; K719-F732 HydrophobicContact CG-CB 4.5Å; F720-F732 CarbonylContact O-C 3.59Å; F720-F732 VanDerWaalsContact O-CA 3.28Å; F720-F732 WeakPolarHBondContact O-CA 3.4Å; L721-F732 HydrophobicContact CB-CD1 4.07Å; L721-F732 HydrophobicContact CB-CE1 3.84Å; L721-F732 HydrophobicContact CD1-CD1 4.29Å; L721-F732 HydrophobicContact CD1-CE1 3.95Å; L721-F732 HydrophobicContact CD1-CZ 4.16Å; L721-F732 HydrophobicContact CG-CE1 4.34Å; A730-F732 HydrophobicContact CB-CD2 4.25Å; A730-F732 HydrophobicContact CB-CE2 3.48Å; A730-F732 VanDerWaalsContact CB-CE2 3.48Å; A730-F732 HydrophobicContact CB-CZ 3.74Å
733	I	85.6	Confident	83.4	Confident	25 Å²	25	32.2 Å²	32.2	13%	0.128	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	155.6	173.4	67.9	177.5	0	0	0	110	F720 V722 R735 Y764 E766	F720-I733 HydrophobicContact CB-CG1 4.35Å; F720-I733 WeakPolarHBondContact CB-O 3.2Å; F720-I733 HydrophobicContact CD1-CG1 4.28Å; F720-I733 PolarHBondContact N-O 3Å; F720-I733 PolarHBondContact O-N 3.25Å; V722-I733 HydrophobicContact CG2-CB 4.13Å; V722-I733 HydrophobicContact CG2-CD1 3.36Å; V722-I733 HydrophobicContact CG2-CG1 3.41Å; V722-I733 VanDerWaalsContact CG2-CG1 3.41Å; V722-I733 HydrophobicContact CG2-CG2 3.75Å; I733-R735 PolarHBondContact O-N 2.95Å; I733-Y764 HydrophobicContact CD1-CE2 3.67Å; I733-Y764 VanDerWaalsContact CD1-OH 3.29Å; I733-Y764 WeakPolarHBondContact CD1-OH 3.48Å; I733-Y764 HydrophobicContact CG1-CE2 4.42Å; I733-E766 HydrophobicContact CD1-CB 3.48Å; I733-E766 VanDerWaalsContact CD1-CB 3.48Å; I733-E766 HydrophobicContact CD1-CG 3.64Å
734	T	89.6	Confident	84.2	Confident	80 Å²	80	31.2 Å²	31.2	49%	0.491	16%	0.162	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	120.6	166.4	-55.7	0	0	0	0	108.6	H716 M717 Y764	H716-T734 HydrophobicContact CB-CG2 3.63Å; M717-T734 CarbonylContact O-C 3.43Å; M717-T734 WeakPolarHBondContact O-CA 3.45Å; T734-Y764 WeakPolarHBondContact O-CE2 3.5Å
735	R	90.6	Very high	85	Confident	0 Å²	0	29 Å²	29	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	119.8	-179.5	179.1	176.7	-175.6	103.9	-8.3	110.9	H716 M717 F720 I733 V739 S740 E743 Y764 E766	H716-R735 CarbonylContact C-O 3.58Å; H716-R735 WeakPolarHBondContact CA-O 3.37Å; M717-R735 PolarHBondContact N-O 3.38Å; M717-R735 PolarHBondContact O-N 3.19Å; F720-R735 HydrophobicContact CB-CB 3.6Å; F720-R735 HydrophobicContact CD1-CB 4.31Å; F720-R735 HydrophobicContact CD2-CB 4.41Å; F720-R735 VanDerWaalsContact CD2-CD 3.49Å; F720-R735 HydrophobicContact CG-CB 3.87Å; F720-R735 VanDerWaalsContact CG-CD 3.5Å; F720-R735 HydrophobicContact CG-CG 4.34Å; I733-R735 PolarHBondContact O-N 2.95Å; R735-V739 HydrophobicContact CG-CB 4.17Å; R735-V739 PolarHBondContact NH2-O 3.45Å; R735-S740 PolarHBondContact NE-OG 2.94Å; R735-E743 IonicContact CZ-OE1 3.31Å; R735-E743 IonicContact NH1-OE1 3.8Å; R735-E743 IonicContact NH2-OE1 3.92Å; R735-E743 PolarHBondContact NH2-OE1 2.8Å; R735-E743 IonicContact NH2-OE2 2.91Å; R735-Y764 HydrophobicContact CB-CE2 4.16Å; R735-Y764 HydrophobicContact CG-CE2 4.26Å; R735-Y764 WeakPolarHBondContact CG-OH 3.38Å; R735-Y764 PolarHBondContact NH1-OH 3.44Å; R735-E766 IonicContact CZ-OE2 3.06Å; R735-E766 IonicContact NH1-OE2 3.67Å; R735-E766 PolarHBondContact NH1-OE2 3Å
736	P	93.9	Very high	85.9	Confident	5 Å²	5	28.7 Å²	28.7	3%	0.032	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-60.3	138.1	170.4	-20.1	31	0	0	0	110.9	L738 V739 Y764 V773	P736-L738 PolarHBondContact O-N 3.37Å; P736-L738 VanDerWaalsContact O-N 3.16Å; P736-V739 HydrophobicContact CB-CG2 4.14Å; P736-V739 HydrophobicContact CG-CG2 4.23Å; P736-V739 WeakPolarHBondContact O-CB 3.45Å; P736-V739 PolarHBondContact O-N 3.03Å; P736-V739 VanDerWaalsContact O-N 3.09Å; P736-Y764 HydrophobicContact CG-CD2 4.37Å; P736-V773 HydrophobicContact CB-CG2 4.41Å; P736-V773 HydrophobicContact CG-CG2 3.85Å
737	L	92.7	Very high	86.9	Confident	0 Å²	0	23.4 Å²	23.4	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-54.9	-35.6	178.3	176	63.1	0	0	0	111.5	F688 V689 L715 V739 S740 V741 M753	F688-L737 HydrophobicContact CD1-CD2 3.96Å; F688-L737 HydrophobicContact CE1-CD2 3.87Å; V689-L737 HydrophobicContact CB-CD1 4.38Å; V689-L737 HydrophobicContact CB-CD2 4.49Å; V689-L737 HydrophobicContact CG1-CD1 3.89Å; V689-L737 HydrophobicContact CG2-CD1 4.2Å; V689-L737 HydrophobicContact CG2-CD2 3.85Å; L715-L737 HydrophobicContact CB-CB 4.26Å; L715-L737 HydrophobicContact CB-CD2 4.29Å; L715-L737 HydrophobicContact CD1-CD2 4.43Å; L715-L737 WeakPolarHBondContact O-CB 3.32Å; L715-L737 PolarHBondContact O-N 3.45Å; L737-V739 PolarHBondContact O-N 3.27Å; L737-S740 WeakPolarHBondContact O-CA 3.34Å; L737-S740 WeakPolarHBondContact O-CB 3.28Å; L737-S740 PolarHBondContact O-N 2.68Å; L737-V741 HydrophobicContact CG-CG2 4.37Å; L737-V741 PolarHBondContact O-N 3Å; L737-M753 HydrophobicContact CB-CE 3.99Å; L737-M753 HydrophobicContact CD2-CE 3.95Å; L737-M753 HydrophobicContact CG-CE 3.92Å
738	L	94	Very high	87.8	Confident	5 Å²	5	26.5 Å²	26.5	3%	0.026	14%	0.136	C	C	.	.	H	α-helix	trans	-53.3	-37.4	178.9	-167.1	68.4	0	0	0	112.7	P736 S740 V741 M742 L750 M753 A758 L760 V773	P736-L738 PolarHBondContact O-N 3.37Å; P736-L738 VanDerWaalsContact O-N 3.16Å; L738-S740 VanDerWaalsContact C-N 3.26Å; L738-S740 PolarHBondContact O-N 3.34Å; L738-V741 PolarHBondContact O-N 2.71Å; L738-M742 HydrophobicContact CD2-CE 3.92Å; L738-M742 HydrophobicContact CG-CE 3.94Å; L738-M742 WeakPolarHBondContact O-CG 3.41Å; L738-M742 PolarHBondContact O-N 2.95Å; L738-L750 HydrophobicContact CD1-CD1 3.47Å; L738-L750 VanDerWaalsContact CD1-CD1 3.47Å; L738-L750 HydrophobicContact CG-CD1 4.21Å; L738-M753 HydrophobicContact CB-CE 3.98Å; L738-M753 HydrophobicContact CD1-CB 4.36Å; L738-M753 HydrophobicContact CD1-CE 4Å; L738-M753 HydrophobicContact CD1-CG 3.94Å; L738-M753 HydrophobicContact CD1-SD 3.63Å; L738-A758 HydrophobicContact CD1-CB 3.91Å; L738-A758 HydrophobicContact CD2-CB 3.97Å; L738-A758 HydrophobicContact CG-CB 4.48Å; L738-L760 HydrophobicContact CD2-CD2 3.67Å; L738-V773 HydrophobicContact CD2-CG1 3.94Å; L738-V773 HydrophobicContact CG-CG1 4.49Å
739	V	92.7	Very high	89	Confident	0 Å²	0	26 Å²	26	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-64.2	-33.8	177.5	-168.9	0	0	0	0	111.2	R735 P736 L737 E743 Y764 V773 W776	R735-V739 HydrophobicContact CG-CB 4.17Å; R735-V739 PolarHBondContact NH2-O 3.45Å; P736-V739 HydrophobicContact CB-CG2 4.14Å; P736-V739 HydrophobicContact CG-CG2 4.23Å; P736-V739 WeakPolarHBondContact O-CB 3.45Å; P736-V739 PolarHBondContact O-N 3.03Å; P736-V739 VanDerWaalsContact O-N 3.09Å; L737-V739 PolarHBondContact O-N 3.27Å; V739-E743 WeakPolarHBondContact O-CG 3.32Å; V739-E743 PolarHBondContact O-N 3.26Å; V739-Y764 HydrophobicContact CB-CE1 4.47Å; V739-Y764 HydrophobicContact CG1-CD1 4.47Å; V739-Y764 HydrophobicContact CG1-CE1 3.81Å; V739-Y764 HydrophobicContact CG2-CD1 4.04Å; V739-Y764 HydrophobicContact CG2-CE1 3.96Å; V739-Y764 HydrophobicContact CG2-CG 4.47Å; V739-V773 HydrophobicContact CG2-CG1 4Å; V739-V773 HydrophobicContact CG2-CG2 4.31Å; V739-W776 VanDerWaalsContact CG1-CD1 3.46Å; V739-W776 HydrophobicContact CG1-CD2 3.77Å; V739-W776 HydrophobicContact CG1-CG 3.72Å; V739-W776 HydrophobicContact CG1-CZ2 4.22Å; V739-W776 VanDerWaalsContact CG1-NE1 3.31Å
740	S	91	Very high	90	Very high	1 Å²	1	21.2 Å²	21.2	1%	0.007	11%	0.113	C	C	.	.	H	α-helix	trans	-77.3	-33.7	176.8	-50.7	0	0	0	0	111.8	M717 R735 L737 L738 E743 Y744	M717-S740 WeakPolarHBondContact CE-OG 3.29Å; R735-S740 PolarHBondContact NE-OG 2.94Å; L737-S740 WeakPolarHBondContact O-CA 3.34Å; L737-S740 WeakPolarHBondContact O-CB 3.28Å; L737-S740 PolarHBondContact O-N 2.68Å; L738-S740 VanDerWaalsContact C-N 3.26Å; L738-S740 PolarHBondContact O-N 3.34Å; S740-E743 PolarHBondContact O-N 3.37Å; S740-Y744 WeakPolarHBondContact O-CD2 3.42Å; S740-Y744 PolarHBondContact O-N 2.67Å
741	V	93.6	Very high	91	Very high	0 Å²	0	24.1 Å²	24.1	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-64.4	-43.7	172.9	174.2	0	0	0	0	110.9	L737 L738 E743 S745 V749 L750 M753	L737-V741 HydrophobicContact CG-CG2 4.37Å; L737-V741 PolarHBondContact O-N 3Å; L738-V741 PolarHBondContact O-N 2.71Å; V741-E743 PolarHBondContact O-N 2.69Å; V741-S745 VanDerWaalsContact O-CB 3.22Å; V741-S745 WeakPolarHBondContact O-CB 3.34Å; V741-S745 PolarHBondContact O-N 2.96Å; V741-V749 HydrophobicContact CG1-CG1 3.85Å; V741-L750 HydrophobicContact CG1-CB 4.17Å; V741-L750 HydrophobicContact CG1-CD1 4.21Å; V741-M753 HydrophobicContact CB-SD 4.24Å; V741-M753 HydrophobicContact CG1-SD 4.43Å; V741-M753 HydrophobicContact CG2-SD 3.72Å
742	M	93	Very high	91.7	Very high	2 Å²	2	21.8 Å²	21.8	1%	0.01	11%	0.112	C	C	.	.	H	α-helix	trans	-60.8	-30.8	173.8	-69	178	-176.9	0	0	113.3	L738 L750 L760 V773 W776 V790	L738-M742 HydrophobicContact CD2-CE 3.92Å; L738-M742 HydrophobicContact CG-CE 3.94Å; L738-M742 WeakPolarHBondContact O-CG 3.41Å; L738-M742 PolarHBondContact O-N 2.95Å; M742-L750 HydrophobicContact CE-CD1 4.32Å; M742-L750 HydrophobicContact CG-CD1 3.89Å; M742-L750 HydrophobicContact CG-CD2 4.03Å; M742-L760 HydrophobicContact CE-CD2 4.25Å; M742-V773 HydrophobicContact CE-CG1 4.04Å; M742-W776 HydrophobicContact SD-CB 4.34Å; M742-V790 HydrophobicContact CE-CG2 3.56Å
743	E	90.4	Very high	92.2	Very high	10 Å²	10	18.4 Å²	18.4	5%	0.047	10%	0.097	C	C	.	.	H	α-helix	trans	-85.2	-37.6	-179.3	-77.1	-166.8	-146.3	0	0	113.6	R394 R544 R735 V739 S740 V741 W776 F781	R394-E743 WeakPolarHBondContact CB-O 3.35Å; R394-E743 WeakPolarHBondContact CD-O 3.06Å; R394-E743 IonicContact CZ-OE2 3.61Å; R394-E743 IonicContact NE-OE2 3.38Å; R394-E743 PolarHBondContact NE-OE2 3.12Å; R394-E743 IonicContact NH2-OE2 3.51Å; R394-E743 PolarHBondContact NH2-OE2 3.19Å; R544-E743 IonicContact NH1-OE2 2.85Å; R544-E743 PolarHBondContact NH1-OE2 3.47Å; R735-E743 IonicContact CZ-OE1 3.31Å; R735-E743 IonicContact NH1-OE1 3.8Å; R735-E743 IonicContact NH2-OE1 3.92Å; R735-E743 PolarHBondContact NH2-OE1 2.8Å; R735-E743 IonicContact NH2-OE2 2.91Å; V739-E743 WeakPolarHBondContact O-CG 3.32Å; V739-E743 PolarHBondContact O-N 3.26Å; S740-E743 PolarHBondContact O-N 3.37Å; V741-E743 PolarHBondContact O-N 2.69Å; E743-W776 WeakPolarHBondContact OE1-CZ2 3.15Å; E743-W776 PolarHBondContact OE1-NE1 3.26Å; E743-F781 HydrophobicContact CG-CD2 4.21Å; E743-F781 HydrophobicContact CG-CE2 3.7Å
744	Y	89.5	Confident	92.6	Very high	7 Å²	7	18 Å²	18	3%	0.027	10%	0.095	C	C	.	.	H	α-helix	trans	-112.1	-29.1	-167.4	-49.9	-43.2	0	0	0	114	R394 I397 R398 M693 S740	R394-Y744 HydrophobicContact CB-CD1 3.98Å; R394-Y744 HydrophobicContact CB-CE1 4.48Å; R394-Y744 HydrophobicContact CG-CD1 3.87Å; R394-Y744 HydrophobicContact CG-CE1 3.91Å; I397-Y744 HydrophobicContact CB-CD1 4.16Å; I397-Y744 HydrophobicContact CB-CE1 4.49Å; I397-Y744 HydrophobicContact CB-CG 4.43Å; I397-Y744 HydrophobicContact CD1-CD1 3.97Å; I397-Y744 HydrophobicContact CD1-CE1 3.5Å; I397-Y744 VanDerWaalsContact CD1-CE1 3.5Å; I397-Y744 HydrophobicContact CG2-CD1 4.02Å; I397-Y744 HydrophobicContact CG2-CD2 4Å; I397-Y744 HydrophobicContact CG2-CE1 4.31Å; I397-Y744 HydrophobicContact CG2-CE2 4.28Å; I397-Y744 HydrophobicContact CG2-CG 3.88Å; R398-Y744 WeakPolarHBondContact CB-O 3.5Å; R398-Y744 WeakPolarHBondContact CD-O 3.42Å; M693-Y744 HydrophobicContact CE-CD2 4.1Å; M693-Y744 HydrophobicContact CE-CE2 4.27Å; S740-Y744 WeakPolarHBondContact O-CD2 3.42Å; S740-Y744 PolarHBondContact O-N 2.67Å
745	S	90.5	Very high	92.7	Very high	6 Å²	6	20.3 Å²	20.3	4%	0.042	10%	0.1	C	C	.	.	S	Bend	trans	-93	-163.9	-164	-154.6	0	0	0	0	113.7	S692 G695 V741 V749 H786	S692-S745 VanDerWaalsContact O-CB 3.25Å; S692-S745 WeakPolarHBondContact O-CB 3.37Å; S692-S745 PolarHBondContact O-OG 3.23Å; G695-S745 WeakPolarHBondContact CA-OG 3.26Å; V741-S745 VanDerWaalsContact O-CB 3.22Å; V741-S745 WeakPolarHBondContact O-CB 3.34Å; V741-S745 PolarHBondContact O-N 2.96Å; S745-V749 WeakPolarHBondContact OG-CG1 3.35Å; S745-H786 PolarHBondContact O-NE2 2.82Å
746	T	91.9	Very high	92.7	Very high	26 Å²	26	21.5 Å²	21.5	16%	0.16	11%	0.108	C	C	.	.			trans	-99	156.9	172.7	64.4	0	0	0	0	111.4	R398 E748 V749 L750	R398-T746 VanDerWaalsContact NH1-CG2 3.33Å; T746-E748 PolarHBondContact O-N 3.22Å; T746-V749 PolarHBondContact O-N 3.36Å; T746-V749 PolarHBondContact OG1-N 3.25Å; T746-L750 PolarHBondContact O-N 3.31Å; T746-L750 VanDerWaalsContact O-N 3.16Å
747	A	92.3	Very high	92.6	Very high	7 Å²	7	22.7 Å²	22.7	6%	0.058	12%	0.121	C	C	.	.	H	α-helix	trans	-60.6	-33.3	177.8	0	0	0	0	0	112.3	L750 Q751 Q785 H786 E789	A747-L750 WeakPolarHBondContact O-CB 3.29Å; A747-L750 PolarHBondContact O-N 3.28Å; A747-Q751 WeakPolarHBondContact O-CB 3.03Å; A747-Q751 PolarHBondContact O-N 2.91Å; A747-Q785 HydrophobicContact CB-CB 4.44Å; A747-Q785 HydrophobicContact CB-CG 3.7Å; A747-H786 PolarHBondContact N-NE2 3.16Å; A747-E789 HydrophobicContact CB-CG 4.21Å
748	E	93.2	Very high	92.6	Very high	113 Å²	113	23.2 Å²	23.2	53%	0.528	13%	0.126	S	C	.	.	H	α-helix	trans	-65.9	-39.4	177.9	-58	155	141.4	0	0	112.4	I697 T746 L752	I697-E748 HydrophobicContact CD1-CB 3.48Å; I697-E748 VanDerWaalsContact CD1-CB 3.48Å; I697-E748 HydrophobicContact CD1-CG 4.21Å; I697-E748 WeakPolarHBondContact CD1-OE2 3.28Å; I697-E748 HydrophobicContact CG1-CB 4.36Å; T746-E748 PolarHBondContact O-N 3.22Å; E748-L752 WeakPolarHBondContact O-CB 3.07Å; E748-L752 PolarHBondContact O-N 2.92Å
749	V	94.4	Very high	92.5	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-66.5	-41.6	173.8	166.3	0	0	0	0	110.5	I697 L700 V741 S745 T746 L752 M753	I697-V749 HydrophobicContact CD1-CG2 4.4Å; I697-V749 HydrophobicContact CG1-CG2 3.44Å; I697-V749 VanDerWaalsContact CG1-CG2 3.44Å; L700-V749 HydrophobicContact CD2-CB 4.33Å; L700-V749 HydrophobicContact CD2-CG1 3.6Å; L700-V749 HydrophobicContact CD2-CG2 4.17Å; V741-V749 HydrophobicContact CG1-CG1 3.85Å; S745-V749 WeakPolarHBondContact OG-CG1 3.35Å; T746-V749 PolarHBondContact O-N 3.36Å; T746-V749 PolarHBondContact OG1-N 3.25Å; V749-L752 PolarHBondContact O-N 2.95Å; V749-M753 WeakPolarHBondContact O-CB 3.41Å; V749-M753 PolarHBondContact O-N 2.94Å
750	L	95.3	Very high	92.5	Very high	0 Å²	0	26.7 Å²	26.7	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-60.5	-47.3	176.5	179.6	61.6	0	0	0	111.1	L738 V741 M742 T746 A747 L752 M753 I754 H786 V790	L738-L750 HydrophobicContact CD1-CD1 3.47Å; L738-L750 VanDerWaalsContact CD1-CD1 3.47Å; L738-L750 HydrophobicContact CG-CD1 4.21Å; V741-L750 HydrophobicContact CG1-CB 4.17Å; V741-L750 HydrophobicContact CG1-CD1 4.21Å; M742-L750 HydrophobicContact CE-CD1 4.32Å; M742-L750 HydrophobicContact CG-CD1 3.89Å; M742-L750 HydrophobicContact CG-CD2 4.03Å; T746-L750 PolarHBondContact O-N 3.31Å; T746-L750 VanDerWaalsContact O-N 3.16Å; A747-L750 WeakPolarHBondContact O-CB 3.29Å; A747-L750 PolarHBondContact O-N 3.28Å; L750-L752 PolarHBondContact O-N 3.38Å; L750-M753 PolarHBondContact O-N 2.81Å; L750-I754 HydrophobicContact CD1-CD1 4.2Å; L750-I754 HydrophobicContact CD1-CG1 4.42Å; L750-I754 HydrophobicContact CG-CD1 4.01Å; L750-I754 WeakPolarHBondContact O-CG1 3.45Å; L750-I754 PolarHBondContact O-N 3.42Å; L750-H786 HydrophobicContact CD2-CB 3.78Å; L750-V790 HydrophobicContact CD2-CG2 3.97Å
751	Q	94.6	Very high	92.6	Very high	73 Å²	73	29.4 Å²	29.4	34%	0.341	16%	0.164	S	C	.	.	H	α-helix	trans	-56.5	-48.6	176	-173.3	-173.9	35.5	0	0	111.5	A747 M753 I754 Q755 E789	A747-Q751 WeakPolarHBondContact O-CB 3.03Å; A747-Q751 PolarHBondContact O-N 2.91Å; Q751-M753 VanDerWaalsContact C-N 3.3Å; Q751-M753 PolarHBondContact O-N 3.05Å; Q751-I754 PolarHBondContact O-N 3.12Å; Q751-Q755 WeakPolarHBondContact O-CG 3.5Å; Q751-Q755 PolarHBondContact O-N 2.77Å; Q751-E789 HydrophobicContact CB-CG 4.45Å; Q751-E789 WeakPolarHBondContact CG-OE2 3.43Å; Q751-E789 PolarHBondContact NE2-OE2 3.18Å
752	L	93.9	Very high	92.6	Very high	26 Å²	26	31.8 Å²	31.8	14%	0.136	18%	0.175	C	C	.	.	H	α-helix	trans	-62.3	-37.7	178.4	-176.6	63.6	0	0	0	112.3	I697 L700 K701 L704 E748 V749 L750 S756	I697-L752 HydrophobicContact CG2-CD2 4.48Å; L700-L752 HydrophobicContact CD2-CD2 4.02Å; L700-L752 HydrophobicContact CG-CD2 4.22Å; K701-L752 HydrophobicContact CG-CD2 3.74Å; L704-L752 HydrophobicContact CD1-CD1 4.02Å; L704-L752 HydrophobicContact CD1-CD2 3.83Å; L704-L752 HydrophobicContact CD1-CG 3.72Å; E748-L752 WeakPolarHBondContact O-CB 3.07Å; E748-L752 PolarHBondContact O-N 2.92Å; V749-L752 PolarHBondContact O-N 2.95Å; L750-L752 PolarHBondContact O-N 3.38Å; L752-S756 WeakPolarHBondContact O-CB 3.3Å; L752-S756 PolarHBondContact O-N 2.79Å; L752-S756 PolarHBondContact O-OG 3.28Å
753	M	93.6	Very high	92.4	Very high	1 Å²	1	34.5 Å²	34.5	1%	0.005	19%	0.185	C	C	.	.	H	α-helix	trans	-69.2	-39	178	-170.2	172.7	173.3	0	0	111.9	A713 L737 L738 V741 V749 L750 Q751 S756 G757 A758	A713-M753 HydrophobicContact CB-CG 4.2Å; A713-M753 WeakPolarHBondContact O-CE 3.48Å; L737-M753 HydrophobicContact CB-CE 3.99Å; L737-M753 HydrophobicContact CD2-CE 3.95Å; L737-M753 HydrophobicContact CG-CE 3.92Å; L738-M753 HydrophobicContact CB-CE 3.98Å; L738-M753 HydrophobicContact CD1-CB 4.36Å; L738-M753 HydrophobicContact CD1-CE 4Å; L738-M753 HydrophobicContact CD1-CG 3.94Å; L738-M753 HydrophobicContact CD1-SD 3.63Å; V741-M753 HydrophobicContact CB-SD 4.24Å; V741-M753 HydrophobicContact CG1-SD 4.43Å; V741-M753 HydrophobicContact CG2-SD 3.72Å; V749-M753 WeakPolarHBondContact O-CB 3.41Å; V749-M753 PolarHBondContact O-N 2.94Å; L750-M753 PolarHBondContact O-N 2.81Å; Q751-M753 VanDerWaalsContact C-N 3.3Å; Q751-M753 PolarHBondContact O-N 3.05Å; M753-S756 PolarHBondContact O-N 3.28Å; M753-G757 PolarHBondContact O-N 3.38Å; M753-A758 HydrophobicContact CG-CB 4.15Å; M753-A758 WeakPolarHBondContact O-CB 3.34Å; M753-A758 PolarHBondContact O-N 3Å
754	I	93.5	Very high	92.4	Very high	17 Å²	17	34.7 Å²	34.7	9%	0.087	19%	0.186	C	C	.	.	H	α-helix	trans	-62.3	-50	173.2	-66.6	166.7	0	0	0	110.2	L750 Q751 S756 G757 L760 V790 E793	L750-I754 HydrophobicContact CD1-CD1 4.2Å; L750-I754 HydrophobicContact CD1-CG1 4.42Å; L750-I754 HydrophobicContact CG-CD1 4.01Å; L750-I754 WeakPolarHBondContact O-CG1 3.45Å; L750-I754 PolarHBondContact O-N 3.42Å; Q751-I754 PolarHBondContact O-N 3.12Å; I754-S756 PolarHBondContact O-N 3.36Å; I754-S756 VanDerWaalsContact O-N 3.15Å; I754-G757 PolarHBondContact O-N 2.87Å; I754-L760 HydrophobicContact CD1-CD1 4.4Å; I754-L760 HydrophobicContact CD1-CD2 4.34Å; I754-L760 HydrophobicContact CG1-CD1 4.48Å; I754-L760 HydrophobicContact CG1-CD2 4.29Å; I754-L760 HydrophobicContact CG2-CD1 4.17Å; I754-V790 HydrophobicContact CD1-CG2 4.24Å; I754-E793 HydrophobicContact CG2-CB 3.71Å; I754-E793 HydrophobicContact CG2-CG 3.75Å
755	Q	92	Very high	92.1	Very high	127 Å²	127	36.9 Å²	36.9	59%	0.593	20%	0.202	S	C	*	.	H	α-helix	trans	-58.7	-27.6	175.4	-71.1	173	-5.2	0	0	112.9	Q751 G757	Q751-Q755 WeakPolarHBondContact O-CG 3.5Å; Q751-Q755 PolarHBondContact O-N 2.77Å; Q755-G757 VanDerWaalsContact C-N 3.26Å; Q755-G757 PolarHBondContact O-N 3.24Å
756	S	91.3	Very high	91.7	Very high	25 Å²	25	37.5 Å²	37.5	18%	0.175	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.7	1.2	176.8	-59.1	0	0	0	0	114.1	L704 G709 Q710 L752 M753 I754	L704-S756 VanDerWaalsContact CD1-OG 3.29Å; L704-S756 WeakPolarHBondContact CD1-OG 3.03Å; G709-S756 CarbonylContact C-O 3.56Å; Q710-S756 VanDerWaalsContact CA-O 3.31Å; Q710-S756 WeakPolarHBondContact CA-O 3.28Å; Q710-S756 PolarHBondContact N-O 2.94Å; L752-S756 WeakPolarHBondContact O-CB 3.3Å; L752-S756 PolarHBondContact O-N 2.79Å; L752-S756 PolarHBondContact O-OG 3.28Å; M753-S756 PolarHBondContact O-N 3.28Å; I754-S756 PolarHBondContact O-N 3.36Å; I754-S756 VanDerWaalsContact O-N 3.15Å
757	G	91.1	Very high	91	Very high	30 Å²	30	42.1 Å²	42.1	31%	0.309	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	102.3	26.6	174.5	0	0	0	0	0	115.4	Q714 M753 I754 Q755	Q714-G757 WeakPolarHBondContact CG-O 3.3Å; Q714-G757 PolarHBondContact NE2-O 2.7Å; M753-G757 PolarHBondContact O-N 3.38Å; I754-G757 PolarHBondContact O-N 2.87Å; Q755-G757 VanDerWaalsContact C-N 3.26Å; Q755-G757 PolarHBondContact O-N 3.24Å
758	A	92.6	Very high	89.8	Confident	12 Å²	12	45.8 Å²	45.8	10%	0.099	24%	0.238	C	C	.	.			trans	-66.1	134.6	174.2	0	0	0	0	0	111.7	A713 L738 M753 L760	A713-A758 HydrophobicContact CB-CB 4.22Å; L738-A758 HydrophobicContact CD1-CB 3.91Å; L738-A758 HydrophobicContact CD2-CB 3.97Å; L738-A758 HydrophobicContact CG-CB 4.48Å; M753-A758 HydrophobicContact CG-CB 4.15Å; M753-A758 WeakPolarHBondContact O-CB 3.34Å; M753-A758 PolarHBondContact O-N 3Å; A758-L760 PolarHBondContact O-N 3.3Å
759	N	92.6	Very high	89	Confident	66 Å²	66	42.3 Å²	42.3	35%	0.353	23%	0.225	S	C	.	.			trans	-86.8	99.8	-176.4	-174	-4.3	0	0	0	111.7	S761 E762	N759-S761 VanDerWaalsContact C-N 3.29Å; N759-S761 PolarHBondContact O-N 3.49Å; N759-S761 PolarHBondContact OD1-N 3.09Å; N759-S761 PolarHBondContact OD1-OG 3.46Å; N759-E762 HydrophobicContact CB-CB 4.28Å; N759-E762 PolarHBondContact O-N 3.1Å; N759-E762 PolarHBondContact OD1-N 3.13Å
760	L	93.3	Very high	88.4	Confident	11 Å²	11	44.8 Å²	44.8	6%	0.058	24%	0.236	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.6	-22.4	178	-65.6	173.2	0	0	0	113.8	L738 M742 I754 A758 V773 A774 V790 E793 V794	L738-L760 HydrophobicContact CD2-CD2 3.67Å; M742-L760 HydrophobicContact CE-CD2 4.25Å; I754-L760 HydrophobicContact CD1-CD1 4.4Å; I754-L760 HydrophobicContact CD1-CD2 4.34Å; I754-L760 HydrophobicContact CG1-CD1 4.48Å; I754-L760 HydrophobicContact CG1-CD2 4.29Å; I754-L760 HydrophobicContact CG2-CD1 4.17Å; A758-L760 PolarHBondContact O-N 3.3Å; L760-V773 PolarHBondContact O-N 3.19Å; L760-A774 HydrophobicContact CB-CB 4.43Å; L760-A774 PolarHBondContact O-N 3.05Å; L760-A774 VanDerWaalsContact O-N 3.12Å; L760-V790 HydrophobicContact CD1-CG1 4.38Å; L760-V790 HydrophobicContact CD2-CG1 4.06Å; L760-V790 HydrophobicContact CD2-CG2 4.37Å; L760-E793 HydrophobicContact CD1-CB 4.2Å; L760-V794 HydrophobicContact CB-CG2 4.16Å; L760-V794 HydrophobicContact CD1-CB 3.98Å
761	S	92.5	Very high	88	Confident	58 Å²	58	45 Å²	45	41%	0.406	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.8	-1.2	179.3	60.5	0	0	0	0	114.4	N759 Y763	N759-S761 VanDerWaalsContact C-N 3.29Å; N759-S761 PolarHBondContact O-N 3.49Å; N759-S761 PolarHBondContact OD1-N 3.09Å; N759-S761 PolarHBondContact OD1-OG 3.46Å; S761-Y763 PolarHBondContact O-N 2.96Å
762	E	92.4	Very high	88	Confident	50 Å²	50	42.1 Å²	42.1	23%	0.234	23%	0.226	C	C	.	.			trans	-62.9	130	179.2	-171.6	-175.9	159.9	0	0	110.9	H716 N759 Y764 P772 V773	H716-E762 IonicContact CD2-OE1 3.48Å; H716-E762 PolarHBondContact CD2-OE1 3.16Å; H716-E762 IonicContact CE1-OE1 3.83Å; H716-E762 IonicContact CE1-OE2 3.77Å; H716-E762 IonicContact NE2-OE1 2.66Å; H716-E762 PolarHBondContact NE2-OE1 3.29Å; H716-E762 IonicContact NE2-OE2 2.89Å; H716-E762 PolarHBondContact NE2-OE2 3.42Å; N759-E762 HydrophobicContact CB-CB 4.28Å; N759-E762 PolarHBondContact O-N 3.1Å; N759-E762 PolarHBondContact OD1-N 3.13Å; E762-Y764 PolarHBondContact O-N 3.4Å; E762-P772 CarbonylContact O-C 3.53Å; E762-P772 VanDerWaalsContact O-CA 3.23Å; E762-P772 WeakPolarHBondContact O-CA 3.38Å; E762-V773 HydrophobicContact CB-CG2 4.21Å; E762-V773 WeakPolarHBondContact O-CG2 3.33Å; E762-V773 PolarHBondContact O-N 3.38Å
763	Y	89.6	Confident	87.9	Confident	60 Å²	60	41 Å²	41	24%	0.235	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	125.4	179	-172.4	-92.5	0	0	0	111.7	S761 F770 L1074 R1075 N1076	S761-Y763 PolarHBondContact O-N 2.96Å; Y763-F770 HydrophobicContact CE2-CB 4.42Å; Y763-F770 VanDerWaalsContact OH-CB 3.25Å; Y763-F770 WeakPolarHBondContact OH-CB 3.38Å; Y763-L1074 WeakPolarHBondContact CE2-O 3.41Å; Y763-R1075 WeakPolarHBondContact OH-CA 3.47Å; Y763-R1075 PolarHBondContact OH-O 3.06Å; Y763-N1076 HydrophobicContact CD1-CB 3.78Å; Y763-N1076 HydrophobicContact CD2-CB 3.79Å; Y763-N1076 HydrophobicContact CE1-CB 3.85Å; Y763-N1076 HydrophobicContact CE2-CB 3.88Å; Y763-N1076 HydrophobicContact CG-CB 3.73Å
764	Y	90.3	Very high	87.9	Confident	14 Å²	14	41 Å²	41	6%	0.055	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	129.8	-179.1	-176.8	-122.3	0	0	0	111.8	I733 T734 R735 P736 V739 E762 E766 G771 V773 W776	I733-Y764 HydrophobicContact CD1-CE2 3.67Å; I733-Y764 VanDerWaalsContact CD1-OH 3.29Å; I733-Y764 WeakPolarHBondContact CD1-OH 3.48Å; I733-Y764 HydrophobicContact CG1-CE2 4.42Å; T734-Y764 WeakPolarHBondContact O-CE2 3.5Å; R735-Y764 HydrophobicContact CB-CE2 4.16Å; R735-Y764 HydrophobicContact CG-CE2 4.26Å; R735-Y764 WeakPolarHBondContact CG-OH 3.38Å; R735-Y764 PolarHBondContact NH1-OH 3.44Å; P736-Y764 HydrophobicContact CG-CD2 4.37Å; V739-Y764 HydrophobicContact CB-CE1 4.47Å; V739-Y764 HydrophobicContact CG1-CD1 4.47Å; V739-Y764 HydrophobicContact CG1-CE1 3.81Å; V739-Y764 HydrophobicContact CG2-CD1 4.04Å; V739-Y764 HydrophobicContact CG2-CE1 3.96Å; V739-Y764 HydrophobicContact CG2-CG 4.47Å; E762-Y764 PolarHBondContact O-N 3.4Å; Y764-E766 HydrophobicContact CE1-CB 3.83Å; Y764-E766 PolarHBondContact OH-OE2 2.65Å; Y764-G771 PolarHBondContact N-O 2.9Å; Y764-G771 PolarHBondContact O-N 3.19Å; Y764-G771 VanDerWaalsContact O-O 3.04Å; Y764-V773 HydrophobicContact CG-CG2 4.42Å; Y764-W776 HydrophobicContact CD1-CD2 4.49Å; Y764-W776 AromaticContact CD1-CE3 3.91Å; Y764-W776 HydrophobicContact CD1-CE3 3.91Å; Y764-W776 HydrophobicContact CD1-CZ3 4.2Å; Y764-W776 HydrophobicContact CE1-CD2 4.25Å; Y764-W776 AromaticContact CE1-CE3 3.81Å; Y764-W776 HydrophobicContact CE1-CE3 3.81Å; Y764-W776 HydrophobicContact CE1-CH2 4.19Å; Y764-W776 AromaticContact CE1-CZ3 3.78Å; Y764-W776 HydrophobicContact CE1-CZ3 3.78Å
765	S	83.5	Confident	87.9	Confident	52 Å²	52	40.8 Å²	40.8	36%	0.364	22%	0.219	S	C	.	.			trans	-129.3	82.5	-174.7	62.7	0	0	0	0	112.2
766	E	81.2	Confident	87.9	Confident	19 Å²	19	35.6 Å²	35.6	9%	0.089	19%	0.193	C	C	.	.	S	Bend	trans	-99	-53.2	169.7	-172.8	-175.8	159.4	0	0	112.3	R544 V722 I733 R735 Y764 W776	R544-E766 IonicContact NH2-OE1 3.45Å; R544-E766 PolarHBondContact NH2-OE1 3.21Å; V722-E766 HydrophobicContact CB-CG 4.37Å; V722-E766 HydrophobicContact CG1-CG 3.56Å; V722-E766 HydrophobicContact CG2-CG 3.9Å; I733-E766 HydrophobicContact CD1-CB 3.48Å; I733-E766 VanDerWaalsContact CD1-CB 3.48Å; I733-E766 HydrophobicContact CD1-CG 3.64Å; R735-E766 IonicContact CZ-OE2 3.06Å; R735-E766 IonicContact NH1-OE2 3.67Å; R735-E766 PolarHBondContact NH1-OE2 3Å; Y764-E766 HydrophobicContact CE1-CB 3.83Å; Y764-E766 PolarHBondContact OH-OE2 2.65Å; E766-W776 HydrophobicContact CB-CH2 3.82Å; E766-W776 HydrophobicContact CB-CZ3 3.86Å; E766-W776 HydrophobicContact CG-CH2 4.12Å; E766-W776 WeakPolarHBondContact OE2-CH2 3.34Å; E766-W776 WeakPolarHBondContact OE2-CZ2 3.35Å
767	K	78.1	Confident	88	Confident	124 Å²	124	34.4 Å²	34.4	54%	0.539	19%	0.185	S	C	.	.	S	Bend	trans	-136.8	137.6	-179.5	-69.2	-173.2	179.9	-175	0	109.1	P769	K767-P769 CarbonylContact O-C 3.6Å; K767-P769 VanDerWaalsContact O-O 3.11Å
768	E	67.7	Low	88.1	Confident	84 Å²	84	33.4 Å²	33.4	39%	0.393	17%	0.172	S	C	.	.	S	Bend	trans	-60.6	150.1	175.5	-71.2	-173.6	173.2	0	0	111.8	F770 I1164	E768-F770 HydrophobicContact CG-CD1 4.17Å; E768-F770 HydrophobicContact CG-CD2 3.94Å; E768-F770 HydrophobicContact CG-CE1 3.72Å; E768-F770 HydrophobicContact CG-CE2 3.43Å; E768-F770 VanDerWaalsContact CG-CE2 3.43Å; E768-F770 HydrophobicContact CG-CG 4.29Å; E768-F770 HydrophobicContact CG-CZ 3.32Å; E768-F770 WeakPolarHBondContact OE1-CE2 3.33Å; E768-I1164 WeakPolarHBondContact OE2-CG2 3.46Å
769	P	76.2	Confident	87.9	Confident	40 Å²	40	35.3 Å²	35.3	26%	0.26	18%	0.178	S	C	.	.	S	Bend	cis	-66.3	142.1	-10.3	28.2	-35.1	0	0	0	112.2	K767 D800 Y809	K767-P769 CarbonylContact O-C 3.6Å; K767-P769 VanDerWaalsContact O-O 3.11Å; P769-D800 HydrophobicContact CB-CB 4.44Å; P769-D800 WeakPolarHBondContact CB-OD2 3.34Å; P769-Y809 WeakPolarHBondContact CG-OH 3.37Å
770	F	81.9	Confident	87.6	Confident	51 Å²	51	35.3 Å²	35.3	22%	0.224	18%	0.178	C	C	.	.	P	Polyproline II helix	trans	-83.5	159.9	178	-54.1	-50.9	0	0	0	110.3	Y763 E768 D800 S801	Y763-F770 HydrophobicContact CE2-CB 4.42Å; Y763-F770 VanDerWaalsContact OH-CB 3.25Å; Y763-F770 WeakPolarHBondContact OH-CB 3.38Å; E768-F770 HydrophobicContact CG-CD1 4.17Å; E768-F770 HydrophobicContact CG-CD2 3.94Å; E768-F770 HydrophobicContact CG-CE1 3.72Å; E768-F770 HydrophobicContact CG-CE2 3.43Å; E768-F770 VanDerWaalsContact CG-CE2 3.43Å; E768-F770 HydrophobicContact CG-CG 4.29Å; E768-F770 HydrophobicContact CG-CZ 3.32Å; E768-F770 WeakPolarHBondContact OE1-CE2 3.33Å; F770-D800 CarbonylContact O-C 3.56Å; F770-D800 WeakPolarHBondContact O-CA 3.04Å; F770-D800 WeakPolarHBondContact O-CB 3.29Å; F770-S801 PolarHBondContact N-OG 2.96Å; F770-S801 WeakPolarHBondContact O-CB 3.47Å; F770-S801 PolarHBondContact O-N 2.87Å; F770-S801 PolarHBondContact O-OG 3.4Å
771	G	87.1	Confident	87.2	Confident	4 Å²	4	37.4 Å²	37.4	4%	0.041	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	165.1	-169.3	174.9	0	0	0	0	0	113.1	Y764	Y764-G771 PolarHBondContact N-O 2.9Å; Y764-G771 PolarHBondContact O-N 3.19Å; Y764-G771 VanDerWaalsContact O-O 3.04Å
772	P	92.7	Very high	87	Confident	14 Å²	14	34.9 Å²	34.9	9%	0.091	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-49.6	143.8	171.2	-29.6	36	0	0	0	113.4	E762 A774 F775 L798 R799	E762-P772 CarbonylContact O-C 3.53Å; E762-P772 VanDerWaalsContact O-CA 3.23Å; E762-P772 WeakPolarHBondContact O-CA 3.38Å; P772-A774 PolarHBondContact O-N 3.14Å; P772-F775 HydrophobicContact CB-CD2 3.95Å; P772-F775 HydrophobicContact CB-CE2 4.16Å; P772-F775 HydrophobicContact CG-CD2 4.12Å; P772-F775 HydrophobicContact CG-CE2 3.94Å; P772-F775 WeakPolarHBondContact O-CD2 3.35Å; P772-F775 PolarHBondContact O-N 3.32Å; P772-L798 HydrophobicContact CB-CD1 3.87Å; P772-L798 HydrophobicContact CG-CB 4.3Å; P772-L798 HydrophobicContact CG-CD1 4.2Å; P772-L798 HydrophobicContact CG-CD2 4.06Å; P772-L798 HydrophobicContact CG-CG 4.42Å; P772-R799 WeakPolarHBondContact CD-O 3.07Å
773	V	92.7	Very high	86.8	Confident	2 Å²	2	34 Å²	34	1%	0.012	17%	0.168	C	C	.	.	G	3₁₀ helix	trans	-50.8	-33.1	179.1	168.9	0	0	0	0	112.3	P736 L738 V739 M742 L760 E762 Y764 F775 W776	P736-V773 HydrophobicContact CB-CG2 4.41Å; P736-V773 HydrophobicContact CG-CG2 3.85Å; L738-V773 HydrophobicContact CD2-CG1 3.94Å; L738-V773 HydrophobicContact CG-CG1 4.49Å; V739-V773 HydrophobicContact CG2-CG1 4Å; V739-V773 HydrophobicContact CG2-CG2 4.31Å; M742-V773 HydrophobicContact CE-CG1 4.04Å; L760-V773 PolarHBondContact O-N 3.19Å; E762-V773 HydrophobicContact CB-CG2 4.21Å; E762-V773 WeakPolarHBondContact O-CG2 3.33Å; E762-V773 PolarHBondContact O-N 3.38Å; Y764-V773 HydrophobicContact CG-CG2 4.42Å; V773-F775 PolarHBondContact O-N 2.78Å; V773-F775 VanDerWaalsContact O-N 3.15Å; V773-W776 WeakPolarHBondContact O-CB 3.25Å; V773-W776 PolarHBondContact O-N 3.46Å
774	A	94.2	Very high	87	Confident	0 Å²	0	31.1 Å²	31.1	0%	0	16%	0.157	C	C	.	.	G	3₁₀ helix	trans	-51.7	-36.3	176.5	0	0	0	0	0	114.2	L760 P772 W776 S777 V790 V794 L798 L806	L760-A774 HydrophobicContact CB-CB 4.43Å; L760-A774 PolarHBondContact O-N 3.05Å; L760-A774 VanDerWaalsContact O-N 3.12Å; P772-A774 PolarHBondContact O-N 3.14Å; A774-W776 PolarHBondContact O-N 2.73Å; A774-S777 WeakPolarHBondContact O-CB 3.3Å; A774-S777 PolarHBondContact O-N 2.9Å; A774-S777 VanDerWaalsContact O-N 3.16Å; A774-S777 PolarHBondContact O-OG 3.45Å; A774-V790 HydrophobicContact CB-CG1 3.95Å; A774-V794 HydrophobicContact CB-CB 4.43Å; A774-V794 HydrophobicContact CB-CG2 3.46Å; A774-V794 VanDerWaalsContact CB-CG2 3.46Å; A774-L798 HydrophobicContact CB-CD1 4.27Å; A774-L806 HydrophobicContact CB-CD2 4.43Å
775	F	93.4	Very high	87.1	Confident	14 Å²	14	33.1 Å²	33.1	6%	0.061	17%	0.167	C	C	.	.	G	3₁₀ helix	trans	-67.1	-21.3	178.8	-71	-81.4	0	0	0	113	P772 V773 S777 F778 L798 R799 D800 L806 Y809	P772-F775 HydrophobicContact CB-CD2 3.95Å; P772-F775 HydrophobicContact CB-CE2 4.16Å; P772-F775 HydrophobicContact CG-CD2 4.12Å; P772-F775 HydrophobicContact CG-CE2 3.94Å; P772-F775 WeakPolarHBondContact O-CD2 3.35Å; P772-F775 PolarHBondContact O-N 3.32Å; V773-F775 PolarHBondContact O-N 2.78Å; V773-F775 VanDerWaalsContact O-N 3.15Å; F775-S777 PolarHBondContact O-N 3.44Å; F775-F778 PolarHBondContact O-N 3.46Å; F775-F778 VanDerWaalsContact O-N 3.15Å; F775-L798 HydrophobicContact CE2-CB 3.97Å; F775-L798 HydrophobicContact CZ-CB 4.27Å; F775-R799 VanDerWaalsContact CZ-C 3.48Å; F775-D800 HydrophobicContact CD1-CB 4.33Å; F775-D800 HydrophobicContact CD2-CB 4.4Å; F775-D800 HydrophobicContact CE1-CB 4.32Å; F775-D800 HydrophobicContact CE2-CB 4.41Å; F775-D800 HydrophobicContact CG-CB 4.37Å; F775-D800 HydrophobicContact CZ-CB 4.37Å; F775-L806 HydrophobicContact CD1-CD2 4.01Å; F775-L806 HydrophobicContact CE1-CD2 3.78Å; F775-L806 HydrophobicContact CE1-CG 4.13Å; F775-L806 HydrophobicContact CE2-CD2 4.43Å; F775-L806 HydrophobicContact CG-CD2 4.44Å; F775-L806 HydrophobicContact CZ-CD2 3.99Å; F775-L806 HydrophobicContact CZ-CG 4.07Å; F775-Y809 AromaticContact CD1-CD2 3.56Å; F775-Y809 HydrophobicContact CD1-CD2 3.56Å; F775-Y809 HydrophobicContact CD1-CE1 4.39Å; F775-Y809 AromaticContact CD1-CE2 3.38Å; F775-Y809 HydrophobicContact CD1-CE2 3.38Å; F775-Y809 HydrophobicContact CD1-CG 4.14Å; F775-Y809 AromaticContact CD1-CZ 3.83Å; F775-Y809 AromaticContact CE1-CD2 3.61Å; F775-Y809 HydrophobicContact CE1-CD2 3.61Å; F775-Y809 AromaticContact CE1-CE2 3.6Å; F775-Y809 HydrophobicContact CE1-CE2 3.6Å; F775-Y809 HydrophobicContact CE1-CG 4.49Å; F775-Y809 HydrophobicContact CG-CE2 4.5Å
776	W	92	Very high	87.6	Confident	17 Å²	17	31.4 Å²	31.4	6%	0.064	15%	0.153	C	C	.	.	G	3₁₀ helix	trans	-62.2	-28.4	174.7	-160.5	-94.3	0	0	0	112.6	V739 M742 E743 Y764 E766 V773 A774 F778 K779 F781	V739-W776 VanDerWaalsContact CG1-CD1 3.46Å; V739-W776 HydrophobicContact CG1-CD2 3.77Å; V739-W776 HydrophobicContact CG1-CG 3.72Å; V739-W776 HydrophobicContact CG1-CZ2 4.22Å; V739-W776 VanDerWaalsContact CG1-NE1 3.31Å; M742-W776 HydrophobicContact SD-CB 4.34Å; E743-W776 WeakPolarHBondContact OE1-CZ2 3.15Å; E743-W776 PolarHBondContact OE1-NE1 3.26Å; Y764-W776 HydrophobicContact CD1-CD2 4.49Å; Y764-W776 AromaticContact CD1-CE3 3.91Å; Y764-W776 HydrophobicContact CD1-CE3 3.91Å; Y764-W776 HydrophobicContact CD1-CZ3 4.2Å; Y764-W776 HydrophobicContact CE1-CD2 4.25Å; Y764-W776 AromaticContact CE1-CE3 3.81Å; Y764-W776 HydrophobicContact CE1-CE3 3.81Å; Y764-W776 HydrophobicContact CE1-CH2 4.19Å; Y764-W776 AromaticContact CE1-CZ3 3.78Å; Y764-W776 HydrophobicContact CE1-CZ3 3.78Å; E766-W776 HydrophobicContact CB-CH2 3.82Å; E766-W776 HydrophobicContact CB-CZ3 3.86Å; E766-W776 HydrophobicContact CG-CH2 4.12Å; E766-W776 WeakPolarHBondContact OE2-CH2 3.34Å; E766-W776 WeakPolarHBondContact OE2-CZ2 3.35Å; V773-W776 WeakPolarHBondContact O-CB 3.25Å; V773-W776 PolarHBondContact O-N 3.46Å; A774-W776 PolarHBondContact O-N 2.73Å; W776-F778 PolarHBondContact O-N 2.86Å; W776-F778 VanDerWaalsContact O-N 3.09Å; W776-K779 HydrophobicContact CD2-CG 4.28Å; W776-K779 WeakPolarHBondContact O-CG 3.43Å; W776-K779 PolarHBondContact O-N 3.02Å; W776-K779 VanDerWaalsContact O-N 3.11Å; W776-F781 HydrophobicContact CZ2-CZ 4.22Å
777	S	93	Very high	88.3	Confident	0 Å²	0	30.5 Å²	30.5	0%	0	15%	0.149	C	C	.	.	G	3₁₀ helix	trans	-62.5	-16.3	177.6	71.8	0	0	0	0	113.4	A774 F775 T787	A774-S777 WeakPolarHBondContact O-CB 3.3Å; A774-S777 PolarHBondContact O-N 2.9Å; A774-S777 VanDerWaalsContact O-N 3.16Å; A774-S777 PolarHBondContact O-OG 3.45Å; F775-S777 PolarHBondContact O-N 3.44Å; S777-T787 PolarHBondContact O-OG1 3.48Å
778	F	92.1	Very high	89.1	Confident	10 Å²	10	25.4 Å²	25.4	4%	0.044	13%	0.126	C	C	.	.	G	3₁₀ helix	trans	-94.5	12.9	176.7	-68.1	-87.9	0	0	0	113.9	F775 W776 T787 I791 L806 Y809 A810 L813 I831 R878	F775-F778 PolarHBondContact O-N 3.46Å; F775-F778 VanDerWaalsContact O-N 3.15Å; W776-F778 PolarHBondContact O-N 2.86Å; W776-F778 VanDerWaalsContact O-N 3.09Å; F778-T787 HydrophobicContact CD1-CG2 3.89Å; F778-T787 HydrophobicContact CD2-CG2 4.3Å; F778-T787 HydrophobicContact CE1-CG2 3.65Å; F778-T787 HydrophobicContact CE2-CG2 4.07Å; F778-T787 HydrophobicContact CG-CG2 4.22Å; F778-T787 HydrophobicContact CZ-CG2 3.76Å; F778-I791 HydrophobicContact CE2-CD1 4.16Å; F778-I791 HydrophobicContact CZ-CD1 3.96Å; F778-I791 HydrophobicContact CZ-CG1 4.33Å; F778-L806 HydrophobicContact CE2-CD2 3.77Å; F778-Y809 HydrophobicContact CB-CD1 3.58Å; F778-Y809 HydrophobicContact CB-CE1 4.35Å; F778-Y809 HydrophobicContact CB-CG 4.34Å; F778-Y809 HydrophobicContact CD1-CD1 4.48Å; F778-Y809 HydrophobicContact CD2-CD1 4.23Å; F778-Y809 HydrophobicContact CD2-CG 4.23Å; F778-Y809 AromaticContact CG-CD1 3.88Å; F778-Y809 HydrophobicContact CG-CD1 3.88Å; F778-Y809 HydrophobicContact CG-CG 4.14Å; F778-A810 HydrophobicContact CE1-CB 4.29Å; F778-L813 HydrophobicContact CD1-CD1 4.17Å; F778-L813 HydrophobicContact CD1-CD2 4.03Å; F778-L813 HydrophobicContact CD1-CG 4.13Å; F778-L813 HydrophobicContact CE1-CD1 3.96Å; F778-L813 HydrophobicContact CE1-CG 4.28Å; F778-I831 HydrophobicContact CE1-CG2 4.41Å; F778-R878 PolarHBondContact O-NH2 2.52Å
779	K	88.9	Confident	90.4	Very high	51 Å²	51	22.4 Å²	22.4	22%	0.222	11%	0.113	C	C	.	.	S	Bend	trans	-71.8	149.2	171.3	-65	-63.8	-175.4	-171.5	0	110.9	W776 F781 V782 R878	W776-K779 HydrophobicContact CD2-CG 4.28Å; W776-K779 WeakPolarHBondContact O-CG 3.43Å; W776-K779 PolarHBondContact O-N 3.02Å; W776-K779 VanDerWaalsContact O-N 3.11Å; K779-F781 HydrophobicContact CB-CD1 4.24Å; K779-F781 HydrophobicContact CB-CD2 4.3Å; K779-F781 HydrophobicContact CB-CE1 3.74Å; K779-F781 HydrophobicContact CB-CE2 3.78Å; K779-F781 HydrophobicContact CB-CZ 3.49Å; K779-F781 VanDerWaalsContact CB-CZ 3.49Å; K779-F781 HydrophobicContact CG-CE1 4.25Å; K779-F781 HydrophobicContact CG-CE2 4.37Å; K779-F781 HydrophobicContact CG-CZ 3.8Å; K779-F781 PolarHBondContact O-N 3.11Å; K779-F781 VanDerWaalsContact O-N 3.1Å; K779-V782 HydrophobicContact CB-CG2 4.27Å; K779-V782 PolarHBondContact O-N 3.19Å; K779-V782 VanDerWaalsContact O-N 3.07Å; K779-R878 PolarHBondContact O-NH1 2.99Å
780	N	86.9	Confident	91.3	Very high	66 Å²	66	20.5 Å²	20.5	35%	0.353	10%	0.1	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.9	-22	-173.9	-67.6	0.2	0	0	0	114.6	R878 P879	N780-R878 HydrophobicContact CB-CG 4.17Å; N780-P879 WeakPolarHBondContact O-CD 3.28Å
781	F	83.9	Confident	91.9	Very high	56 Å²	56	18.1 Å²	18.1	25%	0.246	9%	0.09	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.4	-1.6	-179.9	53.2	-106	0	0	0	113.8	E743 W776 K779	E743-F781 HydrophobicContact CG-CD2 4.21Å; E743-F781 HydrophobicContact CG-CE2 3.7Å; W776-F781 HydrophobicContact CZ2-CZ 4.22Å; K779-F781 HydrophobicContact CB-CD1 4.24Å; K779-F781 HydrophobicContact CB-CD2 4.3Å; K779-F781 HydrophobicContact CB-CE1 3.74Å; K779-F781 HydrophobicContact CB-CE2 3.78Å; K779-F781 HydrophobicContact CB-CZ 3.49Å; K779-F781 VanDerWaalsContact CB-CZ 3.49Å; K779-F781 HydrophobicContact CG-CE1 4.25Å; K779-F781 HydrophobicContact CG-CE2 4.37Å; K779-F781 HydrophobicContact CG-CZ 3.8Å; K779-F781 PolarHBondContact O-N 3.11Å; K779-F781 VanDerWaalsContact O-N 3.1Å
782	V	88.5	Confident	92.2	Very high	4 Å²	4	20.7 Å²	20.7	2%	0.024	10%	0.1	C	C	.	.	S	Bend	trans	-96.4	131.4	173.3	179.3	0	0	0	0	107.3	K779 H786 R878	K779-V782 HydrophobicContact CB-CG2 4.27Å; K779-V782 PolarHBondContact O-N 3.19Å; K779-V782 VanDerWaalsContact O-N 3.07Å; V782-H786 HydrophobicContact CG1-CB 3.79Å; V782-R878 PolarHBondContact O-NH1 2.87Å
783	S	89.5	Confident	92.2	Very high	31 Å²	31	25.6 Å²	25.6	22%	0.217	12%	0.122	C	C	.	.			trans	-70.1	148.7	-179.7	79.7	0	0	0	0	111.4	Q785 H786 T787 E881	S783-Q785 PolarHBondContact O-N 3.38Å; S783-H786 WeakPolarHBondContact O-CB 3.43Å; S783-H786 PolarHBondContact O-N 3.26Å; S783-H786 PolarHBondContact OG-ND1 2.98Å; S783-T787 PolarHBondContact O-N 3.39Å; S783-T787 PolarHBondContact O-OG1 3.34Å; S783-E881 WeakPolarHBondContact CA-OE1 3.28Å
784	L	93.2	Very high	92.2	Very high	1 Å²	1	25.6 Å²	25.6	1%	0.005	12%	0.121	C	C	.	.	H	α-helix	trans	-64.6	-24.6	-179.2	-63.9	179.8	0	0	0	112.6	T787 Y788 L813 I817 W827 I831 E881	L784-T787 WeakPolarHBondContact O-CB 3.25Å; L784-T787 PolarHBondContact O-N 2.91Å; L784-Y788 WeakPolarHBondContact O-CB 3.39Å; L784-Y788 PolarHBondContact O-N 3.27Å; L784-L813 HydrophobicContact CD2-CD1 3.86Å; L784-L813 HydrophobicContact CD2-CD2 3.82Å; L784-L813 HydrophobicContact CD2-CG 4.47Å; L784-I817 HydrophobicContact CD1-CD1 3.87Å; L784-I817 HydrophobicContact CD1-CG1 4.4Å; L784-W827 HydrophobicContact CB-CB 3.67Å; L784-W827 HydrophobicContact CB-CG 3.97Å; L784-W827 HydrophobicContact CD1-CB 3.71Å; L784-W827 HydrophobicContact CG-CB 4.34Å; L784-I831 HydrophobicContact CB-CD1 4.15Å; L784-I831 HydrophobicContact CD2-CD1 4.2Å; L784-E881 HydrophobicContact CB-CG 4.3Å; L784-E881 HydrophobicContact CD1-CG 3.96Å; L784-E881 HydrophobicContact CG-CG 4.18Å; L784-E881 WeakPolarHBondContact CG-OE1 3.41Å; L784-E881 PolarHBondContact N-OE1 3.32Å
785	Q	93	Very high	92.1	Very high	56 Å²	56	28.1 Å²	28.1	26%	0.262	14%	0.138	S	C	.	.	H	α-helix	trans	-61.1	-42.8	170.2	-168.1	-174.6	29.6	0	0	111.8	A747 S783 T787 Y788 E789 W827 E883	A747-Q785 HydrophobicContact CB-CB 4.44Å; A747-Q785 HydrophobicContact CB-CG 3.7Å; S783-Q785 PolarHBondContact O-N 3.38Å; Q785-T787 VanDerWaalsContact C-N 3.35Å; Q785-Y788 PolarHBondContact O-N 3.27Å; Q785-E789 PolarHBondContact O-N 3.16Å; Q785-E789 VanDerWaalsContact O-N 3.15Å; Q785-W827 HydrophobicContact CB-CH2 4.24Å; Q785-W827 HydrophobicContact CB-CZ2 4.05Å; Q785-W827 HydrophobicContact CG-CH2 3.95Å; Q785-W827 HydrophobicContact CG-CZ2 3.99Å; Q785-E883 PolarHBondContact NE2-OE2 3.46Å; Q785-E883 VanDerWaalsContact NE2-OE2 3.15Å
786	H	94	Very high	92	Very high	16 Å²	16	28.7 Å²	28.7	7%	0.074	14%	0.142	C	C	.	.	H	α-helix	trans	-65.9	-39.5	173.9	-66.7	88.7	0	0	0	111.2	S745 A747 L750 V782 S783 Y788 E789 V790	S745-H786 PolarHBondContact O-NE2 2.82Å; A747-H786 PolarHBondContact N-NE2 3.16Å; L750-H786 HydrophobicContact CD2-CB 3.78Å; V782-H786 HydrophobicContact CG1-CB 3.79Å; S783-H786 WeakPolarHBondContact O-CB 3.43Å; S783-H786 PolarHBondContact O-N 3.26Å; S783-H786 PolarHBondContact OG-ND1 2.98Å; H786-Y788 VanDerWaalsContact C-N 3.31Å; H786-Y788 PolarHBondContact O-N 2.93Å; H786-E789 PolarHBondContact O-N 3.15Å; H786-V790 WeakPolarHBondContact O-CG2 3.14Å; H786-V790 PolarHBondContact O-N 3.09Å
787	T	94.9	Very high	91.9	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-58.4	-44.7	174	-44	0	0	0	0	110.9	S777 F778 S783 L784 Q785 E789 V790 I791 I831	S777-T787 PolarHBondContact O-OG1 3.48Å; F778-T787 HydrophobicContact CD1-CG2 3.89Å; F778-T787 HydrophobicContact CD2-CG2 4.3Å; F778-T787 HydrophobicContact CE1-CG2 3.65Å; F778-T787 HydrophobicContact CE2-CG2 4.07Å; F778-T787 HydrophobicContact CG-CG2 4.22Å; F778-T787 HydrophobicContact CZ-CG2 3.76Å; S783-T787 PolarHBondContact O-N 3.39Å; S783-T787 PolarHBondContact O-OG1 3.34Å; L784-T787 WeakPolarHBondContact O-CB 3.25Å; L784-T787 PolarHBondContact O-N 2.91Å; Q785-T787 VanDerWaalsContact C-N 3.35Å; T787-E789 PolarHBondContact O-N 2.85Å; T787-V790 PolarHBondContact O-N 2.77Å; T787-I791 HydrophobicContact CG2-CG1 4.29Å; T787-I791 WeakPolarHBondContact O-CB 3.45Å; T787-I791 WeakPolarHBondContact O-CG1 3.39Å; T787-I791 PolarHBondContact O-N 2.98Å; T787-I831 HydrophobicContact CG2-CD1 3.96Å
788	Y	95	Very high	91.8	Very high	16 Å²	16	33.7 Å²	33.7	6%	0.063	17%	0.17	C	C	.	.	H	α-helix	trans	-60.6	-45.7	178.7	-179.7	-124	0	0	0	112.6	L784 Q785 H786 V790 I791 K792 W827 L830 I831 T834 E889	L784-Y788 WeakPolarHBondContact O-CB 3.39Å; L784-Y788 PolarHBondContact O-N 3.27Å; Q785-Y788 PolarHBondContact O-N 3.27Å; H786-Y788 VanDerWaalsContact C-N 3.31Å; H786-Y788 PolarHBondContact O-N 2.93Å; Y788-V790 VanDerWaalsContact C-N 3.3Å; Y788-V790 PolarHBondContact O-N 3.37Å; Y788-I791 PolarHBondContact O-N 3.36Å; Y788-I791 VanDerWaalsContact O-N 3.08Å; Y788-K792 VanDerWaalsContact CD1-CE 3.48Å; Y788-K792 HydrophobicContact CE1-CD 4.4Å; Y788-K792 HydrophobicContact CE2-CG 4.46Å; Y788-K792 PolarHBondContact O-N 2.98Å; Y788-K792 WeakPolarHBondContact OH-CE 3.48Å; Y788-W827 HydrophobicContact CD1-CE3 4.44Å; Y788-W827 HydrophobicContact CD1-CH2 4.15Å; Y788-W827 AromaticContact CD1-CZ3 3.45Å; Y788-W827 HydrophobicContact CD1-CZ3 3.45Å; Y788-W827 VanDerWaalsContact CD1-CZ3 3.45Å; Y788-W827 HydrophobicContact CE1-CZ3 4.08Å; Y788-W827 HydrophobicContact CG-CE3 4.26Å; Y788-W827 AromaticContact CG-CZ3 3.68Å; Y788-W827 HydrophobicContact CG-CZ3 3.68Å; Y788-L830 HydrophobicContact CD2-CD2 4.27Å; Y788-L830 HydrophobicContact CD2-CG 4.14Å; Y788-L830 HydrophobicContact CE1-CD2 4.06Å; Y788-L830 HydrophobicContact CE2-CD1 4.2Å; Y788-L830 HydrophobicContact CE2-CD2 3.9Å; Y788-L830 HydrophobicContact CE2-CG 3.7Å; Y788-I831 HydrophobicContact CD2-CG1 4.4Å; Y788-T834 HydrophobicContact CE2-CG2 4.32Å; Y788-E889 WeakPolarHBondContact CE1-OE2 3.47Å; Y788-E889 PolarHBondContact OH-OE1 3.1Å; Y788-E889 PolarHBondContact OH-OE2 3.05Å
789	E	94.8	Very high	91.8	Very high	22 Å²	22	34.3 Å²	34.3	10%	0.103	17%	0.172	C	C	.	.	H	α-helix	trans	-61.8	-36	177	-68.5	-53.5	130.1	0	0	112.9	A747 Q751 Q785 H786 T787 K792	A747-E789 HydrophobicContact CB-CG 4.21Å; Q751-E789 HydrophobicContact CB-CG 4.45Å; Q751-E789 WeakPolarHBondContact CG-OE2 3.43Å; Q751-E789 PolarHBondContact NE2-OE2 3.18Å; Q785-E789 PolarHBondContact O-N 3.16Å; Q785-E789 VanDerWaalsContact O-N 3.15Å; H786-E789 PolarHBondContact O-N 3.15Å; T787-E789 PolarHBondContact O-N 2.85Å; E789-K792 IonicContact OE1-NZ 3.87Å; E789-K792 PolarHBondContact OE1-NZ 2.88Å; E789-K792 IonicContact OE2-NZ 2.98Å
790	V	95.2	Very high	91.9	Very high	0 Å²	0	32 Å²	32	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-66.3	-43.9	172.4	171.9	0	0	0	0	110.9	M742 L750 I754 L760 A774 H786 T787 Y788 K792 E793 V794	M742-V790 HydrophobicContact CE-CG2 3.56Å; L750-V790 HydrophobicContact CD2-CG2 3.97Å; I754-V790 HydrophobicContact CD1-CG2 4.24Å; L760-V790 HydrophobicContact CD1-CG1 4.38Å; L760-V790 HydrophobicContact CD2-CG1 4.06Å; L760-V790 HydrophobicContact CD2-CG2 4.37Å; A774-V790 HydrophobicContact CB-CG1 3.95Å; H786-V790 WeakPolarHBondContact O-CG2 3.14Å; H786-V790 PolarHBondContact O-N 3.09Å; T787-V790 PolarHBondContact O-N 2.77Å; Y788-V790 VanDerWaalsContact C-N 3.3Å; Y788-V790 PolarHBondContact O-N 3.37Å; V790-K792 PolarHBondContact O-N 2.66Å; V790-E793 PolarHBondContact O-N 3.18Å; V790-V794 HydrophobicContact CG1-CB 4.27Å; V790-V794 VanDerWaalsContact O-CB 3.27Å; V790-V794 WeakPolarHBondContact O-CB 3.28Å; V790-V794 WeakPolarHBondContact O-CG1 3.46Å; V790-V794 PolarHBondContact O-N 3.34Å
791	I	94.6	Very high	92	Very high	1 Å²	1	28.9 Å²	28.9	1%	0.005	15%	0.146	C	C	.	.	H	α-helix	trans	-67.5	-19.7	-176.7	-72.4	-61.2	0	0	0	113.2	F778 T787 Y788 V794 L806 I831 T834 I835 R838	F778-I791 HydrophobicContact CE2-CD1 4.16Å; F778-I791 HydrophobicContact CZ-CD1 3.96Å; F778-I791 HydrophobicContact CZ-CG1 4.33Å; T787-I791 HydrophobicContact CG2-CG1 4.29Å; T787-I791 WeakPolarHBondContact O-CB 3.45Å; T787-I791 WeakPolarHBondContact O-CG1 3.39Å; T787-I791 PolarHBondContact O-N 2.98Å; Y788-I791 PolarHBondContact O-N 3.36Å; Y788-I791 VanDerWaalsContact O-N 3.08Å; I791-V794 HydrophobicContact CD1-CG1 4.03Å; I791-L806 HydrophobicContact CD1-CB 4.42Å; I791-L806 HydrophobicContact CD1-CD1 4.3Å; I791-L806 HydrophobicContact CD1-CD2 4.3Å; I791-I831 HydrophobicContact CG1-CG2 4.15Å; I791-I831 HydrophobicContact CG2-CG2 4.5Å; I791-T834 HydrophobicContact CG2-CG2 3.99Å; I791-I835 HydrophobicContact CD1-CD1 3.77Å; I791-I835 HydrophobicContact CD1-CG1 3.98Å; I791-I835 HydrophobicContact CG1-CD1 4.33Å; I791-I835 HydrophobicContact CG1-CG1 4.47Å; I791-I835 HydrophobicContact CG2-CD1 4.16Å; I791-I835 HydrophobicContact CG2-CG1 3.49Å; I791-I835 VanDerWaalsContact CG2-CG1 3.49Å; I791-R838 PolarHBondContact O-NH1 2.75Å
792	K	92.9	Very high	92.1	Very high	57 Å²	57	27.5 Å²	27.5	25%	0.248	14%	0.141	C	C	.	.	H	α-helix	trans	-67.9	-37.6	173	-72.8	174.3	-177.3	171.6	0	113.1	Y788 E789 V790 R838	Y788-K792 VanDerWaalsContact CD1-CE 3.48Å; Y788-K792 HydrophobicContact CE1-CD 4.4Å; Y788-K792 HydrophobicContact CE2-CG 4.46Å; Y788-K792 PolarHBondContact O-N 2.98Å; Y788-K792 WeakPolarHBondContact OH-CE 3.48Å; E789-K792 IonicContact OE1-NZ 3.87Å; E789-K792 PolarHBondContact OE1-NZ 2.88Å; E789-K792 IonicContact OE2-NZ 2.98Å; V790-K792 PolarHBondContact O-N 2.66Å; K792-R838 PolarHBondContact O-NE 3.47Å; K792-R838 PolarHBondContact O-NH1 2.86Å; K792-R838 PolarHBondContact O-NH2 3.4Å
793	E	92.7	Very high	92	Very high	118 Å²	118	27.3 Å²	27.3	55%	0.551	14%	0.14	S	C	*	.	H	α-helix	trans	-110.7	-26.1	-168.9	-62.8	-61.5	149.9	0	0	113.5	I754 L760 V790 R838	I754-E793 HydrophobicContact CG2-CB 3.71Å; I754-E793 HydrophobicContact CG2-CG 3.75Å; L760-E793 HydrophobicContact CD1-CB 4.2Å; V790-E793 PolarHBondContact O-N 3.18Å; E793-R838 PolarHBondContact O-NH2 2.9Å
794	V	93.3	Very high	92.1	Very high	1 Å²	1	26.3 Å²	26.3	1%	0.006	13%	0.133	C	C	.	.	S	Bend	trans	-60	144.5	-174.3	69.1	0	0	0	0	113.7	L760 A774 V790 I791 V796 L798 L806 R838	L760-V794 HydrophobicContact CB-CG2 4.16Å; L760-V794 HydrophobicContact CD1-CB 3.98Å; A774-V794 HydrophobicContact CB-CB 4.43Å; A774-V794 HydrophobicContact CB-CG2 3.46Å; A774-V794 VanDerWaalsContact CB-CG2 3.46Å; V790-V794 HydrophobicContact CG1-CB 4.27Å; V790-V794 VanDerWaalsContact O-CB 3.27Å; V790-V794 WeakPolarHBondContact O-CB 3.28Å; V790-V794 WeakPolarHBondContact O-CG1 3.46Å; V790-V794 PolarHBondContact O-N 3.34Å; I791-V794 HydrophobicContact CD1-CG1 4.03Å; V794-V796 PolarHBondContact O-N 2.99Å; V794-L798 HydrophobicContact CG2-CD1 3.49Å; V794-L798 VanDerWaalsContact CG2-CD1 3.49Å; V794-L806 HydrophobicContact CB-CD1 4.45Å; V794-L806 HydrophobicContact CG1-CD1 3.59Å; V794-L806 HydrophobicContact CG2-CD1 3.95Å; V794-R838 PolarHBondContact O-NH1 2.9Å; V794-R838 PolarHBondContact O-NH2 3.43Å
795	P	92.9	Very high	92.1	Very high	53 Å²	53	26.3 Å²	26.3	34%	0.344	13%	0.133	S	C	.	.			trans	-59.8	126.9	166.5	-20.3	31.4	0	0	0	111.5	D797 L798 L806	P795-D797 VanDerWaalsContact C-N 3.28Å; P795-D797 WeakPolarHBondContact CB-OD1 3.48Å; P795-D797 PolarHBondContact O-N 3.34Å; P795-L798 HydrophobicContact CB-CD2 4.45Å; P795-L798 HydrophobicContact CB-CG 4.11Å; P795-L798 WeakPolarHBondContact O-CG 3.42Å; P795-L806 WeakPolarHBondContact O-CD1 3.45Å
796	V	90.2	Very high	92.1	Very high	26 Å²	26	23.7 Å²	23.7	16%	0.158	12%	0.121	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.4	-16.3	-173.5	-67.2	0	0	0	0	113.9	V794 L798 R838 V840	V794-V796 PolarHBondContact O-N 2.99Å; V796-L798 VanDerWaalsContact C-N 3.33Å; V796-R838 HydrophobicContact CG1-CB 3.67Å; V796-V840 HydrophobicContact CB-CB 4.41Å; V796-V840 HydrophobicContact CB-CG2 4.43Å
797	D	89.7	Confident	92.1	Very high	98 Å²	98	23 Å²	23	52%	0.524	12%	0.117	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.5	-9.9	-177	61.3	-45.6	0	0	0	113.6	P795 R799	P795-D797 VanDerWaalsContact C-N 3.28Å; P795-D797 WeakPolarHBondContact CB-OD1 3.48Å; P795-D797 PolarHBondContact O-N 3.34Å; D797-R799 PolarHBondContact O-NH1 2.87Å
798	L	92.6	Very high	91.9	Very high	24 Å²	24	23.1 Å²	23.1	13%	0.126	12%	0.118	C	C	.	.			trans	-56.4	150.6	-179.1	-64.7	-178.7	0	0	0	113.3	P772 A774 F775 V794 P795 V796 L806	P772-L798 HydrophobicContact CB-CD1 3.87Å; P772-L798 HydrophobicContact CG-CB 4.3Å; P772-L798 HydrophobicContact CG-CD1 4.2Å; P772-L798 HydrophobicContact CG-CD2 4.06Å; P772-L798 HydrophobicContact CG-CG 4.42Å; A774-L798 HydrophobicContact CB-CD1 4.27Å; F775-L798 HydrophobicContact CE2-CB 3.97Å; F775-L798 HydrophobicContact CZ-CB 4.27Å; V794-L798 HydrophobicContact CG2-CD1 3.49Å; V794-L798 VanDerWaalsContact CG2-CD1 3.49Å; P795-L798 HydrophobicContact CB-CD2 4.45Å; P795-L798 HydrophobicContact CB-CG 4.11Å; P795-L798 WeakPolarHBondContact O-CG 3.42Å; V796-L798 VanDerWaalsContact C-N 3.33Å; L798-L806 HydrophobicContact CB-CD1 4.5Å
799	R	91.7	Very high	91.8	Very high	24 Å²	24	24.4 Å²	24.4	9%	0.091	12%	0.123	C	C	.	.	B	Isolated β-bridge	trans	-136.7	150.1	176.3	-66.3	-63.1	-171.4	-53.8	-47.2	112.1	P772 F775 D797 G803 S804 S805 L1074	P772-R799 WeakPolarHBondContact CD-O 3.07Å; F775-R799 VanDerWaalsContact CZ-C 3.48Å; D797-R799 PolarHBondContact O-NH1 2.87Å; R799-G803 WeakPolarHBondContact CD-O 3.39Å; R799-G803 PolarHBondContact NE-O 3.48Å; R799-S804 WeakPolarHBondContact CA-O 3.31Å; R799-S804 WeakPolarHBondContact CD-O 3.38Å; R799-S805 VanDerWaalsContact NH1-CB 3.31Å; R799-L1074 HydrophobicContact CB-CD1 3.45Å; R799-L1074 VanDerWaalsContact CB-CD1 3.45Å; R799-L1074 HydrophobicContact CB-CD2 3.65Å; R799-L1074 HydrophobicContact CB-CG 4.14Å; R799-L1074 HydrophobicContact CG-CD1 3.98Å; R799-L1074 HydrophobicContact CG-CD2 4.39Å
800	D	91	Very high	91.8	Very high	1 Å²	1	23.4 Å²	23.4	1%	0.005	12%	0.118	C	C	.	.			trans	-84.4	178.8	168	78.5	-2.5	0	0	0	111.8	P769 F770 F775 N802 G803 S804 Y809 L1074	P769-D800 HydrophobicContact CB-CB 4.44Å; P769-D800 WeakPolarHBondContact CB-OD2 3.34Å; F770-D800 CarbonylContact O-C 3.56Å; F770-D800 WeakPolarHBondContact O-CA 3.04Å; F770-D800 WeakPolarHBondContact O-CB 3.29Å; F775-D800 HydrophobicContact CD1-CB 4.33Å; F775-D800 HydrophobicContact CD2-CB 4.4Å; F775-D800 HydrophobicContact CE1-CB 4.32Å; F775-D800 HydrophobicContact CE2-CB 4.41Å; F775-D800 HydrophobicContact CG-CB 4.37Å; F775-D800 HydrophobicContact CZ-CB 4.37Å; D800-N802 PolarHBondContact O-N 3.37Å; D800-N802 VanDerWaalsContact OD1-C 3.27Å; D800-N802 VanDerWaalsContact OD1-CA 3.31Å; D800-N802 WeakPolarHBondContact OD1-CA 3.37Å; D800-N802 WeakPolarHBondContact OD1-CB 3.18Å; D800-N802 PolarHBondContact OD1-N 2.93Å; D800-G803 PolarHBondContact O-N 2.86Å; D800-G803 PolarHBondContact OD1-N 3.25Å; D800-G803 VanDerWaalsContact OD1-N 3.09Å; D800-S804 PolarHBondContact N-O 2.89Å; D800-S804 VanDerWaalsContact N-O 3.08Å; D800-S804 WeakPolarHBondContact OD1-CB 3.49Å; D800-S804 PolarHBondContact OD1-N 3.34Å; D800-Y809 HydrophobicContact CB-CE2 4.39Å; D800-Y809 WeakPolarHBondContact OD2-CE2 3.24Å; D800-Y809 PolarHBondContact OD2-OH 3.29Å; D800-L1074 WeakPolarHBondContact O-CB 3.33Å; D800-L1074 WeakPolarHBondContact O-CD1 3.49Å
801	S	88.2	Confident	91.7	Very high	2 Å²	2	23.4 Å²	23.4	1%	0.014	12%	0.118	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.9	-13.9	179.6	62	0	0	0	0	114.4	F770	F770-S801 PolarHBondContact N-OG 2.96Å; F770-S801 WeakPolarHBondContact O-CB 3.47Å; F770-S801 PolarHBondContact O-N 2.87Å; F770-S801 PolarHBondContact O-OG 3.4Å
802	N	86.4	Confident	91.5	Very high	27 Å²	27	26.2 Å²	26.2	14%	0.144	13%	0.134	C	C	.	.	T	Hydrogen-bonded Turn	trans	-105.6	10.6	-179.5	-68.4	-5	0	0	0	111.7	D800 S804 I847 W848	D800-N802 PolarHBondContact O-N 3.37Å; D800-N802 VanDerWaalsContact OD1-C 3.27Å; D800-N802 VanDerWaalsContact OD1-CA 3.31Å; D800-N802 WeakPolarHBondContact OD1-CA 3.37Å; D800-N802 WeakPolarHBondContact OD1-CB 3.18Å; D800-N802 PolarHBondContact OD1-N 2.93Å; N802-S804 PolarHBondContact O-N 3.29Å; N802-I847 HydrophobicContact CB-CD1 3.75Å; N802-I847 HydrophobicContact CB-CG1 3.95Å; N802-I847 WeakPolarHBondContact O-CG2 3.31Å; N802-I847 PolarHBondContact O-N 2.7Å; N802-W848 HydrophobicContact CB-CH2 4.44Å; N802-W848 HydrophobicContact CB-CZ3 4.35Å
803	G	86.4	Confident	91.4	Very high	0 Å²	0	23.6 Å²	23.6	0%	0	12%	0.122	C	C	.	.	S	Bend	trans	70	7.1	-177.9	0	0	0	0	0	114.1	R799 D800 C1038	R799-G803 WeakPolarHBondContact CD-O 3.39Å; R799-G803 PolarHBondContact NE-O 3.48Å; D800-G803 PolarHBondContact O-N 2.86Å; D800-G803 PolarHBondContact OD1-N 3.25Å; D800-G803 VanDerWaalsContact OD1-N 3.09Å; G803-C1038 WeakPolarHBondContact CA-O 3.28Å
804	S	90.6	Very high	91.3	Very high	10 Å²	10	18.9 Å²	18.9	7%	0.07	10%	0.1	C	C	.	.			trans	-75.8	127.9	175.9	-63.2	0	0	0	0	109.8	R799 D800 N802 D846	R799-S804 WeakPolarHBondContact CA-O 3.31Å; R799-S804 WeakPolarHBondContact CD-O 3.38Å; D800-S804 PolarHBondContact N-O 2.89Å; D800-S804 VanDerWaalsContact N-O 3.08Å; D800-S804 WeakPolarHBondContact OD1-CB 3.49Å; D800-S804 PolarHBondContact OD1-N 3.34Å; N802-S804 PolarHBondContact O-N 3.29Å; S804-D846 WeakPolarHBondContact OG-CB 3.48Å
805	S	93	Very high	91	Very high	0 Å²	0	21 Å²	21	0%	0	11%	0.11	C	C	.	.	B	Isolated β-bridge	trans	-82.7	164.6	174.8	72.1	0	0	0	0	112.2	R799 F807 H808 Y809	R799-S805 VanDerWaalsContact NH1-CB 3.31Å; S805-F807 PolarHBondContact O-N 3.43Å; S805-F807 WeakPolarHBondContact OG-CB 3.09Å; S805-F807 PolarHBondContact OG-N 3.31Å; S805-H808 PolarHBondContact N-ND1 3.05Å; S805-H808 VanDerWaalsContact N-ND1 3.15Å; S805-H808 WeakPolarHBondContact O-CB 3.46Å; S805-H808 PolarHBondContact O-N 3.34Å; S805-H808 PolarHBondContact OG-N 3.13Å; S805-H808 PolarHBondContact OG-ND1 2.97Å; S805-Y809 WeakPolarHBondContact O-CD2 3.27Å; S805-Y809 PolarHBondContact O-N 2.88Å
806	L	93.2	Very high	90.7	Very high	1 Å²	1	19.5 Å²	19.5	1%	0.005	10%	0.099	C	C	.	.	H	α-helix	trans	-51.5	-30.4	170.7	-66.4	169.1	0	0	0	112	A774 F775 F778 I791 V794 P795 L798 Y809 A810 I835	A774-L806 HydrophobicContact CB-CD2 4.43Å; F775-L806 HydrophobicContact CD1-CD2 4.01Å; F775-L806 HydrophobicContact CE1-CD2 3.78Å; F775-L806 HydrophobicContact CE1-CG 4.13Å; F775-L806 HydrophobicContact CE2-CD2 4.43Å; F775-L806 HydrophobicContact CG-CD2 4.44Å; F775-L806 HydrophobicContact CZ-CD2 3.99Å; F775-L806 HydrophobicContact CZ-CG 4.07Å; F778-L806 HydrophobicContact CE2-CD2 3.77Å; I791-L806 HydrophobicContact CD1-CB 4.42Å; I791-L806 HydrophobicContact CD1-CD1 4.3Å; I791-L806 HydrophobicContact CD1-CD2 4.3Å; V794-L806 HydrophobicContact CB-CD1 4.45Å; V794-L806 HydrophobicContact CG1-CD1 3.59Å; V794-L806 HydrophobicContact CG2-CD1 3.95Å; P795-L806 WeakPolarHBondContact O-CD1 3.45Å; L798-L806 HydrophobicContact CB-CD1 4.5Å; L806-Y809 PolarHBondContact O-N 3.49Å; L806-A810 WeakPolarHBondContact O-CB 3.27Å; L806-A810 PolarHBondContact O-N 3.45Å; L806-I835 HydrophobicContact CB-CD1 4.5Å
807	F	94	Very high	90.6	Very high	1 Å²	1	18.3 Å²	18.3	0%	0.004	9%	0.092	C	C	.	.	H	α-helix	trans	-69.4	-35.7	176.7	-164.7	-127	0	0	0	113.6	S805 T811 L832 I835 L836 V840 I842 A852 I908	S805-F807 PolarHBondContact O-N 3.43Å; S805-F807 WeakPolarHBondContact OG-CB 3.09Å; S805-F807 PolarHBondContact OG-N 3.31Å; F807-T811 WeakPolarHBondContact O-CB 3.37Å; F807-T811 PolarHBondContact O-N 3.2Å; F807-T811 PolarHBondContact O-OG1 3.35Å; F807-L832 HydrophobicContact CD2-CD1 3.74Å; F807-L832 HydrophobicContact CE2-CD1 3.34Å; F807-L832 HydrophobicContact CE2-CG 4.06Å; F807-L832 HydrophobicContact CZ-CD1 4.17Å; F807-I835 HydrophobicContact CB-CG2 4.27Å; F807-I835 HydrophobicContact CD2-CB 4.49Å; F807-I835 HydrophobicContact CD2-CG2 3.92Å; F807-L836 HydrophobicContact CE2-CD1 4.24Å; F807-L836 HydrophobicContact CE2-CD2 3.64Å; F807-L836 HydrophobicContact CE2-CG 3.69Å; F807-L836 HydrophobicContact CZ-CD1 4.46Å; F807-L836 HydrophobicContact CZ-CD2 3.58Å; F807-L836 HydrophobicContact CZ-CG 4.09Å; F807-V840 HydrophobicContact CB-CG1 4.24Å; F807-V840 HydrophobicContact CB-CG2 3.98Å; F807-V840 HydrophobicContact CD1-CG1 4.33Å; F807-V840 HydrophobicContact CD2-CG1 3.87Å; F807-V840 HydrophobicContact CE2-CG1 4.27Å; F807-V840 HydrophobicContact CG-CG1 3.91Å; F807-I842 HydrophobicContact CD1-CB 4.47Å; F807-I842 HydrophobicContact CD1-CG2 4.28Å; F807-I842 HydrophobicContact CE1-CB 3.92Å; F807-I842 HydrophobicContact CE1-CG2 3.65Å; F807-I842 HydrophobicContact CZ-CG2 3.95Å; F807-A852 HydrophobicContact CB-CB 4.45Å; F807-A852 HydrophobicContact CD1-CB 3.22Å; F807-A852 HydrophobicContact CE1-CB 3.6Å; F807-A852 HydrophobicContact CG-CB 4Å; F807-I908 HydrophobicContact CE1-CD1 4.19Å; F807-I908 HydrophobicContact CZ-CD1 3.83Å; F807-I908 HydrophobicContact CZ-CG1 3.82Å
808	H	92.4	Very high	90.5	Very high	4 Å²	4	16 Å²	16	2%	0.019	8%	0.078	C	C	.	.	H	α-helix	trans	-63.7	-43.8	171.8	-67.3	77.4	0	0	0	110.7	S805 T811 N812 Y844 R850 A852 I855	S805-H808 PolarHBondContact N-ND1 3.05Å; S805-H808 VanDerWaalsContact N-ND1 3.15Å; S805-H808 WeakPolarHBondContact O-CB 3.46Å; S805-H808 PolarHBondContact O-N 3.34Å; S805-H808 PolarHBondContact OG-N 3.13Å; S805-H808 PolarHBondContact OG-ND1 2.97Å; H808-T811 PolarHBondContact O-N 3.06Å; H808-N812 WeakPolarHBondContact O-CB 3.42Å; H808-N812 PolarHBondContact O-N 3.36Å; H808-Y844 PolarHBondContact CE1-O 3.36Å; H808-Y844 PolarHBondContact NE2-O 2.88Å; H808-R850 PolarHBondContact NE2-O 3.36Å; H808-A852 PolarHBondContact NE2-N 2.48Å; H808-I855 HydrophobicContact CB-CD1 3.94Å
809	Y	92.8	Very high	90.1	Very high	43 Å²	43	18.4 Å²	18.4	17%	0.169	10%	0.095	C	C	.	.	H	α-helix	trans	-63.7	-46.2	177.5	-81.7	-97.8	0	0	0	112.2	P769 F775 F778 D800 S805 L806 T811 N812 L813	P769-Y809 WeakPolarHBondContact CG-OH 3.37Å; F775-Y809 AromaticContact CD1-CD2 3.56Å; F775-Y809 HydrophobicContact CD1-CD2 3.56Å; F775-Y809 HydrophobicContact CD1-CE1 4.39Å; F775-Y809 AromaticContact CD1-CE2 3.38Å; F775-Y809 HydrophobicContact CD1-CE2 3.38Å; F775-Y809 HydrophobicContact CD1-CG 4.14Å; F775-Y809 AromaticContact CD1-CZ 3.83Å; F775-Y809 AromaticContact CE1-CD2 3.61Å; F775-Y809 HydrophobicContact CE1-CD2 3.61Å; F775-Y809 AromaticContact CE1-CE2 3.6Å; F775-Y809 HydrophobicContact CE1-CE2 3.6Å; F775-Y809 HydrophobicContact CE1-CG 4.49Å; F775-Y809 HydrophobicContact CG-CE2 4.5Å; F778-Y809 HydrophobicContact CB-CD1 3.58Å; F778-Y809 HydrophobicContact CB-CE1 4.35Å; F778-Y809 HydrophobicContact CB-CG 4.34Å; F778-Y809 HydrophobicContact CD1-CD1 4.48Å; F778-Y809 HydrophobicContact CD2-CD1 4.23Å; F778-Y809 HydrophobicContact CD2-CG 4.23Å; F778-Y809 AromaticContact CG-CD1 3.88Å; F778-Y809 HydrophobicContact CG-CD1 3.88Å; F778-Y809 HydrophobicContact CG-CG 4.14Å; D800-Y809 HydrophobicContact CB-CE2 4.39Å; D800-Y809 WeakPolarHBondContact OD2-CE2 3.24Å; D800-Y809 PolarHBondContact OD2-OH 3.29Å; S805-Y809 WeakPolarHBondContact O-CD2 3.27Å; S805-Y809 PolarHBondContact O-N 2.88Å; L806-Y809 PolarHBondContact O-N 3.49Å; Y809-T811 VanDerWaalsContact C-N 3.28Å; Y809-T811 PolarHBondContact O-N 3.44Å; Y809-N812 PolarHBondContact O-N 3.04Å; Y809-L813 PolarHBondContact O-N 3.33Å; Y809-L813 VanDerWaalsContact O-N 3.08Å
810	A	94.2	Very high	89.9	Confident	0 Å²	0	25.1 Å²	25.1	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-59.5	-39.9	175.8	0	0	0	0	0	112.2	F778 L806 L813 I831 L832 I835	F778-A810 HydrophobicContact CE1-CB 4.29Å; L806-A810 WeakPolarHBondContact O-CB 3.27Å; L806-A810 PolarHBondContact O-N 3.45Å; A810-L813 VanDerWaalsContact O-CB 3.31Å; A810-L813 WeakPolarHBondContact O-CB 3.49Å; A810-L813 PolarHBondContact O-N 2.64Å; A810-I831 HydrophobicContact CB-CG2 3.94Å; A810-L832 HydrophobicContact CB-CD1 3.94Å; A810-I835 HydrophobicContact CB-CD1 3.51Å
811	T	92.7	Very high	89.8	Confident	0 Å²	0	25.2 Å²	25.2	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-71.5	-35.9	177.3	-51.5	0	0	0	0	111.9	F807 H808 Y809 L813 F814 L832 A852 L856	F807-T811 WeakPolarHBondContact O-CB 3.37Å; F807-T811 PolarHBondContact O-N 3.2Å; F807-T811 PolarHBondContact O-OG1 3.35Å; H808-T811 PolarHBondContact O-N 3.06Å; Y809-T811 VanDerWaalsContact C-N 3.28Å; Y809-T811 PolarHBondContact O-N 3.44Å; T811-L813 PolarHBondContact O-N 3.29Å; T811-F814 WeakPolarHBondContact O-CD2 3.48Å; T811-F814 PolarHBondContact O-N 2.96Å; T811-L832 WeakPolarHBondContact OG1-CD1 3.35Å; T811-A852 VanDerWaalsContact CG2-O 3.25Å; T811-A852 WeakPolarHBondContact CG2-O 3.4Å; T811-L856 HydrophobicContact CG2-CD1 3.8Å; T811-L856 HydrophobicContact CG2-CD2 3.39Å; T811-L856 HydrophobicContact CG2-CG 3.35Å
812	N	90.6	Very high	89.9	Confident	61 Å²	61	29.3 Å²	29.3	33%	0.326	15%	0.151	S	C	.	.	H	α-helix	trans	-68.2	-20.4	175.4	-168	63.3	0	0	0	113	H808 Y809 F814 H815 T816 I855	H808-N812 WeakPolarHBondContact O-CB 3.42Å; H808-N812 PolarHBondContact O-N 3.36Å; Y809-N812 PolarHBondContact O-N 3.04Å; N812-F814 PolarHBondContact O-N 3.44Å; N812-H815 PolarHBondContact O-N 3.25Å; N812-T816 PolarHBondContact O-N 3.49Å; N812-I855 HydrophobicContact CB-CG2 4.42Å
813	L	91.8	Very high	90.2	Very high	2 Å²	2	29.8 Å²	29.8	1%	0.01	15%	0.153	C	C	.	.	H	α-helix	trans	-54.3	-39.3	175.1	-71.3	178.7	0	0	0	112	F778 L784 Y809 A810 T811 H815 T816 I817 A828 I831	F778-L813 HydrophobicContact CD1-CD1 4.17Å; F778-L813 HydrophobicContact CD1-CD2 4.03Å; F778-L813 HydrophobicContact CD1-CG 4.13Å; F778-L813 HydrophobicContact CE1-CD1 3.96Å; F778-L813 HydrophobicContact CE1-CG 4.28Å; L784-L813 HydrophobicContact CD2-CD1 3.86Å; L784-L813 HydrophobicContact CD2-CD2 3.82Å; L784-L813 HydrophobicContact CD2-CG 4.47Å; Y809-L813 PolarHBondContact O-N 3.33Å; Y809-L813 VanDerWaalsContact O-N 3.08Å; A810-L813 VanDerWaalsContact O-CB 3.31Å; A810-L813 WeakPolarHBondContact O-CB 3.49Å; A810-L813 PolarHBondContact O-N 2.64Å; T811-L813 PolarHBondContact O-N 3.29Å; L813-H815 PolarHBondContact O-N 3.28Å; L813-H815 VanDerWaalsContact O-N 3.1Å; L813-T816 WeakPolarHBondContact CA-OG1 3.16Å; L813-T816 PolarHBondContact O-N 3.24Å; L813-T816 PolarHBondContact O-OG1 3.47Å; L813-I817 HydrophobicContact CB-CD1 4.06Å; L813-I817 WeakPolarHBondContact O-CD1 3.36Å; L813-I817 VanDerWaalsContact O-CG1 3.3Å; L813-I817 WeakPolarHBondContact O-CG1 3.49Å; L813-I817 PolarHBondContact O-N 3.34Å; L813-A828 HydrophobicContact CB-CB 4.03Å; L813-A828 HydrophobicContact CD1-CB 4.29Å; L813-I831 HydrophobicContact CD1-CD1 4Å; L813-I831 HydrophobicContact CD1-CG2 4.41Å
814	F	89.9	Confident	90.4	Very high	18 Å²	18	29.8 Å²	29.8	8%	0.079	15%	0.153	C	C	.	.	H	α-helix	trans	-62.1	-17.4	179.5	-66.9	-92.4	0	0	0	113.8	T811 N812 F825 A828 L832 R860 A904	T811-F814 WeakPolarHBondContact O-CD2 3.48Å; T811-F814 PolarHBondContact O-N 2.96Å; N812-F814 PolarHBondContact O-N 3.44Å; F814-F825 AromaticContact CD1-CD1 3.82Å; F814-F825 HydrophobicContact CD1-CD1 3.82Å; F814-F825 HydrophobicContact CD1-CE1 4.01Å; F814-F825 HydrophobicContact CE1-CD1 4.24Å; F814-A828 HydrophobicContact CD2-CB 4.44Å; F814-A828 HydrophobicContact CE1-CB 4.23Å; F814-A828 HydrophobicContact CE2-CB 4.07Å; F814-A828 HydrophobicContact CZ-CB 3.96Å; F814-L832 HydrophobicContact CE2-CB 4.33Å; F814-L832 HydrophobicContact CE2-CD2 3.94Å; F814-L832 HydrophobicContact CZ-CD2 4.23Å; F814-R860 PolarHBondContact O-NH2 2.98Å; F814-A904 HydrophobicContact CD1-CB 4.37Å; F814-A904 HydrophobicContact CD2-CB 4.08Å; F814-A904 HydrophobicContact CE1-CB 4.16Å; F814-A904 HydrophobicContact CE2-CB 3.87Å; F814-A904 HydrophobicContact CG-CB 4.34Å; F814-A904 HydrophobicContact CZ-CB 3.9Å
815	H	86	Confident	90.5	Very high	46 Å²	46	30.9 Å²	30.9	21%	0.213	16%	0.156	C	C	.	.	H	α-helix	trans	-94.9	-23.6	172.1	-65.6	-57.9	0	0	0	113.1	N812 L813 I855 R858	N812-H815 PolarHBondContact O-N 3.25Å; L813-H815 PolarHBondContact O-N 3.28Å; L813-H815 VanDerWaalsContact O-N 3.1Å; H815-I855 PolarHBondContact NE2-O 3.27Å; H815-R858 PolarHBondContact CE1-O 3.44Å
816	T	87	Confident	90.5	Very high	21 Å²	21	35.3 Å²	35.3	13%	0.129	17%	0.173	C	C	.	.	H	α-helix	trans	-90	-17.3	-179.2	65.2	0	0	0	0	114.2	N812 L813 F877 R878	N812-T816 PolarHBondContact O-N 3.49Å; L813-T816 WeakPolarHBondContact CA-OG1 3.16Å; L813-T816 PolarHBondContact O-N 3.24Å; L813-T816 PolarHBondContact O-OG1 3.47Å; T816-F877 WeakPolarHBondContact O-CA 3.46Å; T816-R878 PolarHBondContact O-N 3.1Å; T816-R878 PolarHBondContact OG1-NE 3.38Å; T816-R878 VanDerWaalsContact OG1-NE 3.15Å
817	I	88.8	Confident	90.5	Very high	1 Å²	1	35.8 Å²	35.8	1%	0.005	18%	0.175	C	C	.	.	S	Bend	trans	-86.3	134.4	179.4	-67.3	160.1	0	0	0	109.1	L784 L813 D821 G824 F825 A828	L784-I817 HydrophobicContact CD1-CD1 3.87Å; L784-I817 HydrophobicContact CD1-CG1 4.4Å; L813-I817 HydrophobicContact CB-CD1 4.06Å; L813-I817 WeakPolarHBondContact O-CD1 3.36Å; L813-I817 VanDerWaalsContact O-CG1 3.3Å; L813-I817 WeakPolarHBondContact O-CG1 3.49Å; L813-I817 PolarHBondContact O-N 3.34Å; I817-D821 HydrophobicContact CG2-CB 3.87Å; I817-G824 WeakPolarHBondContact CD1-O 3.23Å; I817-F825 HydrophobicContact CB-CZ 4.34Å; I817-F825 HydrophobicContact CG2-CD2 4.17Å; I817-F825 HydrophobicContact CG2-CE1 4.43Å; I817-F825 HydrophobicContact CG2-CE2 3.92Å; I817-F825 HydrophobicContact CG2-CG 4.49Å; I817-F825 HydrophobicContact CG2-CZ 4.03Å; I817-A828 HydrophobicContact CD1-CB 3.53Å
818	H	87.4	Confident	90.5	Very high	49 Å²	49	35.7 Å²	35.7	23%	0.227	18%	0.175	C	C	.	.			trans	-63.2	137.9	179.1	-175.2	-90.9	0	0	0	110.7	K820 D821 F825 F877 F880	H818-K820 WeakPolarHBondContact ND1-CB 3.49Å; H818-K820 PolarHBondContact ND1-N 2.97Å; H818-K820 VanDerWaalsContact ND1-N 3.14Å; H818-K820 PolarHBondContact O-N 2.86Å; H818-D821 HydrophobicContact CB-CB 4.4Å; H818-D821 WeakPolarHBondContact O-CB 3.33Å; H818-D821 PolarHBondContact O-N 3.2Å; H818-F825 WeakPolarHBondContact O-CE2 3.12Å; H818-F877 HydrophobicContact CB-CB 4.18Å; H818-F877 HydrophobicContact CB-CD1 4.24Å; H818-F877 HydrophobicContact CB-CG 4.15Å; H818-F877 AromaticContact CD2-CD2 3.88Å; H818-F880 HydrophobicContact CB-CE2 3.86Å; H818-F880 HydrophobicContact CB-CZ 4.21Å; H818-F880 AromaticContact CG-CE2 3.81Å; H818-F880 AromaticContact CG-CZ 3.91Å; H818-F880 AromaticContact ND1-CE2 3.77Å; H818-F880 AromaticContact ND1-CZ 3.37Å; H818-F880 WeakPolarHBondContact ND1-CZ 3.49Å
819	P	84.7	Confident	90.5	Very high	76 Å²	76	35.7 Å²	35.7	49%	0.494	18%	0.175	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.7	-25.9	-175.9	-28.2	35.4	0	0	0	115.6
820	K	87.6	Confident	90.6	Very high	164 Å²	164	33.9 Å²	33.9	71%	0.713	17%	0.168	S	C	*	.	T	Hydrogen-bonded Turn	trans	-86.2	-5.7	176.9	-58	-178.7	-175.1	174.4	0	114.2	H818 V822 F880	H818-K820 WeakPolarHBondContact ND1-CB 3.49Å; H818-K820 PolarHBondContact ND1-N 2.97Å; H818-K820 VanDerWaalsContact ND1-N 3.14Å; H818-K820 PolarHBondContact O-N 2.86Å; K820-V822 PolarHBondContact O-N 3.46Å; K820-F880 HydrophobicContact CB-CE1 4.21Å; K820-F880 HydrophobicContact CB-CZ 4.13Å
821	D	88.9	Confident	90.6	Very high	4 Å²	4	33.9 Å²	33.9	2%	0.021	17%	0.168	C	C	.	.			trans	-86.9	85.2	-178.5	-177.9	11.3	0	0	0	111.5	I817 H818 N823 G824 F825 F880 E881	I817-D821 HydrophobicContact CG2-CB 3.87Å; H818-D821 HydrophobicContact CB-CB 4.4Å; H818-D821 WeakPolarHBondContact O-CB 3.33Å; H818-D821 PolarHBondContact O-N 3.2Å; D821-N823 VanDerWaalsContact C-N 3.32Å; D821-N823 PolarHBondContact O-N 3.23Å; D821-N823 PolarHBondContact OD1-N 3.02Å; D821-G824 VanDerWaalsContact CG-N 3.32Å; D821-G824 PolarHBondContact O-N 3.47Å; D821-G824 PolarHBondContact OD1-N 3.16Å; D821-G824 WeakPolarHBondContact OD2-CA 3.3Å; D821-G824 PolarHBondContact OD2-N 2.86Å; D821-F825 WeakPolarHBondContact O-CD2 3.42Å; D821-F825 PolarHBondContact O-N 2.97Å; D821-F825 VanDerWaalsContact O-N 3.16Å; D821-F880 HydrophobicContact CB-CD1 3.87Å; D821-F880 HydrophobicContact CB-CE1 4.03Å; D821-F880 HydrophobicContact CB-CG 4.16Å; D821-F880 HydrophobicContact CB-CZ 4.46Å; D821-E881 PolarHBondContact OD2-N 3.34Å
822	V	90.3	Very high	90.6	Very high	88 Å²	88	33.9 Å²	33.9	53%	0.533	17%	0.168	S	C	.	.	H	α-helix	trans	-60.9	-41	-179.5	-179	0	0	0	0	111.7	K820 F825 R826	K820-V822 PolarHBondContact O-N 3.46Å; V822-F825 PolarHBondContact O-N 2.9Å; V822-R826 WeakPolarHBondContact O-CG 3.31Å; V822-R826 PolarHBondContact O-N 3.04Å
823	N	91.6	Very high	90.7	Very high	36 Å²	36	31.3 Å²	31.3	19%	0.193	16%	0.156	C	C	.	.	H	α-helix	trans	-68	-41	179.8	-73.1	-19	0	0	0	111.1	D821 F825 R826 W827 E881 E882	D821-N823 VanDerWaalsContact C-N 3.32Å; D821-N823 PolarHBondContact O-N 3.23Å; D821-N823 PolarHBondContact OD1-N 3.02Å; N823-F825 VanDerWaalsContact C-N 3.31Å; N823-F825 PolarHBondContact O-N 3.33Å; N823-R826 WeakPolarHBondContact O-CB 3.47Å; N823-R826 PolarHBondContact O-N 3.21Å; N823-R826 VanDerWaalsContact O-N 3.14Å; N823-W827 VanDerWaalsContact O-CD1 3.32Å; N823-W827 PolarHBondContact O-N 3.19Å; N823-E881 HydrophobicContact CB-CB 3.91Å; N823-E881 WeakPolarHBondContact CB-O 3.4Å; N823-E881 PolarHBondContact ND2-O 3.42Å; N823-E882 PolarHBondContact ND2-O 2.94Å
824	G	91.4	Very high	90.8	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-55	-46.2	172.9	0	0	0	0	0	112	I817 D821 R826 W827 A828	I817-G824 WeakPolarHBondContact CD1-O 3.23Å; D821-G824 VanDerWaalsContact CG-N 3.32Å; D821-G824 PolarHBondContact O-N 3.47Å; D821-G824 PolarHBondContact OD1-N 3.16Å; D821-G824 WeakPolarHBondContact OD2-CA 3.3Å; D821-G824 PolarHBondContact OD2-N 2.86Å; G824-R826 PolarHBondContact O-N 3.39Å; G824-W827 PolarHBondContact O-N 2.94Å; G824-A828 WeakPolarHBondContact O-CB 3.23Å; G824-A828 PolarHBondContact O-N 3.43Å
825	F	91.9	Very high	91	Very high	33 Å²	33	31.4 Å²	31.4	15%	0.145	16%	0.157	C	C	.	.	H	α-helix	trans	-65	-37.4	176	-76.6	-66.2	0	0	0	113.5	F814 I817 H818 D821 V822 N823 A828 S829 L901	F814-F825 AromaticContact CD1-CD1 3.82Å; F814-F825 HydrophobicContact CD1-CD1 3.82Å; F814-F825 HydrophobicContact CD1-CE1 4.01Å; F814-F825 HydrophobicContact CE1-CD1 4.24Å; I817-F825 HydrophobicContact CB-CZ 4.34Å; I817-F825 HydrophobicContact CG2-CD2 4.17Å; I817-F825 HydrophobicContact CG2-CE1 4.43Å; I817-F825 HydrophobicContact CG2-CE2 3.92Å; I817-F825 HydrophobicContact CG2-CG 4.49Å; I817-F825 HydrophobicContact CG2-CZ 4.03Å; H818-F825 WeakPolarHBondContact O-CE2 3.12Å; D821-F825 WeakPolarHBondContact O-CD2 3.42Å; D821-F825 PolarHBondContact O-N 2.97Å; D821-F825 VanDerWaalsContact O-N 3.16Å; V822-F825 PolarHBondContact O-N 2.9Å; N823-F825 VanDerWaalsContact C-N 3.31Å; N823-F825 PolarHBondContact O-N 3.33Å; F825-A828 PolarHBondContact O-N 3.15Å; F825-S829 WeakPolarHBondContact O-CB 3.04Å; F825-S829 PolarHBondContact O-N 3.37Å; F825-S829 PolarHBondContact O-OG 3.19Å; F825-L901 HydrophobicContact CB-CD1 4.32Å
826	R	92.7	Very high	91.3	Very high	93 Å²	93	29.6 Å²	29.6	35%	0.351	15%	0.15	S	C	.	.	H	α-helix	trans	-60.8	-48.9	173.7	-71.3	174.3	174.6	-169.2	-2.8	111	V822 N823 G824 S829 L830 P885 L890 L901	V822-R826 WeakPolarHBondContact O-CG 3.31Å; V822-R826 PolarHBondContact O-N 3.04Å; N823-R826 WeakPolarHBondContact O-CB 3.47Å; N823-R826 PolarHBondContact O-N 3.21Å; N823-R826 VanDerWaalsContact O-N 3.14Å; G824-R826 PolarHBondContact O-N 3.39Å; R826-S829 PolarHBondContact O-N 2.88Å; R826-L830 WeakPolarHBondContact O-CB 3.16Å; R826-L830 PolarHBondContact O-N 3.46Å; R826-P885 HydrophobicContact CB-CG 3.67Å; R826-L890 HydrophobicContact CB-CD1 4.46Å; R826-L890 HydrophobicContact CB-CD2 4.38Å; R826-L890 HydrophobicContact CG-CD1 4.27Å; R826-L901 HydrophobicContact CB-CD1 4.44Å; R826-L901 HydrophobicContact CG-CD1 3.73Å; R826-L901 HydrophobicContact CG-CD2 4.37Å
827	W	94.4	Very high	91.5	Very high	11 Å²	11	35 Å²	35	4%	0.042	17%	0.171	C	C	.	.	H	α-helix	trans	-62.1	-46	176.5	-82.1	116.2	0	0	0	112.8	L784 Q785 Y788 N823 G824 S829 L830 I831 E883 P885	L784-W827 HydrophobicContact CB-CB 3.67Å; L784-W827 HydrophobicContact CB-CG 3.97Å; L784-W827 HydrophobicContact CD1-CB 3.71Å; L784-W827 HydrophobicContact CG-CB 4.34Å; Q785-W827 HydrophobicContact CB-CH2 4.24Å; Q785-W827 HydrophobicContact CB-CZ2 4.05Å; Q785-W827 HydrophobicContact CG-CH2 3.95Å; Q785-W827 HydrophobicContact CG-CZ2 3.99Å; Y788-W827 HydrophobicContact CD1-CE3 4.44Å; Y788-W827 HydrophobicContact CD1-CH2 4.15Å; Y788-W827 AromaticContact CD1-CZ3 3.45Å; Y788-W827 HydrophobicContact CD1-CZ3 3.45Å; Y788-W827 VanDerWaalsContact CD1-CZ3 3.45Å; Y788-W827 HydrophobicContact CE1-CZ3 4.08Å; Y788-W827 HydrophobicContact CG-CE3 4.26Å; Y788-W827 AromaticContact CG-CZ3 3.68Å; Y788-W827 HydrophobicContact CG-CZ3 3.68Å; N823-W827 VanDerWaalsContact O-CD1 3.32Å; N823-W827 PolarHBondContact O-N 3.19Å; G824-W827 PolarHBondContact O-N 2.94Å; W827-S829 VanDerWaalsContact C-N 3.32Å; W827-S829 PolarHBondContact O-N 2.97Å; W827-L830 HydrophobicContact CE3-CD2 4.05Å; W827-L830 HydrophobicContact CZ3-CD2 3.89Å; W827-L830 PolarHBondContact O-N 3.21Å; W827-I831 WeakPolarHBondContact O-CB 3.48Å; W827-I831 WeakPolarHBondContact O-CD1 3.36Å; W827-I831 VanDerWaalsContact O-CG1 3.25Å; W827-I831 WeakPolarHBondContact O-CG1 3.3Å; W827-I831 PolarHBondContact O-N 3.39Å; W827-E883 PolarHBondContact NE1-O 2.86Å; W827-P885 HydrophobicContact CD2-CB 4.04Å; W827-P885 HydrophobicContact CD2-CG 4.28Å; W827-P885 HydrophobicContact CE3-CB 4.06Å; W827-P885 HydrophobicContact CH2-CB 3.89Å; W827-P885 HydrophobicContact CZ2-CB 3.89Å; W827-P885 HydrophobicContact CZ3-CB 3.96Å
828	A	93.6	Very high	91.6	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-61.6	-41.2	178.5	0	0	0	0	0	112.2	L813 F814 I817 G824 F825 I831 L832	L813-A828 HydrophobicContact CB-CB 4.03Å; L813-A828 HydrophobicContact CD1-CB 4.29Å; F814-A828 HydrophobicContact CD2-CB 4.44Å; F814-A828 HydrophobicContact CE1-CB 4.23Å; F814-A828 HydrophobicContact CE2-CB 4.07Å; F814-A828 HydrophobicContact CZ-CB 3.96Å; I817-A828 HydrophobicContact CD1-CB 3.53Å; G824-A828 WeakPolarHBondContact O-CB 3.23Å; G824-A828 PolarHBondContact O-N 3.43Å; F825-A828 PolarHBondContact O-N 3.15Å; A828-I831 PolarHBondContact O-N 2.82Å; A828-L832 WeakPolarHBondContact O-CB 2.91Å; A828-L832 PolarHBondContact O-N 2.9Å
829	S	92.7	Very high	91.7	Very high	3 Å²	3	39.3 Å²	39.3	2%	0.021	20%	0.201	C	C	.	.	H	α-helix	trans	-66.8	-40.9	176.8	-51.3	0	0	0	0	111.3	F825 R826 W827 L832 A833	F825-S829 WeakPolarHBondContact O-CB 3.04Å; F825-S829 PolarHBondContact O-N 3.37Å; F825-S829 PolarHBondContact O-OG 3.19Å; R826-S829 PolarHBondContact O-N 2.88Å; W827-S829 VanDerWaalsContact C-N 3.32Å; W827-S829 PolarHBondContact O-N 2.97Å; S829-L832 PolarHBondContact O-N 2.86Å; S829-A833 VanDerWaalsContact O-CB 3.28Å; S829-A833 WeakPolarHBondContact O-CB 3.39Å; S829-A833 PolarHBondContact O-N 2.71Å
830	L	93.7	Very high	92	Very high	5 Å²	5	36 Å²	36	3%	0.026	18%	0.179	C	C	.	.	H	α-helix	trans	-62.5	-46	174.1	-178.3	60.2	0	0	0	112.7	Y788 R826 W827 A833 T834 P885 E889 L890 I893	Y788-L830 HydrophobicContact CD2-CD2 4.27Å; Y788-L830 HydrophobicContact CD2-CG 4.14Å; Y788-L830 HydrophobicContact CE1-CD2 4.06Å; Y788-L830 HydrophobicContact CE2-CD1 4.2Å; Y788-L830 HydrophobicContact CE2-CD2 3.9Å; Y788-L830 HydrophobicContact CE2-CG 3.7Å; R826-L830 WeakPolarHBondContact O-CB 3.16Å; R826-L830 PolarHBondContact O-N 3.46Å; W827-L830 HydrophobicContact CE3-CD2 4.05Å; W827-L830 HydrophobicContact CZ3-CD2 3.89Å; W827-L830 PolarHBondContact O-N 3.21Å; L830-A833 PolarHBondContact O-N 3.46Å; L830-T834 VanDerWaalsContact O-CB 3.29Å; L830-T834 WeakPolarHBondContact O-CB 3.47Å; L830-T834 PolarHBondContact O-N 3.36Å; L830-T834 PolarHBondContact O-OG1 3.29Å; L830-P885 HydrophobicContact CD2-CB 3.7Å; L830-P885 HydrophobicContact CD2-CG 4.48Å; L830-E889 HydrophobicContact CD1-CB 3.94Å; L830-E889 HydrophobicContact CD2-CB 4.2Å; L830-E889 WeakPolarHBondContact CD2-OE2 3.34Å; L830-L890 HydrophobicContact CB-CD2 4.41Å; L830-I893 VanDerWaalsContact CA-CD1 3.48Å; L830-I893 HydrophobicContact CB-CD1 4.14Å; L830-I893 HydrophobicContact CD1-CD1 3.86Å
831	I	94.6	Very high	92.1	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-58.9	-49.3	174.5	-71	163	0	0	0	110.5	F778 L784 T787 Y788 I791 A810 L813 W827 A828 T834 I835	F778-I831 HydrophobicContact CE1-CG2 4.41Å; L784-I831 HydrophobicContact CB-CD1 4.15Å; L784-I831 HydrophobicContact CD2-CD1 4.2Å; T787-I831 HydrophobicContact CG2-CD1 3.96Å; Y788-I831 HydrophobicContact CD2-CG1 4.4Å; I791-I831 HydrophobicContact CG1-CG2 4.15Å; I791-I831 HydrophobicContact CG2-CG2 4.5Å; A810-I831 HydrophobicContact CB-CG2 3.94Å; L813-I831 HydrophobicContact CD1-CD1 4Å; L813-I831 HydrophobicContact CD1-CG2 4.41Å; W827-I831 WeakPolarHBondContact O-CB 3.48Å; W827-I831 WeakPolarHBondContact O-CD1 3.36Å; W827-I831 VanDerWaalsContact O-CG1 3.25Å; W827-I831 WeakPolarHBondContact O-CG1 3.3Å; W827-I831 PolarHBondContact O-N 3.39Å; A828-I831 PolarHBondContact O-N 2.82Å; I831-T834 PolarHBondContact O-N 3.14Å; I831-I835 HydrophobicContact CG2-CD1 3.85Å; I831-I835 VanDerWaalsContact O-CG1 3.27Å; I831-I835 WeakPolarHBondContact O-CG1 3.41Å; I831-I835 PolarHBondContact O-N 3.14Å
832	L	94.1	Very high	92.2	Very high	0 Å²	0	32 Å²	32	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-60.7	-48.2	179.9	-170.5	73.9	0	0	0	111.7	F807 A810 T811 F814 A828 S829 T834 I835 L836 A904 L907	F807-L832 HydrophobicContact CD2-CD1 3.74Å; F807-L832 HydrophobicContact CE2-CD1 3.34Å; F807-L832 HydrophobicContact CE2-CG 4.06Å; F807-L832 HydrophobicContact CZ-CD1 4.17Å; A810-L832 HydrophobicContact CB-CD1 3.94Å; T811-L832 WeakPolarHBondContact OG1-CD1 3.35Å; F814-L832 HydrophobicContact CE2-CB 4.33Å; F814-L832 HydrophobicContact CE2-CD2 3.94Å; F814-L832 HydrophobicContact CZ-CD2 4.23Å; A828-L832 WeakPolarHBondContact O-CB 2.91Å; A828-L832 PolarHBondContact O-N 2.9Å; S829-L832 PolarHBondContact O-N 2.86Å; L832-T834 VanDerWaalsContact C-N 3.32Å; L832-T834 PolarHBondContact O-N 2.84Å; L832-I835 PolarHBondContact O-N 3.24Å; L832-L836 WeakPolarHBondContact O-CG 3.35Å; L832-L836 PolarHBondContact O-N 3.07Å; L832-A904 HydrophobicContact CD2-CB 3.79Å; L832-L907 HydrophobicContact CD2-CB 4.38Å; L832-L907 HydrophobicContact CD2-CD1 4.1Å
833	A	92.7	Very high	92.1	Very high	8 Å²	8	28.1 Å²	28.1	7%	0.066	14%	0.138	C	C	.	.	H	α-helix	trans	-63.5	-37.4	178.9	0	0	0	0	0	112.3	S829 L830 L836 K837 I893	S829-A833 VanDerWaalsContact O-CB 3.28Å; S829-A833 WeakPolarHBondContact O-CB 3.39Å; S829-A833 PolarHBondContact O-N 2.71Å; L830-A833 PolarHBondContact O-N 3.46Å; A833-L836 PolarHBondContact O-N 2.73Å; A833-K837 WeakPolarHBondContact O-CB 3.38Å; A833-K837 WeakPolarHBondContact O-CG 3.49Å; A833-K837 PolarHBondContact O-N 3.01Å; A833-I893 HydrophobicContact CB-CD1 3.52Å; A833-I893 HydrophobicContact CB-CG1 3.78Å
834	T	93.7	Very high	92	Very high	20 Å²	20	27.6 Å²	27.6	12%	0.123	13%	0.133	C	C	.	.	H	α-helix	trans	-66.9	-43.1	178.4	-58.1	0	0	0	0	111	Y788 I791 L830 I831 L832 L836 K837 R838	Y788-T834 HydrophobicContact CE2-CG2 4.32Å; I791-T834 HydrophobicContact CG2-CG2 3.99Å; L830-T834 VanDerWaalsContact O-CB 3.29Å; L830-T834 WeakPolarHBondContact O-CB 3.47Å; L830-T834 PolarHBondContact O-N 3.36Å; L830-T834 PolarHBondContact O-OG1 3.29Å; I831-T834 PolarHBondContact O-N 3.14Å; L832-T834 VanDerWaalsContact C-N 3.32Å; L832-T834 PolarHBondContact O-N 2.84Å; T834-L836 VanDerWaalsContact C-N 3.32Å; T834-L836 PolarHBondContact O-N 2.61Å; T834-K837 PolarHBondContact O-N 3.32Å; T834-R838 VanDerWaalsContact O-CG 3.3Å; T834-R838 WeakPolarHBondContact O-CG 3.37Å; T834-R838 PolarHBondContact O-N 2.93Å
835	I	93.7	Very high	91.7	Very high	1 Å²	1	28.6 Å²	28.6	1%	0.005	14%	0.137	C	C	.	.	H	α-helix	trans	-62.2	-40.8	175.4	-64.8	166.3	0	0	0	110.9	I791 L806 F807 A810 I831 L832 R838 V840	I791-I835 HydrophobicContact CD1-CD1 3.77Å; I791-I835 HydrophobicContact CD1-CG1 3.98Å; I791-I835 HydrophobicContact CG1-CD1 4.33Å; I791-I835 HydrophobicContact CG1-CG1 4.47Å; I791-I835 HydrophobicContact CG2-CD1 4.16Å; I791-I835 HydrophobicContact CG2-CG1 3.49Å; I791-I835 VanDerWaalsContact CG2-CG1 3.49Å; L806-I835 HydrophobicContact CB-CD1 4.5Å; F807-I835 HydrophobicContact CB-CG2 4.27Å; F807-I835 HydrophobicContact CD2-CB 4.49Å; F807-I835 HydrophobicContact CD2-CG2 3.92Å; A810-I835 HydrophobicContact CB-CD1 3.51Å; I831-I835 HydrophobicContact CG2-CD1 3.85Å; I831-I835 VanDerWaalsContact O-CG1 3.27Å; I831-I835 WeakPolarHBondContact O-CG1 3.41Å; I831-I835 PolarHBondContact O-N 3.14Å; L832-I835 PolarHBondContact O-N 3.24Å; I835-R838 PolarHBondContact O-N 3.39Å; I835-V840 HydrophobicContact CG2-CB 3.62Å; I835-V840 HydrophobicContact CG2-CG1 3.65Å; I835-V840 HydrophobicContact CG2-CG2 3.93Å; I835-V840 PolarHBondContact O-N 3.23Å
836	L	91.7	Very high	91.4	Very high	9 Å²	9	27.1 Å²	27.1	5%	0.047	13%	0.131	C	C	.	.	H	α-helix	trans	-63.2	-46.9	175.2	-75.4	169.9	0	0	0	112.4	F807 L832 A833 T834 R838 G839 V840 I842 L907 H911	F807-L836 HydrophobicContact CE2-CD1 4.24Å; F807-L836 HydrophobicContact CE2-CD2 3.64Å; F807-L836 HydrophobicContact CE2-CG 3.69Å; F807-L836 HydrophobicContact CZ-CD1 4.46Å; F807-L836 HydrophobicContact CZ-CD2 3.58Å; F807-L836 HydrophobicContact CZ-CG 4.09Å; L832-L836 WeakPolarHBondContact O-CG 3.35Å; L832-L836 PolarHBondContact O-N 3.07Å; A833-L836 PolarHBondContact O-N 2.73Å; T834-L836 VanDerWaalsContact C-N 3.32Å; T834-L836 PolarHBondContact O-N 2.61Å; L836-R838 PolarHBondContact O-N 3.45Å; L836-G839 PolarHBondContact O-N 3.36Å; L836-V840 HydrophobicContact CD2-CG1 4.23Å; L836-I842 HydrophobicContact CD2-CG2 3.73Å; L836-L907 HydrophobicContact CD1-CB 4.33Å; L836-H911 HydrophobicContact CD1-CB 4.47Å; L836-H911 HydrophobicContact CD2-CB 4.17Å
837	K	90.4	Very high	90.8	Very high	134 Å²	134	25 Å²	25	58%	0.583	13%	0.125	S	C	*	.	H	α-helix	trans	-60.5	-32.4	177.4	-75.7	175.1	176.8	-177.4	0	112.4	A833 T834 G839 D892	A833-K837 WeakPolarHBondContact O-CB 3.38Å; A833-K837 WeakPolarHBondContact O-CG 3.49Å; A833-K837 PolarHBondContact O-N 3.01Å; T834-K837 PolarHBondContact O-N 3.32Å; K837-G839 PolarHBondContact O-N 3.46Å; K837-D892 WeakPolarHBondContact CE-OD2 3.41Å; K837-D892 IonicContact NZ-OD2 3.85Å; K837-D892 PolarHBondContact NZ-OD2 3.22Å
838	R	92.7	Very high	90.1	Very high	91 Å²	91	31 Å²	31	34%	0.343	15%	0.148	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.6	5.9	177	-66.7	-175.6	76.5	-148.6	-2.1	114	I791 K792 E793 V794 V796 T834 I835 L836	I791-R838 PolarHBondContact O-NH1 2.75Å; K792-R838 PolarHBondContact O-NE 3.47Å; K792-R838 PolarHBondContact O-NH1 2.86Å; K792-R838 PolarHBondContact O-NH2 3.4Å; E793-R838 PolarHBondContact O-NH2 2.9Å; V794-R838 PolarHBondContact O-NH1 2.9Å; V794-R838 PolarHBondContact O-NH2 3.43Å; V796-R838 HydrophobicContact CG1-CB 3.67Å; T834-R838 VanDerWaalsContact O-CG 3.3Å; T834-R838 WeakPolarHBondContact O-CG 3.37Å; T834-R838 PolarHBondContact O-N 2.93Å; I835-R838 PolarHBondContact O-N 3.39Å; L836-R838 PolarHBondContact O-N 3.45Å
839	G	88.7	Confident	89.3	Confident	50 Å²	50	33.1 Å²	33.1	52%	0.515	16%	0.158	S	C	.	.	T	Hydrogen-bonded Turn	trans	80.8	35.4	170.1	0	0	0	0	0	114.7	L836 K837	L836-G839 PolarHBondContact O-N 3.36Å; K837-G839 PolarHBondContact O-N 3.46Å
840	V	90.6	Very high	88.9	Confident	6 Å²	6	35 Å²	35	4%	0.036	17%	0.165	C	C	.	.			trans	-62.9	142.4	175.3	77.1	0	0	0	0	111.5	V796 F807 I835 L836 I842	V796-V840 HydrophobicContact CB-CB 4.41Å; V796-V840 HydrophobicContact CB-CG2 4.43Å; F807-V840 HydrophobicContact CB-CG1 4.24Å; F807-V840 HydrophobicContact CB-CG2 3.98Å; F807-V840 HydrophobicContact CD1-CG1 4.33Å; F807-V840 HydrophobicContact CD2-CG1 3.87Å; F807-V840 HydrophobicContact CE2-CG1 4.27Å; F807-V840 HydrophobicContact CG-CG1 3.91Å; I835-V840 HydrophobicContact CG2-CB 3.62Å; I835-V840 HydrophobicContact CG2-CG1 3.65Å; I835-V840 HydrophobicContact CG2-CG2 3.93Å; I835-V840 PolarHBondContact O-N 3.23Å; L836-V840 HydrophobicContact CD2-CG1 4.23Å; V840-I842 HydrophobicContact CG1-CG2 4.15Å; V840-I842 PolarHBondContact O-N 3.09Å
841	K	90	Very high	88.6	Confident	77 Å²	77	34.9 Å²	34.9	34%	0.335	16%	0.164	S	C	.	.			trans	-77.2	108	170.9	-70.7	164.6	164.9	-168	0	109.5	Y843 Y844	K841-Y843 VanDerWaalsContact C-N 3.25Å; K841-Y843 HydrophobicContact CB-CD1 4.11Å; K841-Y843 HydrophobicContact CB-CE1 3.68Å; K841-Y843 HydrophobicContact CB-CE2 4.19Å; K841-Y843 HydrophobicContact CD-CE1 4.17Å; K841-Y843 HydrophobicContact CD-CE2 4.32Å; K841-Y843 WeakPolarHBondContact CD-OH 3.19Å; K841-Y843 WeakPolarHBondContact CE-OH 3.39Å; K841-Y843 HydrophobicContact CG-CE1 3.68Å; K841-Y843 PolarHBondContact NZ-OH 3.43Å; K841-Y843 PolarHBondContact O-N 2.94Å; K841-Y844 HydrophobicContact CB-CD1 4.37Å; K841-Y844 HydrophobicContact CB-CD2 3.59Å; K841-Y844 HydrophobicContact CB-CE1 4.16Å; K841-Y844 HydrophobicContact CB-CE2 3.38Å; K841-Y844 HydrophobicContact CB-CG 4.14Å; K841-Y844 HydrophobicContact CD-CE1 3.89Å; K841-Y844 HydrophobicContact CD-CE2 3.78Å; K841-Y844 WeakPolarHBondContact CD-OH 3.43Å; K841-Y844 HydrophobicContact CG-CE2 4.13Å; K841-Y844 WeakPolarHBondContact O-CD2 3.39Å
842	I	91	Very high	88.3	Confident	6 Å²	6	34.9 Å²	34.9	3%	0.031	16%	0.164	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.2	-15.3	-176.2	63.3	172.8	0	0	0	113.7	F807 L836 V840 Y844 V912 L927 Y932	F807-I842 HydrophobicContact CD1-CB 4.47Å; F807-I842 HydrophobicContact CD1-CG2 4.28Å; F807-I842 HydrophobicContact CE1-CB 3.92Å; F807-I842 HydrophobicContact CE1-CG2 3.65Å; F807-I842 HydrophobicContact CZ-CG2 3.95Å; L836-I842 HydrophobicContact CD2-CG2 3.73Å; V840-I842 HydrophobicContact CG1-CG2 4.15Å; V840-I842 PolarHBondContact O-N 3.09Å; I842-Y844 VanDerWaalsContact C-N 3.34Å; I842-V912 HydrophobicContact CD1-CG2 3.35Å; I842-L927 HydrophobicContact CD1-CD1 4.35Å; I842-L927 HydrophobicContact CD1-CD2 3.72Å; I842-L927 HydrophobicContact CG1-CD2 3.46Å; I842-L927 VanDerWaalsContact CG1-CD2 3.46Å; I842-Y932 HydrophobicContact CD1-CD1 4.49Å; I842-Y932 HydrophobicContact CD1-CE1 3.99Å; I842-Y932 HydrophobicContact CD1-CE2 4.16Å; I842-Y932 HydrophobicContact CG1-CE2 4.24Å
843	Y	88	Confident	88	Confident	7 Å²	7	35.6 Å²	35.6	3%	0.027	17%	0.167	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.6	-5.9	-177.5	57.7	-104.9	0	0	0	114	K841 E926 L927 Y930	K841-Y843 VanDerWaalsContact C-N 3.25Å; K841-Y843 HydrophobicContact CB-CD1 4.11Å; K841-Y843 HydrophobicContact CB-CE1 3.68Å; K841-Y843 HydrophobicContact CB-CE2 4.19Å; K841-Y843 HydrophobicContact CD-CE1 4.17Å; K841-Y843 HydrophobicContact CD-CE2 4.32Å; K841-Y843 WeakPolarHBondContact CD-OH 3.19Å; K841-Y843 WeakPolarHBondContact CE-OH 3.39Å; K841-Y843 HydrophobicContact CG-CE1 3.68Å; K841-Y843 PolarHBondContact NZ-OH 3.43Å; K841-Y843 PolarHBondContact O-N 2.94Å; Y843-E926 HydrophobicContact CE1-CB 4.23Å; Y843-L927 HydrophobicContact CD1-CD2 3.77Å; Y843-L927 HydrophobicContact CG-CD2 4.42Å; Y843-Y930 VanDerWaalsContact CD2-CB 3.47Å; Y843-Y930 AromaticContact CD2-CD1 3.51Å; Y843-Y930 HydrophobicContact CD2-CD1 3.51Å; Y843-Y930 HydrophobicContact CD2-CD2 4.39Å; Y843-Y930 HydrophobicContact CD2-CE1 4.3Å; Y843-Y930 AromaticContact CD2-CG 3.55Å; Y843-Y930 HydrophobicContact CD2-CG 3.55Å; Y843-Y930 AromaticContact CE2-CD1 3.19Å; Y843-Y930 HydrophobicContact CE2-CD1 3.19Å; Y843-Y930 AromaticContact CE2-CD2 3.96Å; Y843-Y930 HydrophobicContact CE2-CD2 3.96Å; Y843-Y930 AromaticContact CE2-CE1 3.53Å; Y843-Y930 HydrophobicContact CE2-CE1 3.53Å; Y843-Y930 HydrophobicContact CE2-CE2 4.25Å; Y843-Y930 AromaticContact CE2-CG 3.42Å; Y843-Y930 HydrophobicContact CE2-CG 3.42Å; Y843-Y930 VanDerWaalsContact CE2-CG 3.42Å; Y843-Y930 HydrophobicContact CG-CG 4.22Å; Y843-Y930 AromaticContact CZ-CG 3.97Å
844	Y	89.5	Confident	87.7	Confident	25 Å²	25	36.8 Å²	36.8	10%	0.098	17%	0.172	C	C	.	.			trans	-59.3	142.7	179.6	-71.8	-42	0	0	0	111.7	H808 K841 I842 T851 E1006	H808-Y844 PolarHBondContact CE1-O 3.36Å; H808-Y844 PolarHBondContact NE2-O 2.88Å; K841-Y844 HydrophobicContact CB-CD1 4.37Å; K841-Y844 HydrophobicContact CB-CD2 3.59Å; K841-Y844 HydrophobicContact CB-CE1 4.16Å; K841-Y844 HydrophobicContact CB-CE2 3.38Å; K841-Y844 HydrophobicContact CB-CG 4.14Å; K841-Y844 HydrophobicContact CD-CE1 3.89Å; K841-Y844 HydrophobicContact CD-CE2 3.78Å; K841-Y844 WeakPolarHBondContact CD-OH 3.43Å; K841-Y844 HydrophobicContact CG-CE2 4.13Å; K841-Y844 WeakPolarHBondContact O-CD2 3.39Å; I842-Y844 VanDerWaalsContact C-N 3.34Å; Y844-T851 WeakPolarHBondContact O-CA 3.45Å; Y844-E1006 WeakPolarHBondContact CA-OE1 3.47Å; Y844-E1006 WeakPolarHBondContact CD1-OE1 3.38Å
845	R	85.8	Confident	87.3	Confident	21 Å²	21	36.1 Å²	36.1	8%	0.079	17%	0.168	C	C	.	.	B	Isolated β-bridge	trans	-118	141.2	-179.5	-66.4	177.3	-176	-83.3	0.2	111.9	E849 R850 T851 D854 G931 N933 W1004 E1006	R845-E849 PolarHBondContact NH1-O 3.17Å; R845-R850 WeakPolarHBondContact CA-O 3.16Å; R845-T851 HydrophobicContact CG-CG2 3.94Å; R845-D854 IonicContact NH1-OD2 3.57Å; R845-G931 PolarHBondContact NH2-O 2.95Å; R845-N933 PolarHBondContact NH2-OD1 3.4Å; R845-W1004 WeakPolarHBondContact CD-O 3.38Å; R845-E1006 PolarHBondContact N-OE1 3.15Å; R845-E1006 VanDerWaalsContact N-OE1 3.1Å
846	D	85.1	Confident	86.8	Confident	3 Å²	3	37.2 Å²	37.2	2%	0.016	17%	0.173	C	C	.	.			trans	-78	175.2	169.9	66.8	19.9	0	0	0	112.1	S804 W848 E849 R850	S804-D846 WeakPolarHBondContact OG-CB 3.48Å; D846-W848 HydrophobicContact CB-CE3 4.06Å; D846-W848 PolarHBondContact O-N 3.4Å; D846-W848 VanDerWaalsContact OD1-CA 3.26Å; D846-W848 WeakPolarHBondContact OD1-CA 3.47Å; D846-W848 WeakPolarHBondContact OD1-CB 3.23Å; D846-W848 PolarHBondContact OD1-N 3.09Å; D846-E849 PolarHBondContact O-N 3.32Å; D846-E849 PolarHBondContact OD1-N 2.9Å; D846-E849 VanDerWaalsContact OD1-N 3.17Å; D846-R850 PolarHBondContact N-O 3.25Å; D846-R850 PolarHBondContact OD1-N 3.35Å; D846-R850 IonicContact OD1-NE 3.48Å; D846-R850 IonicContact OD2-CZ 2.68Å; D846-R850 VanDerWaalsContact OD2-CZ 3.29Å; D846-R850 IonicContact OD2-NE 3.35Å; D846-R850 PolarHBondContact OD2-NE 3.27Å; D846-R850 VanDerWaalsContact OD2-NE 3.07Å; D846-R850 IonicContact OD2-NH2 2.76Å; D846-R850 PolarHBondContact OD2-NH2 3.16Å
847	I	80.8	Confident	85.9	Confident	47 Å²	47	41.7 Å²	41.7	24%	0.241	20%	0.197	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.7	-14.1	174.4	53.5	173.5	0	0	0	114.6	N802 L1039	N802-I847 HydrophobicContact CB-CD1 3.75Å; N802-I847 HydrophobicContact CB-CG1 3.95Å; N802-I847 WeakPolarHBondContact O-CG2 3.31Å; N802-I847 PolarHBondContact O-N 2.7Å; I847-L1039 HydrophobicContact CG2-CD1 4.21Å; I847-L1039 HydrophobicContact CG2-CD2 3.32Å; I847-L1039 HydrophobicContact CG2-CG 3.97Å
848	W	78.9	Confident	84.7	Confident	138 Å²	138	42.4 Å²	42.4	52%	0.523	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	-102.1	17	179.1	-56.1	-78.3	0	0	0	112.4	N802 D846 R850	N802-W848 HydrophobicContact CB-CH2 4.44Å; N802-W848 HydrophobicContact CB-CZ3 4.35Å; D846-W848 HydrophobicContact CB-CE3 4.06Å; D846-W848 PolarHBondContact O-N 3.4Å; D846-W848 VanDerWaalsContact OD1-CA 3.26Å; D846-W848 WeakPolarHBondContact OD1-CA 3.47Å; D846-W848 WeakPolarHBondContact OD1-CB 3.23Å; D846-W848 PolarHBondContact OD1-N 3.09Å; W848-R850 VanDerWaalsContact CE3-NH2 3.27Å; W848-R850 PolarHBondContact O-N 2.86Å
849	E	77.9	Confident	82.9	Confident	44 Å²	44	41.8 Å²	41.8	21%	0.206	21%	0.206	C	C	.	.	S	Bend	trans	72.8	5.2	175.3	-34.9	-169.7	165.8	0	0	115	R845 D846 W1004	R845-E849 PolarHBondContact NH1-O 3.17Å; D846-E849 PolarHBondContact O-N 3.32Å; D846-E849 PolarHBondContact OD1-N 2.9Å; D846-E849 VanDerWaalsContact OD1-N 3.17Å; E849-W1004 HydrophobicContact CB-CE3 4.12Å; E849-W1004 HydrophobicContact CB-CZ3 4.35Å; E849-W1004 VanDerWaalsContact CD-CZ3 3.5Å; E849-W1004 HydrophobicContact CG-CE3 3.58Å; E849-W1004 HydrophobicContact CG-CH2 4.22Å; E849-W1004 HydrophobicContact CG-CZ3 3.38Å; E849-W1004 WeakPolarHBondContact OE1-CH2 3.4Å; E849-W1004 WeakPolarHBondContact OE1-CZ3 2.86Å
850	R	83.7	Confident	81.3	Confident	44 Å²	44	45 Å²	45	17%	0.166	20%	0.203	C	C	.	.			trans	-92.1	132.1	-172.9	-61.5	173.6	-56.3	165	5.8	109.4	H808 R845 D846 W848 D854 I855	H808-R850 PolarHBondContact NE2-O 3.36Å; R845-R850 WeakPolarHBondContact CA-O 3.16Å; D846-R850 PolarHBondContact N-O 3.25Å; D846-R850 PolarHBondContact OD1-N 3.35Å; D846-R850 IonicContact OD1-NE 3.48Å; D846-R850 IonicContact OD2-CZ 2.68Å; D846-R850 VanDerWaalsContact OD2-CZ 3.29Å; D846-R850 IonicContact OD2-NE 3.35Å; D846-R850 PolarHBondContact OD2-NE 3.27Å; D846-R850 VanDerWaalsContact OD2-NE 3.07Å; D846-R850 IonicContact OD2-NH2 2.76Å; D846-R850 PolarHBondContact OD2-NH2 3.16Å; W848-R850 VanDerWaalsContact CE3-NH2 3.27Å; W848-R850 PolarHBondContact O-N 2.86Å; R850-D854 HydrophobicContact CB-CB 3.9Å; R850-D854 HydrophobicContact CG-CB 4.23Å; R850-I855 HydrophobicContact CB-CG1 4.44Å
851	T	88.1	Confident	79	Confident	1 Å²	1	53.3 Å²	53.3	1%	0.006	24%	0.235	C	C	.	.	B	Isolated β-bridge	trans	-72.8	163.5	156.4	66.2	0	0	0	0	109.5	Y844 R845 R853 D854 I855 Y932	Y844-T851 WeakPolarHBondContact O-CA 3.45Å; R845-T851 HydrophobicContact CG-CG2 3.94Å; T851-R853 PolarHBondContact O-N 3.36Å; T851-D854 WeakPolarHBondContact CB-OD2 3.38Å; T851-D854 PolarHBondContact N-OD2 3.45Å; T851-D854 WeakPolarHBondContact O-CB 3.46Å; T851-D854 PolarHBondContact O-N 3.18Å; T851-D854 PolarHBondContact OG1-N 3.28Å; T851-D854 PolarHBondContact OG1-OD2 2.91Å; T851-I855 PolarHBondContact O-N 3.04Å; T851-Y932 HydrophobicContact CG2-CD2 4.4Å
852	A	87.7	Confident	76.6	Confident	0 Å²	0	58.1 Å²	58.1	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-56.3	-35.8	175.7	0	0	0	0	0	112.1	F807 H808 T811 D854 I855	F807-A852 HydrophobicContact CB-CB 4.45Å; F807-A852 HydrophobicContact CD1-CB 3.22Å; F807-A852 HydrophobicContact CE1-CB 3.6Å; F807-A852 HydrophobicContact CG-CB 4Å; H808-A852 PolarHBondContact NE2-N 2.48Å; T811-A852 VanDerWaalsContact CG2-O 3.25Å; T811-A852 WeakPolarHBondContact CG2-O 3.4Å; A852-D854 PolarHBondContact O-N 3.15Å; A852-I855 WeakPolarHBondContact O-CB 3.25Å; A852-I855 PolarHBondContact O-N 2.99Å
853	R	88.3	Confident	73.9	Confident	15 Å²	15	64.2 Å²	64.2	6%	0.057	29%	0.288	C	S	.	.	H	α-helix	trans	-66.4	-34.8	176.3	-175.3	168.2	177.3	167.2	10.3	113	T851 I855 L856 I908 D909 Y932 Y934	T851-R853 PolarHBondContact O-N 3.36Å; R853-I855 PolarHBondContact O-N 3.49Å; R853-L856 WeakPolarHBondContact O-CB 3.37Å; R853-L856 PolarHBondContact O-N 2.8Å; R853-L856 VanDerWaalsContact O-N 3.11Å; R853-I908 HydrophobicContact CB-CD1 4.19Å; R853-D909 IonicContact CZ-OD1 2.77Å; R853-D909 IonicContact CZ-OD2 3.22Å; R853-D909 IonicContact NE-OD1 2.69Å; R853-D909 IonicContact NH1-OD1 3.4Å; R853-D909 PolarHBondContact NH1-OD1 3.01Å; R853-D909 IonicContact NH2-OD1 3.71Å; R853-D909 PolarHBondContact NH2-OD1 3.24Å; R853-D909 IonicContact NH2-OD2 3.77Å; R853-D909 PolarHBondContact NH2-OD2 3.45Å; R853-Y932 VanDerWaalsContact CD-OH 3.25Å; R853-Y932 WeakPolarHBondContact CD-OH 3.48Å; R853-Y932 PolarHBondContact NH1-OH 3.26Å; R853-Y934 HydrophobicContact CB-CD2 4.28Å; R853-Y934 HydrophobicContact CB-CE2 4.14Å; R853-Y934 VanDerWaalsContact CD-CG 3.49Å; R853-Y934 HydrophobicContact CG-CD1 4.44Å; R853-Y934 HydrophobicContact CG-CD2 4.08Å; R853-Y934 HydrophobicContact CG-CE1 4.39Å; R853-Y934 HydrophobicContact CG-CE2 3.99Å; R853-Y934 HydrophobicContact CG-CG 4.32Å; R853-Y934 VanDerWaalsContact CZ-CB 3.45Å; R853-Y934 VanDerWaalsContact NE-CD1 3.35Å
854	D	86.4	Confident	71.3	Confident	33 Å²	33	71.7 Å²	71.7	18%	0.176	33%	0.325	C	S	.	.	H	α-helix	trans	-63.1	-26.7	176	-61.8	-48	0	0	0	112.3	R845 R850 T851 A852 L856 N857 Y934	R845-D854 IonicContact NH1-OD2 3.57Å; R850-D854 HydrophobicContact CB-CB 3.9Å; R850-D854 HydrophobicContact CG-CB 4.23Å; T851-D854 WeakPolarHBondContact CB-OD2 3.38Å; T851-D854 PolarHBondContact N-OD2 3.45Å; T851-D854 WeakPolarHBondContact O-CB 3.46Å; T851-D854 PolarHBondContact O-N 3.18Å; T851-D854 PolarHBondContact OG1-N 3.28Å; T851-D854 PolarHBondContact OG1-OD2 2.91Å; A852-D854 PolarHBondContact O-N 3.15Å; D854-L856 PolarHBondContact O-N 2.85Å; D854-N857 PolarHBondContact O-N 3.49Å; D854-Y934 WeakPolarHBondContact OD1-CE2 3.42Å; D854-Y934 PolarHBondContact OD1-OH 3.24Å
855	I	85.1	Confident	68.5	Low	6 Å²	6	76.5 Å²	76.5	3%	0.031	35%	0.352	C	S	.	.	H	α-helix	trans	-65.8	-29.1	177	-63.3	176.6	0	0	0	111.4	H808 N812 H815 R850 T851 A852 R853 R858	H808-I855 HydrophobicContact CB-CD1 3.94Å; N812-I855 HydrophobicContact CB-CG2 4.42Å; H815-I855 PolarHBondContact NE2-O 3.27Å; R850-I855 HydrophobicContact CB-CG1 4.44Å; T851-I855 PolarHBondContact O-N 3.04Å; A852-I855 WeakPolarHBondContact O-CB 3.25Å; A852-I855 PolarHBondContact O-N 2.99Å; R853-I855 PolarHBondContact O-N 3.49Å; I855-R858 PolarHBondContact O-N 3.02Å
856	L	83.6	Confident	65.8	Low	24 Å²	24	82.7 Å²	82.7	13%	0.126	39%	0.387	C	S	.	.	H	α-helix	trans	-68.8	-33.4	-179.1	-67	170.3	0	0	0	112.5	T811 R853 D854 R858 A904 E905 I908	T811-L856 HydrophobicContact CG2-CD1 3.8Å; T811-L856 HydrophobicContact CG2-CD2 3.39Å; T811-L856 HydrophobicContact CG2-CG 3.35Å; R853-L856 WeakPolarHBondContact O-CB 3.37Å; R853-L856 PolarHBondContact O-N 2.8Å; R853-L856 VanDerWaalsContact O-N 3.11Å; D854-L856 PolarHBondContact O-N 2.85Å; L856-R858 PolarHBondContact O-N 2.81Å; L856-A904 HydrophobicContact CD1-CB 3.74Å; L856-A904 HydrophobicContact CD2-CB 3.75Å; L856-A904 HydrophobicContact CG-CB 4.43Å; L856-E905 HydrophobicContact CB-CG 4.17Å; L856-E905 HydrophobicContact CD1-CB 4.48Å; L856-E905 HydrophobicContact CD1-CG 3.61Å; L856-E905 HydrophobicContact CG-CG 4.45Å; L856-I908 HydrophobicContact CD1-CD1 4.05Å
857	N	71.3	Confident	63.2	Low	103 Å²	103	89.6 Å²	89.6	55%	0.551	42%	0.424	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.1	-7.2	178.9	-69	-21.1	0	0	0	114.1	D854 S859 Y934	D854-N857 PolarHBondContact O-N 3.49Å; N857-S859 PolarHBondContact O-N 2.7Å; N857-S859 VanDerWaalsContact O-N 3.12Å; N857-Y934 PolarHBondContact ND2-OH 3.24Å; N857-Y934 VanDerWaalsContact ND2-OH 3.16Å
858	R	65.9	Low	60.6	Low	150 Å²	150	94.1 Å²	94.1	57%	0.566	45%	0.448	S	S	*	.	S	Bend	trans	-65.3	114.9	171.9	-85.8	-175.5	167.8	-179.6	-4	109.5	H815 I855 L856 R860	H815-R858 PolarHBondContact CE1-O 3.44Å; I855-R858 PolarHBondContact O-N 3.02Å; L856-R858 PolarHBondContact O-N 2.81Å; R858-R860 PolarHBondContact O-N 3.4Å; R858-R860 VanDerWaalsContact O-N 3.1Å
859	S	53.9	Low	58.1	Low	78 Å²	78	93.2 Å²	93.2	55%	0.545	46%	0.458	S	S	.	.			trans	-52.7	117.2	170.9	58.1	0	0	0	0	109.9	N857 Y861	N857-S859 PolarHBondContact O-N 2.7Å; N857-S859 VanDerWaalsContact O-N 3.12Å; S859-Y861 PolarHBondContact O-N 2.68Å
860	R	55.1	Low	55.5	Low	116 Å²	116	99.5 Å²	99.5	44%	0.438	49%	0.487	S	S	.	.	G	3₁₀ helix	trans	-52.8	-18.7	169.6	-89.4	-174.3	179.4	169.8	2.4	112.8	F814 R858 K862	F814-R860 PolarHBondContact O-NH2 2.98Å; R858-R860 PolarHBondContact O-N 3.4Å; R858-R860 VanDerWaalsContact O-N 3.1Å; R860-K862 PolarHBondContact O-N 3.11Å
861	Y	42.1	Very low	52.7	Low	181 Å²	181	102.7 Å²	102.7	71%	0.71	52%	0.515	S	S	*	.	G	3₁₀ helix	trans	-84.8	-0.8	-163.3	-66.2	-74.9	0	0	0	117.4	S859 L863	S859-Y861 PolarHBondContact O-N 2.68Å; Y861-L863 VanDerWaalsContact C-N 3.29Å; Y861-L863 PolarHBondContact O-N 3.2Å
862	K	39.7	Very low	49.6	Very low	179 Å²	179	111.8 Å²	111.8	78%	0.778	56%	0.557	S	S	*	*	G	3₁₀ helix	trans	-79.7	-0.5	174.7	-93.3	-174.8	178.4	-179.6	0	115.6	R860	R860-K862 PolarHBondContact O-N 3.11Å
863	L	35.5	Very low	47	Very low	134 Å²	134	114.7 Å²	114.7	70%	0.702	58%	0.575	S	S	*	*	G	3₁₀ helix	trans	-103.9	-3.7	177.7	-88.9	158.5	0	0	0	114.4	Y861	Y861-L863 VanDerWaalsContact C-N 3.29Å; Y861-L863 PolarHBondContact O-N 3.2Å
864	M	33.3	Very low	44.7	Very low	164 Å²	164	122.9 Å²	122.9	81%	0.808	61%	0.614	S	S	*	*	S	Bend	trans	-116.7	-0.8	-174.8	-66.5	-97.9	-84.4	0	0	113.8
865	D	30.3	Very low	43	Very low	126 Å²	126	128.5 Å²	128.5	67%	0.674	64%	0.639	S	S	*	*			trans	-117.7	20.1	-168.9	-121.7	-0.4	0	0	0	115.3	N867	D865-N867 PolarHBondContact O-N 3.39Å
866	N	29.8	Very low	42.1	Very low	151 Å²	151	132.2 Å²	132.2	81%	0.807	66%	0.659	S	S	*	*			trans	-93.1	80.2	166.5	-77.5	-9.4	0	0	0	109.8	N868	N866-N868 PolarHBondContact O-N 3.12Å
867	N	29.2	Very low	41.9	Very low	148 Å²	148	134.9 Å²	134.9	79%	0.791	67%	0.67	S	S	*	*			trans	-68.6	56.7	163.8	-80.5	-32.7	0	0	0	111.5	D865	D865-N867 PolarHBondContact O-N 3.39Å
868	N	27.2	Very low	42.7	Very low	141 Å²	141	130.5 Å²	130.5	75%	0.754	65%	0.646	S	S	*	*	S	Bend	trans	-148.4	103	167.9	-96.5	-28.2	0	0	0	109.9	N866	N866-N868 PolarHBondContact O-N 3.12Å
869	V	26	Very low	43.4	Very low	120 Å²	120	125.5 Å²	125.5	73%	0.727	63%	0.633	S	S	*	*	S	Bend	trans	60.4	99.1	150.3	-166.6	0	0	0	0	115.9
870	H	23.2	Very low	45	Very low	175 Å²	175	127 Å²	127	81%	0.81	63%	0.63	S	S	*	*			trans	51.5	84.3	159.9	-67.5	-59.2	0	0	0	117
871	C	24.8	Very low	46.5	Very low	112 Å²	112	122.7 Å²	122.7	76%	0.757	61%	0.614	S	S	*	*			trans	-141.1	74.6	159.2	-115.4	0	0	0	0	110.4	T873	C871-T873 PolarHBondContact O-N 3.37Å
872	E	24.1	Very low	48.5	Very low	191 Å²	191	117.9 Å²	117.9	89%	0.893	60%	0.598	S	S	*	*			trans	-60.4	98.8	156.7	-66.6	173.2	179.6	0	0	107.7
873	T	31.3	Very low	50.6	Low	61 Å²	61	114.1 Å²	114.1	37%	0.374	58%	0.583	S	S	.	*			trans	-133.2	71.8	171	52.8	0	0	0	0	111.2	C871 E875	C871-T873 PolarHBondContact O-N 3.37Å; T873-E875 PolarHBondContact O-N 3.28Å; T873-E875 VanDerWaalsContact O-N 3.12Å
874	E	40.5	Very low	53.1	Low	187 Å²	187	111.3 Å²	111.3	87%	0.874	57%	0.573	S	S	*	*	G	3₁₀ helix	trans	-56.7	-11.3	154.7	-71.2	-170.9	156.1	0	0	112	N876	E874-N876 PolarHBondContact O-N 2.68Å; E874-N876 VanDerWaalsContact O-N 3.12Å
875	E	51.8	Low	55.8	Low	151 Å²	151	103.7 Å²	103.7	71%	0.706	54%	0.536	S	S	*	.	G	3₁₀ helix	trans	-66.3	-10.9	-174.6	-63.2	-165.7	149	0	0	115.7	T873	T873-E875 PolarHBondContact O-N 3.28Å; T873-E875 VanDerWaalsContact O-N 3.12Å
876	N	64.7	Low	58.5	Low	85 Å²	85	101.4 Å²	101.4	46%	0.455	52%	0.524	S	S	.	.	G	3₁₀ helix	trans	-93.2	-17.9	-173.7	-70.8	-35.3	0	0	0	115	E874	E874-N876 PolarHBondContact O-N 2.68Å; E874-N876 VanDerWaalsContact O-N 3.12Å
877	F	80.9	Confident	61.1	Low	79 Å²	79	99.1 Å²	99.1	35%	0.346	52%	0.517	S	S	.	.	S	Bend	trans	-92.4	156.6	-177.1	-67.7	-73.1	0	0	0	112.8	T816 H818	T816-F877 WeakPolarHBondContact O-CA 3.46Å; H818-F877 HydrophobicContact CB-CB 4.18Å; H818-F877 HydrophobicContact CB-CD1 4.24Å; H818-F877 HydrophobicContact CB-CG 4.15Å; H818-F877 AromaticContact CD2-CD2 3.88Å
878	R	86.8	Confident	63.8	Low	11 Å²	11	100.7 Å²	100.7	4%	0.042	52%	0.517	C	S	.	.	P	Polyproline II helix	trans	-64.6	148.7	166.6	-69.7	-174.6	-178.2	-103.8	-10	110.6	F778 K779 N780 V782 T816	F778-R878 PolarHBondContact O-NH2 2.52Å; K779-R878 PolarHBondContact O-NH1 2.99Å; N780-R878 HydrophobicContact CB-CG 4.17Å; V782-R878 PolarHBondContact O-NH1 2.87Å; T816-R878 PolarHBondContact O-N 3.1Å; T816-R878 PolarHBondContact OG1-NE 3.38Å; T816-R878 VanDerWaalsContact OG1-NE 3.15Å
879	P	81.9	Confident	66.6	Low	45 Å²	45	96.8 Å²	96.8	29%	0.292	50%	0.495	S	S	.	.	P	Polyproline II helix	trans	-54.4	149.2	163.9	-20	32.3	0	0	0	110.6	H391 N780	H391-P879 HydrophobicContact CB-CG 4.08Å; N780-P879 WeakPolarHBondContact O-CD 3.28Å
880	F	86.4	Confident	69.4	Low	110 Å²	110	91.7 Å²	91.7	48%	0.482	46%	0.463	S	S	.	.	P	Polyproline II helix	trans	-64.4	136.8	178.5	-82.5	-124.4	0	0	0	110.6	H818 K820 D821 E882	H818-F880 HydrophobicContact CB-CE2 3.86Å; H818-F880 HydrophobicContact CB-CZ 4.21Å; H818-F880 AromaticContact CG-CE2 3.81Å; H818-F880 AromaticContact CG-CZ 3.91Å; H818-F880 AromaticContact ND1-CE2 3.77Å; H818-F880 AromaticContact ND1-CZ 3.37Å; H818-F880 WeakPolarHBondContact ND1-CZ 3.49Å; K820-F880 HydrophobicContact CB-CE1 4.21Å; K820-F880 HydrophobicContact CB-CZ 4.13Å; D821-F880 HydrophobicContact CB-CD1 3.87Å; D821-F880 HydrophobicContact CB-CE1 4.03Å; D821-F880 HydrophobicContact CB-CG 4.16Å; D821-F880 HydrophobicContact CB-CZ 4.46Å; F880-E882 PolarHBondContact O-N 3.48Å
881	E	88	Confident	72.2	Confident	26 Å²	26	90 Å²	90	12%	0.121	46%	0.456	C	S	.	.	P	Polyproline II helix	trans	-77.3	119.4	173.5	-69.2	-63.7	165.8	0	0	110.9	S783 L784 D821 N823	S783-E881 WeakPolarHBondContact CA-OE1 3.28Å; L784-E881 HydrophobicContact CB-CG 4.3Å; L784-E881 HydrophobicContact CD1-CG 3.96Å; L784-E881 HydrophobicContact CG-CG 4.18Å; L784-E881 WeakPolarHBondContact CG-OE1 3.41Å; L784-E881 PolarHBondContact N-OE1 3.32Å; D821-E881 PolarHBondContact OD2-N 3.34Å; N823-E881 HydrophobicContact CB-CB 3.91Å; N823-E881 WeakPolarHBondContact CB-O 3.4Å; N823-E881 PolarHBondContact ND2-O 3.42Å
882	E	82.1	Confident	74.9	Confident	79 Å²	79	88.5 Å²	88.5	37%	0.369	44%	0.44	S	S	.	.			trans	-80	-39.2	-176.2	-67.5	171.4	-153.1	0	0	112.1	T346 I347 S348 N823 F880	T346-E882 WeakPolarHBondContact CB-OE1 3.3Å; I347-E882 PolarHBondContact N-OE1 3.12Å; I347-E882 VanDerWaalsContact N-OE1 3.1Å; S348-E882 WeakPolarHBondContact CB-OE2 3.48Å; S348-E882 PolarHBondContact N-OE2 3.02Å; N823-E882 PolarHBondContact ND2-O 2.94Å; F880-E882 PolarHBondContact O-N 3.48Å
883	E	84.5	Confident	77.8	Confident	100 Å²	100	79.4 Å²	79.4	47%	0.467	40%	0.397	S	S	.	.	S	Bend	trans	-93.7	123.8	-177.4	-66.7	-175.8	178.8	0	0	111	Q785 W827	Q785-E883 PolarHBondContact NE2-OE2 3.46Å; Q785-E883 VanDerWaalsContact NE2-OE2 3.15Å; W827-E883 PolarHBondContact NE1-O 2.86Å
884	P	87.8	Confident	80.3	Confident	75 Å²	75	78.4 Å²	78.4	49%	0.487	39%	0.391	S	S	.	.	P	Polyproline II helix	trans	-72.3	148.8	171.4	30.1	-33.1	0	0	0	110.8
885	P	89.9	Confident	82.3	Confident	4 Å²	4	70.2 Å²	70.2	3%	0.026	35%	0.353	C	S	.	.	P	Polyproline II helix	trans	-64.7	161.6	170	26	-30.6	0	0	0	111.3	R826 W827 L830 P887 L890	R826-P885 HydrophobicContact CB-CG 3.67Å; W827-P885 HydrophobicContact CD2-CB 4.04Å; W827-P885 HydrophobicContact CD2-CG 4.28Å; W827-P885 HydrophobicContact CE3-CB 4.06Å; W827-P885 HydrophobicContact CH2-CB 3.89Å; W827-P885 HydrophobicContact CZ2-CB 3.89Å; W827-P885 HydrophobicContact CZ3-CB 3.96Å; L830-P885 HydrophobicContact CD2-CB 3.7Å; L830-P885 HydrophobicContact CD2-CG 4.48Å; P885-P887 WeakPolarHBondContact O-CD 3.46Å; P885-L890 HydrophobicContact CG-CD1 4.13Å; P885-L890 HydrophobicContact CG-CD2 3.94Å; P885-L890 HydrophobicContact CG-CG 4.24Å
886	D	88.1	Confident	83.4	Confident	78 Å²	78	68.2 Å²	68.2	42%	0.417	35%	0.354	S	S	.	.	P	Polyproline II helix	trans	-58.1	123.3	178.2	-177.5	-6.2	0	0	0	109.9	F888 E889	D886-F888 PolarHBondContact O-N 3.5Å; D886-F888 VanDerWaalsContact O-N 3.08Å; D886-F888 VanDerWaalsContact OD1-CD2 3.22Å; D886-F888 WeakPolarHBondContact OD1-CD2 3.36Å; D886-F888 PolarHBondContact OD1-N 2.98Å; D886-E889 HydrophobicContact CB-CG 4.06Å; D886-E889 WeakPolarHBondContact O-CB 3.34Å; D886-E889 PolarHBondContact O-N 3.13Å
887	P	84	Confident	83.9	Confident	103 Å²	103	70.8 Å²	70.8	67%	0.669	36%	0.363	S	S	*	.	G	3₁₀ helix	trans	-50.7	-32.1	176.7	-28.8	35.6	0	0	0	114.2	P885 E889 L890	P885-P887 WeakPolarHBondContact O-CD 3.46Å; P887-E889 VanDerWaalsContact C-N 3.29Å; P887-E889 PolarHBondContact O-N 3.08Å; P887-L890 PolarHBondContact O-N 3.38Å
888	F	86.6	Confident	83.9	Confident	181 Å²	181	70.7 Å²	70.7	79%	0.794	37%	0.369	S	S	*	.	G	3₁₀ helix	trans	-66.7	-29.7	177.9	-66.5	-69.4	0	0	0	113	D886 L890	D886-F888 PolarHBondContact O-N 3.5Å; D886-F888 VanDerWaalsContact O-N 3.08Å; D886-F888 VanDerWaalsContact OD1-CD2 3.22Å; D886-F888 WeakPolarHBondContact OD1-CD2 3.36Å; D886-F888 PolarHBondContact OD1-N 2.98Å; F888-L890 VanDerWaalsContact C-N 3.3Å; F888-L890 PolarHBondContact O-N 3.37Å
889	E	85.2	Confident	83.5	Confident	60 Å²	60	72.7 Å²	72.7	28%	0.28	39%	0.393	S	S	.	.	G	3₁₀ helix	trans	-76	-19.6	178.3	-65.4	-175.1	142.8	0	0	112.4	Y788 L830 D886 P887	Y788-E889 WeakPolarHBondContact CE1-OE2 3.47Å; Y788-E889 PolarHBondContact OH-OE1 3.1Å; Y788-E889 PolarHBondContact OH-OE2 3.05Å; L830-E889 HydrophobicContact CD1-CB 3.94Å; L830-E889 HydrophobicContact CD2-CB 4.2Å; L830-E889 WeakPolarHBondContact CD2-OE2 3.34Å; D886-E889 HydrophobicContact CB-CG 4.06Å; D886-E889 WeakPolarHBondContact O-CB 3.34Å; D886-E889 PolarHBondContact O-N 3.13Å; P887-E889 VanDerWaalsContact C-N 3.29Å; P887-E889 PolarHBondContact O-N 3.08Å
890	L	85.1	Confident	83.7	Confident	12 Å²	12	75.7 Å²	75.7	6%	0.063	41%	0.406	C	S	.	.	G	3₁₀ helix	trans	-85.7	-12.4	-176.4	-65.5	-179.8	0	0	0	114.6	R826 L830 P885 P887 F888 D892 I893 T894	R826-L890 HydrophobicContact CB-CD1 4.46Å; R826-L890 HydrophobicContact CB-CD2 4.38Å; R826-L890 HydrophobicContact CG-CD1 4.27Å; L830-L890 HydrophobicContact CB-CD2 4.41Å; P885-L890 HydrophobicContact CG-CD1 4.13Å; P885-L890 HydrophobicContact CG-CD2 3.94Å; P885-L890 HydrophobicContact CG-CG 4.24Å; P887-L890 PolarHBondContact O-N 3.38Å; F888-L890 VanDerWaalsContact C-N 3.3Å; F888-L890 PolarHBondContact O-N 3.37Å; L890-D892 PolarHBondContact O-N 2.83Å; L890-D892 VanDerWaalsContact O-N 3.09Å; L890-I893 PolarHBondContact O-N 3.36Å; L890-T894 HydrophobicContact CB-CG2 4.41Å; L890-T894 PolarHBondContact O-N 3.16Å; L890-T894 VanDerWaalsContact O-N 3.12Å; L890-T894 PolarHBondContact O-OG1 3.42Å
891	H	82.6	Confident	83.6	Confident	141 Å²	141	72.9 Å²	72.9	65%	0.653	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51	-39.3	-172.1	175	-84.4	0	0	0	114	I893 T894	H891-I893 VanDerWaalsContact C-N 3.28Å; H891-I893 PolarHBondContact O-N 3.09Å; H891-T894 PolarHBondContact O-OG1 3.38Å
892	D	80.2	Confident	83.5	Confident	79 Å²	79	71.9 Å²	71.9	42%	0.422	39%	0.392	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.1	-6.7	-176.9	-64.1	-19	0	0	0	114.2	K837 L890	K837-D892 WeakPolarHBondContact CE-OD2 3.41Å; K837-D892 IonicContact NZ-OD2 3.85Å; K837-D892 PolarHBondContact NZ-OD2 3.22Å; L890-D892 PolarHBondContact O-N 2.83Å; L890-D892 VanDerWaalsContact O-N 3.09Å
893	I	85.7	Confident	83.8	Confident	1 Å²	1	71.5 Å²	71.5	1%	0.005	40%	0.395	C	S	.	.	T	Hydrogen-bonded Turn	trans	-113.2	-17.3	-170.8	-49	176.2	0	0	0	110.3	L830 A833 L890 H891 L901 L902 L907	L830-I893 VanDerWaalsContact CA-CD1 3.48Å; L830-I893 HydrophobicContact CB-CD1 4.14Å; L830-I893 HydrophobicContact CD1-CD1 3.86Å; A833-I893 HydrophobicContact CB-CD1 3.52Å; A833-I893 HydrophobicContact CB-CG1 3.78Å; L890-I893 PolarHBondContact O-N 3.36Å; H891-I893 VanDerWaalsContact C-N 3.28Å; H891-I893 PolarHBondContact O-N 3.09Å; I893-L901 HydrophobicContact CG2-CD2 4.21Å; I893-L902 WeakPolarHBondContact O-CB 3.49Å; I893-L902 VanDerWaalsContact O-CG 3.27Å; I893-L902 WeakPolarHBondContact O-CG 3.36Å; I893-L902 PolarHBondContact O-N 3.44Å; I893-L907 HydrophobicContact CG2-CD1 4.03Å; I893-L907 HydrophobicContact CG2-CD2 4.15Å
894	T	84.2	Confident	83.9	Confident	39 Å²	39	67.1 Å²	67.1	24%	0.239	38%	0.376	C	S	.	.	B	Isolated β-bridge	trans	-90.4	137.8	173	49.8	0	0	0	0	110.8	L890 H891 P896 N900 L901	L890-T894 HydrophobicContact CB-CG2 4.41Å; L890-T894 PolarHBondContact O-N 3.16Å; L890-T894 VanDerWaalsContact O-N 3.12Å; L890-T894 PolarHBondContact O-OG1 3.42Å; H891-T894 PolarHBondContact O-OG1 3.38Å; T894-P896 WeakPolarHBondContact O-CD 3.44Å; T894-N900 CarbonylContact C-O 3.57Å; T894-N900 WeakPolarHBondContact CA-O 3.49Å; T894-L901 HydrophobicContact CG2-CD2 4.07Å
895	D	80.7	Confident	84	Confident	16 Å²	16	67.4 Å²	67.4	9%	0.086	37%	0.371	C	S	.	.			trans	-64.6	121.5	166.7	175.2	6.7	0	0	0	109.2	E897 T898 G899 N900 L902 P942	D895-E897 PolarHBondContact O-N 3.33Å; D895-E897 PolarHBondContact OD1-N 3.4Å; D895-E897 VanDerWaalsContact OD1-N 3.16Å; D895-T898 WeakPolarHBondContact CB-OG1 3.32Å; D895-T898 VanDerWaalsContact CG-OG1 3.26Å; D895-T898 WeakPolarHBondContact OD2-CG2 3.5Å; D895-T898 PolarHBondContact OD2-OG1 2.89Å; D895-G899 VanDerWaalsContact O-CA 3.29Å; D895-G899 WeakPolarHBondContact O-CA 2.93Å; D895-G899 PolarHBondContact O-N 3.31Å; D895-N900 PolarHBondContact N-O 3.27Å; D895-L902 HydrophobicContact CB-CD2 4.33Å; D895-P942 HydrophobicContact CB-CG 4.32Å
896	P	76.7	Confident	83.9	Confident	109 Å²	109	69.5 Å²	69.5	71%	0.708	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.8	-24.6	-176.4	24.1	-34.9	0	0	0	114	T894	T894-P896 WeakPolarHBondContact O-CD 3.44Å
897	E	74.6	Confident	84	Confident	138 Å²	138	66.4 Å²	66.4	65%	0.645	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.1	-47	-179.3	-71.9	-172.3	170.3	0	0	112.6	D895 V943	D895-E897 PolarHBondContact O-N 3.33Å; D895-E897 PolarHBondContact OD1-N 3.4Å; D895-E897 VanDerWaalsContact OD1-N 3.16Å; E897-V943 HydrophobicContact CB-CG2 4.42Å; E897-V943 VanDerWaalsContact CD-CG1 3.46Å; E897-V943 HydrophobicContact CG-CG2 3.51Å; E897-V943 WeakPolarHBondContact OE1-CG1 3.18Å; E897-V943 WeakPolarHBondContact OE1-CG2 3.36Å; E897-V943 VanDerWaalsContact OE2-CG1 3.3Å; E897-V943 WeakPolarHBondContact OE2-CG1 3.28Å
898	T	80.4	Confident	84.3	Confident	77 Å²	77	61.5 Å²	61.5	47%	0.472	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.1	-17.5	-175.4	63.7	0	0	0	0	113.2	D895 N900	D895-T898 WeakPolarHBondContact CB-OG1 3.32Å; D895-T898 VanDerWaalsContact CG-OG1 3.26Å; D895-T898 WeakPolarHBondContact OD2-CG2 3.5Å; D895-T898 PolarHBondContact OD2-OG1 2.89Å; T898-N900 PolarHBondContact O-N 2.86Å; T898-N900 VanDerWaalsContact O-N 3.16Å; T898-N900 WeakPolarHBondContact OG1-CB 3.45Å; T898-N900 PolarHBondContact OG1-N 2.67Å
899	G	79.4	Confident	84.6	Confident	54 Å²	54	53.4 Å²	53.4	56%	0.557	30%	0.296	S	S	*	.			trans	67.3	2.8	-170.9	0	0	0	0	0	113.9	D895	D895-G899 VanDerWaalsContact O-CA 3.29Å; D895-G899 WeakPolarHBondContact O-CA 2.93Å; D895-G899 PolarHBondContact O-N 3.31Å
900	N	84.4	Confident	84.8	Confident	107 Å²	107	55.3 Å²	55.3	57%	0.572	30%	0.301	S	S	*	.	P	Polyproline II helix	trans	-80.2	151.2	-179.7	-69.1	-37.2	0	0	0	111	T894 D895 T898	T894-N900 CarbonylContact C-O 3.57Å; T894-N900 WeakPolarHBondContact CA-O 3.49Å; D895-N900 PolarHBondContact N-O 3.27Å; T898-N900 PolarHBondContact O-N 2.86Å; T898-N900 VanDerWaalsContact O-N 3.16Å; T898-N900 WeakPolarHBondContact OG1-CB 3.45Å; T898-N900 PolarHBondContact OG1-N 2.67Å
901	L	85.7	Confident	85.1	Confident	51 Å²	51	56.5 Å²	56.5	27%	0.267	31%	0.306	S	S	.	.	B	Isolated β-bridge	trans	-66.7	134.7	172.4	-67.6	168.9	0	0	0	110.2	F825 R826 I893 T894	F825-L901 HydrophobicContact CB-CD1 4.32Å; R826-L901 HydrophobicContact CB-CD1 4.44Å; R826-L901 HydrophobicContact CG-CD1 3.73Å; R826-L901 HydrophobicContact CG-CD2 4.37Å; I893-L901 HydrophobicContact CG2-CD2 4.21Å; T894-L901 HydrophobicContact CG2-CD2 4.07Å
902	L	85.7	Confident	85.5	Confident	6 Å²	6	49.8 Å²	49.8	3%	0.031	28%	0.275	C	S	.	.	P	Polyproline II helix	trans	-60.9	140	168.2	-65.6	173	0	0	0	109.6	I893 D895 Q906 L907 P942	I893-L902 WeakPolarHBondContact O-CB 3.49Å; I893-L902 VanDerWaalsContact O-CG 3.27Å; I893-L902 WeakPolarHBondContact O-CG 3.36Å; I893-L902 PolarHBondContact O-N 3.44Å; D895-L902 HydrophobicContact CB-CD2 4.33Å; L902-Q906 HydrophobicContact CB-CB 4.4Å; L902-L907 HydrophobicContact CB-CD2 3.96Å; L902-L907 HydrophobicContact CB-CG 4.02Å; L902-L907 HydrophobicContact CD1-CD2 3.89Å; L902-P942 HydrophobicContact CD2-CG 3.66Å
903	T	87.2	Confident	86	Confident	71 Å²	71	46.1 Å²	46.1	44%	0.436	26%	0.256	S	S	.	.	P	Polyproline II helix	trans	-65.3	154.8	174.5	61.3	0	0	0	0	110.7	E905 Q906 L907	T903-E905 PolarHBondContact O-N 3.42Å; T903-Q906 PolarHBondContact O-N 3.09Å; T903-Q906 VanDerWaalsContact O-N 3.09Å; T903-Q906 WeakPolarHBondContact OG1-CB 3.49Å; T903-Q906 WeakPolarHBondContact OG1-CG 3.47Å; T903-Q906 PolarHBondContact OG1-N 3.05Å; T903-Q906 PolarHBondContact OG1-OE1 3.49Å; T903-L907 PolarHBondContact O-N 3.18Å
904	A	88.4	Confident	86.3	Confident	7 Å²	7	51.3 Å²	51.3	6%	0.058	28%	0.278	C	S	.	.	H	α-helix	trans	-54.5	-39.7	176	0	0	0	0	0	111.7	F814 L832 L856 L907 I908	F814-A904 HydrophobicContact CD1-CB 4.37Å; F814-A904 HydrophobicContact CD2-CB 4.08Å; F814-A904 HydrophobicContact CE1-CB 4.16Å; F814-A904 HydrophobicContact CE2-CB 3.87Å; F814-A904 HydrophobicContact CG-CB 4.34Å; F814-A904 HydrophobicContact CZ-CB 3.9Å; L832-A904 HydrophobicContact CD2-CB 3.79Å; L856-A904 HydrophobicContact CD1-CB 3.74Å; L856-A904 HydrophobicContact CD2-CB 3.75Å; L856-A904 HydrophobicContact CG-CB 4.43Å; A904-L907 PolarHBondContact O-N 3.29Å; A904-I908 VanDerWaalsContact O-CG1 3.28Å; A904-I908 WeakPolarHBondContact O-CG1 3.44Å; A904-I908 PolarHBondContact O-N 3.23Å
905	E	88.8	Confident	86.6	Confident	82 Å²	82	50 Å²	50	38%	0.383	27%	0.27	S	S	.	.	H	α-helix	trans	-61.6	-47.6	176	-62.9	178.3	-176.5	0	0	112	L856 T903 L907 I908 D909	L856-E905 HydrophobicContact CB-CG 4.17Å; L856-E905 HydrophobicContact CD1-CB 4.48Å; L856-E905 HydrophobicContact CD1-CG 3.61Å; L856-E905 HydrophobicContact CG-CG 4.45Å; T903-E905 PolarHBondContact O-N 3.42Å; E905-L907 VanDerWaalsContact C-N 3.31Å; E905-L907 PolarHBondContact O-N 3.44Å; E905-I908 PolarHBondContact O-N 3.03Å; E905-D909 WeakPolarHBondContact O-CB 3.23Å; E905-D909 VanDerWaalsContact O-CG 3.32Å; E905-D909 PolarHBondContact O-N 3.17Å
906	Q	88.2	Confident	87.1	Confident	48 Å²	48	49.2 Å²	49.2	22%	0.224	27%	0.266	C	S	.	.	H	α-helix	trans	-61.8	-36.7	177.4	-74.4	165.2	-23.5	0	0	112.5	L902 T903 D909 R910	L902-Q906 HydrophobicContact CB-CB 4.4Å; T903-Q906 PolarHBondContact O-N 3.09Å; T903-Q906 VanDerWaalsContact O-N 3.09Å; T903-Q906 WeakPolarHBondContact OG1-CB 3.49Å; T903-Q906 WeakPolarHBondContact OG1-CG 3.47Å; T903-Q906 PolarHBondContact OG1-N 3.05Å; T903-Q906 PolarHBondContact OG1-OE1 3.49Å; Q906-D909 PolarHBondContact O-N 3.29Å; Q906-R910 WeakPolarHBondContact O-CB 3.37Å; Q906-R910 PolarHBondContact O-N 2.94Å
907	L	90.3	Very high	87.8	Confident	12 Å²	12	44.7 Å²	44.7	6%	0.063	24%	0.237	C	C	.	.	H	α-helix	trans	-64.1	-40.9	175.9	-71.1	170.8	0	0	0	111.8	L832 L836 I893 L902 T903 A904 E905 H911	L832-L907 HydrophobicContact CD2-CB 4.38Å; L832-L907 HydrophobicContact CD2-CD1 4.1Å; L836-L907 HydrophobicContact CD1-CB 4.33Å; I893-L907 HydrophobicContact CG2-CD1 4.03Å; I893-L907 HydrophobicContact CG2-CD2 4.15Å; L902-L907 HydrophobicContact CB-CD2 3.96Å; L902-L907 HydrophobicContact CB-CG 4.02Å; L902-L907 HydrophobicContact CD1-CD2 3.89Å; T903-L907 PolarHBondContact O-N 3.18Å; A904-L907 PolarHBondContact O-N 3.29Å; E905-L907 VanDerWaalsContact C-N 3.31Å; E905-L907 PolarHBondContact O-N 3.44Å; L907-H911 PolarHBondContact O-N 3.34Å
908	I	91.2	Very high	88.6	Confident	0 Å²	0	39.7 Å²	39.7	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-68.1	-45	176.6	-59.4	179.6	0	0	0	110.5	F807 R853 L856 A904 E905 R910 H911 V912 Y932	F807-I908 HydrophobicContact CE1-CD1 4.19Å; F807-I908 HydrophobicContact CZ-CD1 3.83Å; F807-I908 HydrophobicContact CZ-CG1 3.82Å; R853-I908 HydrophobicContact CB-CD1 4.19Å; L856-I908 HydrophobicContact CD1-CD1 4.05Å; A904-I908 VanDerWaalsContact O-CG1 3.28Å; A904-I908 WeakPolarHBondContact O-CG1 3.44Å; A904-I908 PolarHBondContact O-N 3.23Å; E905-I908 PolarHBondContact O-N 3.03Å; I908-R910 PolarHBondContact O-N 3.49Å; I908-H911 WeakPolarHBondContact O-CB 3.26Å; I908-H911 PolarHBondContact O-N 3.05Å; I908-H911 VanDerWaalsContact O-N 3.16Å; I908-V912 PolarHBondContact O-N 3.3Å; I908-V912 VanDerWaalsContact O-N 3.09Å; I908-Y932 WeakPolarHBondContact CG2-OH 3.2Å
909	D	91.1	Very high	89.2	Confident	11 Å²	11	38.8 Å²	38.8	6%	0.059	21%	0.211	C	C	.	.	H	α-helix	trans	-61.5	-45.2	179.4	-76	-13.5	0	0	0	112.7	R853 E905 Q906 H911 V912 A913 N939	R853-D909 IonicContact CZ-OD1 2.77Å; R853-D909 IonicContact CZ-OD2 3.22Å; R853-D909 IonicContact NE-OD1 2.69Å; R853-D909 IonicContact NH1-OD1 3.4Å; R853-D909 PolarHBondContact NH1-OD1 3.01Å; R853-D909 IonicContact NH2-OD1 3.71Å; R853-D909 PolarHBondContact NH2-OD1 3.24Å; R853-D909 IonicContact NH2-OD2 3.77Å; R853-D909 PolarHBondContact NH2-OD2 3.45Å; E905-D909 WeakPolarHBondContact O-CB 3.23Å; E905-D909 VanDerWaalsContact O-CG 3.32Å; E905-D909 PolarHBondContact O-N 3.17Å; Q906-D909 PolarHBondContact O-N 3.29Å; D909-H911 PolarHBondContact O-N 3.3Å; D909-V912 PolarHBondContact O-N 3.41Å; D909-A913 VanDerWaalsContact O-CB 3.28Å; D909-A913 WeakPolarHBondContact O-CB 3.28Å; D909-A913 PolarHBondContact O-N 3.44Å; D909-N939 CarbonylContact C-O 3.58Å; D909-N939 VanDerWaalsContact C-O 3.29Å
910	R	90.6	Very high	89.8	Confident	100 Å²	100	40.1 Å²	40.1	38%	0.377	20%	0.203	S	C	.	.	H	α-helix	trans	-61.9	-35.2	176.9	-175	174.5	174.8	130.6	-11.9	111.3	Q906 I908 F914 N939	Q906-R910 WeakPolarHBondContact O-CB 3.37Å; Q906-R910 PolarHBondContact O-N 2.94Å; I908-R910 PolarHBondContact O-N 3.49Å; R910-F914 VanDerWaalsContact O-CB 3.23Å; R910-F914 WeakPolarHBondContact O-CB 3.3Å; R910-F914 PolarHBondContact O-N 2.99Å; R910-N939 WeakPolarHBondContact CA-O 3.13Å; R910-N939 PolarHBondContact N-O 2.87Å
911	H	91	Very high	90.1	Very high	38 Å²	38	36.7 Å²	36.7	18%	0.176	18%	0.184	C	C	.	.	H	α-helix	trans	-66.7	-46.6	174.4	-177.8	77.7	0	0	0	112.1	L836 L907 I908 D909 A913 F914 L915	L836-H911 HydrophobicContact CD1-CB 4.47Å; L836-H911 HydrophobicContact CD2-CB 4.17Å; L907-H911 PolarHBondContact O-N 3.34Å; I908-H911 WeakPolarHBondContact O-CB 3.26Å; I908-H911 PolarHBondContact O-N 3.05Å; I908-H911 VanDerWaalsContact O-N 3.16Å; D909-H911 PolarHBondContact O-N 3.3Å; H911-A913 PolarHBondContact O-N 3.36Å; H911-F914 WeakPolarHBondContact O-CB 3.5Å; H911-F914 PolarHBondContact O-N 3.2Å; H911-L915 WeakPolarHBondContact O-CG 3.35Å; H911-L915 PolarHBondContact O-N 3.2Å
912	V	91.1	Very high	90.3	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-65	-41	177.6	178.3	0	0	0	0	111.3	I842 I908 D909 F914 L915 A916 L927 Y932 A938	I842-V912 HydrophobicContact CD1-CG2 3.35Å; I908-V912 PolarHBondContact O-N 3.3Å; I908-V912 VanDerWaalsContact O-N 3.09Å; D909-V912 PolarHBondContact O-N 3.41Å; V912-F914 VanDerWaalsContact C-N 3.3Å; V912-F914 PolarHBondContact O-N 3.05Å; V912-L915 WeakPolarHBondContact O-CB 3.4Å; V912-L915 PolarHBondContact O-N 3.39Å; V912-A916 PolarHBondContact O-N 2.78Å; V912-L927 HydrophobicContact CG1-CD1 4.48Å; V912-Y932 HydrophobicContact CG2-CE1 4.06Å; V912-A938 HydrophobicContact CB-CB 3.58Å; V912-A938 HydrophobicContact CG1-CB 3.45Å; V912-A938 VanDerWaalsContact CG1-CB 3.45Å
913	A	91.6	Very high	90.5	Very high	1 Å²	1	42.2 Å²	42.2	1%	0.008	21%	0.214	C	C	.	.	H	α-helix	trans	-62.9	-36.7	173.4	0	0	0	0	0	112	D909 H911 A916 S917 N939 L951	D909-A913 VanDerWaalsContact O-CB 3.28Å; D909-A913 WeakPolarHBondContact O-CB 3.28Å; D909-A913 PolarHBondContact O-N 3.44Å; H911-A913 PolarHBondContact O-N 3.36Å; A913-A916 PolarHBondContact O-N 3.31Å; A913-S917 PolarHBondContact O-N 3.14Å; A913-N939 VanDerWaalsContact CB-C 3.47Å; A913-N939 WeakPolarHBondContact CB-O 3.33Å; A913-L951 HydrophobicContact CB-CD1 3.84Å
914	F	90.4	Very high	90.7	Very high	110 Å²	110	38.8 Å²	38.8	48%	0.482	19%	0.193	S	C	.	.	H	α-helix	trans	-62.4	-43.4	173.5	172.8	-97	0	0	0	111.7	R910 H911 V912 A916 S917 A918	R910-F914 VanDerWaalsContact O-CB 3.23Å; R910-F914 WeakPolarHBondContact O-CB 3.3Å; R910-F914 PolarHBondContact O-N 2.99Å; H911-F914 WeakPolarHBondContact O-CB 3.5Å; H911-F914 PolarHBondContact O-N 3.2Å; V912-F914 VanDerWaalsContact C-N 3.3Å; V912-F914 PolarHBondContact O-N 3.05Å; F914-A916 VanDerWaalsContact C-N 3.3Å; F914-A916 PolarHBondContact O-N 2.88Å; F914-S917 CarbonylContact O-C 3.52Å; F914-S917 WeakPolarHBondContact O-CA 3.4Å; F914-S917 PolarHBondContact O-N 2.96Å; F914-S917 PolarHBondContact O-OG 3.44Å; F914-A918 HydrophobicContact CE1-CB 4.1Å; F914-A918 HydrophobicContact CE2-CB 4.32Å; F914-A918 HydrophobicContact CZ-CB 4Å; F914-A918 WeakPolarHBondContact O-CB 3.37Å; F914-A918 PolarHBondContact O-N 3.01Å
915	L	91.5	Very high	90.7	Very high	11 Å²	11	40.4 Å²	40.4	6%	0.058	20%	0.199	C	C	.	.	H	α-helix	trans	-57.1	-42.6	176.6	-65	176.1	0	0	0	112.1	H911 V912 A918 N919 H920 M924 L927	H911-L915 WeakPolarHBondContact O-CG 3.35Å; H911-L915 PolarHBondContact O-N 3.2Å; V912-L915 WeakPolarHBondContact O-CB 3.4Å; V912-L915 PolarHBondContact O-N 3.39Å; L915-A918 PolarHBondContact O-N 2.78Å; L915-N919 PolarHBondContact O-N 3.02Å; L915-H920 HydrophobicContact CB-CB 4.39Å; L915-H920 HydrophobicContact CD2-CB 3.92Å; L915-H920 WeakPolarHBondContact CD2-ND1 3.31Å; L915-H920 PolarHBondContact O-N 3.27Å; L915-M924 HydrophobicContact CB-CE 4.29Å; L915-L927 HydrophobicContact CD1-CD1 3.8Å
916	A	91.8	Very high	90.6	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-64.6	-43	174.1	0	0	0	0	0	111.8	V912 A913 F914 A918 N919 M924 A948 H957 M960 L964	V912-A916 PolarHBondContact O-N 2.78Å; A913-A916 PolarHBondContact O-N 3.31Å; F914-A916 VanDerWaalsContact C-N 3.3Å; F914-A916 PolarHBondContact O-N 2.88Å; A916-A918 PolarHBondContact O-N 2.85Å; A916-N919 PolarHBondContact O-N 2.82Å; A916-M924 HydrophobicContact CB-CE 3.7Å; A916-A948 HydrophobicContact CB-CB 3.74Å; A916-A948 WeakPolarHBondContact CB-O 3.44Å; A916-H957 PolarHBondContact O-CD2 2.83Å; A916-M960 HydrophobicContact CB-CG 4.36Å; A916-L964 HydrophobicContact CB-CD1 4.44Å
917	S	91.2	Very high	90.6	Very high	14 Å²	14	37 Å²	37	10%	0.098	18%	0.184	C	C	.	.	H	α-helix	trans	-69	-30.1	179.2	89.9	0	0	0	0	113.6	A913 F914 N919 K955 H957	A913-S917 PolarHBondContact O-N 3.14Å; F914-S917 CarbonylContact O-C 3.52Å; F914-S917 WeakPolarHBondContact O-CA 3.4Å; F914-S917 PolarHBondContact O-N 2.96Å; F914-S917 PolarHBondContact O-OG 3.44Å; S917-N919 VanDerWaalsContact C-N 3.33Å; S917-K955 WeakPolarHBondContact O-CD 3.45Å; S917-K955 WeakPolarHBondContact O-CE 3.34Å; S917-K955 PolarHBondContact O-NZ 3.47Å; S917-K955 PolarHBondContact OG-NZ 3.45Å; S917-H957 PolarHBondContact O-NE2 2.87Å
918	A	91.7	Very high	90.4	Very high	34 Å²	34	37 Å²	37	28%	0.281	18%	0.183	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90	0	-178.3	0	0	0	0	0	112.4	F914 L915 A916 H920	F914-A918 HydrophobicContact CE1-CB 4.1Å; F914-A918 HydrophobicContact CE2-CB 4.32Å; F914-A918 HydrophobicContact CZ-CB 4Å; F914-A918 WeakPolarHBondContact O-CB 3.37Å; F914-A918 PolarHBondContact O-N 3.01Å; L915-A918 PolarHBondContact O-N 2.78Å; A916-A918 PolarHBondContact O-N 2.85Å; A918-H920 VanDerWaalsContact C-N 3.31Å; A918-H920 PolarHBondContact O-CD2 2.81Å; A918-H920 PolarHBondContact O-N 2.97Å
919	N	92.3	Very high	90	Very high	57 Å²	57	38.4 Å²	38.4	31%	0.305	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	57.5	38	-175.2	-157.8	33.3	0	0	0	113.8	L915 A916 S917 L921 H957	L915-N919 PolarHBondContact O-N 3.02Å; A916-N919 PolarHBondContact O-N 2.82Å; S917-N919 VanDerWaalsContact C-N 3.33Å; N919-L921 PolarHBondContact O-N 3.17Å; N919-H957 HydrophobicContact CB-CB 4.48Å
920	H	92.4	Very high	89.6	Confident	82 Å²	82	40 Å²	40	38%	0.38	20%	0.196	S	C	.	.			trans	-79.1	69.9	175.9	-69.6	-172.1	0	0	0	110.6	L915 A918 Q922 S923 M924	L915-H920 HydrophobicContact CB-CB 4.39Å; L915-H920 HydrophobicContact CD2-CB 3.92Å; L915-H920 WeakPolarHBondContact CD2-ND1 3.31Å; L915-H920 PolarHBondContact O-N 3.27Å; A918-H920 VanDerWaalsContact C-N 3.31Å; A918-H920 PolarHBondContact O-CD2 2.81Å; A918-H920 PolarHBondContact O-N 2.97Å; H920-Q922 PolarHBondContact O-N 2.89Å; H920-S923 PolarHBondContact O-N 3.03Å; H920-M924 PolarHBondContact O-N 2.93Å; H920-M924 VanDerWaalsContact O-N 3.09Å
921	L	90.4	Very high	89	Confident	35 Å²	35	36 Å²	36	18%	0.183	19%	0.186	C	C	.	.	H	α-helix	trans	-54.4	-50.1	-175.7	-74.2	165.2	0	0	0	112.4	N919 S923 M924 E925 E959 M960 L963	N919-L921 PolarHBondContact O-N 3.17Å; L921-S923 VanDerWaalsContact C-N 3.34Å; L921-S923 PolarHBondContact O-N 3.07Å; L921-M924 PolarHBondContact O-N 3.09Å; L921-M924 VanDerWaalsContact O-N 3.1Å; L921-E925 WeakPolarHBondContact O-CG 3.43Å; L921-E925 PolarHBondContact O-N 3.18Å; L921-E959 HydrophobicContact CD1-CB 3.89Å; L921-E959 WeakPolarHBondContact CD1-OE2 3.4Å; L921-E959 HydrophobicContact CD2-CB 4.06Å; L921-M960 HydrophobicContact CD2-CB 3.89Å; L921-M960 HydrophobicContact CD2-CE 3.89Å; L921-M960 HydrophobicContact CD2-SD 4.27Å; L921-M960 HydrophobicContact CG-CE 4.17Å; L921-L963 HydrophobicContact CD2-CD2 4.31Å
922	Q	89.6	Confident	88.7	Confident	127 Å²	127	34.6 Å²	34.6	59%	0.593	18%	0.179	S	C	*	.	H	α-helix	trans	-55.3	-46.6	-179.4	-170.9	78	25.6	0	0	112.3	H920 M924 E925 E926	H920-Q922 PolarHBondContact O-N 2.89Å; Q922-M924 VanDerWaalsContact C-N 3.34Å; Q922-M924 PolarHBondContact O-N 3.04Å; Q922-E925 PolarHBondContact O-N 2.89Å; Q922-E926 WeakPolarHBondContact O-CG 3.44Å; Q922-E926 PolarHBondContact O-N 3.3Å
923	S	90.1	Very high	88.3	Confident	46 Å²	46	36 Å²	36	32%	0.322	19%	0.186	S	C	.	.	H	α-helix	trans	-67.8	-35.7	179.8	-55	0	0	0	0	111.9	H920 L921 L927	H920-S923 PolarHBondContact O-N 3.03Å; L921-S923 VanDerWaalsContact C-N 3.34Å; L921-S923 PolarHBondContact O-N 3.07Å; S923-L927 WeakPolarHBondContact O-CG 3.41Å; S923-L927 PolarHBondContact O-N 3.36Å
924	M	91.2	Very high	88.1	Confident	0 Å²	0	36.6 Å²	36.6	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-70.2	-41.3	175	-165.2	69.7	84.6	0	0	111.5	L915 A916 H920 L921 Q922 E926 L927 I928 I935 M960 L963 L964	L915-M924 HydrophobicContact CB-CE 4.29Å; A916-M924 HydrophobicContact CB-CE 3.7Å; H920-M924 PolarHBondContact O-N 2.93Å; H920-M924 VanDerWaalsContact O-N 3.09Å; L921-M924 PolarHBondContact O-N 3.09Å; L921-M924 VanDerWaalsContact O-N 3.1Å; Q922-M924 VanDerWaalsContact C-N 3.34Å; Q922-M924 PolarHBondContact O-N 3.04Å; M924-E926 VanDerWaalsContact C-N 3.31Å; M924-E926 PolarHBondContact O-N 2.73Å; M924-L927 WeakPolarHBondContact O-CB 3.4Å; M924-L927 PolarHBondContact O-N 3.3Å; M924-L927 HydrophobicContact SD-CD1 4.08Å; M924-I928 HydrophobicContact CG-CD1 4.49Å; M924-I928 WeakPolarHBondContact O-CG1 3.38Å; M924-I928 PolarHBondContact O-N 2.67Å; M924-I928 VanDerWaalsContact O-N 3.11Å; M924-I935 HydrophobicContact SD-CG2 4.2Å; M924-M960 HydrophobicContact CB-CE 3.95Å; M924-M960 HydrophobicContact CB-SD 3.84Å; M924-M960 HydrophobicContact CE-SD 3.93Å; M924-M960 HydrophobicContact CG-CE 4.47Å; M924-M960 HydrophobicContact CG-SD 3.72Å; M924-L963 HydrophobicContact CB-CD2 3.98Å; M924-L963 HydrophobicContact CG-CD2 4.03Å; M924-L964 HydrophobicContact CE-CD2 4.08Å; M924-L964 HydrophobicContact CG-CD2 4.21Å; M924-L964 HydrophobicContact SD-CD2 4.11Å
925	E	88.1	Confident	87.9	Confident	40 Å²	40	31.6 Å²	31.6	19%	0.187	17%	0.167	C	C	.	.	H	α-helix	trans	-59.6	-42.8	173.1	-72.6	-168.7	159.3	0	0	110.9	L921 Q922 I928 L929 L963 R997	L921-E925 WeakPolarHBondContact O-CG 3.43Å; L921-E925 PolarHBondContact O-N 3.18Å; Q922-E925 PolarHBondContact O-N 2.89Å; E925-I928 PolarHBondContact O-N 2.73Å; E925-L929 WeakPolarHBondContact O-CB 3.46Å; E925-L929 VanDerWaalsContact O-CG 3.3Å; E925-L929 WeakPolarHBondContact O-CG 3.35Å; E925-L929 PolarHBondContact O-N 2.96Å; E925-L963 HydrophobicContact CB-CD2 4.36Å; E925-L963 HydrophobicContact CG-CD1 3.72Å; E925-L963 HydrophobicContact CG-CD2 3.39Å; E925-L963 HydrophobicContact CG-CG 4.19Å; E925-R997 IonicContact OE1-CZ 2.72Å; E925-R997 IonicContact OE1-NH1 3.87Å; E925-R997 PolarHBondContact OE1-NH1 3.05Å; E925-R997 IonicContact OE1-NH2 3.59Å; E925-R997 PolarHBondContact OE1-NH2 2.81Å; E925-R997 IonicContact OE2-NH2 3.12Å
926	E	87.4	Confident	87.6	Confident	55 Å²	55	36.3 Å²	36.3	26%	0.257	19%	0.188	S	C	.	.	H	α-helix	trans	-60.6	-44.2	173.2	-75.9	177.6	-168.4	0	0	111.9	Y843 Q922 M924 I928 L929 Y930	Y843-E926 HydrophobicContact CE1-CB 4.23Å; Q922-E926 WeakPolarHBondContact O-CG 3.44Å; Q922-E926 PolarHBondContact O-N 3.3Å; M924-E926 VanDerWaalsContact C-N 3.31Å; M924-E926 PolarHBondContact O-N 2.73Å; E926-I928 PolarHBondContact O-N 3.05Å; E926-L929 PolarHBondContact O-N 3.22Å; E926-Y930 HydrophobicContact CB-CD2 4.48Å; E926-Y930 WeakPolarHBondContact O-CB 3.19Å; E926-Y930 WeakPolarHBondContact O-CD2 3.25Å; E926-Y930 PolarHBondContact O-N 3.1Å
927	L	88.1	Confident	87.2	Confident	5 Å²	5	40.1 Å²	40.1	3%	0.026	21%	0.208	C	C	.	.	H	α-helix	trans	-57.6	-38.6	176.3	-71.8	170	0	0	0	112.3	I842 Y843 V912 L915 S923 M924 G931 Y932 I935	I842-L927 HydrophobicContact CD1-CD1 4.35Å; I842-L927 HydrophobicContact CD1-CD2 3.72Å; I842-L927 HydrophobicContact CG1-CD2 3.46Å; I842-L927 VanDerWaalsContact CG1-CD2 3.46Å; Y843-L927 HydrophobicContact CD1-CD2 3.77Å; Y843-L927 HydrophobicContact CG-CD2 4.42Å; V912-L927 HydrophobicContact CG1-CD1 4.48Å; L915-L927 HydrophobicContact CD1-CD1 3.8Å; S923-L927 WeakPolarHBondContact O-CG 3.41Å; S923-L927 PolarHBondContact O-N 3.36Å; M924-L927 WeakPolarHBondContact O-CB 3.4Å; M924-L927 PolarHBondContact O-N 3.3Å; M924-L927 HydrophobicContact SD-CD1 4.08Å; L927-G931 PolarHBondContact O-N 3.09Å; L927-Y932 HydrophobicContact CD2-CD1 4.11Å; L927-Y932 HydrophobicContact CD2-CG 3.94Å; L927-Y932 VanDerWaalsContact O-CB 3.3Å; L927-Y932 WeakPolarHBondContact O-CB 3.48Å; L927-Y932 PolarHBondContact O-N 3.08Å; L927-I935 HydrophobicContact CB-CD1 4.06Å
928	I	86.3	Confident	87	Confident	10 Å²	10	39.5 Å²	39.5	5%	0.051	20%	0.204	C	C	.	.	H	α-helix	trans	-70.6	-49.3	178	-61.9	162.8	0	0	0	110.5	M924 E925 E926 Y930 G931 I935 L963 V967 Y970	M924-I928 HydrophobicContact CG-CD1 4.49Å; M924-I928 WeakPolarHBondContact O-CG1 3.38Å; M924-I928 PolarHBondContact O-N 2.67Å; M924-I928 VanDerWaalsContact O-N 3.11Å; E925-I928 PolarHBondContact O-N 2.73Å; E926-I928 PolarHBondContact O-N 3.05Å; I928-Y930 PolarHBondContact O-N 3.3Å; I928-G931 PolarHBondContact O-N 3.29Å; I928-I935 HydrophobicContact CG1-CD1 3.63Å; I928-L963 HydrophobicContact CD1-CD1 3.79Å; I928-L963 HydrophobicContact CD1-CD2 4.06Å; I928-L963 HydrophobicContact CD1-CG 3.63Å; I928-V967 HydrophobicContact CD1-CG2 3.68Å; I928-V967 HydrophobicContact CG1-CG1 4.35Å; I928-V967 HydrophobicContact CG1-CG2 3.95Å; I928-V967 HydrophobicContact CG2-CG1 4.45Å; I928-Y970 HydrophobicContact CG2-CG 4.47Å
929	L	82.5	Confident	87	Confident	30 Å²	30	39.4 Å²	39.4	16%	0.157	20%	0.199	C	C	.	.	H	α-helix	trans	-65.8	-22.9	-178.1	-71.6	174	0	0	0	114.1	E925 E926 M974 R997	E925-L929 WeakPolarHBondContact O-CB 3.46Å; E925-L929 VanDerWaalsContact O-CG 3.3Å; E925-L929 WeakPolarHBondContact O-CG 3.35Å; E925-L929 PolarHBondContact O-N 2.96Å; E926-L929 PolarHBondContact O-N 3.22Å; L929-M974 HydrophobicContact CD2-SD 4.32Å; L929-M974 WeakPolarHBondContact O-CE 3.34Å; L929-R997 HydrophobicContact CD2-CB 4.48Å; L929-R997 WeakPolarHBondContact CD2-O 3.48Å
930	Y	81.5	Confident	86.6	Confident	45 Å²	45	37.9 Å²	37.9	18%	0.176	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.9	6.4	174.8	-72.3	-107	0	0	0	112.4	Y843 E926 I928 R1002	Y843-Y930 VanDerWaalsContact CD2-CB 3.47Å; Y843-Y930 AromaticContact CD2-CD1 3.51Å; Y843-Y930 HydrophobicContact CD2-CD1 3.51Å; Y843-Y930 HydrophobicContact CD2-CD2 4.39Å; Y843-Y930 HydrophobicContact CD2-CE1 4.3Å; Y843-Y930 AromaticContact CD2-CG 3.55Å; Y843-Y930 HydrophobicContact CD2-CG 3.55Å; Y843-Y930 AromaticContact CE2-CD1 3.19Å; Y843-Y930 HydrophobicContact CE2-CD1 3.19Å; Y843-Y930 AromaticContact CE2-CD2 3.96Å; Y843-Y930 HydrophobicContact CE2-CD2 3.96Å; Y843-Y930 AromaticContact CE2-CE1 3.53Å; Y843-Y930 HydrophobicContact CE2-CE1 3.53Å; Y843-Y930 HydrophobicContact CE2-CE2 4.25Å; Y843-Y930 AromaticContact CE2-CG 3.42Å; Y843-Y930 HydrophobicContact CE2-CG 3.42Å; Y843-Y930 VanDerWaalsContact CE2-CG 3.42Å; Y843-Y930 HydrophobicContact CG-CG 4.22Å; Y843-Y930 AromaticContact CZ-CG 3.97Å; E926-Y930 HydrophobicContact CB-CD2 4.48Å; E926-Y930 WeakPolarHBondContact O-CB 3.19Å; E926-Y930 WeakPolarHBondContact O-CD2 3.25Å; E926-Y930 PolarHBondContact O-N 3.1Å; I928-Y930 PolarHBondContact O-N 3.3Å; Y930-R1002 PolarHBondContact OH-NE 2.99Å
931	G	78.1	Confident	86.1	Confident	16 Å²	16	34.1 Å²	34.1	17%	0.165	18%	0.176	C	C	.	.	T	Hydrogen-bonded Turn	trans	66	50.2	173.1	0	0	0	0	0	113.3	R845 L927 I928 N933	R845-G931 PolarHBondContact NH2-O 2.95Å; L927-G931 PolarHBondContact O-N 3.09Å; I928-G931 PolarHBondContact O-N 3.29Å; G931-N933 PolarHBondContact O-N 3.39Å; G931-N933 PolarHBondContact O-OD1 3.27Å
932	Y	86.1	Confident	85.4	Confident	9 Å²	9	33.5 Å²	33.5	4%	0.035	17%	0.174	C	C	.	.			trans	-78.1	114.6	173.6	-174.4	-108.2	0	0	0	111.1	I842 T851 R853 I908 V912 L927 Y934 I935	I842-Y932 HydrophobicContact CD1-CD1 4.49Å; I842-Y932 HydrophobicContact CD1-CE1 3.99Å; I842-Y932 HydrophobicContact CD1-CE2 4.16Å; I842-Y932 HydrophobicContact CG1-CE2 4.24Å; T851-Y932 HydrophobicContact CG2-CD2 4.4Å; R853-Y932 VanDerWaalsContact CD-OH 3.25Å; R853-Y932 WeakPolarHBondContact CD-OH 3.48Å; R853-Y932 PolarHBondContact NH1-OH 3.26Å; I908-Y932 WeakPolarHBondContact CG2-OH 3.2Å; V912-Y932 HydrophobicContact CG2-CE1 4.06Å; L927-Y932 HydrophobicContact CD2-CD1 4.11Å; L927-Y932 HydrophobicContact CD2-CG 3.94Å; L927-Y932 VanDerWaalsContact O-CB 3.3Å; L927-Y932 WeakPolarHBondContact O-CB 3.48Å; L927-Y932 PolarHBondContact O-N 3.08Å; Y932-Y934 VanDerWaalsContact C-N 3.3Å; Y932-Y934 HydrophobicContact CE2-CD2 4.12Å; Y932-Y934 PolarHBondContact O-N 3.48Å; Y932-I935 HydrophobicContact CD1-CG1 3.79Å
933	N	82.3	Confident	84.4	Confident	28 Å²	28	30.7 Å²	30.7	15%	0.15	17%	0.166	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.3	-14.5	-165.6	-60.4	5.2	0	0	0	114.8	R845 G931 W1110	R845-N933 PolarHBondContact NH2-OD1 3.4Å; G931-N933 PolarHBondContact O-N 3.39Å; G931-N933 PolarHBondContact O-OD1 3.27Å; N933-W1110 HydrophobicContact CB-CE3 4.26Å; N933-W1110 HydrophobicContact CB-CZ3 4.33Å; N933-W1110 VanDerWaalsContact OD1-CE3 3.24Å; N933-W1110 WeakPolarHBondContact OD1-CZ3 3.42Å
934	Y	86.2	Confident	83.7	Confident	15 Å²	15	37.3 Å²	37.3	6%	0.059	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	trans	-107	13.6	-164.7	-56.6	-89.7	0	0	0	114.8	R853 D854 N857 Y932 H936 L937 A938	R853-Y934 HydrophobicContact CB-CD2 4.28Å; R853-Y934 HydrophobicContact CB-CE2 4.14Å; R853-Y934 VanDerWaalsContact CD-CG 3.49Å; R853-Y934 HydrophobicContact CG-CD1 4.44Å; R853-Y934 HydrophobicContact CG-CD2 4.08Å; R853-Y934 HydrophobicContact CG-CE1 4.39Å; R853-Y934 HydrophobicContact CG-CE2 3.99Å; R853-Y934 HydrophobicContact CG-CG 4.32Å; R853-Y934 VanDerWaalsContact CZ-CB 3.45Å; R853-Y934 VanDerWaalsContact NE-CD1 3.35Å; D854-Y934 WeakPolarHBondContact OD1-CE2 3.42Å; D854-Y934 PolarHBondContact OD1-OH 3.24Å; N857-Y934 PolarHBondContact ND2-OH 3.24Å; N857-Y934 VanDerWaalsContact ND2-OH 3.16Å; Y932-Y934 VanDerWaalsContact C-N 3.3Å; Y932-Y934 HydrophobicContact CE2-CD2 4.12Å; Y932-Y934 PolarHBondContact O-N 3.48Å; Y934-H936 VanDerWaalsContact C-N 3.26Å; Y934-H936 PolarHBondContact O-N 3.39Å; Y934-L937 HydrophobicContact CD1-CD1 3.84Å; Y934-L937 PolarHBondContact O-N 2.68Å; Y934-L937 VanDerWaalsContact O-N 3.12Å; Y934-A938 PolarHBondContact O-N 2.9Å
935	I	86.5	Confident	83.3	Confident	5 Å²	5	43.4 Å²	43.4	3%	0.026	21%	0.21	C	C	.	.	G	3₁₀ helix	trans	-56.5	-41.2	-178.5	-60.6	175.8	0	0	0	111.2	M924 L927 I928 Y932 L937 A938 L964	M924-I935 HydrophobicContact SD-CG2 4.2Å; L927-I935 HydrophobicContact CB-CD1 4.06Å; I928-I935 HydrophobicContact CG1-CD1 3.63Å; Y932-I935 HydrophobicContact CD1-CG1 3.79Å; I935-L937 VanDerWaalsContact C-N 3.31Å; I935-L937 PolarHBondContact O-N 3.31Å; I935-A938 WeakPolarHBondContact O-CB 3.43Å; I935-A938 PolarHBondContact O-N 3.09Å; I935-L964 HydrophobicContact CG2-CD2 3.64Å
936	H	85.2	Confident	83.2	Confident	109 Å²	109	44.4 Å²	44.4	51%	0.505	21%	0.214	S	C	.	.	G	3₁₀ helix	trans	-71.8	-20.8	-178.7	-58.2	-68.9	0	0	0	114.3	Y934	Y934-H936 VanDerWaalsContact C-N 3.26Å; Y934-H936 PolarHBondContact O-N 3.39Å
937	L	84.7	Confident	83.4	Confident	80 Å²	80	44 Å²	44	42%	0.419	22%	0.217	S	C	.	.	G	3₁₀ helix	trans	-88.6	-14.3	179.3	-65.1	170.6	0	0	0	112.3	Y934 I935 N939	Y934-L937 HydrophobicContact CD1-CD1 3.84Å; Y934-L937 PolarHBondContact O-N 2.68Å; Y934-L937 VanDerWaalsContact O-N 3.12Å; I935-L937 VanDerWaalsContact C-N 3.31Å; I935-L937 PolarHBondContact O-N 3.31Å; L937-N939 PolarHBondContact O-N 2.91Å; L937-N939 PolarHBondContact O-ND2 2.96Å
938	A	87.4	Confident	83.4	Confident	1 Å²	1	43.9 Å²	43.9	1%	0.008	22%	0.217	C	C	.	.			trans	-64.3	126.2	-177.9	0	0	0	0	0	112.6	V912 Y934 I935 S947 A948	V912-A938 HydrophobicContact CB-CB 3.58Å; V912-A938 HydrophobicContact CG1-CB 3.45Å; V912-A938 VanDerWaalsContact CG1-CB 3.45Å; Y934-A938 PolarHBondContact O-N 2.9Å; I935-A938 WeakPolarHBondContact O-CB 3.43Å; I935-A938 PolarHBondContact O-N 3.09Å; A938-S947 WeakPolarHBondContact O-CA 3.14Å; A938-A948 HydrophobicContact CB-CB 4.38Å; A938-A948 PolarHBondContact O-N 3.43Å
939	N	90.1	Very high	83.5	Confident	32 Å²	32	48.1 Å²	48.1	17%	0.171	23%	0.232	C	C	.	.	B	Isolated β-bridge	trans	-141.2	163.3	-179.5	63.2	74.5	0	0	0	111.4	D909 R910 A913 L937 G941 F945 K946	D909-N939 CarbonylContact C-O 3.58Å; D909-N939 VanDerWaalsContact C-O 3.29Å; R910-N939 WeakPolarHBondContact CA-O 3.13Å; R910-N939 PolarHBondContact N-O 2.87Å; A913-N939 VanDerWaalsContact CB-C 3.47Å; A913-N939 WeakPolarHBondContact CB-O 3.33Å; L937-N939 PolarHBondContact O-N 2.91Å; L937-N939 PolarHBondContact O-ND2 2.96Å; N939-G941 PolarHBondContact O-N 3.43Å; N939-G941 VanDerWaalsContact O-N 3.16Å; N939-G941 WeakPolarHBondContact OD1-CA 3.34Å; N939-G941 PolarHBondContact OD1-N 3.24Å; N939-F945 WeakPolarHBondContact OD1-CD1 3.44Å; N939-K946 CarbonylContact C-O 3.5Å; N939-K946 WeakPolarHBondContact CA-O 3.5Å; N939-K946 WeakPolarHBondContact CB-O 3.3Å
940	S	85	Confident	83.9	Confident	26 Å²	26	49.1 Å²	49.1	18%	0.182	24%	0.239	C	C	.	.			trans	-67	-8.6	-179.4	42.9	0	0	0	0	115.6	R944 K946	S940-R944 PolarHBondContact OG-O 3.41Å; S940-K946 PolarHBondContact N-O 3.45Å; S940-K946 PolarHBondContact OG-N 3.03Å; S940-K946 PolarHBondContact OG-O 3.27Å
941	G	81	Confident	84.3	Confident	2 Å²	2	48.1 Å²	48.1	2%	0.021	24%	0.237	C	C	.	.			trans	71	-173.3	-169.9	0	0	0	0	0	113.5	N939 R944	N939-G941 PolarHBondContact O-N 3.43Å; N939-G941 VanDerWaalsContact O-N 3.16Å; N939-G941 WeakPolarHBondContact OD1-CA 3.34Å; N939-G941 PolarHBondContact OD1-N 3.24Å; G941-R944 CarbonylContact O-C 3.47Å; G941-R944 VanDerWaalsContact O-C 3.27Å; G941-R944 VanDerWaalsContact O-O 3.1Å
942	P	75.5	Confident	84.9	Confident	23 Å²	23	47.4 Å²	47.4	15%	0.149	23%	0.229	C	C	.	.	S	Bend	trans	-62.6	149.3	176.4	25.7	-32.7	0	0	0	111.4	D895 L902 F945	D895-P942 HydrophobicContact CB-CG 4.32Å; L902-P942 HydrophobicContact CD2-CG 3.66Å; P942-F945 HydrophobicContact CB-CE2 4.49Å; P942-F945 HydrophobicContact CB-CZ 4.38Å
943	V	68.6	Low	85.2	Confident	68 Å²	68	52.2 Å²	52.2	41%	0.412	25%	0.252	S	S	.	.	S	Bend	cis	-81.2	-27.6	8.6	-175.6	0	0	0	0	113.7	E897	E897-V943 HydrophobicContact CB-CG2 4.42Å; E897-V943 VanDerWaalsContact CD-CG1 3.46Å; E897-V943 HydrophobicContact CG-CG2 3.51Å; E897-V943 WeakPolarHBondContact OE1-CG1 3.18Å; E897-V943 WeakPolarHBondContact OE1-CG2 3.36Å; E897-V943 VanDerWaalsContact OE2-CG1 3.3Å; E897-V943 WeakPolarHBondContact OE2-CG1 3.28Å
944	R	75.4	Confident	85.6	Confident	185 Å²	185	56.1 Å²	56.1	70%	0.698	27%	0.27	S	S	*	.			trans	-118.7	107.6	-175.2	-63.4	-175.2	-175.4	-172.1	2.6	109.7	S940 G941 K946	S940-R944 PolarHBondContact OG-O 3.41Å; G941-R944 CarbonylContact O-C 3.47Å; G941-R944 VanDerWaalsContact O-C 3.27Å; G941-R944 VanDerWaalsContact O-O 3.1Å; R944-K946 PolarHBondContact O-N 3.47Å
945	F	82.4	Confident	85.8	Confident	127 Å²	127	61.1 Å²	61.1	56%	0.557	29%	0.292	S	S	*	.			trans	-70.2	96.2	174.4	-65.5	-90.3	0	0	0	110.2	N939 P942	N939-F945 WeakPolarHBondContact OD1-CD1 3.44Å; P942-F945 HydrophobicContact CB-CE2 4.49Å; P942-F945 HydrophobicContact CB-CZ 4.38Å
946	K	87.8	Confident	86.1	Confident	62 Å²	62	62.7 Å²	62.7	27%	0.27	31%	0.309	S	S	.	.			trans	-109.5	129.4	172.6	-63.5	179.3	177.3	-177.6	0	108.9	N939 S940 R944 V950 L951	N939-K946 CarbonylContact C-O 3.5Å; N939-K946 WeakPolarHBondContact CA-O 3.5Å; N939-K946 WeakPolarHBondContact CB-O 3.3Å; S940-K946 PolarHBondContact N-O 3.45Å; S940-K946 PolarHBondContact OG-N 3.03Å; S940-K946 PolarHBondContact OG-O 3.27Å; R944-K946 PolarHBondContact O-N 3.47Å; K946-V950 HydrophobicContact CB-CG1 4.49Å; K946-L951 HydrophobicContact CB-CD1 4.5Å; K946-L951 HydrophobicContact CB-CD2 3.87Å; K946-L951 HydrophobicContact CB-CG 3.91Å; K946-L951 HydrophobicContact CD-CD2 3.77Å; K946-L951 HydrophobicContact CG-CD2 4.49Å
947	S	90.2	Very high	86.5	Confident	46 Å²	46	59.5 Å²	59.5	32%	0.322	29%	0.294	S	S	.	.	B	Isolated β-bridge	trans	-66.2	155.5	176	67.9	0	0	0	0	111.3	A938 R949 V950 L951	A938-S947 WeakPolarHBondContact O-CA 3.14Å; S947-R949 PolarHBondContact O-N 3.48Å; S947-V950 PolarHBondContact O-N 2.66Å; S947-V950 VanDerWaalsContact O-N 3.09Å; S947-V950 WeakPolarHBondContact OG-CG2 3.14Å; S947-V950 PolarHBondContact OG-N 3.04Å; S947-L951 PolarHBondContact O-N 3.41Å
948	A	88.3	Confident	86.8	Confident	3 Å²	3	62.9 Å²	62.9	3%	0.025	31%	0.308	C	S	.	.	H	α-helix	trans	-50	-40.3	176.1	0	0	0	0	0	112.8	A916 A938 L951 A952	A916-A948 HydrophobicContact CB-CB 3.74Å; A916-A948 WeakPolarHBondContact CB-O 3.44Å; A938-A948 HydrophobicContact CB-CB 4.38Å; A938-A948 PolarHBondContact O-N 3.43Å; A948-L951 PolarHBondContact O-N 3.1Å; A948-A952 PolarHBondContact O-N 2.96Å; A948-A952 VanDerWaalsContact O-N 3.09Å
949	R	89.8	Confident	86.9	Confident	98 Å²	98	69.4 Å²	69.4	37%	0.37	34%	0.338	S	S	.	.	H	α-helix	trans	-64.1	-46.9	177.3	-170.9	-176	179.6	-71.4	-2.8	112.7	S947 L951 A952 E953 L964 D965	S947-R949 PolarHBondContact O-N 3.48Å; R949-L951 VanDerWaalsContact C-N 3.29Å; R949-L951 PolarHBondContact O-N 3.41Å; R949-A952 PolarHBondContact O-N 2.93Å; R949-E953 IonicContact NH1-OE2 2.94Å; R949-E953 PolarHBondContact NH1-OE2 3.09Å; R949-E953 WeakPolarHBondContact O-CB 3.37Å; R949-E953 PolarHBondContact O-N 3.17Å; R949-L964 HydrophobicContact CB-CD1 4.33Å; R949-D965 IonicContact CZ-OD1 3.38Å; R949-D965 IonicContact NE-OD1 3.81Å; R949-D965 PolarHBondContact NE-OD1 3.06Å; R949-D965 IonicContact NE-OD2 2.96Å; R949-D965 IonicContact NH2-OD1 3.13Å; R949-D965 IonicContact NH2-OD2 2.84Å; R949-D965 PolarHBondContact NH2-OD2 2.88Å
950	V	90	Very high	87	Confident	51 Å²	51	67.9 Å²	67.9	31%	0.309	33%	0.33	S	S	.	.	H	α-helix	trans	-64.7	-35.1	178.9	171.9	0	0	0	0	111.2	K946 S947 E953 Q954	K946-V950 HydrophobicContact CB-CG1 4.49Å; S947-V950 PolarHBondContact O-N 2.66Å; S947-V950 VanDerWaalsContact O-N 3.09Å; S947-V950 WeakPolarHBondContact OG-CG2 3.14Å; S947-V950 PolarHBondContact OG-N 3.04Å; V950-E953 PolarHBondContact O-N 3.04Å; V950-Q954 HydrophobicContact CG1-CG 4.42Å; V950-Q954 WeakPolarHBondContact O-CB 3.13Å; V950-Q954 VanDerWaalsContact O-CG 3.28Å; V950-Q954 WeakPolarHBondContact O-CG 3.14Å; V950-Q954 PolarHBondContact O-N 3.19Å
951	L	90	Very high	87.3	Confident	25 Å²	25	67.7 Å²	67.7	13%	0.131	33%	0.327	C	S	.	.	H	α-helix	trans	-67.5	-39.4	175.4	-69.9	170.1	0	0	0	112.6	A913 K946 S947 A948 R949 K955	A913-L951 HydrophobicContact CB-CD1 3.84Å; K946-L951 HydrophobicContact CB-CD1 4.5Å; K946-L951 HydrophobicContact CB-CD2 3.87Å; K946-L951 HydrophobicContact CB-CG 3.91Å; K946-L951 HydrophobicContact CD-CD2 3.77Å; K946-L951 HydrophobicContact CG-CD2 4.49Å; S947-L951 PolarHBondContact O-N 3.41Å; A948-L951 PolarHBondContact O-N 3.1Å; R949-L951 VanDerWaalsContact C-N 3.29Å; R949-L951 PolarHBondContact O-N 3.41Å; L951-K955 PolarHBondContact O-N 2.91Å
952	A	91.2	Very high	87.8	Confident	0 Å²	0	71.1 Å²	71.1	0%	0	35%	0.35	C	S	.	.	H	α-helix	trans	-65.6	-41.1	174.1	0	0	0	0	0	111.3	A948 R949 K955 G956 H957 M960 I961	A948-A952 PolarHBondContact O-N 2.96Å; A948-A952 VanDerWaalsContact O-N 3.09Å; R949-A952 PolarHBondContact O-N 2.93Å; A952-K955 PolarHBondContact O-N 3.05Å; A952-G956 PolarHBondContact O-N 2.9Å; A952-H957 HydrophobicContact CB-CB 4.28Å; A952-H957 PolarHBondContact O-N 3.5Å; A952-M960 HydrophobicContact CB-CB 4.36Å; A952-M960 HydrophobicContact CB-CG 3.96Å; A952-I961 HydrophobicContact CB-CG1 3.85Å
953	E	92	Very high	88.5	Confident	110 Å²	110	70.5 Å²	70.5	51%	0.514	35%	0.345	S	S	.	.	H	α-helix	trans	-62.3	-47.3	176.2	-172.2	171.4	-175.9	0	0	112.3	R949 V950 K955 G956 I961	R949-E953 IonicContact NH1-OE2 2.94Å; R949-E953 PolarHBondContact NH1-OE2 3.09Å; R949-E953 WeakPolarHBondContact O-CB 3.37Å; R949-E953 PolarHBondContact O-N 3.17Å; V950-E953 PolarHBondContact O-N 3.04Å; E953-K955 PolarHBondContact O-N 2.94Å; E953-G956 PolarHBondContact O-N 2.79Å; E953-G956 VanDerWaalsContact O-N 3.1Å; E953-I961 HydrophobicContact CB-CD1 4.08Å
954	Q	90.9	Very high	89.4	Confident	111 Å²	111	67.9 Å²	67.9	52%	0.519	33%	0.329	S	S	.	.	H	α-helix	trans	-62.4	-26.5	178	-76.2	173.5	5.8	0	0	113.6	V950	V950-Q954 HydrophobicContact CG1-CG 4.42Å; V950-Q954 WeakPolarHBondContact O-CB 3.13Å; V950-Q954 VanDerWaalsContact O-CG 3.28Å; V950-Q954 WeakPolarHBondContact O-CG 3.14Å; V950-Q954 PolarHBondContact O-N 3.19Å
955	K	90.8	Very high	90	Very high	120 Å²	120	63.6 Å²	63.6	52%	0.522	32%	0.32	S	S	.	.	H	α-helix	trans	-96.7	-3.1	177.8	-71.9	-174.3	174	-171.2	0	114	S917 L951 A952 E953 H957	S917-K955 WeakPolarHBondContact O-CD 3.45Å; S917-K955 WeakPolarHBondContact O-CE 3.34Å; S917-K955 PolarHBondContact O-NZ 3.47Å; S917-K955 PolarHBondContact OG-NZ 3.45Å; L951-K955 PolarHBondContact O-N 2.91Å; A952-K955 PolarHBondContact O-N 3.05Å; E953-K955 PolarHBondContact O-N 2.94Å; K955-H957 WeakPolarHBondContact CB-NE2 3.44Å
956	G	91.1	Very high	90.2	Very high	38 Å²	38	59.3 Å²	59.3	39%	0.392	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	76.1	24.7	178.6	0	0	0	0	0	115.1	A952 E953 H958	A952-G956 PolarHBondContact O-N 2.9Å; E953-G956 PolarHBondContact O-N 2.79Å; E953-G956 VanDerWaalsContact O-N 3.1Å; G956-H958 PolarHBondContact O-CD2 2.89Å; G956-H958 PolarHBondContact O-N 3Å
957	H	93.6	Very high	90.1	Very high	41 Å²	41	56.9 Å²	56.9	19%	0.19	30%	0.295	C	S	.	.			trans	-83.5	73.7	-177.3	-61	-32.2	0	0	0	111.9	A916 S917 N919 A952 K955 E959 M960 I961	A916-H957 PolarHBondContact O-CD2 2.83Å; S917-H957 PolarHBondContact O-NE2 2.87Å; N919-H957 HydrophobicContact CB-CB 4.48Å; A952-H957 HydrophobicContact CB-CB 4.28Å; A952-H957 PolarHBondContact O-N 3.5Å; K955-H957 WeakPolarHBondContact CB-NE2 3.44Å; H957-E959 PolarHBondContact O-N 2.76Å; H957-M960 HydrophobicContact CB-CB 3.94Å; H957-M960 WeakPolarHBondContact O-CB 3.44Å; H957-M960 PolarHBondContact O-N 2.92Å; H957-M960 VanDerWaalsContact O-N 3.16Å; H957-I961 WeakPolarHBondContact O-CG1 3.31Å; H957-I961 PolarHBondContact O-N 2.99Å; H957-I961 VanDerWaalsContact O-N 3.12Å
958	H	91.6	Very high	89.8	Confident	152 Å²	152	58.7 Å²	58.7	70%	0.704	30%	0.301	S	S	*	.	H	α-helix	trans	-57.5	-40.9	-173.1	-65.2	-65.3	0	0	0	114.7	G956 M960 I961 S962	G956-H958 PolarHBondContact O-CD2 2.89Å; G956-H958 PolarHBondContact O-N 3Å; H958-M960 VanDerWaalsContact C-N 3.34Å; H958-M960 PolarHBondContact O-N 2.88Å; H958-I961 PolarHBondContact O-N 3.25Å; H958-S962 PolarHBondContact O-N 3.25Å
959	E	90.6	Very high	89.6	Confident	138 Å²	138	64 Å²	64	65%	0.645	33%	0.325	S	S	*	.	H	α-helix	trans	-64.5	-39	178.3	-66.9	-179.4	178.6	0	0	111.9	L921 H957 S962 L963	L921-E959 HydrophobicContact CD1-CB 3.89Å; L921-E959 WeakPolarHBondContact CD1-OE2 3.4Å; L921-E959 HydrophobicContact CD2-CB 4.06Å; H957-E959 PolarHBondContact O-N 2.76Å; E959-S962 PolarHBondContact O-N 3.18Å; E959-L963 WeakPolarHBondContact O-CB 3.42Å; E959-L963 PolarHBondContact O-N 3.03Å
960	M	92.1	Very high	89.2	Confident	0 Å²	0	61.2 Å²	61.2	0%	0	32%	0.315	C	S	.	.	H	α-helix	trans	-67.1	-39.5	178	179.1	64.1	71.3	0	0	111.1	A916 L921 M924 A952 H957 H958 L963 L964	A916-M960 HydrophobicContact CB-CG 4.36Å; L921-M960 HydrophobicContact CD2-CB 3.89Å; L921-M960 HydrophobicContact CD2-CE 3.89Å; L921-M960 HydrophobicContact CD2-SD 4.27Å; L921-M960 HydrophobicContact CG-CE 4.17Å; M924-M960 HydrophobicContact CB-CE 3.95Å; M924-M960 HydrophobicContact CB-SD 3.84Å; M924-M960 HydrophobicContact CE-SD 3.93Å; M924-M960 HydrophobicContact CG-CE 4.47Å; M924-M960 HydrophobicContact CG-SD 3.72Å; A952-M960 HydrophobicContact CB-CB 4.36Å; A952-M960 HydrophobicContact CB-CG 3.96Å; H957-M960 HydrophobicContact CB-CB 3.94Å; H957-M960 WeakPolarHBondContact O-CB 3.44Å; H957-M960 PolarHBondContact O-N 2.92Å; H957-M960 VanDerWaalsContact O-N 3.16Å; H958-M960 VanDerWaalsContact C-N 3.34Å; H958-M960 PolarHBondContact O-N 2.88Å; M960-L963 PolarHBondContact O-N 3.33Å; M960-L964 HydrophobicContact CG-CD1 4.11Å; M960-L964 HydrophobicContact CG-CG 4.49Å; M960-L964 WeakPolarHBondContact O-CB 3.5Å; M960-L964 VanDerWaalsContact O-CG 3.28Å; M960-L964 WeakPolarHBondContact O-CG 3.48Å; M960-L964 PolarHBondContact O-N 3.27Å; M960-L964 HydrophobicContact SD-CD1 4.44Å; M960-L964 HydrophobicContact SD-CG 4.36Å
961	I	90.9	Very high	88.7	Confident	22 Å²	22	62.6 Å²	62.6	11%	0.113	32%	0.315	C	S	.	.	H	α-helix	trans	-64.2	-47	176.8	-62	163.6	0	0	0	110	A952 E953 H957 H958 L963 L964 D965	A952-I961 HydrophobicContact CB-CG1 3.85Å; E953-I961 HydrophobicContact CB-CD1 4.08Å; H957-I961 WeakPolarHBondContact O-CG1 3.31Å; H957-I961 PolarHBondContact O-N 2.99Å; H957-I961 VanDerWaalsContact O-N 3.12Å; H958-I961 PolarHBondContact O-N 3.25Å; I961-L963 VanDerWaalsContact C-N 3.27Å; I961-L963 PolarHBondContact O-N 3.11Å; I961-L964 PolarHBondContact O-N 3.46Å; I961-L964 VanDerWaalsContact O-N 3.16Å; I961-D965 WeakPolarHBondContact O-CB 2.8Å; I961-D965 PolarHBondContact O-N 2.9Å
962	S	91.5	Very high	88.4	Confident	73 Å²	73	66 Å²	66	51%	0.51	34%	0.336	S	S	.	.	H	α-helix	trans	-57.5	-41.4	175.5	-177.7	0	0	0	0	112	H958 E959 D965 T966	H958-S962 PolarHBondContact O-N 3.25Å; E959-S962 PolarHBondContact O-N 3.18Å; S962-D965 PolarHBondContact O-N 3.33Å; S962-T966 VanDerWaalsContact O-CG2 3.3Å; S962-T966 WeakPolarHBondContact O-CG2 3.44Å; S962-T966 PolarHBondContact O-N 3.46Å; S962-T966 PolarHBondContact O-OG1 2.89Å
963	L	89.2	Confident	88	Confident	10 Å²	10	68.5 Å²	68.5	5%	0.052	35%	0.348	C	S	.	.	H	α-helix	trans	-64.8	-45.1	175.7	-177.5	67.2	0	0	0	112.3	L921 M924 E925 I928 E959 M960 I961 D965 T966 V967 Y970	L921-L963 HydrophobicContact CD2-CD2 4.31Å; M924-L963 HydrophobicContact CB-CD2 3.98Å; M924-L963 HydrophobicContact CG-CD2 4.03Å; E925-L963 HydrophobicContact CB-CD2 4.36Å; E925-L963 HydrophobicContact CG-CD1 3.72Å; E925-L963 HydrophobicContact CG-CD2 3.39Å; E925-L963 HydrophobicContact CG-CG 4.19Å; I928-L963 HydrophobicContact CD1-CD1 3.79Å; I928-L963 HydrophobicContact CD1-CD2 4.06Å; I928-L963 HydrophobicContact CD1-CG 3.63Å; E959-L963 WeakPolarHBondContact O-CB 3.42Å; E959-L963 PolarHBondContact O-N 3.03Å; M960-L963 PolarHBondContact O-N 3.33Å; I961-L963 VanDerWaalsContact C-N 3.27Å; I961-L963 PolarHBondContact O-N 3.11Å; L963-D965 VanDerWaalsContact C-N 3.31Å; L963-D965 PolarHBondContact O-N 3.48Å; L963-T966 WeakPolarHBondContact CA-OG1 3.4Å; L963-T966 PolarHBondContact O-N 3.47Å; L963-T966 PolarHBondContact O-OG1 3.35Å; L963-V967 WeakPolarHBondContact O-CG2 3.3Å; L963-V967 PolarHBondContact O-N 3.34Å; L963-Y970 HydrophobicContact CD1-CE2 4.39Å
964	L	88.4	Confident	87.7	Confident	13 Å²	13	63.9 Å²	63.9	7%	0.068	33%	0.327	C	S	.	.	H	α-helix	trans	-65.6	-33.3	178.4	-73.4	173.4	0	0	0	112.7	A916 M924 I935 R949 M960 I961 T966 V967	A916-L964 HydrophobicContact CB-CD1 4.44Å; M924-L964 HydrophobicContact CE-CD2 4.08Å; M924-L964 HydrophobicContact CG-CD2 4.21Å; M924-L964 HydrophobicContact SD-CD2 4.11Å; I935-L964 HydrophobicContact CG2-CD2 3.64Å; R949-L964 HydrophobicContact CB-CD1 4.33Å; M960-L964 HydrophobicContact CG-CD1 4.11Å; M960-L964 HydrophobicContact CG-CG 4.49Å; M960-L964 WeakPolarHBondContact O-CB 3.5Å; M960-L964 VanDerWaalsContact O-CG 3.28Å; M960-L964 WeakPolarHBondContact O-CG 3.48Å; M960-L964 PolarHBondContact O-N 3.27Å; M960-L964 HydrophobicContact SD-CD1 4.44Å; M960-L964 HydrophobicContact SD-CG 4.36Å; I961-L964 PolarHBondContact O-N 3.46Å; I961-L964 VanDerWaalsContact O-N 3.16Å; L964-T966 VanDerWaalsContact C-N 3.3Å; L964-V967 VanDerWaalsContact O-CG2 3.23Å; L964-V967 WeakPolarHBondContact O-CG2 2.98Å
965	D	88.5	Confident	87.3	Confident	95 Å²	95	62.8 Å²	62.8	51%	0.508	32%	0.323	S	S	.	.	H	α-helix	trans	-76.6	-17	177	-69.1	-16.3	0	0	0	111.9	R949 I961 S962 L963	R949-D965 IonicContact CZ-OD1 3.38Å; R949-D965 IonicContact NE-OD1 3.81Å; R949-D965 PolarHBondContact NE-OD1 3.06Å; R949-D965 IonicContact NE-OD2 2.96Å; R949-D965 IonicContact NH2-OD1 3.13Å; R949-D965 IonicContact NH2-OD2 2.84Å; R949-D965 PolarHBondContact NH2-OD2 2.88Å; I961-D965 WeakPolarHBondContact O-CB 2.8Å; I961-D965 PolarHBondContact O-N 2.9Å; S962-D965 PolarHBondContact O-N 3.33Å; L963-D965 VanDerWaalsContact C-N 3.31Å; L963-D965 PolarHBondContact O-N 3.48Å
966	T	86.1	Confident	87	Confident	37 Å²	37	60.4 Å²	60.4	23%	0.227	31%	0.313	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.2	2	-179.7	51.1	0	0	0	0	114.9	S962 L963 L964 D968 Q969 Y970	S962-T966 VanDerWaalsContact O-CG2 3.3Å; S962-T966 WeakPolarHBondContact O-CG2 3.44Å; S962-T966 PolarHBondContact O-N 3.46Å; S962-T966 PolarHBondContact O-OG1 2.89Å; L963-T966 WeakPolarHBondContact CA-OG1 3.4Å; L963-T966 PolarHBondContact O-N 3.47Å; L963-T966 PolarHBondContact O-OG1 3.35Å; L964-T966 VanDerWaalsContact C-N 3.3Å; T966-D968 PolarHBondContact O-N 3.1Å; T966-Q969 PolarHBondContact O-N 3.32Å; T966-Y970 WeakPolarHBondContact O-CD2 3.32Å; T966-Y970 PolarHBondContact O-N 3.16Å; T966-Y970 VanDerWaalsContact O-N 3.15Å
967	V	85.1	Confident	86.8	Confident	11 Å²	11	58.6 Å²	58.6	7%	0.067	30%	0.295	C	S	.	.	H	α-helix	trans	-54.1	-49.1	-175.2	175.9	0	0	0	0	112.9	I928 L963 L964 Q969 Y970 R971	I928-V967 HydrophobicContact CD1-CG2 3.68Å; I928-V967 HydrophobicContact CG1-CG1 4.35Å; I928-V967 HydrophobicContact CG1-CG2 3.95Å; I928-V967 HydrophobicContact CG2-CG1 4.45Å; L963-V967 WeakPolarHBondContact O-CG2 3.3Å; L963-V967 PolarHBondContact O-N 3.34Å; L964-V967 VanDerWaalsContact O-CG2 3.23Å; L964-V967 WeakPolarHBondContact O-CG2 2.98Å; V967-Q969 VanDerWaalsContact C-N 3.33Å; V967-Q969 PolarHBondContact O-N 3.29Å; V967-Y970 PolarHBondContact O-N 2.79Å; V967-R971 PolarHBondContact O-N 3.38Å; V967-R971 VanDerWaalsContact O-N 3.08Å
968	D	84.3	Confident	86.5	Confident	84 Å²	84	57.3 Å²	57.3	45%	0.449	29%	0.289	S	S	.	.	H	α-helix	trans	-67.9	-33.2	-176.3	-70.8	-36.8	0	0	0	112.6	T966 T972	T966-D968 PolarHBondContact O-N 3.1Å; D968-T972 PolarHBondContact O-N 3.09Å; D968-T972 VanDerWaalsContact O-N 3.15Å; D968-T972 PolarHBondContact O-OG1 3.49Å
969	Q	84.3	Confident	86.3	Confident	116 Å²	116	55.6 Å²	55.6	54%	0.542	28%	0.279	S	S	.	.	H	α-helix	trans	-65.7	-50.6	175.3	-177.4	-177.9	-10.7	0	0	110.6	T966 V967 R971 T972 E973	T966-Q969 PolarHBondContact O-N 3.32Å; V967-Q969 VanDerWaalsContact C-N 3.33Å; V967-Q969 PolarHBondContact O-N 3.29Å; Q969-R971 VanDerWaalsContact C-N 3.29Å; Q969-R971 PolarHBondContact O-N 3.35Å; Q969-T972 PolarHBondContact O-N 3.49Å; Q969-T972 VanDerWaalsContact O-N 3.14Å; Q969-E973 PolarHBondContact NE2-OE1 3.41Å; Q969-E973 PolarHBondContact O-N 3.04Å
970	Y	80.6	Confident	86.2	Confident	39 Å²	39	49.1 Å²	49.1	15%	0.153	25%	0.249	C	C	.	.	H	α-helix	trans	-56.7	-45.1	178	-85.6	-67.3	0	0	0	111.7	I928 L963 T966 V967 T972 E973 M974 R997	I928-Y970 HydrophobicContact CG2-CG 4.47Å; L963-Y970 HydrophobicContact CD1-CE2 4.39Å; T966-Y970 WeakPolarHBondContact O-CD2 3.32Å; T966-Y970 PolarHBondContact O-N 3.16Å; T966-Y970 VanDerWaalsContact O-N 3.15Å; V967-Y970 PolarHBondContact O-N 2.79Å; Y970-T972 VanDerWaalsContact C-N 3.29Å; Y970-T972 PolarHBondContact O-N 3.32Å; Y970-E973 PolarHBondContact O-N 3.4Å; Y970-M974 WeakPolarHBondContact O-CB 3.5Å; Y970-M974 WeakPolarHBondContact O-CG 3.46Å; Y970-M974 PolarHBondContact O-N 2.91Å; Y970-R997 HydrophobicContact CE1-CB 4.37Å; Y970-R997 WeakPolarHBondContact OH-CD 3.2Å; Y970-R997 PolarHBondContact OH-NH1 3.26Å; Y970-R997 VanDerWaalsContact OH-NH1 3.09Å
971	R	79.7	Confident	86.1	Confident	80 Å²	80	49.1 Å²	49.1	30%	0.302	25%	0.249	S	C	.	.	H	α-helix	trans	-58.5	-41.6	178.6	179.6	173.5	160.8	-163.1	-12.8	112.3	V967 Q969 M975 W1110	V967-R971 PolarHBondContact O-N 3.38Å; V967-R971 VanDerWaalsContact O-N 3.08Å; Q969-R971 VanDerWaalsContact C-N 3.29Å; Q969-R971 PolarHBondContact O-N 3.35Å; R971-M975 WeakPolarHBondContact O-CG 3.47Å; R971-M975 PolarHBondContact O-N 3.12Å; R971-M975 VanDerWaalsContact O-N 3.1Å; R971-W1110 HydrophobicContact CG-CH2 4.24Å; R971-W1110 VanDerWaalsContact NH1-CE3 3.29Å
972	T	83.9	Confident	85.9	Confident	96 Å²	96	49.9 Å²	49.9	59%	0.589	25%	0.253	S	S	*	.	H	α-helix	trans	-66.7	-45.7	177.9	-54.1	0	0	0	0	111.5	D968 Q969 Y970 M974 M975 E976	D968-T972 PolarHBondContact O-N 3.09Å; D968-T972 VanDerWaalsContact O-N 3.15Å; D968-T972 PolarHBondContact O-OG1 3.49Å; Q969-T972 PolarHBondContact O-N 3.49Å; Q969-T972 VanDerWaalsContact O-N 3.14Å; Y970-T972 VanDerWaalsContact C-N 3.29Å; Y970-T972 PolarHBondContact O-N 3.32Å; T972-M974 VanDerWaalsContact C-N 3.34Å; T972-M974 PolarHBondContact O-N 3.16Å; T972-M975 PolarHBondContact O-N 3.46Å; T972-E976 PolarHBondContact O-N 2.97Å; T972-E976 VanDerWaalsContact O-N 3.08Å
973	E	83.6	Confident	85.7	Confident	52 Å²	52	50.3 Å²	50.3	24%	0.243	25%	0.253	C	S	.	.	H	α-helix	trans	-60.5	-42.7	176.8	-71.2	177.9	-167.6	0	0	111.8	Q969 Y970 E976 V977 V998	Q969-E973 PolarHBondContact NE2-OE1 3.41Å; Q969-E973 PolarHBondContact O-N 3.04Å; Y970-E973 PolarHBondContact O-N 3.4Å; E973-E976 PolarHBondContact O-N 2.9Å; E973-V977 WeakPolarHBondContact O-CG2 3.23Å; E973-V977 PolarHBondContact O-N 3.25Å; E973-V998 HydrophobicContact CB-CG2 4.3Å
974	M	84.1	Confident	85.7	Confident	13 Å²	13	51.1 Å²	51.1	6%	0.064	26%	0.264	C	S	.	.	H	α-helix	trans	-60.7	-48.5	176.7	-70.2	167.9	60.1	0	0	111.5	L929 Y970 T972 E976 V977 H978	L929-M974 HydrophobicContact CD2-SD 4.32Å; L929-M974 WeakPolarHBondContact O-CE 3.34Å; Y970-M974 WeakPolarHBondContact O-CB 3.5Å; Y970-M974 WeakPolarHBondContact O-CG 3.46Å; Y970-M974 PolarHBondContact O-N 2.91Å; T972-M974 VanDerWaalsContact C-N 3.34Å; T972-M974 PolarHBondContact O-N 3.16Å; M974-E976 VanDerWaalsContact C-N 3.29Å; M974-E976 PolarHBondContact O-N 3.41Å; M974-V977 PolarHBondContact O-N 3.42Å; M974-H978 PolarHBondContact O-N 3.03Å; M974-H978 VanDerWaalsContact O-N 3.13Å; M974-H978 PolarHBondContact O-ND1 3.36Å
975	M	82.3	Confident	85.8	Confident	88 Å²	88	54.1 Å²	54.1	43%	0.433	28%	0.279	S	S	.	.	H	α-helix	trans	-59.1	-42	178.6	-75	-179.2	60.7	0	0	111.8	R971 T972 H978 K979	R971-M975 WeakPolarHBondContact O-CG 3.47Å; R971-M975 PolarHBondContact O-N 3.12Å; R971-M975 VanDerWaalsContact O-N 3.1Å; T972-M975 PolarHBondContact O-N 3.46Å; M975-H978 PolarHBondContact O-N 3.34Å; M975-K979 WeakPolarHBondContact O-CB 3.14Å; M975-K979 PolarHBondContact O-N 2.99Å
976	E	85.4	Confident	85.8	Confident	70 Å²	70	53.2 Å²	53.2	33%	0.327	27%	0.269	S	S	.	.	H	α-helix	trans	-66.7	-41.8	-179.5	-165.3	63.4	-168	0	0	111.7	T972 E973 M974 K979 T980 L992	T972-E976 PolarHBondContact O-N 2.97Å; T972-E976 VanDerWaalsContact O-N 3.08Å; E973-E976 PolarHBondContact O-N 2.9Å; M974-E976 VanDerWaalsContact C-N 3.29Å; M974-E976 PolarHBondContact O-N 3.41Å; E976-K979 WeakPolarHBondContact O-CB 3.18Å; E976-K979 PolarHBondContact O-N 3.04Å; E976-K979 IonicContact OE2-NZ 3.35Å; E976-T980 WeakPolarHBondContact O-CG2 3.14Å; E976-T980 PolarHBondContact O-N 3.14Å; E976-L992 HydrophobicContact CB-CD1 4.06Å; E976-L992 HydrophobicContact CG-CD1 3.71Å
977	V	87.4	Confident	85.9	Confident	0 Å²	0	57 Å²	57	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-62.6	-45.6	176.3	175	0	0	0	0	112.2	E973 M974 K979 T980 I981 F989 L992 V998 L1009	E973-V977 WeakPolarHBondContact O-CG2 3.23Å; E973-V977 PolarHBondContact O-N 3.25Å; M974-V977 PolarHBondContact O-N 3.42Å; V977-K979 VanDerWaalsContact C-N 3.26Å; V977-K979 PolarHBondContact O-N 3.09Å; V977-T980 PolarHBondContact O-N 2.84Å; V977-T980 PolarHBondContact O-OG1 2.69Å; V977-I981 PolarHBondContact O-N 3.4Å; V977-F989 HydrophobicContact CG1-CD2 4.31Å; V977-F989 HydrophobicContact CG1-CE2 4.4Å; V977-L992 HydrophobicContact CG2-CB 3.27Å; V977-L992 HydrophobicContact CG2-CD1 3.61Å; V977-L992 HydrophobicContact CG2-CG 4Å; V977-V998 HydrophobicContact CB-CG1 3.9Å; V977-V998 HydrophobicContact CG1-CG1 4.38Å; V977-V998 HydrophobicContact CG2-CG1 3.41Å; V977-V998 VanDerWaalsContact CG2-CG1 3.41Å; V977-L1009 HydrophobicContact CG1-CD1 3.63Å; V977-L1009 HydrophobicContact CG1-CD2 3.78Å; V977-L1009 HydrophobicContact CG1-CG 4.38Å
978	H	86.6	Confident	86.1	Confident	14 Å²	14	58.9 Å²	58.9	7%	0.065	29%	0.292	C	S	.	.	H	α-helix	trans	-58.7	-41.9	175.4	-68.5	99.9	0	0	0	111.3	M974 M975 T980 I981 I982 S1001 R1002 D1003 L1012	M974-H978 PolarHBondContact O-N 3.03Å; M974-H978 VanDerWaalsContact O-N 3.13Å; M974-H978 PolarHBondContact O-ND1 3.36Å; M975-H978 PolarHBondContact O-N 3.34Å; H978-T980 PolarHBondContact O-N 2.69Å; H978-I981 PolarHBondContact O-N 2.84Å; H978-I982 WeakPolarHBondContact O-CG1 3.45Å; H978-I982 PolarHBondContact O-N 3.24Å; H978-S1001 PolarHBondContact CE1-OG 3.2Å; H978-R1002 VanDerWaalsContact NE2-C 3.31Å; H978-D1003 PolarHBondContact NE2-N 2.87Å; H978-L1012 HydrophobicContact CB-CD1 4.2Å
979	K	87.3	Confident	86.3	Confident	116 Å²	116	54.9 Å²	54.9	50%	0.504	27%	0.271	S	S	.	.	H	α-helix	trans	-60.1	-42	176.8	-174	-179.3	175.7	-172.2	0	111.9	M975 E976 V977 I981 I982 T983	M975-K979 WeakPolarHBondContact O-CB 3.14Å; M975-K979 PolarHBondContact O-N 2.99Å; E976-K979 WeakPolarHBondContact O-CB 3.18Å; E976-K979 PolarHBondContact O-N 3.04Å; E976-K979 IonicContact OE2-NZ 3.35Å; V977-K979 VanDerWaalsContact C-N 3.26Å; V977-K979 PolarHBondContact O-N 3.09Å; K979-I981 VanDerWaalsContact C-N 3.29Å; K979-I981 PolarHBondContact O-N 3.13Å; K979-I982 PolarHBondContact O-N 2.69Å; K979-I982 VanDerWaalsContact O-N 3.14Å; K979-T983 HydrophobicContact CG-CG2 4.08Å; K979-T983 WeakPolarHBondContact O-CG2 3.28Å; K979-T983 PolarHBondContact O-N 3.17Å; K979-T983 PolarHBondContact O-OG1 3.12Å
980	T	89.9	Confident	86.4	Confident	2 Å²	2	52.8 Å²	52.8	1%	0.012	26%	0.263	C	S	.	.	H	α-helix	trans	-57.8	-37	177.7	65.6	0	0	0	0	113.8	E976 V977 H978 T983 G984 D985 Q988 L992	E976-T980 WeakPolarHBondContact O-CG2 3.14Å; E976-T980 PolarHBondContact O-N 3.14Å; V977-T980 PolarHBondContact O-N 2.84Å; V977-T980 PolarHBondContact O-OG1 2.69Å; H978-T980 PolarHBondContact O-N 2.69Å; T980-T983 PolarHBondContact O-OG1 2.52Å; T980-G984 CarbonylContact O-C 3.5Å; T980-G984 VanDerWaalsContact O-CA 3.31Å; T980-G984 WeakPolarHBondContact O-CA 3.44Å; T980-G984 PolarHBondContact O-N 2.91Å; T980-D985 PolarHBondContact O-N 2.52Å; T980-Q988 HydrophobicContact CG2-CB 3.81Å; T980-Q988 HydrophobicContact CG2-CG 3.68Å; T980-L992 HydrophobicContact CG2-CD1 3.97Å
981	I	89	Confident	86.7	Confident	0 Å²	0	58.4 Å²	58.4	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-70.5	-40.4	178.2	-61.3	-174.5	0	0	0	110.8	V977 H978 K979 F989 L1009 L1012 A1013 R1018 F1021 L1025	V977-I981 PolarHBondContact O-N 3.4Å; H978-I981 PolarHBondContact O-N 2.84Å; K979-I981 VanDerWaalsContact C-N 3.29Å; K979-I981 PolarHBondContact O-N 3.13Å; I981-F989 HydrophobicContact CD1-CE2 4.18Å; I981-F989 HydrophobicContact CG1-CD2 4.19Å; I981-F989 HydrophobicContact CG1-CE2 4.27Å; I981-L1009 HydrophobicContact CD1-CB 3.57Å; I981-L1009 HydrophobicContact CD1-CD1 4.47Å; I981-L1009 HydrophobicContact CD1-CD2 3.62Å; I981-L1009 HydrophobicContact CD1-CG 4.06Å; I981-L1009 WeakPolarHBondContact CD1-O 3.48Å; I981-L1012 HydrophobicContact CG2-CB 3.91Å; I981-A1013 HydrophobicContact CG2-CB 4.07Å; I981-R1018 PolarHBondContact O-NE 3.07Å; I981-F1021 HydrophobicContact CB-CD1 4.48Å; I981-F1021 HydrophobicContact CG1-CD1 3.79Å; I981-F1021 HydrophobicContact CG1-CE1 3.98Å; I981-L1025 HydrophobicContact CD1-CD1 4.18Å
982	I	86	Confident	86.8	Confident	38 Å²	38	56.3 Å²	56.3	20%	0.195	28%	0.279	C	S	.	.	H	α-helix	trans	-65.5	-51.6	179.4	-64	169.5	0	0	0	109.7	H978 K979 G984 Y1016 R1018 L1105	H978-I982 WeakPolarHBondContact O-CG1 3.45Å; H978-I982 PolarHBondContact O-N 3.24Å; K979-I982 PolarHBondContact O-N 2.69Å; K979-I982 VanDerWaalsContact O-N 3.14Å; I982-G984 VanDerWaalsContact C-N 3.31Å; I982-G984 PolarHBondContact O-N 2.87Å; I982-Y1016 HydrophobicContact CB-CE2 4.43Å; I982-Y1016 HydrophobicContact CG1-CD2 4.24Å; I982-Y1016 HydrophobicContact CG1-CE2 3.7Å; I982-Y1016 HydrophobicContact CG2-CE1 3.96Å; I982-Y1016 HydrophobicContact CG2-CE2 4.42Å; I982-R1018 PolarHBondContact O-NH2 3.09Å; I982-L1105 HydrophobicContact CD1-CD1 3.47Å; I982-L1105 VanDerWaalsContact CD1-CD1 3.47Å
983	T	87.8	Confident	86.5	Confident	83 Å²	83	52.3 Å²	52.3	51%	0.509	25%	0.254	S	S	.	.	H	α-helix	trans	-69.8	-28.4	179.2	60.3	0	0	0	0	112.4	K979 T980 R1018	K979-T983 HydrophobicContact CG-CG2 4.08Å; K979-T983 WeakPolarHBondContact O-CG2 3.28Å; K979-T983 PolarHBondContact O-N 3.17Å; K979-T983 PolarHBondContact O-OG1 3.12Å; T980-T983 PolarHBondContact O-OG1 2.52Å; T983-R1018 PolarHBondContact O-NH2 2.72Å
984	G	88.3	Confident	85.9	Confident	27 Å²	27	56.5 Å²	56.5	28%	0.278	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	86.4	19.4	-176.5	0	0	0	0	0	113.9	T980 I982 Y986	T980-G984 CarbonylContact O-C 3.5Å; T980-G984 VanDerWaalsContact O-CA 3.31Å; T980-G984 WeakPolarHBondContact O-CA 3.44Å; T980-G984 PolarHBondContact O-N 2.91Å; I982-G984 VanDerWaalsContact C-N 3.31Å; I982-G984 PolarHBondContact O-N 2.87Å; G984-Y986 PolarHBondContact O-N 2.88Å; G984-Y986 VanDerWaalsContact O-N 3.07Å
985	D	91.5	Very high	85.3	Confident	75 Å²	75	58.3 Å²	58.3	40%	0.401	29%	0.288	S	S	.	.			trans	-78.5	86.9	177.1	-172	-13	0	0	0	111.3	T980 H987 Q988 F989	T980-D985 PolarHBondContact O-N 2.52Å; D985-H987 VanDerWaalsContact C-N 3.29Å; D985-H987 PolarHBondContact O-N 2.98Å; D985-H987 PolarHBondContact OD1-N 3.1Å; D985-Q988 HydrophobicContact CB-CB 4.27Å; D985-Q988 VanDerWaalsContact CG-CB 3.44Å; D985-Q988 PolarHBondContact OD1-N 3.32Å; D985-Q988 VanDerWaalsContact OD2-CB 3.32Å; D985-Q988 WeakPolarHBondContact OD2-CB 3.4Å; D985-F989 WeakPolarHBondContact O-CB 3.29Å; D985-F989 PolarHBondContact O-N 2.77Å; D985-F989 VanDerWaalsContact O-N 3.11Å
986	Y	89.6	Confident	84.7	Confident	76 Å²	76	62.5 Å²	62.5	30%	0.298	30%	0.304	S	S	.	.	H	α-helix	trans	-67	-29.8	-177.9	-169.2	-106.4	0	0	0	113	G984 F989 L990 D1020 F1021 Q1024	G984-Y986 PolarHBondContact O-N 2.88Å; G984-Y986 VanDerWaalsContact O-N 3.07Å; Y986-F989 HydrophobicContact CD2-CD1 4.24Å; Y986-F989 HydrophobicContact CE2-CD1 4.22Å; Y986-F989 HydrophobicContact CE2-CE1 4.48Å; Y986-F989 WeakPolarHBondContact O-CB 3.33Å; Y986-F989 PolarHBondContact O-N 2.85Å; Y986-L990 HydrophobicContact CD1-CD1 3.99Å; Y986-L990 HydrophobicContact CD1-CG 4.31Å; Y986-L990 HydrophobicContact CE1-CD1 3.59Å; Y986-L990 HydrophobicContact CE1-CD2 4.32Å; Y986-L990 HydrophobicContact CE1-CG 3.98Å; Y986-L990 WeakPolarHBondContact O-CG 3.38Å; Y986-L990 PolarHBondContact O-N 2.82Å; Y986-L990 VanDerWaalsContact O-N 3.1Å; Y986-D1020 HydrophobicContact CE2-CB 4.41Å; Y986-F1021 HydrophobicContact CD2-CD1 4.22Å; Y986-F1021 AromaticContact CD2-CD2 3.89Å; Y986-F1021 HydrophobicContact CD2-CD2 3.89Å; Y986-F1021 HydrophobicContact CD2-CE1 4.13Å; Y986-F1021 AromaticContact CD2-CE2 3.79Å; Y986-F1021 HydrophobicContact CD2-CE2 3.79Å; Y986-F1021 HydrophobicContact CD2-CG 4.15Å; Y986-F1021 AromaticContact CD2-CZ 3.93Å; Y986-F1021 HydrophobicContact CD2-CZ 3.93Å; Y986-F1021 HydrophobicContact CG-CE2 4.4Å; Y986-F1021 HydrophobicContact CG-CZ 4.45Å; Y986-Q1024 HydrophobicContact CE2-CB 4.34Å; Y986-Q1024 PolarHBondContact OH-OE1 3.05Å
987	H	88.1	Confident	84.2	Confident	118 Å²	118	63.8 Å²	63.8	55%	0.546	31%	0.306	S	S	.	.	H	α-helix	trans	-72.1	-43.7	-178.5	-172.2	-74.1	0	0	0	111	D985 F989 L990 R991	D985-H987 VanDerWaalsContact C-N 3.29Å; D985-H987 PolarHBondContact O-N 2.98Å; D985-H987 PolarHBondContact OD1-N 3.1Å; H987-F989 VanDerWaalsContact C-N 3.32Å; H987-L990 PolarHBondContact O-N 3.27Å; H987-R991 PolarHBondContact CE1-NE 2.71Å; H987-R991 PolarHBondContact CE1-NH2 2.91Å; H987-R991 PolarHBondContact O-N 2.82Å
988	Q	87.7	Confident	83.9	Confident	49 Å²	49	63.9 Å²	63.9	23%	0.229	31%	0.306	C	S	.	.	H	α-helix	trans	-67.7	-35.7	174.9	-172.2	63	5	0	0	111.7	T980 D985 R991 L992	T980-Q988 HydrophobicContact CG2-CB 3.81Å; T980-Q988 HydrophobicContact CG2-CG 3.68Å; D985-Q988 HydrophobicContact CB-CB 4.27Å; D985-Q988 VanDerWaalsContact CG-CB 3.44Å; D985-Q988 PolarHBondContact OD1-N 3.32Å; D985-Q988 VanDerWaalsContact OD2-CB 3.32Å; D985-Q988 WeakPolarHBondContact OD2-CB 3.4Å; Q988-R991 WeakPolarHBondContact O-CB 3.49Å; Q988-R991 PolarHBondContact O-N 3.17Å; Q988-L992 HydrophobicContact CG-CD1 4.04Å; Q988-L992 WeakPolarHBondContact O-CG 3.41Å; Q988-L992 PolarHBondContact O-N 3.48Å
989	F	89.3	Confident	83.8	Confident	0 Å²	0	63.8 Å²	63.8	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-56.2	-51.2	172.9	172.8	-100.5	0	0	0	112.2	V977 I981 D985 Y986 H987 R991 L992 V993 L1009 F1021 Q1024 L1025	V977-F989 HydrophobicContact CG1-CD2 4.31Å; V977-F989 HydrophobicContact CG1-CE2 4.4Å; I981-F989 HydrophobicContact CD1-CE2 4.18Å; I981-F989 HydrophobicContact CG1-CD2 4.19Å; I981-F989 HydrophobicContact CG1-CE2 4.27Å; D985-F989 WeakPolarHBondContact O-CB 3.29Å; D985-F989 PolarHBondContact O-N 2.77Å; D985-F989 VanDerWaalsContact O-N 3.11Å; Y986-F989 HydrophobicContact CD2-CD1 4.24Å; Y986-F989 HydrophobicContact CE2-CD1 4.22Å; Y986-F989 HydrophobicContact CE2-CE1 4.48Å; Y986-F989 WeakPolarHBondContact O-CB 3.33Å; Y986-F989 PolarHBondContact O-N 2.85Å; H987-F989 VanDerWaalsContact C-N 3.32Å; F989-R991 PolarHBondContact O-N 3.14Å; F989-L992 PolarHBondContact O-N 3.44Å; F989-L992 VanDerWaalsContact O-N 3.15Å; F989-V993 HydrophobicContact CD1-CG2 4.05Å; F989-V993 HydrophobicContact CD2-CG2 3.61Å; F989-V993 HydrophobicContact CE1-CG2 3.82Å; F989-V993 HydrophobicContact CE2-CG2 3.35Å; F989-V993 HydrophobicContact CG-CG2 3.95Å; F989-V993 HydrophobicContact CZ-CG2 3.46Å; F989-V993 VanDerWaalsContact CZ-CG2 3.46Å; F989-V993 WeakPolarHBondContact O-CB 3.27Å; F989-V993 WeakPolarHBondContact O-CG2 3.33Å; F989-V993 PolarHBondContact O-N 3.22Å; F989-L1009 HydrophobicContact CE2-CD1 4.5Å; F989-F1021 HydrophobicContact CB-CD1 4.38Å; F989-F1021 HydrophobicContact CB-CE1 3.61Å; F989-F1021 HydrophobicContact CB-CZ 4.37Å; F989-F1021 AromaticContact CD1-CD1 3.94Å; F989-F1021 HydrophobicContact CD1-CD1 3.94Å; F989-F1021 AromaticContact CD1-CE1 3.99Å; F989-F1021 HydrophobicContact CD1-CE1 3.99Å; F989-F1021 AromaticContact CD2-CD1 3.92Å; F989-F1021 HydrophobicContact CD2-CD1 3.92Å; F989-F1021 AromaticContact CD2-CE1 3.85Å; F989-F1021 HydrophobicContact CD2-CE1 3.85Å; F989-F1021 HydrophobicContact CE1-CD1 4.16Å; F989-F1021 HydrophobicContact CE2-CD1 4.13Å; F989-F1021 AromaticContact CG-CD1 3.81Å; F989-F1021 HydrophobicContact CG-CD1 3.81Å; F989-F1021 AromaticContact CG-CE1 3.54Å; F989-F1021 HydrophobicContact CG-CE1 3.54Å; F989-F1021 HydrophobicContact CZ-CD1 4.25Å; F989-Q1024 HydrophobicContact CE1-CG 4.14Å; F989-L1025 HydrophobicContact CE2-CD2 4.16Å; F989-L1025 HydrophobicContact CZ-CD2 3.71Å; F989-L1025 HydrophobicContact CZ-CG 3.97Å
990	L	86.4	Confident	83.6	Confident	73 Å²	73	61.1 Å²	61.1	38%	0.382	30%	0.296	S	S	.	.	H	α-helix	trans	-59.9	-29.2	179.1	-71.7	177.8	0	0	0	113.5	Y986 H987	Y986-L990 HydrophobicContact CD1-CD1 3.99Å; Y986-L990 HydrophobicContact CD1-CG 4.31Å; Y986-L990 HydrophobicContact CE1-CD1 3.59Å; Y986-L990 HydrophobicContact CE1-CD2 4.32Å; Y986-L990 HydrophobicContact CE1-CG 3.98Å; Y986-L990 WeakPolarHBondContact O-CG 3.38Å; Y986-L990 PolarHBondContact O-N 2.82Å; Y986-L990 VanDerWaalsContact O-N 3.1Å; H987-L990 PolarHBondContact O-N 3.27Å
991	R	85.8	Confident	83.3	Confident	157 Å²	157	61 Å²	61	59%	0.592	30%	0.296	S	S	*	.	H	α-helix	trans	-70.5	-43.2	176.3	-72.8	178.3	169.2	176.4	-2.9	112.4	H987 Q988 F989 N994	H987-R991 PolarHBondContact CE1-NE 2.71Å; H987-R991 PolarHBondContact CE1-NH2 2.91Å; H987-R991 PolarHBondContact O-N 2.82Å; Q988-R991 WeakPolarHBondContact O-CB 3.49Å; Q988-R991 PolarHBondContact O-N 3.17Å; F989-R991 PolarHBondContact O-N 3.14Å; R991-N994 PolarHBondContact O-ND2 2.92Å
992	L	82.6	Confident	83.1	Confident	36 Å²	36	62.3 Å²	62.3	19%	0.188	30%	0.301	C	S	.	.	H	α-helix	trans	-80.5	-29	-174.3	-64.8	167.7	0	0	0	113	E976 V977 T980 Q988 F989 N994	E976-L992 HydrophobicContact CB-CD1 4.06Å; E976-L992 HydrophobicContact CG-CD1 3.71Å; V977-L992 HydrophobicContact CG2-CB 3.27Å; V977-L992 HydrophobicContact CG2-CD1 3.61Å; V977-L992 HydrophobicContact CG2-CG 4Å; T980-L992 HydrophobicContact CG2-CD1 3.97Å; Q988-L992 HydrophobicContact CG-CD1 4.04Å; Q988-L992 WeakPolarHBondContact O-CG 3.41Å; Q988-L992 PolarHBondContact O-N 3.48Å; F989-L992 PolarHBondContact O-N 3.44Å; F989-L992 VanDerWaalsContact O-N 3.15Å; L992-N994 PolarHBondContact O-N 3.43Å
993	V	78.4	Confident	82.9	Confident	11 Å²	11	61.3 Å²	61.3	7%	0.067	30%	0.296	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.8	-13.3	-175.9	163.5	0	0	0	0	114	F989 N995 I999 L1028	F989-V993 HydrophobicContact CD1-CG2 4.05Å; F989-V993 HydrophobicContact CD2-CG2 3.61Å; F989-V993 HydrophobicContact CE1-CG2 3.82Å; F989-V993 HydrophobicContact CE2-CG2 3.35Å; F989-V993 HydrophobicContact CG-CG2 3.95Å; F989-V993 HydrophobicContact CZ-CG2 3.46Å; F989-V993 VanDerWaalsContact CZ-CG2 3.46Å; F989-V993 WeakPolarHBondContact O-CB 3.27Å; F989-V993 WeakPolarHBondContact O-CG2 3.33Å; F989-V993 PolarHBondContact O-N 3.22Å; V993-N995 CarbonylContact O-C 3.49Å; V993-N995 PolarHBondContact O-N 2.87Å; V993-I999 HydrophobicContact CB-CG1 4.47Å; V993-I999 HydrophobicContact CG1-CD1 3.64Å; V993-I999 HydrophobicContact CG1-CG1 3.85Å; V993-I999 WeakPolarHBondContact O-CD1 3.48Å; V993-L1028 HydrophobicContact CG1-CD1 3.42Å; V993-L1028 VanDerWaalsContact CG1-CD1 3.42Å
994	N	71.4	Confident	82.3	Confident	140 Å²	140	59.5 Å²	59.5	75%	0.749	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.4	-23.8	177.5	-70.9	-36.4	0	0	0	113.3	R991 L992 K996	R991-N994 PolarHBondContact O-ND2 2.92Å; L992-N994 PolarHBondContact O-N 3.43Å; N994-K996 PolarHBondContact O-N 3.38Å
995	N	70.2	Confident	81.8	Confident	52 Å²	52	58.8 Å²	58.8	28%	0.278	27%	0.268	S	S	.	.	S	Bend	trans	-86.9	103.6	171	-168.7	-11.4	0	0	0	110.1	V993 R997 V998	V993-N995 CarbonylContact O-C 3.49Å; V993-N995 PolarHBondContact O-N 2.87Å; N995-R997 PolarHBondContact O-N 3.08Å; N995-R997 WeakPolarHBondContact OD1-CB 3.4Å; N995-R997 PolarHBondContact OD1-N 3.15Å; N995-V998 HydrophobicContact CB-CB 4.41Å; N995-V998 HydrophobicContact CB-CG2 3.8Å; N995-V998 PolarHBondContact O-N 2.96Å
996	K	70	Confident	81.5	Confident	176 Å²	176	55.9 Å²	55.9	77%	0.765	25%	0.253	S	S	*	.	H	α-helix	trans	-49.6	-31.3	178	-74.4	-173.7	177.6	-177.7	0	113	N994 V998 I999	N994-K996 PolarHBondContact O-N 3.38Å; K996-V998 VanDerWaalsContact C-N 3.34Å; K996-V998 PolarHBondContact O-N 3.31Å; K996-I999 PolarHBondContact O-N 3.35Å
997	R	74.9	Confident	81.4	Confident	97 Å²	97	52.8 Å²	52.8	37%	0.366	24%	0.24	S	C	.	.	H	α-helix	trans	-65	-37.5	179.2	-61.5	176.2	173.7	-145.4	-15.1	112	E925 L929 Y970 N995 M1000	E925-R997 IonicContact OE1-CZ 2.72Å; E925-R997 IonicContact OE1-NH1 3.87Å; E925-R997 PolarHBondContact OE1-NH1 3.05Å; E925-R997 IonicContact OE1-NH2 3.59Å; E925-R997 PolarHBondContact OE1-NH2 2.81Å; E925-R997 IonicContact OE2-NH2 3.12Å; L929-R997 HydrophobicContact CD2-CB 4.48Å; L929-R997 WeakPolarHBondContact CD2-O 3.48Å; Y970-R997 HydrophobicContact CE1-CB 4.37Å; Y970-R997 WeakPolarHBondContact OH-CD 3.2Å; Y970-R997 PolarHBondContact OH-NH1 3.26Å; Y970-R997 VanDerWaalsContact OH-NH1 3.09Å; N995-R997 PolarHBondContact O-N 3.08Å; N995-R997 WeakPolarHBondContact OD1-CB 3.4Å; N995-R997 PolarHBondContact OD1-N 3.15Å; R997-M1000 PolarHBondContact O-N 3.35Å
998	V	80.5	Confident	81.5	Confident	1 Å²	1	47.2 Å²	47.2	1%	0.006	21%	0.214	C	C	.	.	H	α-helix	trans	-74.1	-28.8	-178.4	-172.5	0	0	0	0	111.5	E973 V977 N995 K996 M1000 S1001	E973-V998 HydrophobicContact CB-CG2 4.3Å; V977-V998 HydrophobicContact CB-CG1 3.9Å; V977-V998 HydrophobicContact CG1-CG1 4.38Å; V977-V998 HydrophobicContact CG2-CG1 3.41Å; V977-V998 VanDerWaalsContact CG2-CG1 3.41Å; N995-V998 HydrophobicContact CB-CB 4.41Å; N995-V998 HydrophobicContact CB-CG2 3.8Å; N995-V998 PolarHBondContact O-N 2.96Å; K996-V998 VanDerWaalsContact C-N 3.34Å; K996-V998 PolarHBondContact O-N 3.31Å; V998-M1000 PolarHBondContact O-N 3.49Å; V998-S1001 WeakPolarHBondContact O-CB 3.5Å; V998-S1001 PolarHBondContact O-N 3.43Å; V998-S1001 VanDerWaalsContact O-N 3.1Å; V998-S1001 PolarHBondContact O-OG 2.88Å
999	I	84.5	Confident	81.6	Confident	12 Å²	12	44.9 Å²	44.9	6%	0.062	20%	0.204	C	C	.	.	H	α-helix	trans	-60.6	-35.1	173.3	-57.4	176.8	0	0	0	111.3	V993 K996 S1001 L1009 L1025 L1028 C1029 L1032	V993-I999 HydrophobicContact CB-CG1 4.47Å; V993-I999 HydrophobicContact CG1-CD1 3.64Å; V993-I999 HydrophobicContact CG1-CG1 3.85Å; V993-I999 WeakPolarHBondContact O-CD1 3.48Å; K996-I999 PolarHBondContact O-N 3.35Å; I999-S1001 PolarHBondContact O-N 3.15Å; I999-L1009 WeakPolarHBondContact O-CD1 3.4Å; I999-L1025 HydrophobicContact CG2-CD2 4.37Å; I999-L1028 HydrophobicContact CD1-CB 4.4Å; I999-L1028 HydrophobicContact CD1-CD1 4.29Å; I999-C1029 HydrophobicContact CG2-CB 4.3Å; I999-L1032 HydrophobicContact CG2-CD1 4.17Å
1000	M	83.7	Confident	81.7	Confident	61 Å²	61	44.9 Å²	44.9	30%	0.3	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.4	-1	-179.1	-56.3	-64.4	-99.2	0	0	112.9	R997 V998 L1032 Y1035	R997-M1000 PolarHBondContact O-N 3.35Å; V998-M1000 PolarHBondContact O-N 3.49Å; M1000-L1032 HydrophobicContact SD-CD2 4.43Å; M1000-Y1035 WeakPolarHBondContact CE-OH 3.46Å
1001	S	83.5	Confident	82	Confident	0 Å²	0	41.4 Å²	41.4	0%	0	19%	0.185	C	C	.	.			trans	-62.8	151.4	177.6	68.7	0	0	0	0	111.6	H978 V998 I999	H978-S1001 PolarHBondContact CE1-OG 3.2Å; V998-S1001 WeakPolarHBondContact O-CB 3.5Å; V998-S1001 PolarHBondContact O-N 3.43Å; V998-S1001 VanDerWaalsContact O-N 3.1Å; V998-S1001 PolarHBondContact O-OG 2.88Å; I999-S1001 PolarHBondContact O-N 3.15Å
1002	R	85.3	Confident	82.2	Confident	27 Å²	27	34 Å²	34	10%	0.102	16%	0.158	C	C	.	.	B	Isolated β-bridge	trans	-125.9	151.2	176.7	-66.2	175	-179.3	-108.4	9	109.5	Y930 H978 E1006 R1007 Q1036	Y930-R1002 PolarHBondContact OH-NE 2.99Å; H978-R1002 VanDerWaalsContact NE2-C 3.31Å; R1002-E1006 WeakPolarHBondContact CD-O 3.23Å; R1002-E1006 PolarHBondContact NH1-O 3.45Å; R1002-R1007 WeakPolarHBondContact CA-O 3.02Å; R1002-Q1036 PolarHBondContact NH1-O 3.5Å
1003	D	82.3	Confident	82.6	Confident	17 Å²	17	32.3 Å²	32.3	9%	0.091	15%	0.149	C	C	.	.			trans	-77.9	-178.5	170.4	79.8	-3.1	0	0	0	111.2	H978 R1005 E1006 R1007	H978-D1003 PolarHBondContact NE2-N 2.87Å; D1003-R1005 PolarHBondContact O-N 2.96Å; D1003-R1005 WeakPolarHBondContact OD1-CA 3.19Å; D1003-R1005 WeakPolarHBondContact OD1-CB 3.41Å; D1003-R1005 PolarHBondContact OD1-N 2.77Å; D1003-E1006 WeakPolarHBondContact O-CA 3.39Å; D1003-E1006 PolarHBondContact O-N 2.82Å; D1003-E1006 PolarHBondContact OD1-N 3.12Å; D1003-R1007 PolarHBondContact N-O 3.2Å; D1003-R1007 WeakPolarHBondContact OD1-CA 3.15Å; D1003-R1007 VanDerWaalsContact OD1-CB 3.23Å; D1003-R1007 WeakPolarHBondContact OD1-CB 3.48Å; D1003-R1007 PolarHBondContact OD1-N 3.18Å; D1003-R1007 IonicContact OD1-NE 2.82Å; D1003-R1007 IonicContact OD2-CZ 2.74Å; D1003-R1007 IonicContact OD2-NE 2.96Å; D1003-R1007 PolarHBondContact OD2-NE 3.19Å; D1003-R1007 IonicContact OD2-NH2 2.69Å; D1003-R1007 PolarHBondContact OD2-NH2 2.9Å
1004	W	74	Confident	83.3	Confident	44 Å²	44	31.8 Å²	31.8	17%	0.167	15%	0.146	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-15.2	-180	61.9	-92.6	0	0	0	114.4	R845 E849 E1006 I1103 L1105	R845-W1004 WeakPolarHBondContact CD-O 3.38Å; E849-W1004 HydrophobicContact CB-CE3 4.12Å; E849-W1004 HydrophobicContact CB-CZ3 4.35Å; E849-W1004 VanDerWaalsContact CD-CZ3 3.5Å; E849-W1004 HydrophobicContact CG-CE3 3.58Å; E849-W1004 HydrophobicContact CG-CH2 4.22Å; E849-W1004 HydrophobicContact CG-CZ3 3.38Å; E849-W1004 WeakPolarHBondContact OE1-CH2 3.4Å; E849-W1004 WeakPolarHBondContact OE1-CZ3 2.86Å; W1004-E1006 VanDerWaalsContact C-N 3.31Å; W1004-I1103 HydrophobicContact CH2-CG2 3.2Å; W1004-I1103 HydrophobicContact CZ2-CG2 3.36Å; W1004-I1103 HydrophobicContact CZ3-CG2 4.5Å; W1004-L1105 VanDerWaalsContact NE1-CD2 3.32Å
1005	R	78.6	Confident	84.1	Confident	12 Å²	12	25.2 Å²	25.2	5%	0.045	11%	0.11	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.7	12.7	169.7	-68.3	-156	80.6	164	9.1	112.4	D1003 R1007 C1038 E1100	D1003-R1005 PolarHBondContact O-N 2.96Å; D1003-R1005 WeakPolarHBondContact OD1-CA 3.19Å; D1003-R1005 WeakPolarHBondContact OD1-CB 3.41Å; D1003-R1005 PolarHBondContact OD1-N 2.77Å; R1005-R1007 HydrophobicContact CB-CG 3.85Å; R1005-R1007 PolarHBondContact O-N 3.47Å; R1005-C1038 VanDerWaalsContact O-CB 3.32Å; R1005-C1038 WeakPolarHBondContact O-CB 3.27Å; R1005-C1038 PolarHBondContact O-N 3.35Å; R1005-C1038 PolarHBondContact O-SG 3.01Å; R1005-E1100 IonicContact CZ-OE1 2.82Å; R1005-E1100 IonicContact CZ-OE2 2.69Å; R1005-E1100 IonicContact NE-OE2 2.77Å; R1005-E1100 IonicContact NH1-OE1 3.09Å; R1005-E1100 PolarHBondContact NH1-OE1 3.31Å; R1005-E1100 IonicContact NH1-OE2 3.65Å; R1005-E1100 PolarHBondContact NH1-OE2 2.68Å
1006	E	84.3	Confident	85	Confident	15 Å²	15	25.8 Å²	25.8	7%	0.07	11%	0.109	C	C	.	.			trans	59.5	18	-170.6	-53.6	-178.2	-159.2	0	0	113.2	Y844 R845 R1002 D1003 W1004 S1008 C1038	Y844-E1006 WeakPolarHBondContact CA-OE1 3.47Å; Y844-E1006 WeakPolarHBondContact CD1-OE1 3.38Å; R845-E1006 PolarHBondContact N-OE1 3.15Å; R845-E1006 VanDerWaalsContact N-OE1 3.1Å; R1002-E1006 WeakPolarHBondContact CD-O 3.23Å; R1002-E1006 PolarHBondContact NH1-O 3.45Å; D1003-E1006 WeakPolarHBondContact O-CA 3.39Å; D1003-E1006 PolarHBondContact O-N 2.82Å; D1003-E1006 PolarHBondContact OD1-N 3.12Å; W1004-E1006 VanDerWaalsContact C-N 3.31Å; E1006-S1008 PolarHBondContact O-N 3Å; E1006-C1038 HydrophobicContact CB-CB 4.49Å; E1006-C1038 HydrophobicContact CG-CB 4.38Å
1007	R	87.3	Confident	85.8	Confident	10 Å²	10	23.1 Å²	23.1	4%	0.038	9%	0.094	C	C	.	.			trans	-74.6	128	178.5	-65	176.6	-63.4	-163.5	2.1	109	R1002 D1003 R1005 H1011 D1037 E1100	R1002-R1007 WeakPolarHBondContact CA-O 3.02Å; D1003-R1007 PolarHBondContact N-O 3.2Å; D1003-R1007 WeakPolarHBondContact OD1-CA 3.15Å; D1003-R1007 VanDerWaalsContact OD1-CB 3.23Å; D1003-R1007 WeakPolarHBondContact OD1-CB 3.48Å; D1003-R1007 PolarHBondContact OD1-N 3.18Å; D1003-R1007 IonicContact OD1-NE 2.82Å; D1003-R1007 IonicContact OD2-CZ 2.74Å; D1003-R1007 IonicContact OD2-NE 2.96Å; D1003-R1007 PolarHBondContact OD2-NE 3.19Å; D1003-R1007 IonicContact OD2-NH2 2.69Å; D1003-R1007 PolarHBondContact OD2-NH2 2.9Å; R1005-R1007 HydrophobicContact CB-CG 3.85Å; R1005-R1007 PolarHBondContact O-N 3.47Å; R1007-H1011 HydrophobicContact CB-CB 3.81Å; R1007-H1011 HydrophobicContact CG-CB 4.27Å; R1007-D1037 HydrophobicContact CG-CB 3.74Å; R1007-E1100 PolarHBondContact NH1-O 3.05Å; R1007-E1100 IonicContact NH1-OE2 3.13Å; R1007-E1100 PolarHBondContact NH1-OE2 3.01Å
1008	S	90.1	Very high	86.5	Confident	1 Å²	1	22.6 Å²	22.6	1%	0.007	9%	0.092	C	C	.	.	B	Isolated β-bridge	trans	-70.1	163.9	171.5	70.6	0	0	0	0	111.7	E1006 L1010 H1011 L1012	E1006-S1008 PolarHBondContact O-N 3Å; S1008-L1010 PolarHBondContact O-N 2.87Å; S1008-L1010 VanDerWaalsContact O-N 3.07Å; S1008-H1011 PolarHBondContact N-ND1 2.82Å; S1008-H1011 VanDerWaalsContact N-ND1 3.18Å; S1008-H1011 WeakPolarHBondContact O-CB 3.38Å; S1008-H1011 PolarHBondContact O-N 3.36Å; S1008-H1011 PolarHBondContact OG-ND1 3.4Å; S1008-L1012 PolarHBondContact O-N 2.96Å
1009	L	90.5	Very high	86.9	Confident	0 Å²	0	25 Å²	25	0%	0	11%	0.107	C	C	.	.	H	α-helix	trans	-50.6	-34	172.6	-64.1	-177.4	0	0	0	113	V977 I981 F989 I999 L1012 A1013 L1025	V977-L1009 HydrophobicContact CG1-CD1 3.63Å; V977-L1009 HydrophobicContact CG1-CD2 3.78Å; V977-L1009 HydrophobicContact CG1-CG 4.38Å; I981-L1009 HydrophobicContact CD1-CB 3.57Å; I981-L1009 HydrophobicContact CD1-CD1 4.47Å; I981-L1009 HydrophobicContact CD1-CD2 3.62Å; I981-L1009 HydrophobicContact CD1-CG 4.06Å; I981-L1009 WeakPolarHBondContact CD1-O 3.48Å; F989-L1009 HydrophobicContact CE2-CD1 4.5Å; I999-L1009 WeakPolarHBondContact O-CD1 3.4Å; L1009-L1012 PolarHBondContact O-N 3.06Å; L1009-A1013 WeakPolarHBondContact O-CB 3.23Å; L1009-A1013 PolarHBondContact O-N 3.06Å; L1009-L1025 HydrophobicContact CB-CD1 3.83Å; L1009-L1025 HydrophobicContact CB-CD2 3.89Å; L1009-L1025 HydrophobicContact CD1-CD2 4.1Å
1010	L	92.2	Very high	87.1	Confident	0 Å²	0	29.3 Å²	29.3	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-69.1	-37.3	178.3	-175.8	59	0	0	0	112.6	S1008 A1013 V1014 V1022 L1025 I1026 L1032 V1033 P1043	S1008-L1010 PolarHBondContact O-N 2.87Å; S1008-L1010 VanDerWaalsContact O-N 3.07Å; L1010-A1013 PolarHBondContact O-N 3.47Å; L1010-V1014 HydrophobicContact CD1-CG2 4.46Å; L1010-V1014 WeakPolarHBondContact O-CG2 3.48Å; L1010-V1014 PolarHBondContact O-N 2.95Å; L1010-V1022 HydrophobicContact CD1-CB 4.27Å; L1010-V1022 HydrophobicContact CD1-CG1 3.98Å; L1010-V1022 HydrophobicContact CD1-CG2 4.21Å; L1010-L1025 HydrophobicContact CB-CD1 4.47Å; L1010-L1025 HydrophobicContact CD1-CB 4.41Å; L1010-I1026 HydrophobicContact CD1-CD1 4.37Å; L1010-I1026 HydrophobicContact CD1-CG1 4.11Å; L1010-I1026 HydrophobicContact CD2-CG1 4.08Å; L1010-L1032 HydrophobicContact CB-CB 3.99Å; L1010-L1032 HydrophobicContact CB-CD1 4.46Å; L1010-L1032 HydrophobicContact CD2-CB 3.94Å; L1010-V1033 HydrophobicContact CD2-CB 4.41Å; L1010-V1033 HydrophobicContact CD2-CG2 3.82Å; L1010-P1043 HydrophobicContact CB-CG 4.27Å; L1010-P1043 HydrophobicContact CD2-CB 4.27Å; L1010-P1043 HydrophobicContact CD2-CG 3.95Å; L1010-P1043 HydrophobicContact CG-CB 4.05Å; L1010-P1043 HydrophobicContact CG-CG 3.91Å
1011	H	91.7	Very high	87.5	Confident	0 Å²	0	26.8 Å²	26.8	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-60	-48.3	173.5	-70.3	88.4	0	0	0	110.8	R1007 S1008 A1013 V1014 L1015 Y1035 R1041 T1042 P1043 Y1046	R1007-H1011 HydrophobicContact CB-CB 3.81Å; R1007-H1011 HydrophobicContact CG-CB 4.27Å; S1008-H1011 PolarHBondContact N-ND1 2.82Å; S1008-H1011 VanDerWaalsContact N-ND1 3.18Å; S1008-H1011 WeakPolarHBondContact O-CB 3.38Å; S1008-H1011 PolarHBondContact O-N 3.36Å; S1008-H1011 PolarHBondContact OG-ND1 3.4Å; H1011-A1013 VanDerWaalsContact C-N 3.35Å; H1011-A1013 PolarHBondContact O-N 3.33Å; H1011-V1014 PolarHBondContact O-N 2.88Å; H1011-L1015 WeakPolarHBondContact O-CB 3.4Å; H1011-L1015 WeakPolarHBondContact O-CG 3.47Å; H1011-L1015 PolarHBondContact O-N 3.29Å; H1011-Y1035 PolarHBondContact CE1-O 3.48Å; H1011-Y1035 PolarHBondContact NE2-O 3.4Å; H1011-R1041 PolarHBondContact NE2-O 3.5Å; H1011-T1042 VanDerWaalsContact NE2-C 3.33Å; H1011-P1043 VanDerWaalsContact NE2-CD 3.28Å; H1011-P1043 WeakPolarHBondContact NE2-CD 3.48Å; H1011-Y1046 AromaticContact CD2-CD2 3.78Å; H1011-Y1046 AromaticContact CD2-CE2 3.72Å
1012	L	90	Very high	87.9	Confident	2 Å²	2	26.9 Å²	26.9	1%	0.01	12%	0.118	C	C	.	.	H	α-helix	trans	-61.3	-44.8	178.1	-63.7	-172.5	0	0	0	110.9	H978 I981 S1008 L1009 V1014 L1015 Y1016	H978-L1012 HydrophobicContact CB-CD1 4.2Å; I981-L1012 HydrophobicContact CG2-CB 3.91Å; S1008-L1012 PolarHBondContact O-N 2.96Å; L1009-L1012 PolarHBondContact O-N 3.06Å; L1012-V1014 VanDerWaalsContact C-N 3.29Å; L1012-V1014 PolarHBondContact O-N 3.16Å; L1012-L1015 HydrophobicContact CD2-CD1 4.45Å; L1012-L1015 PolarHBondContact O-N 3.43Å; L1012-Y1016 HydrophobicContact CD2-CE2 4.46Å; L1012-Y1016 WeakPolarHBondContact O-CB 3.3Å; L1012-Y1016 VanDerWaalsContact O-CD2 3.29Å; L1012-Y1016 WeakPolarHBondContact O-CD2 3.46Å; L1012-Y1016 PolarHBondContact O-N 2.86Å
1013	A	91.5	Very high	88.1	Confident	0 Å²	0	28.3 Å²	28.3	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-60.2	-38.7	178.3	0	0	0	0	0	112.2	I981 L1009 L1010 H1011 R1017 R1018 F1021 V1022 L1025	I981-A1013 HydrophobicContact CG2-CB 4.07Å; L1009-A1013 WeakPolarHBondContact O-CB 3.23Å; L1009-A1013 PolarHBondContact O-N 3.06Å; L1010-A1013 PolarHBondContact O-N 3.47Å; H1011-A1013 VanDerWaalsContact C-N 3.35Å; H1011-A1013 PolarHBondContact O-N 3.33Å; A1013-R1017 PolarHBondContact O-N 3.3Å; A1013-R1017 VanDerWaalsContact O-N 3.11Å; A1013-R1018 PolarHBondContact O-N 3.33Å; A1013-F1021 HydrophobicContact CB-CB 3.97Å; A1013-V1022 HydrophobicContact CB-CG2 3.59Å; A1013-L1025 HydrophobicContact CB-CD1 4.02Å
1014	V	92.2	Very high	88.4	Confident	0 Å²	0	29.7 Å²	29.7	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-68.2	-49.4	174.2	171.6	0	0	0	0	111.8	L1010 H1011 L1012 Y1016 R1017 V1022 P1043 A1047 L1050 I1060	L1010-V1014 HydrophobicContact CD1-CG2 4.46Å; L1010-V1014 WeakPolarHBondContact O-CG2 3.48Å; L1010-V1014 PolarHBondContact O-N 2.95Å; H1011-V1014 PolarHBondContact O-N 2.88Å; L1012-V1014 VanDerWaalsContact C-N 3.29Å; L1012-V1014 PolarHBondContact O-N 3.16Å; V1014-Y1016 PolarHBondContact O-N 3.45Å; V1014-R1017 PolarHBondContact O-N 3.38Å; V1014-V1022 HydrophobicContact CG2-CG2 4.01Å; V1014-P1043 HydrophobicContact CG2-CB 4.16Å; V1014-A1047 HydrophobicContact CG1-CB 3.85Å; V1014-L1050 HydrophobicContact CG1-CD1 4.26Å; V1014-I1060 HydrophobicContact CG2-CD1 3.78Å
1015	L	90	Very high	89.2	Confident	2 Å²	2	27.6 Å²	27.6	1%	0.01	13%	0.126	C	C	.	.	H	α-helix	trans	-55.7	-51.2	179	-76.6	168.8	0	0	0	110.6	H1011 L1012 R1017 Y1046 I1097 E1100 K1101	H1011-L1015 WeakPolarHBondContact O-CB 3.4Å; H1011-L1015 WeakPolarHBondContact O-CG 3.47Å; H1011-L1015 PolarHBondContact O-N 3.29Å; L1012-L1015 HydrophobicContact CD2-CD1 4.45Å; L1012-L1015 PolarHBondContact O-N 3.43Å; L1015-R1017 PolarHBondContact O-N 3.47Å; L1015-Y1046 HydrophobicContact CD2-CD1 3.69Å; L1015-Y1046 HydrophobicContact CD2-CE1 4.23Å; L1015-Y1046 HydrophobicContact CD2-CG 3.97Å; L1015-Y1046 HydrophobicContact CG-CG 4.41Å; L1015-I1097 HydrophobicContact CD2-CG2 4.29Å; L1015-E1100 HydrophobicContact CD2-CB 3.97Å; L1015-K1101 VanDerWaalsContact C-CE 3.43Å; L1015-K1101 WeakPolarHBondContact O-CE 3.3Å; L1015-K1101 PolarHBondContact O-NZ 3.24Å
1016	Y	88.2	Confident	89.7	Confident	65 Å²	65	27.3 Å²	27.3	26%	0.255	13%	0.125	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.2	3.1	179.6	-71.1	-83.5	0	0	0	114.3	I982 L1012 V1014 R1018 K1101	I982-Y1016 HydrophobicContact CB-CE2 4.43Å; I982-Y1016 HydrophobicContact CG1-CD2 4.24Å; I982-Y1016 HydrophobicContact CG1-CE2 3.7Å; I982-Y1016 HydrophobicContact CG2-CE1 3.96Å; I982-Y1016 HydrophobicContact CG2-CE2 4.42Å; L1012-Y1016 HydrophobicContact CD2-CE2 4.46Å; L1012-Y1016 WeakPolarHBondContact O-CB 3.3Å; L1012-Y1016 VanDerWaalsContact O-CD2 3.29Å; L1012-Y1016 WeakPolarHBondContact O-CD2 3.46Å; L1012-Y1016 PolarHBondContact O-N 2.86Å; V1014-Y1016 PolarHBondContact O-N 3.45Å; Y1016-R1018 VanDerWaalsContact C-N 3.29Å; Y1016-R1018 PolarHBondContact O-N 3.35Å; Y1016-K1101 HydrophobicContact CE1-CG 4.45Å
1017	R	87.5	Confident	89.9	Confident	120 Å²	120	32.5 Å²	32.5	45%	0.453	15%	0.149	S	C	.	.	T	Hydrogen-bonded Turn	trans	56.3	37.1	179.1	-57.1	-175.4	66.4	-169.8	3.5	113.9	A1013 V1014 L1015 T1019 L1050 D1052	A1013-R1017 PolarHBondContact O-N 3.3Å; A1013-R1017 VanDerWaalsContact O-N 3.11Å; V1014-R1017 PolarHBondContact O-N 3.38Å; L1015-R1017 PolarHBondContact O-N 3.47Å; R1017-T1019 PolarHBondContact O-N 3.14Å; R1017-L1050 HydrophobicContact CG-CD2 3.71Å; R1017-D1052 IonicContact CZ-OD2 3Å; R1017-D1052 IonicContact NH1-OD2 3.92Å; R1017-D1052 IonicContact NH2-OD2 2.68Å; R1017-D1052 PolarHBondContact NH2-OD2 3.45Å
1018	R	89.2	Confident	89.9	Confident	86 Å²	86	35.8 Å²	35.8	33%	0.325	17%	0.167	S	C	.	.			trans	-87.6	81.7	-179.9	-58	-58.5	-170.8	-176.8	1.1	110.5	I981 I982 T983 A1013 Y1016 D1020 F1021 V1022	I981-R1018 PolarHBondContact O-NE 3.07Å; I982-R1018 PolarHBondContact O-NH2 3.09Å; T983-R1018 PolarHBondContact O-NH2 2.72Å; A1013-R1018 PolarHBondContact O-N 3.33Å; Y1016-R1018 VanDerWaalsContact C-N 3.29Å; Y1016-R1018 PolarHBondContact O-N 3.35Å; R1018-D1020 VanDerWaalsContact C-N 3.29Å; R1018-D1020 PolarHBondContact O-N 3.03Å; R1018-F1021 HydrophobicContact CB-CB 3.96Å; R1018-F1021 HydrophobicContact CB-CD2 3.63Å; R1018-F1021 HydrophobicContact CB-CE2 4.4Å; R1018-F1021 HydrophobicContact CB-CG 4.06Å; R1018-F1021 HydrophobicContact CG-CD2 4.3Å; R1018-F1021 PolarHBondContact O-N 3.48Å; R1018-V1022 WeakPolarHBondContact O-CG2 3.44Å; R1018-V1022 PolarHBondContact O-N 3.17Å
1019	T	87.7	Confident	89.7	Confident	51 Å²	51	36.7 Å²	36.7	31%	0.313	17%	0.173	S	C	.	.	H	α-helix	trans	-59.1	-36.3	-171.2	53.1	0	0	0	0	114.3	R1017 V1022 L1023 L1056	R1017-T1019 PolarHBondContact O-N 3.14Å; T1019-V1022 PolarHBondContact O-N 3.45Å; T1019-L1023 WeakPolarHBondContact O-CG 3.3Å; T1019-L1023 PolarHBondContact O-N 3.35Å; T1019-L1023 VanDerWaalsContact O-N 3.07Å; T1019-L1056 HydrophobicContact CG2-CD1 3.96Å
1020	D	90	Very high	89.5	Confident	103 Å²	103	42.3 Å²	42.3	55%	0.551	20%	0.199	S	C	*	.	H	α-helix	trans	-70.2	-41.7	-177.2	-52	-30.2	0	0	0	110.6	Y986 R1018 L1023 Q1024	Y986-D1020 HydrophobicContact CE2-CB 4.41Å; R1018-D1020 VanDerWaalsContact C-N 3.29Å; R1018-D1020 PolarHBondContact O-N 3.03Å; D1020-L1023 PolarHBondContact O-N 3.36Å; D1020-Q1024 WeakPolarHBondContact O-CB 2.95Å; D1020-Q1024 PolarHBondContact O-N 3.41Å
1021	F	91.9	Very high	89.2	Confident	8 Å²	8	48.1 Å²	48.1	4%	0.035	23%	0.227	C	C	.	.	H	α-helix	trans	-62	-43.3	171.9	-69.3	-103.2	0	0	0	111.9	I981 Y986 F989 A1013 R1018 L1023 Q1024 L1025	I981-F1021 HydrophobicContact CB-CD1 4.48Å; I981-F1021 HydrophobicContact CG1-CD1 3.79Å; I981-F1021 HydrophobicContact CG1-CE1 3.98Å; Y986-F1021 HydrophobicContact CD2-CD1 4.22Å; Y986-F1021 AromaticContact CD2-CD2 3.89Å; Y986-F1021 HydrophobicContact CD2-CD2 3.89Å; Y986-F1021 HydrophobicContact CD2-CE1 4.13Å; Y986-F1021 AromaticContact CD2-CE2 3.79Å; Y986-F1021 HydrophobicContact CD2-CE2 3.79Å; Y986-F1021 HydrophobicContact CD2-CG 4.15Å; Y986-F1021 AromaticContact CD2-CZ 3.93Å; Y986-F1021 HydrophobicContact CD2-CZ 3.93Å; Y986-F1021 HydrophobicContact CG-CE2 4.4Å; Y986-F1021 HydrophobicContact CG-CZ 4.45Å; F989-F1021 HydrophobicContact CB-CD1 4.38Å; F989-F1021 HydrophobicContact CB-CE1 3.61Å; F989-F1021 HydrophobicContact CB-CZ 4.37Å; F989-F1021 AromaticContact CD1-CD1 3.94Å; F989-F1021 HydrophobicContact CD1-CD1 3.94Å; F989-F1021 AromaticContact CD1-CE1 3.99Å; F989-F1021 HydrophobicContact CD1-CE1 3.99Å; F989-F1021 AromaticContact CD2-CD1 3.92Å; F989-F1021 HydrophobicContact CD2-CD1 3.92Å; F989-F1021 AromaticContact CD2-CE1 3.85Å; F989-F1021 HydrophobicContact CD2-CE1 3.85Å; F989-F1021 HydrophobicContact CE1-CD1 4.16Å; F989-F1021 HydrophobicContact CE2-CD1 4.13Å; F989-F1021 AromaticContact CG-CD1 3.81Å; F989-F1021 HydrophobicContact CG-CD1 3.81Å; F989-F1021 AromaticContact CG-CE1 3.54Å; F989-F1021 HydrophobicContact CG-CE1 3.54Å; F989-F1021 HydrophobicContact CZ-CD1 4.25Å; A1013-F1021 HydrophobicContact CB-CB 3.97Å; R1018-F1021 HydrophobicContact CB-CB 3.96Å; R1018-F1021 HydrophobicContact CB-CD2 3.63Å; R1018-F1021 HydrophobicContact CB-CE2 4.4Å; R1018-F1021 HydrophobicContact CB-CG 4.06Å; R1018-F1021 HydrophobicContact CG-CD2 4.3Å; R1018-F1021 PolarHBondContact O-N 3.48Å; F1021-L1023 PolarHBondContact O-N 2.97Å; F1021-Q1024 PolarHBondContact O-N 3.16Å; F1021-L1025 VanDerWaalsContact O-CB 3.26Å; F1021-L1025 WeakPolarHBondContact O-CB 3.35Å; F1021-L1025 WeakPolarHBondContact O-CD1 3.46Å; F1021-L1025 WeakPolarHBondContact O-CG 3.3Å; F1021-L1025 PolarHBondContact O-N 2.99Å
1022	V	90.9	Very high	89.1	Confident	1 Å²	1	48.1 Å²	48.1	1%	0.006	23%	0.227	C	C	.	.	H	α-helix	trans	-57.8	-48.2	177.4	167.5	0	0	0	0	111.1	L1010 A1013 V1014 R1018 T1019 I1026 L1056 I1060	L1010-V1022 HydrophobicContact CD1-CB 4.27Å; L1010-V1022 HydrophobicContact CD1-CG1 3.98Å; L1010-V1022 HydrophobicContact CD1-CG2 4.21Å; A1013-V1022 HydrophobicContact CB-CG2 3.59Å; V1014-V1022 HydrophobicContact CG2-CG2 4.01Å; R1018-V1022 WeakPolarHBondContact O-CG2 3.44Å; R1018-V1022 PolarHBondContact O-N 3.17Å; T1019-V1022 PolarHBondContact O-N 3.45Å; V1022-I1026 HydrophobicContact CG1-CD1 3.87Å; V1022-I1026 WeakPolarHBondContact O-CD1 3.37Å; V1022-I1026 VanDerWaalsContact O-CG1 3.24Å; V1022-I1026 WeakPolarHBondContact O-CG1 3.43Å; V1022-I1026 PolarHBondContact O-N 3.08Å; V1022-I1026 VanDerWaalsContact O-N 3.15Å; V1022-L1056 HydrophobicContact CG1-CD1 4.29Å; V1022-I1060 HydrophobicContact CG1-CD1 3.97Å; V1022-I1060 HydrophobicContact CG1-CG1 3.54Å
1023	L	89.5	Confident	89	Confident	57 Å²	57	48.3 Å²	48.3	30%	0.298	23%	0.228	S	C	.	.	H	α-helix	trans	-66.4	-43.1	-179.5	-67.8	174.2	0	0	0	111.7	T1019 D1020 F1021 E1027 K1063	T1019-L1023 WeakPolarHBondContact O-CG 3.3Å; T1019-L1023 PolarHBondContact O-N 3.35Å; T1019-L1023 VanDerWaalsContact O-N 3.07Å; D1020-L1023 PolarHBondContact O-N 3.36Å; F1021-L1023 PolarHBondContact O-N 2.97Å; L1023-E1027 WeakPolarHBondContact O-CB 3.47Å; L1023-E1027 PolarHBondContact O-N 2.72Å; L1023-E1027 VanDerWaalsContact O-N 3.1Å; L1023-K1063 HydrophobicContact CD2-CB 4.33Å; L1023-K1063 HydrophobicContact CD2-CG 4.26Å
1024	Q	89.7	Confident	88.9	Confident	47 Å²	47	52.4 Å²	52.4	22%	0.22	25%	0.25	C	C	.	.	H	α-helix	trans	-64.3	-43.1	178.2	-170.9	63.3	31.5	0	0	112	Y986 F989 D1020 F1021 E1027 L1028	Y986-Q1024 HydrophobicContact CE2-CB 4.34Å; Y986-Q1024 PolarHBondContact OH-OE1 3.05Å; F989-Q1024 HydrophobicContact CE1-CG 4.14Å; D1020-Q1024 WeakPolarHBondContact O-CB 2.95Å; D1020-Q1024 PolarHBondContact O-N 3.41Å; F1021-Q1024 PolarHBondContact O-N 3.16Å; Q1024-E1027 PolarHBondContact O-N 3.38Å; Q1024-L1028 HydrophobicContact CG-CD1 3.97Å; Q1024-L1028 HydrophobicContact CG-CG 4.49Å; Q1024-L1028 WeakPolarHBondContact O-CB 3.45Å; Q1024-L1028 VanDerWaalsContact O-CG 3.28Å; Q1024-L1028 WeakPolarHBondContact O-CG 3.15Å; Q1024-L1028 PolarHBondContact O-N 3.48Å
1025	L	90.7	Very high	88.8	Confident	0 Å²	0	54.5 Å²	54.5	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-65.2	-40.9	179.5	-76.4	167.8	0	0	0	112.3	I981 F989 I999 L1009 L1010 A1013 F1021 E1027 L1028 C1029 L1032	I981-L1025 HydrophobicContact CD1-CD1 4.18Å; F989-L1025 HydrophobicContact CE2-CD2 4.16Å; F989-L1025 HydrophobicContact CZ-CD2 3.71Å; F989-L1025 HydrophobicContact CZ-CG 3.97Å; I999-L1025 HydrophobicContact CG2-CD2 4.37Å; L1009-L1025 HydrophobicContact CB-CD1 3.83Å; L1009-L1025 HydrophobicContact CB-CD2 3.89Å; L1009-L1025 HydrophobicContact CD1-CD2 4.1Å; L1010-L1025 HydrophobicContact CB-CD1 4.47Å; L1010-L1025 HydrophobicContact CD1-CB 4.41Å; A1013-L1025 HydrophobicContact CB-CD1 4.02Å; F1021-L1025 VanDerWaalsContact O-CB 3.26Å; F1021-L1025 WeakPolarHBondContact O-CB 3.35Å; F1021-L1025 WeakPolarHBondContact O-CD1 3.46Å; F1021-L1025 WeakPolarHBondContact O-CG 3.3Å; F1021-L1025 PolarHBondContact O-N 2.99Å; L1025-E1027 VanDerWaalsContact C-N 3.29Å; L1025-E1027 PolarHBondContact O-N 3.33Å; L1025-L1028 PolarHBondContact O-N 3.44Å; L1025-C1029 CarbonylContact O-C 3.59Å; L1025-C1029 PolarHBondContact O-N 3.18Å; L1025-L1032 HydrophobicContact CB-CD1 4.22Å; L1025-L1032 HydrophobicContact CD2-CD1 4.11Å
1026	I	89.3	Confident	88.8	Confident	6 Å²	6	58.1 Å²	58.1	3%	0.031	28%	0.275	C	S	.	.	H	α-helix	trans	-66	-35.6	176	-65.9	165.9	0	0	0	110.8	L1010 V1022 C1029 Q1030 V1033 I1060 K1063	L1010-I1026 HydrophobicContact CD1-CD1 4.37Å; L1010-I1026 HydrophobicContact CD1-CG1 4.11Å; L1010-I1026 HydrophobicContact CD2-CG1 4.08Å; V1022-I1026 HydrophobicContact CG1-CD1 3.87Å; V1022-I1026 WeakPolarHBondContact O-CD1 3.37Å; V1022-I1026 VanDerWaalsContact O-CG1 3.24Å; V1022-I1026 WeakPolarHBondContact O-CG1 3.43Å; V1022-I1026 PolarHBondContact O-N 3.08Å; V1022-I1026 VanDerWaalsContact O-N 3.15Å; I1026-C1029 CarbonylContact O-C 3.59Å; I1026-Q1030 WeakPolarHBondContact O-CA 3.39Å; I1026-Q1030 PolarHBondContact O-N 3.09Å; I1026-V1033 HydrophobicContact CG1-CG2 4.04Å; I1026-I1060 HydrophobicContact CD1-CB 4.36Å; I1026-I1060 HydrophobicContact CD1-CG1 4.31Å; I1026-I1060 HydrophobicContact CD1-CG2 3.84Å; I1026-K1063 HydrophobicContact CB-CG 4.46Å; I1026-K1063 HydrophobicContact CG2-CB 4.34Å; I1026-K1063 HydrophobicContact CG2-CG 3.91Å
1027	E	88	Confident	88.9	Confident	123 Å²	123	55.2 Å²	55.2	58%	0.575	26%	0.264	S	S	*	.	H	α-helix	trans	-70.4	-37.3	177.2	-171.6	161.4	155.3	0	0	112.7	L1023 Q1024 L1025 K1063	L1023-E1027 WeakPolarHBondContact O-CB 3.47Å; L1023-E1027 PolarHBondContact O-N 2.72Å; L1023-E1027 VanDerWaalsContact O-N 3.1Å; Q1024-E1027 PolarHBondContact O-N 3.38Å; L1025-E1027 VanDerWaalsContact C-N 3.29Å; L1025-E1027 PolarHBondContact O-N 3.33Å; E1027-K1063 WeakPolarHBondContact OE2-CE 3.44Å; E1027-K1063 IonicContact OE2-NZ 2.82Å; E1027-K1063 PolarHBondContact OE2-NZ 3.13Å
1028	L	87.3	Confident	88.8	Confident	79 Å²	79	49.8 Å²	49.8	41%	0.414	24%	0.244	S	C	.	.	H	α-helix	trans	-76.1	-41	176.7	-69.8	169	0	0	0	112.8	V993 I999 Q1024 L1025	V993-L1028 HydrophobicContact CG1-CD1 3.42Å; V993-L1028 VanDerWaalsContact CG1-CD1 3.42Å; I999-L1028 HydrophobicContact CD1-CB 4.4Å; I999-L1028 HydrophobicContact CD1-CD1 4.29Å; Q1024-L1028 HydrophobicContact CG-CD1 3.97Å; Q1024-L1028 HydrophobicContact CG-CG 4.49Å; Q1024-L1028 WeakPolarHBondContact O-CB 3.45Å; Q1024-L1028 VanDerWaalsContact O-CG 3.28Å; Q1024-L1028 WeakPolarHBondContact O-CG 3.15Å; Q1024-L1028 PolarHBondContact O-N 3.48Å; L1025-L1028 PolarHBondContact O-N 3.44Å
1029	C	86.1	Confident	88.7	Confident	20 Å²	20	46.3 Å²	46.3	14%	0.135	23%	0.231	C	C	.	.			trans	-149.3	95.2	-177.4	-172.6	0	0	0	0	110.7	I999 L1025 I1026 E1031 L1032	I999-C1029 HydrophobicContact CG2-CB 4.3Å; L1025-C1029 CarbonylContact O-C 3.59Å; L1025-C1029 PolarHBondContact O-N 3.18Å; I1026-C1029 CarbonylContact O-C 3.59Å; C1029-E1031 PolarHBondContact O-N 3.34Å; C1029-L1032 HydrophobicContact CB-CD1 4Å; C1029-L1032 HydrophobicContact CB-CG 3.92Å; C1029-L1032 WeakPolarHBondContact O-CG 3.47Å; C1029-L1032 PolarHBondContact O-N 2.84Å
1030	Q	87	Confident	88.8	Confident	118 Å²	118	43.9 Å²	43.9	55%	0.551	22%	0.217	S	C	*	.	G	3₁₀ helix	trans	-63.7	-24.7	179.2	-169	177.1	2.1	0	0	112.7	I1026 L1032 V1033 S1064	I1026-Q1030 WeakPolarHBondContact O-CA 3.39Å; I1026-Q1030 PolarHBondContact O-N 3.09Å; Q1030-L1032 PolarHBondContact O-N 3.18Å; Q1030-V1033 WeakPolarHBondContact O-CB 3.28Å; Q1030-V1033 VanDerWaalsContact O-CG2 3.25Å; Q1030-V1033 WeakPolarHBondContact O-CG2 3.38Å; Q1030-V1033 PolarHBondContact O-N 2.97Å; Q1030-S1064 PolarHBondContact NE2-O 3.35Å
1031	E	85.7	Confident	88.9	Confident	123 Å²	123	39.4 Å²	39.4	58%	0.575	19%	0.192	S	C	*	.	G	3₁₀ helix	trans	-62.9	-27.8	-179.4	-61	-179.6	-175.5	0	0	113.3	C1029 V1033 N1034 Y1035	C1029-E1031 PolarHBondContact O-N 3.34Å; E1031-V1033 PolarHBondContact O-N 3.07Å; E1031-N1034 PolarHBondContact O-N 3.05Å; E1031-Y1035 HydrophobicContact CB-CE1 3.99Å; E1031-Y1035 WeakPolarHBondContact O-CD1 3.24Å
1032	L	88.1	Confident	88.9	Confident	0 Å²	0	39 Å²	39	0%	0	19%	0.191	C	C	.	.	G	3₁₀ helix	trans	-57	-21.6	-179.5	-64.9	178.9	0	0	0	113.2	I999 M1000 L1010 L1025 C1029 Q1030 N1034 Y1035	I999-L1032 HydrophobicContact CG2-CD1 4.17Å; M1000-L1032 HydrophobicContact SD-CD2 4.43Å; L1010-L1032 HydrophobicContact CB-CB 3.99Å; L1010-L1032 HydrophobicContact CB-CD1 4.46Å; L1010-L1032 HydrophobicContact CD2-CB 3.94Å; L1025-L1032 HydrophobicContact CB-CD1 4.22Å; L1025-L1032 HydrophobicContact CD2-CD1 4.11Å; C1029-L1032 HydrophobicContact CB-CD1 4Å; C1029-L1032 HydrophobicContact CB-CG 3.92Å; C1029-L1032 WeakPolarHBondContact O-CG 3.47Å; C1029-L1032 PolarHBondContact O-N 2.84Å; Q1030-L1032 PolarHBondContact O-N 3.18Å; L1032-N1034 VanDerWaalsContact C-N 3.28Å; L1032-N1034 PolarHBondContact O-N 3Å; L1032-Y1035 HydrophobicContact CD2-CD2 3.8Å; L1032-Y1035 HydrophobicContact CD2-CE2 3.78Å; L1032-Y1035 HydrophobicContact CD2-CG 4.42Å; L1032-Y1035 PolarHBondContact O-N 3.02Å
1033	V	89.5	Confident	89	Confident	6 Å²	6	39.1 Å²	39.1	4%	0.036	19%	0.191	C	C	.	.	G	3₁₀ helix	trans	-64.9	-31.7	179.1	177.7	0	0	0	0	112.3	L1010 I1026 Q1030 E1031 P1043 F1044	L1010-V1033 HydrophobicContact CD2-CB 4.41Å; L1010-V1033 HydrophobicContact CD2-CG2 3.82Å; I1026-V1033 HydrophobicContact CG1-CG2 4.04Å; Q1030-V1033 WeakPolarHBondContact O-CB 3.28Å; Q1030-V1033 VanDerWaalsContact O-CG2 3.25Å; Q1030-V1033 WeakPolarHBondContact O-CG2 3.38Å; Q1030-V1033 PolarHBondContact O-N 2.97Å; E1031-V1033 PolarHBondContact O-N 3.07Å; V1033-P1043 WeakPolarHBondContact O-CD 3.35Å; V1033-F1044 HydrophobicContact CG1-CD2 3.91Å; V1033-F1044 HydrophobicContact CG1-CE2 3.13Å; V1033-F1044 HydrophobicContact CG1-CZ 3.85Å
1034	N	89.2	Confident	89.1	Confident	86 Å²	86	36.5 Å²	36.5	46%	0.46	18%	0.178	S	C	.	.	G	3₁₀ helix	trans	-99.5	-2	-179.3	-65.6	-26.5	0	0	0	112.8	E1031 L1032 Q1036 I1071	E1031-N1034 PolarHBondContact O-N 3.05Å; L1032-N1034 VanDerWaalsContact C-N 3.28Å; L1032-N1034 PolarHBondContact O-N 3Å; N1034-Q1036 PolarHBondContact O-N 2.85Å; N1034-I1071 HydrophobicContact CB-CD1 4.45Å
1035	Y	89.9	Confident	89.2	Confident	43 Å²	43	34.3 Å²	34.3	17%	0.169	17%	0.167	C	C	.	.			trans	-65.6	139.9	179.1	-79.2	23.2	0	0	0	108.9	M1000 H1011 E1031 L1032 T1042 P1043	M1000-Y1035 WeakPolarHBondContact CE-OH 3.46Å; H1011-Y1035 PolarHBondContact CE1-O 3.48Å; H1011-Y1035 PolarHBondContact NE2-O 3.4Å; E1031-Y1035 HydrophobicContact CB-CE1 3.99Å; E1031-Y1035 WeakPolarHBondContact O-CD1 3.24Å; L1032-Y1035 HydrophobicContact CD2-CD2 3.8Å; L1032-Y1035 HydrophobicContact CD2-CE2 3.78Å; L1032-Y1035 HydrophobicContact CD2-CG 4.42Å; L1032-Y1035 PolarHBondContact O-N 3.02Å; Y1035-T1042 WeakPolarHBondContact O-CA 3.4Å; Y1035-P1043 WeakPolarHBondContact O-CD 3.5Å
1036	Q	90.6	Very high	89.2	Confident	78 Å²	78	34.3 Å²	34.3	36%	0.364	17%	0.167	S	C	.	.			trans	-107.2	142.9	178	-66.2	177.6	-1	0	0	109.7	R1002 N1034 G1040 R1041 T1042 I1071	R1002-Q1036 PolarHBondContact NH1-O 3.5Å; N1034-Q1036 PolarHBondContact O-N 2.85Å; Q1036-G1040 WeakPolarHBondContact CG-O 3.42Å; Q1036-R1041 CarbonylContact C-O 3.6Å; Q1036-R1041 VanDerWaalsContact CA-O 3.3Å; Q1036-R1041 WeakPolarHBondContact CA-O 3.33Å; Q1036-T1042 HydrophobicContact CG-CG2 4.01Å; Q1036-I1071 VanDerWaalsContact NE2-CG2 3.31Å
1037	D	89.9	Confident	89.3	Confident	5 Å²	5	34 Å²	34	3%	0.027	17%	0.166	C	C	.	.			trans	-76.8	-177	167.6	69.8	8	0	0	0	112.1	R1007 L1039 G1040 R1041 Y1046	R1007-D1037 HydrophobicContact CG-CB 3.74Å; D1037-L1039 PolarHBondContact O-N 2.9Å; D1037-L1039 WeakPolarHBondContact OD1-CA 3.43Å; D1037-L1039 WeakPolarHBondContact OD1-CB 3.26Å; D1037-L1039 PolarHBondContact OD1-N 3.27Å; D1037-G1040 PolarHBondContact O-N 3.1Å; D1037-G1040 PolarHBondContact OD1-N 3.37Å; D1037-G1040 VanDerWaalsContact OD1-N 3.14Å; D1037-R1041 PolarHBondContact N-O 3.14Å; D1037-R1041 WeakPolarHBondContact OD1-CB 3.43Å; D1037-R1041 PolarHBondContact OD1-N 2.86Å; D1037-Y1046 WeakPolarHBondContact OD2-CE2 3.49Å; D1037-Y1046 PolarHBondContact OD2-OH 3.48Å
1038	C	85.7	Confident	89.4	Confident	5 Å²	5	29.5 Å²	29.5	3%	0.034	15%	0.145	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58	-15.3	177.9	59.5	0	0	0	0	114	G803 R1005 E1006 L1074	G803-C1038 WeakPolarHBondContact CA-O 3.28Å; R1005-C1038 VanDerWaalsContact O-CB 3.32Å; R1005-C1038 WeakPolarHBondContact O-CB 3.27Å; R1005-C1038 PolarHBondContact O-N 3.35Å; R1005-C1038 PolarHBondContact O-SG 3.01Å; E1006-C1038 HydrophobicContact CB-CB 4.49Å; E1006-C1038 HydrophobicContact CG-CB 4.38Å; C1038-L1074 VanDerWaalsContact O-CD1 3.3Å; C1038-L1074 WeakPolarHBondContact O-CD1 3.48Å
1039	L	86.9	Confident	89.5	Confident	13 Å²	13	25.9 Å²	25.9	7%	0.068	13%	0.126	C	C	.	.	T	Hydrogen-bonded Turn	trans	-104.2	7.5	177.5	-73.6	179.9	0	0	0	113.2	I847 D1037 R1041 L1074	I847-L1039 HydrophobicContact CG2-CD1 4.21Å; I847-L1039 HydrophobicContact CG2-CD2 3.32Å; I847-L1039 HydrophobicContact CG2-CG 3.97Å; D1037-L1039 PolarHBondContact O-N 2.9Å; D1037-L1039 WeakPolarHBondContact OD1-CA 3.43Å; D1037-L1039 WeakPolarHBondContact OD1-CB 3.26Å; D1037-L1039 PolarHBondContact OD1-N 3.27Å; L1039-R1041 HydrophobicContact CB-CG 4.27Å; L1039-R1041 PolarHBondContact O-N 2.63Å; L1039-L1074 VanDerWaalsContact C-CG 3.48Å; L1039-L1074 WeakPolarHBondContact O-CB 3.37Å; L1039-L1074 WeakPolarHBondContact O-CG 3.34Å; L1039-L1074 PolarHBondContact O-N 3.42Å
1040	G	89.6	Confident	89.5	Confident	1 Å²	1	25 Å²	25	1%	0.01	12%	0.12	C	C	.	.	S	Bend	trans	78	5.1	-179	0	0	0	0	0	113.8	Q1036 D1037	Q1036-G1040 WeakPolarHBondContact CG-O 3.42Å; D1037-G1040 PolarHBondContact O-N 3.1Å; D1037-G1040 PolarHBondContact OD1-N 3.37Å; D1037-G1040 VanDerWaalsContact OD1-N 3.14Å
1041	R	91.5	Very high	89.2	Confident	8 Å²	8	23.5 Å²	23.5	3%	0.03	12%	0.121	C	C	.	.			trans	-84.4	137.2	-176.1	-60.9	164.8	175.6	166	0.2	109.5	H1011 Q1036 D1037 L1039 H1045 Y1046 D1073 Y1082 E1100	H1011-R1041 PolarHBondContact NE2-O 3.5Å; Q1036-R1041 CarbonylContact C-O 3.6Å; Q1036-R1041 VanDerWaalsContact CA-O 3.3Å; Q1036-R1041 WeakPolarHBondContact CA-O 3.33Å; D1037-R1041 PolarHBondContact N-O 3.14Å; D1037-R1041 WeakPolarHBondContact OD1-CB 3.43Å; D1037-R1041 PolarHBondContact OD1-N 2.86Å; L1039-R1041 HydrophobicContact CB-CG 4.27Å; L1039-R1041 PolarHBondContact O-N 2.63Å; R1041-H1045 HydrophobicContact CB-CB 4.01Å; R1041-H1045 HydrophobicContact CG-CB 4.41Å; R1041-Y1046 HydrophobicContact CB-CE2 3.92Å; R1041-Y1046 WeakPolarHBondContact CD-OH 3.35Å; R1041-Y1046 PolarHBondContact NH1-OH 2.95Å; R1041-D1073 HydrophobicContact CG-CB 3.9Å; R1041-Y1082 PolarHBondContact NE-OH 3.27Å; R1041-E1100 IonicContact NH1-OE1 3.66Å; R1041-E1100 PolarHBondContact NH1-OE1 2.78Å; R1041-E1100 VanDerWaalsContact NH1-OE1 3.13Å
1042	T	92.6	Very high	88.8	Confident	1 Å²	1	21.9 Å²	21.9	1%	0.006	12%	0.116	C	C	.	.			trans	-91	167.3	171.8	68.2	0	0	0	0	111.4	H1011 Y1035 Q1036 F1044 H1045 I1071	H1011-T1042 VanDerWaalsContact NE2-C 3.33Å; Y1035-T1042 WeakPolarHBondContact O-CA 3.4Å; Q1036-T1042 HydrophobicContact CG-CG2 4.01Å; T1042-F1044 PolarHBondContact O-N 3.09Å; T1042-F1044 PolarHBondContact OG1-N 2.82Å; T1042-H1045 PolarHBondContact N-ND1 3.29Å; T1042-H1045 WeakPolarHBondContact O-CB 3.28Å; T1042-H1045 PolarHBondContact O-N 2.87Å; T1042-H1045 PolarHBondContact OG1-ND1 2.87Å; T1042-I1071 HydrophobicContact CG2-CD1 4.2Å; T1042-I1071 HydrophobicContact CG2-CG2 3.73Å
1043	P	91.9	Very high	88.2	Confident	2 Å²	2	23.6 Å²	23.6	1%	0.013	13%	0.125	C	C	.	.	H	α-helix	trans	-55.8	-27.8	174.7	-25.5	35.7	0	0	0	113.1	L1010 H1011 V1014 V1033 Y1035 Y1046 A1047	L1010-P1043 HydrophobicContact CB-CG 4.27Å; L1010-P1043 HydrophobicContact CD2-CB 4.27Å; L1010-P1043 HydrophobicContact CD2-CG 3.95Å; L1010-P1043 HydrophobicContact CG-CB 4.05Å; L1010-P1043 HydrophobicContact CG-CG 3.91Å; H1011-P1043 VanDerWaalsContact NE2-CD 3.28Å; H1011-P1043 WeakPolarHBondContact NE2-CD 3.48Å; V1014-P1043 HydrophobicContact CG2-CB 4.16Å; V1033-P1043 WeakPolarHBondContact O-CD 3.35Å; Y1035-P1043 WeakPolarHBondContact O-CD 3.5Å; P1043-Y1046 PolarHBondContact O-N 3.43Å; P1043-A1047 WeakPolarHBondContact O-CB 3.45Å; P1043-A1047 PolarHBondContact O-N 3.14Å
1044	F	91.7	Very high	87.7	Confident	3 Å²	3	32.8 Å²	32.8	1%	0.013	16%	0.159	C	C	.	.	H	α-helix	trans	-69.3	-32.2	176.2	-75.6	-64.2	0	0	0	114.3	V1033 T1042 Y1046 A1047 I1048 F1057 I1060 V1061 I1067 I1079	V1033-F1044 HydrophobicContact CG1-CD2 3.91Å; V1033-F1044 HydrophobicContact CG1-CE2 3.13Å; V1033-F1044 HydrophobicContact CG1-CZ 3.85Å; T1042-F1044 PolarHBondContact O-N 3.09Å; T1042-F1044 PolarHBondContact OG1-N 2.82Å; F1044-Y1046 PolarHBondContact O-N 2.89Å; F1044-A1047 PolarHBondContact O-N 3.4Å; F1044-I1048 PolarHBondContact O-N 2.94Å; F1044-I1048 VanDerWaalsContact O-N 3.09Å; F1044-F1057 HydrophobicContact CB-CE2 4.27Å; F1044-F1057 AromaticContact CD1-CD2 3.88Å; F1044-F1057 HydrophobicContact CD1-CD2 3.88Å; F1044-F1057 AromaticContact CD1-CE2 3.64Å; F1044-F1057 HydrophobicContact CD1-CE2 3.64Å; F1044-F1057 HydrophobicContact CD1-CZ 4.24Å; F1044-F1057 HydrophobicContact CE1-CE2 4.46Å; F1044-F1057 HydrophobicContact CG-CE2 4.38Å; F1044-I1060 HydrophobicContact CD1-CG2 4.28Å; F1044-I1060 HydrophobicContact CE1-CB 3.9Å; F1044-I1060 HydrophobicContact CE1-CG2 3.34Å; F1044-I1060 HydrophobicContact CE2-CG2 4.36Å; F1044-I1060 HydrophobicContact CZ-CB 4.34Å; F1044-I1060 HydrophobicContact CZ-CG2 3.38Å; F1044-V1061 HydrophobicContact CE1-CG2 3.71Å; F1044-V1061 HydrophobicContact CZ-CG2 4.16Å; F1044-I1067 HydrophobicContact CD1-CD1 4.05Å; F1044-I1067 HydrophobicContact CD1-CG1 4.03Å; F1044-I1067 HydrophobicContact CD2-CB 4.49Å; F1044-I1067 HydrophobicContact CD2-CG1 4.1Å; F1044-I1067 HydrophobicContact CD2-CG2 3.87Å; F1044-I1067 HydrophobicContact CE1-CD1 3.91Å; F1044-I1067 HydrophobicContact CE1-CG1 3.64Å; F1044-I1067 HydrophobicContact CE2-CB 4.21Å; F1044-I1067 HydrophobicContact CE2-CG1 3.65Å; F1044-I1067 HydrophobicContact CE2-CG2 4.08Å; F1044-I1067 HydrophobicContact CG-CG1 4.26Å; F1044-I1067 HydrophobicContact CG-CG2 4.2Å; F1044-I1067 HydrophobicContact CZ-CB 4.46Å; F1044-I1067 HydrophobicContact CZ-CD1 4.24Å; F1044-I1067 HydrophobicContact CZ-CG1 3.44Å; F1044-I1067 VanDerWaalsContact CZ-CG1 3.44Å; F1044-I1079 HydrophobicContact CB-CD1 3.82Å; F1044-I1079 HydrophobicContact CB-CG1 4.4Å; F1044-I1079 HydrophobicContact CB-CG2 4.29Å
1045	H	91.8	Very high	87.4	Confident	0 Å²	0	37.6 Å²	37.6	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-62.6	-35.8	174.5	-68.7	85.9	0	0	0	111	R1041 T1042 I1048 I1079 Y1082	R1041-H1045 HydrophobicContact CB-CB 4.01Å; R1041-H1045 HydrophobicContact CG-CB 4.41Å; T1042-H1045 PolarHBondContact N-ND1 3.29Å; T1042-H1045 WeakPolarHBondContact O-CB 3.28Å; T1042-H1045 PolarHBondContact O-N 2.87Å; T1042-H1045 PolarHBondContact OG1-ND1 2.87Å; H1045-I1048 WeakPolarHBondContact O-CG2 3.42Å; H1045-I1079 WeakPolarHBondContact CE1-CG1 3.43Å; H1045-I1079 WeakPolarHBondContact NE2-CG1 3.45Å; H1045-Y1082 HydrophobicContact CB-CD1 4.35Å; H1045-Y1082 HydrophobicContact CB-CE1 4.37Å; H1045-Y1082 AromaticContact CD2-CD2 3.59Å; H1045-Y1082 AromaticContact CD2-CE2 3.61Å
1046	Y	91	Very high	87.1	Confident	1 Å²	1	36.2 Å²	36.2	0%	0.004	17%	0.166	C	C	.	.	H	α-helix	trans	-76.7	-41.9	173.5	-65.3	-65.3	0	0	0	112.4	H1011 L1015 D1037 R1041 P1043 F1044 I1048 C1049 L1050 L1096 E1100	H1011-Y1046 AromaticContact CD2-CD2 3.78Å; H1011-Y1046 AromaticContact CD2-CE2 3.72Å; L1015-Y1046 HydrophobicContact CD2-CD1 3.69Å; L1015-Y1046 HydrophobicContact CD2-CE1 4.23Å; L1015-Y1046 HydrophobicContact CD2-CG 3.97Å; L1015-Y1046 HydrophobicContact CG-CG 4.41Å; D1037-Y1046 WeakPolarHBondContact OD2-CE2 3.49Å; D1037-Y1046 PolarHBondContact OD2-OH 3.48Å; R1041-Y1046 HydrophobicContact CB-CE2 3.92Å; R1041-Y1046 WeakPolarHBondContact CD-OH 3.35Å; R1041-Y1046 PolarHBondContact NH1-OH 2.95Å; P1043-Y1046 PolarHBondContact O-N 3.43Å; F1044-Y1046 PolarHBondContact O-N 2.89Å; Y1046-I1048 VanDerWaalsContact C-N 3.28Å; Y1046-I1048 PolarHBondContact O-N 3.29Å; Y1046-C1049 PolarHBondContact O-N 3.06Å; Y1046-C1049 VanDerWaalsContact O-N 3.14Å; Y1046-L1050 PolarHBondContact O-N 3.3Å; Y1046-L1096 HydrophobicContact CD1-CD2 4.11Å; Y1046-L1096 HydrophobicContact CD1-CG 4.36Å; Y1046-L1096 HydrophobicContact CE1-CD1 4.5Å; Y1046-L1096 HydrophobicContact CE1-CD2 4.16Å; Y1046-L1096 HydrophobicContact CE1-CG 4.22Å; Y1046-E1100 HydrophobicContact CE1-CG 3.78Å
1047	A	91	Very high	86.9	Confident	0 Å²	0	34.3 Å²	34.3	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-61.4	-34.9	-177.2	0	0	0	0	0	113	V1014 P1043 F1044 C1049 L1050 N1053 F1057 I1060	V1014-A1047 HydrophobicContact CG1-CB 3.85Å; P1043-A1047 WeakPolarHBondContact O-CB 3.45Å; P1043-A1047 PolarHBondContact O-N 3.14Å; F1044-A1047 PolarHBondContact O-N 3.4Å; A1047-C1049 VanDerWaalsContact C-N 3.32Å; A1047-L1050 WeakPolarHBondContact O-CB 3.48Å; A1047-L1050 PolarHBondContact O-N 3.29Å; A1047-N1053 WeakPolarHBondContact O-CA 3.16Å; A1047-N1053 WeakPolarHBondContact O-CB 3.15Å; A1047-F1057 HydrophobicContact CB-CD2 3.9Å; A1047-I1060 HydrophobicContact CB-CD1 4.26Å
1048	I	90.1	Very high	86.7	Confident	28 Å²	28	39.5 Å²	39.5	14%	0.144	18%	0.184	C	C	.	.	H	α-helix	trans	-72.1	-24.7	178.8	-159.2	168.1	0	0	0	113.2	F1044 H1045 Y1046 L1050 N1053 F1057 I1079	F1044-I1048 PolarHBondContact O-N 2.94Å; F1044-I1048 VanDerWaalsContact O-N 3.09Å; H1045-I1048 WeakPolarHBondContact O-CG2 3.42Å; Y1046-I1048 VanDerWaalsContact C-N 3.28Å; Y1046-I1048 PolarHBondContact O-N 3.29Å; I1048-L1050 VanDerWaalsContact C-N 3.35Å; I1048-N1053 WeakPolarHBondContact O-CB 3.17Å; I1048-N1053 PolarHBondContact O-ND2 3.14Å; I1048-F1057 HydrophobicContact CB-CD2 4.28Å; I1048-F1057 HydrophobicContact CB-CE2 4.1Å; I1048-I1079 HydrophobicContact CD1-CG2 4.29Å; I1048-I1079 WeakPolarHBondContact CD1-O 3.37Å; I1048-I1079 HydrophobicContact CG2-CG2 4.44Å
1049	C	89	Confident	86.6	Confident	2 Å²	2	42.9 Å²	42.9	1%	0.014	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.5	8	176.9	-62.9	0	0	0	0	113.4	Y1046 A1047 Y1086 L1096 I1097	Y1046-C1049 PolarHBondContact O-N 3.06Å; Y1046-C1049 VanDerWaalsContact O-N 3.14Å; A1047-C1049 VanDerWaalsContact C-N 3.32Å; C1049-Y1086 HydrophobicContact CB-CD2 3.89Å; C1049-Y1086 HydrophobicContact CB-CE2 4.28Å; C1049-Y1086 WeakPolarHBondContact O-CE2 3.32Å; C1049-L1096 HydrophobicContact CB-CD2 4.27Å; C1049-I1097 HydrophobicContact CB-CD1 4.41Å; C1049-I1097 VanDerWaalsContact O-CD1 3.29Å; C1049-I1097 WeakPolarHBondContact O-CD1 3.29Å
1050	L	87.7	Confident	86.5	Confident	2 Å²	2	42.4 Å²	42.4	1%	0.01	20%	0.196	C	C	.	.	S	Bend	trans	-73	146.4	172.8	-77.2	166.2	0	0	0	110.9	V1014 R1017 Y1046 A1047 I1048 D1052 N1053 L1056 I1097	V1014-L1050 HydrophobicContact CG1-CD1 4.26Å; R1017-L1050 HydrophobicContact CG-CD2 3.71Å; Y1046-L1050 PolarHBondContact O-N 3.3Å; A1047-L1050 WeakPolarHBondContact O-CB 3.48Å; A1047-L1050 PolarHBondContact O-N 3.29Å; I1048-L1050 VanDerWaalsContact C-N 3.35Å; L1050-D1052 PolarHBondContact O-N 3.28Å; L1050-N1053 HydrophobicContact CB-CB 4.43Å; L1050-N1053 WeakPolarHBondContact O-CA 3.5Å; L1050-N1053 WeakPolarHBondContact O-CB 3.37Å; L1050-N1053 PolarHBondContact O-N 3.29Å; L1050-L1056 HydrophobicContact CD1-CB 4.45Å; L1050-L1056 HydrophobicContact CD1-CD2 3.74Å; L1050-I1097 HydrophobicContact CB-CD1 4.09Å; L1050-I1097 HydrophobicContact CD2-CD1 3.28Å; L1050-I1097 HydrophobicContact CG-CD1 3.46Å; L1050-I1097 VanDerWaalsContact CG-CD1 3.46Å
1051	P	79.8	Confident	86.4	Confident	86 Å²	86	44.2 Å²	44.2	56%	0.558	21%	0.206	S	C	*	.	T	Hydrogen-bonded Turn	trans	-54.5	-36.4	173.5	-27.2	34.7	0	0	0	113.4
1052	D	76.7	Confident	86.1	Confident	90 Å²	90	48.3 Å²	48.3	48%	0.481	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-105.6	39.1	175	-59.5	-35.8	0	0	0	111.6	R1017 L1050 R1054 R1055	R1017-D1052 IonicContact CZ-OD2 3Å; R1017-D1052 IonicContact NH1-OD2 3.92Å; R1017-D1052 IonicContact NH2-OD2 2.68Å; R1017-D1052 PolarHBondContact NH2-OD2 3.45Å; L1050-D1052 PolarHBondContact O-N 3.28Å; D1052-R1054 PolarHBondContact O-N 3.02Å; D1052-R1055 PolarHBondContact O-N 3.46Å; D1052-R1055 VanDerWaalsContact O-N 3.17Å
1053	N	76.4	Confident	85.8	Confident	35 Å²	35	52.8 Å²	52.8	19%	0.187	26%	0.256	C	S	.	.	H	α-helix	trans	-43.5	-47	-171.8	54.6	9.8	0	0	0	113.3	A1047 I1048 L1050 R1055 F1057	A1047-N1053 WeakPolarHBondContact O-CA 3.16Å; A1047-N1053 WeakPolarHBondContact O-CB 3.15Å; I1048-N1053 WeakPolarHBondContact O-CB 3.17Å; I1048-N1053 PolarHBondContact O-ND2 3.14Å; L1050-N1053 HydrophobicContact CB-CB 4.43Å; L1050-N1053 WeakPolarHBondContact O-CA 3.5Å; L1050-N1053 WeakPolarHBondContact O-CB 3.37Å; L1050-N1053 PolarHBondContact O-N 3.29Å; N1053-R1055 PolarHBondContact O-N 3.19Å; N1053-F1057 WeakPolarHBondContact O-CB 2.93Å; N1053-F1057 PolarHBondContact O-N 2.96Å
1054	R	78.4	Confident	85.4	Confident	199 Å²	199	53.1 Å²	53.1	75%	0.751	26%	0.258	S	S	*	.	H	α-helix	trans	-53.9	-46.2	-176.6	-72.6	-179	170.9	158	-0.7	114.2	D1052 L1058	D1052-R1054 PolarHBondContact O-N 3.02Å; R1054-L1058 WeakPolarHBondContact O-CB 3.41Å; R1054-L1058 WeakPolarHBondContact O-CD1 3.13Å; R1054-L1058 WeakPolarHBondContact O-CG 3.45Å; R1054-L1058 PolarHBondContact O-N 3.27Å
1055	R	83.9	Confident	84.8	Confident	188 Å²	188	56.5 Å²	56.5	71%	0.709	29%	0.294	S	S	*	.	H	α-helix	trans	-72.1	-49.1	-169.4	-171.4	178.2	-177.4	-174.7	-0.6	112.2	D1052 N1053 K1059	D1052-R1055 PolarHBondContact O-N 3.46Å; D1052-R1055 VanDerWaalsContact O-N 3.17Å; N1053-R1055 PolarHBondContact O-N 3.19Å; R1055-K1059 WeakPolarHBondContact O-CG 3.43Å; R1055-K1059 PolarHBondContact O-N 3.36Å
1056	L	83.9	Confident	84.3	Confident	13 Å²	13	58.1 Å²	58.1	7%	0.068	31%	0.31	C	S	.	.	H	α-helix	trans	-72.9	-42.7	179.9	-177.9	54.9	0	0	0	110.8	T1019 V1022 L1050 L1058 K1059 I1060	T1019-L1056 HydrophobicContact CG2-CD1 3.96Å; V1022-L1056 HydrophobicContact CG1-CD1 4.29Å; L1050-L1056 HydrophobicContact CD1-CB 4.45Å; L1050-L1056 HydrophobicContact CD1-CD2 3.74Å; L1056-L1058 PolarHBondContact O-N 3.2Å; L1056-K1059 PolarHBondContact O-N 3.04Å; L1056-I1060 HydrophobicContact CD1-CD1 4.13Å; L1056-I1060 HydrophobicContact CD1-CG1 4.14Å; L1056-I1060 HydrophobicContact CG-CD1 3.87Å; L1056-I1060 HydrophobicContact CG-CG1 4.36Å; L1056-I1060 VanDerWaalsContact O-CG1 3.3Å; L1056-I1060 WeakPolarHBondContact O-CG1 3.29Å; L1056-I1060 PolarHBondContact O-N 2.95Å
1057	F	86	Confident	83.9	Confident	38 Å²	38	60 Å²	60	17%	0.167	32%	0.32	C	S	.	.	H	α-helix	trans	-56.1	-52.4	176.8	-171.8	-88.4	0	0	0	110.9	F1044 A1047 I1048 N1053 K1059 I1060 V1061 I1067 I1079	F1044-F1057 HydrophobicContact CB-CE2 4.27Å; F1044-F1057 AromaticContact CD1-CD2 3.88Å; F1044-F1057 HydrophobicContact CD1-CD2 3.88Å; F1044-F1057 AromaticContact CD1-CE2 3.64Å; F1044-F1057 HydrophobicContact CD1-CE2 3.64Å; F1044-F1057 HydrophobicContact CD1-CZ 4.24Å; F1044-F1057 HydrophobicContact CE1-CE2 4.46Å; F1044-F1057 HydrophobicContact CG-CE2 4.38Å; A1047-F1057 HydrophobicContact CB-CD2 3.9Å; I1048-F1057 HydrophobicContact CB-CD2 4.28Å; I1048-F1057 HydrophobicContact CB-CE2 4.1Å; N1053-F1057 WeakPolarHBondContact O-CB 2.93Å; N1053-F1057 PolarHBondContact O-N 2.96Å; F1057-K1059 VanDerWaalsContact C-N 3.31Å; F1057-K1059 PolarHBondContact O-N 3.37Å; F1057-I1060 PolarHBondContact O-N 3.48Å; F1057-I1060 VanDerWaalsContact O-N 3.16Å; F1057-V1061 HydrophobicContact CD1-CG2 3.95Å; F1057-V1061 HydrophobicContact CE1-CG2 3.91Å; F1057-V1061 VanDerWaalsContact O-CG2 3.27Å; F1057-V1061 WeakPolarHBondContact O-CG2 3.49Å; F1057-V1061 PolarHBondContact O-N 3.41Å; F1057-I1067 HydrophobicContact CD1-CD1 4.46Å; F1057-I1067 HydrophobicContact CE1-CD1 3.44Å; F1057-I1067 VanDerWaalsContact CE1-CD1 3.44Å; F1057-I1067 HydrophobicContact CE2-CD1 4.1Å; F1057-I1067 HydrophobicContact CZ-CD1 3.22Å; F1057-I1079 HydrophobicContact CE2-CG2 4.33Å
1058	L	84.6	Confident	83.5	Confident	114 Å²	114	63.3 Å²	63.3	60%	0.597	34%	0.338	S	S	*	.	H	α-helix	trans	-61.1	-36.9	178.7	-70.5	171.1	0	0	0	113.1	R1054 L1056 V1061 S1062	R1054-L1058 WeakPolarHBondContact O-CB 3.41Å; R1054-L1058 WeakPolarHBondContact O-CD1 3.13Å; R1054-L1058 WeakPolarHBondContact O-CG 3.45Å; R1054-L1058 PolarHBondContact O-N 3.27Å; L1056-L1058 PolarHBondContact O-N 3.2Å; L1058-V1061 PolarHBondContact O-N 2.93Å; L1058-S1062 WeakPolarHBondContact O-CB 2.76Å; L1058-S1062 PolarHBondContact O-N 3.09Å; L1058-S1062 PolarHBondContact O-OG 2.65Å
1059	K	84.2	Confident	83.1	Confident	77 Å²	77	70.1 Å²	70.1	34%	0.335	37%	0.366	S	S	.	.	H	α-helix	trans	-62.3	-47.5	174.1	-80.5	-176.3	172.9	-166.3	0	111.8	R1055 L1056 F1057 V1061 S1062 K1063	R1055-K1059 WeakPolarHBondContact O-CG 3.43Å; R1055-K1059 PolarHBondContact O-N 3.36Å; L1056-K1059 PolarHBondContact O-N 3.04Å; F1057-K1059 VanDerWaalsContact C-N 3.31Å; F1057-K1059 PolarHBondContact O-N 3.37Å; K1059-V1061 PolarHBondContact O-N 3.3Å; K1059-S1062 PolarHBondContact O-N 3.03Å; K1059-S1062 PolarHBondContact O-OG 3.2Å; K1059-K1063 PolarHBondContact O-N 3.33Å; K1059-K1063 VanDerWaalsContact O-N 3.08Å
1060	I	85.2	Confident	82.9	Confident	2 Å²	2	78.1 Å²	78.1	1%	0.01	40%	0.403	C	S	.	.	H	α-helix	trans	-58.6	-50	177	-64.5	167.6	0	0	0	109.3	V1014 V1022 I1026 F1044 A1047 L1056 F1057 S1062 K1063 S1064	V1014-I1060 HydrophobicContact CG2-CD1 3.78Å; V1022-I1060 HydrophobicContact CG1-CD1 3.97Å; V1022-I1060 HydrophobicContact CG1-CG1 3.54Å; I1026-I1060 HydrophobicContact CD1-CB 4.36Å; I1026-I1060 HydrophobicContact CD1-CG1 4.31Å; I1026-I1060 HydrophobicContact CD1-CG2 3.84Å; F1044-I1060 HydrophobicContact CD1-CG2 4.28Å; F1044-I1060 HydrophobicContact CE1-CB 3.9Å; F1044-I1060 HydrophobicContact CE1-CG2 3.34Å; F1044-I1060 HydrophobicContact CE2-CG2 4.36Å; F1044-I1060 HydrophobicContact CZ-CB 4.34Å; F1044-I1060 HydrophobicContact CZ-CG2 3.38Å; A1047-I1060 HydrophobicContact CB-CD1 4.26Å; L1056-I1060 HydrophobicContact CD1-CD1 4.13Å; L1056-I1060 HydrophobicContact CD1-CG1 4.14Å; L1056-I1060 HydrophobicContact CG-CD1 3.87Å; L1056-I1060 HydrophobicContact CG-CG1 4.36Å; L1056-I1060 VanDerWaalsContact O-CG1 3.3Å; L1056-I1060 WeakPolarHBondContact O-CG1 3.29Å; L1056-I1060 PolarHBondContact O-N 2.95Å; F1057-I1060 PolarHBondContact O-N 3.48Å; F1057-I1060 VanDerWaalsContact O-N 3.16Å; I1060-S1062 VanDerWaalsContact C-N 3.33Å; I1060-S1062 PolarHBondContact O-N 2.87Å; I1060-K1063 PolarHBondContact O-N 3.26Å; I1060-S1064 VanDerWaalsContact O-CB 3.32Å; I1060-S1064 WeakPolarHBondContact O-CB 3.29Å; I1060-S1064 PolarHBondContact O-N 2.98Å; I1060-S1064 PolarHBondContact O-OG 3.31Å
1061	V	86.6	Confident	82.9	Confident	39 Å²	39	79.2 Å²	79.2	24%	0.236	41%	0.409	C	S	.	.	H	α-helix	trans	-57.4	-44.3	178.5	177.6	0	0	0	0	112.2	F1044 F1057 L1058 K1059 K1063 S1064 G1065 G1066 I1067	F1044-V1061 HydrophobicContact CE1-CG2 3.71Å; F1044-V1061 HydrophobicContact CZ-CG2 4.16Å; F1057-V1061 HydrophobicContact CD1-CG2 3.95Å; F1057-V1061 HydrophobicContact CE1-CG2 3.91Å; F1057-V1061 VanDerWaalsContact O-CG2 3.27Å; F1057-V1061 WeakPolarHBondContact O-CG2 3.49Å; F1057-V1061 PolarHBondContact O-N 3.41Å; L1058-V1061 PolarHBondContact O-N 2.93Å; K1059-V1061 PolarHBondContact O-N 3.3Å; V1061-K1063 VanDerWaalsContact C-N 3.33Å; V1061-K1063 PolarHBondContact O-N 3.31Å; V1061-S1064 PolarHBondContact O-OG 3.27Å; V1061-G1065 PolarHBondContact O-N 3.45Å; V1061-G1065 VanDerWaalsContact O-N 3.15Å; V1061-G1066 PolarHBondContact O-N 3.02Å; V1061-I1067 HydrophobicContact CG2-CD1 3.23Å; V1061-I1067 HydrophobicContact CG2-CG1 3.56Å
1062	S	85.8	Confident	83.4	Confident	95 Å²	95	79.7 Å²	79.7	66%	0.664	40%	0.402	S	S	*	.	H	α-helix	trans	-65	-36.7	-178.8	69.4	0	0	0	0	112.8	L1058 K1059 I1060	L1058-S1062 WeakPolarHBondContact O-CB 2.76Å; L1058-S1062 PolarHBondContact O-N 3.09Å; L1058-S1062 PolarHBondContact O-OG 2.65Å; K1059-S1062 PolarHBondContact O-N 3.03Å; K1059-S1062 PolarHBondContact O-OG 3.2Å; I1060-S1062 VanDerWaalsContact C-N 3.33Å; I1060-S1062 PolarHBondContact O-N 2.87Å
1063	K	85.6	Confident	84.1	Confident	95 Å²	95	75.8 Å²	75.8	41%	0.413	38%	0.381	S	S	.	.	H	α-helix	trans	-84.9	-32.5	-178.5	-167.2	75	173.5	-174.8	0	112.1	L1023 I1026 E1027 K1059 I1060 V1061	L1023-K1063 HydrophobicContact CD2-CB 4.33Å; L1023-K1063 HydrophobicContact CD2-CG 4.26Å; I1026-K1063 HydrophobicContact CB-CG 4.46Å; I1026-K1063 HydrophobicContact CG2-CB 4.34Å; I1026-K1063 HydrophobicContact CG2-CG 3.91Å; E1027-K1063 WeakPolarHBondContact OE2-CE 3.44Å; E1027-K1063 IonicContact OE2-NZ 2.82Å; E1027-K1063 PolarHBondContact OE2-NZ 3.13Å; K1059-K1063 PolarHBondContact O-N 3.33Å; K1059-K1063 VanDerWaalsContact O-N 3.08Å; I1060-K1063 PolarHBondContact O-N 3.26Å; V1061-K1063 VanDerWaalsContact C-N 3.33Å; V1061-K1063 PolarHBondContact O-N 3.31Å
1064	S	84.5	Confident	84.7	Confident	9 Å²	9	75.8 Å²	75.8	6%	0.063	38%	0.381	C	S	.	.	H	α-helix	trans	-81.9	-10.9	178.9	70	0	0	0	0	114.1	Q1030 I1060 V1061 G1066	Q1030-S1064 PolarHBondContact NE2-O 3.35Å; I1060-S1064 VanDerWaalsContact O-CB 3.32Å; I1060-S1064 WeakPolarHBondContact O-CB 3.29Å; I1060-S1064 PolarHBondContact O-N 2.98Å; I1060-S1064 PolarHBondContact O-OG 3.31Å; V1061-S1064 PolarHBondContact O-OG 3.27Å; S1064-G1066 VanDerWaalsContact C-N 3.27Å; S1064-G1066 PolarHBondContact O-N 2.96Å; S1064-G1066 PolarHBondContact OG-O 3.34Å
1065	G	79.3	Confident	85	Confident	73 Å²	73	69.9 Å²	69.9	75%	0.753	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.2	4.6	-179.1	0	0	0	0	0	115.1	V1061	V1061-G1065 PolarHBondContact O-N 3.45Å; V1061-G1065 VanDerWaalsContact O-N 3.15Å
1066	G	81.4	Confident	85.3	Confident	34 Å²	34	63.9 Å²	63.9	35%	0.351	34%	0.341	S	S	.	.			trans	152.8	175.6	179.3	0	0	0	0	0	114.7	V1061 S1064	V1061-G1066 PolarHBondContact O-N 3.02Å; S1064-G1066 VanDerWaalsContact C-N 3.27Å; S1064-G1066 PolarHBondContact O-N 2.96Å; S1064-G1066 PolarHBondContact OG-O 3.34Å
1067	I	80.8	Confident	85.5	Confident	40 Å²	40	64.6 Å²	64.6	21%	0.205	35%	0.345	C	S	.	.			trans	-128.1	131.4	173.4	-56.5	162.7	0	0	0	108.2	F1044 F1057 V1061 K1069 I1079	F1044-I1067 HydrophobicContact CD1-CD1 4.05Å; F1044-I1067 HydrophobicContact CD1-CG1 4.03Å; F1044-I1067 HydrophobicContact CD2-CB 4.49Å; F1044-I1067 HydrophobicContact CD2-CG1 4.1Å; F1044-I1067 HydrophobicContact CD2-CG2 3.87Å; F1044-I1067 HydrophobicContact CE1-CD1 3.91Å; F1044-I1067 HydrophobicContact CE1-CG1 3.64Å; F1044-I1067 HydrophobicContact CE2-CB 4.21Å; F1044-I1067 HydrophobicContact CE2-CG1 3.65Å; F1044-I1067 HydrophobicContact CE2-CG2 4.08Å; F1044-I1067 HydrophobicContact CG-CG1 4.26Å; F1044-I1067 HydrophobicContact CG-CG2 4.2Å; F1044-I1067 HydrophobicContact CZ-CB 4.46Å; F1044-I1067 HydrophobicContact CZ-CD1 4.24Å; F1044-I1067 HydrophobicContact CZ-CG1 3.44Å; F1044-I1067 VanDerWaalsContact CZ-CG1 3.44Å; F1057-I1067 HydrophobicContact CD1-CD1 4.46Å; F1057-I1067 HydrophobicContact CE1-CD1 3.44Å; F1057-I1067 VanDerWaalsContact CE1-CD1 3.44Å; F1057-I1067 HydrophobicContact CE2-CD1 4.1Å; F1057-I1067 HydrophobicContact CZ-CD1 3.22Å; V1061-I1067 HydrophobicContact CG2-CD1 3.23Å; V1061-I1067 HydrophobicContact CG2-CG1 3.56Å; I1067-K1069 PolarHBondContact O-N 3.23Å; I1067-I1079 HydrophobicContact CG2-CD1 3.64Å
1068	D	83.6	Confident	85.8	Confident	70 Å²	70	63.7 Å²	63.7	37%	0.374	34%	0.343	S	S	.	.			trans	-76.1	107.5	163.5	-171.9	-3.9	0	0	0	110.3	Q1070 I1071	D1068-Q1070 VanDerWaalsContact C-N 3.26Å; D1068-Q1070 PolarHBondContact O-N 3.42Å; D1068-Q1070 VanDerWaalsContact OD1-CB 3.29Å; D1068-Q1070 WeakPolarHBondContact OD1-CB 3.16Å; D1068-Q1070 PolarHBondContact OD1-N 3.5Å; D1068-I1071 HydrophobicContact CB-CD1 3.85Å; D1068-I1071 HydrophobicContact CB-CG1 3.99Å
1069	K	80.8	Confident	86	Confident	171 Å²	171	58.8 Å²	58.8	74%	0.743	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.5	-9.9	-179.7	-58.4	178.4	-174.7	176.9	0	112.7	I1067	I1067-K1069 PolarHBondContact O-N 3.23Å
1070	Q	85.5	Confident	86.3	Confident	170 Å²	170	61.1 Å²	61.1	79%	0.794	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.4	-20.3	-178.8	-56.7	-174	-0.1	0	0	112.1	D1068 K1072	D1068-Q1070 VanDerWaalsContact C-N 3.26Å; D1068-Q1070 PolarHBondContact O-N 3.42Å; D1068-Q1070 VanDerWaalsContact OD1-CB 3.29Å; D1068-Q1070 WeakPolarHBondContact OD1-CB 3.16Å; D1068-Q1070 PolarHBondContact OD1-N 3.5Å; Q1070-K1072 PolarHBondContact O-N 2.91Å
1071	I	88.7	Confident	86.5	Confident	25 Å²	25	64.7 Å²	64.7	13%	0.128	35%	0.346	C	S	.	.			trans	-65.8	130.9	177	-56.6	175.7	0	0	0	109.7	N1034 Q1036 T1042 D1068	N1034-I1071 HydrophobicContact CB-CD1 4.45Å; Q1036-I1071 VanDerWaalsContact NE2-CG2 3.31Å; T1042-I1071 HydrophobicContact CG2-CD1 4.2Å; T1042-I1071 HydrophobicContact CG2-CG2 3.73Å; D1068-I1071 HydrophobicContact CB-CD1 3.85Å; D1068-I1071 HydrophobicContact CB-CG1 3.99Å
1072	K	90.5	Very high	86.7	Confident	96 Å²	96	62.9 Å²	62.9	42%	0.417	34%	0.335	S	S	.	.	B	Isolated β-bridge	trans	-123.8	154.2	175.6	-60.5	178.6	-179.3	176.6	0	109.4	Q1070 N1076 I1077	Q1070-K1072 PolarHBondContact O-N 2.91Å; K1072-N1076 WeakPolarHBondContact CD-OD1 3.43Å; K1072-N1076 PolarHBondContact NZ-OD1 2.93Å; K1072-I1077 WeakPolarHBondContact CA-O 3.34Å
1073	D	90.6	Very high	86.8	Confident	8 Å²	8	58.7 Å²	58.7	4%	0.043	31%	0.307	C	S	.	.			trans	-70.4	176	169.2	76.7	-1.7	0	0	0	111.8	R1041 R1075 N1076 I1077 Y1082	R1041-D1073 HydrophobicContact CG-CB 3.9Å; D1073-R1075 PolarHBondContact O-N 3.24Å; D1073-R1075 VanDerWaalsContact OD1-C 3.26Å; D1073-R1075 VanDerWaalsContact OD1-CA 3.31Å; D1073-R1075 WeakPolarHBondContact OD1-CA 3.36Å; D1073-R1075 WeakPolarHBondContact OD1-CB 3.4Å; D1073-R1075 PolarHBondContact OD1-N 3.18Å; D1073-N1076 WeakPolarHBondContact O-CA 3.38Å; D1073-N1076 PolarHBondContact O-N 3.27Å; D1073-N1076 PolarHBondContact OD1-N 2.98Å; D1073-I1077 PolarHBondContact N-O 3.45Å; D1073-I1077 WeakPolarHBondContact OD1-CA 3.39Å; D1073-I1077 WeakPolarHBondContact OD1-CB 3.49Å; D1073-I1077 PolarHBondContact OD1-N 3.45Å; D1073-Y1082 HydrophobicContact CB-CE2 4.34Å; D1073-Y1082 VanDerWaalsContact OD2-CE2 3.23Å; D1073-Y1082 WeakPolarHBondContact OD2-CE2 3.25Å; D1073-Y1082 VanDerWaalsContact OD2-CZ 3.28Å; D1073-Y1082 PolarHBondContact OD2-OH 3.17Å
1074	L	89	Confident	87	Confident	36 Å²	36	58 Å²	58	19%	0.188	31%	0.305	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.7	-5.8	178.5	-64.6	179.8	0	0	0	114.2	Y763 R799 D800 C1038 L1039 N1076	Y763-L1074 WeakPolarHBondContact CE2-O 3.41Å; R799-L1074 HydrophobicContact CB-CD1 3.45Å; R799-L1074 VanDerWaalsContact CB-CD1 3.45Å; R799-L1074 HydrophobicContact CB-CD2 3.65Å; R799-L1074 HydrophobicContact CB-CG 4.14Å; R799-L1074 HydrophobicContact CG-CD1 3.98Å; R799-L1074 HydrophobicContact CG-CD2 4.39Å; D800-L1074 WeakPolarHBondContact O-CB 3.33Å; D800-L1074 WeakPolarHBondContact O-CD1 3.49Å; C1038-L1074 VanDerWaalsContact O-CD1 3.3Å; C1038-L1074 WeakPolarHBondContact O-CD1 3.48Å; L1039-L1074 VanDerWaalsContact C-CG 3.48Å; L1039-L1074 WeakPolarHBondContact O-CB 3.37Å; L1039-L1074 WeakPolarHBondContact O-CG 3.34Å; L1039-L1074 PolarHBondContact O-N 3.42Å; L1074-N1076 VanDerWaalsContact C-N 3.32Å
1075	R	85.4	Confident	87.3	Confident	74 Å²	74	59.2 Å²	59.2	28%	0.279	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.2	8.2	168.7	-67	-177.6	178.1	179	0.9	112.2	Y763 D1073 I1077 E1092	Y763-R1075 WeakPolarHBondContact OH-CA 3.47Å; Y763-R1075 PolarHBondContact OH-O 3.06Å; D1073-R1075 PolarHBondContact O-N 3.24Å; D1073-R1075 VanDerWaalsContact OD1-C 3.26Å; D1073-R1075 VanDerWaalsContact OD1-CA 3.31Å; D1073-R1075 WeakPolarHBondContact OD1-CA 3.36Å; D1073-R1075 WeakPolarHBondContact OD1-CB 3.4Å; D1073-R1075 PolarHBondContact OD1-N 3.18Å; R1075-I1077 VanDerWaalsContact C-N 3.29Å; R1075-I1077 HydrophobicContact CB-CD1 4.01Å; R1075-I1077 HydrophobicContact CB-CG1 4.08Å; R1075-I1077 PolarHBondContact O-N 2.95Å; R1075-E1092 IonicContact CZ-OE1 3.4Å; R1075-E1092 IonicContact NH1-OE1 3.69Å; R1075-E1092 PolarHBondContact NH1-OE1 3.32Å; R1075-E1092 IonicContact NH1-OE2 2.69Å; R1075-E1092 IonicContact NH2-OE1 3.98Å
1076	N	88.4	Confident	87.7	Confident	62 Å²	62	57.6 Å²	57.6	33%	0.332	28%	0.282	S	S	.	.	S	Bend	trans	63.6	31.5	-179	-165.7	23.8	0	0	0	113.2	Y763 K1072 D1073 L1074	Y763-N1076 HydrophobicContact CD1-CB 3.78Å; Y763-N1076 HydrophobicContact CD2-CB 3.79Å; Y763-N1076 HydrophobicContact CE1-CB 3.85Å; Y763-N1076 HydrophobicContact CE2-CB 3.88Å; Y763-N1076 HydrophobicContact CG-CB 3.73Å; K1072-N1076 WeakPolarHBondContact CD-OD1 3.43Å; K1072-N1076 PolarHBondContact NZ-OD1 2.93Å; D1073-N1076 WeakPolarHBondContact O-CA 3.38Å; D1073-N1076 PolarHBondContact O-N 3.27Å; D1073-N1076 PolarHBondContact OD1-N 2.98Å; L1074-N1076 VanDerWaalsContact C-N 3.32Å
1077	I	89.4	Confident	88	Confident	28 Å²	28	61.5 Å²	61.5	14%	0.144	30%	0.295	C	S	.	.			trans	-105.2	127.3	179.4	-53.6	177.6	0	0	0	109.1	K1072 D1073 R1075 Q1081 Y1082 L1085 Y1093	K1072-I1077 WeakPolarHBondContact CA-O 3.34Å; D1073-I1077 PolarHBondContact N-O 3.45Å; D1073-I1077 WeakPolarHBondContact OD1-CA 3.39Å; D1073-I1077 WeakPolarHBondContact OD1-CB 3.49Å; D1073-I1077 PolarHBondContact OD1-N 3.45Å; R1075-I1077 VanDerWaalsContact C-N 3.29Å; R1075-I1077 HydrophobicContact CB-CD1 4.01Å; R1075-I1077 HydrophobicContact CB-CG1 4.08Å; R1075-I1077 PolarHBondContact O-N 2.95Å; I1077-Q1081 HydrophobicContact CG2-CB 3.53Å; I1077-Y1082 HydrophobicContact CB-CD2 4.22Å; I1077-Y1082 HydrophobicContact CB-CE2 3.84Å; I1077-Y1082 HydrophobicContact CG2-CD2 3.52Å; I1077-Y1082 HydrophobicContact CG2-CE2 3.63Å; I1077-L1085 HydrophobicContact CD1-CD1 4.41Å; I1077-L1085 HydrophobicContact CG2-CD1 4.04Å; I1077-Y1093 WeakPolarHBondContact CD1-OH 3.41Å
1078	S	91.3	Very high	88.5	Confident	19 Å²	19	65.9 Å²	65.9	13%	0.133	31%	0.309	C	S	.	.	B	Isolated β-bridge	trans	-83.5	162.6	179.2	72.4	0	0	0	0	112.8	H1080 Q1081 Y1082	S1078-H1080 PolarHBondContact O-N 3.37Å; S1078-H1080 VanDerWaalsContact O-N 3.16Å; S1078-Q1081 WeakPolarHBondContact O-CB 3.49Å; S1078-Q1081 PolarHBondContact O-N 3.41Å; S1078-Q1081 PolarHBondContact OG-N 3.23Å; S1078-Y1082 WeakPolarHBondContact O-CD2 3.46Å; S1078-Y1082 PolarHBondContact O-N 3.05Å
1079	I	90	Very high	88.6	Confident	11 Å²	11	69.8 Å²	69.8	6%	0.056	32%	0.322	C	S	.	.	H	α-helix	trans	-51.2	-41.1	174.6	-58.8	166.6	0	0	0	111.6	F1044 H1045 I1048 F1057 I1067 Y1082 G1083	F1044-I1079 HydrophobicContact CB-CD1 3.82Å; F1044-I1079 HydrophobicContact CB-CG1 4.4Å; F1044-I1079 HydrophobicContact CB-CG2 4.29Å; H1045-I1079 WeakPolarHBondContact CE1-CG1 3.43Å; H1045-I1079 WeakPolarHBondContact NE2-CG1 3.45Å; I1048-I1079 HydrophobicContact CD1-CG2 4.29Å; I1048-I1079 WeakPolarHBondContact CD1-O 3.37Å; I1048-I1079 HydrophobicContact CG2-CG2 4.44Å; F1057-I1079 HydrophobicContact CE2-CG2 4.33Å; I1067-I1079 HydrophobicContact CG2-CD1 3.64Å; I1079-Y1082 WeakPolarHBondContact O-CB 3.5Å; I1079-Y1082 PolarHBondContact O-N 3.28Å; I1079-G1083 PolarHBondContact O-N 3.31Å
1080	H	89	Confident	88.9	Confident	126 Å²	126	64.4 Å²	64.4	58%	0.583	30%	0.301	S	S	*	.	H	α-helix	trans	-63	-43.8	178.3	179	-89.4	0	0	0	112.2	S1078 Y1082 G1083 E1084	S1078-H1080 PolarHBondContact O-N 3.37Å; S1078-H1080 VanDerWaalsContact O-N 3.16Å; H1080-Y1082 VanDerWaalsContact C-N 3.32Å; H1080-Y1082 PolarHBondContact O-N 2.99Å; H1080-G1083 PolarHBondContact O-N 2.98Å; H1080-G1083 VanDerWaalsContact O-N 3.14Å; H1080-E1084 IonicContact CE1-OE1 3.51Å; H1080-E1084 PolarHBondContact CE1-OE1 3.27Å; H1080-E1084 IonicContact ND1-OE1 3.55Å; H1080-E1084 PolarHBondContact O-N 3.24Å
1081	Q	90.7	Very high	88.9	Confident	78 Å²	78	60.6 Å²	60.6	36%	0.364	29%	0.291	S	S	.	.	H	α-helix	trans	-66.1	-35.3	178.4	-70.4	170.8	-37.2	0	0	111.4	I1077 S1078 G1083 E1084 L1085	I1077-Q1081 HydrophobicContact CG2-CB 3.53Å; S1078-Q1081 WeakPolarHBondContact O-CB 3.49Å; S1078-Q1081 PolarHBondContact O-N 3.41Å; S1078-Q1081 PolarHBondContact OG-N 3.23Å; Q1081-G1083 VanDerWaalsContact C-N 3.26Å; Q1081-G1083 PolarHBondContact O-N 2.82Å; Q1081-E1084 PolarHBondContact O-N 3.11Å; Q1081-E1084 VanDerWaalsContact O-N 3.17Å; Q1081-L1085 WeakPolarHBondContact O-CB 3.37Å; Q1081-L1085 WeakPolarHBondContact O-CG 3.22Å; Q1081-L1085 PolarHBondContact O-N 2.84Å
1082	Y	90.2	Very high	88.7	Confident	0 Å²	0	62.3 Å²	62.3	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-55.2	-43.5	170.7	-91.5	-110.8	0	0	0	111.8	R1041 H1045 D1073 I1077 S1078 I1079 H1080 L1085 Y1086 Y1093 L1096	R1041-Y1082 PolarHBondContact NE-OH 3.27Å; H1045-Y1082 HydrophobicContact CB-CD1 4.35Å; H1045-Y1082 HydrophobicContact CB-CE1 4.37Å; H1045-Y1082 AromaticContact CD2-CD2 3.59Å; H1045-Y1082 AromaticContact CD2-CE2 3.61Å; D1073-Y1082 HydrophobicContact CB-CE2 4.34Å; D1073-Y1082 VanDerWaalsContact OD2-CE2 3.23Å; D1073-Y1082 WeakPolarHBondContact OD2-CE2 3.25Å; D1073-Y1082 VanDerWaalsContact OD2-CZ 3.28Å; D1073-Y1082 PolarHBondContact OD2-OH 3.17Å; I1077-Y1082 HydrophobicContact CB-CD2 4.22Å; I1077-Y1082 HydrophobicContact CB-CE2 3.84Å; I1077-Y1082 HydrophobicContact CG2-CD2 3.52Å; I1077-Y1082 HydrophobicContact CG2-CE2 3.63Å; S1078-Y1082 WeakPolarHBondContact O-CD2 3.46Å; S1078-Y1082 PolarHBondContact O-N 3.05Å; I1079-Y1082 WeakPolarHBondContact O-CB 3.5Å; I1079-Y1082 PolarHBondContact O-N 3.28Å; H1080-Y1082 VanDerWaalsContact C-N 3.32Å; H1080-Y1082 PolarHBondContact O-N 2.99Å; Y1082-L1085 PolarHBondContact O-N 3.49Å; Y1082-Y1086 VanDerWaalsContact O-CB 3.27Å; Y1082-Y1086 WeakPolarHBondContact O-CB 3.48Å; Y1082-Y1086 PolarHBondContact O-N 3.21Å; Y1082-Y1093 AromaticContact CD1-CD1 3.64Å; Y1082-Y1093 HydrophobicContact CD1-CD1 3.64Å; Y1082-Y1093 AromaticContact CD1-CE1 3.68Å; Y1082-Y1093 HydrophobicContact CD1-CE1 3.68Å; Y1082-Y1093 HydrophobicContact CD2-CE1 4.21Å; Y1082-Y1093 AromaticContact CE1-CD1 3.86Å; Y1082-Y1093 HydrophobicContact CE1-CD1 3.86Å; Y1082-Y1093 AromaticContact CE1-CE1 3.56Å; Y1082-Y1093 HydrophobicContact CE1-CE1 3.56Å; Y1082-Y1093 HydrophobicContact CE2-CE1 4.12Å; Y1082-Y1093 HydrophobicContact CG-CD1 4.14Å; Y1082-Y1093 AromaticContact CG-CE1 3.99Å; Y1082-Y1093 HydrophobicContact CG-CE1 3.99Å; Y1082-Y1093 AromaticContact CZ-CE1 3.79Å; Y1082-L1096 HydrophobicContact CD1-CD2 4.09Å; Y1082-L1096 HydrophobicContact CE1-CD2 3.78Å
1083	G	88.3	Confident	88.5	Confident	7 Å²	7	58.3 Å²	58.3	7%	0.072	28%	0.281	C	S	.	.	H	α-helix	trans	-61.5	-47.2	174.1	0	0	0	0	0	112.8	I1079 H1080 Q1081 L1085 Y1086 D1087	I1079-G1083 PolarHBondContact O-N 3.31Å; H1080-G1083 PolarHBondContact O-N 2.98Å; H1080-G1083 VanDerWaalsContact O-N 3.14Å; Q1081-G1083 VanDerWaalsContact C-N 3.26Å; Q1081-G1083 PolarHBondContact O-N 2.82Å; G1083-L1085 PolarHBondContact O-N 3.11Å; G1083-Y1086 WeakPolarHBondContact O-CB 2.89Å; G1083-Y1086 PolarHBondContact O-N 3.21Å; G1083-D1087 WeakPolarHBondContact O-CB 3.31Å; G1083-D1087 VanDerWaalsContact O-CG 3.28Å; G1083-D1087 PolarHBondContact O-N 3.46Å
1084	E	89.7	Confident	88.2	Confident	80 Å²	80	61.4 Å²	61.4	37%	0.374	30%	0.295	S	S	.	.	H	α-helix	trans	-61.7	-41.9	177	-67.5	-172.8	157.5	0	0	112.8	H1080 Q1081 D1087 R1088	H1080-E1084 IonicContact CE1-OE1 3.51Å; H1080-E1084 PolarHBondContact CE1-OE1 3.27Å; H1080-E1084 IonicContact ND1-OE1 3.55Å; H1080-E1084 PolarHBondContact O-N 3.24Å; Q1081-E1084 PolarHBondContact O-N 3.11Å; Q1081-E1084 VanDerWaalsContact O-N 3.17Å; E1084-D1087 PolarHBondContact O-N 3.01Å; E1084-R1088 WeakPolarHBondContact O-CB 3.41Å; E1084-R1088 VanDerWaalsContact O-CG 3.26Å; E1084-R1088 WeakPolarHBondContact O-CG 3.44Å; E1084-R1088 PolarHBondContact O-N 3.39Å
1085	L	90.8	Very high	88.1	Confident	36 Å²	36	63.5 Å²	63.5	19%	0.188	31%	0.307	C	S	.	.	H	α-helix	trans	-69.1	-36.5	179.9	-63.3	167.5	0	0	0	111	I1077 Q1081 Y1082 G1083 K1089 I1090 Y1093	I1077-L1085 HydrophobicContact CD1-CD1 4.41Å; I1077-L1085 HydrophobicContact CG2-CD1 4.04Å; Q1081-L1085 WeakPolarHBondContact O-CB 3.37Å; Q1081-L1085 WeakPolarHBondContact O-CG 3.22Å; Q1081-L1085 PolarHBondContact O-N 2.84Å; Y1082-L1085 PolarHBondContact O-N 3.49Å; G1083-L1085 PolarHBondContact O-N 3.11Å; L1085-K1089 PolarHBondContact O-N 2.84Å; L1085-I1090 HydrophobicContact CB-CD1 4.06Å; L1085-I1090 HydrophobicContact CD2-CD1 3.33Å; L1085-I1090 HydrophobicContact CG-CD1 4.26Å; L1085-I1090 WeakPolarHBondContact O-CB 3.48Å; L1085-I1090 PolarHBondContact O-N 2.92Å; L1085-I1090 VanDerWaalsContact O-N 3.12Å; L1085-Y1093 HydrophobicContact CB-CD1 4.17Å; L1085-Y1093 HydrophobicContact CB-CD2 3.68Å; L1085-Y1093 HydrophobicContact CB-CE1 4.47Å; L1085-Y1093 HydrophobicContact CB-CE2 4.04Å; L1085-Y1093 HydrophobicContact CB-CG 3.77Å; L1085-Y1093 HydrophobicContact CD1-CD1 4.33Å; L1085-Y1093 HydrophobicContact CD1-CD2 4.15Å; L1085-Y1093 HydrophobicContact CD1-CE1 3.79Å; L1085-Y1093 HydrophobicContact CD1-CE2 3.62Å; L1085-Y1093 HydrophobicContact CD1-CG 4.49Å; L1085-Y1093 VanDerWaalsContact CD1-CZ 3.42Å; L1085-Y1093 HydrophobicContact CG-CD2 4.45Å; L1085-Y1093 HydrophobicContact CG-CE2 4.33Å
1086	Y	88	Confident	88.2	Confident	38 Å²	38	60.2 Å²	60.2	15%	0.149	30%	0.295	C	S	.	.	H	α-helix	trans	-63.9	-47	171.2	-176.1	-89.6	0	0	0	111.7	C1049 Y1082 G1083 R1088 K1089 Y1093 Q1094	C1049-Y1086 HydrophobicContact CB-CD2 3.89Å; C1049-Y1086 HydrophobicContact CB-CE2 4.28Å; C1049-Y1086 WeakPolarHBondContact O-CE2 3.32Å; Y1082-Y1086 VanDerWaalsContact O-CB 3.27Å; Y1082-Y1086 WeakPolarHBondContact O-CB 3.48Å; Y1082-Y1086 PolarHBondContact O-N 3.21Å; G1083-Y1086 WeakPolarHBondContact O-CB 2.89Å; G1083-Y1086 PolarHBondContact O-N 3.21Å; Y1086-R1088 VanDerWaalsContact C-N 3.35Å; Y1086-R1088 PolarHBondContact O-N 3.42Å; Y1086-K1089 WeakPolarHBondContact O-CA 3.44Å; Y1086-K1089 PolarHBondContact O-N 3.15Å; Y1086-Y1093 WeakPolarHBondContact CD2-O 3.26Å; Y1086-Q1094 HydrophobicContact CD2-CG 4.38Å; Y1086-Q1094 HydrophobicContact CE2-CG 4.47Å
1087	D	88.4	Confident	88.1	Confident	117 Å²	117	57.7 Å²	57.7	63%	0.626	28%	0.281	S	S	*	.	H	α-helix	trans	-66.4	-34.6	179.5	-73.8	-16.1	0	0	0	112.4	G1083 E1084 K1089	G1083-D1087 WeakPolarHBondContact O-CB 3.31Å; G1083-D1087 VanDerWaalsContact O-CG 3.28Å; G1083-D1087 PolarHBondContact O-N 3.46Å; E1084-D1087 PolarHBondContact O-N 3.01Å; D1087-K1089 PolarHBondContact O-N 3.35Å
1088	R	89.8	Confident	87.8	Confident	131 Å²	131	62.3 Å²	62.3	49%	0.494	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.8	-0.3	171.3	-73.8	-177.8	-167.4	-166.5	10.5	113.9	E1084 Y1086 I1090	E1084-R1088 WeakPolarHBondContact O-CB 3.41Å; E1084-R1088 VanDerWaalsContact O-CG 3.26Å; E1084-R1088 WeakPolarHBondContact O-CG 3.44Å; E1084-R1088 PolarHBondContact O-N 3.39Å; Y1086-R1088 VanDerWaalsContact C-N 3.35Å; Y1086-R1088 PolarHBondContact O-N 3.42Å; R1088-I1090 VanDerWaalsContact C-N 3.33Å; R1088-I1090 HydrophobicContact CB-CG1 4.35Å; R1088-I1090 PolarHBondContact O-N 3.5Å
1089	K	86.4	Confident	87.5	Confident	152 Å²	152	63.7 Å²	63.7	66%	0.661	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.9	36.3	179.5	-47.3	-171.6	177	178.7	0	114.2	L1085 Y1086 D1087 P1091 Q1094	L1085-K1089 PolarHBondContact O-N 2.84Å; Y1086-K1089 WeakPolarHBondContact O-CA 3.44Å; Y1086-K1089 PolarHBondContact O-N 3.15Å; D1087-K1089 PolarHBondContact O-N 3.35Å; K1089-P1091 WeakPolarHBondContact O-CD 3.48Å; K1089-Q1094 VanDerWaalsContact CA-CD 3.47Å
1090	I	87	Confident	87.1	Confident	58 Å²	58	63.6 Å²	63.6	30%	0.297	31%	0.307	S	S	.	.			trans	-68.9	122.5	173.5	-63.7	178.3	0	0	0	108.4	L1085 R1088 E1092 Y1093 Q1094	L1085-I1090 HydrophobicContact CB-CD1 4.06Å; L1085-I1090 HydrophobicContact CD2-CD1 3.33Å; L1085-I1090 HydrophobicContact CG-CD1 4.26Å; L1085-I1090 WeakPolarHBondContact O-CB 3.48Å; L1085-I1090 PolarHBondContact O-N 2.92Å; L1085-I1090 VanDerWaalsContact O-N 3.12Å; R1088-I1090 VanDerWaalsContact C-N 3.33Å; R1088-I1090 HydrophobicContact CB-CG1 4.35Å; R1088-I1090 PolarHBondContact O-N 3.5Å; I1090-E1092 HydrophobicContact CG2-CB 4.35Å; I1090-E1092 PolarHBondContact O-N 3.22Å; I1090-E1092 VanDerWaalsContact O-N 3.12Å; I1090-Y1093 HydrophobicContact CB-CD2 4.11Å; I1090-Y1093 HydrophobicContact CG2-CD2 3.85Å; I1090-Y1093 HydrophobicContact CG2-CE2 4.37Å; I1090-Y1093 PolarHBondContact O-N 3.16Å; I1090-Q1094 PolarHBondContact O-N 3.02Å
1091	P	85.4	Confident	86.8	Confident	90 Å²	90	60.9 Å²	60.9	58%	0.584	29%	0.293	S	S	*	.	H	α-helix	trans	-55.2	-36.4	-171.1	-28.9	34.8	0	0	0	114.4	K1089 Y1093 N1095	K1089-P1091 WeakPolarHBondContact O-CD 3.48Å; P1091-Y1093 PolarHBondContact O-N 3.45Å; P1091-N1095 VanDerWaalsContact O-CB 3.29Å; P1091-N1095 WeakPolarHBondContact O-CB 3.44Å; P1091-N1095 PolarHBondContact O-N 3.36Å; P1091-N1095 PolarHBondContact O-ND2 2.83Å
1092	E	83.9	Confident	85.9	Confident	62 Å²	62	61.2 Å²	61.2	29%	0.29	30%	0.304	S	S	.	.	H	α-helix	trans	-59.5	-43.2	178.4	-176.3	176.9	-166.6	0	0	112.5	R1075 I1090 L1096	R1075-E1092 IonicContact CZ-OE1 3.4Å; R1075-E1092 IonicContact NH1-OE1 3.69Å; R1075-E1092 PolarHBondContact NH1-OE1 3.32Å; R1075-E1092 IonicContact NH1-OE2 2.69Å; R1075-E1092 IonicContact NH2-OE1 3.98Å; I1090-E1092 HydrophobicContact CG2-CB 4.35Å; I1090-E1092 PolarHBondContact O-N 3.22Å; I1090-E1092 VanDerWaalsContact O-N 3.12Å; E1092-L1096 WeakPolarHBondContact O-CA 3.49Å; E1092-L1096 WeakPolarHBondContact O-CB 3.21Å; E1092-L1096 PolarHBondContact O-N 3.01Å; E1092-L1096 VanDerWaalsContact O-N 3.09Å
1093	Y	86.4	Confident	84.8	Confident	11 Å²	11	63.2 Å²	63.2	4%	0.043	31%	0.314	C	S	.	.	H	α-helix	trans	-84	-33.5	-177	-66.8	-90	0	0	0	112	I1077 Y1082 L1085 Y1086 I1090 P1091 L1096	I1077-Y1093 WeakPolarHBondContact CD1-OH 3.41Å; Y1082-Y1093 AromaticContact CD1-CD1 3.64Å; Y1082-Y1093 HydrophobicContact CD1-CD1 3.64Å; Y1082-Y1093 AromaticContact CD1-CE1 3.68Å; Y1082-Y1093 HydrophobicContact CD1-CE1 3.68Å; Y1082-Y1093 HydrophobicContact CD2-CE1 4.21Å; Y1082-Y1093 AromaticContact CE1-CD1 3.86Å; Y1082-Y1093 HydrophobicContact CE1-CD1 3.86Å; Y1082-Y1093 AromaticContact CE1-CE1 3.56Å; Y1082-Y1093 HydrophobicContact CE1-CE1 3.56Å; Y1082-Y1093 HydrophobicContact CE2-CE1 4.12Å; Y1082-Y1093 HydrophobicContact CG-CD1 4.14Å; Y1082-Y1093 AromaticContact CG-CE1 3.99Å; Y1082-Y1093 HydrophobicContact CG-CE1 3.99Å; Y1082-Y1093 AromaticContact CZ-CE1 3.79Å; L1085-Y1093 HydrophobicContact CB-CD1 4.17Å; L1085-Y1093 HydrophobicContact CB-CD2 3.68Å; L1085-Y1093 HydrophobicContact CB-CE1 4.47Å; L1085-Y1093 HydrophobicContact CB-CE2 4.04Å; L1085-Y1093 HydrophobicContact CB-CG 3.77Å; L1085-Y1093 HydrophobicContact CD1-CD1 4.33Å; L1085-Y1093 HydrophobicContact CD1-CD2 4.15Å; L1085-Y1093 HydrophobicContact CD1-CE1 3.79Å; L1085-Y1093 HydrophobicContact CD1-CE2 3.62Å; L1085-Y1093 HydrophobicContact CD1-CG 4.49Å; L1085-Y1093 VanDerWaalsContact CD1-CZ 3.42Å; L1085-Y1093 HydrophobicContact CG-CD2 4.45Å; L1085-Y1093 HydrophobicContact CG-CE2 4.33Å; Y1086-Y1093 WeakPolarHBondContact CD2-O 3.26Å; I1090-Y1093 HydrophobicContact CB-CD2 4.11Å; I1090-Y1093 HydrophobicContact CG2-CD2 3.85Å; I1090-Y1093 HydrophobicContact CG2-CE2 4.37Å; I1090-Y1093 PolarHBondContact O-N 3.16Å; P1091-Y1093 PolarHBondContact O-N 3.45Å; Y1093-L1096 WeakPolarHBondContact O-CB 3.24Å; Y1093-L1096 PolarHBondContact O-N 3.15Å
1094	Q	85.3	Confident	83.2	Confident	73 Å²	73	70.8 Å²	70.8	34%	0.341	35%	0.345	S	S	.	.	H	α-helix	trans	-66.3	-40.4	174.1	-70.2	-158.5	-39	0	0	112.5	Y1086 K1089 I1090	Y1086-Q1094 HydrophobicContact CD2-CG 4.38Å; Y1086-Q1094 HydrophobicContact CE2-CG 4.47Å; K1089-Q1094 VanDerWaalsContact CA-CD 3.47Å; I1090-Q1094 PolarHBondContact O-N 3.02Å
1095	N	86	Confident	81.2	Confident	80 Å²	80	71.2 Å²	71.2	43%	0.428	35%	0.35	S	S	.	.	S	Bend	trans	-90.5	0.3	179.4	-64.6	-34.8	0	0	0	112.9	P1091 I1097 H1098 I1099	P1091-N1095 VanDerWaalsContact O-CB 3.29Å; P1091-N1095 WeakPolarHBondContact O-CB 3.44Å; P1091-N1095 PolarHBondContact O-N 3.36Å; P1091-N1095 PolarHBondContact O-ND2 2.83Å; N1095-I1097 VanDerWaalsContact C-N 3.29Å; N1095-I1097 PolarHBondContact O-N 3.23Å; N1095-I1097 VanDerWaalsContact O-N 3.16Å; N1095-H1098 CarbonylContact O-C 3.59Å; N1095-H1098 WeakPolarHBondContact O-CA 3.32Å; N1095-H1098 WeakPolarHBondContact O-CB 3.49Å; N1095-H1098 PolarHBondContact O-N 3.49Å; N1095-I1099 HydrophobicContact CB-CD1 3.92Å; N1095-I1099 HydrophobicContact CB-CG1 4.2Å; N1095-I1099 WeakPolarHBondContact O-CG1 3.49Å; N1095-I1099 PolarHBondContact O-N 2.9Å
1096	L	87.4	Confident	78.8	Confident	5 Å²	5	74.3 Å²	74.3	3%	0.026	37%	0.366	C	S	.	.	H	α-helix	trans	-48.7	-49.4	-173.6	-178.8	64	0	0	0	112.4	Y1046 C1049 Y1082 E1092 Y1093 H1098 I1099 E1100	Y1046-L1096 HydrophobicContact CD1-CD2 4.11Å; Y1046-L1096 HydrophobicContact CD1-CG 4.36Å; Y1046-L1096 HydrophobicContact CE1-CD1 4.5Å; Y1046-L1096 HydrophobicContact CE1-CD2 4.16Å; Y1046-L1096 HydrophobicContact CE1-CG 4.22Å; C1049-L1096 HydrophobicContact CB-CD2 4.27Å; Y1082-L1096 HydrophobicContact CD1-CD2 4.09Å; Y1082-L1096 HydrophobicContact CE1-CD2 3.78Å; E1092-L1096 WeakPolarHBondContact O-CA 3.49Å; E1092-L1096 WeakPolarHBondContact O-CB 3.21Å; E1092-L1096 PolarHBondContact O-N 3.01Å; E1092-L1096 VanDerWaalsContact O-N 3.09Å; Y1093-L1096 WeakPolarHBondContact O-CB 3.24Å; Y1093-L1096 PolarHBondContact O-N 3.15Å; L1096-H1098 PolarHBondContact O-N 2.86Å; L1096-I1099 PolarHBondContact O-N 3.43Å; L1096-E1100 HydrophobicContact CD1-CG 4.23Å; L1096-E1100 WeakPolarHBondContact O-CB 3.27Å; L1096-E1100 VanDerWaalsContact O-CG 3.24Å; L1096-E1100 WeakPolarHBondContact O-CG 3.32Å; L1096-E1100 PolarHBondContact O-N 3.49Å
1097	I	86.2	Confident	76.5	Confident	9 Å²	9	80 Å²	80	5%	0.046	39%	0.394	C	S	.	.	H	α-helix	trans	-69.3	-36.1	-177.4	-60	-176.8	0	0	0	111.7	L1015 C1049 L1050 N1095 K1101	L1015-I1097 HydrophobicContact CD2-CG2 4.29Å; C1049-I1097 HydrophobicContact CB-CD1 4.41Å; C1049-I1097 VanDerWaalsContact O-CD1 3.29Å; C1049-I1097 WeakPolarHBondContact O-CD1 3.29Å; L1050-I1097 HydrophobicContact CB-CD1 4.09Å; L1050-I1097 HydrophobicContact CD2-CD1 3.28Å; L1050-I1097 HydrophobicContact CG-CD1 3.46Å; L1050-I1097 VanDerWaalsContact CG-CD1 3.46Å; N1095-I1097 VanDerWaalsContact C-N 3.29Å; N1095-I1097 PolarHBondContact O-N 3.23Å; N1095-I1097 VanDerWaalsContact O-N 3.16Å; I1097-K1101 HydrophobicContact CG2-CD 4.27Å; I1097-K1101 WeakPolarHBondContact O-CB 3.38Å; I1097-K1101 VanDerWaalsContact O-CG 3.28Å; I1097-K1101 WeakPolarHBondContact O-CG 3.07Å; I1097-K1101 PolarHBondContact O-N 3.18Å
1098	H	84.5	Confident	73.9	Confident	126 Å²	126	78.5 Å²	78.5	58%	0.583	39%	0.392	S	S	*	.	H	α-helix	trans	-68.2	-43.1	175.8	-72.3	-69.8	0	0	0	111.2	N1095 L1096 K1101 S1102	N1095-H1098 CarbonylContact O-C 3.59Å; N1095-H1098 WeakPolarHBondContact O-CA 3.32Å; N1095-H1098 WeakPolarHBondContact O-CB 3.49Å; N1095-H1098 PolarHBondContact O-N 3.49Å; L1096-H1098 PolarHBondContact O-N 2.86Å; H1098-K1101 PolarHBondContact O-N 3.41Å; H1098-S1102 VanDerWaalsContact O-CB 3.27Å; H1098-S1102 WeakPolarHBondContact O-CB 3.18Å; H1098-S1102 PolarHBondContact O-N 3.07Å; H1098-S1102 PolarHBondContact O-OG 2.94Å
1099	I	83.4	Confident	71.2	Confident	48 Å²	48	77.6 Å²	77.6	25%	0.246	40%	0.397	C	S	.	.	H	α-helix	trans	-58.6	-54.7	174.7	-66.9	165.6	0	0	0	109	N1095 L1096 K1101 S1102 I1103 F1162	N1095-I1099 HydrophobicContact CB-CD1 3.92Å; N1095-I1099 HydrophobicContact CB-CG1 4.2Å; N1095-I1099 WeakPolarHBondContact O-CG1 3.49Å; N1095-I1099 PolarHBondContact O-N 2.9Å; L1096-I1099 PolarHBondContact O-N 3.43Å; I1099-K1101 VanDerWaalsContact C-N 3.26Å; I1099-K1101 PolarHBondContact O-N 3.39Å; I1099-S1102 WeakPolarHBondContact CA-OG 3.36Å; I1099-S1102 PolarHBondContact O-N 3.15Å; I1099-S1102 PolarHBondContact O-OG 3.21Å; I1099-I1103 HydrophobicContact CG2-CD1 4.45Å; I1099-I1103 WeakPolarHBondContact O-CG1 3.08Å; I1099-I1103 PolarHBondContact O-N 3.46Å; I1099-F1162 HydrophobicContact CG2-CE1 3.86Å; I1099-F1162 HydrophobicContact CG2-CZ 4.01Å
1100	E	83.6	Confident	68.8	Low	9 Å²	9	73.7 Å²	73.7	4%	0.042	38%	0.378	C	S	.	.	H	α-helix	trans	-62.4	-28.1	-177.5	-71.2	-63.8	152.9	0	0	114.5	R1005 R1007 L1015 R1041 Y1046 L1096	R1005-E1100 IonicContact CZ-OE1 2.82Å; R1005-E1100 IonicContact CZ-OE2 2.69Å; R1005-E1100 IonicContact NE-OE2 2.77Å; R1005-E1100 IonicContact NH1-OE1 3.09Å; R1005-E1100 PolarHBondContact NH1-OE1 3.31Å; R1005-E1100 IonicContact NH1-OE2 3.65Å; R1005-E1100 PolarHBondContact NH1-OE2 2.68Å; R1007-E1100 PolarHBondContact NH1-O 3.05Å; R1007-E1100 IonicContact NH1-OE2 3.13Å; R1007-E1100 PolarHBondContact NH1-OE2 3.01Å; L1015-E1100 HydrophobicContact CD2-CB 3.97Å; R1041-E1100 IonicContact NH1-OE1 3.66Å; R1041-E1100 PolarHBondContact NH1-OE1 2.78Å; R1041-E1100 VanDerWaalsContact NH1-OE1 3.13Å; Y1046-E1100 HydrophobicContact CE1-CG 3.78Å; L1096-E1100 HydrophobicContact CD1-CG 4.23Å; L1096-E1100 WeakPolarHBondContact O-CB 3.27Å; L1096-E1100 VanDerWaalsContact O-CG 3.24Å; L1096-E1100 WeakPolarHBondContact O-CG 3.32Å; L1096-E1100 PolarHBondContact O-N 3.49Å
1101	K	81.3	Confident	66.1	Low	69 Å²	69	74.7 Å²	74.7	30%	0.3	39%	0.388	S	S	.	.	H	α-helix	trans	-78.9	-34.8	171.2	-77.4	178.4	178.2	176.1	0	113.6	L1015 Y1016 I1097 H1098 I1099 I1103	L1015-K1101 VanDerWaalsContact C-CE 3.43Å; L1015-K1101 WeakPolarHBondContact O-CE 3.3Å; L1015-K1101 PolarHBondContact O-NZ 3.24Å; Y1016-K1101 HydrophobicContact CE1-CG 4.45Å; I1097-K1101 HydrophobicContact CG2-CD 4.27Å; I1097-K1101 WeakPolarHBondContact O-CB 3.38Å; I1097-K1101 VanDerWaalsContact O-CG 3.28Å; I1097-K1101 WeakPolarHBondContact O-CG 3.07Å; I1097-K1101 PolarHBondContact O-N 3.18Å; H1098-K1101 PolarHBondContact O-N 3.41Å; I1099-K1101 VanDerWaalsContact C-N 3.26Å; I1099-K1101 PolarHBondContact O-N 3.39Å; K1101-I1103 PolarHBondContact O-N 2.98Å
1102	S	71.8	Confident	63.2	Low	85 Å²	85	76.6 Å²	76.6	59%	0.594	39%	0.394	S	S	*	.	H	α-helix	trans	-70.4	-22.6	-176.4	70.1	0	0	0	0	112.9	H1098 I1099 K1104	H1098-S1102 VanDerWaalsContact O-CB 3.27Å; H1098-S1102 WeakPolarHBondContact O-CB 3.18Å; H1098-S1102 PolarHBondContact O-N 3.07Å; H1098-S1102 PolarHBondContact O-OG 2.94Å; I1099-S1102 WeakPolarHBondContact CA-OG 3.36Å; I1099-S1102 PolarHBondContact O-N 3.15Å; I1099-S1102 PolarHBondContact O-OG 3.21Å; S1102-K1104 VanDerWaalsContact C-N 3.33Å; S1102-K1104 PolarHBondContact O-N 3.23Å
1103	I	66.4	Low	60.6	Low	41 Å²	41	81.8 Å²	81.8	21%	0.21	42%	0.418	C	S	.	.	S	Bend	trans	-67.5	93.4	172.5	-63.3	171	0	0	0	107.7	W1004 I1099 K1101	W1004-I1103 HydrophobicContact CH2-CG2 3.2Å; W1004-I1103 HydrophobicContact CZ2-CG2 3.36Å; W1004-I1103 HydrophobicContact CZ3-CG2 4.5Å; I1099-I1103 HydrophobicContact CG2-CD1 4.45Å; I1099-I1103 WeakPolarHBondContact O-CG1 3.08Å; I1099-I1103 PolarHBondContact O-N 3.46Å; K1101-I1103 PolarHBondContact O-N 2.98Å
1104	K	54.9	Low	57.8	Low	167 Å²	167	86.2 Å²	86.2	73%	0.726	45%	0.446	S	S	*	.			trans	-60.5	136	176.9	-74.2	-177.2	177	-179.3	0	109	S1102 L1106	S1102-K1104 VanDerWaalsContact C-N 3.33Å; S1102-K1104 PolarHBondContact O-N 3.23Å; K1104-L1106 VanDerWaalsContact C-N 3.27Å; K1104-L1106 HydrophobicContact CB-CD1 4.45Å; K1104-L1106 PolarHBondContact O-N 3.45Å
1105	L	47.6	Very low	55	Low	89 Å²	89	89.6 Å²	89.6	47%	0.466	47%	0.465	S	S	.	.			trans	-54.7	95.7	158	-78.8	143.3	0	0	0	107	I982 W1004 E1107	I982-L1105 HydrophobicContact CD1-CD1 3.47Å; I982-L1105 VanDerWaalsContact CD1-CD1 3.47Å; W1004-L1105 VanDerWaalsContact NE1-CD2 3.32Å; L1105-E1107 PolarHBondContact O-N 3.35Å; L1105-E1107 VanDerWaalsContact O-N 3.14Å
1106	L	42.2	Very low	52.1	Low	100 Å²	100	90.1 Å²	90.1	52%	0.524	47%	0.474	S	S	.	.			trans	-71.5	107.5	169.9	-104.6	87.2	0	0	0	106.6	K1104 S1108	K1104-L1106 VanDerWaalsContact C-N 3.27Å; K1104-L1106 HydrophobicContact CB-CD1 4.45Å; K1104-L1106 PolarHBondContact O-N 3.45Å; L1106-S1108 WeakPolarHBondContact CD2-OG 3.46Å; L1106-S1108 PolarHBondContact O-N 3.4Å
1107	E	39.1	Very low	49.2	Very low	159 Å²	159	94.7 Å²	94.7	74%	0.743	51%	0.507	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.3	-2.2	172.5	-69.4	174.8	157.3	0	0	112.9	L1105	L1105-E1107 PolarHBondContact O-N 3.35Å; L1105-E1107 VanDerWaalsContact O-N 3.14Å
1108	S	33.3	Very low	46.2	Very low	84 Å²	84	99 Å²	99	59%	0.587	54%	0.538	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.8	2.4	-157.4	21.9	0	0	0	0	117.5	L1106	L1106-S1108 WeakPolarHBondContact CD2-OG 3.46Å; L1106-S1108 PolarHBondContact O-N 3.4Å
1109	N	34.3	Very low	43.3	Very low	112 Å²	112	97.5 Å²	97.5	60%	0.599	54%	0.541	S	S	*	.			trans	-106.2	14.1	178.4	-80.3	-15.5	0	0	0	114.5	P1111	N1109-P1111 WeakPolarHBondContact O-CD 3.37Å
1110	W	35.7	Very low	40.5	Very low	71 Å²	71	102.9 Å²	102.9	27%	0.269	57%	0.569	S	S	.	*	S	Bend	trans	-78.1	119.5	165	-60.8	100.9	0	0	0	107.2	N933 R971 D1112	N933-W1110 HydrophobicContact CB-CE3 4.26Å; N933-W1110 HydrophobicContact CB-CZ3 4.33Å; N933-W1110 VanDerWaalsContact OD1-CE3 3.24Å; N933-W1110 WeakPolarHBondContact OD1-CZ3 3.42Å; R971-W1110 HydrophobicContact CG-CH2 4.24Å; R971-W1110 VanDerWaalsContact NH1-CE3 3.29Å; W1110-D1112 PolarHBondContact O-N 3.47Å
1111	P	29	Very low	37.7	Very low	78 Å²	78	111.9 Å²	111.9	51%	0.506	61%	0.609	S	S	.	*	P	Polyproline II helix	trans	-59.7	117.7	-178.8	23.1	-30.4	0	0	0	108.2	N1109 Q1113	N1109-P1111 WeakPolarHBondContact O-CD 3.37Å; P1111-Q1113 PolarHBondContact O-N 3.1Å
1112	D	24.9	Very low	35.1	Very low	131 Å²	131	115.3 Å²	115.3	70%	0.701	63%	0.629	S	S	*	*	P	Polyproline II helix	trans	-54.4	130.7	167.4	-77	-35	0	0	0	107.6	W1110 T1114	W1110-D1112 PolarHBondContact O-N 3.47Å; D1112-T1114 VanDerWaalsContact CB-OG1 3.3Å; D1112-T1114 WeakPolarHBondContact CB-OG1 3.36Å; D1112-T1114 PolarHBondContact O-N 2.99Å
1113	Q	29.4	Very low	32.8	Very low	170 Å²	170	116.5 Å²	116.5	79%	0.794	63%	0.634	S	S	*	*	G	3₁₀ helix	trans	-61.5	9.9	178.3	-72.8	177.8	-14.8	0	0	113.6	P1111	P1111-Q1113 PolarHBondContact O-N 3.1Å
1114	T	27.2	Very low	31.1	Very low	104 Å²	104	121.9 Å²	121.9	64%	0.638	66%	0.664	S	S	*	*	G	3₁₀ helix	trans	-88.5	-1.9	-172.9	44.7	0	0	0	0	114.7	D1112	D1112-T1114 VanDerWaalsContact CB-OG1 3.3Å; D1112-T1114 WeakPolarHBondContact CB-OG1 3.36Å; D1112-T1114 PolarHBondContact O-N 2.99Å
1115	I	26.6	Very low	29.8	Very low	144 Å²	144	120.9 Å²	120.9	74%	0.738	67%	0.666	S	S	*	*	G	3₁₀ helix	trans	-97.1	-8.1	176.8	-56.3	178.4	0	0	0	113
1116	C	24.7	Very low	28.9	Very low	91 Å²	91	123.4 Å²	123.4	62%	0.615	68%	0.68	S	S	*	*	S	Bend	trans	-102.4	9.5	-179.3	-80.8	0	0	0	0	116.1
1117	S	26.1	Very low	28.3	Very low	102 Å²	102	125.5 Å²	125.5	71%	0.713	69%	0.692	S	S	*	*	S	Bend	trans	-95.2	-0.4	173.2	41.7	0	0	0	0	114.7
1118	S	23.6	Very low	28	Very low	100 Å²	100	124 Å²	124	70%	0.699	69%	0.689	S	S	*	*			trans	-102.1	56.2	165.8	56	0	0	0	0	110.7	L1120	S1118-L1120 PolarHBondContact O-N 3.4Å
1119	S	25.1	Very low	27.8	Very low	93 Å²	93	127.7 Å²	127.7	65%	0.65	70%	0.697	S	S	*	*			trans	-71.8	111.8	163.5	-4.4	0	0	0	0	107.2	K1121	S1119-K1121 VanDerWaalsContact C-N 3.35Å; S1119-K1121 PolarHBondContact O-N 3.32Å
1120	L	23.9	Very low	27.6	Very low	161 Å²	161	129.7 Å²	129.7	84%	0.843	71%	0.707	S	S	*	*			trans	-46.7	102.1	160.4	-81.8	133.5	0	0	0	108.3	S1118 I1122	S1118-L1120 PolarHBondContact O-N 3.4Å; L1120-I1122 VanDerWaalsContact C-N 3.3Å; L1120-I1122 PolarHBondContact O-N 3.07Å
1121	K	24.6	Very low	27.1	Very low	199 Å²	199	130.7 Å²	130.7	87%	0.865	73%	0.725	S	S	*	*			trans	-66.1	97.6	159.7	-75.9	-176.8	177.4	-180	0	106.1	S1119 P1123	S1119-K1121 VanDerWaalsContact C-N 3.35Å; S1119-K1121 PolarHBondContact O-N 3.32Å; K1121-P1123 WeakPolarHBondContact O-CD 3.28Å
1122	I	26.6	Very low	27.2	Very low	140 Å²	140	133.5 Å²	133.5	72%	0.718	73%	0.734	S	S	*	*			trans	-79.2	112.4	159.2	-58.5	173.7	0	0	0	105	L1120	L1120-I1122 VanDerWaalsContact C-N 3.3Å; L1120-I1122 PolarHBondContact O-N 3.07Å
1123	P	24.7	Very low	27.6	Very low	110 Å²	110	135.3 Å²	135.3	71%	0.714	74%	0.736	S	S	*	*	P	Polyproline II helix	trans	-81.4	125.4	177.7	28.7	-21.5	0	0	0	108.7	K1121	K1121-P1123 WeakPolarHBondContact O-CD 3.28Å
1124	N	29.3	Very low	27.6	Very low	155 Å²	155	134.1 Å²	134.1	83%	0.829	74%	0.735	S	S	*	*	P	Polyproline II helix	trans	-88.6	124.4	162.5	-88.4	-7.1	0	0	0	108.5
1125	D	27.2	Very low	27.9	Very low	145 Å²	145	137.9 Å²	137.9	78%	0.775	74%	0.742	S	S	*	*	P	Polyproline II helix	trans	-46.9	133.1	168.4	-64.9	-48.3	0	0	0	112.1
1126	N	29.6	Very low	28.3	Very low	142 Å²	142	137.8 Å²	137.8	76%	0.759	74%	0.743	S	S	*	*				-177.4	131.9	116.8	-83	-22	0	0	0	110.2
1127	D	30.2	Very low	28.6	Very low	145 Å²	145	142.3 Å²	142.3	78%	0.775	76%	0.755	S	S	*	*			trans	83.6	117.7	152.9	-53.1	-28	0	0	0	120.5
1128	D	32.2	Very low	29	Very low	127 Å²	127	142.4 Å²	142.4	68%	0.679	75%	0.753	S	S	*	*			trans	88.8	91.7	145.5	-65.9	-34.7	0	0	0	121.5
1129	Q	29.8	Very low	29.2	Very low	161 Å²	161	144.6 Å²	144.6	75%	0.752	76%	0.757	S	S	*	*				71.5	139.2	119.5	-66.9	175.3	46.6	0	0	120.6
1130	L	29.9	Very low	29.4	Very low	155 Å²	155	147.2 Å²	147.2	81%	0.812	76%	0.764	S	S	*	*			trans	85.5	85.4	171.4	-67.4	117.7	0	0	0	115.6
1131	S	25.1	Very low	29.7	Very low	92 Å²	92	148.7 Å²	148.7	64%	0.643	77%	0.767	S	S	*	*				74.7	129.4	68.8	84	0	0	0	0	115
1132	I	31.5	Very low	29.9	Very low	136 Å²	136	148.3 Å²	148.3	70%	0.697	77%	0.768	S	S	*	*			trans	118	97.4	146.9	-61.6	167.4	0	0	0	116.7
1133	K	32.2	Very low	30.1	Very low	170 Å²	170	146 Å²	146	74%	0.739	76%	0.764	S	S	*	*				71.9	109.8	127.4	-61.2	-176.7	-169.8	178.9	0	118.5
1134	D	28.8	Very low	30.3	Very low	144 Å²	144	148.6 Å²	148.6	77%	0.77	77%	0.77	S	S	*	*				90.6	122.5	73.9	-72.5	-24.4	0	0	0	112.2
1135	K	34.6	Very low	30.3	Very low	183 Å²	183	148.6 Å²	148.6	80%	0.796	77%	0.769	S	S	*	*			trans	152.1	105.3	142.1	-83.7	175.7	177.5	-169.2	0	109.6
1136	D	34	Very low	30.4	Very low	142 Å²	142	149.7 Å²	149.7	76%	0.759	77%	0.769	S	S	*	*				69.4	118.4	93.8	-61.9	-24.2	0	0	0	109.6
1137	E	31.3	Very low	30.4	Very low	187 Å²	187	149.5 Å²	149.5	87%	0.874	77%	0.773	S	S	*	*			cis	-171.6	170.4	41.4	-114	174.3	172.1	0	0	109.7
1138	P	34	Very low	30.3	Very low	103 Å²	103	150.6 Å²	150.6	67%	0.669	78%	0.777	S	S	*	*			trans	-104.8	-171.2	-158.7	42	-36	0	0	0	115.9
1139	D	29	Very low	30.1	Very low	146 Å²	146	151.7 Å²	151.7	78%	0.781	78%	0.778	S	S	*	*			trans	85.6	88.4	162.2	-56.3	-18	0	0	0	118.6
1140	N	29.6	Very low	29.9	Very low	149 Å²	149	150.9 Å²	150.9	80%	0.797	78%	0.778	S	S	*	*			trans	-157.4	70.8	146.3	-112.9	-11.8	0	0	0	111	Q1142	N1140-Q1142 PolarHBondContact O-N 2.75Å
1141	E	29.2	Very low	29.8	Very low	191 Å²	191	149.3 Å²	149.3	89%	0.893	78%	0.776	S	S	*	*			trans	-76.2	87.9	160	-74.1	-173.6	158.7	0	0	108.6
1142	Q	29.6	Very low	29.8	Very low	191 Å²	191	150.8 Å²	150.8	89%	0.893	78%	0.781	S	S	*	*	S	Bend	trans	162.9	58.9	159	-91.4	160.4	22.6	0	0	111.2	N1140	N1140-Q1142 PolarHBondContact O-N 2.75Å
1143	S	30.2	Very low	29.5	Very low	91 Å²	91	150.4 Å²	150.4	64%	0.636	79%	0.785	S	S	*	*	S	Bend	trans	-167	46.9	168.4	65	0	0	0	0	115.8
1144	I	28.7	Very low	29.2	Very low	166 Å²	166	150.7 Å²	150.7	85%	0.851	79%	0.786	S	S	*	*	S	Bend	trans	-133.4	3.7	165.4	-60	-176.4	0	0	0	112.9
1145	I	30	Very low	29	Very low	155 Å²	155	151.3 Å²	151.3	80%	0.795	79%	0.789	S	S	*	*	S	Bend	trans	-88.6	-1.9	179.8	-68.6	176.5	0	0	0	113.7
1146	E	28.8	Very low	28.6	Very low	168 Å²	168	148.9 Å²	148.9	79%	0.785	79%	0.79	S	S	*	*	S	Bend	trans	-118.1	17.1	-167.9	-77.2	-171.3	150.7	0	0	118.1
1147	V	29.4	Very low	28.1	Very low	137 Å²	137	149.9 Å²	149.9	83%	0.83	79%	0.79	S	S	*	*	S	Bend	trans	-109.9	-0.4	178.2	-175.7	0	0	0	0	114.7
1148	I	29	Very low	27.8	Very low	168 Å²	168	148.1 Å²	148.1	86%	0.862	79%	0.787	S	S	*	*	S	Bend	trans	-110.1	-2.2	172.5	-61.5	177.2	0	0	0	112.3
1149	H	26.9	Very low	27.3	Very low	150 Å²	150	149.4 Å²	149.4	69%	0.694	80%	0.797	S	S	*	*	S	Bend	trans	-97.2	3.3	-172.8	-99.4	-62.3	0	0	0	117.6
1150	N	26	Very low	27.1	Very low	144 Å²	144	149.6 Å²	149.6	77%	0.77	80%	0.797	S	S	*	*	S	Bend	trans	-140.8	38.5	-173.9	-83.7	-34.3	0	0	0	117.2
1151	T	27.4	Very low	26.8	Very low	123 Å²	123	149.4 Å²	149.4	76%	0.755	79%	0.794	S	S	*	*	S	Bend	trans	-159.2	77.3	160.6	37.7	0	0	0	0	108.5
1152	T	25.2	Very low	26.7	Very low	122 Å²	122	146.6 Å²	146.6	75%	0.748	78%	0.78	S	S	*	*				-175.1	80.9	84.8	25.1	0	0	0	0	108.4	K1154	T1152-K1154 PolarHBondContact O-N 3.32Å
1153	T	25	Very low	26.5	Very low	128 Å²	128	142.7 Å²	142.7	79%	0.785	77%	0.771	S	S	*	*	S	Bend	trans	-66.4	81.6	148.9	46	0	0	0	0	107.7
1154	K	26.2	Very low	26.5	Very low	176 Å²	176	144 Å²	144	77%	0.765	77%	0.769	S	S	*	*	S	Bend	trans	169.3	102.9	164.7	-96.5	162.4	-173.3	-176.8	0	107.2	T1152	T1152-K1154 PolarHBondContact O-N 3.32Å
1155	N	24.9	Very low	26.4	Very low	157 Å²	157	140.4 Å²	140.4	84%	0.84	76%	0.757	S	S	*	*			trans	130.9	18.2	168.4	-66.9	-8.7	0	0	0	116.4	E1157	N1155-E1157 VanDerWaalsContact C-N 3.29Å
1156	T	26.2	Very low	26.3	Very low	132 Å²	132	136 Å²	136	81%	0.81	75%	0.75	S	S	*	*			trans	-98	47.5	159.1	52.9	0	0	0	0	111
1157	E	24.6	Very low	26.2	Very low	164 Å²	164	130.2 Å²	130.2	77%	0.766	73%	0.73	S	S	*	*	S	Bend	trans	-142.9	127.3	167	-69.1	-177	169.3	0	0	104.1	N1155	N1155-E1157 VanDerWaalsContact C-N 3.29Å
1158	N	23.8	Very low	26.1	Very low	150 Å²	150	132.1 Å²	132.1	80%	0.802	73%	0.728	S	S	*	*			trans	101.1	43.4	-172.2	-49.6	-29.2	0	0	0	117.2	L1160	N1158-L1160 VanDerWaalsContact C-N 3.3Å; N1158-L1160 PolarHBondContact O-N 2.89Å
1159	C	24.1	Very low	26.1	Very low	129 Å²	129	129.7 Å²	129.7	87%	0.872	72%	0.717	S	S	*	*			trans	-72.8	100	139.3	-85.1	0	0	0	0	106	I1161	C1159-I1161 PolarHBondContact O-N 3.3Å
1160	L	24.6	Very low	26.2	Very low	150 Å²	150	124.6 Å²	124.6	79%	0.785	70%	0.701	S	S	*	*			trans	-47.7	104.9	-179.3	-73.4	164.5	0	0	0	109.9	N1158 F1162	N1158-L1160 VanDerWaalsContact C-N 3.3Å; N1158-L1160 PolarHBondContact O-N 2.89Å; L1160-F1162 VanDerWaalsContact C-N 3.31Å; L1160-F1162 PolarHBondContact O-N 3.08Å
1161	I	24.2	Very low	26.3	Very low	145 Å²	145	124.1 Å²	124.1	74%	0.744	69%	0.692	S	S	*	*			trans	-57.2	101.6	159.4	-63	163.9	0	0	0	104.3	C1159 P1163	C1159-I1161 PolarHBondContact O-N 3.3Å; I1161-P1163 WeakPolarHBondContact O-CD 3.49Å
1162	F	26.9	Very low	26.4	Very low	133 Å²	133	125.5 Å²	125.5	58%	0.583	69%	0.69	S	S	*	*			trans	-53.6	124.2	152.7	-85.7	-80.5	0	0	0	105.2	I1099 L1160 I1164	I1099-F1162 HydrophobicContact CG2-CE1 3.86Å; I1099-F1162 HydrophobicContact CG2-CZ 4.01Å; L1160-F1162 VanDerWaalsContact C-N 3.31Å; L1160-F1162 PolarHBondContact O-N 3.08Å; F1162-I1164 VanDerWaalsContact C-N 3.33Å; F1162-I1164 PolarHBondContact O-N 2.94Å
1163	P	25.7	Very low	26.6	Very low	108 Å²	108	127.1 Å²	127.1	70%	0.701	70%	0.699	S	S	*	*			trans	-62.9	106.5	175.9	26.4	-29.9	0	0	0	106	I1161 P1165	I1161-P1163 WeakPolarHBondContact O-CD 3.49Å; P1163-P1165 VanDerWaalsContact O-CD 3.23Å; P1163-P1165 WeakPolarHBondContact O-CD 3.43Å
1164	I	28.6	Very low	26.8	Very low	118 Å²	118	130 Å²	130	61%	0.605	70%	0.701	S	S	*	*			trans	-53.4	121.5	171.1	-58.7	164.4	0	0	0	106.2	E768 F1162 G1166	E768-I1164 WeakPolarHBondContact OE2-CG2 3.46Å; F1162-I1164 VanDerWaalsContact C-N 3.33Å; F1162-I1164 PolarHBondContact O-N 2.94Å; I1164-G1166 PolarHBondContact O-N 3.27Å
1165	P	27.1	Very low	26.9	Very low	92 Å²	92	132.9 Å²	132.9	60%	0.597	71%	0.707	S	S	*	*			trans	-75.5	55.9	169	-11.1	28.9	0	0	0	110.2	P1163 A1167	P1163-P1165 VanDerWaalsContact O-CD 3.23Å; P1163-P1165 WeakPolarHBondContact O-CD 3.43Å; P1165-A1167 VanDerWaalsContact C-N 3.3Å
1166	G	27.8	Very low	27.1	Very low	63 Å²	63	132.8 Å²	132.8	65%	0.649	71%	0.705	S	S	*	*			trans	-88.3	-1	178	0	0	0	0	0	113.2	I1164	I1164-G1166 PolarHBondContact O-N 3.27Å
1167	A	25.9	Very low	27.1	Very low	45 Å²	45	136.6 Å²	136.6	37%	0.372	71%	0.71	S	S	.	*	S	Bend	trans	-145.5	133.3	-178	0	0	0	0	0	106.8	N726 P1165	N726-A1167 WeakPolarHBondContact ND2-CA 3.36Å; N726-A1167 WeakPolarHBondContact ND2-CB 3.3Å; P1165-A1167 VanDerWaalsContact C-N 3.3Å
1168	F	27.2	Very low	27.3	Very low	177 Å²	177	133.9 Å²	133.9	78%	0.776	71%	0.709	S	S	*	*	S	Bend	trans	102.4	117.8	179.6	-65.7	-86.5	0	0	0	116.8
1169	N	29.5	Very low	27.7	Very low	117 Å²	117	134.2 Å²	134.2	63%	0.626	71%	0.709	S	S	*	*			trans	93.6	63.9	155.9	-59.2	-11.8	0	0	0	119.9	F1171	N1169-F1171 PolarHBondContact O-N 3.1Å; N1169-F1171 VanDerWaalsContact O-N 3.09Å
1170	A	29.3	Very low	27.9	Very low	44 Å²	44	137.6 Å²	137.6	36%	0.364	71%	0.71	S	S	.	*			trans	-72.5	37.1	140.7	0	0	0	0	0	113.3	N725 R729	N725-A1170 WeakPolarHBondContact ND2-CB 3.35Å; R729-A1170 PolarHBondContact NH1-O 3.45Å; R729-A1170 VanDerWaalsContact NH1-O 3.14Å
1171	F	28.8	Very low	28.3	Very low	133 Å²	133	136.4 Å²	136.4	58%	0.583	70%	0.704	S	S	*	*			trans	-126.1	90.6	174.9	-103.9	-90.3	0	0	0	106.1	N1169	N1169-F1171 PolarHBondContact O-N 3.1Å; N1169-F1171 VanDerWaalsContact O-N 3.09Å
1172	E	29	Very low	28.7	Very low	153 Å²	153	141.2 Å²	141.2	72%	0.715	71%	0.713	S	S	*	*	S	Bend	trans	171.1	0.8	144.3	-96.1	-173.6	-178.3	0	0	116.6	K1174	E1172-K1174 PolarHBondContact O-N 2.82Å
1173	V	29.4	Very low	29	Very low	155 Å²	155	143.1 Å²	143.1	94%	0.939	72%	0.721	S	S	*	*			trans	-88.3	48.5	173.1	-165.4	0	0	0	0	112.3
1174	K	28.7	Very low	29.3	Very low	188 Å²	188	146.1 Å²	146.1	82%	0.817	73%	0.726	S	S	*	*	S	Bend	trans	-132.5	50.3	174.1	-109.7	-164.7	-177.7	-168.2	0	111.7	E1172	E1172-K1174 PolarHBondContact O-N 2.82Å
1175	R	29.2	Very low	29.6	Very low	238 Å²	238	151.9 Å²	151.9	90%	0.898	74%	0.74	S	S	*	*	S	Bend	trans	-162	35.1	166	-127.7	178.6	-169.5	-176.5	2.6	117.9
1176	I	27.7	Very low	29.9	Very low	155 Å²	155	160.2 Å²	160.2	80%	0.795	77%	0.774	S	S	*	*	S	Bend	trans	-129.6	44.8	173.1	-44.6	-179.5	0	0	0	112.1
1177	K	27.1	Very low	30	Very low	211 Å²	211	165.1 Å²	165.1	92%	0.917	78%	0.78	S	S	*	*	S	Bend	trans	-150.3	67.7	162.5	-77.3	-164.2	179	178.1	0	110.7
1178	S	29	Very low	30.2	Very low	108 Å²	108	171.4 Å²	171.4	76%	0.755	80%	0.802	S	S	*	*			trans	-170.6	156.6	145.1	69.1	0	0	0	0	108.4
1179	I	31	Very low	30.4	Very low	156 Å²	156	171.1 Å²	171.1	80%	0.8	80%	0.803	S	S	*	*			trans	88.6	57.5	-177.2	-41.5	164.8	0	0	0	113.1
1180	F	29.8	Very low	30.4	Very low	201 Å²	201	174.3 Å²	174.3	88%	0.882	81%	0.814	S	S	*	*			trans	-74.5	138.9	137.5	-118.5	-96	0	0	0	107.8
1181	N	32.5	Very low	30.5	Very low	125 Å²	125	182.4 Å²	182.4	67%	0.668	84%	0.842	S	S	*	*			trans	73.1	115.9	174.6	-63.7	-31.3	0	0	0	117.6
1182	W	31.9	Very low	30.6	Very low	246 Å²	246	185.7 Å²	185.7	93%	0.932	86%	0.859	S	S	*	*				-173.6	130.1	97.9	-101.7	61.3	0	0	0	111.2
1183	K	32.8	Very low	30.7	Very low	173 Å²	173	188.1 Å²	188.1	75%	0.752	87%	0.869	S	S	*	*			trans	-19.1	148.7	167.7	-74.7	172.9	172.4	178.2	0	121.4
1184	Q	33.6	Very low	30.8	Very low	171 Å²	171	190.6 Å²	190.6	80%	0.799	86%	0.864	S	S	*	*			trans	66.1	109.1	136.1	-71.9	173.4	-25.3	0	0	120
1185	R	33.9	Very low	31	Very low	239 Å²	239	190.8 Å²	190.8	90%	0.902	87%	0.868	S	S	*	*				177.3	123.4	117.3	-97.7	172.8	-178.9	-177.7	0.8	111
1186	M	33.3	Very low	31.1	Very low	267 Å²	267	186.5 Å²	186.5	100%	1.315	87%	0.865	S	S	*	*			trans	67.7	0	-170.4	-60.3	-152.9	176.4	0	0	115

Retrieved 1,186 of 1,186 residues in 217.8 ms (Link to these results)

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