A0A087X6B7_POEFO Loading...

Phospholipid-transporting ATPase

AlphaFold DB , UniProt , Accession A0A087X6B7, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 1,046 aa.

						>A0A087X6B7_POEFO|A0A087X6B7
MTDSIPLQPVRRQKRHDSKNRNGCCPWSSCCGMGDFRPRTVWLGHPEKREQRYPKNVINNQKYNFFTFLPGVLFNQFKYFFNLYFLLLACSQFVEELRLGALHTYWVPLGLVLFITITREAIEEIRCYLRDKEVNSQVYSKLSKRGTVKVKSSGIQVGDLIIVEKNQRVPADMIFLRTSERNGSCFLRTDQLDGETDWKLRLPVACTQRLPTAADLLQIRSYVYAEEPNIDIHNFIGTFTREDGDPPVNESLSIENTLWASTVVASGTVVGVVIYTGKELRSVMNTSNPRHKVGLFDLEVNCLTKILFGALVVVSLVMVALQHFAGRWYLQIFRFLLLFSHIVPISLRVNLDMGKMVFSWMIKKDSKIPGTVVRASTIPEQLGRISYLLTDKTGTLTQNEMVFRRLHLGTVAYGMDSMDEVQSHVFSAYTQPTHDLPASRAPAATKVRKTISSRVHEAVKAIALVHNVTPVYEANGVTDQAEAEQHYEDTCRVYQASSPDEVSLVQWTESVGLTLVGRDQSSMQLRTPTGQILNFTILQIFPFTYESKRMGIIVRDESTGEITFYMKGADVVMAGIVQYNDWLEEECGNMAREGLRVLVVSKKSLTEEQYQDFEARYVQAKLSVHDRSLKVATVIESLEMEMELLCLTGVEDQLQTDVRPTLEILRNAGIRVWMLTGDKLETATCTAKNAHLITRNQDIHIFRQVTTRGEAHLELNAFRRKHDCALVISGDSLEVCLKYYEYEFMELACQCPAVVCCRCTPTQKAQIVRLLQERTGKLTCAVGDGGNDVSMIQEADCGVGVEGKEGKQASLASDFSVTQFKHLGRLLMVHGRNSYKRSAALSQFVIHRSLCISTMQAVFSSVFYFASVPLYQGFLIIGYSTIYTMFPVFSLVLDKDVKSEVAMLYPELYKDLLKGRPLSFKTFLIWVLISIYQGSIIMYGAMLLFESEFVHIVAISFTSLILTELLMVALTVQTWHWLMIVGELLSLACYIASLVFLHEFIDVYFITTVSFLWKVTAITLVSCLPLYILKYLRRRFSPPSYSKLTT
					

Structure Viewer

Loading PAE data...

(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	33	Very low	29.5	Very low	247 Å²	247	159.3 Å²	159.3	100%	1.217	85%	0.854	S	S	*	*				0	113.8	0	-86.2	167.8	169.8	0	0	107.2
2	T	35.9	Very low	29.2	Very low	132 Å²	132	166.4 Å²	166.4	81%	0.81	86%	0.86	S	S	*	*			trans	-63.4	128.2	175	41.9	0	0	0	0	110.3
3	D	30.1	Very low	28.8	Very low	155 Å²	155	167.1 Å²	167.1	83%	0.829	86%	0.857	S	S	*	*			trans	-141.8	97	151.1	-90.6	-32.5	0	0	0	109.5
4	S	31.7	Very low	28.6	Very low	116 Å²	116	168.6 Å²	168.6	81%	0.811	85%	0.854	S	S	*	*			trans	-71.6	109.4	164.6	42.9	0	0	0	0	109.7
5	I	31.2	Very low	28.2	Very low	149 Å²	149	172.2 Å²	172.2	76%	0.764	85%	0.853	S	S	*	*			trans	-103.3	122	164.7	-57.1	175.2	0	0	0	107.3	L7	I5-L7 PolarHBondContact O-N 2.96Å
6	P	30.4	Very low	28.1	Very low	115 Å²	115	171.8 Å²	171.8	75%	0.747	85%	0.848	S	S	*	*			trans	-74.7	117.9	177.2	20.3	-13.7	0	0	0	109.7	Q8	P6-Q8 PolarHBondContact O-N 3.23Å; P6-Q8 VanDerWaalsContact O-N 3.11Å
7	L	29.7	Very low	28.1	Very low	175 Å²	175	171.4 Å²	171.4	92%	0.916	85%	0.85	S	S	*	*			trans	-66.4	105.1	167.5	-80.1	158.8	0	0	0	108.8	I5	I5-L7 PolarHBondContact O-N 2.96Å
8	Q	26.8	Very low	28.2	Very low	168 Å²	168	167.3 Å²	167.3	79%	0.785	84%	0.841	S	S	*	*			trans	-61.1	147.5	165.1	-79.6	-178.3	-18.1	0	0	110.4	P6 V10	P6-Q8 PolarHBondContact O-N 3.23Å; P6-Q8 VanDerWaalsContact O-N 3.11Å; Q8-V10 PolarHBondContact O-N 3.24Å; Q8-V10 VanDerWaalsContact O-N 3.11Å
9	P	25.9	Very low	28.2	Very low	124 Å²	124	168.7 Å²	168.7	81%	0.805	84%	0.841	S	S	*	*			trans	-66.2	115.4	176.2	27	-31.2	0	0	0	109.1	R11	P9-R11 PolarHBondContact O-N 3.21Å
10	V	25.6	Very low	28.2	Very low	137 Å²	137	168.3 Å²	168.3	83%	0.83	84%	0.842	S	S	*	*			trans	-59.6	105.5	172.5	176.9	0	0	0	0	107.9	Q8 R12	Q8-V10 PolarHBondContact O-N 3.24Å; Q8-V10 VanDerWaalsContact O-N 3.11Å; V10-R12 PolarHBondContact O-N 3.13Å
11	R	24.6	Very low	28.3	Very low	234 Å²	234	171.2 Å²	171.2	88%	0.883	84%	0.843	S	S	*	*			trans	-48.5	112.7	164.7	-101.6	177.1	166.9	176.5	-3.4	107.9	P9 Q13	P9-R11 PolarHBondContact O-N 3.21Å; R11-Q13 VanDerWaalsContact C-N 3.28Å; R11-Q13 PolarHBondContact O-N 3.37Å
12	R	25.7	Very low	28.1	Very low	245 Å²	245	167.4 Å²	167.4	93%	0.925	83%	0.827	S	S	*	*			trans	-56	91.4	165.5	-91.6	179.9	165	-178.7	-4.2	108.7	V10 K14	V10-R12 PolarHBondContact O-N 3.13Å; R12-K14 PolarHBondContact O-N 3.2Å; R12-K14 VanDerWaalsContact O-N 3.15Å
13	Q	23.5	Very low	27.8	Very low	175 Å²	175	165 Å²	165	82%	0.818	83%	0.829	S	S	*	*			trans	-73.3	98	157.7	-106.6	178.4	-10.3	0	0	106.5	R11 R15	R11-Q13 VanDerWaalsContact C-N 3.28Å; R11-Q13 PolarHBondContact O-N 3.37Å; Q13-R15 VanDerWaalsContact C-N 3.28Å; Q13-R15 PolarHBondContact O-N 2.95Å
14	K	26	Very low	27.7	Very low	189 Å²	189	163.2 Å²	163.2	82%	0.822	83%	0.827	S	S	*	*			trans	-56	96.6	160.7	-83.6	-178.8	172.8	-178.3	0	106.9	R12 H16	R12-K14 PolarHBondContact O-N 3.2Å; R12-K14 VanDerWaalsContact O-N 3.15Å; K14-H16 PolarHBondContact O-N 2.65Å; K14-H16 VanDerWaalsContact O-N 3.16Å
15	R	23.6	Very low	27.6	Very low	222 Å²	222	162.5 Å²	162.5	84%	0.838	82%	0.821	S	S	*	*			trans	-71.4	103.8	163.7	-93.6	-175.7	173.8	179.9	-0.8	106.6	Q13 D17	Q13-R15 VanDerWaalsContact C-N 3.28Å; Q13-R15 PolarHBondContact O-N 2.95Å; R15-D17 PolarHBondContact O-N 3Å
16	H	26.4	Very low	27.5	Very low	166 Å²	166	161.2 Å²	161.2	77%	0.769	82%	0.822	S	S	*	*			trans	-59.6	110.7	159.9	-92	-84.1	0	0	0	108.1	K14 S18	K14-H16 PolarHBondContact O-N 2.65Å; K14-H16 VanDerWaalsContact O-N 3.16Å; H16-S18 PolarHBondContact O-N 2.87Å
17	D	28.1	Very low	27.4	Very low	164 Å²	164	167.6 Å²	167.6	88%	0.877	83%	0.832	S	S	*	*			trans	-72.3	78.7	163.3	-84.9	-30.2	0	0	0	108.9	R15	R15-D17 PolarHBondContact O-N 3Å
18	S	29.8	Very low	27.4	Very low	99 Å²	99	163.4 Å²	163.4	69%	0.692	82%	0.817	S	S	*	*			trans	-100.5	62.7	166.3	70.8	0	0	0	0	109.8	H16	H16-S18 PolarHBondContact O-N 2.87Å
19	K	28.4	Very low	27.3	Very low	193 Å²	193	160.4 Å²	160.4	84%	0.839	82%	0.815	S	S	*	*			trans	-141.2	77.9	169.7	-81.9	-169.7	176.6	177	0	111.7
20	N	27	Very low	27.5	Very low	161 Å²	161	160.4 Å²	160.4	86%	0.861	82%	0.816	S	S	*	*			trans	-175.4	73.6	135.6	-98.2	-14.8	0	0	0	109.8
21	R	30.3	Very low	28	Very low	230 Å²	230	159.4 Å²	159.4	87%	0.868	81%	0.814	S	S	*	*			trans	-122.4	69.4	160.9	-80.3	-171.3	175.8	-178	0.7	108.5
22	N	28.7	Very low	28.4	Very low	166 Å²	166	151.8 Å²	151.8	89%	0.888	81%	0.808	S	S	*	*			trans	-111.6	108	166.7	-81.4	-1.9	0	0	0	108.5
23	G	29.6	Very low	29.2	Very low	81 Å²	81	147.6 Å²	147.6	84%	0.835	80%	0.801	S	S	*	*			trans	152.4	5.1	173.1	0	0	0	0	0	117.8
24	C	29.4	Very low	30.6	Very low	119 Å²	119	142.2 Å²	142.2	80%	0.804	79%	0.792	S	S	*	*			trans	-110.1	133.5	173.6	-93.9	0	0	0	0	111.9
25	C	29.7	Very low	32.7	Very low	100 Å²	100	140 Å²	140	68%	0.676	79%	0.789	S	S	*	*			trans	-51.2	156.3	-179.7	-63.3	0	0	0	0	114	W27	C25-W27 PolarHBondContact O-N 2.83Å
26	P	28.3	Very low	35.5	Very low	122 Å²	122	133.2 Å²	133.2	79%	0.792	77%	0.766	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.9	2.8	-177.4	-15.3	29.8	0	0	0	115.9
27	W	28	Very low	38.3	Very low	250 Å²	250	132.8 Å²	132.8	95%	0.947	76%	0.758	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95	-0.9	-176	-81.2	11.3	0	0	0	114.9	C25 S29	C25-W27 PolarHBondContact O-N 2.83Å; W27-S29 VanDerWaalsContact C-N 3.3Å; W27-S29 PolarHBondContact O-N 3.34Å
28	S	30.5	Very low	41.2	Very low	86 Å²	86	127.6 Å²	127.6	60%	0.601	73%	0.733	S	S	*	*	G	3₁₀ helix	trans	-85.6	4.2	176	68.2	0	0	0	0	114.5	C30	S28-C30 PolarHBondContact O-N 3.1Å
29	S	25.2	Very low	44	Very low	106 Å²	106	123.2 Å²	123.2	74%	0.741	70%	0.701	S	S	*	*	G	3₁₀ helix	trans	-70.7	-7.8	-175.4	-174.5	0	0	0	0	115	W27	W27-S29 VanDerWaalsContact C-N 3.3Å; W27-S29 PolarHBondContact O-N 3.34Å
30	C	28.7	Very low	46.9	Very low	123 Å²	123	115.7 Å²	115.7	83%	0.831	67%	0.671	S	S	*	*	G	3₁₀ helix	trans	-90.9	-3.8	-178.5	-70.9	0	0	0	0	114.7	S28	S28-C30 PolarHBondContact O-N 3.1Å
31	C	36.7	Very low	49.9	Very low	117 Å²	117	108.3 Å²	108.3	79%	0.791	63%	0.632	S	S	*	*			trans	-124.7	65.3	178.3	-71.4	0	0	0	0	110.2	M33	C31-M33 PolarHBondContact O-N 3.49Å
32	G	33.4	Very low	52.7	Low	73 Å²	73	99.1 Å²	99.1	75%	0.753	60%	0.598	S	S	*	*			trans	-61.9	125.5	168.6	0	0	0	0	0	110.3	G34	G32-G34 PolarHBondContact O-N 3.49Å
33	M	42.3	Very low	55.5	Low	157 Å²	157	91.2 Å²	91.2	77%	0.773	56%	0.555	S	S	*	*			trans	-62.4	111.9	157.5	-76.3	167	87.4	0	0	105.9	C31	C31-M33 PolarHBondContact O-N 3.49Å
34	G	52.7	Low	57.6	Low	62 Å²	62	88 Å²	88	64%	0.639	52%	0.522	S	S	*	.	P	Polyproline II helix	trans	-64.8	147.1	167.6	0	0	0	0	0	109.4	G32	G32-G34 PolarHBondContact O-N 3.49Å
35	D	69.6	Low	59.7	Low	142 Å²	142	85.2 Å²	85.2	76%	0.759	50%	0.497	S	S	*	.	P	Polyproline II helix	trans	-58.5	138.8	174.6	-61.3	-42	0	0	0	110.4
36	F	83.4	Confident	61.4	Low	81 Å²	81	84.4 Å²	84.4	36%	0.355	49%	0.49	S	S	.	.	P	Polyproline II helix	trans	-62.2	140.9	173.9	-64	-53.7	0	0	0	109.9	E227 P228 E279 M284	F36-E227 HydrophobicContact CB-CB 4.3Å; F36-P228 HydrophobicContact CB-CG 4.5Å; F36-P228 HydrophobicContact CD1-CB 4.02Å; F36-P228 HydrophobicContact CD1-CG 3.98Å; F36-P228 HydrophobicContact CE1-CB 4.42Å; F36-P228 HydrophobicContact CG-CB 4.3Å; F36-P228 HydrophobicContact CG-CG 4.43Å; F36-E279 HydrophobicContact CE1-CG 4.15Å; F36-M284 HydrophobicContact CD1-CE 4.26Å; F36-M284 HydrophobicContact CE1-CE 3.52Å; F36-M284 HydrophobicContact CE2-CE 3.99Å; F36-M284 HydrophobicContact CZ-CE 3.36Å; F36-M284 HydrophobicContact CZ-SD 4.36Å
37	R	85.4	Confident	63.2	Low	157 Å²	157	87.4 Å²	87.4	59%	0.592	49%	0.494	S	S	*	.			trans	-135.4	147	-178.4	-65.1	-177.4	-175	-172.7	-0.7	110.7
38	P	88.2	Confident	65.1	Low	55 Å²	55	79.4 Å²	79.4	36%	0.357	47%	0.466	S	S	.	.			trans	-64.6	154.1	168.6	29.8	-35.1	0	0	0	110.3	Y224	P38-Y224 HydrophobicContact CB-CE2 4.36Å
39	R	88.3	Confident	66.8	Low	7 Å²	7	80 Å²	80	3%	0.026	46%	0.455	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	149.1	-172.9	65	-171.6	66.3	-178.3	-3.1	113.2	V41 Y53 A225 I274 E279	R39-V41 HydrophobicContact CG-CG2 4.25Å; R39-Y53 HydrophobicContact CB-CE1 4.33Å; R39-A225 PolarHBondContact N-O 3.29Å; R39-A225 PolarHBondContact O-N 3.2Å; R39-I274 PolarHBondContact NH1-O 2.84Å; R39-E279 IonicContact CZ-OE1 2.72Å; R39-E279 IonicContact CZ-OE2 3.14Å; R39-E279 VanDerWaalsContact CZ-OE2 3.26Å; R39-E279 IonicContact NH1-OE1 3.23Å; R39-E279 IonicContact NH1-OE2 3.5Å; R39-E279 PolarHBondContact NH1-OE2 2.72Å; R39-E279 IonicContact NH2-OE1 3.56Å; R39-E279 PolarHBondContact NH2-OE1 2.81Å; R39-E279 IonicContact NH2-OE2 2.87Å; R39-E279 PolarHBondContact NH2-OE2 2.82Å
40	T	90.2	Very high	68.7	Low	34 Å²	34	81.5 Å²	81.5	21%	0.209	45%	0.45	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	125.1	171.7	-54.7	0	0	0	0	109.3	Y222 V223	T40-Y222 HydrophobicContact CG2-CD2 3.45Å; T40-Y222 VanDerWaalsContact CG2-CD2 3.45Å; T40-Y222 HydrophobicContact CG2-CE2 4.17Å; T40-Y222 HydrophobicContact CG2-CG 3.93Å; T40-V223 CarbonylContact C-O 3.45Å; T40-V223 WeakPolarHBondContact CA-O 3.41Å
41	V	90.1	Very high	70.9	Confident	7 Å²	7	78.8 Å²	78.8	4%	0.042	43%	0.425	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	112.5	-176.6	-176.3	0	0	0	0	109.3	R39 V157 G158 Y222 V223 V272 I274	R39-V41 HydrophobicContact CG-CG2 4.25Å; V41-V157 HydrophobicContact CG1-CG1 4.15Å; V41-V157 HydrophobicContact CG2-CG1 3.71Å; V41-G158 VanDerWaalsContact CG1-CA 3.41Å; V41-Y222 CarbonylContact O-C 3.54Å; V41-Y222 WeakPolarHBondContact O-CA 3.26Å; V41-V223 PolarHBondContact N-O 3.19Å; V41-V223 PolarHBondContact O-N 2.83Å; V41-V272 HydrophobicContact CG1-CG2 4.05Å; V41-I274 HydrophobicContact CB-CD1 3.98Å; V41-I274 HydrophobicContact CG1-CD1 4.27Å; V41-I274 HydrophobicContact CG2-CD1 3.86Å
42	W	88.6	Confident	73	Confident	37 Å²	37	85.3 Å²	85.3	14%	0.14	43%	0.433	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	132.8	177.9	-70.1	87	0	0	0	111.5	H45 K48 R220 Y222	W42-H45 HydrophobicContact CB-CB 4.23Å; W42-K48 HydrophobicContact CB-CB 4.34Å; W42-K48 HydrophobicContact CD2-CB 4.43Å; W42-K48 HydrophobicContact CD2-CD 3.63Å; W42-K48 HydrophobicContact CE3-CD 3.95Å; W42-K48 HydrophobicContact CG-CB 3.9Å; W42-K48 HydrophobicContact CG-CD 3.95Å; W42-K48 HydrophobicContact CZ2-CD 4.28Å; W42-K48 HydrophobicContact CZ3-CD 4.41Å; W42-R220 HydrophobicContact CZ3-CG 4.43Å; W42-Y222 HydrophobicContact CE3-CD1 4.18Å; W42-Y222 AromaticContact CH2-CD1 3.63Å; W42-Y222 HydrophobicContact CH2-CD1 3.63Å; W42-Y222 HydrophobicContact CH2-CE1 4.13Å; W42-Y222 HydrophobicContact CH2-CG 4.44Å; W42-Y222 HydrophobicContact CZ2-CD1 4.03Å; W42-Y222 HydrophobicContact CZ2-CG 4.48Å; W42-Y222 AromaticContact CZ3-CD1 3.72Å; W42-Y222 HydrophobicContact CZ3-CD1 3.72Å; W42-Y222 HydrophobicContact CZ3-CG 4.47Å
43	L	86.8	Confident	75.5	Confident	0 Å²	0	84.1 Å²	84.1	0%	0	41%	0.406	C	S	.	.	S	Bend	trans	-77.9	134.6	175.4	-74.3	82.8	0	0	0	110.1	H45 L160 L176 S221 V223 F239	L43-H45 PolarHBondContact O-CD2 3.08Å; L43-H45 VanDerWaalsContact O-CD2 3.24Å; L43-H45 PolarHBondContact O-N 3.11Å; L43-L160 HydrophobicContact CD2-CD2 4.39Å; L43-L176 HydrophobicContact CD2-CD1 3.59Å; L43-L176 HydrophobicContact CD2-CD2 4.34Å; L43-S221 PolarHBondContact N-O 3.09Å; L43-V223 HydrophobicContact CD1-CG2 4.14Å; L43-F239 HydrophobicContact CD1-CE2 3.94Å; L43-F239 HydrophobicContact CD2-CE2 4.14Å
44	G	73.5	Confident	77.8	Confident	13 Å²	13	78.7 Å²	78.7	13%	0.134	38%	0.383	C	S	.	.	S	Bend	trans	68	-3.2	173.5	0	0	0	0	0	116.7	P46	G44-P46 WeakPolarHBondContact O-CD 3.03Å
45	H	74.4	Confident	79.6	Confident	61 Å²	61	84 Å²	84	28%	0.282	39%	0.388	S	S	.	.			trans	-121.3	75.6	-177.1	-68.8	-75.4	0	0	0	112.3	W42 L43 E47 K48	W42-H45 HydrophobicContact CB-CB 4.23Å; L43-H45 PolarHBondContact O-CD2 3.08Å; L43-H45 VanDerWaalsContact O-CD2 3.24Å; L43-H45 PolarHBondContact O-N 3.11Å; H45-E47 PolarHBondContact O-N 3.12Å; H45-E47 VanDerWaalsContact O-N 3.11Å; H45-K48 HydrophobicContact CB-CD 4.37Å; H45-K48 HydrophobicContact CB-CG 4.38Å; H45-K48 PolarHBondContact O-N 2.81Å
46	P	65.4	Low	80.7	Confident	82 Å²	82	77.3 Å²	77.3	53%	0.532	35%	0.353	S	S	.	.	G	3₁₀ helix	trans	-65.2	-14.9	-179.4	27.8	-35.3	0	0	0	113.9	G44 R49	G44-P46 WeakPolarHBondContact O-CD 3.03Å; P46-R49 WeakPolarHBondContact O-CD 3.43Å; P46-R49 VanDerWaalsContact O-CG 3.26Å; P46-R49 WeakPolarHBondContact O-CG 3.28Å
47	E	65.4	Low	81	Confident	186 Å²	186	76.5 Å²	76.5	87%	0.869	36%	0.355	S	S	*	.	G	3₁₀ helix	trans	-74.2	-25.1	178.6	-64.9	168.8	-164.4	0	0	112.9	H45 R49	H45-E47 PolarHBondContact O-N 3.12Å; H45-E47 VanDerWaalsContact O-N 3.11Å; E47-R49 PolarHBondContact O-N 3.18Å; E47-R49 VanDerWaalsContact O-N 3.13Å
48	K	67.5	Low	80.8	Confident	82 Å²	82	71.1 Å²	71.1	36%	0.357	34%	0.337	S	S	.	.	G	3₁₀ helix	trans	-83.9	29.7	178.8	-67.2	-172.9	175.3	-176.8	0	113.1	W42 H45 E50	W42-K48 HydrophobicContact CB-CB 4.34Å; W42-K48 HydrophobicContact CD2-CB 4.43Å; W42-K48 HydrophobicContact CD2-CD 3.63Å; W42-K48 HydrophobicContact CE3-CD 3.95Å; W42-K48 HydrophobicContact CG-CB 3.9Å; W42-K48 HydrophobicContact CG-CD 3.95Å; W42-K48 HydrophobicContact CZ2-CD 4.28Å; W42-K48 HydrophobicContact CZ3-CD 4.41Å; H45-K48 HydrophobicContact CB-CD 4.37Å; H45-K48 HydrophobicContact CB-CG 4.38Å; H45-K48 PolarHBondContact O-N 2.81Å; K48-E50 PolarHBondContact O-N 3.39Å
49	R	68	Low	80.5	Confident	99 Å²	99	73.5 Å²	73.5	37%	0.374	35%	0.347	S	S	.	.			trans	-78.2	107.8	-179.9	-81.7	175.6	176.9	178.3	0.5	110.7	P46 E47 V157	P46-R49 WeakPolarHBondContact O-CD 3.43Å; P46-R49 VanDerWaalsContact O-CG 3.26Å; P46-R49 WeakPolarHBondContact O-CG 3.28Å; E47-R49 PolarHBondContact O-N 3.18Å; E47-R49 VanDerWaalsContact O-N 3.13Å; R49-V157 PolarHBondContact NH2-O 3.09Å
50	E	63.8	Low	79.9	Confident	136 Å²	136	76.6 Å²	76.6	64%	0.636	36%	0.364	S	S	*	.			trans	-77.3	-24.3	179.1	-64.3	178.3	-175.6	0	0	113.4	K48	K48-E50 PolarHBondContact O-N 3.39Å
51	Q	74.7	Confident	79.2	Confident	67 Å²	67	77.7 Å²	77.7	31%	0.313	37%	0.367	S	S	.	.	S	Bend	trans	-136.6	154.1	-171.2	-58.6	-178.8	24.5	0	0	112.6	Y53	Q51-Y53 HydrophobicContact CB-CE1 3.99Å
52	R	81.1	Confident	78.5	Confident	254 Å²	254	81.7 Å²	81.7	96%	0.958	38%	0.383	S	S	*	.			trans	-88.9	126.3	172.1	-82.8	-176.2	176.7	176.3	0.8	110.2
53	Y	87.2	Confident	78.2	Confident	47 Å²	47	81.4 Å²	81.4	18%	0.184	38%	0.383	C	S	.	.			trans	-106.3	152.6	-179.7	-54	-63.3	0	0	0	112	R39 Q51 V157	R39-Y53 HydrophobicContact CB-CE1 4.33Å; Q51-Y53 HydrophobicContact CB-CE1 3.99Å; Y53-V157 HydrophobicContact CD1-CG2 4.29Å; Y53-V157 HydrophobicContact CD2-CB 3.46Å; Y53-V157 VanDerWaalsContact CD2-CB 3.46Å; Y53-V157 HydrophobicContact CD2-CG1 3.85Å; Y53-V157 HydrophobicContact CD2-CG2 3.72Å; Y53-V157 HydrophobicContact CE2-CB 3.83Å; Y53-V157 HydrophobicContact CE2-CG1 3.68Å; Y53-V157 HydrophobicContact CE2-CG2 4.39Å; Y53-V157 HydrophobicContact CG-CB 3.95Å; Y53-V157 HydrophobicContact CG-CG1 4.38Å; Y53-V157 HydrophobicContact CG-CG2 3.63Å
54	P	89.9	Confident	78	Confident	44 Å²	44	86.5 Å²	86.5	29%	0.286	41%	0.41	S	S	.	.			trans	-64.4	147.8	175	26.8	-34.4	0	0	0	111.9	T276 E279	P54-T276 WeakPolarHBondContact CG-O 3.48Å; P54-T276 PolarHBondContact O-OG1 3.21Å; P54-E279 HydrophobicContact CG-CB 4.39Å; P54-E279 HydrophobicContact CG-CG 3.77Å
55	K	90.7	Very high	78.5	Confident	172 Å²	172	94.2 Å²	94.2	75%	0.748	44%	0.44	S	S	*	.			trans	-67.9	148.1	175.4	-62.6	-174.2	179.4	-179.3	0	110.7	V57 G277	K55-V57 HydrophobicContact CB-CG2 4.13Å; K55-V57 PolarHBondContact O-N 2.81Å; K55-G277 WeakPolarHBondContact O-CA 3.4Å
56	N	92.1	Very high	79.1	Confident	2 Å²	2	99.2 Å²	99.2	1%	0.011	46%	0.461	C	S	.	.	S	Bend	trans	-77.2	57.5	178.3	-161.6	40.5	0	0	0	113.2	S152 S153 I155 P170 T276 G277	N56-S152 PolarHBondContact ND2-O 3.34Å; N56-S152 VanDerWaalsContact ND2-O 3.12Å; N56-S153 VanDerWaalsContact O-CA 3.32Å; N56-S153 WeakPolarHBondContact O-CA 3.19Å; N56-I155 HydrophobicContact CB-CB 4.46Å; N56-P170 PolarHBondContact ND2-O 3.01Å; N56-P170 VanDerWaalsContact ND2-O 3.11Å; N56-T276 HydrophobicContact CB-CG2 4.15Å; N56-G277 PolarHBondContact OD1-N 3.09Å
57	V	89.4	Confident	80.2	Confident	65 Å²	65	98.9 Å²	98.9	39%	0.394	46%	0.457	S	S	.	.			trans	-116.2	124.6	-178	-178.7	0	0	0	0	109.8	K55	K55-V57 HydrophobicContact CB-CG2 4.13Å; K55-V57 PolarHBondContact O-N 2.81Å
58	I	82.4	Confident	81.4	Confident	43 Å²	43	91.8 Å²	91.8	22%	0.221	42%	0.424	C	S	.	.			trans	-89	128	171.6	-64.4	165.8	0	0	0	108.2	V134 N135	I58-V134 HydrophobicContact CD1-CG1 3.73Å; I58-N135 PolarHBondContact N-OD1 3.16Å; I58-N135 PolarHBondContact O-ND2 3.42Å
59	N	80.8	Confident	82.5	Confident	106 Å²	106	92.1 Å²	92.1	57%	0.567	43%	0.429	S	S	*	.			trans	-137.3	107.3	176.3	-178.3	5	0	0	0	109.7	Q61	N59-Q61 VanDerWaalsContact OD1-CB 3.27Å; N59-Q61 WeakPolarHBondContact OD1-CB 3.41Å; N59-Q61 WeakPolarHBondContact OD1-CG 3.47Å; N59-Q61 PolarHBondContact OD1-N 3.31Å
60	N	75.5	Confident	83.5	Confident	72 Å²	72	91.3 Å²	91.3	39%	0.385	44%	0.437	S	S	.	.			trans	-102.5	5.1	179.1	-61	-49.8	0	0	0	112.4	D131	N60-D131 WeakPolarHBondContact CB-OD2 3.31Å; N60-D131 PolarHBondContact N-OD2 3.23Å; N60-D131 PolarHBondContact ND2-OD1 3.3Å
61	Q	76.8	Confident	84.6	Confident	57 Å²	57	85.8 Å²	85.8	27%	0.266	42%	0.416	S	S	.	.			trans	-67.2	137	176.4	-61.8	-169.2	-82.7	0	0	110.7	N59 E124	N59-Q61 VanDerWaalsContact OD1-CB 3.27Å; N59-Q61 WeakPolarHBondContact OD1-CB 3.41Å; N59-Q61 WeakPolarHBondContact OD1-CG 3.47Å; N59-Q61 PolarHBondContact OD1-N 3.31Å; Q61-E124 VanDerWaalsContact CA-OE1 3.31Å; Q61-E124 WeakPolarHBondContact CA-OE1 2.91Å; Q61-E124 VanDerWaalsContact CB-OE1 3.28Å; Q61-E124 WeakPolarHBondContact CB-OE1 3.45Å
62	K	74.1	Confident	85.2	Confident	91 Å²	91	82.7 Å²	82.7	40%	0.396	40%	0.402	S	S	.	.	S	Bend	trans	-75.3	-37.6	174.4	-63.6	174.1	-173.7	165.2	0	111	E124	K62-E124 PolarHBondContact N-OE1 2.79Å
63	Y	82.1	Confident	85.5	Confident	31 Å²	31	73 Å²	73	12%	0.122	37%	0.369	C	S	.	.			trans	-125.6	139.2	-174.7	-48.2	-80.4	0	0	0	110.9	F68 V72 N75 E120 E124	Y63-F68 HydrophobicContact CD2-CD2 4.01Å; Y63-F68 HydrophobicContact CG-CD2 4.27Å; Y63-V72 HydrophobicContact CE2-CG2 4.19Å; Y63-N75 PolarHBondContact OH-ND2 3.37Å; Y63-E120 HydrophobicContact CE2-CG 4.24Å; Y63-E124 PolarHBondContact N-OE1 2.91Å
64	N	84.1	Confident	85.6	Confident	107 Å²	107	77.8 Å²	77.8	57%	0.572	39%	0.391	S	S	*	.			trans	-79.8	163.3	160.4	-161.4	1.9	0	0	0	110.4	F66 T67 F68	N64-F66 VanDerWaalsContact C-N 3.27Å; N64-F66 PolarHBondContact O-N 3.49Å; N64-F66 VanDerWaalsContact O-N 3.16Å; N64-T67 WeakPolarHBondContact CA-OG1 3.46Å; N64-T67 WeakPolarHBondContact CB-OG1 3.49Å; N64-T67 PolarHBondContact N-OG1 3.14Å; N64-T67 PolarHBondContact O-N 2.88Å; N64-T67 PolarHBondContact O-OG1 2.89Å; N64-F68 PolarHBondContact O-N 3.29Å
65	F	83.8	Confident	85.2	Confident	174 Å²	174	78 Å²	78	76%	0.763	39%	0.39	S	S	*	.	H	α-helix	trans	-49.7	-44.1	-178.8	-177.7	-99.2	0	0	0	113.1
66	F	87.3	Confident	84.9	Confident	167 Å²	167	70.5 Å²	70.5	73%	0.732	36%	0.357	S	S	*	.	H	α-helix	trans	-76	-31.1	179	-62.7	-73.2	0	0	0	114.1	N64 P70	N64-F66 VanDerWaalsContact C-N 3.27Å; N64-F66 PolarHBondContact O-N 3.49Å; N64-F66 VanDerWaalsContact O-N 3.16Å; F66-P70 VanDerWaalsContact O-CD 3.31Å; F66-P70 WeakPolarHBondContact O-CD 3.4Å
67	T	88.7	Confident	84.7	Confident	74 Å²	74	72.4 Å²	72.4	45%	0.454	37%	0.365	S	S	.	.	H	α-helix	trans	-86.8	-12.9	-178.4	53	0	0	0	0	113	N64 G71	N64-T67 WeakPolarHBondContact CA-OG1 3.46Å; N64-T67 WeakPolarHBondContact CB-OG1 3.49Å; N64-T67 PolarHBondContact N-OG1 3.14Å; N64-T67 PolarHBondContact O-N 2.88Å; N64-T67 PolarHBondContact O-OG1 2.89Å; T67-G71 WeakPolarHBondContact O-CA 3.45Å; T67-G71 PolarHBondContact O-N 3.49Å
68	F	89.8	Confident	84.4	Confident	37 Å²	37	76.2 Å²	76.2	16%	0.162	38%	0.377	C	S	.	.	H	α-helix	trans	-59.3	-61.1	-176.9	175.3	-102.1	0	0	0	111.6	Y63 N64 G71 V72 I117 E120 A121	Y63-F68 HydrophobicContact CD2-CD2 4.01Å; Y63-F68 HydrophobicContact CG-CD2 4.27Å; N64-F68 PolarHBondContact O-N 3.29Å; F68-G71 PolarHBondContact O-N 2.86Å; F68-V72 HydrophobicContact CD2-CG2 3.95Å; F68-V72 HydrophobicContact CE2-CG2 3.72Å; F68-V72 HydrophobicContact CG-CG2 4.47Å; F68-V72 HydrophobicContact CZ-CG2 4.04Å; F68-V72 WeakPolarHBondContact O-CB 3.3Å; F68-V72 WeakPolarHBondContact O-CG2 3.49Å; F68-V72 PolarHBondContact O-N 3.32Å; F68-I117 HydrophobicContact CE1-CG2 3.97Å; F68-I117 HydrophobicContact CZ-CG2 4.31Å; F68-E120 HydrophobicContact CE2-CB 4.18Å; F68-E120 HydrophobicContact CE2-CG 4.03Å; F68-E120 HydrophobicContact CZ-CB 4.29Å; F68-A121 HydrophobicContact CE1-CB 4.2Å; F68-A121 HydrophobicContact CE2-CB 4.41Å; F68-A121 HydrophobicContact CZ-CB 3.65Å
69	L	89.8	Confident	84.3	Confident	90 Å²	90	77.3 Å²	77.3	47%	0.471	38%	0.379	S	S	.	.	H	α-helix	trans	-63.8	-48.3	-175	-174	68.5	0	0	0	112.8	G71 V72 L73 I117	L69-G71 PolarHBondContact O-N 3.24Å; L69-V72 PolarHBondContact O-N 2.84Å; L69-L73 HydrophobicContact CD1-CD1 4.11Å; L69-L73 HydrophobicContact CD1-CG 4.24Å; L69-L73 HydrophobicContact CG-CD1 3.98Å; L69-L73 HydrophobicContact CG-CG 4.48Å; L69-L73 WeakPolarHBondContact O-CB 3.34Å; L69-L73 VanDerWaalsContact O-CG 3.26Å; L69-L73 WeakPolarHBondContact O-CG 3.49Å; L69-L73 PolarHBondContact O-N 3.3Å; L69-I117 HydrophobicContact CD1-CD1 4.09Å
70	P	90.3	Very high	84.4	Confident	82 Å²	82	75.2 Å²	75.2	53%	0.532	37%	0.365	S	S	.	.	H	α-helix	trans	-62.8	-40.3	176.8	-22.4	34.5	0	0	0	113	F66 F74	F66-P70 VanDerWaalsContact O-CD 3.31Å; F66-P70 WeakPolarHBondContact O-CD 3.4Å; P70-F74 VanDerWaalsContact O-CB 3.28Å; P70-F74 WeakPolarHBondContact O-CB 3.32Å; P70-F74 PolarHBondContact O-N 2.7Å
71	G	87.2	Confident	84.6	Confident	20 Å²	20	72.5 Å²	72.5	21%	0.206	35%	0.35	C	S	.	.	H	α-helix	trans	-66.2	-44.6	179.4	0	0	0	0	0	112.4	T67 F68 L69 F74 N75	T67-G71 WeakPolarHBondContact O-CA 3.45Å; T67-G71 PolarHBondContact O-N 3.49Å; F68-G71 PolarHBondContact O-N 2.86Å; L69-G71 PolarHBondContact O-N 3.24Å; G71-F74 PolarHBondContact O-N 3.04Å; G71-N75 WeakPolarHBondContact O-CB 3.28Å; G71-N75 PolarHBondContact O-N 3.16Å; G71-N75 PolarHBondContact O-ND2 3.47Å
72	V	86.8	Confident	84.8	Confident	2 Å²	2	70.2 Å²	70.2	1%	0.012	34%	0.339	C	S	.	.	H	α-helix	trans	-65	-46.8	177.6	173.1	0	0	0	0	110.9	Y63 F68 L69 F74 N75 Q76 I117 E120	Y63-V72 HydrophobicContact CE2-CG2 4.19Å; F68-V72 HydrophobicContact CD2-CG2 3.95Å; F68-V72 HydrophobicContact CE2-CG2 3.72Å; F68-V72 HydrophobicContact CG-CG2 4.47Å; F68-V72 HydrophobicContact CZ-CG2 4.04Å; F68-V72 WeakPolarHBondContact O-CB 3.3Å; F68-V72 WeakPolarHBondContact O-CG2 3.49Å; F68-V72 PolarHBondContact O-N 3.32Å; L69-V72 PolarHBondContact O-N 2.84Å; V72-F74 PolarHBondContact O-N 3.06Å; V72-N75 PolarHBondContact O-N 3.33Å; V72-Q76 WeakPolarHBondContact O-CG 3.49Å; V72-Q76 PolarHBondContact O-N 3.02Å; V72-I117 HydrophobicContact CG1-CG1 3.93Å; V72-E120 HydrophobicContact CG2-CB 4.33Å; V72-E120 HydrophobicContact CG2-CG 3.85Å
73	L	88.1	Confident	85.5	Confident	51 Å²	51	69.3 Å²	69.3	27%	0.267	34%	0.338	S	S	.	.	H	α-helix	trans	-62.1	-43.1	178	-70.2	174.8	0	0	0	111.9	L69 N75 Q76 F77 I117	L69-L73 HydrophobicContact CD1-CD1 4.11Å; L69-L73 HydrophobicContact CD1-CG 4.24Å; L69-L73 HydrophobicContact CG-CD1 3.98Å; L69-L73 HydrophobicContact CG-CG 4.48Å; L69-L73 WeakPolarHBondContact O-CB 3.34Å; L69-L73 VanDerWaalsContact O-CG 3.26Å; L69-L73 WeakPolarHBondContact O-CG 3.49Å; L69-L73 PolarHBondContact O-N 3.3Å; L73-N75 VanDerWaalsContact C-N 3.32Å; L73-N75 PolarHBondContact O-N 3.11Å; L73-Q76 PolarHBondContact O-N 3.39Å; L73-F77 HydrophobicContact CB-CD2 4.43Å; L73-F77 HydrophobicContact CD2-CE2 4.11Å; L73-F77 WeakPolarHBondContact O-CD2 3.34Å; L73-F77 PolarHBondContact O-N 3.12Å; L73-I117 HydrophobicContact CD2-CD1 4.09Å
74	F	88.2	Confident	85.7	Confident	146 Å²	146	68.7 Å²	68.7	64%	0.64	34%	0.336	S	S	*	.	H	α-helix	trans	-59.2	-44.7	174.9	-179.4	-98.1	0	0	0	111.6	P70 G71 V72 Q76 F77 K78	P70-F74 VanDerWaalsContact O-CB 3.28Å; P70-F74 WeakPolarHBondContact O-CB 3.32Å; P70-F74 PolarHBondContact O-N 2.7Å; G71-F74 PolarHBondContact O-N 3.04Å; V72-F74 PolarHBondContact O-N 3.06Å; F74-Q76 VanDerWaalsContact C-N 3.29Å; F74-Q76 PolarHBondContact O-N 3.18Å; F74-F77 PolarHBondContact O-N 3.46Å; F74-K78 WeakPolarHBondContact O-CB 3.41Å; F74-K78 PolarHBondContact O-N 3.32Å
75	N	82.3	Confident	85.8	Confident	49 Å²	49	64 Å²	64	26%	0.262	31%	0.31	S	S	.	.	H	α-helix	trans	-65.7	-30	178	-76.2	-26.5	0	0	0	113	Y63 G71 V72 L73 Y79	Y63-N75 PolarHBondContact OH-ND2 3.37Å; G71-N75 WeakPolarHBondContact O-CB 3.28Å; G71-N75 PolarHBondContact O-N 3.16Å; G71-N75 PolarHBondContact O-ND2 3.47Å; V72-N75 PolarHBondContact O-N 3.33Å; L73-N75 VanDerWaalsContact C-N 3.32Å; L73-N75 PolarHBondContact O-N 3.11Å; N75-Y79 WeakPolarHBondContact O-CD2 3.32Å; N75-Y79 VanDerWaalsContact O-CE2 3.31Å; N75-Y79 WeakPolarHBondContact O-CE2 3.12Å
76	Q	83.9	Confident	86	Confident	15 Å²	15	57.9 Å²	57.9	7%	0.07	29%	0.285	C	S	.	.	H	α-helix	trans	-74.1	-47.3	173.4	-67.3	-49.2	-44.8	0	0	112.3	V72 L73 F74 K78 N82 L113 T116	V72-Q76 WeakPolarHBondContact O-CG 3.49Å; V72-Q76 PolarHBondContact O-N 3.02Å; L73-Q76 PolarHBondContact O-N 3.39Å; F74-Q76 VanDerWaalsContact C-N 3.29Å; F74-Q76 PolarHBondContact O-N 3.18Å; Q76-K78 VanDerWaalsContact C-N 3.34Å; Q76-K78 PolarHBondContact O-N 3.12Å; Q76-N82 VanDerWaalsContact O-CB 3.32Å; Q76-N82 WeakPolarHBondContact O-CB 3.46Å; Q76-N82 PolarHBondContact O-ND2 3.13Å; Q76-N82 PolarHBondContact OE1-ND2 3.48Å; Q76-L113 HydrophobicContact CB-CD2 4.35Å; Q76-T116 HydrophobicContact CG-CG2 4.07Å
77	F	87.1	Confident	86.1	Confident	41 Å²	41	55.1 Å²	55.1	18%	0.18	28%	0.278	C	S	.	.	H	α-helix	trans	-82.2	-8.2	-175.7	-67.6	-60.3	0	0	0	114.7	L73 F74 Y79 N82 L86 L113	L73-F77 HydrophobicContact CB-CD2 4.43Å; L73-F77 HydrophobicContact CD2-CE2 4.11Å; L73-F77 WeakPolarHBondContact O-CD2 3.34Å; L73-F77 PolarHBondContact O-N 3.12Å; F74-F77 PolarHBondContact O-N 3.46Å; F77-Y79 PolarHBondContact O-N 3.23Å; F77-N82 HydrophobicContact CD1-CB 3.95Å; F77-N82 HydrophobicContact CE1-CB 4.33Å; F77-L86 HydrophobicContact CD1-CB 4.24Å; F77-L86 HydrophobicContact CD1-CD2 4.02Å; F77-L86 HydrophobicContact CE1-CB 3.77Å; F77-L86 HydrophobicContact CE1-CD1 4.42Å; F77-L86 HydrophobicContact CE1-CD2 3.87Å; F77-L86 HydrophobicContact CE1-CG 4.24Å; F77-L86 HydrophobicContact CE2-CD2 4.37Å; F77-L86 HydrophobicContact CG-CD2 4.36Å; F77-L86 HydrophobicContact CZ-CB 4.44Å; F77-L86 HydrophobicContact CZ-CD1 4.27Å; F77-L86 HydrophobicContact CZ-CD2 4.04Å; F77-L86 HydrophobicContact CZ-CG 4.49Å; F77-L113 HydrophobicContact CE2-CD1 4.48Å; F77-L113 HydrophobicContact CE2-CD2 4.47Å; F77-L113 HydrophobicContact CZ-CD1 3.79Å; F77-L113 HydrophobicContact CZ-CD2 4.03Å
78	K	83.9	Confident	86.1	Confident	146 Å²	146	52.2 Å²	52.2	64%	0.635	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.1	-27.8	168.4	179.4	178.3	176.1	-177.8	0	112.4	F74 Q76	F74-K78 WeakPolarHBondContact O-CB 3.41Å; F74-K78 PolarHBondContact O-N 3.32Å; Q76-K78 VanDerWaalsContact C-N 3.34Å; Q76-K78 PolarHBondContact O-N 3.12Å
79	Y	79.6	Confident	86	Confident	66 Å²	66	50.5 Å²	50.5	26%	0.259	25%	0.252	S	S	.	.	S	Bend	trans	-86.7	134.7	178.5	-61.4	-78	0	0	0	111.6	N75 F77 F81 N82 L83 V293	N75-Y79 WeakPolarHBondContact O-CD2 3.32Å; N75-Y79 VanDerWaalsContact O-CE2 3.31Å; N75-Y79 WeakPolarHBondContact O-CE2 3.12Å; F77-Y79 PolarHBondContact O-N 3.23Å; Y79-F81 PolarHBondContact O-N 2.9Å; Y79-N82 PolarHBondContact O-N 2.66Å; Y79-L83 PolarHBondContact O-N 3.05Å; Y79-L83 VanDerWaalsContact O-N 3.14Å; Y79-V293 HydrophobicContact CE1-CG1 4.41Å; Y79-V293 WeakPolarHBondContact OH-CG2 3.31Å
80	F	83.1	Confident	86	Confident	61 Å²	61	48.9 Å²	48.9	27%	0.268	25%	0.247	S	C	.	.	H	α-helix	trans	-51.7	-41.7	-179.3	177.5	-100	0	0	0	112.8	N82 L83 Y84 T304 K305 F308	F80-N82 PolarHBondContact O-N 2.76Å; F80-L83 PolarHBondContact O-N 2.87Å; F80-Y84 WeakPolarHBondContact O-CB 3.13Å; F80-Y84 PolarHBondContact O-N 3.1Å; F80-T304 HydrophobicContact CD1-CG2 4.37Å; F80-T304 HydrophobicContact CE1-CG2 4.48Å; F80-K305 HydrophobicContact CD1-CG 3.76Å; F80-K305 HydrophobicContact CE1-CG 4.12Å; F80-K305 HydrophobicContact CG-CG 4.22Å; F80-F308 HydrophobicContact CE1-CB 3.96Å; F80-F308 HydrophobicContact CE1-CD1 4.46Å; F80-F308 HydrophobicContact CE1-CG 4.1Å; F80-F308 HydrophobicContact CZ-CB 4.05Å; F80-F308 AromaticContact CZ-CD1 3.72Å; F80-F308 HydrophobicContact CZ-CD1 3.72Å; F80-F308 HydrophobicContact CZ-CD2 4.13Å; F80-F308 HydrophobicContact CZ-CE1 4.19Å; F80-F308 AromaticContact CZ-CG 3.68Å; F80-F308 HydrophobicContact CZ-CG 3.68Å
81	F	78.9	Confident	85.9	Confident	16 Å²	16	46.3 Å²	46.3	7%	0.07	23%	0.231	C	C	.	.	H	α-helix	trans	-53.4	-52.5	178.9	-175.3	-83.6	0	0	0	112.9	Y79 F85 T304 P344 L347 R348	Y79-F81 PolarHBondContact O-N 2.9Å; F81-F85 HydrophobicContact CD1-CD2 4.12Å; F81-F85 AromaticContact CD1-CE2 3.93Å; F81-F85 HydrophobicContact CD1-CE2 3.93Å; F81-F85 HydrophobicContact CD2-CE2 4.28Å; F81-F85 AromaticContact CE1-CD2 3.89Å; F81-F85 HydrophobicContact CE1-CD2 3.89Å; F81-F85 AromaticContact CE1-CE2 3.48Å; F81-F85 HydrophobicContact CE1-CE2 3.48Å; F81-F85 VanDerWaalsContact CE1-CE2 3.48Å; F81-F85 AromaticContact CE2-CE2 3.87Å; F81-F85 HydrophobicContact CE2-CE2 3.87Å; F81-F85 HydrophobicContact CG-CE2 4.3Å; F81-F85 HydrophobicContact CZ-CD2 4.32Å; F81-F85 AromaticContact CZ-CE2 3.46Å; F81-F85 HydrophobicContact CZ-CE2 3.46Å; F81-F85 VanDerWaalsContact CZ-CE2 3.46Å; F81-F85 HydrophobicContact CZ-CZ 4.28Å; F81-F85 WeakPolarHBondContact O-CD2 3.5Å; F81-T304 HydrophobicContact CB-CG2 4.4Å; F81-T304 HydrophobicContact CD2-CG2 3.57Å; F81-T304 HydrophobicContact CE2-CG2 4.34Å; F81-T304 HydrophobicContact CG-CG2 4.42Å; F81-P344 WeakPolarHBondContact CZ-O 3.29Å; F81-L347 HydrophobicContact CE2-CB 4.33Å; F81-L347 HydrophobicContact CE2-CD2 4.34Å; F81-L347 HydrophobicContact CZ-CB 4.25Å; F81-R348 HydrophobicContact CD1-CB 4.13Å; F81-R348 HydrophobicContact CE1-CB 3.38Å; F81-R348 HydrophobicContact CE1-CG 4.27Å; F81-R348 HydrophobicContact CZ-CB 3.8Å
82	N	82.4	Confident	85.9	Confident	8 Å²	8	45.4 Å²	45.4	4%	0.043	22%	0.222	C	C	.	.	H	α-helix	trans	-73.5	-36.3	-178.3	-72.2	-25.1	0	0	0	111.9	Q76 F77 Y79 F80 F85 L86	Q76-N82 VanDerWaalsContact O-CB 3.32Å; Q76-N82 WeakPolarHBondContact O-CB 3.46Å; Q76-N82 PolarHBondContact O-ND2 3.13Å; Q76-N82 PolarHBondContact OE1-ND2 3.48Å; F77-N82 HydrophobicContact CD1-CB 3.95Å; F77-N82 HydrophobicContact CE1-CB 4.33Å; Y79-N82 PolarHBondContact O-N 2.66Å; F80-N82 PolarHBondContact O-N 2.76Å; N82-F85 PolarHBondContact O-N 2.95Å; N82-L86 PolarHBondContact O-N 3.23Å
83	L	87.6	Confident	86	Confident	72 Å²	72	51 Å²	51	38%	0.377	25%	0.246	S	C	.	.	H	α-helix	trans	-62.6	-41.9	176.7	-176.4	63.3	0	0	0	111.8	Y79 F80 F85 L86 L87	Y79-L83 PolarHBondContact O-N 3.05Å; Y79-L83 VanDerWaalsContact O-N 3.14Å; F80-L83 PolarHBondContact O-N 2.87Å; L83-F85 PolarHBondContact O-N 3.19Å; L83-L86 PolarHBondContact O-N 3.39Å; L83-L87 HydrophobicContact CG-CD1 4.3Å; L83-L87 WeakPolarHBondContact O-CG 3.11Å; L83-L87 PolarHBondContact O-N 3.45Å
84	Y	87.1	Confident	86	Confident	19 Å²	19	52 Å²	52	8%	0.075	25%	0.254	C	S	.	.	H	α-helix	trans	-57.5	-46.4	177.2	164.4	-106.1	0	0	0	112	F80 L86 L87 L88 F308 L311 V343	F80-Y84 WeakPolarHBondContact O-CB 3.13Å; F80-Y84 PolarHBondContact O-N 3.1Å; Y84-L86 PolarHBondContact O-N 2.89Å; Y84-L87 PolarHBondContact O-N 3.15Å; Y84-L88 WeakPolarHBondContact O-CB 3.46Å; Y84-L88 PolarHBondContact O-N 2.9Å; Y84-F308 AromaticContact CD2-CD2 3.73Å; Y84-F308 HydrophobicContact CD2-CD2 3.73Å; Y84-F308 AromaticContact CD2-CE2 3.7Å; Y84-F308 HydrophobicContact CD2-CE2 3.7Å; Y84-F308 AromaticContact CE2-CD2 3.62Å; Y84-F308 HydrophobicContact CE2-CD2 3.62Å; Y84-F308 AromaticContact CE2-CE2 3.62Å; Y84-F308 HydrophobicContact CE2-CE2 3.62Å; Y84-L311 HydrophobicContact CE2-CD2 4.34Å; Y84-L311 WeakPolarHBondContact OH-CD2 3.19Å; Y84-V343 HydrophobicContact CD1-CB 4.43Å; Y84-V343 HydrophobicContact CD1-CG1 4.11Å; Y84-V343 HydrophobicContact CE1-CB 3.72Å; Y84-V343 HydrophobicContact CE1-CG1 3.89Å; Y84-V343 HydrophobicContact CE1-CG2 4.16Å
85	F	85.6	Confident	85.8	Confident	9 Å²	9	52.3 Å²	52.3	4%	0.039	26%	0.258	C	S	.	.	H	α-helix	trans	-70.3	-31.4	179.7	-69.2	-58.2	0	0	0	113.8	F81 N82 L83 L88 A89 L109 V343 I345	F81-F85 HydrophobicContact CD1-CD2 4.12Å; F81-F85 AromaticContact CD1-CE2 3.93Å; F81-F85 HydrophobicContact CD1-CE2 3.93Å; F81-F85 HydrophobicContact CD2-CE2 4.28Å; F81-F85 AromaticContact CE1-CD2 3.89Å; F81-F85 HydrophobicContact CE1-CD2 3.89Å; F81-F85 AromaticContact CE1-CE2 3.48Å; F81-F85 HydrophobicContact CE1-CE2 3.48Å; F81-F85 VanDerWaalsContact CE1-CE2 3.48Å; F81-F85 AromaticContact CE2-CE2 3.87Å; F81-F85 HydrophobicContact CE2-CE2 3.87Å; F81-F85 HydrophobicContact CG-CE2 4.3Å; F81-F85 HydrophobicContact CZ-CD2 4.32Å; F81-F85 AromaticContact CZ-CE2 3.46Å; F81-F85 HydrophobicContact CZ-CE2 3.46Å; F81-F85 VanDerWaalsContact CZ-CE2 3.46Å; F81-F85 HydrophobicContact CZ-CZ 4.28Å; F81-F85 WeakPolarHBondContact O-CD2 3.5Å; N82-F85 PolarHBondContact O-N 2.95Å; L83-F85 PolarHBondContact O-N 3.19Å; F85-L88 HydrophobicContact CD1-CD2 4.08Å; F85-L88 HydrophobicContact CE1-CD2 4.49Å; F85-L88 PolarHBondContact O-N 3.46Å; F85-A89 WeakPolarHBondContact O-CB 3.46Å; F85-A89 PolarHBondContact O-N 2.97Å; F85-L109 HydrophobicContact CB-CD1 4.13Å; F85-V343 HydrophobicContact CE2-CG1 4.36Å; F85-V343 HydrophobicContact CZ-CB 4.35Å; F85-V343 HydrophobicContact CZ-CG1 3.78Å; F85-V343 WeakPolarHBondContact CZ-O 3.46Å; F85-I345 HydrophobicContact CD1-CB 4.47Å; F85-I345 HydrophobicContact CD1-CD1 4.24Å; F85-I345 HydrophobicContact CD1-CG1 3.44Å; F85-I345 VanDerWaalsContact CD1-CG1 3.44Å; F85-I345 HydrophobicContact CE1-CB 4.05Å; F85-I345 HydrophobicContact CE1-CD1 4.13Å; F85-I345 HydrophobicContact CE1-CG1 3.07Å; F85-I345 HydrophobicContact CE2-CB 4.49Å; F85-I345 HydrophobicContact CE2-CG1 4.31Å; F85-I345 HydrophobicContact CG-CG1 4.19Å; F85-I345 VanDerWaalsContact CZ-CA 3.41Å; F85-I345 HydrophobicContact CZ-CB 4.04Å; F85-I345 HydrophobicContact CZ-CG1 3.56Å
86	L	89	Confident	85.8	Confident	44 Å²	44	55.5 Å²	55.5	23%	0.23	27%	0.271	C	S	.	.	H	α-helix	trans	-62.3	-48.3	170.9	-178.4	64.9	0	0	0	110.7	F77 N82 L83 Y84 L88 A89 C90 W106 L109	F77-L86 HydrophobicContact CD1-CB 4.24Å; F77-L86 HydrophobicContact CD1-CD2 4.02Å; F77-L86 HydrophobicContact CE1-CB 3.77Å; F77-L86 HydrophobicContact CE1-CD1 4.42Å; F77-L86 HydrophobicContact CE1-CD2 3.87Å; F77-L86 HydrophobicContact CE1-CG 4.24Å; F77-L86 HydrophobicContact CE2-CD2 4.37Å; F77-L86 HydrophobicContact CG-CD2 4.36Å; F77-L86 HydrophobicContact CZ-CB 4.44Å; F77-L86 HydrophobicContact CZ-CD1 4.27Å; F77-L86 HydrophobicContact CZ-CD2 4.04Å; F77-L86 HydrophobicContact CZ-CG 4.49Å; N82-L86 PolarHBondContact O-N 3.23Å; L83-L86 PolarHBondContact O-N 3.39Å; Y84-L86 PolarHBondContact O-N 2.89Å; L86-L88 VanDerWaalsContact C-N 3.32Å; L86-L88 PolarHBondContact O-N 3.4Å; L86-A89 PolarHBondContact O-N 3.47Å; L86-C90 WeakPolarHBondContact O-CB 3.27Å; L86-C90 PolarHBondContact O-N 3.07Å; L86-C90 PolarHBondContact O-SG 2.79Å; L86-W106 HydrophobicContact CD1-CH2 4.17Å; L86-L109 HydrophobicContact CD1-CD2 4.27Å
87	L	89.6	Confident	85.7	Confident	110 Å²	110	55.9 Å²	55.9	58%	0.576	27%	0.273	S	S	*	.	H	α-helix	trans	-61.8	-41.1	177.1	-67.5	174.3	0	0	0	111.7	L83 Y84 C90 S91	L83-L87 HydrophobicContact CG-CD1 4.3Å; L83-L87 WeakPolarHBondContact O-CG 3.11Å; L83-L87 PolarHBondContact O-N 3.45Å; Y84-L87 PolarHBondContact O-N 3.15Å; L87-C90 PolarHBondContact O-N 3.09Å; L87-S91 PolarHBondContact O-N 3.03Å
88	L	87.3	Confident	85.4	Confident	13 Å²	13	58.3 Å²	58.3	7%	0.068	28%	0.281	C	S	.	.	H	α-helix	trans	-60	-49	175	-171.4	75.6	0	0	0	111.2	Y84 F85 L86 C90 S91 Y105 L337	Y84-L88 WeakPolarHBondContact O-CB 3.46Å; Y84-L88 PolarHBondContact O-N 2.9Å; F85-L88 HydrophobicContact CD1-CD2 4.08Å; F85-L88 HydrophobicContact CE1-CD2 4.49Å; F85-L88 PolarHBondContact O-N 3.46Å; L86-L88 VanDerWaalsContact C-N 3.32Å; L86-L88 PolarHBondContact O-N 3.4Å; L88-C90 PolarHBondContact O-N 3.02Å; L88-S91 PolarHBondContact O-N 2.82Å; L88-S91 PolarHBondContact O-OG 2.99Å; L88-Y105 HydrophobicContact CD2-CD1 3.91Å; L88-Y105 HydrophobicContact CD2-CE1 4.1Å; L88-Y105 HydrophobicContact CG-CD1 4.12Å; L88-Y105 HydrophobicContact CG-CE1 4.29Å; L88-L337 HydrophobicContact CD1-CD2 3.32Å; L88-L337 HydrophobicContact CG-CD2 4.4Å
89	A	87.3	Confident	85	Confident	1 Å²	1	53 Å²	53	1%	0.008	26%	0.26	C	S	.	.	H	α-helix	trans	-65.3	-39.2	179.4	0	0	0	0	0	112.4	F85 L86 Q92 W106 L109	F85-A89 WeakPolarHBondContact O-CB 3.46Å; F85-A89 PolarHBondContact O-N 2.97Å; L86-A89 PolarHBondContact O-N 3.47Å; A89-Q92 PolarHBondContact O-N 2.6Å; A89-W106 HydrophobicContact CB-CD2 4.03Å; A89-W106 HydrophobicContact CB-CG 4.34Å; A89-W106 HydrophobicContact CB-CZ2 3.92Å; A89-W106 PolarHBondContact O-NE1 3.37Å; A89-W106 VanDerWaalsContact O-NE1 3.12Å; A89-L109 HydrophobicContact CB-CD2 4.14Å
90	C	90.2	Very high	84.7	Confident	56 Å²	56	51.2 Å²	51.2	38%	0.378	26%	0.262	S	S	.	.	H	α-helix	trans	-64.8	-36.5	175.1	-72.4	0	0	0	0	112.6	L86 L87 L88 Q92 F93	L86-C90 WeakPolarHBondContact O-CB 3.27Å; L86-C90 PolarHBondContact O-N 3.07Å; L86-C90 PolarHBondContact O-SG 2.79Å; L87-C90 PolarHBondContact O-N 3.09Å; L88-C90 PolarHBondContact O-N 3.02Å; C90-Q92 PolarHBondContact O-N 2.97Å; C90-F93 WeakPolarHBondContact O-CD2 3.15Å; C90-F93 PolarHBondContact O-N 3.01Å
91	S	88.9	Confident	84.5	Confident	28 Å²	28	50.3 Å²	50.3	20%	0.196	27%	0.265	C	S	.	.	H	α-helix	trans	-60.8	-25.9	179.7	73.4	0	0	0	0	113.6	L87 L88 F93 V94 L337	L87-S91 PolarHBondContact O-N 3.03Å; L88-S91 PolarHBondContact O-N 2.82Å; L88-S91 PolarHBondContact O-OG 2.99Å; S91-F93 PolarHBondContact O-N 2.87Å; S91-V94 WeakPolarHBondContact O-CB 3.49Å; S91-V94 PolarHBondContact O-N 2.74Å; S91-V94 VanDerWaalsContact O-N 3.14Å; S91-L337 WeakPolarHBondContact OG-CD2 3.1Å
92	Q	87.2	Confident	84.8	Confident	0 Å²	0	52.5 Å²	52.5	0%	0	28%	0.277	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72	-13.7	-178.8	-56.5	-55.1	-62.3	0	0	114	A89 C90 V94 R98 L102 Y105 L337	A89-Q92 PolarHBondContact O-N 2.6Å; C90-Q92 PolarHBondContact O-N 2.97Å; Q92-V94 PolarHBondContact O-N 2.87Å; Q92-R98 PolarHBondContact O-NE 2.95Å; Q92-R98 VanDerWaalsContact O-NE 3.08Å; Q92-L102 HydrophobicContact CB-CD2 3.77Å; Q92-L102 WeakPolarHBondContact O-CD2 3.39Å; Q92-Y105 HydrophobicContact CG-CD1 4.38Å; Q92-Y105 HydrophobicContact CG-CD2 3.54Å; Q92-Y105 HydrophobicContact CG-CE2 3.77Å; Q92-Y105 HydrophobicContact CG-CG 3.86Å; Q92-L337 VanDerWaalsContact NE2-CD1 3.32Å; Q92-L337 VanDerWaalsContact NE2-CD2 3.3Å
93	F	88.9	Confident	84.8	Confident	119 Å²	119	56.2 Å²	56.2	52%	0.522	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.5	-25.9	171	-71.8	-62.7	0	0	0	112.2	C90 S91 E95 R98 L102 W106	C90-F93 WeakPolarHBondContact O-CD2 3.15Å; C90-F93 PolarHBondContact O-N 3.01Å; S91-F93 PolarHBondContact O-N 2.87Å; F93-E95 PolarHBondContact O-N 3.46Å; F93-R98 PolarHBondContact O-NH2 3.05Å; F93-L102 HydrophobicContact CD1-CD1 4.46Å; F93-L102 HydrophobicContact CD1-CD2 4.17Å; F93-L102 HydrophobicContact CE1-CD1 4.27Å; F93-L102 HydrophobicContact CE1-CD2 4.35Å; F93-W106 AromaticContact CE2-CE2 3.83Å; F93-W106 AromaticContact CE2-CZ2 3.59Å; F93-W106 HydrophobicContact CE2-CZ2 3.59Å; F93-W106 AromaticContact CE2-NE1 3.68Å; F93-W106 HydrophobicContact CZ-CZ2 4.18Å; F93-W106 AromaticContact CZ-NE1 3.77Å
94	V	88.4	Confident	84.3	Confident	72 Å²	72	53.7 Å²	53.7	44%	0.436	28%	0.282	S	S	.	.	S	Bend	trans	-76.8	112.9	176.7	-175.4	0	0	0	0	109.5	S91 Q92 E96 L97 R98	S91-V94 WeakPolarHBondContact O-CB 3.49Å; S91-V94 PolarHBondContact O-N 2.74Å; S91-V94 VanDerWaalsContact O-N 3.14Å; Q92-V94 PolarHBondContact O-N 2.87Å; V94-E96 VanDerWaalsContact C-N 3.3Å; V94-E96 HydrophobicContact CG1-CB 4.44Å; V94-E96 PolarHBondContact O-N 3.18Å; V94-L97 HydrophobicContact CB-CB 4.26Å; V94-L97 HydrophobicContact CB-CD1 4.09Å; V94-L97 HydrophobicContact CB-CG 4.19Å; V94-L97 HydrophobicContact CG1-CB 4.4Å; V94-L97 HydrophobicContact CG1-CD1 4.09Å; V94-L97 HydrophobicContact CG1-CG 3.93Å; V94-L97 HydrophobicContact CG2-CD1 4.48Å; V94-L97 PolarHBondContact O-N 3.4Å; V94-R98 PolarHBondContact O-N 3.23Å
95	E	82.9	Confident	84	Confident	154 Å²	154	54 Å²	54	72%	0.72	28%	0.283	S	S	*	.	G	3₁₀ helix	trans	-60.5	-36.4	-175	-66.1	-173.8	164	0	0	113.1	F93 L97 R98	F93-E95 PolarHBondContact O-N 3.46Å; E95-L97 PolarHBondContact O-N 2.96Å; E95-R98 PolarHBondContact O-N 3.01Å
96	E	82.1	Confident	84	Confident	115 Å²	115	57.7 Å²	57.7	54%	0.537	30%	0.297	S	S	.	.	G	3₁₀ helix	trans	-65.2	-22	177.5	-61.3	-165.5	156.8	0	0	113.8	V94 R327	V94-E96 VanDerWaalsContact C-N 3.3Å; V94-E96 HydrophobicContact CG1-CB 4.44Å; V94-E96 PolarHBondContact O-N 3.18Å; E96-R327 IonicContact OE1-NH1 3.58Å
97	L	81.8	Confident	83.7	Confident	23 Å²	23	60.2 Å²	60.2	12%	0.12	31%	0.314	C	S	.	.	G	3₁₀ helix	trans	-102.8	-9.3	-178	-60.2	-179.2	0	0	0	112.9	V94 E95 L99 L330 F333 L337	V94-L97 HydrophobicContact CB-CB 4.26Å; V94-L97 HydrophobicContact CB-CD1 4.09Å; V94-L97 HydrophobicContact CB-CG 4.19Å; V94-L97 HydrophobicContact CG1-CB 4.4Å; V94-L97 HydrophobicContact CG1-CD1 4.09Å; V94-L97 HydrophobicContact CG1-CG 3.93Å; V94-L97 HydrophobicContact CG2-CD1 4.48Å; V94-L97 PolarHBondContact O-N 3.4Å; E95-L97 PolarHBondContact O-N 2.96Å; L97-L99 PolarHBondContact O-N 3.31Å; L97-L330 HydrophobicContact CD2-CD2 3.96Å; L97-F333 HydrophobicContact CD2-CB 3.62Å; L97-F333 HydrophobicContact CD2-CG 4.41Å; L97-L337 HydrophobicContact CB-CD1 4.01Å; L97-L337 WeakPolarHBondContact O-CD1 3.27Å
98	R	81.2	Confident	83	Confident	93 Å²	93	56.2 Å²	56.2	35%	0.351	29%	0.294	S	S	.	.			trans	-68.9	121.5	-171.2	-169.5	179.6	-67	159.8	4.8	111.1	Q92 F93 V94 E95 G100	Q92-R98 PolarHBondContact O-NE 2.95Å; Q92-R98 VanDerWaalsContact O-NE 3.08Å; F93-R98 PolarHBondContact O-NH2 3.05Å; V94-R98 PolarHBondContact O-N 3.23Å; E95-R98 PolarHBondContact O-N 3.01Å; R98-G100 VanDerWaalsContact CG-O 3.26Å; R98-G100 WeakPolarHBondContact CG-O 3.46Å
99	L	75.8	Confident	82.8	Confident	34 Å²	34	56 Å²	56	18%	0.178	29%	0.293	C	S	.	.			trans	-101.9	-23	175.4	-67	179.6	0	0	0	113.5	L97 R334 L337 L338	L97-L99 PolarHBondContact O-N 3.31Å; L99-R334 WeakPolarHBondContact CD1-O 3.49Å; L99-R334 HydrophobicContact CD2-CB 4.44Å; L99-L337 HydrophobicContact CD1-CB 3.44Å; L99-L337 VanDerWaalsContact CD1-CB 3.44Å; L99-L337 HydrophobicContact CG-CB 4.21Å; L99-L338 HydrophobicContact CD1-CB 3.96Å; L99-L338 HydrophobicContact CD1-CD1 4.48Å; L99-L338 VanDerWaalsContact CD1-N 3.34Å
100	G	73.8	Confident	82.8	Confident	29 Å²	29	57.7 Å²	57.7	30%	0.299	31%	0.311	S	S	.	.	S	Bend	trans	-156.2	-175.4	-175.3	0	0	0	0	0	112.2	R98	R98-G100 VanDerWaalsContact CG-O 3.26Å; R98-G100 WeakPolarHBondContact CG-O 3.46Å
101	A	79.4	Confident	82.3	Confident	42 Å²	42	59.7 Å²	59.7	35%	0.347	32%	0.317	S	S	.	.			trans	-72.9	143.2	-177.1	0	0	0	0	0	112.3	H103 T104	A101-H103 WeakPolarHBondContact CB-CE1 3.37Å; A101-H103 WeakPolarHBondContact CB-ND1 3.42Å; A101-H103 PolarHBondContact O-N 3.09Å; A101-H103 VanDerWaalsContact O-N 3.12Å; A101-T104 HydrophobicContact CB-CG2 4.4Å; A101-T104 WeakPolarHBondContact O-CB 3.17Å; A101-T104 WeakPolarHBondContact O-CG2 3.35Å; A101-T104 PolarHBondContact O-N 2.99Å; A101-T104 PolarHBondContact O-OG1 3.44Å
102	L	84.1	Confident	81.8	Confident	61 Å²	61	58.9 Å²	58.9	32%	0.319	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.9	-35.4	-175.7	-66.1	170.4	0	0	0	113.7	Q92 F93 T104 Y105 W106	Q92-L102 HydrophobicContact CB-CD2 3.77Å; Q92-L102 WeakPolarHBondContact O-CD2 3.39Å; F93-L102 HydrophobicContact CD1-CD1 4.46Å; F93-L102 HydrophobicContact CD1-CD2 4.17Å; F93-L102 HydrophobicContact CE1-CD1 4.27Å; F93-L102 HydrophobicContact CE1-CD2 4.35Å; L102-T104 PolarHBondContact O-N 3Å; L102-Y105 PolarHBondContact O-N 3.02Å; L102-W106 PolarHBondContact O-N 2.81Å
103	H	82.1	Confident	81.6	Confident	86 Å²	86	60 Å²	60	40%	0.398	32%	0.317	S	S	.	.	H	α-helix	trans	-63.6	-26.1	-178.9	61.2	-101.2	0	0	0	113.1	A101 Y105 V107	A101-H103 WeakPolarHBondContact CB-CE1 3.37Å; A101-H103 WeakPolarHBondContact CB-ND1 3.42Å; A101-H103 PolarHBondContact O-N 3.09Å; A101-H103 VanDerWaalsContact O-N 3.12Å; H103-Y105 PolarHBondContact O-N 2.92Å; H103-V107 HydrophobicContact CB-CG2 4.1Å; H103-V107 VanDerWaalsContact O-CB 3.29Å; H103-V107 WeakPolarHBondContact O-CB 3.36Å; H103-V107 VanDerWaalsContact O-CG2 3.31Å; H103-V107 WeakPolarHBondContact O-CG2 3.33Å; H103-V107 PolarHBondContact O-N 3.13Å
104	T	77.7	Confident	81.5	Confident	19 Å²	19	60.7 Å²	60.7	12%	0.117	32%	0.32	C	S	.	.	H	α-helix	trans	-64.2	-25.4	-179.9	62.2	0	0	0	0	112.8	A101 L102 P108 I877	A101-T104 HydrophobicContact CB-CG2 4.4Å; A101-T104 WeakPolarHBondContact O-CB 3.17Å; A101-T104 WeakPolarHBondContact O-CG2 3.35Å; A101-T104 PolarHBondContact O-N 2.99Å; A101-T104 PolarHBondContact O-OG1 3.44Å; L102-T104 PolarHBondContact O-N 3Å; T104-P108 WeakPolarHBondContact O-CD 3.46Å; T104-P108 WeakPolarHBondContact O-CG 3.23Å; T104-I877 HydrophobicContact CG2-CD1 3.76Å; T104-I877 HydrophobicContact CG2-CG1 4.28Å
105	Y	80.8	Confident	81.2	Confident	25 Å²	25	59.9 Å²	59.9	10%	0.098	31%	0.313	C	S	.	.	H	α-helix	trans	-105	-40.9	-178.9	-60.4	-90.8	0	0	0	112.8	L88 Q92 L102 H103	L88-Y105 HydrophobicContact CD2-CD1 3.91Å; L88-Y105 HydrophobicContact CD2-CE1 4.1Å; L88-Y105 HydrophobicContact CG-CD1 4.12Å; L88-Y105 HydrophobicContact CG-CE1 4.29Å; Q92-Y105 HydrophobicContact CG-CD1 4.38Å; Q92-Y105 HydrophobicContact CG-CD2 3.54Å; Q92-Y105 HydrophobicContact CG-CE2 3.77Å; Q92-Y105 HydrophobicContact CG-CG 3.86Å; L102-Y105 PolarHBondContact O-N 3.02Å; H103-Y105 PolarHBondContact O-N 2.92Å
106	W	85.2	Confident	80.9	Confident	88 Å²	88	52.8 Å²	52.8	33%	0.333	28%	0.28	S	S	.	.	H	α-helix	trans	-76.5	-35.1	-175.9	-80.7	95.4	0	0	0	113.8	L86 A89 F93 L102 L109 G110	L86-W106 HydrophobicContact CD1-CH2 4.17Å; A89-W106 HydrophobicContact CB-CD2 4.03Å; A89-W106 HydrophobicContact CB-CG 4.34Å; A89-W106 HydrophobicContact CB-CZ2 3.92Å; A89-W106 PolarHBondContact O-NE1 3.37Å; A89-W106 VanDerWaalsContact O-NE1 3.12Å; F93-W106 AromaticContact CE2-CE2 3.83Å; F93-W106 AromaticContact CE2-CZ2 3.59Å; F93-W106 HydrophobicContact CE2-CZ2 3.59Å; F93-W106 AromaticContact CE2-NE1 3.68Å; F93-W106 HydrophobicContact CZ-CZ2 4.18Å; F93-W106 AromaticContact CZ-NE1 3.77Å; L102-W106 PolarHBondContact O-N 2.81Å; W106-L109 HydrophobicContact CZ3-CD2 4.48Å; W106-L109 PolarHBondContact O-N 2.83Å; W106-G110 PolarHBondContact O-N 2.9Å
107	V	82.9	Confident	81.1	Confident	97 Å²	97	49.2 Å²	49.2	59%	0.588	26%	0.264	S	S	*	.	H	α-helix	trans	-65.1	-48.5	-178.6	173.6	0	0	0	0	111.7	H103 L109 G110 L111	H103-V107 HydrophobicContact CB-CG2 4.1Å; H103-V107 VanDerWaalsContact O-CB 3.29Å; H103-V107 WeakPolarHBondContact O-CB 3.36Å; H103-V107 VanDerWaalsContact O-CG2 3.31Å; H103-V107 WeakPolarHBondContact O-CG2 3.33Å; H103-V107 PolarHBondContact O-N 3.13Å; V107-L109 PolarHBondContact O-N 2.96Å; V107-G110 PolarHBondContact O-N 3.47Å; V107-L111 PolarHBondContact O-N 3.38Å
108	P	76.1	Confident	81.3	Confident	26 Å²	26	50.7 Å²	50.7	17%	0.169	28%	0.275	C	S	.	.	H	α-helix	trans	-59.9	-44.1	176.2	-25.7	36.1	0	0	0	113.1	T104 L111 V112 I345	T104-P108 WeakPolarHBondContact O-CD 3.46Å; T104-P108 WeakPolarHBondContact O-CG 3.23Å; P108-L111 PolarHBondContact O-N 3.38Å; P108-V112 WeakPolarHBondContact O-CG2 3.44Å; P108-V112 PolarHBondContact O-N 2.99Å; P108-V112 VanDerWaalsContact O-N 3.1Å; P108-I345 HydrophobicContact CB-CG2 4.03Å
109	L	82.9	Confident	81.2	Confident	7 Å²	7	47.5 Å²	47.5	4%	0.037	26%	0.263	C	S	.	.	H	α-helix	trans	-62.9	-44.8	178.5	-179.3	62.8	0	0	0	111.7	F85 L86 A89 W106 V107 L111 V112 L113	F85-L109 HydrophobicContact CB-CD1 4.13Å; L86-L109 HydrophobicContact CD1-CD2 4.27Å; A89-L109 HydrophobicContact CB-CD2 4.14Å; W106-L109 HydrophobicContact CZ3-CD2 4.48Å; W106-L109 PolarHBondContact O-N 2.83Å; V107-L109 PolarHBondContact O-N 2.96Å; L109-L111 VanDerWaalsContact C-N 3.33Å; L109-L111 PolarHBondContact O-N 3.26Å; L109-V112 PolarHBondContact O-N 3.43Å; L109-L113 HydrophobicContact CD1-CD1 4.31Å; L109-L113 HydrophobicContact CD1-CG 4.45Å; L109-L113 HydrophobicContact CG-CD1 4.16Å; L109-L113 WeakPolarHBondContact O-CG 3.5Å; L109-L113 PolarHBondContact O-N 3.49Å
110	G	85.6	Confident	81.5	Confident	38 Å²	38	46.1 Å²	46.1	39%	0.392	26%	0.255	S	S	.	.	H	α-helix	trans	-59.6	-42.2	176.5	0	0	0	0	0	112.4	W106 V107 L113 F114	W106-G110 PolarHBondContact O-N 2.9Å; V107-G110 PolarHBondContact O-N 3.47Å; G110-L113 PolarHBondContact O-N 2.96Å; G110-F114 VanDerWaalsContact O-CB 3.25Å; G110-F114 WeakPolarHBondContact O-CB 3.38Å; G110-F114 PolarHBondContact O-N 3.03Å
111	L	81.3	Confident	82.1	Confident	97 Å²	97	46 Å²	46	51%	0.508	25%	0.252	S	S	.	.	H	α-helix	trans	-62.3	-44.3	176.2	-175.4	69.8	0	0	0	112	V107 P108 L109 F114 I115	V107-L111 PolarHBondContact O-N 3.38Å; P108-L111 PolarHBondContact O-N 3.38Å; L109-L111 VanDerWaalsContact C-N 3.33Å; L109-L111 PolarHBondContact O-N 3.26Å; L111-F114 PolarHBondContact O-N 3.04Å; L111-I115 HydrophobicContact CD1-CD1 4.44Å; L111-I115 HydrophobicContact CG-CD1 4.22Å; L111-I115 WeakPolarHBondContact O-CG1 3.28Å; L111-I115 PolarHBondContact O-N 3.26Å; L111-I115 VanDerWaalsContact O-N 3.07Å
112	V	77.6	Confident	82.3	Confident	11 Å²	11	47.7 Å²	47.7	7%	0.067	25%	0.254	C	S	.	.	H	α-helix	trans	-60.1	-48.7	178	-177.9	0	0	0	0	110.9	P108 L109 T116 V349	P108-V112 WeakPolarHBondContact O-CG2 3.44Å; P108-V112 PolarHBondContact O-N 2.99Å; P108-V112 VanDerWaalsContact O-N 3.1Å; L109-V112 PolarHBondContact O-N 3.43Å; V112-T116 PolarHBondContact O-N 2.99Å; V112-T116 PolarHBondContact O-OG1 3.22Å; V112-V349 HydrophobicContact CB-CG2 4.05Å; V112-V349 HydrophobicContact CG1-CG2 4.07Å; V112-V349 HydrophobicContact CG2-CG2 3.23Å
113	L	84	Confident	81.8	Confident	25 Å²	25	46.7 Å²	46.7	13%	0.131	25%	0.247	C	C	.	.	H	α-helix	trans	-65.3	-40.8	-179.9	-67.5	172.7	0	0	0	111.1	Q76 F77 L109 G110 T116 I117	Q76-L113 HydrophobicContact CB-CD2 4.35Å; F77-L113 HydrophobicContact CE2-CD1 4.48Å; F77-L113 HydrophobicContact CE2-CD2 4.47Å; F77-L113 HydrophobicContact CZ-CD1 3.79Å; F77-L113 HydrophobicContact CZ-CD2 4.03Å; L109-L113 HydrophobicContact CD1-CD1 4.31Å; L109-L113 HydrophobicContact CD1-CG 4.45Å; L109-L113 HydrophobicContact CG-CD1 4.16Å; L109-L113 WeakPolarHBondContact O-CG 3.5Å; L109-L113 PolarHBondContact O-N 3.49Å; G110-L113 PolarHBondContact O-N 2.96Å; L113-T116 PolarHBondContact O-N 3.28Å; L113-I117 HydrophobicContact CB-CD1 4.41Å; L113-I117 WeakPolarHBondContact O-CB 3.45Å; L113-I117 WeakPolarHBondContact O-CD1 3.37Å; L113-I117 WeakPolarHBondContact O-CG1 3.46Å; L113-I117 PolarHBondContact O-N 3.46Å
114	F	86.7	Confident	81.9	Confident	133 Å²	133	43.2 Å²	43.2	58%	0.583	23%	0.231	S	C	*	.	H	α-helix	trans	-59.8	-48.2	178.4	177.3	-100.2	0	0	0	112.4	G110 L111 T116 I117 T118	G110-F114 VanDerWaalsContact O-CB 3.25Å; G110-F114 WeakPolarHBondContact O-CB 3.38Å; G110-F114 PolarHBondContact O-N 3.03Å; L111-F114 PolarHBondContact O-N 3.04Å; F114-T116 VanDerWaalsContact C-N 3.27Å; F114-T116 PolarHBondContact O-N 3.42Å; F114-I117 PolarHBondContact O-N 3.14Å; F114-T118 VanDerWaalsContact O-CB 3.29Å; F114-T118 WeakPolarHBondContact O-CB 3.44Å; F114-T118 PolarHBondContact O-N 3.22Å; F114-T118 PolarHBondContact O-OG1 3.38Å
115	I	80.4	Confident	82.2	Confident	54 Å²	54	47 Å²	47	28%	0.277	25%	0.25	S	C	.	.	H	α-helix	trans	-59.8	-42.5	177.5	-67.9	169	0	0	0	110.2	L111 R119 V349 M356	L111-I115 HydrophobicContact CD1-CD1 4.44Å; L111-I115 HydrophobicContact CG-CD1 4.22Å; L111-I115 WeakPolarHBondContact O-CG1 3.28Å; L111-I115 PolarHBondContact O-N 3.26Å; L111-I115 VanDerWaalsContact O-N 3.07Å; I115-R119 WeakPolarHBondContact O-CB 3.45Å; I115-R119 PolarHBondContact O-N 2.79Å; I115-V349 HydrophobicContact CD1-CG1 4.44Å; I115-M356 HydrophobicContact CG2-CE 4.3Å
116	T	77.6	Confident	82.2	Confident	6 Å²	6	53.7 Å²	53.7	4%	0.037	28%	0.275	C	S	.	.	H	α-helix	trans	-70	-44.8	-176.8	-51.1	0	0	0	0	112.5	Q76 V112 L113 F114 R119 E120	Q76-T116 HydrophobicContact CG-CG2 4.07Å; V112-T116 PolarHBondContact O-N 2.99Å; V112-T116 PolarHBondContact O-OG1 3.22Å; L113-T116 PolarHBondContact O-N 3.28Å; F114-T116 VanDerWaalsContact C-N 3.27Å; F114-T116 PolarHBondContact O-N 3.42Å; T116-R119 PolarHBondContact O-N 3.42Å; T116-E120 PolarHBondContact O-N 2.68Å; T116-E120 VanDerWaalsContact O-N 3.08Å
117	I	86.9	Confident	81.8	Confident	39 Å²	39	51 Å²	51	20%	0.2	27%	0.27	C	S	.	.	H	α-helix	trans	-64	-43.7	177.1	-68.1	164.8	0	0	0	110.3	F68 L69 V72 L73 L113 F114 R119 E120 A121	F68-I117 HydrophobicContact CE1-CG2 3.97Å; F68-I117 HydrophobicContact CZ-CG2 4.31Å; L69-I117 HydrophobicContact CD1-CD1 4.09Å; V72-I117 HydrophobicContact CG1-CG1 3.93Å; L73-I117 HydrophobicContact CD2-CD1 4.09Å; L113-I117 HydrophobicContact CB-CD1 4.41Å; L113-I117 WeakPolarHBondContact O-CB 3.45Å; L113-I117 WeakPolarHBondContact O-CD1 3.37Å; L113-I117 WeakPolarHBondContact O-CG1 3.46Å; L113-I117 PolarHBondContact O-N 3.46Å; F114-I117 PolarHBondContact O-N 3.14Å; I117-R119 VanDerWaalsContact C-N 3.33Å; I117-R119 PolarHBondContact O-N 3.39Å; I117-E120 PolarHBondContact O-N 2.99Å; I117-A121 WeakPolarHBondContact O-CB 3.4Å; I117-A121 PolarHBondContact O-N 3.32Å
118	T	85.5	Confident	81.9	Confident	55 Å²	55	51.7 Å²	51.7	34%	0.337	26%	0.262	S	S	.	.	H	α-helix	trans	-62	-42.3	178.6	-57.5	0	0	0	0	111.1	F114 A121 I122	F114-T118 VanDerWaalsContact O-CB 3.29Å; F114-T118 WeakPolarHBondContact O-CB 3.44Å; F114-T118 PolarHBondContact O-N 3.22Å; F114-T118 PolarHBondContact O-OG1 3.38Å; T118-A121 PolarHBondContact O-N 3.37Å; T118-I122 HydrophobicContact CG2-CD1 4.1Å; T118-I122 VanDerWaalsContact O-CG1 3.28Å; T118-I122 WeakPolarHBondContact O-CG1 3.39Å; T118-I122 PolarHBondContact O-N 2.97Å
119	R	79.8	Confident	82.3	Confident	26 Å²	26	55.3 Å²	55.3	10%	0.098	28%	0.279	C	S	.	.	H	α-helix	trans	-59.9	-51.4	176	-169.4	-168.2	78.4	-162.5	-1.2	111.7	I115 T116 I117 A121 I122 E123 M356 T377	I115-R119 WeakPolarHBondContact O-CB 3.45Å; I115-R119 PolarHBondContact O-N 2.79Å; T116-R119 PolarHBondContact O-N 3.42Å; I117-R119 VanDerWaalsContact C-N 3.33Å; I117-R119 PolarHBondContact O-N 3.39Å; R119-A121 VanDerWaalsContact C-N 3.29Å; R119-A121 PolarHBondContact O-N 2.69Å; R119-I122 PolarHBondContact O-N 3.44Å; R119-E123 PolarHBondContact O-N 2.97Å; R119-M356 HydrophobicContact CB-CE 4.48Å; R119-M356 HydrophobicContact CG-CE 4.2Å; R119-T377 VanDerWaalsContact NH2-CG2 3.3Å
120	E	81.1	Confident	82.1	Confident	5 Å²	5	58.4 Å²	58.4	2%	0.023	29%	0.291	C	S	.	.	H	α-helix	trans	-62.6	-38.1	-179.8	-161.8	80.1	-176.3	0	0	111.2	Y63 F68 V72 T116 I117 I122 E123 E124	Y63-E120 HydrophobicContact CE2-CG 4.24Å; F68-E120 HydrophobicContact CE2-CB 4.18Å; F68-E120 HydrophobicContact CE2-CG 4.03Å; F68-E120 HydrophobicContact CZ-CB 4.29Å; V72-E120 HydrophobicContact CG2-CB 4.33Å; V72-E120 HydrophobicContact CG2-CG 3.85Å; T116-E120 PolarHBondContact O-N 2.68Å; T116-E120 VanDerWaalsContact O-N 3.08Å; I117-E120 PolarHBondContact O-N 2.99Å; E120-I122 PolarHBondContact O-N 3.4Å; E120-E123 PolarHBondContact O-N 3.32Å; E120-E124 PolarHBondContact O-N 3.13Å
121	A	86.4	Confident	81.9	Confident	27 Å²	27	57 Å²	57	22%	0.223	27%	0.274	C	S	.	.	H	α-helix	trans	-61.3	-43.3	176.5	0	0	0	0	0	111.9	F68 I117 T118 R119 E123 E124 I125	F68-A121 HydrophobicContact CE1-CB 4.2Å; F68-A121 HydrophobicContact CE2-CB 4.41Å; F68-A121 HydrophobicContact CZ-CB 3.65Å; I117-A121 WeakPolarHBondContact O-CB 3.4Å; I117-A121 PolarHBondContact O-N 3.32Å; T118-A121 PolarHBondContact O-N 3.37Å; R119-A121 VanDerWaalsContact C-N 3.29Å; R119-A121 PolarHBondContact O-N 2.69Å; A121-E123 VanDerWaalsContact C-N 3.33Å; A121-E123 PolarHBondContact O-N 3.49Å; A121-E124 PolarHBondContact O-N 3.13Å; A121-I125 WeakPolarHBondContact O-CB 3.4Å; A121-I125 WeakPolarHBondContact O-CD1 3.45Å; A121-I125 VanDerWaalsContact O-CG1 3.22Å; A121-I125 WeakPolarHBondContact O-CG1 3.44Å; A121-I125 PolarHBondContact O-N 3.22Å
122	I	83.2	Confident	82.2	Confident	76 Å²	76	58 Å²	58	39%	0.39	27%	0.274	S	S	.	.	H	α-helix	trans	-62	-41.7	177.4	-68.9	165	0	0	0	110.9	T118 R119 E120 R126	T118-I122 HydrophobicContact CG2-CD1 4.1Å; T118-I122 VanDerWaalsContact O-CG1 3.28Å; T118-I122 WeakPolarHBondContact O-CG1 3.39Å; T118-I122 PolarHBondContact O-N 2.97Å; R119-I122 PolarHBondContact O-N 3.44Å; E120-I122 PolarHBondContact O-N 3.4Å; I122-R126 VanDerWaalsContact CG2-NH2 3.31Å; I122-R126 WeakPolarHBondContact O-CG 3.24Å; I122-R126 PolarHBondContact O-N 2.96Å
123	E	74.8	Confident	82.6	Confident	41 Å²	41	63.8 Å²	63.8	19%	0.192	30%	0.301	C	S	.	.	H	α-helix	trans	-64.1	-43.1	177.7	-71	179.7	-169.9	0	0	111.8	R119 E120 A121 R126 C127	R119-E123 PolarHBondContact O-N 2.97Å; E120-E123 PolarHBondContact O-N 3.32Å; A121-E123 VanDerWaalsContact C-N 3.33Å; A121-E123 PolarHBondContact O-N 3.49Å; E123-R126 PolarHBondContact O-N 3.46Å; E123-C127 PolarHBondContact O-N 3.06Å; E123-C127 PolarHBondContact O-SG 3.12Å; E123-C127 VanDerWaalsContact O-SG 3.4Å
124	E	83	Confident	82.5	Confident	12 Å²	12	64.9 Å²	64.9	6%	0.056	31%	0.308	C	S	.	.	H	α-helix	trans	-68.2	-38.5	-179.7	-154.4	68.1	-171.5	0	0	112.4	Q61 K62 Y63 E120 A121 R126 C127 Y128	Q61-E124 VanDerWaalsContact CA-OE1 3.31Å; Q61-E124 WeakPolarHBondContact CA-OE1 2.91Å; Q61-E124 VanDerWaalsContact CB-OE1 3.28Å; Q61-E124 WeakPolarHBondContact CB-OE1 3.45Å; K62-E124 PolarHBondContact N-OE1 2.79Å; Y63-E124 PolarHBondContact N-OE1 2.91Å; E120-E124 PolarHBondContact O-N 3.13Å; A121-E124 PolarHBondContact O-N 3.13Å; E124-R126 VanDerWaalsContact C-N 3.34Å; E124-R126 PolarHBondContact O-N 3.36Å; E124-C127 PolarHBondContact O-N 3.4Å; E124-Y128 PolarHBondContact O-N 3.49Å
125	I	85.1	Confident	82.6	Confident	99 Å²	99	59.6 Å²	59.6	51%	0.508	29%	0.286	S	S	.	.	H	α-helix	trans	-62.6	-41.5	175.5	-70.8	165.6	0	0	0	110.8	A121 C127 Y128 L129	A121-I125 WeakPolarHBondContact O-CB 3.4Å; A121-I125 WeakPolarHBondContact O-CD1 3.45Å; A121-I125 VanDerWaalsContact O-CG1 3.22Å; A121-I125 WeakPolarHBondContact O-CG1 3.44Å; A121-I125 PolarHBondContact O-N 3.22Å; I125-C127 VanDerWaalsContact C-N 3.33Å; I125-C127 PolarHBondContact O-N 3.47Å; I125-Y128 WeakPolarHBondContact O-CB 3.32Å; I125-Y128 PolarHBondContact O-N 2.87Å; I125-L129 HydrophobicContact CG2-CD1 4.2Å; I125-L129 WeakPolarHBondContact O-CG 3.26Å; I125-L129 PolarHBondContact O-N 3.19Å
126	R	80	Confident	83.1	Confident	165 Å²	165	59.8 Å²	59.8	62%	0.623	29%	0.292	S	S	*	.	H	α-helix	trans	-63.6	-39.9	176.7	-71.2	178.8	-161.7	159.3	5.6	111.8	I122 E123 E124 L129 R130	I122-R126 VanDerWaalsContact CG2-NH2 3.31Å; I122-R126 WeakPolarHBondContact O-CG 3.24Å; I122-R126 PolarHBondContact O-N 2.96Å; E123-R126 PolarHBondContact O-N 3.46Å; E124-R126 VanDerWaalsContact C-N 3.34Å; E124-R126 PolarHBondContact O-N 3.36Å; R126-L129 PolarHBondContact O-N 3.38Å; R126-R130 PolarHBondContact O-N 2.84Å
127	C	76.9	Confident	83.7	Confident	33 Å²	33	63.1 Å²	63.1	22%	0.223	31%	0.307	C	S	.	.	H	α-helix	trans	-63.6	-44.7	175.8	-66.1	0	0	0	0	111.3	E123 E124 I125 L129 R130 D131	E123-C127 PolarHBondContact O-N 3.06Å; E123-C127 PolarHBondContact O-SG 3.12Å; E123-C127 VanDerWaalsContact O-SG 3.4Å; E124-C127 PolarHBondContact O-N 3.4Å; I125-C127 VanDerWaalsContact C-N 3.33Å; I125-C127 PolarHBondContact O-N 3.47Å; C127-L129 PolarHBondContact O-N 3.07Å; C127-R130 PolarHBondContact O-N 3.29Å; C127-D131 PolarHBondContact O-N 2.65Å
128	Y	84.3	Confident	84	Confident	110 Å²	110	65 Å²	65	43%	0.431	32%	0.32	S	S	.	.	H	α-helix	trans	-57	-46	175.6	175.1	-110	0	0	0	113.1	E124 I125 R130 D131 K132	E124-Y128 PolarHBondContact O-N 3.49Å; I125-Y128 WeakPolarHBondContact O-CB 3.32Å; I125-Y128 PolarHBondContact O-N 2.87Å; Y128-R130 VanDerWaalsContact C-N 3.32Å; Y128-R130 PolarHBondContact O-N 3.24Å; Y128-D131 PolarHBondContact O-N 3.47Å; Y128-K132 HydrophobicContact CE1-CD 4.32Å; Y128-K132 VanDerWaalsContact O-CB 3.29Å; Y128-K132 WeakPolarHBondContact O-CB 3.4Å; Y128-K132 PolarHBondContact O-N 3.17Å
129	L	85.4	Confident	84.4	Confident	102 Å²	102	62.6 Å²	62.6	53%	0.534	31%	0.305	S	S	.	.	H	α-helix	trans	-61.6	-41.4	-179.9	-71	172.8	0	0	0	111.7	I125 R126 C127 K132 E133	I125-L129 HydrophobicContact CG2-CD1 4.2Å; I125-L129 WeakPolarHBondContact O-CG 3.26Å; I125-L129 PolarHBondContact O-N 3.19Å; R126-L129 PolarHBondContact O-N 3.38Å; C127-L129 PolarHBondContact O-N 3.07Å; L129-K132 PolarHBondContact O-N 3.25Å; L129-E133 PolarHBondContact O-N 2.84Å
130	R	78.3	Confident	85.1	Confident	73 Å²	73	62.1 Å²	62.1	28%	0.275	31%	0.306	S	S	.	.	H	α-helix	trans	-65.4	-45.2	176.5	-178.2	176.4	61.9	-171.4	-2.3	112.2	R126 C127 Y128 K132 E133 V134	R126-R130 PolarHBondContact O-N 2.84Å; C127-R130 PolarHBondContact O-N 3.29Å; Y128-R130 VanDerWaalsContact C-N 3.32Å; Y128-R130 PolarHBondContact O-N 3.24Å; R130-K132 VanDerWaalsContact C-N 3.31Å; R130-K132 PolarHBondContact O-N 3.4Å; R130-E133 WeakPolarHBondContact O-CB 3.49Å; R130-E133 PolarHBondContact O-N 3.05Å; R130-V134 PolarHBondContact O-N 2.91Å
131	D	82.4	Confident	85.6	Confident	7 Å²	7	64.3 Å²	64.3	4%	0.037	32%	0.315	C	S	.	.	H	α-helix	trans	-66.2	-37.2	178.3	-69.5	-8.9	0	0	0	111.1	N60 C127 Y128 E133 V134 N135	N60-D131 WeakPolarHBondContact CB-OD2 3.31Å; N60-D131 PolarHBondContact N-OD2 3.23Å; N60-D131 PolarHBondContact ND2-OD1 3.3Å; C127-D131 PolarHBondContact O-N 2.65Å; Y128-D131 PolarHBondContact O-N 3.47Å; D131-E133 VanDerWaalsContact C-N 3.34Å; D131-E133 PolarHBondContact O-N 2.85Å; D131-V134 PolarHBondContact O-N 3.33Å; D131-N135 VanDerWaalsContact O-CB 3.31Å; D131-N135 WeakPolarHBondContact O-CB 3.26Å; D131-N135 VanDerWaalsContact O-CG 3.24Å; D131-N135 PolarHBondContact O-N 2.93Å; D131-N135 PolarHBondContact O-ND2 3.01Å
132	K	87.6	Confident	85.8	Confident	118 Å²	118	63.8 Å²	63.8	51%	0.513	31%	0.308	S	S	.	.	H	α-helix	trans	-61.8	-41.8	175.1	-175.6	179.3	178.4	-175.1	0	111.6	Y128 L129 R130 S136	Y128-K132 HydrophobicContact CE1-CD 4.32Å; Y128-K132 VanDerWaalsContact O-CB 3.29Å; Y128-K132 WeakPolarHBondContact O-CB 3.4Å; Y128-K132 PolarHBondContact O-N 3.17Å; L129-K132 PolarHBondContact O-N 3.25Å; R130-K132 VanDerWaalsContact C-N 3.31Å; R130-K132 PolarHBondContact O-N 3.4Å; K132-S136 WeakPolarHBondContact O-CB 3.22Å; K132-S136 PolarHBondContact O-N 3.2Å; K132-S136 PolarHBondContact O-OG 2.94Å; K132-S136 VanDerWaalsContact O-OG 3.05Å
133	E	86.1	Confident	86	Confident	134 Å²	134	62.3 Å²	62.3	63%	0.626	31%	0.305	S	S	*	.	H	α-helix	trans	-58.3	-53.1	177.3	-173.6	177.9	-179.6	0	0	111.1	L129 R130 D131 N135 S136 Q137	L129-E133 PolarHBondContact O-N 2.84Å; R130-E133 WeakPolarHBondContact O-CB 3.49Å; R130-E133 PolarHBondContact O-N 3.05Å; D131-E133 VanDerWaalsContact C-N 3.34Å; D131-E133 PolarHBondContact O-N 2.85Å; E133-N135 PolarHBondContact O-N 2.89Å; E133-S136 PolarHBondContact O-N 3.4Å; E133-S136 VanDerWaalsContact O-N 3.15Å; E133-S136 PolarHBondContact O-OG 3.49Å; E133-Q137 PolarHBondContact O-N 2.97Å
134	V	81.4	Confident	86.3	Confident	48 Å²	48	67.8 Å²	67.8	29%	0.291	33%	0.328	S	S	.	.	H	α-helix	trans	-60.8	-47	179.7	177.1	0	0	0	0	111.5	I58 R130 D131 S136 Q137	I58-V134 HydrophobicContact CD1-CG1 3.73Å; R130-V134 PolarHBondContact O-N 2.91Å; D131-V134 PolarHBondContact O-N 3.33Å; V134-S136 PolarHBondContact O-N 3.5Å; V134-Q137 PolarHBondContact O-N 2.94Å
135	N	88.7	Confident	86.1	Confident	22 Å²	22	78.9 Å²	78.9	12%	0.118	37%	0.37	C	S	.	.	H	α-helix	trans	-66.7	-23.4	-180	-72.4	-43.5	0	0	0	112.9	I58 D131 E133 S153	I58-N135 PolarHBondContact N-OD1 3.16Å; I58-N135 PolarHBondContact O-ND2 3.42Å; D131-N135 VanDerWaalsContact O-CB 3.31Å; D131-N135 WeakPolarHBondContact O-CB 3.26Å; D131-N135 VanDerWaalsContact O-CG 3.24Å; D131-N135 PolarHBondContact O-N 2.93Å; D131-N135 PolarHBondContact O-ND2 3.01Å; E133-N135 PolarHBondContact O-N 2.89Å; N135-S153 PolarHBondContact O-N 2.91Å
136	S	91.4	Very high	86	Confident	57 Å²	57	75.9 Å²	75.9	40%	0.399	36%	0.363	S	S	.	.	H	α-helix	trans	-88.5	-7.1	-178.6	72.4	0	0	0	0	115	K132 E133 V134	K132-S136 WeakPolarHBondContact O-CB 3.22Å; K132-S136 PolarHBondContact O-N 3.2Å; K132-S136 PolarHBondContact O-OG 2.94Å; K132-S136 VanDerWaalsContact O-OG 3.05Å; E133-S136 PolarHBondContact O-N 3.4Å; E133-S136 VanDerWaalsContact O-N 3.15Å; E133-S136 PolarHBondContact O-OG 3.49Å; V134-S136 PolarHBondContact O-N 3.5Å
137	Q	89.6	Confident	86.4	Confident	77 Å²	77	72 Å²	72	36%	0.36	36%	0.358	S	S	.	.			trans	-56.5	140.8	177.3	-70.3	-175.8	-4.6	0	0	111.5	E133 V134 Y139 K151 S152	E133-Q137 PolarHBondContact O-N 2.97Å; V134-Q137 PolarHBondContact O-N 2.94Å; Q137-Y139 HydrophobicContact CB-CE2 3.8Å; Q137-Y139 PolarHBondContact OE1-OH 2.9Å; Q137-K151 CarbonylContact O-C 3.56Å; Q137-K151 WeakPolarHBondContact O-CA 3.37Å; Q137-S152 PolarHBondContact O-N 3.02Å
138	V	93.5	Very high	87.1	Confident	77 Å²	77	73.8 Å²	73.8	47%	0.467	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	135.8	-172.9	-178	0	0	0	0	110.4	K149 Q167	V138-K149 HydrophobicContact CG1-CB 3.8Å; V138-K149 HydrophobicContact CG1-CD 4.17Å; V138-K149 HydrophobicContact CG1-CG 4.26Å; V138-Q167 PolarHBondContact O-NE2 2.91Å
139	Y	93.8	Very high	87.5	Confident	5 Å²	5	76.6 Å²	76.6	2%	0.02	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	154.1	-178.8	-69.4	-84	0	0	0	111	Q137 K149 V150 I155 I161 Q167 R168 P170	Q137-Y139 HydrophobicContact CB-CE2 3.8Å; Q137-Y139 PolarHBondContact OE1-OH 2.9Å; Y139-K149 CarbonylContact O-C 3.01Å; Y139-K149 WeakPolarHBondContact O-CA 3.39Å; Y139-V150 PolarHBondContact N-O 2.85Å; Y139-V150 PolarHBondContact O-N 3.06Å; Y139-I155 HydrophobicContact CD2-CD1 3.91Å; Y139-I155 HydrophobicContact CG-CD1 4.06Å; Y139-I161 HydrophobicContact CD1-CG2 4.42Å; Y139-Q167 HydrophobicContact CE1-CG 3.94Å; Y139-R168 WeakPolarHBondContact CE1-O 3.48Å; Y139-R168 PolarHBondContact OH-O 3.22Å; Y139-P170 HydrophobicContact CD1-CB 4.09Å; Y139-P170 HydrophobicContact CD1-CG 3.77Å; Y139-P170 HydrophobicContact CD2-CB 3.95Å; Y139-P170 HydrophobicContact CD2-CG 4.37Å; Y139-P170 HydrophobicContact CE1-CB 3.83Å; Y139-P170 HydrophobicContact CE1-CG 3.83Å; Y139-P170 HydrophobicContact CE2-CB 3.69Å; Y139-P170 HydrophobicContact CE2-CG 4.43Å; Y139-P170 HydrophobicContact CG-CB 4.15Å; Y139-P170 HydrophobicContact CG-CG 4.05Å
140	S	94.1	Very high	87.9	Confident	16 Å²	16	73.1 Å²	73.1	11%	0.112	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	118	177.7	-72.4	0	0	0	0	109.7	I161 I162	S140-I161 WeakPolarHBondContact O-CA 3.38Å; S140-I162 PolarHBondContact O-N 3.38Å
141	K	92.4	Very high	88.7	Confident	52 Å²	52	75.7 Å²	75.7	23%	0.226	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	130.3	176.7	177.6	178.4	178.2	165.8	0	110.1	T147 V148 V150 D159 L160 I161	K141-T147 WeakPolarHBondContact O-CA 3.09Å; K141-V148 WeakPolarHBondContact CB-O 3.29Å; K141-V148 PolarHBondContact N-O 2.76Å; K141-V148 PolarHBondContact O-N 2.88Å; K141-V150 HydrophobicContact CB-CG2 3.8Å; K141-V150 HydrophobicContact CD-CG2 3.97Å; K141-D159 HydrophobicContact CD-CB 4.35Å; K141-D159 VanDerWaalsContact CE-OD1 3.27Å; K141-D159 WeakPolarHBondContact CE-OD1 3.47Å; K141-D159 WeakPolarHBondContact CE-OD2 3.28Å; K141-D159 IonicContact NZ-OD1 3.81Å; K141-D159 PolarHBondContact NZ-OD1 2.9Å; K141-D159 IonicContact NZ-OD2 3.83Å; K141-D159 PolarHBondContact NZ-OD2 2.91Å; K141-L160 CarbonylContact C-O 3.19Å; K141-L160 WeakPolarHBondContact CA-O 3.37Å; K141-I161 HydrophobicContact CB-CD1 3.97Å; K141-I161 HydrophobicContact CG-CD1 4.22Å
142	L	90	Very high	89.2	Confident	15 Å²	15	75.6 Å²	75.6	8%	0.079	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78	125.4	173.8	-167.9	74.3	0	0	0	110	L160 I162 A213 L217	L142-L160 HydrophobicContact CB-CB 3.88Å; L142-L160 HydrophobicContact CD2-CD1 4.01Å; L142-L160 PolarHBondContact N-O 2.89Å; L142-I162 HydrophobicContact CD1-CD1 4.29Å; L142-A213 WeakPolarHBondContact CD2-O 3.49Å; L142-L217 HydrophobicContact CD2-CD1 4.09Å; L142-L217 HydrophobicContact CD2-CG 4.06Å; L142-L217 HydrophobicContact CG-CD1 3.9Å; L142-L217 HydrophobicContact CG-CG 4.37Å
143	S	86.7	Confident	89.4	Confident	46 Å²	46	72.2 Å²	72.2	32%	0.322	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	162.3	179.1	-175.2	0	0	0	0	110.9	R145 G146 L217	S143-R145 PolarHBondContact O-N 2.87Å; S143-G146 WeakPolarHBondContact CA-O 3.38Å; S143-G146 VanDerWaalsContact CB-O 3.29Å; S143-G146 WeakPolarHBondContact CB-O 3.32Å; S143-G146 PolarHBondContact N-O 2.88Å; S143-G146 PolarHBondContact O-N 3.06Å; S143-L217 WeakPolarHBondContact O-CD1 3.41Å
144	K	81	Confident	89.7	Confident	156 Å²	156	67.5 Å²	67.5	68%	0.678	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.5	-20.8	178	-66.3	-174.3	178.1	-177	0	113.3	L217	K144-L217 HydrophobicContact CG-CD1 4.46Å
145	R	78.4	Confident	90.2	Very high	245 Å²	245	65.2 Å²	65.2	93%	0.925	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.4	10.2	178	-60.4	-177.8	-178.2	179.5	0.2	113.4	S143	S143-R145 PolarHBondContact O-N 2.87Å
146	G	84.3	Confident	90.3	Very high	35 Å²	35	68.7 Å²	68.7	36%	0.361	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	107.2	-166.2	-175.1	0	0	0	0	0	113.6	S143	S143-G146 WeakPolarHBondContact CA-O 3.38Å; S143-G146 VanDerWaalsContact CB-O 3.29Å; S143-G146 WeakPolarHBondContact CB-O 3.32Å; S143-G146 PolarHBondContact N-O 2.88Å; S143-G146 PolarHBondContact O-N 3.06Å
147	T	88.1	Confident	90.3	Very high	85 Å²	85	66.2 Å²	66.2	52%	0.521	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	124.3	-177.5	-51.6	0	0	0	0	111.2	K141 I162	K141-T147 WeakPolarHBondContact O-CA 3.09Å; T147-I162 HydrophobicContact CG2-CD1 4.07Å
148	V	92.3	Very high	90.3	Very high	70 Å²	70	63.4 Å²	63.4	42%	0.424	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	135	-180	180	0	0	0	0	109.8	K141 V150	K141-V148 WeakPolarHBondContact CB-O 3.29Å; K141-V148 PolarHBondContact N-O 2.76Å; K141-V148 PolarHBondContact O-N 2.88Å; V148-V150 HydrophobicContact CG1-CG2 4.38Å
149	K	93.1	Very high	90.2	Very high	168 Å²	168	60.2 Å²	60.2	73%	0.73	31%	0.312	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.7	130.3	175.1	-66.6	-170.4	179.6	-173.9	0	111.1	V138 Y139	V138-K149 HydrophobicContact CG1-CB 3.8Å; V138-K149 HydrophobicContact CG1-CD 4.17Å; V138-K149 HydrophobicContact CG1-CG 4.26Å; Y139-K149 CarbonylContact O-C 3.01Å; Y139-K149 WeakPolarHBondContact O-CA 3.39Å
150	V	93.9	Very high	90.2	Very high	30 Å²	30	60.1 Å²	60.1	18%	0.182	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	143.2	-178.7	-176.6	0	0	0	0	109.6	Y139 K141 V148 I155	Y139-V150 PolarHBondContact N-O 2.85Å; Y139-V150 PolarHBondContact O-N 3.06Å; K141-V150 HydrophobicContact CB-CG2 3.8Å; K141-V150 HydrophobicContact CD-CG2 3.97Å; V148-V150 HydrophobicContact CG1-CG2 4.38Å; V150-I155 HydrophobicContact CG1-CG1 4.46Å
151	K	94.1	Very high	90.2	Very high	126 Å²	126	59.4 Å²	59.4	55%	0.548	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	151.8	173.7	-65.2	-179.7	-179.7	177.7	0	110.7	Q137 S153 G154 I155	Q137-K151 CarbonylContact O-C 3.56Å; Q137-K151 WeakPolarHBondContact O-CA 3.37Å; K151-S153 PolarHBondContact O-N 3.46Å; K151-G154 WeakPolarHBondContact O-CA 3.44Å; K151-G154 PolarHBondContact O-N 3.21Å; K151-I155 PolarHBondContact O-N 3.32Å
152	S	92.1	Very high	90.3	Very high	6 Å²	6	58.1 Å²	58.1	4%	0.042	30%	0.303	C	S	.	.	G	3₁₀ helix	trans	-50.2	-45.1	177.3	-171.6	0	0	0	0	112.2	N56 Q137 G154 I155	N56-S152 PolarHBondContact ND2-O 3.34Å; N56-S152 VanDerWaalsContact ND2-O 3.12Å; Q137-S152 PolarHBondContact O-N 3.02Å; S152-G154 PolarHBondContact O-N 3.31Å; S152-G154 VanDerWaalsContact O-N 3.14Å; S152-I155 WeakPolarHBondContact O-CB 3.31Å; S152-I155 PolarHBondContact O-N 2.88Å
153	S	92.6	Very high	90.4	Very high	47 Å²	47	57.4 Å²	57.4	33%	0.329	30%	0.299	S	S	.	.	G	3₁₀ helix	trans	-61.8	-20.5	176.7	67.2	0	0	0	0	115.4	N56 N135 K151	N56-S153 VanDerWaalsContact O-CA 3.32Å; N56-S153 WeakPolarHBondContact O-CA 3.19Å; N135-S153 PolarHBondContact O-N 2.91Å; K151-S153 PolarHBondContact O-N 3.46Å
154	G	91.8	Very high	90.7	Very high	34 Å²	34	60.3 Å²	60.3	35%	0.351	31%	0.307	S	S	.	.	G	3₁₀ helix	trans	-94.3	-6.3	-178.4	0	0	0	0	0	114.3	K151 S152	K151-G154 WeakPolarHBondContact O-CA 3.44Å; K151-G154 PolarHBondContact O-N 3.21Å; S152-G154 PolarHBondContact O-N 3.31Å; S152-G154 VanDerWaalsContact O-N 3.14Å
155	I	92.6	Very high	91	Very high	1 Å²	1	57.5 Å²	57.5	1%	0.005	30%	0.295	C	S	.	.			trans	-71.3	138.1	179.4	-64.8	171.4	0	0	0	109.9	N56 Y139 V150 K151 S152 I161 P170 V273	N56-I155 HydrophobicContact CB-CB 4.46Å; Y139-I155 HydrophobicContact CD2-CD1 3.91Å; Y139-I155 HydrophobicContact CG-CD1 4.06Å; V150-I155 HydrophobicContact CG1-CG1 4.46Å; K151-I155 PolarHBondContact O-N 3.32Å; S152-I155 WeakPolarHBondContact O-CB 3.31Å; S152-I155 PolarHBondContact O-N 2.88Å; I155-I161 HydrophobicContact CD1-CD1 4.36Å; I155-I161 HydrophobicContact CG1-CD1 4.21Å; I155-I161 HydrophobicContact CG2-CD1 4.37Å; I155-I161 HydrophobicContact CG2-CG1 4.36Å; I155-P170 HydrophobicContact CD1-CB 3.46Å; I155-P170 VanDerWaalsContact CD1-CB 3.46Å; I155-P170 HydrophobicContact CD1-CG 3.59Å; I155-V273 HydrophobicContact CG2-CG1 4.26Å; I155-V273 HydrophobicContact CG2-CG2 3.8Å
156	Q	91.5	Very high	91.4	Very high	95 Å²	95	51 Å²	51	44%	0.444	28%	0.279	S	S	.	.			trans	-129.3	157.2	-178.9	-60.8	179.9	-2.6	0	0	111.4	G158 D159	Q156-G158 PolarHBondContact O-N 3.36Å; Q156-D159 PolarHBondContact N-OD2 2.79Å; Q156-D159 WeakPolarHBondContact O-CB 3.29Å; Q156-D159 VanDerWaalsContact O-CG 3.24Å; Q156-D159 PolarHBondContact O-N 3.44Å; Q156-D159 VanDerWaalsContact O-N 3.09Å
157	V	91	Very high	91.6	Very high	4 Å²	4	51.3 Å²	51.3	2%	0.024	27%	0.271	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.8	134.8	172.9	180	0	0	0	0	110.7	V41 R49 Y53 I274 T276	V41-V157 HydrophobicContact CG1-CG1 4.15Å; V41-V157 HydrophobicContact CG2-CG1 3.71Å; R49-V157 PolarHBondContact NH2-O 3.09Å; Y53-V157 HydrophobicContact CD1-CG2 4.29Å; Y53-V157 HydrophobicContact CD2-CB 3.46Å; Y53-V157 VanDerWaalsContact CD2-CB 3.46Å; Y53-V157 HydrophobicContact CD2-CG1 3.85Å; Y53-V157 HydrophobicContact CD2-CG2 3.72Å; Y53-V157 HydrophobicContact CE2-CB 3.83Å; Y53-V157 HydrophobicContact CE2-CG1 3.68Å; Y53-V157 HydrophobicContact CE2-CG2 4.39Å; Y53-V157 HydrophobicContact CG-CB 3.95Å; Y53-V157 HydrophobicContact CG-CG1 4.38Å; Y53-V157 HydrophobicContact CG-CG2 3.63Å; V157-I274 WeakPolarHBondContact CG1-O 3.46Å; V157-I274 WeakPolarHBondContact CG2-O 3.39Å; V157-T276 HydrophobicContact CG2-CG2 4.04Å
158	G	89.5	Confident	91.6	Very high	18 Å²	18	50.5 Å²	50.5	19%	0.186	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	86.9	-4.9	-174.2	0	0	0	0	0	115.1	V41 Q156 V273	V41-G158 VanDerWaalsContact CG1-CA 3.41Å; Q156-G158 PolarHBondContact O-N 3.36Å; G158-V273 PolarHBondContact N-O 3.35Å
159	D	91	Very high	91.7	Very high	10 Å²	10	47.2 Å²	47.2	5%	0.053	24%	0.238	C	C	.	.			trans	-71.3	136.4	174	-71.2	-10.1	0	0	0	110.7	K141 Q156 I161 V273	K141-D159 HydrophobicContact CD-CB 4.35Å; K141-D159 VanDerWaalsContact CE-OD1 3.27Å; K141-D159 WeakPolarHBondContact CE-OD1 3.47Å; K141-D159 WeakPolarHBondContact CE-OD2 3.28Å; K141-D159 IonicContact NZ-OD1 3.81Å; K141-D159 PolarHBondContact NZ-OD1 2.9Å; K141-D159 IonicContact NZ-OD2 3.83Å; K141-D159 PolarHBondContact NZ-OD2 2.91Å; Q156-D159 PolarHBondContact N-OD2 2.79Å; Q156-D159 WeakPolarHBondContact O-CB 3.29Å; Q156-D159 VanDerWaalsContact O-CG 3.24Å; Q156-D159 PolarHBondContact O-N 3.44Å; Q156-D159 VanDerWaalsContact O-N 3.09Å; D159-I161 HydrophobicContact CB-CD1 4.11Å; D159-I161 HydrophobicContact CB-CG1 4.43Å; D159-V273 WeakPolarHBondContact O-CG2 3.33Å; D159-V273 PolarHBondContact O-N 2.93Å
160	L	93.1	Very high	91.6	Very high	4 Å²	4	39.7 Å²	39.7	2%	0.021	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	115.2	170.7	-68.1	174.2	0	0	0	108.7	L43 K141 L142 L176 L216 L217 G271 V272	L43-L160 HydrophobicContact CD2-CD2 4.39Å; K141-L160 CarbonylContact C-O 3.19Å; K141-L160 WeakPolarHBondContact CA-O 3.37Å; L142-L160 HydrophobicContact CB-CB 3.88Å; L142-L160 HydrophobicContact CD2-CD1 4.01Å; L142-L160 PolarHBondContact N-O 2.89Å; L160-L176 HydrophobicContact CD2-CD1 3.52Å; L160-L216 HydrophobicContact CD1-CB 4.25Å; L160-L217 HydrophobicContact CD1-CD2 3.58Å; L160-L217 HydrophobicContact CD1-CG 4.02Å; L160-G271 WeakPolarHBondContact CA-O 3.25Å; L160-V272 HydrophobicContact CD2-CB 3.82Å; L160-V272 HydrophobicContact CD2-CG2 4.33Å
161	I	94.4	Very high	91.7	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	135.4	-176.7	-56.4	-61	0	0	0	109.2	Y139 S140 K141 I155 D159 V163 P170 M173 V270 G271 V273	Y139-I161 HydrophobicContact CD1-CG2 4.42Å; S140-I161 WeakPolarHBondContact O-CA 3.38Å; K141-I161 HydrophobicContact CB-CD1 3.97Å; K141-I161 HydrophobicContact CG-CD1 4.22Å; I155-I161 HydrophobicContact CD1-CD1 4.36Å; I155-I161 HydrophobicContact CG1-CD1 4.21Å; I155-I161 HydrophobicContact CG2-CD1 4.37Å; I155-I161 HydrophobicContact CG2-CG1 4.36Å; D159-I161 HydrophobicContact CB-CD1 4.11Å; D159-I161 HydrophobicContact CB-CG1 4.43Å; I161-V163 HydrophobicContact CG2-CG2 4.13Å; I161-P170 HydrophobicContact CG2-CG 4.09Å; I161-M173 HydrophobicContact CB-CE 3.75Å; I161-M173 HydrophobicContact CG1-CE 4.33Å; I161-M173 HydrophobicContact CG2-CE 4.2Å; I161-V270 WeakPolarHBondContact O-CA 3.41Å; I161-G271 PolarHBondContact N-O 3.32Å; I161-G271 PolarHBondContact O-N 3.04Å; I161-V273 HydrophobicContact CG1-CG2 3.74Å
162	I	94	Very high	91.7	Very high	26 Å²	26	32.3 Å²	32.3	13%	0.133	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	122.3	172	-50.1	177.3	0	0	0	107	S140 L142 T147 V269 V270	S140-I162 PolarHBondContact O-N 3.38Å; L142-I162 HydrophobicContact CD1-CD1 4.29Å; T147-I162 HydrophobicContact CG2-CD1 4.07Å; I162-V269 CarbonylContact C-O 3.5Å; I162-V269 WeakPolarHBondContact CA-O 3.44Å; I162-V270 HydrophobicContact CG1-CG2 4.26Å
163	V	93.8	Very high	91.8	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	124.2	177.9	-173.3	0	0	0	0	108.1	I161 Q167 M173 V264 T268 V269	I161-V163 HydrophobicContact CG2-CG2 4.13Å; V163-Q167 HydrophobicContact CG1-CB 3.88Å; V163-Q167 HydrophobicContact CG1-CG 4.3Å; V163-M173 HydrophobicContact CG2-CE 4.33Å; V163-M173 HydrophobicContact CG2-SD 4.3Å; V163-V264 HydrophobicContact CB-CG2 4.18Å; V163-V264 HydrophobicContact CG1-CB 4.29Å; V163-V264 HydrophobicContact CG1-CG2 3.59Å; V163-T268 WeakPolarHBondContact O-CA 3.45Å; V163-V269 PolarHBondContact N-O 3.44Å; V163-V269 PolarHBondContact O-N 2.83Å
164	E	91.8	Very high	91.9	Very high	107 Å²	107	30 Å²	30	50%	0.5	16%	0.155	S	C	.	.			trans	-84.4	165.4	-179.6	-65.6	177.4	-173.8	0	0	111.8	N166 Q167	E164-N166 PolarHBondContact O-N 2.62Å; E164-Q167 HydrophobicContact CB-CB 4.44Å; E164-Q167 WeakPolarHBondContact O-CB 3.42Å; E164-Q167 PolarHBondContact O-N 3Å
165	K	88.4	Confident	92.1	Very high	96 Å²	96	28.3 Å²	28.3	42%	0.417	14%	0.139	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53	136.8	173.1	-177.3	179.5	177.8	-176.1	0	110.3	Q167 A265 G267	K165-Q167 PolarHBondContact O-N 2.83Å; K165-Q167 VanDerWaalsContact O-N 3.17Å; K165-A265 WeakPolarHBondContact CE-O 3.33Å; K165-A265 WeakPolarHBondContact CG-O 3.25Å; K165-G267 PolarHBondContact N-O 3.28Å
166	N	85.8	Confident	92.1	Very high	109 Å²	109	28.3 Å²	28.3	58%	0.583	14%	0.138	S	C	*	.	T	Hydrogen-bonded Turn	trans	62.8	9.3	-177.7	-60.8	-34.8	0	0	0	115.2	E164 V264	E164-N166 PolarHBondContact O-N 2.62Å; N166-V264 WeakPolarHBondContact CA-O 3.25Å; N166-V264 PolarHBondContact N-O 3.17Å
167	Q	88.5	Confident	92.1	Very high	41 Å²	41	25.5 Å²	25.5	19%	0.192	12%	0.124	C	C	.	.	P	Polyproline II helix	trans	-89.6	146.5	172.7	-164.1	176.2	19.1	0	0	110.5	V138 Y139 V163 E164 K165 V264	V138-Q167 PolarHBondContact O-NE2 2.91Å; Y139-Q167 HydrophobicContact CE1-CG 3.94Å; V163-Q167 HydrophobicContact CG1-CB 3.88Å; V163-Q167 HydrophobicContact CG1-CG 4.3Å; E164-Q167 HydrophobicContact CB-CB 4.44Å; E164-Q167 WeakPolarHBondContact O-CB 3.42Å; E164-Q167 PolarHBondContact O-N 3Å; K165-Q167 PolarHBondContact O-N 2.83Å; K165-Q167 VanDerWaalsContact O-N 3.17Å; Q167-V264 PolarHBondContact O-N 3Å
168	R	89.1	Confident	92.1	Very high	68 Å²	68	25.5 Å²	25.5	26%	0.257	12%	0.124	S	C	.	.	B	Isolated β-bridge	trans	-79.5	144.5	175.4	-74.2	-174.5	-174.3	-79.5	-5.5	111.2	Y139 D190 Q191 S261 T262 V263	Y139-R168 WeakPolarHBondContact CE1-O 3.48Å; Y139-R168 PolarHBondContact OH-O 3.22Å; R168-D190 IonicContact NH1-OD1 2.72Å; R168-Q191 VanDerWaalsContact CZ-CD 3.41Å; R168-Q191 VanDerWaalsContact NH2-NE2 3.12Å; R168-S261 PolarHBondContact NH1-O 3.42Å; R168-T262 CarbonylContact C-O 3.52Å; R168-T262 VanDerWaalsContact CA-O 3.23Å; R168-T262 WeakPolarHBondContact CA-O 3.21Å; R168-V263 HydrophobicContact CG-CG2 3.85Å
169	V	92.8	Very high	92	Very high	2 Å²	2	28.2 Å²	28.2	1%	0.012	14%	0.14	C	C	.	.	P	Polyproline II helix	trans	-71.2	126.5	173.2	176.5	0	0	0	0	109.2	A171 M173 L187 L258 W259 A260 S261 T262 V264	V169-A171 WeakPolarHBondContact CG1-O 3.28Å; V169-M173 HydrophobicContact CG1-CE 4.26Å; V169-M173 HydrophobicContact CG1-CG 3.9Å; V169-M173 HydrophobicContact CG1-SD 3.9Å; V169-L187 HydrophobicContact CG2-CD2 4.1Å; V169-L258 HydrophobicContact CG1-CB 4.24Å; V169-L258 HydrophobicContact CG2-CB 4.17Å; V169-W259 WeakPolarHBondContact CB-O 3.4Å; V169-A260 WeakPolarHBondContact O-CA 3.24Å; V169-S261 PolarHBondContact O-N 3.42Å; V169-T262 VanDerWaalsContact CG2-OG1 3.29Å; V169-T262 WeakPolarHBondContact CG2-OG1 3.39Å; V169-T262 PolarHBondContact N-O 3.03Å; V169-V264 HydrophobicContact CG2-CG2 4.18Å
170	P	92.7	Very high	91.5	Very high	10 Å²	10	30.3 Å²	30.3	7%	0.065	15%	0.149	C	C	.	.			trans	-81.2	-21.7	-171.1	27.3	-33.1	0	0	0	115.5	N56 Y139 I155 I161 M173	N56-P170 PolarHBondContact ND2-O 3.01Å; N56-P170 VanDerWaalsContact ND2-O 3.11Å; Y139-P170 HydrophobicContact CD1-CB 4.09Å; Y139-P170 HydrophobicContact CD1-CG 3.77Å; Y139-P170 HydrophobicContact CD2-CB 3.95Å; Y139-P170 HydrophobicContact CD2-CG 4.37Å; Y139-P170 HydrophobicContact CE1-CB 3.83Å; Y139-P170 HydrophobicContact CE1-CG 3.83Å; Y139-P170 HydrophobicContact CE2-CB 3.69Å; Y139-P170 HydrophobicContact CE2-CG 4.43Å; Y139-P170 HydrophobicContact CG-CB 4.15Å; Y139-P170 HydrophobicContact CG-CG 4.05Å; I155-P170 HydrophobicContact CD1-CB 3.46Å; I155-P170 VanDerWaalsContact CD1-CB 3.46Å; I155-P170 HydrophobicContact CD1-CG 3.59Å; I161-P170 HydrophobicContact CG2-CG 4.09Å; P170-M173 HydrophobicContact CG-CE 4.46Å
171	A	94.2	Very high	90.6	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	19%	0.194	C	C	.	.	S	Bend	trans	-160.9	159.2	-174.3	0	0	0	0	0	109.1	V169 M173 V273 T276 L280	V169-A171 WeakPolarHBondContact CG1-O 3.28Å; A171-M173 PolarHBondContact O-N 3.19Å; A171-V273 HydrophobicContact CB-CG1 3.73Å; A171-V273 HydrophobicContact CB-CG2 4.38Å; A171-T276 HydrophobicContact CB-CG2 4.16Å; A171-L280 HydrophobicContact CB-CD2 4.15Å
172	D	94.6	Very high	89.4	Confident	1 Å²	1	45.4 Å²	45.4	1%	0.005	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.9	123.6	-179.8	-64.4	-22.7	0	0	0	109.9	W259 A260 I274 Y275 L280 R281	D172-W259 HydrophobicContact CB-CE3 3.94Å; D172-W259 HydrophobicContact CB-CZ3 4.24Å; D172-W259 WeakPolarHBondContact OD1-CA 3.34Å; D172-A260 WeakPolarHBondContact OD1-CB 3.05Å; D172-A260 PolarHBondContact OD1-N 3.17Å; D172-I274 PolarHBondContact O-N 3.37Å; D172-Y275 HydrophobicContact CB-CD2 3.9Å; D172-Y275 HydrophobicContact CB-CG 4.48Å; D172-Y275 PolarHBondContact N-O 3.18Å; D172-Y275 PolarHBondContact O-N 3.42Å; D172-L280 HydrophobicContact CB-CD2 4.33Å; D172-L280 WeakPolarHBondContact OD2-CA 3.27Å; D172-R281 PolarHBondContact OD2-N 3.02Å
173	M	94.8	Very high	88.6	Confident	1 Å²	1	45.1 Å²	45.1	1%	0.005	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	157.3	-171.6	59.1	171.7	46.7	0	0	113.1	I161 V163 V169 P170 A171 L258 V272 V273	I161-M173 HydrophobicContact CB-CE 3.75Å; I161-M173 HydrophobicContact CG1-CE 4.33Å; I161-M173 HydrophobicContact CG2-CE 4.2Å; V163-M173 HydrophobicContact CG2-CE 4.33Å; V163-M173 HydrophobicContact CG2-SD 4.3Å; V169-M173 HydrophobicContact CG1-CE 4.26Å; V169-M173 HydrophobicContact CG1-CG 3.9Å; V169-M173 HydrophobicContact CG1-SD 3.9Å; P170-M173 HydrophobicContact CG-CE 4.46Å; A171-M173 PolarHBondContact O-N 3.19Å; M173-L258 HydrophobicContact CG-CB 3.62Å; M173-L258 HydrophobicContact CG-CD1 3.79Å; M173-L258 HydrophobicContact CG-CG 4.13Å; M173-L258 WeakPolarHBondContact CG-O 3.45Å; M173-L258 PolarHBondContact N-O 3.14Å; M173-L258 PolarHBondContact O-N 3.25Å; M173-L258 HydrophobicContact SD-CB 4.2Å; M173-L258 HydrophobicContact SD-CD1 3.54Å; M173-L258 VanDerWaalsContact SD-CD1 3.54Å; M173-L258 HydrophobicContact SD-CG 4.44Å; M173-V272 CarbonylContact C-O 3.38Å; M173-V272 WeakPolarHBondContact CA-O 3.3Å; M173-V272 WeakPolarHBondContact CB-O 3.07Å; M173-V273 HydrophobicContact CE-CG2 4.18Å
174	I	95.3	Very high	88.1	Confident	2 Å²	2	45.9 Å²	45.9	1%	0.01	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	133.1	170.9	-60.4	-55.8	0	0	0	109.8	L176 V204 V223 F235 L252 N256 T257 G271 V272 I274	I174-L176 HydrophobicContact CG2-CD2 4.28Å; I174-L176 PolarHBondContact O-N 3.37Å; I174-V204 HydrophobicContact CG2-CG2 4.19Å; I174-V223 HydrophobicContact CG1-CG1 4.15Å; I174-F235 HydrophobicContact CD1-CD1 4.4Å; I174-F235 HydrophobicContact CD1-CE1 3.56Å; I174-F235 HydrophobicContact CD1-CZ 3.67Å; I174-L252 HydrophobicContact CD1-CD1 4.29Å; I174-L252 HydrophobicContact CG1-CD1 4.24Å; I174-L252 HydrophobicContact CG2-CD1 4.02Å; I174-L252 HydrophobicContact CG2-CD2 4.26Å; I174-N256 CarbonylContact C-O 3.6Å; I174-N256 WeakPolarHBondContact CA-O 3.48Å; I174-T257 HydrophobicContact CD1-CG2 3.85Å; I174-G271 CarbonylContact O-C 3.53Å; I174-G271 WeakPolarHBondContact O-CA 3.35Å; I174-V272 HydrophobicContact CB-CG1 3.88Å; I174-V272 PolarHBondContact N-O 3.49Å; I174-V272 PolarHBondContact O-N 2.98Å; I174-I274 HydrophobicContact CD1-CG1 4.49Å; I174-I274 HydrophobicContact CG1-CD1 4.12Å; I174-I274 HydrophobicContact CG1-CG1 3.77Å
175	F	94.8	Very high	87.8	Confident	0 Å²	0	40.8 Å²	40.8	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	112	-178.5	-173.8	-162.7	0	0	0	110.9	R177 T178 C185 R201 L202 P203 V204 N256 L258 V269	F175-R177 WeakPolarHBondContact CE2-O 3.46Å; F175-T178 HydrophobicContact CZ-CG2 4.07Å; F175-C185 HydrophobicContact CE1-CB 3.91Å; F175-C185 HydrophobicContact CZ-CB 3.64Å; F175-R201 HydrophobicContact CD1-CB 3.79Å; F175-R201 HydrophobicContact CE1-CB 4.02Å; F175-R201 WeakPolarHBondContact CE1-O 3.48Å; F175-L202 WeakPolarHBondContact CD1-O 3.34Å; F175-P203 HydrophobicContact CD1-CB 4.23Å; F175-P203 VanDerWaalsContact CD1-N 3.3Å; F175-P203 HydrophobicContact CD2-CB 4.21Å; F175-P203 HydrophobicContact CE1-CB 4.15Å; F175-P203 HydrophobicContact CE1-CG 4.36Å; F175-P203 VanDerWaalsContact CE1-N 3.35Å; F175-P203 HydrophobicContact CE2-CB 4.14Å; F175-P203 HydrophobicContact CG-CB 4.26Å; F175-P203 HydrophobicContact CZ-CB 4.11Å; F175-P203 HydrophobicContact CZ-CG 4.35Å; F175-P203 WeakPolarHBondContact O-CA 3.33Å; F175-V204 PolarHBondContact O-N 3.36Å; F175-V204 VanDerWaalsContact O-N 3.08Å; F175-N256 WeakPolarHBondContact CB-O 3.44Å; F175-N256 PolarHBondContact N-O 3.32Å; F175-L258 HydrophobicContact CB-CD1 3.96Å; F175-L258 HydrophobicContact CB-CD2 4.08Å; F175-L258 HydrophobicContact CB-CG 3.93Å; F175-L258 HydrophobicContact CD1-CD2 4.37Å; F175-L258 HydrophobicContact CD2-CD1 4.21Å; F175-L258 HydrophobicContact CG-CD1 4.24Å; F175-L258 HydrophobicContact CG-CD2 4.15Å; F175-L258 HydrophobicContact CG-CG 4.42Å; F175-V269 HydrophobicContact CD2-CG1 3.46Å; F175-V269 VanDerWaalsContact CD2-CG1 3.46Å; F175-V269 HydrophobicContact CE2-CB 4.17Å; F175-V269 HydrophobicContact CE2-CG1 3.46Å; F175-V269 VanDerWaalsContact CE2-CG1 3.46Å; F175-V269 HydrophobicContact CE2-CG2 3.94Å; F175-V269 HydrophobicContact CG-CG1 4.44Å; F175-V269 HydrophobicContact CZ-CG1 4.43Å; F175-V269 HydrophobicContact CZ-CG2 4.28Å
176	L	93.2	Very high	87.6	Confident	0 Å²	0	37.5 Å²	37.5	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	-38.4	-175.4	-60.7	175.7	0	0	0	112.9	L43 L160 I174 V204 T207 L216 F239 V270 V272	L43-L176 HydrophobicContact CD2-CD1 3.59Å; L43-L176 HydrophobicContact CD2-CD2 4.34Å; L160-L176 HydrophobicContact CD2-CD1 3.52Å; I174-L176 HydrophobicContact CG2-CD2 4.28Å; I174-L176 PolarHBondContact O-N 3.37Å; L176-V204 HydrophobicContact CD2-CG2 4.29Å; L176-T207 WeakPolarHBondContact O-CB 3.46Å; L176-T207 PolarHBondContact O-OG1 2.94Å; L176-L216 HydrophobicContact CB-CD1 4.34Å; L176-L216 HydrophobicContact CB-CD2 4.41Å; L176-F239 HydrophobicContact CD2-CD2 4.43Å; L176-F239 HydrophobicContact CD2-CE2 4.05Å; L176-V270 PolarHBondContact N-O 3.2Å; L176-V272 HydrophobicContact CD1-CB 3.98Å; L176-V272 HydrophobicContact CD1-CG1 4.02Å; L176-V272 HydrophobicContact CD2-CG1 4.32Å; L176-V272 HydrophobicContact CG-CG1 4.3Å
177	R	91.9	Very high	87.6	Confident	37 Å²	37	32.4 Å²	32.4	14%	0.14	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.2	145.3	-174.5	-172	-173.6	-178	80.7	-0.8	112.4	F175 T207 Q208 L210 P211 L216 V270	F175-R177 WeakPolarHBondContact CE2-O 3.46Å; R177-T207 PolarHBondContact NH1-O 2.93Å; R177-Q208 VanDerWaalsContact CA-OE1 3.26Å; R177-Q208 PolarHBondContact NH1-O 2.88Å; R177-L210 PolarHBondContact NH1-O 2.83Å; R177-L210 PolarHBondContact NH2-O 2.92Å; R177-P211 PolarHBondContact NH2-O 3.04Å; R177-L216 HydrophobicContact CB-CD1 4.38Å; R177-V270 HydrophobicContact CB-CB 4.28Å; R177-V270 PolarHBondContact N-O 3.04Å; R177-V270 PolarHBondContact O-N 3.24Å
178	T	90.5	Very high	87.3	Confident	3 Å²	3	34 Å²	34	2%	0.018	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	153.8	167.2	-177.7	0	0	0	0	112.8	F175 E180 P203 Q208 T268	F175-T178 HydrophobicContact CZ-CG2 4.07Å; T178-E180 VanDerWaalsContact C-N 3.34Å; T178-E180 HydrophobicContact CG2-CB 3.97Å; T178-E180 WeakPolarHBondContact OG1-CB 3.41Å; T178-E180 PolarHBondContact OG1-N 3.29Å; T178-E180 VanDerWaalsContact OG1-N 3.11Å; T178-P203 HydrophobicContact CG2-CG 4.47Å; T178-Q208 PolarHBondContact O-NE2 3.14Å; T178-Q208 VanDerWaalsContact O-NE2 3.1Å; T178-T268 VanDerWaalsContact CA-O 3.3Å; T178-T268 WeakPolarHBondContact CA-O 3.34Å; T178-T268 PolarHBondContact OG1-O 3.45Å
179	S	87.1	Confident	86.6	Confident	75 Å²	75	30.9 Å²	30.9	52%	0.524	15%	0.148	S	C	.	.	S	Bend	trans	-82.5	-7.3	169.1	64.6	0	0	0	0	114.2	T268	S179-T268 VanDerWaalsContact CB-OG1 3.25Å; S179-T268 WeakPolarHBondContact CB-OG1 3.34Å; S179-T268 PolarHBondContact N-O 3.2Å; S179-T268 VanDerWaalsContact N-O 3.08Å; S179-T268 PolarHBondContact OG-N 3.2Å; S179-T268 PolarHBondContact OG-OG1 3.07Å
180	E	81.4	Confident	85.3	Confident	54 Å²	54	30.9 Å²	30.9	25%	0.252	15%	0.148	S	C	.	.			trans	-63.2	134.5	175.7	-82.4	-85.4	174.3	0	0	111.9	T178 N182 G183 S184 S266 G267	T178-E180 VanDerWaalsContact C-N 3.34Å; T178-E180 HydrophobicContact CG2-CB 3.97Å; T178-E180 WeakPolarHBondContact OG1-CB 3.41Å; T178-E180 PolarHBondContact OG1-N 3.29Å; T178-E180 VanDerWaalsContact OG1-N 3.11Å; E180-N182 PolarHBondContact O-N 3.25Å; E180-G183 PolarHBondContact O-N 2.92Å; E180-S184 WeakPolarHBondContact CB-O 3.36Å; E180-S184 WeakPolarHBondContact CG-O 3.46Å; E180-S266 WeakPolarHBondContact OE1-CB 3.3Å; E180-S266 PolarHBondContact OE1-OG 2.91Å; E180-G267 PolarHBondContact OE1-N 3.39Å
181	R	73.9	Confident	84	Confident	252 Å²	252	32 Å²	32	95%	0.951	15%	0.152	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.9	-31.9	177	-66.7	-174.5	-178.9	-168.8	1.8	111.6	G183	R181-G183 PolarHBondContact O-N 3.4Å
182	N	69.4	Low	82.7	Confident	69 Å²	69	32.7 Å²	32.7	37%	0.369	16%	0.156	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.8	-1	-176.1	-60.7	16.6	0	0	0	112.5	E180 S184	E180-N182 PolarHBondContact O-N 3.25Å; N182-S184 PolarHBondContact O-N 3.45Å; N182-S184 VanDerWaalsContact O-N 3.12Å
183	G	77.1	Confident	81.1	Confident	21 Å²	21	33.1 Å²	33.1	22%	0.216	16%	0.158	C	C	.	.	S	Bend	trans	63.7	18.3	177	0	0	0	0	0	114.6	E180 R181 P203	E180-G183 PolarHBondContact O-N 2.92Å; R181-G183 PolarHBondContact O-N 3.4Å; G183-P203 WeakPolarHBondContact O-CD 3.3Å; G183-P203 WeakPolarHBondContact O-CG 3.42Å
184	S	81.9	Confident	79.2	Confident	16 Å²	16	33.5 Å²	33.5	11%	0.112	16%	0.162	C	C	.	.			trans	-138.8	160.3	-178.5	56.9	0	0	0	0	110.5	E180 N182	E180-S184 WeakPolarHBondContact CB-O 3.36Å; E180-S184 WeakPolarHBondContact CG-O 3.46Å; N182-S184 PolarHBondContact O-N 3.45Å; N182-S184 VanDerWaalsContact O-N 3.12Å
185	C	85.4	Confident	77.7	Confident	0 Å²	0	37 Å²	37	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	138.9	178.3	-177.5	0	0	0	0	109.7	F175 R201 S266 V269	F175-C185 HydrophobicContact CE1-CB 3.91Å; F175-C185 HydrophobicContact CZ-CB 3.64Å; C185-R201 PolarHBondContact N-O 3.47Å; C185-R201 VanDerWaalsContact N-O 3.1Å; C185-R201 PolarHBondContact O-N 3.39Å; C185-S266 PolarHBondContact SG-O 3.28Å; C185-V269 HydrophobicContact CB-CG2 4.03Å; C185-V269 WeakPolarHBondContact SG-CG2 3.26Å
186	F	85.3	Confident	76.1	Confident	26 Å²	26	38.7 Å²	38.7	11%	0.114	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89	139.5	169.8	-66	-80.2	0	0	0	110.3	W198 L200 A265	F186-W198 HydrophobicContact CB-CB 4.13Å; F186-W198 HydrophobicContact CB-CE3 4.21Å; F186-W198 HydrophobicContact CD1-CB 3.83Å; F186-W198 HydrophobicContact CG-CB 4.26Å; F186-L200 HydrophobicContact CD1-CB 4.32Å; F186-L200 HydrophobicContact CD1-CD1 4.09Å; F186-L200 HydrophobicContact CE1-CB 4.14Å; F186-L200 HydrophobicContact CE1-CD1 3.72Å; F186-L200 HydrophobicContact CE2-CD1 4.33Å; F186-L200 HydrophobicContact CZ-CD1 3.85Å; F186-A265 HydrophobicContact CB-CB 3.69Å; F186-A265 WeakPolarHBondContact O-CB 3.4Å; F186-A265 PolarHBondContact O-N 3.04Å
187	L	85.3	Confident	74.9	Confident	2 Å²	2	40.4 Å²	40.4	1%	0.01	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	143.9	168.4	-70.7	109.7	0	0	0	111	V169 K199 R201 L258 T262 V263 V264	V169-L187 HydrophobicContact CG2-CD2 4.1Å; L187-K199 PolarHBondContact N-O 3.43Å; L187-K199 PolarHBondContact O-N 3Å; L187-R201 HydrophobicContact CD1-CB 3.67Å; L187-R201 HydrophobicContact CD1-CG 3.13Å; L187-L258 HydrophobicContact CD1-CD2 3.3Å; L187-L258 HydrophobicContact CD2-CB 4.34Å; L187-L258 HydrophobicContact CD2-CD2 3.75Å; L187-L258 HydrophobicContact CG-CD2 4.14Å; L187-T262 WeakPolarHBondContact CD2-OG1 3.43Å; L187-V263 CarbonylContact C-O 3.48Å; L187-V263 VanDerWaalsContact CA-O 3.32Å; L187-V263 WeakPolarHBondContact CA-O 3.32Å; L187-V264 HydrophobicContact CD2-CG2 4.04Å
188	R	81.5	Confident	74.2	Confident	74 Å²	74	41.1 Å²	41.1	28%	0.279	20%	0.201	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	125.9	168.1	-163.3	167.6	68.4	-145.8	-0.7	109.3	D190 W198 T262 V263	R188-D190 HydrophobicContact CG-CB 4.01Å; R188-D190 IonicContact CZ-OD2 3.64Å; R188-D190 IonicContact NE-OD2 2.95Å; R188-D190 PolarHBondContact NE-OD2 3Å; R188-D190 IonicContact NH2-OD2 3.26Å; R188-W198 HydrophobicContact CB-CE3 3.96Å; R188-W198 HydrophobicContact CB-CH2 4.39Å; R188-W198 HydrophobicContact CB-CZ3 3.68Å; R188-W198 HydrophobicContact CG-CZ3 4.45Å; R188-T262 WeakPolarHBondContact O-CA 3.34Å; R188-T262 WeakPolarHBondContact O-CB 3.32Å; R188-V263 HydrophobicContact CB-CB 4.26Å; R188-V263 PolarHBondContact N-O 2.95Å; R188-V263 PolarHBondContact O-N 3Å
189	T	76.1	Confident	73.7	Confident	3 Å²	3	42.8 Å²	42.8	2%	0.018	21%	0.207	C	C	.	.			trans	-104.7	9.9	-178.1	56.6	0	0	0	0	114.4	Q191 L192 D193 K199 T262	T189-Q191 PolarHBondContact O-N 3.5Å; T189-L192 PolarHBondContact O-N 3.16Å; T189-D193 VanDerWaalsContact CB-OD1 3.29Å; T189-D193 WeakPolarHBondContact CB-OD1 3.43Å; T189-D193 WeakPolarHBondContact CB-OD2 3.33Å; T189-D193 PolarHBondContact O-N 3.45Å; T189-D193 VanDerWaalsContact OG1-CG 3.27Å; T189-D193 PolarHBondContact OG1-OD1 2.88Å; T189-D193 PolarHBondContact OG1-OD2 3.19Å; T189-K199 HydrophobicContact CG2-CD 3.81Å; T189-K199 HydrophobicContact CG2-CG 4.28Å; T189-K199 WeakPolarHBondContact OG1-CE 3.25Å; T189-T262 HydrophobicContact CG2-CG2 3.81Å
190	D	65.8	Low	73.6	Confident	3 Å²	3	43 Å²	43	2%	0.016	20%	0.202	C	C	.	.	H	α-helix	trans	-32.2	-45.1	179.1	63.9	-1	0	0	0	116.2	R168 R188 G194 E195 E805	R168-D190 IonicContact NH1-OD1 2.72Å; R188-D190 HydrophobicContact CG-CB 4.01Å; R188-D190 IonicContact CZ-OD2 3.64Å; R188-D190 IonicContact NE-OD2 2.95Å; R188-D190 PolarHBondContact NE-OD2 3Å; R188-D190 IonicContact NH2-OD2 3.26Å; D190-G194 VanDerWaalsContact O-CA 3.26Å; D190-G194 WeakPolarHBondContact O-CA 3.34Å; D190-G194 PolarHBondContact O-N 2.82Å; D190-G194 VanDerWaalsContact O-N 3.14Å; D190-E195 VanDerWaalsContact CA-O 3.27Å; D190-E195 WeakPolarHBondContact CA-O 3.33Å; D190-E195 PolarHBondContact N-O 3.01Å; D190-E195 VanDerWaalsContact N-O 3.08Å; D190-E805 VanDerWaalsContact CB-O 3.32Å; D190-E805 WeakPolarHBondContact CB-O 3.47Å
191	Q	64	Low	73.9	Confident	33 Å²	33	41.4 Å²	41.4	15%	0.154	19%	0.194	C	C	.	.	H	α-helix	trans	-80.8	-16.9	-178.8	-67.5	-158.4	-10.9	0	0	116.5	R168 T189 Q808	R168-Q191 VanDerWaalsContact CZ-CD 3.41Å; R168-Q191 VanDerWaalsContact NH2-NE2 3.12Å; T189-Q191 PolarHBondContact O-N 3.5Å; Q191-Q808 HydrophobicContact CB-CG 4.29Å; Q191-Q808 VanDerWaalsContact CD-NE2 3.25Å; Q191-Q808 HydrophobicContact CG-CG 3.94Å
192	L	66.8	Low	74.6	Confident	14 Å²	14	32.3 Å²	32.3	7%	0.073	16%	0.164	C	C	.	.	H	α-helix	trans	-96.3	-47.5	-177.8	-88.8	146.6	0	0	0	112.2	T189 I232 W259 A260 T262 N787	T189-L192 PolarHBondContact O-N 3.16Å; L192-I232 HydrophobicContact CD2-CG2 4.07Å; L192-W259 HydrophobicContact CD1-CB 3.48Å; L192-W259 VanDerWaalsContact CD1-CB 3.48Å; L192-W259 HydrophobicContact CD1-CG 4.37Å; L192-A260 WeakPolarHBondContact CD1-O 3.42Å; L192-T262 HydrophobicContact CD1-CG2 3.35Å; L192-N787 PolarHBondContact O-OD1 3.47Å; L192-N787 VanDerWaalsContact O-OD1 3.11Å
193	D	61.8	Low	75.6	Confident	11 Å²	11	29.6 Å²	29.6	6%	0.059	15%	0.15	C	C	.	.	H	α-helix	trans	-121.6	5.7	-173.7	53	20.7	0	0	0	113.7	T189 E195 K199 I232 N787	T189-D193 VanDerWaalsContact CB-OD1 3.29Å; T189-D193 WeakPolarHBondContact CB-OD1 3.43Å; T189-D193 WeakPolarHBondContact CB-OD2 3.33Å; T189-D193 PolarHBondContact O-N 3.45Å; T189-D193 VanDerWaalsContact OG1-CG 3.27Å; T189-D193 PolarHBondContact OG1-OD1 2.88Å; T189-D193 PolarHBondContact OG1-OD2 3.19Å; D193-E195 PolarHBondContact O-N 3.3Å; D193-E195 WeakPolarHBondContact OD1-CB 3.37Å; D193-E195 PolarHBondContact OD1-N 3.2Å; D193-E195 VanDerWaalsContact OD1-N 3.09Å; D193-K199 IonicContact OD2-NZ 3.02Å; D193-K199 PolarHBondContact OD2-NZ 3.3Å; D193-I232 HydrophobicContact CB-CD1 3.63Å; D193-N787 VanDerWaalsContact C-CG 3.48Å; D193-N787 WeakPolarHBondContact CA-OD1 3.42Å; D193-N787 PolarHBondContact O-ND2 3.18Å
194	G	55.3	Low	76.3	Confident	8 Å²	8	28.6 Å²	28.6	8%	0.082	14%	0.14	C	C	.	.	S	Bend	trans	60.6	15.2	-177.2	0	0	0	0	0	113.1	D190 E805	D190-G194 VanDerWaalsContact O-CA 3.26Å; D190-G194 WeakPolarHBondContact O-CA 3.34Å; D190-G194 PolarHBondContact O-N 2.82Å; D190-G194 VanDerWaalsContact O-N 3.14Å; G194-E805 VanDerWaalsContact O-OE1 3.1Å
195	E	63.9	Low	76.5	Confident	77 Å²	77	30 Å²	30	36%	0.36	15%	0.152	S	C	.	.			trans	-93.8	125.5	174.7	-66.7	178.4	179.8	0	0	108.4	D190 D193 D197 K199	D190-E195 VanDerWaalsContact CA-O 3.27Å; D190-E195 WeakPolarHBondContact CA-O 3.33Å; D190-E195 PolarHBondContact N-O 3.01Å; D190-E195 VanDerWaalsContact N-O 3.08Å; D193-E195 PolarHBondContact O-N 3.3Å; D193-E195 WeakPolarHBondContact OD1-CB 3.37Å; D193-E195 PolarHBondContact OD1-N 3.2Å; D193-E195 VanDerWaalsContact OD1-N 3.09Å; E195-D197 PolarHBondContact O-N 3.42Å; E195-K199 WeakPolarHBondContact OE2-CE 3.47Å; E195-K199 IonicContact OE2-NZ 3.32Å; E195-K199 PolarHBondContact OE2-NZ 3Å
196	T	59.7	Low	76.5	Confident	34 Å²	34	30.4 Å²	30.4	21%	0.209	16%	0.155	C	C	.	.			trans	-73.4	-8.3	172.2	51.2	0	0	0	0	113.2	N399 E805	T196-N399 VanDerWaalsContact CG2-ND2 3.31Å; T196-N399 WeakPolarHBondContact CG2-ND2 3.04Å; T196-N399 PolarHBondContact OG1-ND2 3.33Å; T196-E805 HydrophobicContact CG2-CG 3.31Å
197	D	68.3	Low	76.7	Confident	36 Å²	36	29.2 Å²	29.2	19%	0.193	15%	0.15	C	C	.	.	S	Bend	trans	-71.7	144.1	-167	-63.7	-11.5	0	0	0	111.5	E195 K199 S497 P499	E195-D197 PolarHBondContact O-N 3.42Å; D197-K199 PolarHBondContact O-N 3.24Å; D197-S497 WeakPolarHBondContact CB-O 3.23Å; D197-P499 VanDerWaalsContact OD1-CD 3.32Å; D197-P499 WeakPolarHBondContact OD1-CD 3.16Å
198	W	76.9	Confident	76.8	Confident	53 Å²	53	31.3 Å²	31.3	20%	0.201	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	110.2	178	-62.7	104.4	0	0	0	109.6	F186 R188 A265 S497	F186-W198 HydrophobicContact CB-CB 4.13Å; F186-W198 HydrophobicContact CB-CE3 4.21Å; F186-W198 HydrophobicContact CD1-CB 3.83Å; F186-W198 HydrophobicContact CG-CB 4.26Å; R188-W198 HydrophobicContact CB-CE3 3.96Å; R188-W198 HydrophobicContact CB-CH2 4.39Å; R188-W198 HydrophobicContact CB-CZ3 3.68Å; R188-W198 HydrophobicContact CG-CZ3 4.45Å; W198-A265 HydrophobicContact CD2-CB 4.42Å; W198-A265 HydrophobicContact CE3-CB 3.46Å; W198-A265 VanDerWaalsContact CE3-CB 3.46Å; W198-A265 HydrophobicContact CH2-CB 3.86Å; W198-A265 HydrophobicContact CZ3-CB 3.13Å; W198-S497 VanDerWaalsContact O-CA 3.24Å; W198-S497 WeakPolarHBondContact O-CA 3.49Å
199	K	81.6	Confident	77	Confident	37 Å²	37	37.8 Å²	37.8	16%	0.161	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	117.1	177.3	-59.3	-164.6	-179	-177.2	0	109.8	L187 T189 D193 E195 D197 R201	L187-K199 PolarHBondContact N-O 3.43Å; L187-K199 PolarHBondContact O-N 3Å; T189-K199 HydrophobicContact CG2-CD 3.81Å; T189-K199 HydrophobicContact CG2-CG 4.28Å; T189-K199 WeakPolarHBondContact OG1-CE 3.25Å; D193-K199 IonicContact OD2-NZ 3.02Å; D193-K199 PolarHBondContact OD2-NZ 3.3Å; E195-K199 WeakPolarHBondContact OE2-CE 3.47Å; E195-K199 IonicContact OE2-NZ 3.32Å; E195-K199 PolarHBondContact OE2-NZ 3Å; D197-K199 PolarHBondContact O-N 3.24Å; K199-R201 PolarHBondContact O-N 3.29Å
200	L	83.6	Confident	77.4	Confident	80 Å²	80	38.7 Å²	38.7	42%	0.419	19%	0.189	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.4	128.2	173	-172.2	69.4	0	0	0	109.4	F186	F186-L200 HydrophobicContact CD1-CB 4.32Å; F186-L200 HydrophobicContact CD1-CD1 4.09Å; F186-L200 HydrophobicContact CE1-CB 4.14Å; F186-L200 HydrophobicContact CE1-CD1 3.72Å; F186-L200 HydrophobicContact CE2-CD1 4.33Å; F186-L200 HydrophobicContact CZ-CD1 3.85Å
201	R	87.5	Confident	78.1	Confident	21 Å²	21	43.6 Å²	43.6	8%	0.079	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	150.1	169.5	-65.4	-57.2	-168.8	-155.7	5.2	110.4	F175 C185 L187 K199 I254 E255 T257 L258	F175-R201 HydrophobicContact CD1-CB 3.79Å; F175-R201 HydrophobicContact CE1-CB 4.02Å; F175-R201 WeakPolarHBondContact CE1-O 3.48Å; C185-R201 PolarHBondContact N-O 3.47Å; C185-R201 VanDerWaalsContact N-O 3.1Å; C185-R201 PolarHBondContact O-N 3.39Å; L187-R201 HydrophobicContact CD1-CB 3.67Å; L187-R201 HydrophobicContact CD1-CG 3.13Å; K199-R201 PolarHBondContact O-N 3.29Å; R201-I254 PolarHBondContact NE-O 2.93Å; R201-I254 PolarHBondContact NH1-O 2.77Å; R201-E255 CarbonylContact C-O 3.48Å; R201-E255 WeakPolarHBondContact CA-O 3.5Å; R201-E255 WeakPolarHBondContact CB-O 3.32Å; R201-E255 VanDerWaalsContact CD-O 3.26Å; R201-E255 WeakPolarHBondContact CD-O 3.43Å; R201-T257 WeakPolarHBondContact CD-O 3.15Å; R201-T257 PolarHBondContact NE-O 3.05Å; R201-L258 HydrophobicContact CB-CD2 4.37Å; R201-L258 HydrophobicContact CG-CD2 4.21Å
202	L	88.6	Confident	79	Confident	60 Å²	60	45.3 Å²	45.3	31%	0.314	23%	0.233	S	C	.	.			trans	-120.2	131.7	-178.2	-63.4	176	0	0	0	110.2	F175 E255 N256	F175-L202 WeakPolarHBondContact CD1-O 3.34Å; L202-E255 PolarHBondContact N-O 3.03Å; L202-N256 WeakPolarHBondContact O-CA 3.47Å; L202-N256 PolarHBondContact O-ND2 2.99Å
203	P	92.4	Very high	79.8	Confident	12 Å²	12	45.9 Å²	45.9	8%	0.078	24%	0.24	C	C	.	.			trans	-68.7	158.9	173.8	31	-33.9	0	0	0	110.1	F175 T178 G183 A205 Q208	F175-P203 HydrophobicContact CD1-CB 4.23Å; F175-P203 VanDerWaalsContact CD1-N 3.3Å; F175-P203 HydrophobicContact CD2-CB 4.21Å; F175-P203 HydrophobicContact CE1-CB 4.15Å; F175-P203 HydrophobicContact CE1-CG 4.36Å; F175-P203 VanDerWaalsContact CE1-N 3.35Å; F175-P203 HydrophobicContact CE2-CB 4.14Å; F175-P203 HydrophobicContact CG-CB 4.26Å; F175-P203 HydrophobicContact CZ-CB 4.11Å; F175-P203 HydrophobicContact CZ-CG 4.35Å; F175-P203 WeakPolarHBondContact O-CA 3.33Å; T178-P203 HydrophobicContact CG2-CG 4.47Å; G183-P203 WeakPolarHBondContact O-CD 3.3Å; G183-P203 WeakPolarHBondContact O-CG 3.42Å; P203-A205 PolarHBondContact O-N 3.15Å; P203-Q208 HydrophobicContact CB-CB 4.27Å; P203-Q208 HydrophobicContact CG-CB 3.89Å; P203-Q208 HydrophobicContact CG-CG 3.91Å
204	V	91.3	Very high	80.8	Confident	0 Å²	0	47.7 Å²	47.7	0%	0	26%	0.257	C	S	.	.			trans	-57.3	129.9	169.4	177.6	0	0	0	0	109.4	I174 F175 L176 C206 T207 Q208 F239 E250 L252	I174-V204 HydrophobicContact CG2-CG2 4.19Å; F175-V204 PolarHBondContact O-N 3.36Å; F175-V204 VanDerWaalsContact O-N 3.08Å; L176-V204 HydrophobicContact CD2-CG2 4.29Å; V204-C206 PolarHBondContact O-N 3.43Å; V204-T207 WeakPolarHBondContact CB-OG1 3.22Å; V204-T207 HydrophobicContact CG1-CG2 4.42Å; V204-T207 PolarHBondContact O-N 2.94Å; V204-T207 PolarHBondContact O-OG1 3.2Å; V204-Q208 PolarHBondContact O-N 3.48Å; V204-Q208 VanDerWaalsContact O-N 3.08Å; V204-F239 HydrophobicContact CG1-CB 4.29Å; V204-F239 HydrophobicContact CG1-CD1 3.78Å; V204-F239 HydrophobicContact CG1-CD2 4.42Å; V204-F239 HydrophobicContact CG1-CE1 4.21Å; V204-F239 HydrophobicContact CG1-CG 3.91Å; V204-E250 WeakPolarHBondContact CG1-OE2 3.43Å; V204-L252 HydrophobicContact CG2-CD2 3.53Å
205	A	86.4	Confident	82.2	Confident	45 Å²	45	48.8 Å²	48.8	37%	0.372	26%	0.261	S	S	.	.	H	α-helix	trans	-68.3	-41.1	-164.3	0	0	0	0	0	111.4	P203 T207 R209 E250	P203-A205 PolarHBondContact O-N 3.15Å; A205-T207 VanDerWaalsContact C-N 3.28Å; A205-T207 PolarHBondContact O-N 3.12Å; A205-R209 WeakPolarHBondContact O-CG 3.44Å; A205-R209 PolarHBondContact O-N 3.11Å; A205-E250 PolarHBondContact N-OE2 3.14Å
206	C	85.6	Confident	83.2	Confident	10 Å²	10	45.1 Å²	45.1	7%	0.068	24%	0.244	C	C	.	.	H	α-helix	trans	-66.2	-26.7	178	69.2	0	0	0	0	114	V204 F239 V248 E250	V204-C206 PolarHBondContact O-N 3.43Å; C206-F239 WeakPolarHBondContact SG-CE1 3.34Å; C206-V248 HydrophobicContact CB-CG1 4.3Å; C206-E250 WeakPolarHBondContact CB-OE1 3.48Å; C206-E250 PolarHBondContact N-OE1 3.29Å
207	T	87.6	Confident	84.4	Confident	1 Å²	1	44.7 Å²	44.7	1%	0.006	24%	0.24	C	C	.	.	H	α-helix	trans	-88.2	-30.5	-179.4	51.1	0	0	0	0	112.6	L176 R177 V204 A205 R209 L210 L216 I219 F239	L176-T207 WeakPolarHBondContact O-CB 3.46Å; L176-T207 PolarHBondContact O-OG1 2.94Å; R177-T207 PolarHBondContact NH1-O 2.93Å; V204-T207 WeakPolarHBondContact CB-OG1 3.22Å; V204-T207 HydrophobicContact CG1-CG2 4.42Å; V204-T207 PolarHBondContact O-N 2.94Å; V204-T207 PolarHBondContact O-OG1 3.2Å; A205-T207 VanDerWaalsContact C-N 3.28Å; A205-T207 PolarHBondContact O-N 3.12Å; T207-R209 VanDerWaalsContact C-N 3.26Å; T207-R209 PolarHBondContact O-N 2.89Å; T207-L210 WeakPolarHBondContact O-CB 3.46Å; T207-L210 PolarHBondContact O-N 2.84Å; T207-L216 HydrophobicContact CG2-CD2 3.84Å; T207-I219 HydrophobicContact CG2-CD1 4.13Å; T207-F239 HydrophobicContact CG2-CE1 4.09Å; T207-F239 HydrophobicContact CG2-CE2 4.32Å; T207-F239 HydrophobicContact CG2-CZ 3.66Å
208	Q	89.1	Confident	85.1	Confident	46 Å²	46	50.1 Å²	50.1	22%	0.215	26%	0.264	C	S	.	.	H	α-helix	trans	-63.7	-33.4	173.6	-174.2	61.3	22	0	0	111.8	R177 T178 P203 V204 L210	R177-Q208 VanDerWaalsContact CA-OE1 3.26Å; R177-Q208 PolarHBondContact NH1-O 2.88Å; T178-Q208 PolarHBondContact O-NE2 3.14Å; T178-Q208 VanDerWaalsContact O-NE2 3.1Å; P203-Q208 HydrophobicContact CB-CB 4.27Å; P203-Q208 HydrophobicContact CG-CB 3.89Å; P203-Q208 HydrophobicContact CG-CG 3.91Å; V204-Q208 PolarHBondContact O-N 3.48Å; V204-Q208 VanDerWaalsContact O-N 3.08Å; Q208-L210 PolarHBondContact O-N 3.04Å
209	R	84.8	Confident	85.6	Confident	209 Å²	209	48 Å²	48	79%	0.789	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.3	-12.5	177.6	-68.1	176.9	-163.8	171.3	5.5	114.8	A205 T207	A205-R209 WeakPolarHBondContact O-CG 3.44Å; A205-R209 PolarHBondContact O-N 3.11Å; T207-R209 VanDerWaalsContact C-N 3.26Å; T207-R209 PolarHBondContact O-N 2.89Å
210	L	84	Confident	85.8	Confident	23 Å²	23	52 Å²	52	12%	0.12	27%	0.271	C	S	.	.	S	Bend	trans	-65.9	153.7	176.9	-64.5	170.8	0	0	0	110.6	R177 T207 Q208 D215 L216 I219	R177-L210 PolarHBondContact NH1-O 2.83Å; R177-L210 PolarHBondContact NH2-O 2.92Å; T207-L210 WeakPolarHBondContact O-CB 3.46Å; T207-L210 PolarHBondContact O-N 2.84Å; Q208-L210 PolarHBondContact O-N 3.04Å; L210-D215 HydrophobicContact CB-CB 4.3Å; L210-D215 HydrophobicContact CD1-CB 4.19Å; L210-D215 HydrophobicContact CD2-CB 4.34Å; L210-L216 HydrophobicContact CD1-CD2 3.76Å; L210-L216 HydrophobicContact CD1-CG 4.36Å; L210-I219 HydrophobicContact CD1-CD1 4.42Å; L210-I219 HydrophobicContact CD1-CG2 4.41Å
211	P	80.7	Confident	86.1	Confident	106 Å²	106	48.2 Å²	48.2	69%	0.688	25%	0.251	S	S	*	.	S	Bend	trans	-77.5	-37.3	178.6	23.6	-26.3	0	0	0	112.6	R177 D215	R177-P211 PolarHBondContact NH2-O 3.04Å; P211-D215 VanDerWaalsContact CD-OD2 3.31Å; P211-D215 WeakPolarHBondContact CD-OD2 3.41Å; P211-D215 VanDerWaalsContact CG-OD2 3.31Å; P211-D215 WeakPolarHBondContact CG-OD2 3.33Å
212	T	84.3	Confident	86.3	Confident	68 Å²	68	50 Å²	50	42%	0.417	26%	0.258	S	S	.	.			trans	-130.1	156.1	179.9	71	0	0	0	0	113.2	A214 D215	T212-A214 PolarHBondContact O-N 3.47Å; T212-D215 PolarHBondContact N-OD2 2.88Å; T212-D215 WeakPolarHBondContact O-CB 3.26Å; T212-D215 PolarHBondContact O-N 3.11Å; T212-D215 PolarHBondContact OG1-OD1 3.1Å; T212-D215 PolarHBondContact OG1-OD2 2.92Å
213	A	81.8	Confident	86.5	Confident	26 Å²	26	47.1 Å²	47.1	22%	0.215	24%	0.243	C	C	.	.	G	3₁₀ helix	trans	-64.7	-27.5	174.3	0	0	0	0	0	112.4	L142 D215 L216 V270	L142-A213 WeakPolarHBondContact CD2-O 3.49Å; A213-D215 PolarHBondContact O-N 3.48Å; A213-L216 VanDerWaalsContact O-CB 3.25Å; A213-L216 WeakPolarHBondContact O-CB 3.42Å; A213-L216 WeakPolarHBondContact O-CG 3.42Å; A213-L216 PolarHBondContact O-N 2.98Å; A213-V270 HydrophobicContact CB-CG2 4.18Å
214	A	83	Confident	86.4	Confident	50 Å²	50	51.4 Å²	51.4	41%	0.413	26%	0.258	S	S	.	.	G	3₁₀ helix	trans	-64.1	-28.1	178.1	0	0	0	0	0	112.6	T212 L216 L217	T212-A214 PolarHBondContact O-N 3.47Å; A214-L216 PolarHBondContact O-N 3.12Å; A214-L217 WeakPolarHBondContact O-CB 3.28Å; A214-L217 PolarHBondContact O-N 3.44Å
215	D	84.6	Confident	86.5	Confident	30 Å²	30	51.4 Å²	51.4	16%	0.16	26%	0.258	C	S	.	.	G	3₁₀ helix	trans	-64.8	-21.7	178.5	-55.3	-36.4	0	0	0	112.1	L210 P211 T212 A213 L217 Q218 I219	L210-D215 HydrophobicContact CB-CB 4.3Å; L210-D215 HydrophobicContact CD1-CB 4.19Å; L210-D215 HydrophobicContact CD2-CB 4.34Å; P211-D215 VanDerWaalsContact CD-OD2 3.31Å; P211-D215 WeakPolarHBondContact CD-OD2 3.41Å; P211-D215 VanDerWaalsContact CG-OD2 3.31Å; P211-D215 WeakPolarHBondContact CG-OD2 3.33Å; T212-D215 PolarHBondContact N-OD2 2.88Å; T212-D215 WeakPolarHBondContact O-CB 3.26Å; T212-D215 PolarHBondContact O-N 3.11Å; T212-D215 PolarHBondContact OG1-OD1 3.1Å; T212-D215 PolarHBondContact OG1-OD2 2.92Å; A213-D215 PolarHBondContact O-N 3.48Å; D215-L217 PolarHBondContact O-N 3.45Å; D215-Q218 PolarHBondContact O-N 2.93Å; D215-I219 PolarHBondContact O-N 2.97Å
216	L	85.4	Confident	86.7	Confident	0 Å²	0	51 Å²	51	0%	0	25%	0.249	C	C	.	.	G	3₁₀ helix	trans	-61.5	-23.7	173.2	-63.9	170.2	0	0	0	113.1	L160 L176 R177 T207 L210 A213 A214 I219 V270	L160-L216 HydrophobicContact CD1-CB 4.25Å; L176-L216 HydrophobicContact CB-CD1 4.34Å; L176-L216 HydrophobicContact CB-CD2 4.41Å; R177-L216 HydrophobicContact CB-CD1 4.38Å; T207-L216 HydrophobicContact CG2-CD2 3.84Å; L210-L216 HydrophobicContact CD1-CD2 3.76Å; L210-L216 HydrophobicContact CD1-CG 4.36Å; A213-L216 VanDerWaalsContact O-CB 3.25Å; A213-L216 WeakPolarHBondContact O-CB 3.42Å; A213-L216 WeakPolarHBondContact O-CG 3.42Å; A213-L216 PolarHBondContact O-N 2.98Å; A214-L216 PolarHBondContact O-N 3.12Å; L216-I219 HydrophobicContact CD2-CD1 4.28Å; L216-I219 WeakPolarHBondContact O-CG1 3.47Å; L216-V270 HydrophobicContact CD1-CB 4.36Å; L216-V270 HydrophobicContact CD1-CG1 3.79Å
217	L	84.6	Confident	86.9	Confident	25 Å²	25	55.7 Å²	55.7	13%	0.131	27%	0.27	C	S	.	.	G	3₁₀ helix	trans	-85	-14.6	176.5	-71	170.8	0	0	0	113.3	L142 S143 K144 L160 A214 D215	L142-L217 HydrophobicContact CD2-CD1 4.09Å; L142-L217 HydrophobicContact CD2-CG 4.06Å; L142-L217 HydrophobicContact CG-CD1 3.9Å; L142-L217 HydrophobicContact CG-CG 4.37Å; S143-L217 WeakPolarHBondContact O-CD1 3.41Å; K144-L217 HydrophobicContact CG-CD1 4.46Å; L160-L217 HydrophobicContact CD1-CD2 3.58Å; L160-L217 HydrophobicContact CD1-CG 4.02Å; A214-L217 WeakPolarHBondContact O-CB 3.28Å; A214-L217 PolarHBondContact O-N 3.44Å; D215-L217 PolarHBondContact O-N 3.45Å
218	Q	83.9	Confident	87	Confident	151 Å²	151	56 Å²	56	71%	0.706	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.3	-27.8	-178	-60.8	-176.6	9.9	0	0	111.9	D215	D215-Q218 PolarHBondContact O-N 2.93Å
219	I	85.9	Confident	86.9	Confident	7 Å²	7	57 Å²	57	4%	0.036	28%	0.278	C	S	.	.	S	Bend	trans	-70.3	137.5	179.4	59.1	169.7	0	0	0	112.2	T207 L210 D215 L216 S221 F239 D243	T207-I219 HydrophobicContact CG2-CD1 4.13Å; L210-I219 HydrophobicContact CD1-CD1 4.42Å; L210-I219 HydrophobicContact CD1-CG2 4.41Å; D215-I219 PolarHBondContact O-N 2.97Å; L216-I219 HydrophobicContact CD2-CD1 4.28Å; L216-I219 WeakPolarHBondContact O-CG1 3.47Å; I219-S221 WeakPolarHBondContact CD1-OG 3.36Å; I219-S221 PolarHBondContact O-N 2.96Å; I219-F239 HydrophobicContact CD1-CZ 4.39Å; I219-D243 WeakPolarHBondContact CA-OD2 3.41Å; I219-D243 WeakPolarHBondContact CB-OD2 3.41Å
220	R	87	Confident	86.7	Confident	123 Å²	123	50.6 Å²	50.6	46%	0.464	26%	0.259	S	S	.	.			trans	-85.3	94.6	170.6	-165	172.2	161.6	172.9	-8.7	109.1	W42 E242 D243	W42-R220 HydrophobicContact CZ3-CG 4.43Å; R220-E242 HydrophobicContact CB-CB 4.48Å; R220-E242 HydrophobicContact CG-CB 4.34Å; R220-E242 IonicContact CZ-OE2 2.9Å; R220-E242 VanDerWaalsContact CZ-OE2 3.25Å; R220-E242 IonicContact NE-OE2 2.97Å; R220-E242 PolarHBondContact NE-OE2 2.83Å; R220-E242 IonicContact NH2-OE2 3.99Å; R220-E242 PolarHBondContact NH2-OE2 3.48Å; R220-E242 VanDerWaalsContact NH2-OE2 3.13Å; R220-E242 PolarHBondContact O-N 2.82Å; R220-D243 WeakPolarHBondContact CB-OD1 3.4Å; R220-D243 VanDerWaalsContact N-CG 3.35Å; R220-D243 PolarHBondContact N-OD1 2.73Å; R220-D243 PolarHBondContact N-OD2 3.34Å
221	S	89.6	Confident	86.5	Confident	0 Å²	0	52.3 Å²	52.3	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	156.2	-178.4	57.2	0	0	0	0	112.6	L43 I219 T240	L43-S221 PolarHBondContact N-O 3.09Å; I219-S221 WeakPolarHBondContact CD1-OG 3.36Å; I219-S221 PolarHBondContact O-N 2.96Å; S221-T240 WeakPolarHBondContact CA-O 3.44Å; S221-T240 VanDerWaalsContact CB-O 3.23Å; S221-T240 WeakPolarHBondContact CB-O 3.37Å
222	Y	91.1	Very high	86.5	Confident	57 Å²	57	48.3 Å²	48.3	22%	0.224	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	155.1	173.6	63.5	-93.2	0	0	0	111.1	T40 V41 W42 T240 E242	T40-Y222 HydrophobicContact CG2-CD2 3.45Å; T40-Y222 VanDerWaalsContact CG2-CD2 3.45Å; T40-Y222 HydrophobicContact CG2-CE2 4.17Å; T40-Y222 HydrophobicContact CG2-CG 3.93Å; V41-Y222 CarbonylContact O-C 3.54Å; V41-Y222 WeakPolarHBondContact O-CA 3.26Å; W42-Y222 HydrophobicContact CE3-CD1 4.18Å; W42-Y222 AromaticContact CH2-CD1 3.63Å; W42-Y222 HydrophobicContact CH2-CD1 3.63Å; W42-Y222 HydrophobicContact CH2-CE1 4.13Å; W42-Y222 HydrophobicContact CH2-CG 4.44Å; W42-Y222 HydrophobicContact CZ2-CD1 4.03Å; W42-Y222 HydrophobicContact CZ2-CG 4.48Å; W42-Y222 AromaticContact CZ3-CD1 3.72Å; W42-Y222 HydrophobicContact CZ3-CD1 3.72Å; W42-Y222 HydrophobicContact CZ3-CG 4.47Å; Y222-T240 HydrophobicContact CE1-CG2 3.74Å; Y222-T240 HydrophobicContact CE2-CG2 4.48Å; Y222-T240 PolarHBondContact N-O 3.35Å; Y222-T240 PolarHBondContact O-N 2.96Å; Y222-E242 HydrophobicContact CE1-CG 4.34Å
223	V	92.5	Very high	86.3	Confident	0 Å²	0	50.3 Å²	50.3	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	125.3	173	172.2	0	0	0	0	108.5	T40 V41 L43 I174 A225 T238 F239 L252 V272 I274	T40-V223 CarbonylContact C-O 3.45Å; T40-V223 WeakPolarHBondContact CA-O 3.41Å; V41-V223 PolarHBondContact N-O 3.19Å; V41-V223 PolarHBondContact O-N 2.83Å; L43-V223 HydrophobicContact CD1-CG2 4.14Å; I174-V223 HydrophobicContact CG1-CG1 4.15Å; V223-A225 HydrophobicContact CG1-CB 4.48Å; V223-T238 WeakPolarHBondContact CA-O 3.35Å; V223-F239 HydrophobicContact CG2-CD2 3.7Å; V223-F239 HydrophobicContact CG2-CE2 4.3Å; V223-L252 HydrophobicContact CG1-CD1 3.81Å; V223-L252 HydrophobicContact CG2-CD1 4.41Å; V223-V272 HydrophobicContact CG2-CG1 4.2Å; V223-I274 HydrophobicContact CB-CD1 4.27Å; V223-I274 HydrophobicContact CG1-CD1 3.96Å
224	Y	92.1	Very high	86.3	Confident	103 Å²	103	52.6 Å²	52.6	40%	0.404	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	125.1	161.8	178.4	-97.6	0	0	0	109	P38 G237 T238	P38-Y224 HydrophobicContact CB-CE2 4.36Å; Y224-G237 CarbonylContact O-C 3.58Å; Y224-G237 WeakPolarHBondContact O-CA 3.34Å; Y224-T238 PolarHBondContact N-O 2.97Å; Y224-T238 PolarHBondContact O-N 3.43Å
225	A	91.5	Very high	86.6	Confident	0 Å²	0	50.5 Å²	50.5	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	143.5	177.4	0	0	0	0	0	110.7	R39 V223 F235 I274	R39-A225 PolarHBondContact N-O 3.29Å; R39-A225 PolarHBondContact O-N 3.2Å; V223-A225 HydrophobicContact CG1-CB 4.48Å; A225-F235 HydrophobicContact CB-CE2 4.25Å; A225-F235 HydrophobicContact CB-CZ 4.05Å; A225-I274 HydrophobicContact CB-CG2 3.57Å
226	E	91.2	Very high	86.7	Confident	35 Å²	35	53.9 Å²	53.9	16%	0.164	25%	0.253	C	S	.	.			trans	-61.5	177.5	176	64.3	179.3	174.3	0	0	113.5	F235 I236 Y275 R281	E226-F235 HydrophobicContact CG-CD2 4.44Å; E226-F235 HydrophobicContact CG-CE2 4.44Å; E226-F235 WeakPolarHBondContact OE1-CA 3.13Å; E226-I236 PolarHBondContact N-O 3.4Å; E226-I236 PolarHBondContact OE1-N 3.17Å; E226-Y275 PolarHBondContact O-OH 2.97Å; E226-R281 IonicContact OE1-NH2 3.82Å; E226-R281 PolarHBondContact OE1-NH2 2.93Å
227	E	90.9	Very high	86.9	Confident	109 Å²	109	54.1 Å²	54.1	51%	0.509	26%	0.255	S	S	.	.			trans	-67.7	144.1	172.5	63.8	-175.1	179.9	0	0	111.2	F36 N229	F36-E227 HydrophobicContact CB-CB 4.3Å; E227-N229 PolarHBondContact O-N 3.16Å; E227-N229 VanDerWaalsContact O-N 3.15Å
228	P	89.5	Confident	87.3	Confident	7 Å²	7	55.5 Å²	55.5	5%	0.045	27%	0.265	C	S	.	.			trans	-50.7	121.7	173.4	-24.9	28	0	0	0	112	F36 Y275 E279 M284	F36-P228 HydrophobicContact CB-CG 4.5Å; F36-P228 HydrophobicContact CD1-CB 4.02Å; F36-P228 HydrophobicContact CD1-CG 3.98Å; F36-P228 HydrophobicContact CE1-CB 4.42Å; F36-P228 HydrophobicContact CG-CB 4.3Å; F36-P228 HydrophobicContact CG-CG 4.43Å; P228-Y275 HydrophobicContact CB-CD1 4.36Å; P228-Y275 HydrophobicContact CB-CE1 4.32Å; P228-Y275 HydrophobicContact CG-CD1 3.68Å; P228-Y275 HydrophobicContact CG-CE1 3.6Å; P228-E279 HydrophobicContact CB-CB 4.44Å; P228-E279 HydrophobicContact CG-CB 4.28Å; P228-E279 HydrophobicContact CG-CG 4.21Å; P228-M284 HydrophobicContact CB-CE 3.44Å; P228-M284 VanDerWaalsContact CB-CE 3.44Å
229	N	86.1	Confident	87.6	Confident	67 Å²	67	48.3 Å²	48.3	36%	0.358	23%	0.231	S	C	.	.			trans	-125.3	152.4	180	-170.4	1.3	0	0	0	110.3	E227 D231 R281	E227-N229 PolarHBondContact O-N 3.16Å; E227-N229 VanDerWaalsContact O-N 3.15Å; N229-D231 VanDerWaalsContact C-N 3.35Å; N229-R281 WeakPolarHBondContact O-CG 3.46Å; N229-R281 PolarHBondContact O-NE 2.72Å
230	I	80.7	Confident	87.8	Confident	75 Å²	75	48.6 Å²	48.6	39%	0.385	23%	0.233	S	C	.	.	S	Bend	trans	-73.4	-26.9	-179.6	-143.9	171	0	0	0	112.7	I232 M284 N285	I230-I232 PolarHBondContact O-N 2.85Å; I230-M284 HydrophobicContact CG1-CB 4.01Å; I230-N285 WeakPolarHBondContact CG1-OD1 3.43Å; I230-N285 PolarHBondContact O-ND2 2.92Å
231	D	79.4	Confident	87.9	Confident	60 Å²	60	45.7 Å²	45.7	32%	0.321	22%	0.222	S	C	.	.			trans	-65.3	124.8	179.8	-178.5	5.1	0	0	0	110.4	N229 H233 N234 R281	N229-D231 VanDerWaalsContact C-N 3.35Å; D231-H233 PolarHBondContact OD1-N 3.22Å; D231-N234 VanDerWaalsContact OD2-CB 3.28Å; D231-N234 WeakPolarHBondContact OD2-CB 3.5Å; D231-R281 PolarHBondContact O-NE 2.92Å; D231-R281 PolarHBondContact O-NH1 2.81Å
232	I	80.3	Confident	87.7	Confident	22 Å²	22	49 Å²	49	11%	0.113	24%	0.238	C	C	.	.	S	Bend	trans	-92.2	-14.9	-178.3	51.9	160.6	0	0	0	113.5	L192 D193 I230 I254 W259 R281	L192-I232 HydrophobicContact CD2-CG2 4.07Å; D193-I232 HydrophobicContact CB-CD1 3.63Å; I230-I232 PolarHBondContact O-N 2.85Å; I232-I254 WeakPolarHBondContact O-CD1 3.37Å; I232-W259 PolarHBondContact O-NE1 2.8Å; I232-W259 VanDerWaalsContact O-NE1 3.15Å; I232-R281 HydrophobicContact CG2-CB 4.22Å
233	H	80.8	Confident	87.2	Confident	110 Å²	110	50.1 Å²	50.1	51%	0.509	25%	0.247	S	C	.	.	S	Bend	trans	-96.3	-11.6	-174.2	-63	-64	0	0	0	113.8	D231 I254	D231-H233 PolarHBondContact OD1-N 3.22Å; H233-I254 WeakPolarHBondContact O-CD1 3.45Å
234	N	81.9	Confident	86	Confident	73 Å²	73	51.4 Å²	51.4	39%	0.39	26%	0.26	S	S	.	.			trans	-117.1	139.7	177.4	-168.3	12.9	0	0	0	111.2	D231 R281	D231-N234 VanDerWaalsContact OD2-CB 3.28Å; D231-N234 WeakPolarHBondContact OD2-CB 3.5Å; N234-R281 VanDerWaalsContact O-CZ 3.29Å; N234-R281 PolarHBondContact O-NH1 3.31Å; N234-R281 PolarHBondContact O-NH2 3.35Å
235	F	88.7	Confident	84.9	Confident	6 Å²	6	54.3 Å²	54.3	3%	0.026	28%	0.283	C	S	.	.			trans	-151.6	130.3	168.6	177.9	-101.4	0	0	0	109.3	I174 A225 E226 L252 T257 W259 Y275	I174-F235 HydrophobicContact CD1-CD1 4.4Å; I174-F235 HydrophobicContact CD1-CE1 3.56Å; I174-F235 HydrophobicContact CD1-CZ 3.67Å; A225-F235 HydrophobicContact CB-CE2 4.25Å; A225-F235 HydrophobicContact CB-CZ 4.05Å; E226-F235 HydrophobicContact CG-CD2 4.44Å; E226-F235 HydrophobicContact CG-CE2 4.44Å; E226-F235 WeakPolarHBondContact OE1-CA 3.13Å; F235-L252 HydrophobicContact CD1-CB 4.48Å; F235-L252 HydrophobicContact CE1-CB 3.98Å; F235-L252 HydrophobicContact CE1-CD1 4.47Å; F235-T257 HydrophobicContact CB-CG2 3.93Å; F235-T257 HydrophobicContact CD1-CG2 3.39Å; F235-T257 HydrophobicContact CD2-CG2 4.3Å; F235-T257 HydrophobicContact CE1-CG2 3.96Å; F235-T257 HydrophobicContact CG-CG2 3.59Å; F235-W259 HydrophobicContact CB-CH2 3.95Å; F235-W259 HydrophobicContact CB-CZ2 4.13Å; F235-W259 AromaticContact CD2-CH2 3.82Å; F235-W259 HydrophobicContact CD2-CH2 3.82Å; F235-W259 AromaticContact CG-CH2 3.97Å; F235-W259 HydrophobicContact CG-CH2 3.97Å; F235-Y275 HydrophobicContact CE2-CE2 4.48Å
236	I	88	Confident	84.3	Confident	102 Å²	102	59.1 Å²	59.1	52%	0.523	31%	0.314	S	S	.	.			trans	-120.5	122.5	177	-56.2	175	0	0	0	108.8	E226	E226-I236 PolarHBondContact N-O 3.4Å; E226-I236 PolarHBondContact OE1-N 3.17Å
237	G	90.2	Very high	83.6	Confident	4 Å²	4	60.8 Å²	60.8	4%	0.041	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.3	174.3	174.2	0	0	0	0	0	112.6	Y224 L252	Y224-G237 CarbonylContact O-C 3.58Å; Y224-G237 WeakPolarHBondContact O-CA 3.34Å; G237-L252 PolarHBondContact N-O 3.11Å; G237-L252 PolarHBondContact O-N 2.86Å
238	T	91	Very high	83.3	Confident	55 Å²	55	58.3 Å²	58.3	34%	0.337	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	132.8	176.8	-48	0	0	0	0	109.4	V223 Y224	V223-T238 WeakPolarHBondContact CA-O 3.35Å; Y224-T238 PolarHBondContact N-O 2.97Å; Y224-T238 PolarHBondContact O-N 3.43Å
239	F	92.1	Very high	83	Confident	0 Å²	0	63 Å²	63	0%	0	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	126.9	169.2	-176.3	-90	0	0	0	109.1	L43 L176 V204 C206 T207 I219 V223 R241 N249 E250 L252	L43-F239 HydrophobicContact CD1-CE2 3.94Å; L43-F239 HydrophobicContact CD2-CE2 4.14Å; L176-F239 HydrophobicContact CD2-CD2 4.43Å; L176-F239 HydrophobicContact CD2-CE2 4.05Å; V204-F239 HydrophobicContact CG1-CB 4.29Å; V204-F239 HydrophobicContact CG1-CD1 3.78Å; V204-F239 HydrophobicContact CG1-CD2 4.42Å; V204-F239 HydrophobicContact CG1-CE1 4.21Å; V204-F239 HydrophobicContact CG1-CG 3.91Å; C206-F239 WeakPolarHBondContact SG-CE1 3.34Å; T207-F239 HydrophobicContact CG2-CE1 4.09Å; T207-F239 HydrophobicContact CG2-CE2 4.32Å; T207-F239 HydrophobicContact CG2-CZ 3.66Å; I219-F239 HydrophobicContact CD1-CZ 4.39Å; V223-F239 HydrophobicContact CG2-CD2 3.7Å; V223-F239 HydrophobicContact CG2-CE2 4.3Å; F239-R241 HydrophobicContact CE1-CB 4.1Å; F239-N249 WeakPolarHBondContact O-CA 3.08Å; F239-E250 PolarHBondContact N-O 3.03Å; F239-E250 PolarHBondContact O-N 2.66Å; F239-L252 HydrophobicContact CB-CD1 4.17Å; F239-L252 HydrophobicContact CB-CD2 3.94Å; F239-L252 HydrophobicContact CB-CG 4.08Å
240	T	89.6	Confident	83	Confident	13 Å²	13	61.9 Å²	61.9	8%	0.08	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	125.2	179.3	-59.2	0	0	0	0	109.7	S221 Y222 E242 N249	S221-T240 WeakPolarHBondContact CA-O 3.44Å; S221-T240 VanDerWaalsContact CB-O 3.23Å; S221-T240 WeakPolarHBondContact CB-O 3.37Å; Y222-T240 HydrophobicContact CE1-CG2 3.74Å; Y222-T240 HydrophobicContact CE2-CG2 4.48Å; Y222-T240 PolarHBondContact N-O 3.35Å; Y222-T240 PolarHBondContact O-N 2.96Å; T240-E242 HydrophobicContact CG2-CG 4.42Å; T240-N249 VanDerWaalsContact CG2-OD1 3.25Å; T240-N249 WeakPolarHBondContact CG2-OD1 3.23Å; T240-N249 PolarHBondContact OG1-OD1 3.29Å
241	R	88.7	Confident	83.3	Confident	61 Å²	61	63.2 Å²	63.2	23%	0.23	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	116.4	171.1	-177.2	178.9	-179.8	-175.4	-3.8	109.8	F239 D243 P247 V248	F239-R241 HydrophobicContact CE1-CB 4.1Å; R241-D243 HydrophobicContact CG-CB 4.45Å; R241-D243 IonicContact NE-OD2 3.5Å; R241-P247 WeakPolarHBondContact O-CA 3.49Å; R241-V248 HydrophobicContact CB-CB 4.39Å; R241-V248 PolarHBondContact N-O 3.24Å; R241-V248 PolarHBondContact O-N 2.94Å; R241-V248 VanDerWaalsContact O-N 3.08Å
242	E	85.4	Confident	83.8	Confident	71 Å²	71	60.7 Å²	60.7	33%	0.332	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.8	-13.8	-176.4	-63.4	-173.5	160.4	0	0	113.4	R220 Y222 T240 G244	R220-E242 HydrophobicContact CB-CB 4.48Å; R220-E242 HydrophobicContact CG-CB 4.34Å; R220-E242 IonicContact CZ-OE2 2.9Å; R220-E242 VanDerWaalsContact CZ-OE2 3.25Å; R220-E242 IonicContact NE-OE2 2.97Å; R220-E242 PolarHBondContact NE-OE2 2.83Å; R220-E242 IonicContact NH2-OE2 3.99Å; R220-E242 PolarHBondContact NH2-OE2 3.48Å; R220-E242 VanDerWaalsContact NH2-OE2 3.13Å; R220-E242 PolarHBondContact O-N 2.82Å; Y222-E242 HydrophobicContact CE1-CG 4.34Å; T240-E242 HydrophobicContact CG2-CG 4.42Å; E242-G244 VanDerWaalsContact C-N 3.32Å; E242-G244 PolarHBondContact O-N 3.45Å
243	D	79.9	Confident	84.1	Confident	79 Å²	79	61.9 Å²	61.9	42%	0.422	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.7	-15.2	-174.9	-52.7	-46.2	0	0	0	114.6	I219 R220 R241	I219-D243 WeakPolarHBondContact CA-OD2 3.41Å; I219-D243 WeakPolarHBondContact CB-OD2 3.41Å; R220-D243 WeakPolarHBondContact CB-OD1 3.4Å; R220-D243 VanDerWaalsContact N-CG 3.35Å; R220-D243 PolarHBondContact N-OD1 2.73Å; R220-D243 PolarHBondContact N-OD2 3.34Å; R241-D243 HydrophobicContact CG-CB 4.45Å; R241-D243 IonicContact NE-OD2 3.5Å
244	G	68.2	Low	84.5	Confident	27 Å²	27	58.5 Å²	58.5	28%	0.278	34%	0.336	S	S	.	.	S	Bend	trans	-88.3	145.9	177.3	0	0	0	0	0	111.1	E242 P246 P247	E242-G244 VanDerWaalsContact C-N 3.32Å; E242-G244 PolarHBondContact O-N 3.45Å; G244-P246 VanDerWaalsContact C-C 3.44Å; G244-P246 CarbonylContact C-O 3.59Å; G244-P246 CarbonylContact O-C 3.5Å; G244-P246 VanDerWaalsContact O-O 3.11Å; G244-P247 WeakPolarHBondContact O-CA 3.38Å; G244-P247 VanDerWaalsContact O-N 3.09Å
245	D	68.1	Low	84.7	Confident	165 Å²	165	59.8 Å²	59.8	88%	0.882	34%	0.339	S	S	*	.	S	Bend	trans	-113.5	106.2	168.5	-165.8	9.6	0	0	0	109.1
246	P	79.1	Confident	84.9	Confident	100 Å²	100	60.4 Å²	60.4	65%	0.649	34%	0.343	S	S	*	.	S	Bend	cis	-73.6	162.6	-0.1	31.2	-35.6	0	0	0	113.8	G244 V248	G244-P246 VanDerWaalsContact C-C 3.44Å; G244-P246 CarbonylContact C-O 3.59Å; G244-P246 CarbonylContact O-C 3.5Å; G244-P246 VanDerWaalsContact O-O 3.11Å; P246-V248 PolarHBondContact O-N 3.07Å
247	P	77.5	Confident	85.2	Confident	71 Å²	71	55.6 Å²	55.6	46%	0.461	32%	0.318	S	S	.	.	P	Polyproline II helix	trans	-60.5	134.6	177.3	23.4	-33.3	0	0	0	111.2	R241 G244	R241-P247 WeakPolarHBondContact O-CA 3.49Å; G244-P247 WeakPolarHBondContact O-CA 3.38Å; G244-P247 VanDerWaalsContact O-N 3.09Å
248	V	83.9	Confident	85.3	Confident	57 Å²	57	55.4 Å²	55.4	35%	0.345	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	116	-177.4	-178.8	0	0	0	0	108.8	C206 R241 P246 E250	C206-V248 HydrophobicContact CB-CG1 4.3Å; R241-V248 HydrophobicContact CB-CB 4.39Å; R241-V248 PolarHBondContact N-O 3.24Å; R241-V248 PolarHBondContact O-N 2.94Å; R241-V248 VanDerWaalsContact O-N 3.08Å; P246-V248 PolarHBondContact O-N 3.07Å; V248-E250 HydrophobicContact CG1-CG 4.28Å
249	N	84	Confident	85.4	Confident	104 Å²	104	53.2 Å²	53.2	56%	0.556	30%	0.302	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-111	119.3	176.3	-64.7	-24.4	0	0	0	109.5	F239 T240	F239-N249 WeakPolarHBondContact O-CA 3.08Å; T240-N249 VanDerWaalsContact CG2-OD1 3.25Å; T240-N249 WeakPolarHBondContact CG2-OD1 3.23Å; T240-N249 PolarHBondContact OG1-OD1 3.29Å
250	E	85.8	Confident	85.2	Confident	44 Å²	44	53.3 Å²	53.3	21%	0.206	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	132.1	175.2	-69.3	-174.2	-164.2	0	0	109.6	V204 A205 C206 F239 V248	V204-E250 WeakPolarHBondContact CG1-OE2 3.43Å; A205-E250 PolarHBondContact N-OE2 3.14Å; C206-E250 WeakPolarHBondContact CB-OE1 3.48Å; C206-E250 PolarHBondContact N-OE1 3.29Å; F239-E250 PolarHBondContact N-O 3.03Å; F239-E250 PolarHBondContact O-N 2.66Å; V248-E250 HydrophobicContact CG1-CG 4.28Å
251	S	87.3	Confident	84.9	Confident	104 Å²	104	54.2 Å²	54.2	73%	0.727	31%	0.309	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73.3	130.7	171.6	56.5	0	0	0	0	109.8
252	L	88.7	Confident	84.8	Confident	7 Å²	7	51.4 Å²	51.4	4%	0.037	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	132.6	173.8	-59.1	176.8	0	0	0	109.7	I174 V204 V223 F235 G237 F239 N256	I174-L252 HydrophobicContact CD1-CD1 4.29Å; I174-L252 HydrophobicContact CG1-CD1 4.24Å; I174-L252 HydrophobicContact CG2-CD1 4.02Å; I174-L252 HydrophobicContact CG2-CD2 4.26Å; V204-L252 HydrophobicContact CG2-CD2 3.53Å; V223-L252 HydrophobicContact CG1-CD1 3.81Å; V223-L252 HydrophobicContact CG2-CD1 4.41Å; F235-L252 HydrophobicContact CD1-CB 4.48Å; F235-L252 HydrophobicContact CE1-CB 3.98Å; F235-L252 HydrophobicContact CE1-CD1 4.47Å; G237-L252 PolarHBondContact N-O 3.11Å; G237-L252 PolarHBondContact O-N 2.86Å; F239-L252 HydrophobicContact CB-CD1 4.17Å; F239-L252 HydrophobicContact CB-CD2 3.94Å; F239-L252 HydrophobicContact CB-CG 4.08Å; L252-N256 HydrophobicContact CD2-CB 3.99Å
253	S	87.7	Confident	85	Confident	46 Å²	46	48.3 Å²	48.3	32%	0.322	29%	0.285	S	S	.	.			trans	-118.7	-177.1	172.3	74.4	0	0	0	0	110.3	E255 N256	S253-E255 PolarHBondContact O-N 2.95Å; S253-E255 PolarHBondContact OG-N 2.86Å; S253-N256 PolarHBondContact N-OD1 3.4Å; S253-N256 PolarHBondContact O-N 2.98Å
254	I	87.9	Confident	85.3	Confident	40 Å²	40	44.5 Å²	44.5	21%	0.205	27%	0.265	C	S	.	.	G	3₁₀ helix	trans	-56	-30.5	174.5	-173	155.8	0	0	0	113.2	R201 I232 H233 N256 T257	R201-I254 PolarHBondContact NE-O 2.93Å; R201-I254 PolarHBondContact NH1-O 2.77Å; I232-I254 WeakPolarHBondContact O-CD1 3.37Å; H233-I254 WeakPolarHBondContact O-CD1 3.45Å; I254-N256 PolarHBondContact O-N 2.76Å; I254-N256 VanDerWaalsContact O-N 3.12Å; I254-T257 PolarHBondContact O-N 2.84Å; I254-T257 VanDerWaalsContact O-N 3.09Å; I254-T257 PolarHBondContact O-OG1 3.1Å
255	E	87.8	Confident	85.8	Confident	99 Å²	99	43.4 Å²	43.4	46%	0.463	25%	0.253	S	S	.	.	G	3₁₀ helix	trans	-62.3	-20.1	178.1	-63.6	-177.8	177.8	0	0	113.2	R201 L202 S253	R201-E255 CarbonylContact C-O 3.48Å; R201-E255 WeakPolarHBondContact CA-O 3.5Å; R201-E255 WeakPolarHBondContact CB-O 3.32Å; R201-E255 VanDerWaalsContact CD-O 3.26Å; R201-E255 WeakPolarHBondContact CD-O 3.43Å; L202-E255 PolarHBondContact N-O 3.03Å; S253-E255 PolarHBondContact O-N 2.95Å; S253-E255 PolarHBondContact OG-N 2.86Å
256	N	92.4	Very high	86.4	Confident	20 Å²	20	36 Å²	36	11%	0.107	21%	0.214	C	C	.	.	G	3₁₀ helix	trans	-98.5	11.3	179.7	-49	111	0	0	0	113.1	I174 F175 L202 L252 S253 I254	I174-N256 CarbonylContact C-O 3.6Å; I174-N256 WeakPolarHBondContact CA-O 3.48Å; F175-N256 WeakPolarHBondContact CB-O 3.44Å; F175-N256 PolarHBondContact N-O 3.32Å; L202-N256 WeakPolarHBondContact O-CA 3.47Å; L202-N256 PolarHBondContact O-ND2 2.99Å; L252-N256 HydrophobicContact CD2-CB 3.99Å; S253-N256 PolarHBondContact N-OD1 3.4Å; S253-N256 PolarHBondContact O-N 2.98Å; I254-N256 PolarHBondContact O-N 2.76Å; I254-N256 VanDerWaalsContact O-N 3.12Å
257	T	93.1	Very high	86.5	Confident	0 Å²	0	32.2 Å²	32.2	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	148.2	-173.3	65.2	0	0	0	0	112.4	I174 R201 F235 I254 W259	I174-T257 HydrophobicContact CD1-CG2 3.85Å; R201-T257 WeakPolarHBondContact CD-O 3.15Å; R201-T257 PolarHBondContact NE-O 3.05Å; F235-T257 HydrophobicContact CB-CG2 3.93Å; F235-T257 HydrophobicContact CD1-CG2 3.39Å; F235-T257 HydrophobicContact CD2-CG2 4.3Å; F235-T257 HydrophobicContact CE1-CG2 3.96Å; F235-T257 HydrophobicContact CG-CG2 3.59Å; I254-T257 PolarHBondContact O-N 2.84Å; I254-T257 VanDerWaalsContact O-N 3.09Å; I254-T257 PolarHBondContact O-OG1 3.1Å; T257-W259 VanDerWaalsContact CB-CH2 3.46Å; T257-W259 HydrophobicContact CG2-CH2 3.45Å; T257-W259 VanDerWaalsContact CG2-CH2 3.45Å; T257-W259 HydrophobicContact CG2-CZ2 3.82Å; T257-W259 HydrophobicContact CG2-CZ3 4.07Å; T257-W259 WeakPolarHBondContact OG1-CZ2 3.36Å
258	L	93.5	Very high	87.1	Confident	1 Å²	1	31.4 Å²	31.4	1%	0.005	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	111.4	172.2	-39	160.6	0	0	0	107.4	V169 M173 F175 L187 R201 V269	V169-L258 HydrophobicContact CG1-CB 4.24Å; V169-L258 HydrophobicContact CG2-CB 4.17Å; M173-L258 HydrophobicContact CG-CB 3.62Å; M173-L258 HydrophobicContact CG-CD1 3.79Å; M173-L258 HydrophobicContact CG-CG 4.13Å; M173-L258 WeakPolarHBondContact CG-O 3.45Å; M173-L258 PolarHBondContact N-O 3.14Å; M173-L258 PolarHBondContact O-N 3.25Å; M173-L258 HydrophobicContact SD-CB 4.2Å; M173-L258 HydrophobicContact SD-CD1 3.54Å; M173-L258 VanDerWaalsContact SD-CD1 3.54Å; M173-L258 HydrophobicContact SD-CG 4.44Å; F175-L258 HydrophobicContact CB-CD1 3.96Å; F175-L258 HydrophobicContact CB-CD2 4.08Å; F175-L258 HydrophobicContact CB-CG 3.93Å; F175-L258 HydrophobicContact CD1-CD2 4.37Å; F175-L258 HydrophobicContact CD2-CD1 4.21Å; F175-L258 HydrophobicContact CG-CD1 4.24Å; F175-L258 HydrophobicContact CG-CD2 4.15Å; F175-L258 HydrophobicContact CG-CG 4.42Å; L187-L258 HydrophobicContact CD1-CD2 3.3Å; L187-L258 HydrophobicContact CD2-CB 4.34Å; L187-L258 HydrophobicContact CD2-CD2 3.75Å; L187-L258 HydrophobicContact CG-CD2 4.14Å; R201-L258 HydrophobicContact CB-CD2 4.37Å; R201-L258 HydrophobicContact CG-CD2 4.21Å; L258-V269 HydrophobicContact CD1-CG1 3.3Å
259	W	91.9	Very high	87.5	Confident	9 Å²	9	28.7 Å²	28.7	3%	0.034	17%	0.171	C	C	.	.			trans	-83	148.1	-177.2	-56.1	142.6	0	0	0	111.7	V169 D172 L192 I232 F235 T257 T262	V169-W259 WeakPolarHBondContact CB-O 3.4Å; D172-W259 HydrophobicContact CB-CE3 3.94Å; D172-W259 HydrophobicContact CB-CZ3 4.24Å; D172-W259 WeakPolarHBondContact OD1-CA 3.34Å; L192-W259 HydrophobicContact CD1-CB 3.48Å; L192-W259 VanDerWaalsContact CD1-CB 3.48Å; L192-W259 HydrophobicContact CD1-CG 4.37Å; I232-W259 PolarHBondContact O-NE1 2.8Å; I232-W259 VanDerWaalsContact O-NE1 3.15Å; F235-W259 HydrophobicContact CB-CH2 3.95Å; F235-W259 HydrophobicContact CB-CZ2 4.13Å; F235-W259 AromaticContact CD2-CH2 3.82Å; F235-W259 HydrophobicContact CD2-CH2 3.82Å; F235-W259 AromaticContact CG-CH2 3.97Å; F235-W259 HydrophobicContact CG-CH2 3.97Å; T257-W259 VanDerWaalsContact CB-CH2 3.46Å; T257-W259 HydrophobicContact CG2-CH2 3.45Å; T257-W259 VanDerWaalsContact CG2-CH2 3.45Å; T257-W259 HydrophobicContact CG2-CZ2 3.82Å; T257-W259 HydrophobicContact CG2-CZ3 4.07Å; T257-W259 WeakPolarHBondContact OG1-CZ2 3.36Å; W259-T262 HydrophobicContact CB-CG2 3.97Å; W259-T262 WeakPolarHBondContact O-CB 3.38Å; W259-T262 VanDerWaalsContact O-CG2 3.29Å; W259-T262 WeakPolarHBondContact O-CG2 3.29Å; W259-T262 PolarHBondContact O-N 3.28Å; W259-T262 PolarHBondContact O-OG1 3.4Å
260	A	89.6	Confident	88	Confident	1 Å²	1	24 Å²	24	1%	0.008	15%	0.146	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.2	144.5	176.7	0	0	0	0	0	111.7	V169 D172 L192 T262 L280	V169-A260 WeakPolarHBondContact O-CA 3.24Å; D172-A260 WeakPolarHBondContact OD1-CB 3.05Å; D172-A260 PolarHBondContact OD1-N 3.17Å; L192-A260 WeakPolarHBondContact CD1-O 3.42Å; A260-T262 PolarHBondContact O-N 3.34Å; A260-L280 HydrophobicContact CB-CB 4.48Å; A260-L280 HydrophobicContact CB-CD1 4.05Å; A260-L280 HydrophobicContact CB-CD2 3.89Å; A260-L280 HydrophobicContact CB-CG 4.35Å
261	S	82.5	Confident	88.4	Confident	32 Å²	32	22 Å²	22	22%	0.224	14%	0.136	C	C	.	.	T	Hydrogen-bonded Turn	trans	70.9	-4	-177.6	-50.7	0	0	0	0	116.2	R168 V169	R168-S261 PolarHBondContact NH1-O 3.42Å; V169-S261 PolarHBondContact O-N 3.42Å
262	T	87.4	Confident	88.7	Confident	3 Å²	3	17 Å²	17	2%	0.018	10%	0.101	C	C	.	.			trans	-66.9	153.7	167.1	59.9	0	0	0	0	111.5	R168 V169 L187 R188 T189 L192 W259 A260	R168-T262 CarbonylContact C-O 3.52Å; R168-T262 VanDerWaalsContact CA-O 3.23Å; R168-T262 WeakPolarHBondContact CA-O 3.21Å; V169-T262 VanDerWaalsContact CG2-OG1 3.29Å; V169-T262 WeakPolarHBondContact CG2-OG1 3.39Å; V169-T262 PolarHBondContact N-O 3.03Å; L187-T262 WeakPolarHBondContact CD2-OG1 3.43Å; R188-T262 WeakPolarHBondContact O-CA 3.34Å; R188-T262 WeakPolarHBondContact O-CB 3.32Å; T189-T262 HydrophobicContact CG2-CG2 3.81Å; L192-T262 HydrophobicContact CD1-CG2 3.35Å; W259-T262 HydrophobicContact CB-CG2 3.97Å; W259-T262 WeakPolarHBondContact O-CB 3.38Å; W259-T262 VanDerWaalsContact O-CG2 3.29Å; W259-T262 WeakPolarHBondContact O-CG2 3.29Å; W259-T262 PolarHBondContact O-N 3.28Å; W259-T262 PolarHBondContact O-OG1 3.4Å; A260-T262 PolarHBondContact O-N 3.34Å
263	V	87.8	Confident	89	Confident	5 Å²	5	16.7 Å²	16.7	3%	0.03	10%	0.1	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108	131.3	179	-178.1	0	0	0	0	110.1	R168 L187 R188	R168-V263 HydrophobicContact CG-CG2 3.85Å; L187-V263 CarbonylContact C-O 3.48Å; L187-V263 VanDerWaalsContact CA-O 3.32Å; L187-V263 WeakPolarHBondContact CA-O 3.32Å; R188-V263 HydrophobicContact CB-CB 4.26Å; R188-V263 PolarHBondContact N-O 2.95Å; R188-V263 PolarHBondContact O-N 3Å
264	V	88.1	Confident	89.3	Confident	0 Å²	0	14.6 Å²	14.6	0%	0	9%	0.085	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	124.6	174.6	175.3	0	0	0	0	110	V163 N166 Q167 V169 L187 V269	V163-V264 HydrophobicContact CB-CG2 4.18Å; V163-V264 HydrophobicContact CG1-CB 4.29Å; V163-V264 HydrophobicContact CG1-CG2 3.59Å; N166-V264 WeakPolarHBondContact CA-O 3.25Å; N166-V264 PolarHBondContact N-O 3.17Å; Q167-V264 PolarHBondContact O-N 3Å; V169-V264 HydrophobicContact CG2-CG2 4.18Å; L187-V264 HydrophobicContact CD2-CG2 4.04Å; V264-V269 HydrophobicContact CG1-CG2 3.76Å; V264-V269 HydrophobicContact CG2-CB 4.49Å; V264-V269 HydrophobicContact CG2-CG2 4.34Å
265	A	78.3	Confident	89.6	Confident	3 Å²	3	12.8 Å²	12.8	3%	0.025	8%	0.075	C	C	.	.			trans	-82.3	-36.7	-172.9	0	0	0	0	0	113.9	K165 F186 W198	K165-A265 WeakPolarHBondContact CE-O 3.33Å; K165-A265 WeakPolarHBondContact CG-O 3.25Å; F186-A265 HydrophobicContact CB-CB 3.69Å; F186-A265 WeakPolarHBondContact O-CB 3.4Å; F186-A265 PolarHBondContact O-N 3.04Å; W198-A265 HydrophobicContact CD2-CB 4.42Å; W198-A265 HydrophobicContact CE3-CB 3.46Å; W198-A265 VanDerWaalsContact CE3-CB 3.46Å; W198-A265 HydrophobicContact CH2-CB 3.86Å; W198-A265 HydrophobicContact CZ3-CB 3.13Å
266	S	79.4	Confident	89.8	Confident	11 Å²	11	8.1 Å²	8.1	8%	0.077	5%	0.054	C	C	.	.	S	Bend	trans	-151.9	151.2	-167.3	79.7	0	0	0	0	111.2	E180 C185	E180-S266 WeakPolarHBondContact OE1-CB 3.3Å; E180-S266 PolarHBondContact OE1-OG 2.91Å; C185-S266 PolarHBondContact SG-O 3.28Å
267	G	82.6	Confident	89.7	Confident	20 Å²	20	7.2 Å²	7.2	21%	0.206	5%	0.05	C	C	.	.	S	Bend	trans	60.1	-162.1	-175.2	0	0	0	0	0	115.3	K165 E180	K165-G267 PolarHBondContact N-O 3.28Å; E180-G267 PolarHBondContact OE1-N 3.39Å
268	T	89.4	Confident	89.3	Confident	54 Å²	54	15.4 Å²	15.4	33%	0.331	9%	0.085	S	C	.	.			trans	-117.8	138.9	171.2	58.5	0	0	0	0	108.6	V163 T178 S179	V163-T268 WeakPolarHBondContact O-CA 3.45Å; T178-T268 VanDerWaalsContact CA-O 3.3Å; T178-T268 WeakPolarHBondContact CA-O 3.34Å; T178-T268 PolarHBondContact OG1-O 3.45Å; S179-T268 VanDerWaalsContact CB-OG1 3.25Å; S179-T268 WeakPolarHBondContact CB-OG1 3.34Å; S179-T268 PolarHBondContact N-O 3.2Å; S179-T268 VanDerWaalsContact N-O 3.08Å; S179-T268 PolarHBondContact OG-N 3.2Å; S179-T268 PolarHBondContact OG-OG1 3.07Å
269	V	93.1	Very high	89.2	Confident	0 Å²	0	16.6 Å²	16.6	0%	0	9%	0.09	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	133.1	-175.4	171.9	0	0	0	0	109.6	I162 V163 F175 C185 L258 V264	I162-V269 CarbonylContact C-O 3.5Å; I162-V269 WeakPolarHBondContact CA-O 3.44Å; V163-V269 PolarHBondContact N-O 3.44Å; V163-V269 PolarHBondContact O-N 2.83Å; F175-V269 HydrophobicContact CD2-CG1 3.46Å; F175-V269 VanDerWaalsContact CD2-CG1 3.46Å; F175-V269 HydrophobicContact CE2-CB 4.17Å; F175-V269 HydrophobicContact CE2-CG1 3.46Å; F175-V269 VanDerWaalsContact CE2-CG1 3.46Å; F175-V269 HydrophobicContact CE2-CG2 3.94Å; F175-V269 HydrophobicContact CG-CG1 4.44Å; F175-V269 HydrophobicContact CZ-CG1 4.43Å; F175-V269 HydrophobicContact CZ-CG2 4.28Å; C185-V269 HydrophobicContact CB-CG2 4.03Å; C185-V269 WeakPolarHBondContact SG-CG2 3.26Å; L258-V269 HydrophobicContact CD1-CG1 3.3Å; V264-V269 HydrophobicContact CG1-CG2 3.76Å; V264-V269 HydrophobicContact CG2-CB 4.49Å; V264-V269 HydrophobicContact CG2-CG2 4.34Å
270	V	94	Very high	89	Confident	6 Å²	6	16.3 Å²	16.3	4%	0.036	9%	0.09	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	124.5	172.5	-171.4	0	0	0	0	108.7	I161 I162 L176 R177 A213 L216	I161-V270 WeakPolarHBondContact O-CA 3.41Å; I162-V270 HydrophobicContact CG1-CG2 4.26Å; L176-V270 PolarHBondContact N-O 3.2Å; R177-V270 HydrophobicContact CB-CB 4.28Å; R177-V270 PolarHBondContact N-O 3.04Å; R177-V270 PolarHBondContact O-N 3.24Å; A213-V270 HydrophobicContact CB-CG2 4.18Å; L216-V270 HydrophobicContact CD1-CB 4.36Å; L216-V270 HydrophobicContact CD1-CG1 3.79Å
271	G	94.2	Very high	88.8	Confident	0 Å²	0	16.3 Å²	16.3	0%	0	9%	0.089	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	157	178.1	0	0	0	0	0	113.9	L160 I161 I174	L160-G271 WeakPolarHBondContact CA-O 3.25Å; I161-G271 PolarHBondContact N-O 3.32Å; I161-G271 PolarHBondContact O-N 3.04Å; I174-G271 CarbonylContact O-C 3.53Å; I174-G271 WeakPolarHBondContact O-CA 3.35Å
272	V	94.3	Very high	88.5	Confident	0 Å²	0	15.8 Å²	15.8	0%	0	9%	0.086	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	128	175.3	58.6	0	0	0	0	110.6	V41 L160 M173 I174 L176 V223 I274	V41-V272 HydrophobicContact CG1-CG2 4.05Å; L160-V272 HydrophobicContact CD2-CB 3.82Å; L160-V272 HydrophobicContact CD2-CG2 4.33Å; M173-V272 CarbonylContact C-O 3.38Å; M173-V272 WeakPolarHBondContact CA-O 3.3Å; M173-V272 WeakPolarHBondContact CB-O 3.07Å; I174-V272 HydrophobicContact CB-CG1 3.88Å; I174-V272 PolarHBondContact N-O 3.49Å; I174-V272 PolarHBondContact O-N 2.98Å; L176-V272 HydrophobicContact CD1-CB 3.98Å; L176-V272 HydrophobicContact CD1-CG1 4.02Å; L176-V272 HydrophobicContact CD2-CG1 4.32Å; L176-V272 HydrophobicContact CG-CG1 4.3Å; V223-V272 HydrophobicContact CG2-CG1 4.2Å; V272-I274 HydrophobicContact CG1-CD1 4.26Å
273	V	94.6	Very high	88.2	Confident	0 Å²	0	17.8 Å²	17.8	0%	0	10%	0.098	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.6	129.2	-178.1	178.3	0	0	0	0	111.4	I155 G158 D159 I161 A171 M173 T276	I155-V273 HydrophobicContact CG2-CG1 4.26Å; I155-V273 HydrophobicContact CG2-CG2 3.8Å; G158-V273 PolarHBondContact N-O 3.35Å; D159-V273 WeakPolarHBondContact O-CG2 3.33Å; D159-V273 PolarHBondContact O-N 2.93Å; I161-V273 HydrophobicContact CG1-CG2 3.74Å; A171-V273 HydrophobicContact CB-CG1 3.73Å; A171-V273 HydrophobicContact CB-CG2 4.38Å; M173-V273 HydrophobicContact CE-CG2 4.18Å; V273-T276 HydrophobicContact CG1-CG2 3.53Å
274	I	93.8	Very high	87.8	Confident	2 Å²	2	19.4 Å²	19.4	1%	0.01	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	-45.8	-178.3	-55.2	-58.1	0	0	0	112.5	R39 V41 V157 D172 I174 V223 A225 V272	R39-I274 PolarHBondContact NH1-O 2.84Å; V41-I274 HydrophobicContact CB-CD1 3.98Å; V41-I274 HydrophobicContact CG1-CD1 4.27Å; V41-I274 HydrophobicContact CG2-CD1 3.86Å; V157-I274 WeakPolarHBondContact CG1-O 3.46Å; V157-I274 WeakPolarHBondContact CG2-O 3.39Å; D172-I274 PolarHBondContact O-N 3.37Å; I174-I274 HydrophobicContact CD1-CG1 4.49Å; I174-I274 HydrophobicContact CG1-CD1 4.12Å; I174-I274 HydrophobicContact CG1-CG1 3.77Å; V223-I274 HydrophobicContact CB-CD1 4.27Å; V223-I274 HydrophobicContact CG1-CD1 3.96Å; A225-I274 HydrophobicContact CB-CG2 3.57Å; V272-I274 HydrophobicContact CG1-CD1 4.26Å
275	Y	93.6	Very high	87	Confident	2 Å²	2	21.8 Å²	21.8	1%	0.008	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	146.3	179.6	-48	-62.7	0	0	0	111.1	D172 E226 P228 F235 L280	D172-Y275 HydrophobicContact CB-CD2 3.9Å; D172-Y275 HydrophobicContact CB-CG 4.48Å; D172-Y275 PolarHBondContact N-O 3.18Å; D172-Y275 PolarHBondContact O-N 3.42Å; E226-Y275 PolarHBondContact O-OH 2.97Å; P228-Y275 HydrophobicContact CB-CD1 4.36Å; P228-Y275 HydrophobicContact CB-CE1 4.32Å; P228-Y275 HydrophobicContact CG-CD1 3.68Å; P228-Y275 HydrophobicContact CG-CE1 3.6Å; F235-Y275 HydrophobicContact CE2-CE2 4.48Å; Y275-L280 VanDerWaalsContact O-CD2 3.22Å; Y275-L280 WeakPolarHBondContact O-CD2 3.41Å
276	T	93.2	Very high	86.6	Confident	1 Å²	1	25.1 Å²	25.1	1%	0.006	14%	0.138	C	C	.	.			trans	-140.7	152.4	-174.5	47.3	0	0	0	0	112.7	P54 N56 V157 A171 V273 K278 E279	P54-T276 WeakPolarHBondContact CG-O 3.48Å; P54-T276 PolarHBondContact O-OG1 3.21Å; N56-T276 HydrophobicContact CB-CG2 4.15Å; V157-T276 HydrophobicContact CG2-CG2 4.04Å; A171-T276 HydrophobicContact CB-CG2 4.16Å; V273-T276 HydrophobicContact CG1-CG2 3.53Å; T276-K278 PolarHBondContact O-N 3.49Å; T276-E279 PolarHBondContact O-N 2.94Å; T276-E279 VanDerWaalsContact O-N 3.12Å
277	G	89.1	Confident	85.9	Confident	2 Å²	2	26.6 Å²	26.6	2%	0.021	15%	0.149	C	C	.	.	G	3₁₀ helix	trans	58.4	-117.1	172.7	0	0	0	0	0	114.2	K55 N56 E279 L280	K55-G277 WeakPolarHBondContact O-CA 3.4Å; N56-G277 PolarHBondContact OD1-N 3.09Å; G277-E279 PolarHBondContact O-N 3.49Å; G277-L280 WeakPolarHBondContact O-CB 3.49Å; G277-L280 VanDerWaalsContact O-CG 3.24Å; G277-L280 WeakPolarHBondContact O-CG 3.43Å; G277-L280 PolarHBondContact O-N 3.12Å
278	K	85.9	Confident	85	Confident	172 Å²	172	32.9 Å²	32.9	75%	0.748	18%	0.178	S	C	*	.	G	3₁₀ helix	trans	-69.6	-15.4	-179.1	-64.7	-175.4	178.5	-176.4	0	113.9	T276	T276-K278 PolarHBondContact O-N 3.49Å
279	E	90.2	Very high	83.6	Confident	25 Å²	25	33.5 Å²	33.5	12%	0.117	18%	0.183	C	C	.	.	G	3₁₀ helix	trans	-88.8	-4.5	178.3	-69.7	174.9	164.7	0	0	113.3	F36 R39 P54 P228 T276 G277 M284	F36-E279 HydrophobicContact CE1-CG 4.15Å; R39-E279 IonicContact CZ-OE1 2.72Å; R39-E279 IonicContact CZ-OE2 3.14Å; R39-E279 VanDerWaalsContact CZ-OE2 3.26Å; R39-E279 IonicContact NH1-OE1 3.23Å; R39-E279 IonicContact NH1-OE2 3.5Å; R39-E279 PolarHBondContact NH1-OE2 2.72Å; R39-E279 IonicContact NH2-OE1 3.56Å; R39-E279 PolarHBondContact NH2-OE1 2.81Å; R39-E279 IonicContact NH2-OE2 2.87Å; R39-E279 PolarHBondContact NH2-OE2 2.82Å; P54-E279 HydrophobicContact CG-CB 4.39Å; P54-E279 HydrophobicContact CG-CG 3.77Å; P228-E279 HydrophobicContact CB-CB 4.44Å; P228-E279 HydrophobicContact CG-CB 4.28Å; P228-E279 HydrophobicContact CG-CG 4.21Å; T276-E279 PolarHBondContact O-N 2.94Å; T276-E279 VanDerWaalsContact O-N 3.12Å; G277-E279 PolarHBondContact O-N 3.49Å; E279-M284 HydrophobicContact CB-CE 4.29Å
280	L	88	Confident	82.4	Confident	3 Å²	3	41.5 Å²	41.5	2%	0.016	21%	0.213	C	C	.	.	S	Bend	trans	-65.9	135.4	177.2	-62.4	176	0	0	0	110.3	A171 D172 A260 Y275 G277 S282 V283 M284	A171-L280 HydrophobicContact CB-CD2 4.15Å; D172-L280 HydrophobicContact CB-CD2 4.33Å; D172-L280 WeakPolarHBondContact OD2-CA 3.27Å; A260-L280 HydrophobicContact CB-CB 4.48Å; A260-L280 HydrophobicContact CB-CD1 4.05Å; A260-L280 HydrophobicContact CB-CD2 3.89Å; A260-L280 HydrophobicContact CB-CG 4.35Å; Y275-L280 VanDerWaalsContact O-CD2 3.22Å; Y275-L280 WeakPolarHBondContact O-CD2 3.41Å; G277-L280 WeakPolarHBondContact O-CB 3.49Å; G277-L280 VanDerWaalsContact O-CG 3.24Å; G277-L280 WeakPolarHBondContact O-CG 3.43Å; G277-L280 PolarHBondContact O-N 3.12Å; L280-S282 PolarHBondContact O-N 3.35Å; L280-V283 HydrophobicContact CB-CB 4.25Å; L280-V283 HydrophobicContact CB-CG2 4.02Å; L280-V283 HydrophobicContact CD1-CG2 4.23Å; L280-V283 PolarHBondContact O-N 3.29Å; L280-M284 WeakPolarHBondContact O-CG 3.29Å; L280-M284 PolarHBondContact O-N 3.35Å
281	R	85.5	Confident	81.2	Confident	1 Å²	1	44.6 Å²	44.6	0%	0.004	23%	0.227	C	C	.	.	H	α-helix	trans	-58.1	-36.1	177.6	-65.8	-169.6	169.2	-172.7	-6.4	112.6	D172 E226 N229 D231 I232 N234 M284 N285	D172-R281 PolarHBondContact OD2-N 3.02Å; E226-R281 IonicContact OE1-NH2 3.82Å; E226-R281 PolarHBondContact OE1-NH2 2.93Å; N229-R281 WeakPolarHBondContact O-CG 3.46Å; N229-R281 PolarHBondContact O-NE 2.72Å; D231-R281 PolarHBondContact O-NE 2.92Å; D231-R281 PolarHBondContact O-NH1 2.81Å; I232-R281 HydrophobicContact CG2-CB 4.22Å; N234-R281 VanDerWaalsContact O-CZ 3.29Å; N234-R281 PolarHBondContact O-NH1 3.31Å; N234-R281 PolarHBondContact O-NH2 3.35Å; R281-M284 PolarHBondContact O-N 3.08Å; R281-N285 WeakPolarHBondContact O-CB 3.5Å; R281-N285 PolarHBondContact O-N 3.44Å; R281-N285 VanDerWaalsContact O-N 3.08Å; R281-N285 PolarHBondContact O-ND2 3.24Å
282	S	77.1	Confident	80.3	Confident	21 Å²	21	46.1 Å²	46.1	15%	0.147	23%	0.233	C	C	.	.	H	α-helix	trans	-62.3	-41.9	175.2	57.1	0	0	0	0	112.4	L280 N285 T286	L280-S282 PolarHBondContact O-N 3.35Å; S282-N285 PolarHBondContact O-N 3.36Å; S282-T286 WeakPolarHBondContact O-CG2 3.48Å; S282-T286 PolarHBondContact O-N 2.94Å
283	V	80.1	Confident	79.6	Confident	45 Å²	45	48 Å²	48	27%	0.273	25%	0.245	S	C	.	.	H	α-helix	trans	-73.7	-37.5	179.2	178.1	0	0	0	0	111.4	L280 N285 T286	L280-V283 HydrophobicContact CB-CB 4.25Å; L280-V283 HydrophobicContact CB-CG2 4.02Å; L280-V283 HydrophobicContact CD1-CG2 4.23Å; L280-V283 PolarHBondContact O-N 3.29Å; V283-N285 VanDerWaalsContact C-N 3.26Å; V283-N285 PolarHBondContact O-N 3.37Å; V283-T286 WeakPolarHBondContact CA-OG1 3.47Å; V283-T286 PolarHBondContact O-N 2.95Å; V283-T286 PolarHBondContact O-OG1 2.7Å
284	M	78.6	Confident	79.1	Confident	39 Å²	39	48 Å²	48	19%	0.192	25%	0.245	C	C	.	.	H	α-helix	trans	-64	-32.9	175.5	-66	-167.3	-179.7	0	0	112.7	F36 P228 I230 E279 L280 R281	F36-M284 HydrophobicContact CD1-CE 4.26Å; F36-M284 HydrophobicContact CE1-CE 3.52Å; F36-M284 HydrophobicContact CE2-CE 3.99Å; F36-M284 HydrophobicContact CZ-CE 3.36Å; F36-M284 HydrophobicContact CZ-SD 4.36Å; P228-M284 HydrophobicContact CB-CE 3.44Å; P228-M284 VanDerWaalsContact CB-CE 3.44Å; I230-M284 HydrophobicContact CG1-CB 4.01Å; E279-M284 HydrophobicContact CB-CE 4.29Å; L280-M284 WeakPolarHBondContact O-CG 3.29Å; L280-M284 PolarHBondContact O-N 3.35Å; R281-M284 PolarHBondContact O-N 3.08Å
285	N	72.8	Confident	78.9	Confident	51 Å²	51	50.2 Å²	50.2	27%	0.273	26%	0.257	S	S	.	.	H	α-helix	trans	-79.6	-14.6	176.2	-81.4	-62.7	0	0	0	113.7	I230 R281 S282 V283	I230-N285 WeakPolarHBondContact CG1-OD1 3.43Å; I230-N285 PolarHBondContact O-ND2 2.92Å; R281-N285 WeakPolarHBondContact O-CB 3.5Å; R281-N285 PolarHBondContact O-N 3.44Å; R281-N285 VanDerWaalsContact O-N 3.08Å; R281-N285 PolarHBondContact O-ND2 3.24Å; S282-N285 PolarHBondContact O-N 3.36Å; V283-N285 VanDerWaalsContact C-N 3.26Å; V283-N285 PolarHBondContact O-N 3.37Å
286	T	69.1	Low	78.7	Confident	72 Å²	72	50.4 Å²	50.4	44%	0.442	26%	0.258	S	S	.	.	S	Bend	trans	-81.9	125.8	174.5	53.4	0	0	0	0	111.9	S282 V283	S282-T286 WeakPolarHBondContact O-CG2 3.48Å; S282-T286 PolarHBondContact O-N 2.94Å; V283-T286 WeakPolarHBondContact CA-OG1 3.47Å; V283-T286 PolarHBondContact O-N 2.95Å; V283-T286 PolarHBondContact O-OG1 2.7Å
287	S	63.9	Low	78.4	Confident	42 Å²	42	51.2 Å²	51.2	29%	0.294	26%	0.262	S	S	.	.	P	Polyproline II helix	trans	-74.4	151.5	170.2	46.5	0	0	0	0	111.6	Q793	S287-Q793 VanDerWaalsContact C-OE1 3.24Å; S287-Q793 PolarHBondContact O-OE1 2.98Å; S287-Q793 PolarHBondContact OG-OE1 3.41Å
288	N	63.9	Low	78.4	Confident	152 Å²	152	55.1 Å²	55.1	81%	0.813	28%	0.282	S	S	*	.	P	Polyproline II helix	trans	-74.4	133.2	175.7	-71.9	-39.3	0	0	0	110.2	R290	N288-R290 PolarHBondContact O-N 3.05Å
289	P	61.9	Low	78.5	Confident	67 Å²	67	49.3 Å²	49.3	44%	0.435	26%	0.257	S	S	.	.	P	Polyproline II helix	trans	-64.5	123.1	-178.9	25.4	-33.2	0	0	0	111.3
290	R	67.8	Low	78.5	Confident	168 Å²	168	48.6 Å²	48.6	63%	0.634	25%	0.254	S	S	*	.	P	Polyproline II helix	trans	-84.2	146.1	176	-174.7	175.7	173.9	-177.5	-3.3	111.3	N288 K292	N288-R290 PolarHBondContact O-N 3.05Å; R290-K292 PolarHBondContact O-N 3.38Å
291	H	68.1	Low	78.5	Confident	72 Å²	72	49.6 Å²	49.6	33%	0.333	26%	0.26	S	S	.	.			trans	-73.8	105.2	166.5	-176.6	-72.6	0	0	0	109.9
292	K	75.9	Confident	78.8	Confident	31 Å²	31	52.2 Å²	52.2	14%	0.135	28%	0.278	C	S	.	.			trans	-79.2	135.7	178	-58.3	-170	-175.2	-172.9	0	110.9	R290 I378 I792 Q793 A795 D796 D814	R290-K292 PolarHBondContact O-N 3.38Å; K292-I378 HydrophobicContact CB-CG2 4.38Å; K292-I792 PolarHBondContact NZ-O 3.33Å; K292-Q793 VanDerWaalsContact CE-O 3.24Å; K292-Q793 WeakPolarHBondContact CE-O 3.31Å; K292-A795 VanDerWaalsContact CE-O 3.24Å; K292-A795 WeakPolarHBondContact CE-O 3.42Å; K292-A795 PolarHBondContact NZ-O 2.8Å; K292-D796 WeakPolarHBondContact CD-O 3.43Å; K292-D814 WeakPolarHBondContact CD-OD2 3.37Å; K292-D814 WeakPolarHBondContact CE-OD2 3.2Å; K292-D814 IonicContact NZ-OD1 3.74Å; K292-D814 IonicContact NZ-OD2 3.71Å; K292-D814 PolarHBondContact NZ-OD2 3.09Å
293	V	79.3	Confident	79.4	Confident	39 Å²	39	51.5 Å²	51.5	24%	0.236	27%	0.272	C	S	.	.			trans	-121.3	131.6	-179.1	-178.6	0	0	0	0	107.8	Y79 D297 L298 Q381	Y79-V293 HydrophobicContact CE1-CG1 4.41Å; Y79-V293 WeakPolarHBondContact OH-CG2 3.31Å; V293-D297 HydrophobicContact CG1-CB 4.32Å; V293-L298 HydrophobicContact CG1-CD2 4.34Å; V293-L298 HydrophobicContact CG1-CG 4.41Å; V293-Q381 PolarHBondContact O-NE2 2.96Å; V293-Q381 VanDerWaalsContact O-NE2 3.17Å
294	G	83.8	Confident	79.8	Confident	1 Å²	1	49.5 Å²	49.5	1%	0.01	26%	0.26	C	S	.	.			trans	-60.1	137.9	179.5	0	0	0	0	0	112.5	F296 D297 L298	G294-F296 PolarHBondContact O-N 3.22Å; G294-D297 WeakPolarHBondContact O-CB 3.29Å; G294-D297 PolarHBondContact O-N 3.41Å; G294-D297 VanDerWaalsContact O-N 3.13Å; G294-L298 PolarHBondContact O-N 3.35Å
295	L	88.7	Confident	80.4	Confident	49 Å²	49	52.9 Å²	52.9	26%	0.257	27%	0.274	S	S	.	.	H	α-helix	trans	-59.8	-38.1	168.6	176.1	65.2	0	0	0	110.6	D297 L298 E299 L778	L295-D297 VanDerWaalsContact C-N 3.3Å; L295-D297 PolarHBondContact O-N 3.27Å; L295-L298 WeakPolarHBondContact O-CB 3.43Å; L295-L298 PolarHBondContact O-N 2.72Å; L295-L298 VanDerWaalsContact O-N 3.12Å; L295-E299 WeakPolarHBondContact O-CG 3.49Å; L295-E299 PolarHBondContact O-N 2.68Å; L295-L778 HydrophobicContact CB-CD1 4.27Å; L295-L778 HydrophobicContact CB-CD2 4.09Å; L295-L778 HydrophobicContact CD2-CD1 3.96Å; L295-L778 HydrophobicContact CD2-CD2 4.26Å; L295-L778 HydrophobicContact CD2-CG 4.04Å
296	F	89.4	Confident	81.3	Confident	6 Å²	6	53.9 Å²	53.9	3%	0.026	28%	0.278	C	S	.	.	H	α-helix	trans	-57.5	-42.1	174.5	-175.3	-92.9	0	0	0	112.2	G294 L298 E299 V300 L351 E380 Y835 S838 A839 L918	G294-F296 PolarHBondContact O-N 3.22Å; F296-L298 VanDerWaalsContact C-N 3.3Å; F296-L298 PolarHBondContact O-N 2.83Å; F296-E299 PolarHBondContact O-N 2.74Å; F296-V300 HydrophobicContact CD1-CG2 3.95Å; F296-V300 HydrophobicContact CE1-CG2 3.55Å; F296-V300 HydrophobicContact CZ-CG2 3.89Å; F296-V300 WeakPolarHBondContact O-CG2 3.36Å; F296-V300 PolarHBondContact O-N 3.22Å; F296-L351 HydrophobicContact CE1-CD1 3.91Å; F296-L351 HydrophobicContact CE1-CD2 3.69Å; F296-L351 HydrophobicContact CE1-CG 4.43Å; F296-L351 HydrophobicContact CZ-CD2 4.25Å; F296-E380 HydrophobicContact CB-CB 4.37Å; F296-E380 WeakPolarHBondContact CB-OE2 3.42Å; F296-E380 WeakPolarHBondContact CD1-OE2 3.22Å; F296-E380 VanDerWaalsContact CG-OE2 3.28Å; F296-E380 WeakPolarHBondContact CG-OE2 3.42Å; F296-Y835 HydrophobicContact CD2-CD2 4.03Å; F296-Y835 AromaticContact CD2-CE2 3.77Å; F296-Y835 HydrophobicContact CD2-CE2 3.77Å; F296-Y835 HydrophobicContact CE2-CE2 4.31Å; F296-S838 WeakPolarHBondContact CZ-O 3.35Å; F296-A839 HydrophobicContact CE2-CB 4.21Å; F296-L918 HydrophobicContact CD2-CD2 4.05Å; F296-L918 HydrophobicContact CE2-CD1 4.45Å; F296-L918 HydrophobicContact CE2-CD2 3.7Å; F296-L918 HydrophobicContact CE2-CG 4.45Å; F296-L918 HydrophobicContact CZ-CD2 4.22Å
297	D	88.3	Confident	82.4	Confident	17 Å²	17	50.7 Å²	50.7	9%	0.091	26%	0.258	C	S	.	.	H	α-helix	trans	-63	-37.5	176.4	-74.2	-32.6	0	0	0	111.8	V293 G294 L295 N301 R348 K355	V293-D297 HydrophobicContact CG1-CB 4.32Å; G294-D297 WeakPolarHBondContact O-CB 3.29Å; G294-D297 PolarHBondContact O-N 3.41Å; G294-D297 VanDerWaalsContact O-N 3.13Å; L295-D297 VanDerWaalsContact C-N 3.3Å; L295-D297 PolarHBondContact O-N 3.27Å; D297-N301 VanDerWaalsContact O-CB 3.29Å; D297-N301 WeakPolarHBondContact O-CB 3.38Å; D297-N301 PolarHBondContact O-N 3.4Å; D297-R348 VanDerWaalsContact CG-NH1 3.34Å; D297-R348 IonicContact OD1-NH1 3.98Å; D297-R348 PolarHBondContact OD1-NH1 2.85Å; D297-R348 VanDerWaalsContact OD1-NH1 3.14Å; D297-R348 IonicContact OD2-NH1 2.71Å; D297-R348 IonicContact OD2-NH2 3.89Å; D297-K355 IonicContact OD1-NZ 3.62Å; D297-K355 PolarHBondContact OD1-NZ 3.11Å; D297-K355 IonicContact OD2-NZ 3.88Å; D297-K355 PolarHBondContact OD2-NZ 2.78Å
298	L	87.8	Confident	83.8	Confident	85 Å²	85	51.9 Å²	51.9	45%	0.445	26%	0.259	S	S	.	.	H	α-helix	trans	-67.8	-40.4	175.9	-63.7	175.6	0	0	0	111.9	V293 G294 L295 F296 N301 C302	V293-L298 HydrophobicContact CG1-CD2 4.34Å; V293-L298 HydrophobicContact CG1-CG 4.41Å; G294-L298 PolarHBondContact O-N 3.35Å; L295-L298 WeakPolarHBondContact O-CB 3.43Å; L295-L298 PolarHBondContact O-N 2.72Å; L295-L298 VanDerWaalsContact O-N 3.12Å; F296-L298 VanDerWaalsContact C-N 3.3Å; F296-L298 PolarHBondContact O-N 2.83Å; L298-N301 PolarHBondContact O-N 3.07Å; L298-C302 PolarHBondContact O-N 3.35Å
299	E	89.6	Confident	85.2	Confident	50 Å²	50	46.2 Å²	46.2	23%	0.234	24%	0.236	C	C	.	.	H	α-helix	trans	-64.4	-45.5	175.2	-70.7	176.3	161.1	0	0	111.3	L295 F296 N301 C302 L303 R384 L918	L295-E299 WeakPolarHBondContact O-CG 3.49Å; L295-E299 PolarHBondContact O-N 2.68Å; F296-E299 PolarHBondContact O-N 2.74Å; E299-N301 VanDerWaalsContact C-N 3.31Å; E299-N301 PolarHBondContact O-N 3.31Å; E299-C302 WeakPolarHBondContact O-CA 3.34Å; E299-C302 VanDerWaalsContact O-CB 3.29Å; E299-C302 WeakPolarHBondContact O-CB 3.38Å; E299-C302 PolarHBondContact O-N 3.33Å; E299-L303 PolarHBondContact O-N 3.45Å; E299-R384 IonicContact OE1-CZ 2.72Å; E299-R384 IonicContact OE1-NH1 3.09Å; E299-R384 PolarHBondContact OE1-NH1 2.66Å; E299-R384 IonicContact OE1-NH2 3.35Å; E299-R384 IonicContact OE2-NH1 3Å; E299-R384 PolarHBondContact OE2-NH1 3.32Å; E299-L918 HydrophobicContact CB-CD2 3.92Å
300	V	89	Confident	86.6	Confident	9 Å²	9	45.1 Å²	45.1	6%	0.055	23%	0.233	C	C	.	.	H	α-helix	trans	-61.6	-39.4	174.6	171.2	0	0	0	0	111.4	F296 C302 L303 T304 L347 L351 L918	F296-V300 HydrophobicContact CD1-CG2 3.95Å; F296-V300 HydrophobicContact CE1-CG2 3.55Å; F296-V300 HydrophobicContact CZ-CG2 3.89Å; F296-V300 WeakPolarHBondContact O-CG2 3.36Å; F296-V300 PolarHBondContact O-N 3.22Å; V300-C302 VanDerWaalsContact C-N 3.3Å; V300-C302 PolarHBondContact O-N 3.1Å; V300-L303 PolarHBondContact O-N 2.79Å; V300-T304 WeakPolarHBondContact O-CB 3.43Å; V300-T304 PolarHBondContact O-N 2.84Å; V300-T304 PolarHBondContact O-OG1 3.16Å; V300-L347 HydrophobicContact CG1-CD2 3.66Å; V300-L347 HydrophobicContact CG1-CG 4.31Å; V300-L351 HydrophobicContact CG1-CD1 4.24Å; V300-L351 HydrophobicContact CG2-CD1 4.24Å; V300-L918 HydrophobicContact CG2-CD2 3.98Å
301	N	89.1	Confident	87.9	Confident	24 Å²	24	37.2 Å²	37.2	13%	0.128	20%	0.203	C	C	.	.	H	α-helix	trans	-64.2	-35.2	173.9	-175.4	57.2	0	0	0	111.9	D297 L298 E299 T304 K305	D297-N301 VanDerWaalsContact O-CB 3.29Å; D297-N301 WeakPolarHBondContact O-CB 3.38Å; D297-N301 PolarHBondContact O-N 3.4Å; L298-N301 PolarHBondContact O-N 3.07Å; E299-N301 VanDerWaalsContact C-N 3.31Å; E299-N301 PolarHBondContact O-N 3.31Å; N301-T304 PolarHBondContact O-N 2.72Å; N301-K305 WeakPolarHBondContact O-CG 3.41Å; N301-K305 PolarHBondContact O-N 3.39Å; N301-K305 VanDerWaalsContact O-N 3.12Å
302	C	90.1	Very high	89.1	Confident	56 Å²	56	36.1 Å²	36.1	38%	0.378	20%	0.201	S	C	.	.	H	α-helix	trans	-64.8	-46.6	172.1	-172.9	0	0	0	0	111.8	L298 E299 V300 T304 K305 I306	L298-C302 PolarHBondContact O-N 3.35Å; E299-C302 WeakPolarHBondContact O-CA 3.34Å; E299-C302 VanDerWaalsContact O-CB 3.29Å; E299-C302 WeakPolarHBondContact O-CB 3.38Å; E299-C302 PolarHBondContact O-N 3.33Å; V300-C302 VanDerWaalsContact C-N 3.3Å; V300-C302 PolarHBondContact O-N 3.1Å; C302-T304 VanDerWaalsContact C-N 3.28Å; C302-T304 PolarHBondContact O-N 3.23Å; C302-K305 WeakPolarHBondContact O-CB 3.29Å; C302-K305 PolarHBondContact O-N 3.45Å; C302-K305 VanDerWaalsContact O-N 3.14Å; C302-I306 PolarHBondContact O-N 3.34Å; C302-I306 VanDerWaalsContact O-N 3.16Å
303	L	89.6	Confident	90	Very high	6 Å²	6	38.8 Å²	38.8	3%	0.031	22%	0.22	C	C	.	.	H	α-helix	trans	-60.2	-39	175.1	-66.9	179.2	0	0	0	112.1	E299 V300 K305 I306 L307 L918 F920 F923	E299-L303 PolarHBondContact O-N 3.45Å; V300-L303 PolarHBondContact O-N 2.79Å; L303-K305 VanDerWaalsContact C-N 3.33Å; L303-K305 PolarHBondContact O-N 2.99Å; L303-I306 WeakPolarHBondContact O-CB 3.36Å; L303-I306 PolarHBondContact O-N 3.38Å; L303-L307 WeakPolarHBondContact O-CG 3.43Å; L303-L307 PolarHBondContact O-N 2.82Å; L303-L918 HydrophobicContact CD1-CD1 3.96Å; L303-L918 HydrophobicContact CD1-CD2 4.14Å; L303-L918 HydrophobicContact CD1-CG 3.92Å; L303-F920 HydrophobicContact CD2-CD1 4.14Å; L303-F920 HydrophobicContact CD2-CE1 3.97Å; L303-F923 HydrophobicContact CD1-CD2 4.24Å; L303-F923 HydrophobicContact CD2-CB 4.29Å; L303-F923 HydrophobicContact CD2-CD1 4.19Å; L303-F923 HydrophobicContact CD2-CD2 3.99Å; L303-F923 HydrophobicContact CD2-CE2 4.35Å; L303-F923 HydrophobicContact CD2-CG 3.89Å
304	T	88.5	Confident	90.6	Very high	3 Å²	3	39.3 Å²	39.3	2%	0.018	22%	0.223	C	C	.	.	H	α-helix	trans	-60.7	-41.7	175.4	-57.8	0	0	0	0	111.6	F80 F81 V300 N301 C302 I306 L307 F308 V343	F80-T304 HydrophobicContact CD1-CG2 4.37Å; F80-T304 HydrophobicContact CE1-CG2 4.48Å; F81-T304 HydrophobicContact CB-CG2 4.4Å; F81-T304 HydrophobicContact CD2-CG2 3.57Å; F81-T304 HydrophobicContact CE2-CG2 4.34Å; F81-T304 HydrophobicContact CG-CG2 4.42Å; V300-T304 WeakPolarHBondContact O-CB 3.43Å; V300-T304 PolarHBondContact O-N 2.84Å; V300-T304 PolarHBondContact O-OG1 3.16Å; N301-T304 PolarHBondContact O-N 2.72Å; C302-T304 VanDerWaalsContact C-N 3.28Å; C302-T304 PolarHBondContact O-N 3.23Å; T304-I306 VanDerWaalsContact C-N 3.31Å; T304-I306 PolarHBondContact O-N 2.93Å; T304-L307 PolarHBondContact O-N 2.71Å; T304-F308 WeakPolarHBondContact O-CB 3.27Å; T304-F308 PolarHBondContact O-N 2.92Å; T304-V343 HydrophobicContact CG2-CG1 3.7Å
305	K	91.5	Very high	91	Very high	110 Å²	110	39.3 Å²	39.3	48%	0.478	22%	0.223	S	C	.	.	H	α-helix	trans	-62.8	-38.5	175.6	-69.6	172	-176.1	-177.1	0	111.9	F80 N301 C302 L303 F308 G309	F80-K305 HydrophobicContact CD1-CG 3.76Å; F80-K305 HydrophobicContact CE1-CG 4.12Å; F80-K305 HydrophobicContact CG-CG 4.22Å; N301-K305 WeakPolarHBondContact O-CG 3.41Å; N301-K305 PolarHBondContact O-N 3.39Å; N301-K305 VanDerWaalsContact O-N 3.12Å; C302-K305 WeakPolarHBondContact O-CB 3.29Å; C302-K305 PolarHBondContact O-N 3.45Å; C302-K305 VanDerWaalsContact O-N 3.14Å; L303-K305 VanDerWaalsContact C-N 3.33Å; L303-K305 PolarHBondContact O-N 2.99Å; K305-F308 PolarHBondContact O-N 3.29Å; K305-G309 PolarHBondContact O-N 3.48Å
306	I	92.4	Very high	91.2	Very high	73 Å²	73	40.5 Å²	40.5	37%	0.374	23%	0.229	S	C	.	.	H	α-helix	trans	-66.4	-44.6	176	-66.3	167.6	0	0	0	110.6	C302 L303 T304 F308 G309 A310 F920 F923	C302-I306 PolarHBondContact O-N 3.34Å; C302-I306 VanDerWaalsContact O-N 3.16Å; L303-I306 WeakPolarHBondContact O-CB 3.36Å; L303-I306 PolarHBondContact O-N 3.38Å; T304-I306 VanDerWaalsContact C-N 3.31Å; T304-I306 PolarHBondContact O-N 2.93Å; I306-F308 VanDerWaalsContact C-N 3.3Å; I306-F308 PolarHBondContact O-N 2.81Å; I306-G309 PolarHBondContact O-N 2.97Å; I306-G309 VanDerWaalsContact O-N 3.15Å; I306-A310 PolarHBondContact O-N 3.29Å; I306-F920 HydrophobicContact CD1-CD1 4.1Å; I306-F920 HydrophobicContact CD1-CE1 3.36Å; I306-F920 HydrophobicContact CD1-CZ 4.21Å; I306-F923 HydrophobicContact CG2-CE1 4.34Å
307	L	91.8	Very high	91.4	Very high	4 Å²	4	43.7 Å²	43.7	2%	0.021	25%	0.249	C	C	.	.	H	α-helix	trans	-60.8	-39.3	175.2	-72.7	172.4	0	0	0	111.9	L303 T304 A310 L311 I342 V343 I846 L850 F923	L303-L307 WeakPolarHBondContact O-CG 3.43Å; L303-L307 PolarHBondContact O-N 2.82Å; T304-L307 PolarHBondContact O-N 2.71Å; L307-A310 PolarHBondContact O-N 2.85Å; L307-L311 WeakPolarHBondContact O-CB 3.23Å; L307-L311 PolarHBondContact O-N 2.99Å; L307-I342 HydrophobicContact CB-CG2 4.12Å; L307-I342 HydrophobicContact CD2-CG2 4.11Å; L307-I342 WeakPolarHBondContact O-CG2 3.33Å; L307-V343 HydrophobicContact CB-CG2 4.14Å; L307-I846 HydrophobicContact CD1-CD1 4.32Å; L307-I846 HydrophobicContact CD1-CG1 4.23Å; L307-I846 HydrophobicContact CD1-CG2 4.01Å; L307-I846 HydrophobicContact CD2-CG2 4.44Å; L307-L850 HydrophobicContact CD2-CD1 4.29Å; L307-L850 HydrophobicContact CD2-CD2 4.06Å; L307-F923 HydrophobicContact CD1-CE2 4.4Å; L307-F923 HydrophobicContact CD2-CE2 4.11Å; L307-F923 HydrophobicContact CD2-CZ 3.71Å; L307-F923 HydrophobicContact CG-CE2 4.25Å; L307-F923 HydrophobicContact CG-CZ 3.97Å
308	F	92.8	Very high	91.5	Very high	68 Å²	68	43.2 Å²	43.2	30%	0.298	25%	0.246	S	C	.	.	H	α-helix	trans	-65.1	-40.5	173	178.9	-97.2	0	0	0	112.3	F80 Y84 T304 K305 I306 A310 L311 V312	F80-F308 HydrophobicContact CE1-CB 3.96Å; F80-F308 HydrophobicContact CE1-CD1 4.46Å; F80-F308 HydrophobicContact CE1-CG 4.1Å; F80-F308 HydrophobicContact CZ-CB 4.05Å; F80-F308 AromaticContact CZ-CD1 3.72Å; F80-F308 HydrophobicContact CZ-CD1 3.72Å; F80-F308 HydrophobicContact CZ-CD2 4.13Å; F80-F308 HydrophobicContact CZ-CE1 4.19Å; F80-F308 AromaticContact CZ-CG 3.68Å; F80-F308 HydrophobicContact CZ-CG 3.68Å; Y84-F308 AromaticContact CD2-CD2 3.73Å; Y84-F308 HydrophobicContact CD2-CD2 3.73Å; Y84-F308 AromaticContact CD2-CE2 3.7Å; Y84-F308 HydrophobicContact CD2-CE2 3.7Å; Y84-F308 AromaticContact CE2-CD2 3.62Å; Y84-F308 HydrophobicContact CE2-CD2 3.62Å; Y84-F308 AromaticContact CE2-CE2 3.62Å; Y84-F308 HydrophobicContact CE2-CE2 3.62Å; T304-F308 WeakPolarHBondContact O-CB 3.27Å; T304-F308 PolarHBondContact O-N 2.92Å; K305-F308 PolarHBondContact O-N 3.29Å; I306-F308 VanDerWaalsContact C-N 3.3Å; I306-F308 PolarHBondContact O-N 2.81Å; F308-A310 VanDerWaalsContact C-N 3.34Å; F308-A310 PolarHBondContact O-N 3.37Å; F308-L311 HydrophobicContact CD2-CD2 4.14Å; F308-L311 HydrophobicContact CE2-CD2 4.46Å; F308-L311 WeakPolarHBondContact O-CB 3.4Å; F308-L311 PolarHBondContact O-N 3.27Å; F308-V312 HydrophobicContact CD1-CG2 4.46Å; F308-V312 HydrophobicContact CE1-CG2 4Å; F308-V312 HydrophobicContact CZ-CG2 4.05Å; F308-V312 WeakPolarHBondContact O-CG2 3.38Å; F308-V312 PolarHBondContact O-N 3.3Å
309	G	94.1	Very high	91.7	Very high	33 Å²	33	39.2 Å²	39.2	34%	0.34	23%	0.225	S	C	.	.	H	α-helix	trans	-59.3	-45.1	171.5	0	0	0	0	0	112.1	K305 I306 L311 V312 V313	K305-G309 PolarHBondContact O-N 3.48Å; I306-G309 PolarHBondContact O-N 2.97Å; I306-G309 VanDerWaalsContact O-N 3.15Å; G309-L311 PolarHBondContact O-N 3.43Å; G309-V312 PolarHBondContact O-N 2.86Å; G309-V313 WeakPolarHBondContact O-CG2 3.27Å; G309-V313 PolarHBondContact O-N 3.43Å
310	A	91.9	Very high	91.8	Very high	44 Å²	44	38.9 Å²	38.9	36%	0.364	23%	0.231	S	C	.	.	H	α-helix	trans	-62.5	-40.4	175.8	0	0	0	0	0	112.2	I306 L307 F308 V313 V314	I306-A310 PolarHBondContact O-N 3.29Å; L307-A310 PolarHBondContact O-N 2.85Å; F308-A310 VanDerWaalsContact C-N 3.34Å; F308-A310 PolarHBondContact O-N 3.37Å; A310-V313 PolarHBondContact O-N 2.91Å; A310-V314 WeakPolarHBondContact O-CG2 3.23Å; A310-V314 PolarHBondContact O-N 2.97Å
311	L	93.6	Very high	91.8	Very high	2 Å²	2	42.5 Å²	42.5	1%	0.01	25%	0.25	C	C	.	.	H	α-helix	trans	-54.7	-52.3	172.9	165.4	62.9	0	0	0	111.3	Y84 L307 F308 G309 V313 V314 S315 L336 F339 I342	Y84-L311 HydrophobicContact CE2-CD2 4.34Å; Y84-L311 WeakPolarHBondContact OH-CD2 3.19Å; L307-L311 WeakPolarHBondContact O-CB 3.23Å; L307-L311 PolarHBondContact O-N 2.99Å; F308-L311 HydrophobicContact CD2-CD2 4.14Å; F308-L311 HydrophobicContact CE2-CD2 4.46Å; F308-L311 WeakPolarHBondContact O-CB 3.4Å; F308-L311 PolarHBondContact O-N 3.27Å; G309-L311 PolarHBondContact O-N 3.43Å; L311-V313 VanDerWaalsContact C-N 3.32Å; L311-V313 PolarHBondContact O-N 3.36Å; L311-V314 PolarHBondContact O-N 2.71Å; L311-S315 PolarHBondContact O-N 3.42Å; L311-S315 PolarHBondContact O-OG 3.17Å; L311-L336 HydrophobicContact CD1-CD2 4.32Å; L311-L336 HydrophobicContact CD2-CD2 4.45Å; L311-L336 HydrophobicContact CG-CD2 3.91Å; L311-F339 HydrophobicContact CD1-CB 3.32Å; L311-F339 WeakPolarHBondContact CD1-O 3.36Å; L311-I342 HydrophobicContact CB-CB 4.5Å; L311-I342 HydrophobicContact CB-CD1 4.16Å; L311-I342 HydrophobicContact CB-CG2 4.39Å; L311-I342 HydrophobicContact CD1-CD1 4.12Å
312	V	94.1	Very high	91.8	Very high	48 Å²	48	43.7 Å²	43.7	29%	0.291	25%	0.254	S	S	.	.	H	α-helix	trans	-59.9	-44	178.9	175	0	0	0	0	111.3	F308 G309 S315 L316 L336	F308-V312 HydrophobicContact CD1-CG2 4.46Å; F308-V312 HydrophobicContact CE1-CG2 4Å; F308-V312 HydrophobicContact CZ-CG2 4.05Å; F308-V312 WeakPolarHBondContact O-CG2 3.38Å; F308-V312 PolarHBondContact O-N 3.3Å; G309-V312 PolarHBondContact O-N 2.86Å; V312-S315 PolarHBondContact O-N 3.5Å; V312-L316 HydrophobicContact CG1-CD1 3.88Å; V312-L316 HydrophobicContact CG1-CG 4.4Å; V312-L316 WeakPolarHBondContact O-CB 3.32Å; V312-L316 VanDerWaalsContact O-CG 3.28Å; V312-L316 WeakPolarHBondContact O-CG 3.45Å; V312-L316 PolarHBondContact O-N 3.13Å; V312-L336 HydrophobicContact CB-CD2 4.41Å; V312-L336 HydrophobicContact CG2-CD2 3.93Å
313	V	94.6	Very high	91.7	Very high	88 Å²	88	48.8 Å²	48.8	53%	0.533	27%	0.272	S	S	.	.	H	α-helix	trans	-62.1	-48.3	178.8	171.5	0	0	0	0	111.3	G309 A310 L311 S315 L316 V317	G309-V313 WeakPolarHBondContact O-CG2 3.27Å; G309-V313 PolarHBondContact O-N 3.43Å; A310-V313 PolarHBondContact O-N 2.91Å; L311-V313 VanDerWaalsContact C-N 3.32Å; L311-V313 PolarHBondContact O-N 3.36Å; V313-S315 PolarHBondContact O-N 3.04Å; V313-L316 PolarHBondContact O-N 3.43Å; V313-V317 HydrophobicContact CG1-CG2 4.33Å; V313-V317 VanDerWaalsContact O-CG2 3.29Å; V313-V317 WeakPolarHBondContact O-CG2 3.36Å; V313-V317 PolarHBondContact O-N 3.21Å
314	V	92.2	Very high	91.6	Very high	50 Å²	50	53.7 Å²	53.7	30%	0.303	29%	0.293	S	S	.	.	H	α-helix	trans	-62.1	-44.2	179.5	172.6	0	0	0	0	110.7	A310 L311 L316 V317 M318 F339	A310-V314 WeakPolarHBondContact O-CG2 3.23Å; A310-V314 PolarHBondContact O-N 2.97Å; L311-V314 PolarHBondContact O-N 2.71Å; V314-L316 VanDerWaalsContact C-N 3.34Å; V314-L316 PolarHBondContact O-N 3.11Å; V314-V317 PolarHBondContact O-N 3.17Å; V314-M318 WeakPolarHBondContact O-CG 3.48Å; V314-M318 PolarHBondContact O-N 2.95Å; V314-F339 HydrophobicContact CG1-CD2 3.95Å; V314-F339 HydrophobicContact CG1-CE2 3.82Å; V314-F339 HydrophobicContact CG1-CG 4.39Å; V314-F339 HydrophobicContact CG1-CZ 4.12Å
315	S	92.8	Very high	91.2	Very high	0 Å²	0	55.9 Å²	55.9	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-61	-41.2	176.7	-58.6	0	0	0	0	112.6	L311 V312 V313 M318 V319 F335 L336	L311-S315 PolarHBondContact O-N 3.42Å; L311-S315 PolarHBondContact O-OG 3.17Å; V312-S315 PolarHBondContact O-N 3.5Å; V313-S315 PolarHBondContact O-N 3.04Å; S315-M318 PolarHBondContact O-N 3.32Å; S315-V319 WeakPolarHBondContact O-CG2 3.49Å; S315-V319 PolarHBondContact O-N 3.22Å; S315-F335 VanDerWaalsContact OG-C 3.3Å; S315-F335 PolarHBondContact OG-O 3.22Å; S315-L336 WeakPolarHBondContact OG-CA 3.33Å; S315-L336 PolarHBondContact OG-N 3.31Å
316	L	93.1	Very high	90.8	Very high	74 Å²	74	53.8 Å²	53.8	39%	0.387	32%	0.322	S	S	.	.	H	α-helix	trans	-66.1	-42.5	176	-73.9	170.5	0	0	0	112.1	V312 V313 V314 M318 V319 A320 I332	V312-L316 HydrophobicContact CG1-CD1 3.88Å; V312-L316 HydrophobicContact CG1-CG 4.4Å; V312-L316 WeakPolarHBondContact O-CB 3.32Å; V312-L316 VanDerWaalsContact O-CG 3.28Å; V312-L316 WeakPolarHBondContact O-CG 3.45Å; V312-L316 PolarHBondContact O-N 3.13Å; V313-L316 PolarHBondContact O-N 3.43Å; V314-L316 VanDerWaalsContact C-N 3.34Å; V314-L316 PolarHBondContact O-N 3.11Å; L316-M318 VanDerWaalsContact C-N 3.32Å; L316-M318 PolarHBondContact O-N 2.88Å; L316-V319 PolarHBondContact O-N 3.26Å; L316-A320 WeakPolarHBondContact O-CB 3.41Å; L316-A320 PolarHBondContact O-N 3.12Å; L316-I332 HydrophobicContact CD2-CD1 3.78Å; L316-I332 HydrophobicContact CD2-CG1 4.21Å; L316-I332 HydrophobicContact CD2-CG2 4.41Å
317	V	92.5	Very high	90.5	Very high	73 Å²	73	57.3 Å²	57.3	44%	0.442	33%	0.33	S	S	.	.	H	α-helix	trans	-60.3	-43.4	177.6	168.8	0	0	0	0	110.7	V313 V314 V319 A320 L321	V313-V317 HydrophobicContact CG1-CG2 4.33Å; V313-V317 VanDerWaalsContact O-CG2 3.29Å; V313-V317 WeakPolarHBondContact O-CG2 3.36Å; V313-V317 PolarHBondContact O-N 3.21Å; V314-V317 PolarHBondContact O-N 3.17Å; V317-V319 VanDerWaalsContact C-N 3.34Å; V317-V319 PolarHBondContact O-N 3.43Å; V317-A320 PolarHBondContact O-N 2.79Å; V317-L321 HydrophobicContact CG1-CD1 3.92Å; V317-L321 HydrophobicContact CG1-CG 4.32Å; V317-L321 WeakPolarHBondContact O-CB 3.36Å; V317-L321 VanDerWaalsContact O-CG 3.28Å; V317-L321 WeakPolarHBondContact O-CG 2.93Å; V317-L321 PolarHBondContact O-N 3.09Å
318	M	90.9	Very high	90.3	Very high	8 Å²	8	63.1 Å²	63.1	4%	0.039	35%	0.352	C	S	.	.	H	α-helix	trans	-61.7	-41.1	178.5	-66.2	-61.9	-81.9	0	0	112.4	V314 S315 L316 L321 Q322 F335 F339 S860 F865	V314-M318 WeakPolarHBondContact O-CG 3.48Å; V314-M318 PolarHBondContact O-N 2.95Å; S315-M318 PolarHBondContact O-N 3.32Å; L316-M318 VanDerWaalsContact C-N 3.32Å; L316-M318 PolarHBondContact O-N 2.88Å; M318-L321 PolarHBondContact O-N 3.41Å; M318-Q322 PolarHBondContact O-N 2.88Å; M318-Q322 VanDerWaalsContact O-N 3.1Å; M318-F335 HydrophobicContact CB-CD1 4.09Å; M318-F335 HydrophobicContact CB-CD2 4.21Å; M318-F335 HydrophobicContact CB-CE1 3.99Å; M318-F335 HydrophobicContact CB-CE2 4.1Å; M318-F335 HydrophobicContact CB-CG 4.2Å; M318-F335 HydrophobicContact CB-CZ 3.98Å; M318-F335 HydrophobicContact CE-CE1 4.23Å; M318-F335 HydrophobicContact CG-CD1 4.44Å; M318-F335 HydrophobicContact CG-CE1 4.4Å; M318-F339 HydrophobicContact CE-CZ 4.37Å; M318-F339 HydrophobicContact CG-CE2 3.81Å; M318-F339 HydrophobicContact CG-CZ 4.09Å; M318-S860 VanDerWaalsContact CE-CB 3.4Å; M318-F865 HydrophobicContact CE-CD1 3.75Å; M318-F865 HydrophobicContact CE-CE1 4.4Å; M318-F865 HydrophobicContact SD-CD1 4.02Å; M318-F865 HydrophobicContact SD-CE1 4.31Å
319	V	91.9	Very high	90	Very high	0 Å²	0	65.1 Å²	65.1	0%	0	36%	0.358	C	S	.	.	H	α-helix	trans	-71.3	-36.7	176.8	177.1	0	0	0	0	112	S315 L316 V317 L321 Q322 H323 F324 W328 Q331 I332 F335	S315-V319 WeakPolarHBondContact O-CG2 3.49Å; S315-V319 PolarHBondContact O-N 3.22Å; L316-V319 PolarHBondContact O-N 3.26Å; V317-V319 VanDerWaalsContact C-N 3.34Å; V317-V319 PolarHBondContact O-N 3.43Å; V319-L321 VanDerWaalsContact C-N 3.35Å; V319-Q322 CarbonylContact O-C 3.59Å; V319-Q322 WeakPolarHBondContact O-CA 3.48Å; V319-Q322 WeakPolarHBondContact O-CB 3.12Å; V319-Q322 PolarHBondContact O-N 2.96Å; V319-Q322 VanDerWaalsContact O-N 3.15Å; V319-H323 PolarHBondContact O-N 3.4Å; V319-F324 HydrophobicContact CG1-CD1 3.8Å; V319-F324 HydrophobicContact CG1-CE1 4.16Å; V319-F324 PolarHBondContact O-N 3.22Å; V319-F324 VanDerWaalsContact O-N 3.12Å; V319-W328 HydrophobicContact CG1-CB 4.12Å; V319-Q331 HydrophobicContact CG2-CB 4.08Å; V319-I332 HydrophobicContact CB-CG1 4.14Å; V319-I332 HydrophobicContact CG1-CG1 4.12Å; V319-I332 HydrophobicContact CG2-CG1 3.77Å; V319-F335 HydrophobicContact CG2-CD2 3.53Å; V319-F335 HydrophobicContact CG2-CE2 3.95Å
320	A	90.9	Very high	89.7	Confident	43 Å²	43	64.8 Å²	64.8	36%	0.355	35%	0.349	S	S	.	.	H	α-helix	trans	-64.1	-40.6	175.3	0	0	0	0	0	111.5	L316 V317 Q322 H323 F324	L316-A320 WeakPolarHBondContact O-CB 3.41Å; L316-A320 PolarHBondContact O-N 3.12Å; V317-A320 PolarHBondContact O-N 2.79Å; A320-Q322 PolarHBondContact O-N 2.95Å; A320-H323 WeakPolarHBondContact O-CA 3.24Å; A320-H323 PolarHBondContact O-N 2.91Å; A320-F324 HydrophobicContact CB-CE2 4.01Å; A320-F324 HydrophobicContact CB-CZ 3.95Å
321	L	90.3	Very high	89.4	Confident	85 Å²	85	64.3 Å²	64.3	45%	0.445	34%	0.339	S	S	.	.	H	α-helix	trans	-66.5	-27.7	173.3	-68.3	173.6	0	0	0	112.3	V317 M318 V319 H323 F865	V317-L321 HydrophobicContact CG1-CD1 3.92Å; V317-L321 HydrophobicContact CG1-CG 4.32Å; V317-L321 WeakPolarHBondContact O-CB 3.36Å; V317-L321 VanDerWaalsContact O-CG 3.28Å; V317-L321 WeakPolarHBondContact O-CG 2.93Å; V317-L321 PolarHBondContact O-N 3.09Å; M318-L321 PolarHBondContact O-N 3.41Å; V319-L321 VanDerWaalsContact C-N 3.35Å; L321-H323 PolarHBondContact O-CE1 2.63Å; L321-H323 PolarHBondContact O-N 3.16Å; L321-H323 PolarHBondContact O-ND1 2.9Å; L321-F865 HydrophobicContact CB-CD1 4.08Å; L321-F865 HydrophobicContact CB-CE1 3.77Å; L321-F865 HydrophobicContact CB-CE2 4.21Å; L321-F865 HydrophobicContact CB-CG 4.45Å; L321-F865 HydrophobicContact CB-CZ 3.85Å; L321-F865 HydrophobicContact CD1-CD1 4.4Å; L321-F865 HydrophobicContact CD1-CE1 3.58Å; L321-F865 HydrophobicContact CD1-CZ 3.98Å; L321-F865 HydrophobicContact CG-CE1 4.31Å; L321-F865 HydrophobicContact CG-CZ 4.44Å
322	Q	87.7	Confident	89.2	Confident	49 Å²	49	65.3 Å²	65.3	23%	0.229	34%	0.344	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.8	7.3	168.2	-155.9	-179.5	-0.6	0	0	113.2	M318 V319 A320 F324 A325 F865	M318-Q322 PolarHBondContact O-N 2.88Å; M318-Q322 VanDerWaalsContact O-N 3.1Å; V319-Q322 CarbonylContact O-C 3.59Å; V319-Q322 WeakPolarHBondContact O-CA 3.48Å; V319-Q322 WeakPolarHBondContact O-CB 3.12Å; V319-Q322 PolarHBondContact O-N 2.96Å; V319-Q322 VanDerWaalsContact O-N 3.15Å; A320-Q322 PolarHBondContact O-N 2.95Å; Q322-F324 PolarHBondContact O-N 3.22Å; Q322-A325 WeakPolarHBondContact O-CB 3.34Å; Q322-A325 PolarHBondContact O-N 3.04Å; Q322-F865 HydrophobicContact CB-CB 4.37Å
323	H	88.3	Confident	89	Confident	164 Å²	164	68.2 Å²	68.2	76%	0.759	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.8	30.4	179.4	-56.5	73.4	0	0	0	113.7	V319 A320 L321 A325	V319-H323 PolarHBondContact O-N 3.4Å; A320-H323 WeakPolarHBondContact O-CA 3.24Å; A320-H323 PolarHBondContact O-N 2.91Å; L321-H323 PolarHBondContact O-CE1 2.63Å; L321-H323 PolarHBondContact O-N 3.16Å; L321-H323 PolarHBondContact O-ND1 2.9Å; H323-A325 PolarHBondContact O-N 3.22Å; H323-A325 VanDerWaalsContact O-N 3.15Å
324	F	88.2	Confident	88.7	Confident	108 Å²	108	68.6 Å²	68.6	47%	0.474	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.3	33	-177	-59.9	-85.4	0	0	0	113.8	V319 A320 Q322 W328	V319-F324 HydrophobicContact CG1-CD1 3.8Å; V319-F324 HydrophobicContact CG1-CE1 4.16Å; V319-F324 PolarHBondContact O-N 3.22Å; V319-F324 VanDerWaalsContact O-N 3.12Å; A320-F324 HydrophobicContact CB-CE2 4.01Å; A320-F324 HydrophobicContact CB-CZ 3.95Å; Q322-F324 PolarHBondContact O-N 3.22Å; F324-W328 HydrophobicContact CB-CB 4.15Å; F324-W328 HydrophobicContact CB-CG 4.44Å; F324-W328 HydrophobicContact CD1-CB 4.24Å; F324-W328 HydrophobicContact CD1-CE3 4.49Å; F324-W328 HydrophobicContact CD1-CG 4.45Å
325	A	79.6	Confident	88.6	Confident	50 Å²	50	66.2 Å²	66.2	41%	0.413	33%	0.331	S	S	.	.			trans	-71.3	132.9	-176.2	0	0	0	0	0	113	Q322 H323 Q331	Q322-A325 WeakPolarHBondContact O-CB 3.34Å; Q322-A325 PolarHBondContact O-N 3.04Å; H323-A325 PolarHBondContact O-N 3.22Å; H323-A325 VanDerWaalsContact O-N 3.15Å; A325-Q331 PolarHBondContact O-NE2 3.47Å; A325-Q331 PolarHBondContact O-OE1 2.82Å; A325-Q331 VanDerWaalsContact O-OE1 3.1Å
326	G	82.4	Confident	88.6	Confident	66 Å²	66	67.8 Å²	67.8	68%	0.68	34%	0.339	S	S	*	.	S	Bend	trans	76.8	-144	175.7	0	0	0	0	0	113.9	W328	G326-W328 PolarHBondContact O-N 3.09Å
327	R	87.3	Confident	88.4	Confident	146 Å²	146	64.7 Å²	64.7	55%	0.551	32%	0.323	S	S	*	.	S	Bend	trans	-76.8	68.1	176	-64	-175.5	-176.4	-177.2	1.6	110.3	E96 Y329 L330 Q331	E96-R327 IonicContact OE1-NH1 3.58Å; R327-Y329 HydrophobicContact CB-CE1 4.06Å; R327-Y329 HydrophobicContact CG-CE1 4.37Å; R327-Y329 PolarHBondContact O-N 3.48Å; R327-Y329 VanDerWaalsContact O-N 3.15Å; R327-L330 HydrophobicContact CB-CB 4.26Å; R327-L330 HydrophobicContact CB-CD1 4.02Å; R327-L330 HydrophobicContact CB-CG 4.26Å; R327-L330 VanDerWaalsContact CD-CD1 3.48Å; R327-L330 HydrophobicContact CG-CD1 4.41Å; R327-L330 PolarHBondContact O-N 3.34Å; R327-Q331 PolarHBondContact O-N 3Å; R327-Q331 VanDerWaalsContact O-N 3.12Å
328	W	87.4	Confident	88.2	Confident	126 Å²	126	61.8 Å²	61.8	48%	0.477	30%	0.304	S	S	.	.	H	α-helix	trans	-54.1	-34.7	-174.5	60.6	-95.8	0	0	0	113.1	V319 F324 G326 Q331 I332	V319-W328 HydrophobicContact CG1-CB 4.12Å; F324-W328 HydrophobicContact CB-CB 4.15Å; F324-W328 HydrophobicContact CB-CG 4.44Å; F324-W328 HydrophobicContact CD1-CB 4.24Å; F324-W328 HydrophobicContact CD1-CE3 4.49Å; F324-W328 HydrophobicContact CD1-CG 4.45Å; G326-W328 PolarHBondContact O-N 3.09Å; W328-Q331 WeakPolarHBondContact O-CB 3.03Å; W328-Q331 PolarHBondContact O-N 3.17Å; W328-I332 HydrophobicContact CE3-CD1 3.64Å; W328-I332 HydrophobicContact CZ3-CD1 3.82Å; W328-I332 WeakPolarHBondContact O-CG1 3.42Å; W328-I332 PolarHBondContact O-N 3.38Å
329	Y	87.3	Confident	88.3	Confident	110 Å²	110	61.4 Å²	61.4	43%	0.431	30%	0.302	S	S	.	.	H	α-helix	trans	-65.3	-40.9	177.6	59.5	-86.5	0	0	0	112.3	R327 Q331 I332 F333	R327-Y329 HydrophobicContact CB-CE1 4.06Å; R327-Y329 HydrophobicContact CG-CE1 4.37Å; R327-Y329 PolarHBondContact O-N 3.48Å; R327-Y329 VanDerWaalsContact O-N 3.15Å; Y329-Q331 VanDerWaalsContact C-N 3.35Å; Y329-I332 PolarHBondContact O-N 3.15Å; Y329-F333 WeakPolarHBondContact O-CD2 3.45Å; Y329-F333 PolarHBondContact O-N 3.09Å
330	L	86.8	Confident	88.1	Confident	26 Å²	26	61.6 Å²	61.6	14%	0.136	30%	0.304	C	S	.	.	H	α-helix	trans	-67.6	-37.8	173.6	-67.6	178.9	0	0	0	111.1	L97 R327 I332 F333 R334	L97-L330 HydrophobicContact CD2-CD2 3.96Å; R327-L330 HydrophobicContact CB-CB 4.26Å; R327-L330 HydrophobicContact CB-CD1 4.02Å; R327-L330 HydrophobicContact CB-CG 4.26Å; R327-L330 VanDerWaalsContact CD-CD1 3.48Å; R327-L330 HydrophobicContact CG-CD1 4.41Å; R327-L330 PolarHBondContact O-N 3.34Å; L330-I332 VanDerWaalsContact C-N 3.33Å; L330-I332 PolarHBondContact O-N 3.17Å; L330-F333 PolarHBondContact O-N 2.78Å; L330-R334 WeakPolarHBondContact O-CG 3.44Å; L330-R334 PolarHBondContact O-N 3.4Å
331	Q	86.3	Confident	87.9	Confident	34 Å²	34	61.8 Å²	61.8	16%	0.159	30%	0.297	C	S	.	.	H	α-helix	trans	-63.6	-38.7	176.8	-70.3	170.3	-11.3	0	0	111.8	V319 A325 R327 W328 Y329 F333 R334 F335	V319-Q331 HydrophobicContact CG2-CB 4.08Å; A325-Q331 PolarHBondContact O-NE2 3.47Å; A325-Q331 PolarHBondContact O-OE1 2.82Å; A325-Q331 VanDerWaalsContact O-OE1 3.1Å; R327-Q331 PolarHBondContact O-N 3Å; R327-Q331 VanDerWaalsContact O-N 3.12Å; W328-Q331 WeakPolarHBondContact O-CB 3.03Å; W328-Q331 PolarHBondContact O-N 3.17Å; Y329-Q331 VanDerWaalsContact C-N 3.35Å; Q331-F333 VanDerWaalsContact C-N 3.35Å; Q331-F333 PolarHBondContact O-N 3.46Å; Q331-R334 PolarHBondContact O-N 3.11Å; Q331-F335 WeakPolarHBondContact O-CD2 3.23Å; Q331-F335 PolarHBondContact O-N 2.66Å
332	I	89.7	Confident	88	Confident	24 Å²	24	58.1 Å²	58.1	12%	0.123	28%	0.278	C	S	.	.	H	α-helix	trans	-56.9	-49.5	172.9	-68.8	169.1	0	0	0	110.1	L316 V319 W328 Y329 L330 R334 F335 L336	L316-I332 HydrophobicContact CD2-CD1 3.78Å; L316-I332 HydrophobicContact CD2-CG1 4.21Å; L316-I332 HydrophobicContact CD2-CG2 4.41Å; V319-I332 HydrophobicContact CB-CG1 4.14Å; V319-I332 HydrophobicContact CG1-CG1 4.12Å; V319-I332 HydrophobicContact CG2-CG1 3.77Å; W328-I332 HydrophobicContact CE3-CD1 3.64Å; W328-I332 HydrophobicContact CZ3-CD1 3.82Å; W328-I332 WeakPolarHBondContact O-CG1 3.42Å; W328-I332 PolarHBondContact O-N 3.38Å; Y329-I332 PolarHBondContact O-N 3.15Å; L330-I332 VanDerWaalsContact C-N 3.33Å; L330-I332 PolarHBondContact O-N 3.17Å; I332-R334 PolarHBondContact O-N 2.92Å; I332-F335 PolarHBondContact O-N 2.93Å; I332-L336 HydrophobicContact CG2-CD1 4.02Å; I332-L336 HydrophobicContact CG2-CG 4.4Å; I332-L336 VanDerWaalsContact O-CG 3.32Å; I332-L336 WeakPolarHBondContact O-CG 3.34Å; I332-L336 PolarHBondContact O-N 3.16Å
333	F	89.3	Confident	88.1	Confident	109 Å²	109	55.9 Å²	55.9	48%	0.478	27%	0.268	S	S	.	.	H	α-helix	trans	-64.6	-39.2	177.8	-74.3	-71.7	0	0	0	112.6	L97 Y329 L330 Q331 F335 L336 L337	L97-F333 HydrophobicContact CD2-CB 3.62Å; L97-F333 HydrophobicContact CD2-CG 4.41Å; Y329-F333 WeakPolarHBondContact O-CD2 3.45Å; Y329-F333 PolarHBondContact O-N 3.09Å; L330-F333 PolarHBondContact O-N 2.78Å; Q331-F333 VanDerWaalsContact C-N 3.35Å; Q331-F333 PolarHBondContact O-N 3.46Å; F333-F335 PolarHBondContact O-N 2.75Å; F333-L336 HydrophobicContact CD1-CD1 4.07Å; F333-L336 HydrophobicContact CE1-CD1 4.44Å; F333-L336 WeakPolarHBondContact O-CB 3.35Å; F333-L336 PolarHBondContact O-N 3.11Å; F333-L337 VanDerWaalsContact O-CG 3.27Å; F333-L337 WeakPolarHBondContact O-CG 3.31Å; F333-L337 PolarHBondContact O-N 2.85Å
334	R	88.4	Confident	88.1	Confident	95 Å²	95	48.1 Å²	48.1	36%	0.358	23%	0.232	S	C	.	.	H	α-helix	trans	-63	-40.7	174.6	-70.1	179.5	81.9	178.7	6.7	111.7	L99 L330 Q331 I332 L337 L338	L99-R334 WeakPolarHBondContact CD1-O 3.49Å; L99-R334 HydrophobicContact CD2-CB 4.44Å; L330-R334 WeakPolarHBondContact O-CG 3.44Å; L330-R334 PolarHBondContact O-N 3.4Å; Q331-R334 PolarHBondContact O-N 3.11Å; I332-R334 PolarHBondContact O-N 2.92Å; R334-L337 PolarHBondContact O-N 2.92Å; R334-L338 VanDerWaalsContact O-CB 3.26Å; R334-L338 WeakPolarHBondContact O-CB 3.45Å; R334-L338 PolarHBondContact O-N 3.18Å
335	F	90.6	Very high	87.8	Confident	1 Å²	1	44.8 Å²	44.8	0%	0.004	22%	0.219	C	C	.	.	H	α-helix	trans	-69.5	-35.1	174	-80.4	-64.6	0	0	0	113	S315 M318 V319 Q331 I332 F333 L337 L338 F339 F865	S315-F335 VanDerWaalsContact OG-C 3.3Å; S315-F335 PolarHBondContact OG-O 3.22Å; M318-F335 HydrophobicContact CB-CD1 4.09Å; M318-F335 HydrophobicContact CB-CD2 4.21Å; M318-F335 HydrophobicContact CB-CE1 3.99Å; M318-F335 HydrophobicContact CB-CE2 4.1Å; M318-F335 HydrophobicContact CB-CG 4.2Å; M318-F335 HydrophobicContact CB-CZ 3.98Å; M318-F335 HydrophobicContact CE-CE1 4.23Å; M318-F335 HydrophobicContact CG-CD1 4.44Å; M318-F335 HydrophobicContact CG-CE1 4.4Å; V319-F335 HydrophobicContact CG2-CD2 3.53Å; V319-F335 HydrophobicContact CG2-CE2 3.95Å; Q331-F335 WeakPolarHBondContact O-CD2 3.23Å; Q331-F335 PolarHBondContact O-N 2.66Å; I332-F335 PolarHBondContact O-N 2.93Å; F333-F335 PolarHBondContact O-N 2.75Å; F335-L337 VanDerWaalsContact C-N 3.3Å; F335-L337 PolarHBondContact O-N 2.62Å; F335-L338 HydrophobicContact CD1-CD2 3.99Å; F335-L338 HydrophobicContact CE1-CD2 4.18Å; F335-L338 PolarHBondContact O-N 2.66Å; F335-F339 HydrophobicContact CB-CD2 4.33Å; F335-F339 HydrophobicContact CB-CE2 4.32Å; F335-F339 HydrophobicContact CD1-CD2 4.39Å; F335-F339 AromaticContact CD1-CE2 3.68Å; F335-F339 HydrophobicContact CD1-CE2 3.68Å; F335-F339 HydrophobicContact CD1-CZ 4.33Å; F335-F339 HydrophobicContact CE1-CE2 4.47Å; F335-F339 HydrophobicContact CG-CE2 4.4Å; F335-F339 WeakPolarHBondContact O-CB 3.49Å; F335-F339 WeakPolarHBondContact O-CD2 3.45Å; F335-F339 PolarHBondContact O-N 3.33Å; F335-F865 WeakPolarHBondContact CZ-O 3.17Å
336	L	91.3	Very high	88	Confident	32 Å²	32	43.4 Å²	43.4	17%	0.168	21%	0.206	C	C	.	.	H	α-helix	trans	-61.1	-41.6	173.5	-77.3	169.9	0	0	0	111.3	L311 V312 S315 I332 F333 S340	L311-L336 HydrophobicContact CD1-CD2 4.32Å; L311-L336 HydrophobicContact CD2-CD2 4.45Å; L311-L336 HydrophobicContact CG-CD2 3.91Å; V312-L336 HydrophobicContact CB-CD2 4.41Å; V312-L336 HydrophobicContact CG2-CD2 3.93Å; S315-L336 WeakPolarHBondContact OG-CA 3.33Å; S315-L336 PolarHBondContact OG-N 3.31Å; I332-L336 HydrophobicContact CG2-CD1 4.02Å; I332-L336 HydrophobicContact CG2-CG 4.4Å; I332-L336 VanDerWaalsContact O-CG 3.32Å; I332-L336 WeakPolarHBondContact O-CG 3.34Å; I332-L336 PolarHBondContact O-N 3.16Å; F333-L336 HydrophobicContact CD1-CD1 4.07Å; F333-L336 HydrophobicContact CE1-CD1 4.44Å; F333-L336 WeakPolarHBondContact O-CB 3.35Å; F333-L336 PolarHBondContact O-N 3.11Å; L336-S340 PolarHBondContact O-N 2.79Å; L336-S340 VanDerWaalsContact O-N 3.13Å
337	L	88.9	Confident	88.2	Confident	10 Å²	10	40.3 Å²	40.3	5%	0.052	17%	0.174	C	C	.	.	H	α-helix	trans	-70.6	-40.3	176	-65.7	176.9	0	0	0	111.7	L88 S91 Q92 L97 L99 F333 R334 F335 F339 S340	L88-L337 HydrophobicContact CD1-CD2 3.32Å; L88-L337 HydrophobicContact CG-CD2 4.4Å; S91-L337 WeakPolarHBondContact OG-CD2 3.1Å; Q92-L337 VanDerWaalsContact NE2-CD1 3.32Å; Q92-L337 VanDerWaalsContact NE2-CD2 3.3Å; L97-L337 HydrophobicContact CB-CD1 4.01Å; L97-L337 WeakPolarHBondContact O-CD1 3.27Å; L99-L337 HydrophobicContact CD1-CB 3.44Å; L99-L337 VanDerWaalsContact CD1-CB 3.44Å; L99-L337 HydrophobicContact CG-CB 4.21Å; F333-L337 VanDerWaalsContact O-CG 3.27Å; F333-L337 WeakPolarHBondContact O-CG 3.31Å; F333-L337 PolarHBondContact O-N 2.85Å; R334-L337 PolarHBondContact O-N 2.92Å; F335-L337 VanDerWaalsContact C-N 3.3Å; F335-L337 PolarHBondContact O-N 2.62Å; L337-F339 VanDerWaalsContact C-N 3.33Å; L337-F339 PolarHBondContact O-N 2.97Å; L337-S340 VanDerWaalsContact O-CB 3.3Å; L337-S340 WeakPolarHBondContact O-CB 3.5Å; L337-S340 PolarHBondContact O-N 3.48Å; L337-S340 PolarHBondContact O-OG 3.27Å
338	L	89.2	Confident	87.9	Confident	11 Å²	11	35.7 Å²	35.7	6%	0.058	16%	0.157	C	C	.	.	H	α-helix	trans	-63.5	-39.8	179.3	-174	63.3	0	0	0	112.1	L99 R334 F335 Q856 P869	L99-L338 HydrophobicContact CD1-CB 3.96Å; L99-L338 HydrophobicContact CD1-CD1 4.48Å; L99-L338 VanDerWaalsContact CD1-N 3.34Å; R334-L338 VanDerWaalsContact O-CB 3.26Å; R334-L338 WeakPolarHBondContact O-CB 3.45Å; R334-L338 PolarHBondContact O-N 3.18Å; F335-L338 HydrophobicContact CD1-CD2 3.99Å; F335-L338 HydrophobicContact CE1-CD2 4.18Å; F335-L338 PolarHBondContact O-N 2.66Å; L338-Q856 HydrophobicContact CD1-CG 4.09Å; L338-Q856 HydrophobicContact CD2-CG 4.16Å; L338-Q856 HydrophobicContact CG-CG 3.8Å; L338-P869 HydrophobicContact CD1-CB 3.94Å
339	F	92	Very high	87.7	Confident	0 Å²	0	31 Å²	31	0%	0	14%	0.141	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.2	8.6	177.4	-64.2	-54.7	0	0	0	113.5	L311 V314 M318 F335 L337 H341 I342 S853 Q856 A857	L311-F339 HydrophobicContact CD1-CB 3.32Å; L311-F339 WeakPolarHBondContact CD1-O 3.36Å; V314-F339 HydrophobicContact CG1-CD2 3.95Å; V314-F339 HydrophobicContact CG1-CE2 3.82Å; V314-F339 HydrophobicContact CG1-CG 4.39Å; V314-F339 HydrophobicContact CG1-CZ 4.12Å; M318-F339 HydrophobicContact CE-CZ 4.37Å; M318-F339 HydrophobicContact CG-CE2 3.81Å; M318-F339 HydrophobicContact CG-CZ 4.09Å; F335-F339 HydrophobicContact CB-CD2 4.33Å; F335-F339 HydrophobicContact CB-CE2 4.32Å; F335-F339 HydrophobicContact CD1-CD2 4.39Å; F335-F339 AromaticContact CD1-CE2 3.68Å; F335-F339 HydrophobicContact CD1-CE2 3.68Å; F335-F339 HydrophobicContact CD1-CZ 4.33Å; F335-F339 HydrophobicContact CE1-CE2 4.47Å; F335-F339 HydrophobicContact CG-CE2 4.4Å; F335-F339 WeakPolarHBondContact O-CB 3.49Å; F335-F339 WeakPolarHBondContact O-CD2 3.45Å; F335-F339 PolarHBondContact O-N 3.33Å; L337-F339 VanDerWaalsContact C-N 3.33Å; L337-F339 PolarHBondContact O-N 2.97Å; F339-H341 PolarHBondContact O-N 3.15Å; F339-I342 HydrophobicContact CB-CD1 3.94Å; F339-I342 HydrophobicContact CB-CG1 4.4Å; F339-I342 WeakPolarHBondContact O-CB 3.22Å; F339-I342 VanDerWaalsContact O-CG1 3.28Å; F339-I342 WeakPolarHBondContact O-CG1 3.27Å; F339-I342 PolarHBondContact O-N 3.16Å; F339-S853 WeakPolarHBondContact CD1-OG 3.41Å; F339-Q856 HydrophobicContact CD1-CG 4.25Å; F339-Q856 HydrophobicContact CE1-CB 4.2Å; F339-Q856 HydrophobicContact CE1-CG 3.88Å; F339-A857 HydrophobicContact CE1-CB 3.72Å; F339-A857 HydrophobicContact CZ-CB 3.99Å
340	S	89	Confident	87.7	Confident	4 Å²	4	25.9 Å²	25.9	3%	0.028	12%	0.122	C	C	.	.	G	3₁₀ helix	trans	-58.3	-22.9	-176.6	70.1	0	0	0	0	113.3	L336 L337 I342 V343	L336-S340 PolarHBondContact O-N 2.79Å; L336-S340 VanDerWaalsContact O-N 3.13Å; L337-S340 VanDerWaalsContact O-CB 3.3Å; L337-S340 WeakPolarHBondContact O-CB 3.5Å; L337-S340 PolarHBondContact O-N 3.48Å; L337-S340 PolarHBondContact O-OG 3.27Å; S340-I342 PolarHBondContact O-N 3.42Å; S340-V343 PolarHBondContact O-N 3.49Å
341	H	87.1	Confident	87.8	Confident	48 Å²	48	24.7 Å²	24.7	22%	0.222	12%	0.116	C	C	.	.	G	3₁₀ helix	trans	-64.3	-15.1	174.7	-67.9	-66.3	0	0	0	114.9	F339 V343 S849 I876	F339-H341 PolarHBondContact O-N 3.15Å; H341-V343 PolarHBondContact O-N 2.79Å; H341-S849 WeakPolarHBondContact O-CB 3.42Å; H341-S849 PolarHBondContact O-OG 3.43Å; H341-I876 WeakPolarHBondContact NE2-CD1 3.39Å
342	I	91.8	Very high	87.7	Confident	7 Å²	7	23.4 Å²	23.4	4%	0.036	11%	0.11	C	C	.	.	G	3₁₀ helix	trans	-53.2	-36.8	168.3	-71.4	177.4	0	0	0	110.7	L307 L311 F339 S340 P344 L850 S853	L307-I342 HydrophobicContact CB-CG2 4.12Å; L307-I342 HydrophobicContact CD2-CG2 4.11Å; L307-I342 WeakPolarHBondContact O-CG2 3.33Å; L311-I342 HydrophobicContact CB-CB 4.5Å; L311-I342 HydrophobicContact CB-CD1 4.16Å; L311-I342 HydrophobicContact CB-CG2 4.39Å; L311-I342 HydrophobicContact CD1-CD1 4.12Å; F339-I342 HydrophobicContact CB-CD1 3.94Å; F339-I342 HydrophobicContact CB-CG1 4.4Å; F339-I342 WeakPolarHBondContact O-CB 3.22Å; F339-I342 VanDerWaalsContact O-CG1 3.28Å; F339-I342 WeakPolarHBondContact O-CG1 3.27Å; F339-I342 PolarHBondContact O-N 3.16Å; S340-I342 PolarHBondContact O-N 3.42Å; I342-P344 VanDerWaalsContact O-CD 3.29Å; I342-P344 WeakPolarHBondContact O-CD 3.46Å; I342-L850 HydrophobicContact CB-CD2 4.46Å; I342-L850 HydrophobicContact CG1-CD2 4.4Å; I342-L850 HydrophobicContact CG2-CD2 3.95Å; I342-S853 WeakPolarHBondContact CD1-OG 3.45Å; I342-S853 VanDerWaalsContact CG1-CB 3.48Å; I342-S853 WeakPolarHBondContact CG1-OG 3.41Å
343	V	90.1	Very high	87.6	Confident	2 Å²	2	24.8 Å²	24.8	1%	0.012	12%	0.116	C	C	.	.	S	Bend	trans	-98.7	105.4	176	-173	0	0	0	0	108.8	Y84 F85 T304 L307 S340 H341 I345	Y84-V343 HydrophobicContact CD1-CB 4.43Å; Y84-V343 HydrophobicContact CD1-CG1 4.11Å; Y84-V343 HydrophobicContact CE1-CB 3.72Å; Y84-V343 HydrophobicContact CE1-CG1 3.89Å; Y84-V343 HydrophobicContact CE1-CG2 4.16Å; F85-V343 HydrophobicContact CE2-CG1 4.36Å; F85-V343 HydrophobicContact CZ-CB 4.35Å; F85-V343 HydrophobicContact CZ-CG1 3.78Å; F85-V343 WeakPolarHBondContact CZ-O 3.46Å; T304-V343 HydrophobicContact CG2-CG1 3.7Å; L307-V343 HydrophobicContact CB-CG2 4.14Å; S340-V343 PolarHBondContact O-N 3.49Å; H341-V343 PolarHBondContact O-N 2.79Å; V343-I345 PolarHBondContact O-N 3.14Å
344	P	86.7	Confident	87.7	Confident	2 Å²	2	19.6 Å²	19.6	1%	0.013	9%	0.094	C	C	.	.			trans	-70.3	113	-174.6	24.6	-34.5	0	0	0	113.1	F81 I342 S346 L347 V845 I846 S849	F81-P344 WeakPolarHBondContact CZ-O 3.29Å; I342-P344 VanDerWaalsContact O-CD 3.29Å; I342-P344 WeakPolarHBondContact O-CD 3.46Å; P344-S346 PolarHBondContact O-N 3.01Å; P344-L347 HydrophobicContact CB-CB 4.05Å; P344-L347 HydrophobicContact CG-CB 3.73Å; P344-L347 HydrophobicContact CG-CD2 4.05Å; P344-L347 HydrophobicContact CG-CG 4.46Å; P344-L347 WeakPolarHBondContact O-CB 3.37Å; P344-L347 PolarHBondContact O-N 3.37Å; P344-V845 HydrophobicContact CB-CG1 3.79Å; P344-V845 HydrophobicContact CG-CG1 4.22Å; P344-I846 HydrophobicContact CG-CG1 4.05Å; P344-S849 WeakPolarHBondContact CB-OG 3.29Å
345	I	81.9	Confident	87.8	Confident	37 Å²	37	15.2 Å²	15.2	19%	0.19	8%	0.077	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.7	-41.8	172.9	-60.8	162.2	0	0	0	111.3	F85 P108 V343 L347	F85-I345 HydrophobicContact CD1-CB 4.47Å; F85-I345 HydrophobicContact CD1-CD1 4.24Å; F85-I345 HydrophobicContact CD1-CG1 3.44Å; F85-I345 VanDerWaalsContact CD1-CG1 3.44Å; F85-I345 HydrophobicContact CE1-CB 4.05Å; F85-I345 HydrophobicContact CE1-CD1 4.13Å; F85-I345 HydrophobicContact CE1-CG1 3.07Å; F85-I345 HydrophobicContact CE2-CB 4.49Å; F85-I345 HydrophobicContact CE2-CG1 4.31Å; F85-I345 HydrophobicContact CG-CG1 4.19Å; F85-I345 VanDerWaalsContact CZ-CA 3.41Å; F85-I345 HydrophobicContact CZ-CB 4.04Å; F85-I345 HydrophobicContact CZ-CG1 3.56Å; P108-I345 HydrophobicContact CB-CG2 4.03Å; V343-I345 PolarHBondContact O-N 3.14Å; I345-L347 VanDerWaalsContact C-N 3.25Å; I345-L347 PolarHBondContact O-N 3.25Å
346	S	83.9	Confident	87.6	Confident	21 Å²	21	18.7 Å²	18.7	15%	0.147	9%	0.094	C	C	.	.	H	α-helix	trans	-75.7	-6.5	-174.5	48	0	0	0	0	114.2	P344 V349 N350 R848	P344-S346 PolarHBondContact O-N 3.01Å; S346-V349 PolarHBondContact O-N 3.4Å; S346-N350 WeakPolarHBondContact O-CB 3.12Å; S346-N350 PolarHBondContact O-N 3.43Å; S346-N350 PolarHBondContact O-ND2 3.31Å; S346-R848 VanDerWaalsContact CB-NH2 3.3Å; S346-R848 PolarHBondContact OG-NH2 2.9Å
347	L	86.6	Confident	87.7	Confident	1 Å²	1	19 Å²	19	1%	0.005	10%	0.097	C	C	.	.	H	α-helix	trans	-61	-47	178.5	176.7	60.6	0	0	0	111.5	F81 V300 P344 I345 V349 N350 L351 V845 I846	F81-L347 HydrophobicContact CE2-CB 4.33Å; F81-L347 HydrophobicContact CE2-CD2 4.34Å; F81-L347 HydrophobicContact CZ-CB 4.25Å; V300-L347 HydrophobicContact CG1-CD2 3.66Å; V300-L347 HydrophobicContact CG1-CG 4.31Å; P344-L347 HydrophobicContact CB-CB 4.05Å; P344-L347 HydrophobicContact CG-CB 3.73Å; P344-L347 HydrophobicContact CG-CD2 4.05Å; P344-L347 HydrophobicContact CG-CG 4.46Å; P344-L347 WeakPolarHBondContact O-CB 3.37Å; P344-L347 PolarHBondContact O-N 3.37Å; I345-L347 VanDerWaalsContact C-N 3.25Å; I345-L347 PolarHBondContact O-N 3.25Å; L347-V349 PolarHBondContact O-N 3.2Å; L347-N350 PolarHBondContact O-N 3.39Å; L347-L351 HydrophobicContact CD1-CD1 3.91Å; L347-L351 HydrophobicContact CD1-CG 4.2Å; L347-L351 HydrophobicContact CG-CD1 4.09Å; L347-L351 WeakPolarHBondContact O-CG 3.42Å; L347-L351 PolarHBondContact O-N 3.42Å; L347-V845 HydrophobicContact CB-CG1 3.88Å; L347-V845 HydrophobicContact CD1-CB 4.05Å; L347-V845 HydrophobicContact CD1-CG1 4.1Å; L347-I846 HydrophobicContact CD2-CD1 4.29Å; L347-I846 HydrophobicContact CD2-CG1 4.16Å
348	R	82.1	Confident	87.9	Confident	50 Å²	50	18.6 Å²	18.6	19%	0.189	10%	0.095	C	C	.	.	H	α-helix	trans	-63.7	-44.9	-179.3	-176.1	68.4	-167.2	-174.2	2.4	111.9	F81 D297 N350 L351 D352	F81-R348 HydrophobicContact CD1-CB 4.13Å; F81-R348 HydrophobicContact CE1-CB 3.38Å; F81-R348 HydrophobicContact CE1-CG 4.27Å; F81-R348 HydrophobicContact CZ-CB 3.8Å; D297-R348 VanDerWaalsContact CG-NH1 3.34Å; D297-R348 IonicContact OD1-NH1 3.98Å; D297-R348 PolarHBondContact OD1-NH1 2.85Å; D297-R348 VanDerWaalsContact OD1-NH1 3.14Å; D297-R348 IonicContact OD2-NH1 2.71Å; D297-R348 IonicContact OD2-NH2 3.89Å; R348-N350 PolarHBondContact O-N 3.05Å; R348-L351 PolarHBondContact O-N 2.89Å; R348-D352 IonicContact CZ-OD1 2.66Å; R348-D352 IonicContact CZ-OD2 3.86Å; R348-D352 IonicContact NE-OD1 3.18Å; R348-D352 PolarHBondContact NE-OD1 3.42Å; R348-D352 IonicContact NE-OD2 2.68Å; R348-D352 PolarHBondContact NE-OD2 3.08Å; R348-D352 IonicContact NH2-OD1 2.71Å; R348-D352 PolarHBondContact NH2-OD1 3.48Å; R348-D352 IonicContact NH2-OD2 2.61Å; R348-D352 WeakPolarHBondContact O-CB 3.49Å; R348-D352 PolarHBondContact O-N 3.29Å
349	V	82.3	Confident	88	Confident	26 Å²	26	18.6 Å²	18.6	16%	0.158	10%	0.096	C	C	.	.	H	α-helix	trans	-60.5	-48	179.5	-177.5	0	0	0	0	111	V112 I115 S346 L347 L351 D352 M353	V112-V349 HydrophobicContact CB-CG2 4.05Å; V112-V349 HydrophobicContact CG1-CG2 4.07Å; V112-V349 HydrophobicContact CG2-CG2 3.23Å; I115-V349 HydrophobicContact CD1-CG1 4.44Å; S346-V349 PolarHBondContact O-N 3.4Å; L347-V349 PolarHBondContact O-N 3.2Å; V349-L351 VanDerWaalsContact C-N 3.34Å; V349-L351 PolarHBondContact O-N 2.89Å; V349-D352 PolarHBondContact O-N 3.25Å; V349-M353 HydrophobicContact CG1-CG 4.3Å; V349-M353 HydrophobicContact CG1-SD 3.8Å; V349-M353 WeakPolarHBondContact O-CB 3.43Å; V349-M353 VanDerWaalsContact O-CG 3.29Å; V349-M353 WeakPolarHBondContact O-CG 3.35Å; V349-M353 PolarHBondContact O-N 3.41Å
350	N	87.9	Confident	88	Confident	4 Å²	4	25.8 Å²	25.8	2%	0.021	12%	0.123	C	C	.	.	H	α-helix	trans	-61.9	-41.7	179.3	-80.4	-63.3	0	0	0	112.1	S346 L347 R348 G354 L841 V845	S346-N350 WeakPolarHBondContact O-CB 3.12Å; S346-N350 PolarHBondContact O-N 3.43Å; S346-N350 PolarHBondContact O-ND2 3.31Å; L347-N350 PolarHBondContact O-N 3.39Å; R348-N350 PolarHBondContact O-N 3.05Å; N350-G354 PolarHBondContact O-N 3.31Å; N350-L841 HydrophobicContact CB-CD1 4.37Å; N350-L841 HydrophobicContact CB-CD2 4.15Å; N350-L841 HydrophobicContact CB-CG 4.34Å; N350-V845 HydrophobicContact CB-CG2 4.3Å
351	L	88.6	Confident	88.2	Confident	1 Å²	1	27.4 Å²	27.4	1%	0.005	13%	0.131	C	C	.	.	H	α-helix	trans	-66.4	-45.3	177	-70.3	175	0	0	0	112	F296 V300 L347 R348 V349 G354 K355 L841	F296-L351 HydrophobicContact CE1-CD1 3.91Å; F296-L351 HydrophobicContact CE1-CD2 3.69Å; F296-L351 HydrophobicContact CE1-CG 4.43Å; F296-L351 HydrophobicContact CZ-CD2 4.25Å; V300-L351 HydrophobicContact CG1-CD1 4.24Å; V300-L351 HydrophobicContact CG2-CD1 4.24Å; L347-L351 HydrophobicContact CD1-CD1 3.91Å; L347-L351 HydrophobicContact CD1-CG 4.2Å; L347-L351 HydrophobicContact CG-CD1 4.09Å; L347-L351 WeakPolarHBondContact O-CG 3.42Å; L347-L351 PolarHBondContact O-N 3.42Å; R348-L351 PolarHBondContact O-N 2.89Å; V349-L351 VanDerWaalsContact C-N 3.34Å; V349-L351 PolarHBondContact O-N 2.89Å; L351-G354 PolarHBondContact O-N 2.97Å; L351-K355 VanDerWaalsContact O-CG 3.29Å; L351-K355 WeakPolarHBondContact O-CG 3.24Å; L351-K355 PolarHBondContact O-N 3.34Å; L351-L841 HydrophobicContact CD2-CD2 4.34Å
352	D	84.9	Confident	88.6	Confident	7 Å²	7	25.1 Å²	25.1	4%	0.037	12%	0.12	C	C	.	.	H	α-helix	trans	-65.8	-39.9	178.9	-74.8	-26.4	0	0	0	111.7	R348 V349 K355 M356	R348-D352 IonicContact CZ-OD1 2.66Å; R348-D352 IonicContact CZ-OD2 3.86Å; R348-D352 IonicContact NE-OD1 3.18Å; R348-D352 PolarHBondContact NE-OD1 3.42Å; R348-D352 IonicContact NE-OD2 2.68Å; R348-D352 PolarHBondContact NE-OD2 3.08Å; R348-D352 IonicContact NH2-OD1 2.71Å; R348-D352 PolarHBondContact NH2-OD1 3.48Å; R348-D352 IonicContact NH2-OD2 2.61Å; R348-D352 WeakPolarHBondContact O-CB 3.49Å; R348-D352 PolarHBondContact O-N 3.29Å; V349-D352 PolarHBondContact O-N 3.25Å; D352-K355 PolarHBondContact O-N 2.6Å; D352-K355 IonicContact OD1-NZ 2.62Å; D352-M356 WeakPolarHBondContact O-CG 3.45Å; D352-M356 PolarHBondContact O-N 3.01Å
353	M	86.4	Confident	88.6	Confident	53 Å²	53	31 Å²	31	26%	0.261	15%	0.145	S	C	.	.	H	α-helix	trans	-64.1	-40.3	171.1	-72	178.4	64.5	0	0	111.9	V349 K355 M356 V357 M885 F889	V349-M353 HydrophobicContact CG1-CG 4.3Å; V349-M353 HydrophobicContact CG1-SD 3.8Å; V349-M353 WeakPolarHBondContact O-CB 3.43Å; V349-M353 VanDerWaalsContact O-CG 3.29Å; V349-M353 WeakPolarHBondContact O-CG 3.35Å; V349-M353 PolarHBondContact O-N 3.41Å; M353-K355 PolarHBondContact O-N 3.04Å; M353-M356 WeakPolarHBondContact O-CB 3.42Å; M353-M356 PolarHBondContact O-N 3.07Å; M353-V357 WeakPolarHBondContact O-CG2 3.31Å; M353-V357 PolarHBondContact O-N 3.41Å; M353-V357 VanDerWaalsContact O-N 3.09Å; M353-M885 HydrophobicContact CE-CE 3.88Å; M353-M885 HydrophobicContact SD-CE 4.32Å; M353-F889 HydrophobicContact CB-CD2 4.45Å; M353-F889 HydrophobicContact CB-CE2 3.45Å; M353-F889 VanDerWaalsContact CB-CE2 3.45Å; M353-F889 HydrophobicContact CB-CZ 3.71Å; M353-F889 HydrophobicContact CE-CE1 4.3Å; M353-F889 HydrophobicContact CE-CE2 4.32Å; M353-F889 HydrophobicContact CE-CZ 4.07Å
354	G	91.1	Very high	88.7	Confident	0 Å²	0	37.9 Å²	37.9	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-60.2	-44.8	176.8	0	0	0	0	0	111.8	N350 L351 M356 V357 F358	N350-G354 PolarHBondContact O-N 3.31Å; L351-G354 PolarHBondContact O-N 2.97Å; G354-M356 VanDerWaalsContact C-N 3.33Å; G354-M356 PolarHBondContact O-N 3.1Å; G354-V357 PolarHBondContact O-N 2.8Å; G354-V357 VanDerWaalsContact O-N 3.12Å; G354-F358 WeakPolarHBondContact O-CD2 3.32Å; G354-F358 WeakPolarHBondContact O-CE2 3.24Å; G354-F358 WeakPolarHBondContact O-CG 3.38Å; G354-F358 PolarHBondContact O-N 3.3Å
355	K	90.6	Very high	89.1	Confident	2 Å²	2	38.8 Å²	38.8	1%	0.009	18%	0.18	C	C	.	.	H	α-helix	trans	-60.5	-38.1	175.8	-69.2	167.6	-174.8	173.3	0	113	D297 L351 D352 M353 F358 S359 S376 T377 E380	D297-K355 IonicContact OD1-NZ 3.62Å; D297-K355 PolarHBondContact OD1-NZ 3.11Å; D297-K355 IonicContact OD2-NZ 3.88Å; D297-K355 PolarHBondContact OD2-NZ 2.78Å; L351-K355 VanDerWaalsContact O-CG 3.29Å; L351-K355 WeakPolarHBondContact O-CG 3.24Å; L351-K355 PolarHBondContact O-N 3.34Å; D352-K355 PolarHBondContact O-N 2.6Å; D352-K355 IonicContact OD1-NZ 2.62Å; M353-K355 PolarHBondContact O-N 3.04Å; K355-F358 PolarHBondContact O-N 2.87Å; K355-S359 WeakPolarHBondContact O-CB 3.49Å; K355-S359 PolarHBondContact O-N 2.84Å; K355-S359 PolarHBondContact O-OG 2.93Å; K355-S376 WeakPolarHBondContact CB-O 2.99Å; K355-T377 WeakPolarHBondContact CD-O 3.29Å; K355-E380 WeakPolarHBondContact CE-OE1 3.28Å; K355-E380 WeakPolarHBondContact CE-OE2 3.43Å
356	M	87.8	Confident	89.6	Confident	74 Å²	74	42.1 Å²	42.1	37%	0.365	21%	0.206	S	C	.	.	H	α-helix	trans	-62.8	-44.5	173.1	-67.1	180	-175.8	0	0	111.5	I115 R119 D352 M353 G354 S359 W360	I115-M356 HydrophobicContact CG2-CE 4.3Å; R119-M356 HydrophobicContact CB-CE 4.48Å; R119-M356 HydrophobicContact CG-CE 4.2Å; D352-M356 WeakPolarHBondContact O-CG 3.45Å; D352-M356 PolarHBondContact O-N 3.01Å; M353-M356 WeakPolarHBondContact O-CB 3.42Å; M353-M356 PolarHBondContact O-N 3.07Å; G354-M356 VanDerWaalsContact C-N 3.33Å; G354-M356 PolarHBondContact O-N 3.1Å; M356-S359 PolarHBondContact O-N 2.92Å; M356-W360 WeakPolarHBondContact O-CB 3.3Å; M356-W360 PolarHBondContact O-N 3.12Å
357	V	91.8	Very high	89.9	Confident	38 Å²	38	46 Å²	46	23%	0.23	22%	0.221	C	C	.	.	H	α-helix	trans	-64.2	-42.7	177.6	174.3	0	0	0	0	111.2	M353 G354 S359 W360 M361 F889 V892	M353-V357 WeakPolarHBondContact O-CG2 3.31Å; M353-V357 PolarHBondContact O-N 3.41Å; M353-V357 VanDerWaalsContact O-N 3.09Å; G354-V357 PolarHBondContact O-N 2.8Å; G354-V357 VanDerWaalsContact O-N 3.12Å; V357-S359 PolarHBondContact O-N 2.68Å; V357-W360 PolarHBondContact O-N 2.87Å; V357-M361 HydrophobicContact CG1-CE 3.4Å; V357-M361 VanDerWaalsContact CG1-CE 3.4Å; V357-M361 HydrophobicContact CG1-CG 4.47Å; V357-M361 HydrophobicContact CG1-SD 4.29Å; V357-M361 WeakPolarHBondContact O-CG 3.26Å; V357-M361 PolarHBondContact O-N 2.96Å; V357-F889 HydrophobicContact CG2-CE1 4.27Å; V357-F889 HydrophobicContact CG2-CZ 3.87Å; V357-V892 HydrophobicContact CB-CG1 3.74Å; V357-V892 HydrophobicContact CG1-CG1 3.47Å; V357-V892 VanDerWaalsContact CG1-CG1 3.47Å; V357-V892 HydrophobicContact CG2-CG1 4.43Å
358	F	94.1	Very high	90.2	Very high	2 Å²	2	46.1 Å²	46.1	1%	0.009	22%	0.221	C	C	.	.	H	α-helix	trans	-61.6	-44.8	175.4	-57.7	-35.9	0	0	0	112	G354 K355 W360 M361 I362 P379 S834 R837 S838 V892	G354-F358 WeakPolarHBondContact O-CD2 3.32Å; G354-F358 WeakPolarHBondContact O-CE2 3.24Å; G354-F358 WeakPolarHBondContact O-CG 3.38Å; G354-F358 PolarHBondContact O-N 3.3Å; K355-F358 PolarHBondContact O-N 2.87Å; F358-W360 VanDerWaalsContact C-N 3.27Å; F358-W360 PolarHBondContact O-N 2.8Å; F358-M361 PolarHBondContact O-N 3.39Å; F358-I362 WeakPolarHBondContact O-CG1 3.24Å; F358-I362 PolarHBondContact O-N 3.07Å; F358-P379 HydrophobicContact CB-CB 3.92Å; F358-P379 HydrophobicContact CB-CG 4.29Å; F358-P379 HydrophobicContact CD2-CB 4.42Å; F358-S834 WeakPolarHBondContact CB-OG 3.2Å; F358-S834 WeakPolarHBondContact CG-OG 3.33Å; F358-R837 HydrophobicContact CE1-CB 3.95Å; F358-R837 HydrophobicContact CE1-CG 4.47Å; F358-R837 HydrophobicContact CZ-CB 3.69Å; F358-S838 VanDerWaalsContact CE2-OG 3.24Å; F358-S838 WeakPolarHBondContact CE2-OG 3.4Å; F358-V892 HydrophobicContact CD1-CG1 4.04Å; F358-V892 HydrophobicContact CE1-CB 4.24Å; F358-V892 HydrophobicContact CE1-CG1 3.41Å; F358-V892 VanDerWaalsContact CE1-CG1 3.41Å; F358-V892 HydrophobicContact CZ-CB 4.46Å; F358-V892 HydrophobicContact CZ-CG1 3.91Å; F358-V892 HydrophobicContact CZ-CG2 4.35Å
359	S	92	Very high	90.5	Very high	11 Å²	11	47.2 Å²	47.2	8%	0.077	24%	0.235	C	C	.	.	H	α-helix	trans	-59.8	-40.1	176.6	-58.4	0	0	0	0	111.5	K355 M356 V357 K363 P379	K355-S359 WeakPolarHBondContact O-CB 3.49Å; K355-S359 PolarHBondContact O-N 2.84Å; K355-S359 PolarHBondContact O-OG 2.93Å; M356-S359 PolarHBondContact O-N 2.92Å; V357-S359 PolarHBondContact O-N 2.68Å; S359-K363 PolarHBondContact O-N 2.8Å; S359-K363 VanDerWaalsContact O-N 3.16Å; S359-P379 WeakPolarHBondContact OG-CG 3.48Å
360	W	91.4	Very high	90.5	Very high	151 Å²	151	48.3 Å²	48.3	57%	0.572	25%	0.252	S	S	*	.	H	α-helix	trans	-66.8	-41.3	175.2	178.6	84.6	0	0	0	112.6	M356 V357 F358 K363 K364	M356-W360 WeakPolarHBondContact O-CB 3.3Å; M356-W360 PolarHBondContact O-N 3.12Å; V357-W360 PolarHBondContact O-N 2.87Å; F358-W360 VanDerWaalsContact C-N 3.27Å; F358-W360 PolarHBondContact O-N 2.8Å; W360-K363 PolarHBondContact O-N 3.29Å; W360-K364 HydrophobicContact CH2-CD 3.76Å; W360-K364 HydrophobicContact CZ2-CD 3.56Å; W360-K364 HydrophobicContact CZ3-CD 4.47Å; W360-K364 PolarHBondContact O-N 3.25Å; W360-K364 VanDerWaalsContact O-N 3.14Å
361	M	93.4	Very high	90.7	Very high	39 Å²	39	48.2 Å²	48.2	19%	0.192	25%	0.251	C	S	.	.	H	α-helix	trans	-62.8	-41.2	176.2	-73.1	177.7	-174.9	0	0	112.4	V357 F358 K363 K364 D365 R837 L893	V357-M361 HydrophobicContact CG1-CE 3.4Å; V357-M361 VanDerWaalsContact CG1-CE 3.4Å; V357-M361 HydrophobicContact CG1-CG 4.47Å; V357-M361 HydrophobicContact CG1-SD 4.29Å; V357-M361 WeakPolarHBondContact O-CG 3.26Å; V357-M361 PolarHBondContact O-N 2.96Å; F358-M361 PolarHBondContact O-N 3.39Å; M361-K363 VanDerWaalsContact C-N 3.33Å; M361-K364 PolarHBondContact O-N 2.94Å; M361-D365 PolarHBondContact O-N 3.28Å; M361-R837 PolarHBondContact SD-NH1 2.94Å; M361-R837 VanDerWaalsContact SD-NH1 3.44Å; M361-L893 HydrophobicContact CE-CD2 3.34Å
362	I	94.6	Very high	90.6	Very high	0 Å²	0	50.1 Å²	50.1	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-60.3	-46.3	175.3	-68.4	164.6	0	0	0	109.8	F358 K364 D365 I368 T371 V373 L382 F815 L826 H830	F358-I362 WeakPolarHBondContact O-CG1 3.24Å; F358-I362 PolarHBondContact O-N 3.07Å; I362-K364 VanDerWaalsContact C-N 3.26Å; I362-K364 PolarHBondContact O-N 3.09Å; I362-D365 PolarHBondContact O-N 3.25Å; I362-I368 HydrophobicContact CG2-CD1 4.23Å; I362-T371 HydrophobicContact CG2-CG2 3.7Å; I362-V373 HydrophobicContact CB-CG2 3.91Å; I362-V373 HydrophobicContact CD1-CG2 4.48Å; I362-V373 HydrophobicContact CG2-CG2 3.66Å; I362-L382 HydrophobicContact CD1-CD1 4.33Å; I362-F815 HydrophobicContact CD1-CE1 4.13Å; I362-L826 HydrophobicContact CD1-CD1 4.38Å; I362-L826 HydrophobicContact CG2-CD1 3.88Å; I362-H830 HydrophobicContact CD1-CB 4.15Å; I362-H830 HydrophobicContact CG1-CB 3.71Å
363	K	92.3	Very high	90.8	Very high	129 Å²	129	50.8 Å²	50.8	56%	0.561	27%	0.267	S	S	*	.	H	α-helix	trans	-66.2	-24.6	-177.4	-151.2	176.2	-173.9	176.3	0	113.9	S359 W360 M361 T371	S359-K363 PolarHBondContact O-N 2.8Å; S359-K363 VanDerWaalsContact O-N 3.16Å; W360-K363 PolarHBondContact O-N 3.29Å; M361-K363 VanDerWaalsContact C-N 3.33Å; K363-T371 WeakPolarHBondContact CG-O 3.39Å
364	K	92.8	Very high	90.6	Very high	148 Å²	148	52.5 Å²	52.5	64%	0.643	27%	0.271	S	S	*	.	H	α-helix	trans	-97.8	-5	-177.1	-168.1	171.5	177.3	-179.6	0	113.7	W360 M361 I362 S366	W360-K364 HydrophobicContact CH2-CD 3.76Å; W360-K364 HydrophobicContact CZ2-CD 3.56Å; W360-K364 HydrophobicContact CZ3-CD 4.47Å; W360-K364 PolarHBondContact O-N 3.25Å; W360-K364 VanDerWaalsContact O-N 3.14Å; M361-K364 PolarHBondContact O-N 2.94Å; I362-K364 VanDerWaalsContact C-N 3.26Å; I362-K364 PolarHBondContact O-N 3.09Å; K364-S366 PolarHBondContact O-N 3.42Å
365	D	94.3	Very high	90.1	Very high	21 Å²	21	53.2 Å²	53.2	11%	0.112	28%	0.276	C	S	.	.			trans	-71	119.5	-176.4	-174	-2.5	0	0	0	111.9	M361 I362 K367 I368 R825 H830	M361-D365 PolarHBondContact O-N 3.28Å; I362-D365 PolarHBondContact O-N 3.25Å; D365-K367 VanDerWaalsContact C-N 3.26Å; D365-K367 PolarHBondContact O-N 2.9Å; D365-K367 PolarHBondContact OD1-N 3.36Å; D365-K367 VanDerWaalsContact OD1-N 3.08Å; D365-I368 HydrophobicContact CB-CD1 4.1Å; D365-I368 HydrophobicContact CB-CG1 3.63Å; D365-I368 CarbonylContact O-C 3.57Å; D365-I368 PolarHBondContact O-N 3.42Å; D365-R825 IonicContact OD1-CZ 2.97Å; D365-R825 IonicContact OD1-NE 2.63Å; D365-R825 IonicContact OD1-NH2 3.79Å; D365-R825 PolarHBondContact OD1-NH2 3.29Å; D365-R825 IonicContact OD2-CZ 2.71Å; D365-R825 IonicContact OD2-NE 3.21Å; D365-R825 PolarHBondContact OD2-NE 3.22Å; D365-R825 IonicContact OD2-NH2 2.71Å; D365-R825 PolarHBondContact OD2-NH2 3.04Å; D365-H830 IonicContact OD2-CD2 2.82Å; D365-H830 IonicContact OD2-CE1 3.17Å; D365-H830 IonicContact OD2-NE2 3.19Å; D365-H830 PolarHBondContact OD2-NE2 3.34Å
366	S	92.1	Very high	89.6	Confident	106 Å²	106	54.2 Å²	54.2	74%	0.741	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.1	-22	-177.7	57.4	0	0	0	0	113.9	K364 I368	K364-S366 PolarHBondContact O-N 3.42Å; S366-I368 VanDerWaalsContact C-N 3.32Å
367	K	91.6	Very high	89.3	Confident	104 Å²	104	51.6 Å²	51.6	45%	0.452	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82	-9.4	178.4	-70.6	179.3	176.6	-178.9	0	113.1	D365 H822 R825 E900	D365-K367 VanDerWaalsContact C-N 3.26Å; D365-K367 PolarHBondContact O-N 2.9Å; D365-K367 PolarHBondContact OD1-N 3.36Å; D365-K367 VanDerWaalsContact OD1-N 3.08Å; K367-H822 PolarHBondContact O-ND1 2.88Å; K367-R825 VanDerWaalsContact CD-CZ 3.45Å; K367-E900 IonicContact NZ-OE1 3.9Å; K367-E900 PolarHBondContact NZ-OE1 2.9Å
368	I	91.5	Very high	89.2	Confident	2 Å²	2	49.8 Å²	49.8	1%	0.01	26%	0.261	C	S	.	.	S	Bend	trans	-130.9	61.5	174.1	52.8	171.1	0	0	0	110.1	I362 D365 S366 T371 H822 R825	I362-I368 HydrophobicContact CG2-CD1 4.23Å; D365-I368 HydrophobicContact CB-CD1 4.1Å; D365-I368 HydrophobicContact CB-CG1 3.63Å; D365-I368 CarbonylContact O-C 3.57Å; D365-I368 PolarHBondContact O-N 3.42Å; S366-I368 VanDerWaalsContact C-N 3.32Å; I368-T371 WeakPolarHBondContact CB-OG1 3.44Å; I368-T371 HydrophobicContact CD1-CG2 4.4Å; I368-T371 WeakPolarHBondContact O-CB 3.26Å; I368-T371 PolarHBondContact O-N 3.3Å; I368-T371 PolarHBondContact O-OG1 3.46Å; I368-H822 HydrophobicContact CB-CB 4.24Å; I368-H822 HydrophobicContact CG2-CB 3.65Å; I368-R825 HydrophobicContact CG2-CB 4.04Å; I368-R825 HydrophobicContact CG2-CG 4.2Å
369	P	88.4	Confident	89.1	Confident	74 Å²	74	49.7 Å²	49.7	48%	0.481	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.1	145.7	-172.8	29.6	-35.7	0	0	0	111.5	T371 T818	P369-T371 PolarHBondContact O-N 2.96Å; P369-T818 WeakPolarHBondContact O-CG2 3.36Å; P369-T818 PolarHBondContact O-OG1 3.28Å
370	G	84.1	Confident	89.1	Confident	49 Å²	49	49.3 Å²	49.3	51%	0.505	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	77.3	1.4	179.7	0	0	0	0	0	114.8	V372	G370-V372 PolarHBondContact O-N 3.36Å
371	T	90.3	Very high	89.1	Confident	2 Å²	2	42.5 Å²	42.5	1%	0.012	23%	0.232	C	C	.	.			trans	-63.3	127.7	178	-58.1	0	0	0	0	111.2	I362 K363 I368 P369 S816 V817	I362-T371 HydrophobicContact CG2-CG2 3.7Å; K363-T371 WeakPolarHBondContact CG-O 3.39Å; I368-T371 WeakPolarHBondContact CB-OG1 3.44Å; I368-T371 HydrophobicContact CD1-CG2 4.4Å; I368-T371 WeakPolarHBondContact O-CB 3.26Å; I368-T371 PolarHBondContact O-N 3.3Å; I368-T371 PolarHBondContact O-OG1 3.46Å; P369-T371 PolarHBondContact O-N 2.96Å; T371-S816 CarbonylContact C-O 3.3Å; T371-S816 WeakPolarHBondContact CA-O 3.2Å; T371-S816 WeakPolarHBondContact CG2-O 3.41Å; T371-V817 HydrophobicContact CG2-CG1 4.17Å
372	V	88.1	Confident	89.1	Confident	40 Å²	40	40.6 Å²	40.6	24%	0.242	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	121.9	177.5	-177	0	0	0	0	110	G370 R374 S816	G370-V372 PolarHBondContact O-N 3.36Å; V372-R374 HydrophobicContact CG1-CG 4.28Å; V372-S816 PolarHBondContact N-O 3.36Å; V372-S816 PolarHBondContact O-N 3.24Å
373	V	88.7	Confident	89	Confident	21 Å²	21	40.6 Å²	40.6	13%	0.127	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	116.5	170.1	-173.3	0	0	0	0	108.8	I362 F815	I362-V373 HydrophobicContact CB-CG2 3.91Å; I362-V373 HydrophobicContact CD1-CG2 4.48Å; I362-V373 HydrophobicContact CG2-CG2 3.66Å; V373-F815 HydrophobicContact CB-CD1 4.38Å; V373-F815 HydrophobicContact CB-CE1 4.42Å; V373-F815 HydrophobicContact CG1-CD1 4.05Å; V373-F815 HydrophobicContact CG1-CE1 3.69Å; V373-F815 HydrophobicContact CG2-CD1 3.98Å; V373-F815 HydrophobicContact CG2-CE1 4.08Å
374	R	82.9	Confident	89.1	Confident	90 Å²	90	36 Å²	36	34%	0.34	20%	0.201	S	C	.	.			trans	-96.3	-46.6	176.1	-63.1	-171.3	-178.2	-85.7	-2.9	111.1	V372 S376 S810 S813 D814	V372-R374 HydrophobicContact CG1-CG 4.28Å; R374-S376 PolarHBondContact O-N 3.07Å; R374-S810 WeakPolarHBondContact CD-O 3.46Å; R374-S810 PolarHBondContact NE-O 3.46Å; R374-S813 WeakPolarHBondContact CB-O 3.24Å; R374-S813 WeakPolarHBondContact CD-O 3.44Å; R374-D814 WeakPolarHBondContact CA-O 3.3Å; R374-D814 PolarHBondContact N-O 2.65Å
375	A	79.8	Confident	89.2	Confident	15 Å²	15	29 Å²	29	12%	0.124	17%	0.171	C	C	.	.			trans	-92.5	99.8	175.5	0	0	0	0	0	110.6	T377 I378 D814	A375-T377 PolarHBondContact O-N 3.38Å; A375-I378 HydrophobicContact CB-CD1 4.39Å; A375-I378 HydrophobicContact CB-CG1 4.18Å; A375-D814 HydrophobicContact CB-CB 3.71Å; A375-D814 VanDerWaalsContact CB-OD1 3.3Å; A375-D814 WeakPolarHBondContact CB-OD1 3.28Å; A375-D814 PolarHBondContact N-O 3.22Å; A375-D814 VanDerWaalsContact N-O 3.08Å
376	S	79.4	Confident	89.2	Confident	22 Å²	22	28.6 Å²	28.6	15%	0.154	17%	0.17	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.6	-4.2	179.9	65	0	0	0	0	114.2	K355 R374 P379	K355-S376 WeakPolarHBondContact CB-O 2.99Å; R374-S376 PolarHBondContact O-N 3.07Å; S376-P379 WeakPolarHBondContact O-CD 3.25Å
377	T	81.6	Confident	89.4	Confident	19 Å²	19	23.7 Å²	23.7	12%	0.117	14%	0.135	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.5	-19.9	-170.6	51.3	0	0	0	0	114.9	R119 K355 A375 P379	R119-T377 VanDerWaalsContact NH2-CG2 3.3Å; K355-T377 WeakPolarHBondContact CD-O 3.29Å; A375-T377 PolarHBondContact O-N 3.38Å; T377-P379 VanDerWaalsContact C-CD 3.44Å
378	I	89.4	Confident	89.6	Confident	1 Å²	1	18.8 Å²	18.8	1%	0.005	11%	0.114	C	C	.	.			trans	-115.3	15.4	-171	65.8	168.7	0	0	0	118	K292 A375 E380 Q381 C797 D814 F815	K292-I378 HydrophobicContact CB-CG2 4.38Å; A375-I378 HydrophobicContact CB-CD1 4.39Å; A375-I378 HydrophobicContact CB-CG1 4.18Å; I378-E380 PolarHBondContact O-N 3.27Å; I378-Q381 HydrophobicContact CB-CB 4.44Å; I378-Q381 HydrophobicContact CB-CG 4.36Å; I378-Q381 WeakPolarHBondContact O-CB 3.32Å; I378-Q381 PolarHBondContact O-N 3.29Å; I378-C797 HydrophobicContact CD1-CB 4.49Å; I378-D814 HydrophobicContact CD1-CB 3.77Å; I378-F815 HydrophobicContact CD1-CE2 4.07Å; I378-F815 HydrophobicContact CG1-CE2 3.97Å; I378-F815 HydrophobicContact CG1-CZ 4.23Å
379	P	92.2	Very high	89.9	Confident	0 Å²	0	18.7 Å²	18.7	0%	0	11%	0.113	C	C	.	.	T	Hydrogen-bonded Turn	trans	-51.1	-30.3	178.9	-28.9	33.8	0	0	0	115.7	F358 S359 S376 T377 L382 S834	F358-P379 HydrophobicContact CB-CB 3.92Å; F358-P379 HydrophobicContact CB-CG 4.29Å; F358-P379 HydrophobicContact CD2-CB 4.42Å; S359-P379 WeakPolarHBondContact OG-CG 3.48Å; S376-P379 WeakPolarHBondContact O-CD 3.25Å; T377-P379 VanDerWaalsContact C-CD 3.44Å; P379-L382 WeakPolarHBondContact O-CB 3.5Å; P379-S834 WeakPolarHBondContact O-CB 3.39Å
380	E	91.7	Very high	90.2	Very high	3 Å²	3	15.1 Å²	15.1	1%	0.014	9%	0.091	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.7	-29.1	179.7	-63.2	156.9	-179.8	0	0	113.3	F296 K355 I378 L382 G383 S838	F296-E380 HydrophobicContact CB-CB 4.37Å; F296-E380 WeakPolarHBondContact CB-OE2 3.42Å; F296-E380 WeakPolarHBondContact CD1-OE2 3.22Å; F296-E380 VanDerWaalsContact CG-OE2 3.28Å; F296-E380 WeakPolarHBondContact CG-OE2 3.42Å; K355-E380 WeakPolarHBondContact CE-OE1 3.28Å; K355-E380 WeakPolarHBondContact CE-OE2 3.43Å; I378-E380 PolarHBondContact O-N 3.27Å; E380-L382 PolarHBondContact O-N 2.82Å; E380-G383 PolarHBondContact O-N 2.85Å; E380-S838 VanDerWaalsContact CG-OG 3.32Å; E380-S838 WeakPolarHBondContact CG-OG 3.35Å; E380-S838 WeakPolarHBondContact OE1-CB 3.46Å; E380-S838 PolarHBondContact OE1-OG 2.92Å
381	Q	91.6	Very high	90.5	Very high	7 Å²	7	13.2 Å²	13.2	3%	0.033	7%	0.069	C	C	.	.	G	3₁₀ helix	trans	-65.2	-30.3	179.1	-76.6	-176.4	-26.1	0	0	111.5	V293 I378 G383 R384 L778 D796	V293-Q381 PolarHBondContact O-NE2 2.96Å; V293-Q381 VanDerWaalsContact O-NE2 3.17Å; I378-Q381 HydrophobicContact CB-CB 4.44Å; I378-Q381 HydrophobicContact CB-CG 4.36Å; I378-Q381 WeakPolarHBondContact O-CB 3.32Å; I378-Q381 PolarHBondContact O-N 3.29Å; Q381-G383 PolarHBondContact O-N 3.37Å; Q381-R384 PolarHBondContact O-N 3.11Å; Q381-L778 HydrophobicContact CB-CD1 4.32Å; Q381-L778 HydrophobicContact CG-CD1 4.3Å; Q381-D796 PolarHBondContact OE1-O 3.23Å; Q381-D796 VanDerWaalsContact OE1-O 3.1Å
382	L	94.4	Very high	90.5	Very high	0 Å²	0	13.2 Å²	13.2	0%	0	7%	0.069	C	C	.	.	G	3₁₀ helix	trans	-55.7	-24.1	176	-66.5	173.6	0	0	0	112.7	I362 P379 E380 R384 I385 C797 F815 L826 L827 Y909	I362-L382 HydrophobicContact CD1-CD1 4.33Å; P379-L382 WeakPolarHBondContact O-CB 3.5Å; E380-L382 PolarHBondContact O-N 2.82Å; L382-R384 VanDerWaalsContact C-N 3.34Å; L382-I385 HydrophobicContact CD2-CD1 4.07Å; L382-C797 WeakPolarHBondContact CD2-SG 3.48Å; L382-F815 HydrophobicContact CD1-CD1 4.42Å; L382-F815 HydrophobicContact CD1-CE1 3.84Å; L382-F815 HydrophobicContact CD1-CE2 3.97Å; L382-F815 HydrophobicContact CD1-CZ 3.6Å; L382-F815 HydrophobicContact CD2-CD2 4.12Å; L382-F815 HydrophobicContact CD2-CE2 3.86Å; L382-F815 HydrophobicContact CD2-CZ 4.35Å; L382-F815 HydrophobicContact CG-CE2 3.98Å; L382-F815 HydrophobicContact CG-CZ 4.02Å; L382-L826 HydrophobicContact CD1-CD1 3.92Å; L382-L826 HydrophobicContact CD1-CG 4.13Å; L382-L826 HydrophobicContact CD2-CG 4.47Å; L382-L827 HydrophobicContact CB-CD2 4.07Å; L382-L827 HydrophobicContact CD2-CD2 3.71Å; L382-L827 HydrophobicContact CG-CD2 4.5Å; L382-L827 WeakPolarHBondContact O-CD2 3.23Å; L382-Y909 WeakPolarHBondContact O-CE2 3.46Å; L382-Y909 PolarHBondContact O-OH 3.44Å
383	G	92.9	Very high	90.2	Very high	0 Å²	0	12.3 Å²	12.3	0%	0	6%	0.063	C	C	.	.	G	3₁₀ helix	trans	-82.2	-3	178.2	0	0	0	0	0	115.5	E380 Q381 G831 Y909 L912	E380-G383 PolarHBondContact O-N 2.85Å; Q381-G383 PolarHBondContact O-N 3.37Å; G383-G831 VanDerWaalsContact CA-O 3.28Å; G383-G831 WeakPolarHBondContact CA-O 3.5Å; G383-G831 PolarHBondContact N-O 2.95Å; G383-Y909 VanDerWaalsContact C-CZ 3.5Å; G383-Y909 VanDerWaalsContact C-OH 3.23Å; G383-L912 WeakPolarHBondContact O-CB 3.49Å
384	R	93.6	Very high	89.7	Confident	31 Å²	31	11.5 Å²	11.5	12%	0.117	6%	0.059	C	C	.	.	S	Bend	trans	-137.5	15.2	-173	-68.4	-172	69.5	-175.9	0.4	114.9	E299 Q381 L382 S386 L778 Y835 Y909	E299-R384 IonicContact OE1-CZ 2.72Å; E299-R384 IonicContact OE1-NH1 3.09Å; E299-R384 PolarHBondContact OE1-NH1 2.66Å; E299-R384 IonicContact OE1-NH2 3.35Å; E299-R384 IonicContact OE2-NH1 3Å; E299-R384 PolarHBondContact OE2-NH1 3.32Å; Q381-R384 PolarHBondContact O-N 3.11Å; L382-R384 VanDerWaalsContact C-N 3.34Å; R384-S386 PolarHBondContact O-N 3.18Å; R384-L778 HydrophobicContact CB-CD1 3.76Å; R384-Y835 VanDerWaalsContact CD-CE2 3.48Å; R384-Y835 HydrophobicContact CG-CD1 4.18Å; R384-Y835 HydrophobicContact CG-CD2 4.25Å; R384-Y835 HydrophobicContact CG-CE1 4.2Å; R384-Y835 HydrophobicContact CG-CE2 4.28Å; R384-Y835 HydrophobicContact CG-CG 4.23Å; R384-Y909 PolarHBondContact N-OH 3.05Å; R384-Y909 VanDerWaalsContact N-OH 3.16Å
385	I	95.3	Very high	90	Very high	1 Å²	1	7.2 Å²	7.2	1%	0.005	4%	0.043	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.5	128	175.8	-72	160.2	0	0	0	109	L382 Y387 I670 C780 C797 L827 Y909 L913	L382-I385 HydrophobicContact CD2-CD1 4.07Å; I385-Y387 WeakPolarHBondContact CG2-O 3.09Å; I385-I670 HydrophobicContact CG2-CG2 4.41Å; I385-C780 HydrophobicContact CB-CB 4.31Å; I385-C780 HydrophobicContact CD1-CB 3.56Å; I385-C780 HydrophobicContact CG1-CB 3.88Å; I385-C780 HydrophobicContact CG2-CB 3.47Å; I385-C780 VanDerWaalsContact CG2-CB 3.47Å; I385-C797 HydrophobicContact CD1-CB 4.19Å; I385-L827 HydrophobicContact CD1-CD2 3.46Å; I385-L827 VanDerWaalsContact CD1-CD2 3.46Å; I385-Y909 PolarHBondContact N-OH 2.84Å; I385-L913 VanDerWaalsContact O-CD2 3.26Å; I385-L913 WeakPolarHBondContact O-CD2 3.21Å
386	S	94.3	Very high	90.5	Very high	13 Å²	13	6.5 Å²	6.5	9%	0.091	4%	0.037	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	-31.3	178.9	-59.6	0	0	0	0	112.8	R384 I670 R671 L778	R384-S386 PolarHBondContact O-N 3.18Å; S386-I670 WeakPolarHBondContact O-CA 3.11Å; S386-R671 PolarHBondContact O-N 3.18Å; S386-L778 PolarHBondContact N-O 3.33Å
387	Y	95.8	Very high	91	Very high	4 Å²	4	5.5 Å²	5.5	2%	0.016	3%	0.03	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	131.1	177.3	-71.9	-83.1	0	0	0	109.4	I385 R671 L771 T775 K777 L778 T779 C780	I385-Y387 WeakPolarHBondContact CG2-O 3.09Å; Y387-R671 CarbonylContact C-O 3.56Å; Y387-R671 WeakPolarHBondContact CA-O 3.5Å; Y387-R671 HydrophobicContact CD1-CB 3.71Å; Y387-R671 HydrophobicContact CE1-CB 3.8Å; Y387-R671 HydrophobicContact CE1-CG 4.29Å; Y387-R671 PolarHBondContact OH-NH1 3.41Å; Y387-L771 HydrophobicContact CD1-CD2 4.41Å; Y387-L771 HydrophobicContact CE1-CD2 4.28Å; Y387-T775 HydrophobicContact CE2-CG2 3.84Å; Y387-K777 HydrophobicContact CD2-CB 4.26Å; Y387-K777 HydrophobicContact CE2-CB 4.26Å; Y387-K777 HydrophobicContact CE2-CD 4Å; Y387-L778 PolarHBondContact N-O 3.25Å; Y387-T779 CarbonylContact O-C 3.46Å; Y387-T779 WeakPolarHBondContact O-CA 3.38Å; Y387-C780 PolarHBondContact O-N 3.47Å
388	L	96.4	Very high	91.1	Very high	0 Å²	0	7.3 Å²	7.3	0%	0	4%	0.037	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	116.8	171.4	-175.7	72	0	0	0	108.4	L665 I670 R671 V672 W673 C780 V782 L823	L388-L665 HydrophobicContact CD2-CD1 3.6Å; L388-I670 HydrophobicContact CB-CG2 3.72Å; L388-R671 PolarHBondContact N-O 2.89Å; L388-V672 HydrophobicContact CB-CG2 4.27Å; L388-V672 HydrophobicContact CD2-CG1 4.34Å; L388-V672 HydrophobicContact CD2-CG2 4.24Å; L388-V672 CarbonylContact O-C 3.6Å; L388-V672 VanDerWaalsContact O-CA 3.29Å; L388-V672 WeakPolarHBondContact O-CA 3.24Å; L388-W673 PolarHBondContact O-N 3.03Å; L388-C780 CarbonylContact C-O 3.5Å; L388-C780 WeakPolarHBondContact CA-O 3.21Å; L388-C780 HydrophobicContact CD1-CB 3.73Å; L388-V782 HydrophobicContact CD1-CG2 3.53Å; L388-V782 HydrophobicContact CG-CG2 4.32Å; L388-L823 HydrophobicContact CD1-CD2 4.05Å; L388-L823 HydrophobicContact CD2-CD2 3.69Å
389	L	96.5	Very high	90.6	Very high	0 Å²	0	8.4 Å²	8.4	0%	0	4%	0.043	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	125.4	170.6	-57.5	96.8	0	0	0	107.6	W673 L675 I767 V768 L771 T779 C780 A781 V782 M791	L389-W673 CarbonylContact C-O 3.59Å; L389-W673 WeakPolarHBondContact CA-O 3.47Å; L389-W673 HydrophobicContact CG-CB 4.45Å; L389-L675 HydrophobicContact CB-CD1 4.35Å; L389-L675 HydrophobicContact CD2-CD1 3.45Å; L389-L675 VanDerWaalsContact CD2-CD1 3.45Å; L389-L675 HydrophobicContact CD2-CG 4.13Å; L389-I767 HydrophobicContact CD2-CG2 4.05Å; L389-V768 HydrophobicContact CD1-CG2 4.07Å; L389-V768 HydrophobicContact CD2-CG2 3.67Å; L389-V768 HydrophobicContact CG-CG2 4.34Å; L389-L771 HydrophobicContact CD1-CD1 4.2Å; L389-L771 HydrophobicContact CD2-CD1 3.93Å; L389-L771 HydrophobicContact CG-CD1 4.35Å; L389-T779 HydrophobicContact CD1-CG2 4.32Å; L389-C780 PolarHBondContact N-O 2.82Å; L389-A781 CarbonylContact O-C 3.11Å; L389-A781 VanDerWaalsContact O-CA 3.28Å; L389-A781 WeakPolarHBondContact O-CA 3.34Å; L389-V782 PolarHBondContact O-N 2.87Å; L389-M791 HydrophobicContact CB-SD 4.06Å
390	T	94.9	Very high	90.1	Very high	0 Å²	0	12.3 Å²	12.3	0%	0	6%	0.061	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	139.3	-179.1	-174.3	0	0	0	0	109.7	T395 L396 V672 W673 M674 L675 V782	T390-T395 WeakPolarHBondContact OG1-CG2 3.26Å; T390-L396 HydrophobicContact CG2-CD1 3.91Å; T390-L396 HydrophobicContact CG2-CD2 4.4Å; T390-L396 HydrophobicContact CG2-CG 4.31Å; T390-V672 HydrophobicContact CG2-CG1 3.97Å; T390-W673 PolarHBondContact N-O 3.34Å; T390-M674 WeakPolarHBondContact O-CA 3.48Å; T390-L675 PolarHBondContact O-N 3.02Å; T390-V782 WeakPolarHBondContact CA-O 3.33Å
391	D	91.8	Very high	89.9	Confident	8 Å²	8	12.8 Å²	12.8	4%	0.043	6%	0.063	C	C	.	.			trans	-72.9	163	162.8	-166.6	61.9	0	0	0	110.9	T393 L396 K764 V782 D788	D391-T393 PolarHBondContact OD2-N 2.96Å; D391-T393 VanDerWaalsContact OD2-O 3.05Å; D391-L396 WeakPolarHBondContact O-CG 3.38Å; D391-K764 IonicContact OD1-NZ 2.82Å; D391-K764 PolarHBondContact OD1-NZ 3.37Å; D391-V782 PolarHBondContact N-O 3.15Å; D391-D788 VanDerWaalsContact CB-OD2 3.32Å; D391-D788 WeakPolarHBondContact CB-OD2 3.46Å
392	K	88.8	Confident	89.8	Confident	3 Å²	3	14.1 Å²	14.1	1%	0.013	7%	0.072	C	C	.	.	S	Bend	trans	-91.6	-58	178.3	-173.5	-124.4	66.5	167.3	0	111.4	L396 T397 D652 M674 T676 D678 T686	K392-L396 PolarHBondContact O-N 3.15Å; K392-T397 PolarHBondContact O-N 3.3Å; K392-T397 VanDerWaalsContact O-N 3.09Å; K392-D652 IonicContact NZ-OD2 3.59Å; K392-D652 PolarHBondContact NZ-OD2 2.86Å; K392-D652 VanDerWaalsContact NZ-OD2 3.09Å; K392-M674 HydrophobicContact CB-CG 4.32Å; K392-M674 HydrophobicContact CB-SD 4.04Å; K392-M674 HydrophobicContact CG-SD 4.05Å; K392-T676 HydrophobicContact CB-CG2 4.45Å; K392-D678 VanDerWaalsContact CD-OD2 3.27Å; K392-D678 WeakPolarHBondContact CD-OD2 3.37Å; K392-D678 WeakPolarHBondContact CE-OD2 3.39Å; K392-D678 IonicContact NZ-OD2 2.74Å; K392-D678 PolarHBondContact NZ-OD2 3Å; K392-T686 HydrophobicContact CD-CG2 4.08Å; K392-T686 HydrophobicContact CG-CG2 3.58Å
393	T	82.5	Confident	89.7	Confident	20 Å²	20	14.5 Å²	14.5	12%	0.123	7%	0.074	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.4	135.2	-170.7	-53	0	0	0	0	108	D391 T395 N399 E805	D391-T393 PolarHBondContact OD2-N 2.96Å; D391-T393 VanDerWaalsContact OD2-O 3.05Å; T393-T395 PolarHBondContact O-N 2.81Å; T393-N399 HydrophobicContact CG2-CB 4.36Å; T393-E805 WeakPolarHBondContact CG2-OE1 3.37Å
394	G	79	Confident	89.6	Confident	5 Å²	5	18.6 Å²	18.6	5%	0.052	9%	0.089	C	C	.	.	T	Hydrogen-bonded Turn	trans	68.4	-15.2	176.1	0	0	0	0	0	116	T397 Q655 D784	G394-T397 CarbonylContact C-O 3.54Å; G394-T397 VanDerWaalsContact C-O 3.3Å; G394-T397 VanDerWaalsContact CA-O 3.3Å; G394-T397 WeakPolarHBondContact CA-O 3.32Å; G394-T397 PolarHBondContact N-O 3.02Å; G394-Q655 PolarHBondContact O-NE2 3.45Å; G394-D784 VanDerWaalsContact C-OD2 3.3Å; G394-D784 WeakPolarHBondContact CA-OD2 3.39Å
395	T	88.4	Confident	89.5	Confident	0 Å²	0	19.7 Å²	19.7	0%	0	9%	0.093	C	C	.	.	T	Hydrogen-bonded Turn	trans	-102.8	-60	176.3	-62.1	0	0	0	0	112.4	T390 T393 Q655 V782 G783 D784 V801 F820	T390-T395 WeakPolarHBondContact OG1-CG2 3.26Å; T393-T395 PolarHBondContact O-N 2.81Å; T395-Q655 PolarHBondContact O-NE2 3.45Å; T395-Q655 VanDerWaalsContact O-NE2 3.09Å; T395-V782 HydrophobicContact CG2-CB 4.34Å; T395-V782 HydrophobicContact CG2-CG1 3.76Å; T395-G783 VanDerWaalsContact OG1-CA 3.3Å; T395-G783 WeakPolarHBondContact OG1-CA 3.49Å; T395-D784 PolarHBondContact OG1-N 3.08Å; T395-D784 PolarHBondContact OG1-OD1 3.32Å; T395-V801 HydrophobicContact CG2-CG2 4.26Å; T395-F820 HydrophobicContact CG2-CD2 3.87Å; T395-F820 HydrophobicContact CG2-CE2 4.31Å; T395-F820 WeakPolarHBondContact O-CB 3.31Å
396	L	91.1	Very high	89.5	Confident	0 Å²	0	19.7 Å²	19.7	0%	0	9%	0.093	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.4	-32.8	174.9	-66.8	176.2	0	0	0	111.4	T390 D391 K392 L654 Q655 V658 L662 M674 F820	T390-L396 HydrophobicContact CG2-CD1 3.91Å; T390-L396 HydrophobicContact CG2-CD2 4.4Å; T390-L396 HydrophobicContact CG2-CG 4.31Å; D391-L396 WeakPolarHBondContact O-CG 3.38Å; K392-L396 PolarHBondContact O-N 3.15Å; L396-L654 CarbonylContact O-C 3.57Å; L396-L654 WeakPolarHBondContact O-CA 3.18Å; L396-Q655 PolarHBondContact O-N 3.42Å; L396-V658 HydrophobicContact CD2-CG1 3.7Å; L396-L662 HydrophobicContact CD2-CD1 4.32Å; L396-M674 HydrophobicContact CD1-CE 3.36Å; L396-M674 HydrophobicContact CD1-CG 4.47Å; L396-M674 HydrophobicContact CD1-SD 4.4Å; L396-F820 HydrophobicContact CD2-CD1 4.25Å; L396-F820 HydrophobicContact CD2-CD2 4.04Å; L396-F820 HydrophobicContact CD2-CE1 3.95Å; L396-F820 HydrophobicContact CD2-CE2 3.73Å; L396-F820 HydrophobicContact CD2-CG 4.29Å; L396-F820 HydrophobicContact CD2-CZ 3.69Å
397	T	88.9	Confident	89.4	Confident	0 Å²	0	19.6 Å²	19.6	0%	0	9%	0.092	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	157.5	175.8	72.4	0	0	0	0	111.3	K392 G394 D652 Q653 L654 T686	K392-T397 PolarHBondContact O-N 3.3Å; K392-T397 VanDerWaalsContact O-N 3.09Å; G394-T397 CarbonylContact C-O 3.54Å; G394-T397 VanDerWaalsContact C-O 3.3Å; G394-T397 VanDerWaalsContact CA-O 3.3Å; G394-T397 WeakPolarHBondContact CA-O 3.32Å; G394-T397 PolarHBondContact N-O 3.02Å; T397-D652 WeakPolarHBondContact CB-OD1 3.31Å; T397-D652 HydrophobicContact CG2-CB 4.47Å; T397-D652 WeakPolarHBondContact CG2-OD1 3.39Å; T397-D652 PolarHBondContact OG1-OD1 3.03Å; T397-Q653 CarbonylContact C-O 3.54Å; T397-Q653 VanDerWaalsContact CA-O 3.24Å; T397-Q653 WeakPolarHBondContact CA-O 3.45Å; T397-Q653 WeakPolarHBondContact CB-O 3.38Å; T397-L654 HydrophobicContact CG2-CD2 4.03Å; T397-T686 HydrophobicContact CG2-CG2 3.84Å
398	Q	84.6	Confident	89.1	Confident	57 Å²	57	19.6 Å²	19.6	27%	0.266	9%	0.092	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	0.2	173.2	-67.5	-175.6	0.2	0	0	112.5	E400 Q653 Q655	Q398-E400 HydrophobicContact CB-CB 4.33Å; Q398-E400 PolarHBondContact O-N 2.83Å; Q398-Q653 PolarHBondContact N-O 2.83Å; Q398-Q655 HydrophobicContact CG-CB 4.21Å; Q398-Q655 HydrophobicContact CG-CG 3.76Å
399	N	77.3	Confident	88.5	Confident	24 Å²	24	20.6 Å²	20.6	13%	0.128	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	51.6	44.9	-172.1	-161.7	5.3	0	0	0	111.1	T196 T393 E805	T196-N399 VanDerWaalsContact CG2-ND2 3.31Å; T196-N399 WeakPolarHBondContact CG2-ND2 3.04Å; T196-N399 PolarHBondContact OG1-ND2 3.33Å; T393-N399 HydrophobicContact CG2-CB 4.36Å; N399-E805 PolarHBondContact ND2-OE1 2.81Å
400	E	83.5	Confident	87.8	Confident	82 Å²	82	25.7 Å²	25.7	38%	0.383	13%	0.133	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	108.1	179.9	-169.4	166.3	150.5	0	0	107.8	Q398 V402 Q653 K804	Q398-E400 HydrophobicContact CB-CB 4.33Å; Q398-E400 PolarHBondContact O-N 2.83Å; E400-V402 HydrophobicContact CG-CG2 4.25Å; E400-Q653 PolarHBondContact O-N 3.11Å; E400-Q653 VanDerWaalsContact O-N 3.11Å; E400-K804 IonicContact OE2-NZ 3.92Å; E400-K804 PolarHBondContact OE2-NZ 2.91Å
401	M	86.4	Confident	87.5	Confident	13 Å²	13	27.7 Å²	27.7	6%	0.064	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	121.2	-178.5	-60.7	-56.5	170	0	0	108.6	P499 D500 S503 V650 E651 D652	M401-P499 HydrophobicContact CB-CB 4.48Å; M401-P499 HydrophobicContact CE-CG 4.05Å; M401-P499 HydrophobicContact CG-CB 3.76Å; M401-P499 HydrophobicContact CG-CG 3.86Å; M401-D500 WeakPolarHBondContact CG-OD1 3.32Å; M401-S503 WeakPolarHBondContact O-CB 3.39Å; M401-V650 HydrophobicContact CB-CG1 3.78Å; M401-E651 WeakPolarHBondContact CA-O 3.38Å; M401-D652 HydrophobicContact CE-CB 4.13Å; M401-D652 HydrophobicContact SD-CB 3.72Å
402	V	89.9	Confident	87.3	Confident	35 Å²	35	29.2 Å²	29.2	21%	0.212	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	126	-179.3	177.8	0	0	0	0	109.8	E400 R404 E651 Q653	E400-V402 HydrophobicContact CG-CG2 4.25Å; V402-R404 PolarHBondContact O-N 3.24Å; V402-E651 PolarHBondContact N-O 2.99Å; V402-E651 PolarHBondContact O-N 2.85Å; V402-Q653 HydrophobicContact CB-CG 4.43Å; V402-Q653 HydrophobicContact CG2-CG 4.11Å
403	F	92.1	Very high	87.4	Confident	8 Å²	8	29.4 Å²	29.4	4%	0.035	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.4	125	171.6	-172	-89.5	0	0	0	109.9	R405 L406 M415 M418 L504 W507 T648 V650	F403-R405 WeakPolarHBondContact CZ-O 3.41Å; F403-L406 HydrophobicContact CE1-CB 4.15Å; F403-L406 HydrophobicContact CZ-CB 3.85Å; F403-L406 HydrophobicContact CZ-CD1 4.22Å; F403-M415 VanDerWaalsContact O-SD 3.38Å; F403-M418 HydrophobicContact CD1-CE 3.8Å; F403-M418 HydrophobicContact CE1-CE 3.59Å; F403-M418 HydrophobicContact CE1-SD 4.27Å; F403-L504 HydrophobicContact CD2-CD2 3.6Å; F403-L504 HydrophobicContact CE2-CD2 3.71Å; F403-W507 HydrophobicContact CB-CB 3.8Å; F403-W507 HydrophobicContact CB-CG 3.92Å; F403-W507 HydrophobicContact CD1-CB 4.39Å; F403-W507 AromaticContact CD1-CD1 3.37Å; F403-W507 AromaticContact CD1-CD2 3.77Å; F403-W507 HydrophobicContact CD1-CD2 3.77Å; F403-W507 AromaticContact CD1-CE2 3.65Å; F403-W507 AromaticContact CD1-CG 3.58Å; F403-W507 HydrophobicContact CD1-CG 3.58Å; F403-W507 HydrophobicContact CD1-CZ2 4.42Å; F403-W507 AromaticContact CD1-NE1 3.38Å; F403-W507 HydrophobicContact CD2-CB 4.5Å; F403-W507 HydrophobicContact CD2-CD2 4.19Å; F403-W507 HydrophobicContact CD2-CE3 4.42Å; F403-W507 HydrophobicContact CD2-CG 4.22Å; F403-W507 AromaticContact CE1-CD1 3.92Å; F403-W507 AromaticContact CE1-CD2 3.77Å; F403-W507 HydrophobicContact CE1-CD2 3.77Å; F403-W507 AromaticContact CE1-CE2 3.33Å; F403-W507 HydrophobicContact CE1-CE3 4.45Å; F403-W507 HydrophobicContact CE1-CG 4.1Å; F403-W507 HydrophobicContact CE1-CH2 4.34Å; F403-W507 AromaticContact CE1-CZ2 3.66Å; F403-W507 HydrophobicContact CE1-CZ2 3.66Å; F403-W507 AromaticContact CE1-NE1 3.44Å; F403-W507 HydrophobicContact CE2-CD2 4.15Å; F403-W507 HydrophobicContact CE2-CE3 4.16Å; F403-W507 HydrophobicContact CE2-CZ3 4.42Å; F403-W507 HydrophobicContact CG-CB 4Å; F403-W507 AromaticContact CG-CD1 3.86Å; F403-W507 AromaticContact CG-CD2 3.97Å; F403-W507 HydrophobicContact CG-CD2 3.97Å; F403-W507 AromaticContact CG-CG 3.64Å; F403-W507 HydrophobicContact CG-CG 3.64Å; F403-W507 AromaticContact CZ-CD2 3.96Å; F403-W507 HydrophobicContact CZ-CD2 3.96Å; F403-W507 AromaticContact CZ-CE2 3.77Å; F403-W507 HydrophobicContact CZ-CE3 4.18Å; F403-W507 HydrophobicContact CZ-CH2 4.02Å; F403-W507 AromaticContact CZ-CZ2 3.8Å; F403-W507 HydrophobicContact CZ-CZ2 3.8Å; F403-W507 HydrophobicContact CZ-CZ3 4.23Å; F403-T648 HydrophobicContact CE2-CG2 3.83Å; F403-T648 HydrophobicContact CZ-CG2 4.42Å; F403-V650 HydrophobicContact CD2-CG2 4.46Å
404	R	90.9	Very high	87.7	Confident	86 Å²	86	29.6 Å²	29.6	33%	0.325	17%	0.166	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	-33	-177.2	-74.6	-59.5	-161.1	170.8	4.8	114.1	V402 M415 M418 L595 G649 E651	V402-R404 PolarHBondContact O-N 3.24Å; R404-M415 PolarHBondContact O-N 2.98Å; R404-M418 WeakPolarHBondContact O-CE 3.43Å; R404-L595 HydrophobicContact CB-CD1 4.41Å; R404-L595 HydrophobicContact CB-CD2 3.85Å; R404-L595 HydrophobicContact CG-CD2 4.02Å; R404-G649 PolarHBondContact N-O 3.12Å; R404-E651 HydrophobicContact CG-CB 3.62Å; R404-E651 IonicContact CZ-OE2 3.49Å; R404-E651 IonicContact NE-OE2 2.68Å; R404-E651 PolarHBondContact NE-OE2 3.45Å; R404-E651 IonicContact NH2-OE2 3.42Å; R404-E651 PolarHBondContact NH2-OE2 2.94Å
405	R	91.9	Very high	87.8	Confident	55 Å²	55	33.4 Å²	33.4	21%	0.208	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.6	135.5	-166.8	-160.4	162.4	180	157.1	-3	112.3	F403 Y413 M590 E593 L595 T648 G649	F403-R405 WeakPolarHBondContact CZ-O 3.41Å; R405-Y413 WeakPolarHBondContact CA-O 3.37Å; R405-M590 HydrophobicContact CB-CE 3.98Å; R405-M590 HydrophobicContact CG-CE 4.19Å; R405-E593 IonicContact CZ-OE1 2.8Å; R405-E593 IonicContact CZ-OE2 3.36Å; R405-E593 IonicContact NH1-OE1 3.72Å; R405-E593 PolarHBondContact NH1-OE1 3.43Å; R405-E593 IonicContact NH1-OE2 2.66Å; R405-E593 PolarHBondContact NH1-OE2 2.59Å; R405-L595 HydrophobicContact CB-CD1 3.85Å; R405-T648 CarbonylContact O-C 3.57Å; R405-G649 PolarHBondContact N-O 3.39Å; R405-G649 PolarHBondContact O-N 3.29Å
406	L	93.8	Very high	87.6	Confident	0 Å²	0	41.5 Å²	41.5	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119	126.6	170.1	-176.9	68.2	0	0	0	108.6	F403 A412 Y413 V421 I462 W507 C646 L647 T648	F403-L406 HydrophobicContact CE1-CB 4.15Å; F403-L406 HydrophobicContact CZ-CB 3.85Å; F403-L406 HydrophobicContact CZ-CD1 4.22Å; L406-A412 CarbonylContact O-C 3.58Å; L406-A412 WeakPolarHBondContact O-CA 3.32Å; L406-Y413 HydrophobicContact CD2-CD2 4.23Å; L406-Y413 PolarHBondContact N-O 2.92Å; L406-Y413 PolarHBondContact O-N 3.22Å; L406-V421 HydrophobicContact CD2-CG1 4.43Å; L406-I462 HydrophobicContact CD1-CD1 4.04Å; L406-W507 HydrophobicContact CD1-CH2 4.32Å; L406-W507 HydrophobicContact CD2-CH2 3.97Å; L406-W507 HydrophobicContact CD2-CZ2 4.15Å; L406-C646 HydrophobicContact CD1-CB 3.91Å; L406-L647 WeakPolarHBondContact CA-O 3.21Å; L406-T648 HydrophobicContact CD1-CG2 4.29Å
407	H	92.9	Very high	87.4	Confident	12 Å²	12	42.9 Å²	42.9	6%	0.056	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	127.5	178.6	-158.9	-82.1	0	0	0	111.3	G409 A412 W582 E586 M590 C646 L647	H407-G409 VanDerWaalsContact CE1-CA 3.41Å; H407-G409 WeakPolarHBondContact CE1-CA 3.37Å; H407-G409 PolarHBondContact CE1-N 3.42Å; H407-G409 PolarHBondContact CE1-O 3.02Å; H407-G409 WeakPolarHBondContact ND1-CA 3.5Å; H407-G409 PolarHBondContact ND1-N 3.16Å; H407-A412 WeakPolarHBondContact CD2-CB 3.43Å; H407-W582 AromaticContact CE1-CE3 3.81Å; H407-W582 AromaticContact CE1-CZ3 3.81Å; H407-W582 AromaticContact ND1-CE3 3.64Å; H407-W582 AromaticContact ND1-CH2 3.82Å; H407-W582 AromaticContact ND1-CZ3 3.15Å; H407-W582 WeakPolarHBondContact ND1-CZ3 3.42Å; H407-E586 IonicContact NE2-OE2 3.13Å; H407-M590 HydrophobicContact CB-SD 4.36Å; H407-C646 CarbonylContact O-C 3.46Å; H407-C646 WeakPolarHBondContact O-CA 3.44Å; H407-C646 WeakPolarHBondContact O-CB 3.36Å; H407-L647 HydrophobicContact CB-CB 3.96Å; H407-L647 HydrophobicContact CB-CD1 4.4Å; H407-L647 HydrophobicContact CB-CG 4.34Å; H407-L647 PolarHBondContact N-O 3.3Å; H407-L647 PolarHBondContact O-N 2.96Å
408	L	90	Very high	87.1	Confident	3 Å²	3	43.7 Å²	43.7	2%	0.016	24%	0.241	C	C	.	.			trans	-111.2	10.3	-179.9	-63.4	166.1	0	0	0	112.8	T410 V411 Y413 R454 V455 A458 L645 C646	L408-T410 VanDerWaalsContact C-N 3.33Å; L408-T410 PolarHBondContact O-N 3.08Å; L408-V411 PolarHBondContact N-O 3.21Å; L408-Y413 HydrophobicContact CD1-CD2 4.49Å; L408-Y413 HydrophobicContact CD1-CE2 3.88Å; L408-R454 PolarHBondContact O-NH1 3.08Å; L408-R454 PolarHBondContact O-NH2 3.09Å; L408-V455 HydrophobicContact CD1-CB 4.41Å; L408-V455 HydrophobicContact CD1-CG2 3.48Å; L408-V455 VanDerWaalsContact CD1-CG2 3.48Å; L408-A458 HydrophobicContact CD2-CB 3.74Å; L408-L645 WeakPolarHBondContact CD2-O 3.43Å; L408-C646 HydrophobicContact CD2-CB 3.59Å
409	G	84.2	Confident	87.2	Confident	22 Å²	22	47 Å²	47	23%	0.227	26%	0.26	C	S	.	.	S	Bend	trans	91.4	-58.9	-177	0	0	0	0	0	112	H407	H407-G409 VanDerWaalsContact CE1-CA 3.41Å; H407-G409 WeakPolarHBondContact CE1-CA 3.37Å; H407-G409 PolarHBondContact CE1-N 3.42Å; H407-G409 PolarHBondContact CE1-O 3.02Å; H407-G409 WeakPolarHBondContact ND1-CA 3.5Å; H407-G409 PolarHBondContact ND1-N 3.16Å
410	T	81.4	Confident	87.7	Confident	106 Å²	106	50.9 Å²	50.9	65%	0.65	28%	0.278	S	S	*	.	S	Bend	trans	-84.2	-23.6	-180	51.7	0	0	0	0	113.7	L408	L408-T410 VanDerWaalsContact C-N 3.33Å; L408-T410 PolarHBondContact O-N 3.08Å
411	V	87.6	Confident	87.8	Confident	42 Å²	42	47 Å²	47	26%	0.255	26%	0.259	S	S	.	.			trans	-140.4	140.1	-177	-175.2	0	0	0	0	108.8	L408 Y413	L408-V411 PolarHBondContact N-O 3.21Å; V411-Y413 HydrophobicContact CB-CE2 4.33Å; V411-Y413 HydrophobicContact CG1-CD2 4.31Å; V411-Y413 HydrophobicContact CG1-CE1 3.98Å; V411-Y413 HydrophobicContact CG1-CE2 3.76Å
412	A	88.3	Confident	87.8	Confident	41 Å²	41	50.9 Å²	50.9	34%	0.339	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	126.4	173.8	0	0	0	0	0	109.1	L406 H407	L406-A412 CarbonylContact O-C 3.58Å; L406-A412 WeakPolarHBondContact O-CA 3.32Å; H407-A412 WeakPolarHBondContact CD2-CB 3.43Å
413	Y	90.9	Very high	87.7	Confident	6 Å²	6	52.4 Å²	52.4	2%	0.024	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	115.5	173.5	-58.7	-81.4	0	0	0	109	R405 L406 L408 V411 S417 E420 V421 V455	R405-Y413 WeakPolarHBondContact CA-O 3.37Å; L406-Y413 HydrophobicContact CD2-CD2 4.23Å; L406-Y413 PolarHBondContact N-O 2.92Å; L406-Y413 PolarHBondContact O-N 3.22Å; L408-Y413 HydrophobicContact CD1-CD2 4.49Å; L408-Y413 HydrophobicContact CD1-CE2 3.88Å; V411-Y413 HydrophobicContact CB-CE2 4.33Å; V411-Y413 HydrophobicContact CG1-CD2 4.31Å; V411-Y413 HydrophobicContact CG1-CE1 3.98Å; V411-Y413 HydrophobicContact CG1-CE2 3.76Å; Y413-S417 VanDerWaalsContact CA-OG 3.32Å; Y413-S417 WeakPolarHBondContact CA-OG 3.32Å; Y413-E420 HydrophobicContact CD1-CB 4.48Å; Y413-E420 HydrophobicContact CE1-CB 4.09Å; Y413-V421 HydrophobicContact CD1-CG2 3.78Å; Y413-V421 HydrophobicContact CD2-CG2 3.97Å; Y413-V421 HydrophobicContact CE1-CG2 4.28Å; Y413-V421 HydrophobicContact CE2-CG2 4.44Å; Y413-V421 HydrophobicContact CG-CG2 3.61Å; Y413-V455 HydrophobicContact CE2-CG2 3.97Å
414	G	88.4	Confident	87.5	Confident	25 Å²	25	53.1 Å²	53.1	26%	0.258	29%	0.293	S	S	.	.			trans	-94.6	-178.6	166.6	0	0	0	0	0	111.2	D416 S417 M418	G414-D416 VanDerWaalsContact C-N 3.26Å; G414-D416 PolarHBondContact O-N 3.15Å; G414-S417 PolarHBondContact N-OG 2.95Å; G414-S417 PolarHBondContact O-N 3.18Å; G414-S417 PolarHBondContact O-OG 2.97Å; G414-M418 WeakPolarHBondContact O-CG 3.5Å; G414-M418 PolarHBondContact O-N 3.07Å
415	M	81.3	Confident	87.3	Confident	85 Å²	85	49 Å²	49	42%	0.419	28%	0.278	S	S	.	.	G	3₁₀ helix	trans	-53.6	-40.5	-177.9	-75.9	-56.7	-32.7	0	0	114.2	F403 R404 S417 M418	F403-M415 VanDerWaalsContact O-SD 3.38Å; R404-M415 PolarHBondContact O-N 2.98Å; M415-S417 PolarHBondContact O-N 3.05Å; M415-M418 HydrophobicContact CE-CG 4.13Å; M415-M418 PolarHBondContact O-N 3.04Å; M415-M418 HydrophobicContact SD-CE 4.36Å
416	D	83.3	Confident	87	Confident	169 Å²	169	51.4 Å²	51.4	90%	0.904	29%	0.29	S	S	*	.	G	3₁₀ helix	trans	-72.3	-9.8	-177.1	-54.3	-35.3	0	0	0	113.1	G414	G414-D416 VanDerWaalsContact C-N 3.26Å; G414-D416 PolarHBondContact O-N 3.15Å
417	S	87.2	Confident	86.5	Confident	29 Å²	29	53.1 Å²	53.1	20%	0.203	30%	0.301	C	S	.	.	G	3₁₀ helix	trans	-119	10.7	-176.8	57.1	0	0	0	0	113.4	Y413 G414 M415 D419 E420	Y413-S417 VanDerWaalsContact CA-OG 3.32Å; Y413-S417 WeakPolarHBondContact CA-OG 3.32Å; G414-S417 PolarHBondContact N-OG 2.95Å; G414-S417 PolarHBondContact O-N 3.18Å; G414-S417 PolarHBondContact O-OG 2.97Å; M415-S417 PolarHBondContact O-N 3.05Å; S417-D419 VanDerWaalsContact C-N 3.3Å; S417-D419 PolarHBondContact O-N 3.35Å; S417-E420 WeakPolarHBondContact O-CB 3.26Å; S417-E420 PolarHBondContact O-N 2.67Å
418	M	84.1	Confident	86.1	Confident	18 Å²	18	54.4 Å²	54.4	9%	0.089	31%	0.314	C	S	.	.	H	α-helix	trans	-68.4	-27.8	-176.8	-68	-61.5	179.2	0	0	113.1	F403 R404 G414 M415 E420 V421 Q422	F403-M418 HydrophobicContact CD1-CE 3.8Å; F403-M418 HydrophobicContact CE1-CE 3.59Å; F403-M418 HydrophobicContact CE1-SD 4.27Å; R404-M418 WeakPolarHBondContact O-CE 3.43Å; G414-M418 WeakPolarHBondContact O-CG 3.5Å; G414-M418 PolarHBondContact O-N 3.07Å; M415-M418 HydrophobicContact CE-CG 4.13Å; M415-M418 PolarHBondContact O-N 3.04Å; M415-M418 HydrophobicContact SD-CE 4.36Å; M418-E420 PolarHBondContact O-N 3.09Å; M418-V421 WeakPolarHBondContact O-CB 3.46Å; M418-V421 PolarHBondContact O-N 2.87Å; M418-V421 HydrophobicContact SD-CG2 4.46Å; M418-Q422 PolarHBondContact O-N 3.42Å
419	D	86.1	Confident	85.7	Confident	125 Å²	125	56.4 Å²	56.4	67%	0.668	32%	0.322	S	S	*	.	H	α-helix	trans	-60.4	-30.9	176.3	-62.8	-20.2	0	0	0	112	S417 Q422 S423	S417-D419 VanDerWaalsContact C-N 3.3Å; S417-D419 PolarHBondContact O-N 3.35Å; D419-Q422 PolarHBondContact O-N 3Å; D419-S423 PolarHBondContact O-N 3.44Å
420	E	87	Confident	85.3	Confident	107 Å²	107	58.4 Å²	58.4	50%	0.5	33%	0.33	S	S	.	.	H	α-helix	trans	-64.9	-41.2	175.2	-61.4	-172.4	-177.3	0	0	111.2	Y413 S417 M418 Q422 S423 H424	Y413-E420 HydrophobicContact CD1-CB 4.48Å; Y413-E420 HydrophobicContact CE1-CB 4.09Å; S417-E420 WeakPolarHBondContact O-CB 3.26Å; S417-E420 PolarHBondContact O-N 2.67Å; M418-E420 PolarHBondContact O-N 3.09Å; E420-Q422 VanDerWaalsContact C-N 3.33Å; E420-Q422 PolarHBondContact O-N 3.12Å; E420-S423 PolarHBondContact O-N 3.01Å; E420-S423 PolarHBondContact O-OG 2.86Å; E420-H424 PolarHBondContact O-CD2 2.92Å; E420-H424 PolarHBondContact O-N 3.21Å
421	V	86.1	Confident	84.5	Confident	0 Å²	0	59.1 Å²	59.1	0%	0	33%	0.326	C	S	.	.	H	α-helix	trans	-60.8	-45	177.4	-172.5	0	0	0	0	110.2	L406 Y413 M418 S423 H424 V425 V455 V459 W507 V511	L406-V421 HydrophobicContact CD2-CG1 4.43Å; Y413-V421 HydrophobicContact CD1-CG2 3.78Å; Y413-V421 HydrophobicContact CD2-CG2 3.97Å; Y413-V421 HydrophobicContact CE1-CG2 4.28Å; Y413-V421 HydrophobicContact CE2-CG2 4.44Å; Y413-V421 HydrophobicContact CG-CG2 3.61Å; M418-V421 WeakPolarHBondContact O-CB 3.46Å; M418-V421 PolarHBondContact O-N 2.87Å; M418-V421 HydrophobicContact SD-CG2 4.46Å; V421-S423 VanDerWaalsContact C-N 3.32Å; V421-S423 PolarHBondContact O-N 3.08Å; V421-H424 WeakPolarHBondContact O-CB 3.21Å; V421-H424 PolarHBondContact O-N 3.36Å; V421-V425 WeakPolarHBondContact O-CG2 3.49Å; V421-V425 PolarHBondContact O-N 3.49Å; V421-V455 HydrophobicContact CG1-CG1 3.67Å; V421-V459 HydrophobicContact CG1-CG2 4Å; V421-W507 HydrophobicContact CG1-CZ2 4.23Å; V421-V511 HydrophobicContact CB-CG1 4.25Å; V421-V511 HydrophobicContact CG1-CG1 3.66Å
422	Q	87.4	Confident	82.6	Confident	94 Å²	94	62.1 Å²	62.1	44%	0.439	35%	0.346	S	S	.	.	H	α-helix	trans	-59.7	-43.7	176.9	-172.5	-179.2	9.2	0	0	111.4	M418 D419 E420 H424 V425 F426 V511	M418-Q422 PolarHBondContact O-N 3.42Å; D419-Q422 PolarHBondContact O-N 3Å; E420-Q422 VanDerWaalsContact C-N 3.33Å; E420-Q422 PolarHBondContact O-N 3.12Å; Q422-H424 VanDerWaalsContact C-N 3.33Å; Q422-H424 PolarHBondContact O-N 3.41Å; Q422-V425 PolarHBondContact O-N 2.84Å; Q422-F426 WeakPolarHBondContact O-CB 3.29Å; Q422-F426 PolarHBondContact O-N 3.08Å; Q422-V511 HydrophobicContact CB-CG1 4.42Å
423	S	87.1	Confident	80.6	Confident	67 Å²	67	67.1 Å²	67.1	47%	0.469	37%	0.373	S	S	.	.	H	α-helix	trans	-62.3	-39.5	177	81	0	0	0	0	112.5	D419 E420 V421 S427	D419-S423 PolarHBondContact O-N 3.44Å; E420-S423 PolarHBondContact O-N 3.01Å; E420-S423 PolarHBondContact O-OG 2.86Å; V421-S423 VanDerWaalsContact C-N 3.32Å; V421-S423 PolarHBondContact O-N 3.08Å; S423-S427 WeakPolarHBondContact O-CB 3.24Å; S423-S427 PolarHBondContact O-N 2.76Å; S423-S427 PolarHBondContact O-OG 2.61Å
424	H	87.7	Confident	78.1	Confident	24 Å²	24	74 Å²	74	11%	0.111	41%	0.405	C	S	.	.	H	α-helix	trans	-65.1	-45.9	177.1	-77.5	-59.6	0	0	0	111.8	E420 V421 Q422 S427 A428 S452 V455	E420-H424 PolarHBondContact O-CD2 2.92Å; E420-H424 PolarHBondContact O-N 3.21Å; V421-H424 WeakPolarHBondContact O-CB 3.21Å; V421-H424 PolarHBondContact O-N 3.36Å; Q422-H424 VanDerWaalsContact C-N 3.33Å; Q422-H424 PolarHBondContact O-N 3.41Å; H424-S427 PolarHBondContact O-N 3.32Å; H424-S427 PolarHBondContact O-OG 2.71Å; H424-A428 PolarHBondContact O-N 2.87Å; H424-A428 VanDerWaalsContact O-N 3.14Å; H424-S452 WeakPolarHBondContact ND1-CB 3.32Å; H424-S452 PolarHBondContact ND1-OG 3.2Å; H424-S452 PolarHBondContact O-OG 3.25Å; H424-V455 HydrophobicContact CB-CB 4.27Å; H424-V455 HydrophobicContact CB-CG1 3.95Å
425	V	85.8	Confident	75.7	Confident	0 Å²	0	80.7 Å²	80.7	0%	0	43%	0.434	C	S	.	.	H	α-helix	trans	-63.6	-46	177.3	174.4	0	0	0	0	110.9	V421 Q422 S427 A428 Y429 V459 V511 L513 P528	V421-V425 WeakPolarHBondContact O-CG2 3.49Å; V421-V425 PolarHBondContact O-N 3.49Å; Q422-V425 PolarHBondContact O-N 2.84Å; V425-S427 VanDerWaalsContact C-N 3.33Å; V425-S427 PolarHBondContact O-N 2.99Å; V425-A428 PolarHBondContact O-N 2.63Å; V425-Y429 HydrophobicContact CG1-CD2 4.06Å; V425-Y429 HydrophobicContact CG1-CE2 4.01Å; V425-Y429 WeakPolarHBondContact O-CD2 3.44Å; V425-Y429 PolarHBondContact O-N 3.09Å; V425-V459 HydrophobicContact CG2-CB 4.17Å; V425-V459 HydrophobicContact CG2-CG1 4.29Å; V425-V459 HydrophobicContact CG2-CG2 3.88Å; V425-V511 HydrophobicContact CB-CG1 4.24Å; V425-V511 HydrophobicContact CG2-CG1 3.75Å; V425-L513 HydrophobicContact CG1-CD1 4.39Å; V425-L513 HydrophobicContact CG1-CG 4.28Å; V425-P528 HydrophobicContact CG1-CG 4.07Å
426	F	85.8	Confident	73.5	Confident	105 Å²	105	83.3 Å²	83.3	46%	0.461	45%	0.45	S	S	.	.	H	α-helix	trans	-59.1	-44.3	177.4	-170.6	-92.1	0	0	0	111.9	Q422 A428 Y429 T430 P528	Q422-F426 WeakPolarHBondContact O-CB 3.29Å; Q422-F426 PolarHBondContact O-N 3.08Å; F426-A428 VanDerWaalsContact C-N 3.3Å; F426-A428 PolarHBondContact O-N 3.05Å; F426-Y429 PolarHBondContact O-N 2.62Å; F426-T430 HydrophobicContact CD1-CG2 4.06Å; F426-T430 HydrophobicContact CE1-CG2 3.56Å; F426-T430 HydrophobicContact CE2-CG2 4.4Å; F426-T430 HydrophobicContact CZ-CG2 3.75Å; F426-T430 PolarHBondContact O-N 3Å; F426-T430 VanDerWaalsContact O-N 3.13Å; F426-T430 PolarHBondContact O-OG1 2.9Å; F426-P528 HydrophobicContact CD2-CB 3.66Å; F426-P528 HydrophobicContact CE2-CB 4.24Å
427	S	84.9	Confident	71.6	Confident	35 Å²	35	81.1 Å²	81.1	25%	0.245	44%	0.444	C	S	.	.	H	α-helix	trans	-64.6	-31.9	179.4	75.8	0	0	0	0	113.6	S423 H424 V425 T430 Q431 S452	S423-S427 WeakPolarHBondContact O-CB 3.24Å; S423-S427 PolarHBondContact O-N 2.76Å; S423-S427 PolarHBondContact O-OG 2.61Å; H424-S427 PolarHBondContact O-N 3.32Å; H424-S427 PolarHBondContact O-OG 2.71Å; V425-S427 VanDerWaalsContact C-N 3.33Å; V425-S427 PolarHBondContact O-N 2.99Å; S427-T430 WeakPolarHBondContact CA-OG1 3.46Å; S427-Q431 WeakPolarHBondContact O-CG 3.4Å; S427-Q431 PolarHBondContact O-N 2.78Å; S427-S452 PolarHBondContact OG-OG 3.16Å
428	A	82.9	Confident	69.6	Low	39 Å²	39	85 Å²	85	32%	0.322	48%	0.478	S	S	.	.	H	α-helix	trans	-69.8	-33.9	178.9	0	0	0	0	0	112.4	H424 V425 F426 H456	H424-A428 PolarHBondContact O-N 2.87Å; H424-A428 VanDerWaalsContact O-N 3.14Å; V425-A428 PolarHBondContact O-N 2.63Å; F426-A428 VanDerWaalsContact C-N 3.3Å; F426-A428 PolarHBondContact O-N 3.05Å; A428-H456 HydrophobicContact CB-CB 3.97Å
429	Y	82	Confident	67.5	Low	45 Å²	45	89.7 Å²	89.7	18%	0.176	51%	0.513	C	S	.	.	H	α-helix	trans	-91.2	-13.2	179.7	-73.5	-70.6	0	0	0	114.5	V425 F426 H456 L513 T527 P528 L533	V425-Y429 HydrophobicContact CG1-CD2 4.06Å; V425-Y429 HydrophobicContact CG1-CE2 4.01Å; V425-Y429 WeakPolarHBondContact O-CD2 3.44Å; V425-Y429 PolarHBondContact O-N 3.09Å; F426-Y429 PolarHBondContact O-N 2.62Å; Y429-H456 AromaticContact CE1-CE1 3.81Å; Y429-H456 AromaticContact CE2-CE1 3.45Å; Y429-H456 VanDerWaalsContact CE2-CE1 3.45Å; Y429-H456 WeakPolarHBondContact CE2-CE1 3.39Å; Y429-H456 AromaticContact CE2-ND1 3.58Å; Y429-H456 AromaticContact CZ-CE1 3.25Å; Y429-H456 AromaticContact CZ-ND1 3.89Å; Y429-H456 PolarHBondContact OH-CE1 3.49Å; Y429-H456 VanDerWaalsContact OH-CE1 3.26Å; Y429-L513 HydrophobicContact CE2-CD1 4.15Å; Y429-L513 HydrophobicContact CE2-CD2 3.79Å; Y429-L513 HydrophobicContact CE2-CG 4.13Å; Y429-T527 HydrophobicContact CD1-CG2 3.72Å; Y429-T527 HydrophobicContact CE1-CG2 3.56Å; Y429-T527 HydrophobicContact CE2-CG2 4.45Å; Y429-T527 HydrophobicContact CG-CG2 4.24Å; Y429-P528 HydrophobicContact CD2-CG 4.29Å; Y429-L533 HydrophobicContact CE1-CD1 3.93Å
430	T	75.9	Confident	65.7	Low	64 Å²	64	95.7 Å²	95.7	39%	0.393	53%	0.526	S	S	.	.	H	α-helix	trans	-98.1	-19.7	178.9	40.2	0	0	0	0	114.4	F426 S427 P432 T529	F426-T430 HydrophobicContact CD1-CG2 4.06Å; F426-T430 HydrophobicContact CE1-CG2 3.56Å; F426-T430 HydrophobicContact CE2-CG2 4.4Å; F426-T430 HydrophobicContact CZ-CG2 3.75Å; F426-T430 PolarHBondContact O-N 3Å; F426-T430 VanDerWaalsContact O-N 3.13Å; F426-T430 PolarHBondContact O-OG1 2.9Å; S427-T430 WeakPolarHBondContact CA-OG1 3.46Å; T430-P432 WeakPolarHBondContact O-CD 3.38Å; T430-T529 HydrophobicContact CG2-CG2 3.62Å
431	Q	63.9	Low	63.6	Low	121 Å²	121	93.1 Å²	93.1	57%	0.565	52%	0.523	S	S	*	.	S	Bend	trans	-77.3	119.2	175.5	-75.3	-175.8	16.3	0	0	110.3	S427 T433	S427-Q431 WeakPolarHBondContact O-CG 3.4Å; S427-Q431 PolarHBondContact O-N 2.78Å; Q431-T433 PolarHBondContact O-N 2.87Å
432	P	48.8	Very low	61.7	Low	105 Å²	105	97.5 Å²	97.5	68%	0.682	55%	0.551	S	S	*	*			trans	-65.7	131.2	173.2	25.5	-30.2	0	0	0	109.4	T430 H434	T430-P432 WeakPolarHBondContact O-CD 3.38Å; P432-H434 PolarHBondContact O-N 3.45Å
433	T	45.8	Very low	59.9	Low	147 Å²	147	96.8 Å²	96.8	90%	0.902	56%	0.562	S	S	*	*			trans	-66	73.8	167.9	40.2	0	0	0	0	109.8	Q431	Q431-T433 PolarHBondContact O-N 2.87Å
434	H	38.1	Very low	58	Low	151 Å²	151	97.4 Å²	97.4	70%	0.699	57%	0.571	S	S	*	*			trans	-94.9	105.9	166.6	-111.6	-70.9	0	0	0	109.1	P432 L436	P432-H434 PolarHBondContact O-N 3.45Å; H434-L436 PolarHBondContact O-N 2.79Å
435	D	38.1	Very low	56.2	Low	164 Å²	164	99.2 Å²	99.2	88%	0.877	58%	0.584	S	S	*	*			trans	-56.7	101.7	161.1	-76.8	-37	0	0	0	109.1
436	L	35.7	Very low	54.4	Low	141 Å²	141	106.1 Å²	106.1	74%	0.738	61%	0.614	S	S	*	*			trans	-126.3	135.6	164.9	-80.9	162.4	0	0	0	108.3	H434	H434-L436 PolarHBondContact O-N 2.79Å
437	P	43.3	Very low	52.9	Low	122 Å²	122	105.1 Å²	105.1	79%	0.792	62%	0.616	S	S	*	*			trans	-68.2	145.2	-170.9	27.6	-32.7	0	0	0	111.7	S439	P437-S439 PolarHBondContact O-N 3.29Å
438	A	44.9	Very low	51.4	Low	111 Å²	111	112.4 Å²	112.4	92%	0.917	64%	0.638	S	S	*	*			trans	-35.3	110.6	-174.7	0	0	0	0	0	115.8
439	S	40.1	Very low	50.1	Low	116 Å²	116	117.1 Å²	117.1	81%	0.811	65%	0.651	S	S	*	*			trans	-107.7	138.6	153	-176	0	0	0	0	110.2	P437 A441	P437-S439 PolarHBondContact O-N 3.29Å; S439-A441 PolarHBondContact O-N 3.1Å
440	R	48.9	Very low	49.8	Very low	252 Å²	252	118.9 Å²	118.9	95%	0.951	67%	0.667	S	S	*	*			trans	-62.3	93.5	-170.6	-74.6	173	168.8	169.3	-4.3	112.1
441	A	42.3	Very low	50	Low	53 Å²	53	117.9 Å²	117.9	44%	0.438	66%	0.659	S	S	.	*			trans	-80.4	143.9	162.9	0	0	0	0	0	111.1	S439	S439-A441 PolarHBondContact O-N 3.1Å
442	P	46.1	Very low	50.9	Low	91 Å²	91	112.8 Å²	112.8	59%	0.591	64%	0.637	S	S	*	*			trans	-63.9	154.6	-178.2	20.4	-25.9	0	0	0	112.8	A444 T445	P442-A444 PolarHBondContact O-N 3.04Å; P442-A444 VanDerWaalsContact O-N 3.13Å; P442-T445 WeakPolarHBondContact CG-OG1 3.4Å; P442-T445 PolarHBondContact O-N 3.41Å; P442-T445 PolarHBondContact O-OG1 3.23Å
443	A	49.2	Very low	52.6	Low	79 Å²	79	110.6 Å²	110.6	65%	0.653	62%	0.624	S	S	*	*	H	α-helix	trans	-55.6	-34	-172.3	0	0	0	0	0	114	T445 K446 V447	A443-T445 VanDerWaalsContact C-N 3.3Å; A443-T445 PolarHBondContact O-N 2.82Å; A443-K446 PolarHBondContact O-N 3.1Å; A443-V447 PolarHBondContact O-N 3.06Å
444	A	46.9	Very low	54.6	Low	81 Å²	81	107.7 Å²	107.7	67%	0.669	60%	0.597	S	S	*	*	H	α-helix	trans	-62.9	-32.7	176.1	0	0	0	0	0	113.3	P442 R448	P442-A444 PolarHBondContact O-N 3.04Å; P442-A444 VanDerWaalsContact O-N 3.13Å; A444-R448 PolarHBondContact O-N 3.28Å; A444-R448 VanDerWaalsContact O-N 3.12Å
445	T	51	Low	57.1	Low	62 Å²	62	100.5 Å²	100.5	38%	0.38	56%	0.563	S	S	.	*	H	α-helix	trans	-75.8	-28.9	178.4	-23.1	0	0	0	0	111.9	P442 A443 K449	P442-T445 WeakPolarHBondContact CG-OG1 3.4Å; P442-T445 PolarHBondContact O-N 3.41Å; P442-T445 PolarHBondContact O-OG1 3.23Å; A443-T445 VanDerWaalsContact C-N 3.3Å; A443-T445 PolarHBondContact O-N 2.82Å; T445-K449 WeakPolarHBondContact O-CG 3.35Å; T445-K449 PolarHBondContact O-N 3.17Å; T445-K449 VanDerWaalsContact O-N 3.11Å
446	K	47.5	Very low	59.6	Low	145 Å²	145	94.5 Å²	94.5	63%	0.63	53%	0.53	S	S	*	.	H	α-helix	trans	-70.5	-40.4	173.3	-75.1	-174.1	174.8	-174.1	0	112.2	A443 K449 T450	A443-K446 PolarHBondContact O-N 3.1Å; K446-K449 PolarHBondContact O-N 3.28Å; K446-T450 PolarHBondContact O-N 3.41Å; K446-T450 VanDerWaalsContact O-N 3.1Å; K446-T450 PolarHBondContact O-OG1 2.95Å
447	V	53.9	Low	62.2	Low	84 Å²	84	90.6 Å²	90.6	51%	0.509	51%	0.508	S	S	.	.	H	α-helix	trans	-66.7	-40.8	175.5	179.4	0	0	0	0	111	A443 K449 T450 I451	A443-V447 PolarHBondContact O-N 3.06Å; V447-K449 PolarHBondContact O-N 2.74Å; V447-T450 VanDerWaalsContact CA-OG1 3.28Å; V447-T450 WeakPolarHBondContact CA-OG1 3.27Å; V447-T450 PolarHBondContact O-N 3.08Å; V447-T450 PolarHBondContact O-OG1 2.65Å; V447-I451 HydrophobicContact CG1-CD1 4.03Å; V447-I451 WeakPolarHBondContact O-CG1 3.3Å; V447-I451 PolarHBondContact O-N 3.39Å; V447-I451 VanDerWaalsContact O-N 3.08Å
448	R	54.2	Low	64.6	Low	187 Å²	187	84.8 Å²	84.8	71%	0.706	47%	0.47	S	S	*	.	H	α-helix	trans	-66.3	-37.4	177	-162.1	172	-176.9	168.5	1	113	A444 S452	A444-R448 PolarHBondContact O-N 3.28Å; A444-R448 VanDerWaalsContact O-N 3.12Å; R448-S452 WeakPolarHBondContact O-CB 3.49Å; R448-S452 PolarHBondContact O-N 3.07Å; R448-S452 VanDerWaalsContact O-N 3.16Å
449	K	56.4	Low	66.9	Low	138 Å²	138	79.5 Å²	79.5	60%	0.6	43%	0.426	S	S	*	.	H	α-helix	trans	-67	-37.4	174.1	-82.1	-171.9	171.8	-167.4	0	112.9	T445 K446 V447 S453	T445-K449 WeakPolarHBondContact O-CG 3.35Å; T445-K449 PolarHBondContact O-N 3.17Å; T445-K449 VanDerWaalsContact O-N 3.11Å; K446-K449 PolarHBondContact O-N 3.28Å; V447-K449 PolarHBondContact O-N 2.74Å; K449-S453 WeakPolarHBondContact O-CB 3.37Å; K449-S453 PolarHBondContact O-N 2.91Å; K449-S453 VanDerWaalsContact O-N 3.11Å
450	T	74.1	Confident	69.5	Low	83 Å²	83	75.5 Å²	75.5	51%	0.509	39%	0.394	S	S	.	.	H	α-helix	trans	-71.1	-39	178.5	36.4	0	0	0	0	112.5	K446 V447 S453 R454	K446-T450 PolarHBondContact O-N 3.41Å; K446-T450 VanDerWaalsContact O-N 3.1Å; K446-T450 PolarHBondContact O-OG1 2.95Å; V447-T450 VanDerWaalsContact CA-OG1 3.28Å; V447-T450 WeakPolarHBondContact CA-OG1 3.27Å; V447-T450 PolarHBondContact O-N 3.08Å; V447-T450 PolarHBondContact O-OG1 2.65Å; T450-S453 PolarHBondContact O-N 3.34Å; T450-R454 WeakPolarHBondContact O-CG 3.44Å; T450-R454 PolarHBondContact O-N 2.91Å
451	I	81	Confident	71.6	Confident	42 Å²	42	63.5 Å²	63.5	22%	0.215	35%	0.349	C	S	.	.	H	α-helix	trans	-65	-45.8	173.9	-65.6	166.6	0	0	0	110.9	V447 S453 R454 V455	V447-I451 HydrophobicContact CG1-CD1 4.03Å; V447-I451 WeakPolarHBondContact O-CG1 3.3Å; V447-I451 PolarHBondContact O-N 3.39Å; V447-I451 VanDerWaalsContact O-N 3.08Å; I451-S453 VanDerWaalsContact C-N 3.28Å; I451-S453 PolarHBondContact O-N 3.19Å; I451-R454 PolarHBondContact O-N 3.01Å; I451-V455 HydrophobicContact CG2-CG2 4.23Å; I451-V455 VanDerWaalsContact O-CG2 3.3Å; I451-V455 WeakPolarHBondContact O-CG2 3.17Å; I451-V455 PolarHBondContact O-N 2.8Å
452	S	81.9	Confident	74.2	Confident	15 Å²	15	61.3 Å²	61.3	11%	0.105	33%	0.33	C	S	.	.	H	α-helix	trans	-60.3	-38	179	-156.2	0	0	0	0	112.5	H424 S427 R448 H456	H424-S452 WeakPolarHBondContact ND1-CB 3.32Å; H424-S452 PolarHBondContact ND1-OG 3.2Å; H424-S452 PolarHBondContact O-OG 3.25Å; S427-S452 PolarHBondContact OG-OG 3.16Å; R448-S452 WeakPolarHBondContact O-CB 3.49Å; R448-S452 PolarHBondContact O-N 3.07Å; R448-S452 VanDerWaalsContact O-N 3.16Å; S452-H456 WeakPolarHBondContact O-CB 3.41Å; S452-H456 PolarHBondContact O-N 3.44Å
453	S	85.3	Confident	76.4	Confident	59 Å²	59	57 Å²	57	41%	0.413	30%	0.302	S	S	.	.	H	α-helix	trans	-66.7	-44.8	174.9	170.4	0	0	0	0	111.9	K449 T450 I451 V455 H456 E457	K449-S453 WeakPolarHBondContact O-CB 3.37Å; K449-S453 PolarHBondContact O-N 2.91Å; K449-S453 VanDerWaalsContact O-N 3.11Å; T450-S453 PolarHBondContact O-N 3.34Å; I451-S453 VanDerWaalsContact C-N 3.28Å; I451-S453 PolarHBondContact O-N 3.19Å; S453-V455 PolarHBondContact O-N 3.46Å; S453-H456 PolarHBondContact O-N 3.3Å; S453-E457 WeakPolarHBondContact O-CG 3.2Å; S453-E457 PolarHBondContact O-N 3.19Å
454	R	88.3	Confident	78.6	Confident	86 Å²	86	53.2 Å²	53.2	33%	0.325	27%	0.271	S	S	.	.	H	α-helix	trans	-63.6	-39.4	176.2	-70.2	-177	73.2	-151.9	-4.6	112.9	L408 T450 I451 A458	L408-R454 PolarHBondContact O-NH1 3.08Å; L408-R454 PolarHBondContact O-NH2 3.09Å; T450-R454 WeakPolarHBondContact O-CG 3.44Å; T450-R454 PolarHBondContact O-N 2.91Å; I451-R454 PolarHBondContact O-N 3.01Å; R454-A458 WeakPolarHBondContact O-CB 3.09Å; R454-A458 PolarHBondContact O-N 2.96Å
455	V	90.5	Very high	80.8	Confident	0 Å²	0	49.5 Å²	49.5	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-61.3	-49.5	174.1	173	0	0	0	0	110.1	L408 Y413 V421 H424 I451 S453 E457 A458 V459	L408-V455 HydrophobicContact CD1-CB 4.41Å; L408-V455 HydrophobicContact CD1-CG2 3.48Å; L408-V455 VanDerWaalsContact CD1-CG2 3.48Å; Y413-V455 HydrophobicContact CE2-CG2 3.97Å; V421-V455 HydrophobicContact CG1-CG1 3.67Å; H424-V455 HydrophobicContact CB-CB 4.27Å; H424-V455 HydrophobicContact CB-CG1 3.95Å; I451-V455 HydrophobicContact CG2-CG2 4.23Å; I451-V455 VanDerWaalsContact O-CG2 3.3Å; I451-V455 WeakPolarHBondContact O-CG2 3.17Å; I451-V455 PolarHBondContact O-N 2.8Å; S453-V455 PolarHBondContact O-N 3.46Å; V455-E457 PolarHBondContact O-N 2.97Å; V455-A458 PolarHBondContact O-N 3.3Å; V455-V459 HydrophobicContact CG1-CG2 4.33Å; V455-V459 VanDerWaalsContact O-CG2 3.28Å; V455-V459 WeakPolarHBondContact O-CG2 3.22Å; V455-V459 PolarHBondContact O-N 3.28Å
456	H	90.6	Very high	82.7	Confident	37 Å²	37	46.7 Å²	46.7	17%	0.171	22%	0.222	C	C	.	.	H	α-helix	trans	-57.5	-47	178.3	168.3	87.6	0	0	0	112.3	A428 Y429 S452 S453 A458 V459 K460	A428-H456 HydrophobicContact CB-CB 3.97Å; Y429-H456 AromaticContact CE1-CE1 3.81Å; Y429-H456 AromaticContact CE2-CE1 3.45Å; Y429-H456 VanDerWaalsContact CE2-CE1 3.45Å; Y429-H456 WeakPolarHBondContact CE2-CE1 3.39Å; Y429-H456 AromaticContact CE2-ND1 3.58Å; Y429-H456 AromaticContact CZ-CE1 3.25Å; Y429-H456 AromaticContact CZ-ND1 3.89Å; Y429-H456 PolarHBondContact OH-CE1 3.49Å; Y429-H456 VanDerWaalsContact OH-CE1 3.26Å; S452-H456 WeakPolarHBondContact O-CB 3.41Å; S452-H456 PolarHBondContact O-N 3.44Å; S453-H456 PolarHBondContact O-N 3.3Å; H456-A458 PolarHBondContact O-N 3.3Å; H456-V459 PolarHBondContact O-N 3.46Å; H456-K460 WeakPolarHBondContact O-CB 3.43Å; H456-K460 PolarHBondContact O-N 3.07Å
457	E	90.9	Very high	84.7	Confident	59 Å²	59	41.8 Å²	41.8	28%	0.276	20%	0.203	S	C	.	.	H	α-helix	trans	-64.1	-39.9	178	-71.4	-171.7	162.1	0	0	112.8	S453 V455 K460 A461 K602	S453-E457 WeakPolarHBondContact O-CG 3.2Å; S453-E457 PolarHBondContact O-N 3.19Å; V455-E457 PolarHBondContact O-N 2.97Å; E457-K460 PolarHBondContact O-N 3.41Å; E457-A461 WeakPolarHBondContact O-CB 3.46Å; E457-A461 PolarHBondContact O-N 3.19Å; E457-K602 IonicContact OE1-NZ 2.7Å; E457-K602 PolarHBondContact OE1-NZ 3.3Å; E457-K602 IonicContact OE2-NZ 3.8Å; E457-K602 PolarHBondContact OE2-NZ 3.23Å
458	A	93.1	Very high	86.3	Confident	0 Å²	0	37.8 Å²	37.8	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-62.7	-46.4	175.9	0	0	0	0	0	111.7	L408 R454 V455 H456 A461 I462 C646	L408-A458 HydrophobicContact CD2-CB 3.74Å; R454-A458 WeakPolarHBondContact O-CB 3.09Å; R454-A458 PolarHBondContact O-N 2.96Å; V455-A458 PolarHBondContact O-N 3.3Å; H456-A458 PolarHBondContact O-N 3.3Å; A458-A461 PolarHBondContact O-N 3Å; A458-I462 VanDerWaalsContact O-CG1 3.28Å; A458-I462 WeakPolarHBondContact O-CG1 3.49Å; A458-I462 PolarHBondContact O-N 3.21Å; A458-C646 HydrophobicContact CB-CB 3.95Å
459	V	93.4	Very high	87.8	Confident	0 Å²	0	30.2 Å²	30.2	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-65.2	-42.2	177.8	-176.5	0	0	0	0	110.5	V421 V425 V455 H456 A461 I462 A463 W507 T508 V511 L513	V421-V459 HydrophobicContact CG1-CG2 4Å; V425-V459 HydrophobicContact CG2-CB 4.17Å; V425-V459 HydrophobicContact CG2-CG1 4.29Å; V425-V459 HydrophobicContact CG2-CG2 3.88Å; V455-V459 HydrophobicContact CG1-CG2 4.33Å; V455-V459 VanDerWaalsContact O-CG2 3.28Å; V455-V459 WeakPolarHBondContact O-CG2 3.22Å; V455-V459 PolarHBondContact O-N 3.28Å; H456-V459 PolarHBondContact O-N 3.46Å; V459-A461 PolarHBondContact O-N 2.88Å; V459-I462 PolarHBondContact O-N 2.65Å; V459-A463 WeakPolarHBondContact O-CB 2.98Å; V459-A463 PolarHBondContact O-N 3.38Å; V459-W507 HydrophobicContact CG1-CZ3 4.43Å; V459-W507 HydrophobicContact CG2-CH2 3.81Å; V459-W507 HydrophobicContact CG2-CZ3 4.35Å; V459-T508 HydrophobicContact CG1-CG2 4.09Å; V459-V511 HydrophobicContact CG1-CG1 4.48Å; V459-V511 HydrophobicContact CG2-CG1 4.5Å; V459-L513 HydrophobicContact CB-CD1 4.45Å; V459-L513 HydrophobicContact CG1-CD1 3.81Å
460	K	93.3	Very high	89.3	Confident	32 Å²	32	24.3 Å²	24.3	14%	0.139	13%	0.129	C	C	.	.	H	α-helix	trans	-59.3	-44.5	175	-172.8	-179.5	-177.3	-179.4	0	111.2	H456 E457 A463 L464 D556	H456-K460 WeakPolarHBondContact O-CB 3.43Å; H456-K460 PolarHBondContact O-N 3.07Å; E457-K460 PolarHBondContact O-N 3.41Å; K460-A463 PolarHBondContact O-N 3.39Å; K460-L464 HydrophobicContact CG-CD1 3.85Å; K460-L464 WeakPolarHBondContact O-CD1 3.44Å; K460-L464 VanDerWaalsContact O-CG 3.27Å; K460-L464 WeakPolarHBondContact O-CG 3.44Å; K460-L464 PolarHBondContact O-N 3.26Å; K460-D556 IonicContact NZ-OD2 3.71Å; K460-D556 PolarHBondContact NZ-OD2 3.15Å
461	A	94.8	Very high	89.4	Confident	0 Å²	0	22 Å²	22	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-62.4	-44.6	177.5	0	0	0	0	0	112.2	E457 A458 V459 A463 L464 V465 Y565 V600 L645	E457-A461 WeakPolarHBondContact O-CB 3.46Å; E457-A461 PolarHBondContact O-N 3.19Å; A458-A461 PolarHBondContact O-N 3Å; V459-A461 PolarHBondContact O-N 2.88Å; A461-A463 VanDerWaalsContact C-N 3.31Å; A461-A463 PolarHBondContact O-N 3.41Å; A461-L464 PolarHBondContact O-N 3.33Å; A461-L464 VanDerWaalsContact O-N 3.17Å; A461-V465 WeakPolarHBondContact O-CG2 3.42Å; A461-V465 PolarHBondContact O-N 2.86Å; A461-Y565 HydrophobicContact CB-CD1 3.53Å; A461-Y565 HydrophobicContact CB-CE1 3.54Å; A461-V600 HydrophobicContact CB-CG1 3.93Å; A461-L645 HydrophobicContact CB-CD1 3.5Å; A461-L645 VanDerWaalsContact CB-CD1 3.5Å
462	I	94.8	Very high	89	Confident	7 Å²	7	22.9 Å²	22.9	4%	0.036	12%	0.116	C	C	.	.	H	α-helix	trans	-62.8	-39.6	177.6	-65.9	164.2	0	0	0	110.9	L406 A458 V459 L464 L504 W507 T508 V600 T648	L406-I462 HydrophobicContact CD1-CD1 4.04Å; A458-I462 VanDerWaalsContact O-CG1 3.28Å; A458-I462 WeakPolarHBondContact O-CG1 3.49Å; A458-I462 PolarHBondContact O-N 3.21Å; V459-I462 PolarHBondContact O-N 2.65Å; I462-L464 PolarHBondContact O-N 2.77Å; I462-L504 HydrophobicContact CG2-CB 3.82Å; I462-L504 HydrophobicContact CG2-CD2 3.9Å; I462-L504 HydrophobicContact CG2-CG 4.34Å; I462-W507 HydrophobicContact CB-CZ3 4.4Å; I462-W507 HydrophobicContact CD1-CH2 4.1Å; I462-W507 HydrophobicContact CD1-CZ3 3.57Å; I462-W507 HydrophobicContact CG2-CE3 4.31Å; I462-W507 HydrophobicContact CG2-CZ3 4.18Å; I462-T508 HydrophobicContact CB-CG2 4.08Å; I462-T508 HydrophobicContact CG2-CG2 3.69Å; I462-V600 HydrophobicContact CG1-CG2 4.27Å; I462-T648 HydrophobicContact CD1-CG2 3.58Å; I462-T648 HydrophobicContact CG1-CG2 4.19Å
463	A	94.2	Very high	88.1	Confident	1 Å²	1	27.2 Å²	27.2	1%	0.008	13%	0.134	C	C	.	.	H	α-helix	trans	-70.9	-11.9	178	0	0	0	0	0	114.2	V459 K460 A461 H466 T508 L525	V459-A463 WeakPolarHBondContact O-CB 2.98Å; V459-A463 PolarHBondContact O-N 3.38Å; K460-A463 PolarHBondContact O-N 3.39Å; A461-A463 VanDerWaalsContact C-N 3.31Å; A461-A463 PolarHBondContact O-N 3.41Å; A463-H466 PolarHBondContact O-CD2 3.43Å; A463-H466 PolarHBondContact O-NE2 2.89Å; A463-T508 HydrophobicContact CB-CG2 3.99Å; A463-L525 HydrophobicContact CB-CD1 3.94Å; A463-L525 HydrophobicContact CB-CD2 4.44Å
464	L	93.9	Very high	86.7	Confident	0 Å²	0	29 Å²	29	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-109	-36.4	-179.1	-68.4	169.2	0	0	0	112.5	K460 A461 I462 H466 M523 L525 F535 V554 Y565	K460-L464 HydrophobicContact CG-CD1 3.85Å; K460-L464 WeakPolarHBondContact O-CD1 3.44Å; K460-L464 VanDerWaalsContact O-CG 3.27Å; K460-L464 WeakPolarHBondContact O-CG 3.44Å; K460-L464 PolarHBondContact O-N 3.26Å; A461-L464 PolarHBondContact O-N 3.33Å; A461-L464 VanDerWaalsContact O-N 3.17Å; I462-L464 PolarHBondContact O-N 2.77Å; L464-H466 PolarHBondContact O-N 2.96Å; L464-H466 VanDerWaalsContact O-N 3.09Å; L464-M523 HydrophobicContact CD2-CE 4.42Å; L464-M523 HydrophobicContact CD2-SD 3.86Å; L464-M523 WeakPolarHBondContact O-CE 3.24Å; L464-L525 HydrophobicContact CD2-CD1 3.73Å; L464-L525 HydrophobicContact CD2-CG 4.45Å; L464-L525 HydrophobicContact CG-CD1 4.11Å; L464-F535 HydrophobicContact CD1-CD1 4.44Å; L464-F535 HydrophobicContact CD1-CE1 4.14Å; L464-F535 HydrophobicContact CD1-CZ 4.39Å; L464-F535 HydrophobicContact CD2-CB 4.48Å; L464-F535 HydrophobicContact CD2-CD1 4.12Å; L464-F535 HydrophobicContact CD2-CD2 3.78Å; L464-F535 HydrophobicContact CD2-CE1 4.32Å; L464-F535 HydrophobicContact CD2-CE2 3.99Å; L464-F535 HydrophobicContact CD2-CG 3.85Å; L464-F535 HydrophobicContact CD2-CZ 4.27Å; L464-V554 HydrophobicContact CD1-CG2 4.32Å; L464-Y565 HydrophobicContact CB-CD2 4.49Å; L464-Y565 HydrophobicContact CD1-CD2 4.4Å; L464-Y565 HydrophobicContact CD1-CE2 3.7Å
465	V	93.4	Very high	84.4	Confident	3 Å²	3	30.5 Å²	30.5	2%	0.018	17%	0.167	C	C	.	.	S	Bend	trans	-85.2	80.3	-179.3	-168.2	0	0	0	0	111.4	A461 M550 I552 Y565 K567	A461-V465 WeakPolarHBondContact O-CG2 3.42Å; A461-V465 PolarHBondContact O-N 2.86Å; V465-M550 HydrophobicContact CG1-SD 4.26Å; V465-I552 HydrophobicContact CB-CG2 4.34Å; V465-I552 HydrophobicContact CG1-CG2 4.42Å; V465-I552 HydrophobicContact CG2-CG2 3.93Å; V465-Y565 HydrophobicContact CG2-CG 3.99Å; V465-K567 HydrophobicContact CB-CD 4.27Å; V465-K567 HydrophobicContact CG1-CB 4.12Å; V465-K567 HydrophobicContact CG1-CD 3.73Å; V465-K567 HydrophobicContact CG1-CG 3.65Å; V465-K567 WeakPolarHBondContact O-CD 3.5Å; V465-K567 VanDerWaalsContact O-CE 3.26Å; V465-K567 WeakPolarHBondContact O-CE 3.42Å; V465-K567 PolarHBondContact O-NZ 2.9Å
466	H	92.2	Very high	82.1	Confident	2 Å²	2	34 Å²	34	1%	0.009	20%	0.203	C	C	.	.			trans	-158.3	174.5	170.9	60.2	79.1	0	0	0	110.3	A463 L464 V468 E501 V505 L515 R518 M550	A463-H466 PolarHBondContact O-CD2 3.43Å; A463-H466 PolarHBondContact O-NE2 2.89Å; L464-H466 PolarHBondContact O-N 2.96Å; L464-H466 VanDerWaalsContact O-N 3.09Å; H466-V468 HydrophobicContact CB-CB 4.45Å; H466-V468 HydrophobicContact CB-CG2 3.99Å; H466-V468 PolarHBondContact CE1-O 3Å; H466-V468 WeakPolarHBondContact ND1-CB 3.25Å; H466-V468 PolarHBondContact ND1-N 2.89Å; H466-V468 PolarHBondContact ND1-O 3.06Å; H466-E501 HydrophobicContact CB-CB 4.32Å; H466-V505 HydrophobicContact CB-CG2 4.2Å; H466-V505 WeakPolarHBondContact CD2-CG2 3.45Å; H466-L515 WeakPolarHBondContact CE1-CD2 3.42Å; H466-R518 PolarHBondContact CE1-NH1 3.29Å; H466-R518 VanDerWaalsContact CE1-NH1 3.31Å; H466-R518 PolarHBondContact ND1-NH1 3.14Å; H466-R518 PolarHBondContact O-NH1 3.26Å; H466-R518 PolarHBondContact O-NH2 2.81Å; H466-M550 VanDerWaalsContact O-CE 3.3Å; H466-M550 WeakPolarHBondContact O-CE 3.26Å
467	N	88	Confident	79.3	Confident	43 Å²	43	38.3 Å²	38.3	23%	0.23	23%	0.231	C	C	.	.			trans	-115.3	13.7	167.7	-80.1	-24.7	0	0	0	112.5	E501 R518 M550	N467-E501 PolarHBondContact N-OE2 3.42Å; N467-R518 PolarHBondContact OD1-NH2 2.9Å; N467-R518 VanDerWaalsContact OD1-NH2 3.07Å; N467-M550 HydrophobicContact CB-CE 4.41Å; N467-M550 WeakPolarHBondContact OD1-CE 3.26Å
468	V	88.9	Confident	76.8	Confident	0 Å²	0	41.6 Å²	41.6	0%	0	26%	0.256	C	S	.	.			trans	-61.9	130.1	175.8	-177.8	0	0	0	0	111.8	H466 Y494 Q495 A496 E501 V502 V505 L515 R518	H466-V468 HydrophobicContact CB-CB 4.45Å; H466-V468 HydrophobicContact CB-CG2 3.99Å; H466-V468 PolarHBondContact CE1-O 3Å; H466-V468 WeakPolarHBondContact ND1-CB 3.25Å; H466-V468 PolarHBondContact ND1-N 2.89Å; H466-V468 PolarHBondContact ND1-O 3.06Å; V468-Y494 HydrophobicContact CG1-CD1 3.79Å; V468-Y494 HydrophobicContact CG1-CG 3.92Å; V468-Q495 CarbonylContact C-O 3.47Å; V468-Q495 WeakPolarHBondContact CA-O 3.47Å; V468-A496 HydrophobicContact CB-CB 4.17Å; V468-A496 HydrophobicContact CG2-CB 3.64Å; V468-E501 HydrophobicContact CG2-CB 3.61Å; V468-V502 HydrophobicContact CG2-CG2 4.37Å; V468-V505 HydrophobicContact CB-CG2 4.08Å; V468-V505 HydrophobicContact CG1-CB 4.46Å; V468-V505 HydrophobicContact CG1-CG1 4.41Å; V468-V505 HydrophobicContact CG1-CG2 4.45Å; V468-V505 HydrophobicContact CG2-CB 4.4Å; V468-V505 HydrophobicContact CG2-CG2 3.8Å; V468-L515 HydrophobicContact CB-CD2 4.49Å; V468-L515 HydrophobicContact CG1-CD2 4.34Å; V468-L515 WeakPolarHBondContact O-CD2 3.37Å; V468-R518 WeakPolarHBondContact O-CD 3.37Å
469	T	85.8	Confident	74	Confident	28 Å²	28	47.1 Å²	47.1	17%	0.172	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	130	174.5	-55.7	0	0	0	0	109.9	Q495	T469-Q495 PolarHBondContact N-O 2.98Å; T469-Q495 PolarHBondContact O-N 3.32Å
470	P	86.1	Confident	71.3	Confident	13 Å²	13	56.1 Å²	56.1	8%	0.084	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	127.7	172.2	30.4	-30.8	0	0	0	109.8	R492 Y494 L515 V516	P470-R492 HydrophobicContact CB-CG 4.18Å; P470-Y494 HydrophobicContact CB-CD1 4.18Å; P470-Y494 HydrophobicContact CB-CE1 4.12Å; P470-L515 HydrophobicContact CG-CD2 4.4Å; P470-L515 HydrophobicContact CG-CG 4.26Å; P470-V516 WeakPolarHBondContact CG-O 3.36Å
471	V	76.8	Confident	68.6	Low	34 Å²	34	58.9 Å²	58.9	21%	0.206	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	133.8	173.7	-179.3	0	0	0	0	108.8	V493 Q495	V471-V493 PolarHBondContact N-O 2.92Å; V471-V493 PolarHBondContact O-N 3.34Å; V471-Q495 HydrophobicContact CB-CG 4.43Å; V471-Q495 HydrophobicContact CG2-CB 4.36Å; V471-Q495 VanDerWaalsContact CG2-CD 3.45Å; V471-Q495 HydrophobicContact CG2-CG 3.92Å
472	Y	74.1	Confident	65.7	Low	61 Å²	61	67.3 Å²	67.3	24%	0.239	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	121.1	-179.5	-62.5	-74.4	0	0	0	109.8	A474 Y487 R492 V516	Y472-A474 PolarHBondContact O-N 3.16Å; Y472-Y487 WeakPolarHBondContact CB-OH 3.28Å; Y472-Y487 AromaticContact CD1-CD1 3.68Å; Y472-Y487 HydrophobicContact CD1-CD1 3.68Å; Y472-Y487 AromaticContact CD1-CE1 2.97Å; Y472-Y487 HydrophobicContact CD1-CE1 2.97Å; Y472-Y487 AromaticContact CD1-CZ 3.64Å; Y472-Y487 HydrophobicContact CD2-CE1 4.08Å; Y472-Y487 AromaticContact CD2-CZ 3.85Å; Y472-Y487 WeakPolarHBondContact CD2-OH 3.13Å; Y472-Y487 AromaticContact CE1-CD1 3.73Å; Y472-Y487 HydrophobicContact CE1-CD1 3.73Å; Y472-Y487 AromaticContact CE1-CE1 3.45Å; Y472-Y487 HydrophobicContact CE1-CE1 3.45Å; Y472-Y487 VanDerWaalsContact CE1-CE1 3.45Å; Y472-Y487 HydrophobicContact CE2-CE1 4.5Å; Y472-Y487 HydrophobicContact CG-CD1 4.37Å; Y472-Y487 AromaticContact CG-CE1 3.29Å; Y472-Y487 HydrophobicContact CG-CE1 3.29Å; Y472-Y487 AromaticContact CG-CZ 3.45Å; Y472-Y487 VanDerWaalsContact CG-CZ 3.45Å; Y472-R492 HydrophobicContact CD1-CB 4.15Å; Y472-R492 HydrophobicContact CD1-CG 4.04Å; Y472-R492 HydrophobicContact CE1-CB 4.06Å; Y472-R492 HydrophobicContact CE1-CG 3.71Å; Y472-V516 WeakPolarHBondContact OH-CG1 3.46Å; Y472-V516 PolarHBondContact OH-O 3.3Å
473	E	62.9	Low	63	Low	106 Å²	106	69.8 Å²	69.8	50%	0.495	42%	0.417	S	S	.	.			trans	-81.2	115.5	174.8	-67.4	-161.4	148	0	0	109.7	N475 C491	E473-N475 PolarHBondContact O-N 2.97Å; E473-C491 PolarHBondContact N-O 3.47Å; E473-C491 VanDerWaalsContact N-O 3.15Å
474	A	54.4	Low	60.5	Low	96 Å²	96	77.9 Å²	77.9	79%	0.793	46%	0.455	S	S	*	.			trans	-71.6	100.8	172	0	0	0	0	0	109	Y472 G476	Y472-A474 PolarHBondContact O-N 3.16Å; A474-G476 PolarHBondContact O-N 2.94Å
475	N	40.4	Very low	57.8	Low	119 Å²	119	86.3 Å²	86.3	64%	0.636	49%	0.494	S	S	*	.			trans	-70.4	74	168.9	-86.5	-17.8	0	0	0	110.3	E473 V477 C491	E473-N475 PolarHBondContact O-N 2.97Å; N475-V477 WeakPolarHBondContact O-CG2 3.21Å; N475-V477 PolarHBondContact O-N 3.44Å; N475-C491 PolarHBondContact ND2-SG 3.31Å; N475-C491 VanDerWaalsContact ND2-SG 3.39Å
476	G	41.5	Very low	55	Low	72 Å²	72	94.5 Å²	94.5	74%	0.742	53%	0.532	S	S	*	.	S	Bend	trans	59.7	8.1	156.9	0	0	0	0	0	119.4	A474	A474-G476 PolarHBondContact O-N 2.94Å
477	V	33.1	Very low	52.6	Low	128 Å²	128	100.2 Å²	100.2	78%	0.776	56%	0.555	S	S	*	*			trans	-92.2	120.2	175.5	-171.4	0	0	0	0	109.7	N475 D479	N475-V477 WeakPolarHBondContact O-CG2 3.21Å; N475-V477 PolarHBondContact O-N 3.44Å; V477-D479 PolarHBondContact O-N 3.48Å
478	T	37.1	Very low	50.6	Low	128 Å²	128	105.3 Å²	105.3	79%	0.785	58%	0.577	S	S	*	*			trans	-89.7	15.1	-165.4	37.7	0	0	0	0	116.2
479	D	34.3	Very low	48.8	Very low	117 Å²	117	109.2 Å²	109.2	63%	0.626	60%	0.598	S	S	*	*			trans	-117.9	112.8	-179.8	-77.6	-43.3	0	0	0	112.6	V477 A481	V477-D479 PolarHBondContact O-N 3.48Å; D479-A481 PolarHBondContact O-N 2.93Å
480	Q	37.6	Very low	47	Very low	189 Å²	189	113.4 Å²	113.4	88%	0.883	62%	0.623	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.7	-4.2	-174	-72.7	176.4	-16.5	0	0	114.3
481	A	37.4	Very low	45.6	Very low	90 Å²	90	114.3 Å²	114.3	74%	0.744	63%	0.63	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.5	-20.3	-172.4	0	0	0	0	0	114.8	D479	D479-A481 PolarHBondContact O-N 2.93Å
482	E	34.1	Very low	45.5	Very low	176 Å²	176	114.1 Å²	114.1	82%	0.822	63%	0.625	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.3	-6.4	177.9	-67.4	-174.8	166.8	0	0	112.9	E484	E482-E484 VanDerWaalsContact C-N 3.27Å; E482-E484 PolarHBondContact O-N 3.49Å
483	A	37.1	Very low	45.9	Very low	60 Å²	60	114.2 Å²	114.2	50%	0.496	63%	0.632	S	S	.	*	T	Hydrogen-bonded Turn	trans	-75.3	-6.5	-177.6	0	0	0	0	0	114.9
484	E	41.7	Very low	46.9	Very low	171 Å²	171	109.8 Å²	109.8	80%	0.799	61%	0.611	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.9	-10.9	-172.2	-70.6	-174.4	163.1	0	0	114.7	E482	E482-E484 VanDerWaalsContact C-N 3.27Å; E482-E484 PolarHBondContact O-N 3.49Å
485	Q	36.7	Very low	48.2	Very low	177 Å²	177	106 Å²	106	83%	0.827	58%	0.577	S	S	*	*	S	Bend	trans	-115.9	-15.9	-172.2	-71.5	-171.2	-15.5	0	0	116.5
486	H	34.3	Very low	50.2	Low	175 Å²	175	100.6 Å²	100.6	81%	0.81	55%	0.548	S	S	*	.			trans	-132.9	74.4	176.1	-80.3	-77.5	0	0	0	110.8	E488	H486-E488 PolarHBondContact O-N 3.26Å; H486-E488 VanDerWaalsContact O-N 3.15Å
487	Y	43.4	Very low	51.8	Low	122 Å²	122	100 Å²	100	48%	0.478	53%	0.533	S	S	.	.			trans	-70.3	101.5	163.9	-115.5	-78	0	0	0	108.5	Y472 D489	Y472-Y487 WeakPolarHBondContact CB-OH 3.28Å; Y472-Y487 AromaticContact CD1-CD1 3.68Å; Y472-Y487 HydrophobicContact CD1-CD1 3.68Å; Y472-Y487 AromaticContact CD1-CE1 2.97Å; Y472-Y487 HydrophobicContact CD1-CE1 2.97Å; Y472-Y487 AromaticContact CD1-CZ 3.64Å; Y472-Y487 HydrophobicContact CD2-CE1 4.08Å; Y472-Y487 AromaticContact CD2-CZ 3.85Å; Y472-Y487 WeakPolarHBondContact CD2-OH 3.13Å; Y472-Y487 AromaticContact CE1-CD1 3.73Å; Y472-Y487 HydrophobicContact CE1-CD1 3.73Å; Y472-Y487 AromaticContact CE1-CE1 3.45Å; Y472-Y487 HydrophobicContact CE1-CE1 3.45Å; Y472-Y487 VanDerWaalsContact CE1-CE1 3.45Å; Y472-Y487 HydrophobicContact CE2-CE1 4.5Å; Y472-Y487 HydrophobicContact CG-CD1 4.37Å; Y472-Y487 AromaticContact CG-CE1 3.29Å; Y472-Y487 HydrophobicContact CG-CE1 3.29Å; Y472-Y487 AromaticContact CG-CZ 3.45Å; Y472-Y487 VanDerWaalsContact CG-CZ 3.45Å; Y487-D489 PolarHBondContact O-N 3.07Å
488	E	44.9	Very low	54	Low	149 Å²	149	95.7 Å²	95.7	70%	0.696	51%	0.508	S	S	*	.			trans	-63.6	123.7	163.7	-74	-170.3	162.3	0	0	108.7	H486 T490	H486-E488 PolarHBondContact O-N 3.26Å; H486-E488 VanDerWaalsContact O-N 3.15Å; E488-T490 PolarHBondContact O-N 2.64Å
489	D	50.5	Low	56.1	Low	83 Å²	83	90.9 Å²	90.9	44%	0.444	48%	0.48	S	S	.	.	G	3₁₀ helix	trans	-62.5	-3.6	-177.5	-86.1	-24.5	0	0	0	114.4	Y487 R492 R526	Y487-D489 PolarHBondContact O-N 3.07Å; D489-R492 IonicContact OD1-CZ 2.76Å; D489-R492 IonicContact OD1-NH2 2.83Å; D489-R492 PolarHBondContact OD1-NH2 2.95Å; D489-R526 IonicContact OD1-CZ 3.12Å; D489-R526 IonicContact OD1-NH1 3.26Å; D489-R526 PolarHBondContact OD1-NH1 2.98Å; D489-R526 IonicContact OD1-NH2 3.66Å; D489-R526 IonicContact OD2-NH1 2.65Å; D489-R526 PolarHBondContact OD2-NH1 3.47Å
490	T	49.6	Very low	58.5	Low	115 Å²	115	86.5 Å²	86.5	71%	0.706	46%	0.456	S	S	*	.	G	3₁₀ helix	trans	-82.6	-11.9	-173.3	49.4	0	0	0	0	114.9	E488	E488-T490 PolarHBondContact O-N 2.64Å
491	C	55.5	Low	60.9	Low	33 Å²	33	78.2 Å²	78.2	22%	0.223	42%	0.417	C	S	.	.	G	3₁₀ helix	trans	-111.5	20.1	-173.7	-63.1	0	0	0	0	114.8	E473 N475	E473-C491 PolarHBondContact N-O 3.47Å; E473-C491 VanDerWaalsContact N-O 3.15Å; N475-C491 PolarHBondContact ND2-SG 3.31Å; N475-C491 VanDerWaalsContact ND2-SG 3.39Å
492	R	75.1	Confident	63.4	Low	29 Å²	29	75 Å²	75	11%	0.109	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	127	-178	-166.7	-173.5	-41.8	-160.2	5.7	111.5	P470 Y472 D489 T514 L515 V516	P470-R492 HydrophobicContact CB-CG 4.18Å; Y472-R492 HydrophobicContact CD1-CB 4.15Å; Y472-R492 HydrophobicContact CD1-CG 4.04Å; Y472-R492 HydrophobicContact CE1-CB 4.06Å; Y472-R492 HydrophobicContact CE1-CG 3.71Å; D489-R492 IonicContact OD1-CZ 2.76Å; D489-R492 IonicContact OD1-NH2 2.83Å; D489-R492 PolarHBondContact OD1-NH2 2.95Å; R492-T514 VanDerWaalsContact NH1-CG2 3.27Å; R492-L515 PolarHBondContact NH1-O 2.79Å; R492-V516 VanDerWaalsContact NH1-CA 3.33Å
493	V	81.4	Confident	66.2	Low	63 Å²	63	66.8 Å²	66.8	38%	0.382	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	127.5	176.9	-177.4	0	0	0	0	109.4	V471	V471-V493 PolarHBondContact N-O 2.92Å; V471-V493 PolarHBondContact O-N 3.34Å
494	Y	85.8	Confident	68.8	Low	14 Å²	14	64.2 Å²	64.2	6%	0.055	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	135	175	-65.1	-57.9	0	0	0	111.6	V468 P470 V505 Q506 E509 L515	V468-Y494 HydrophobicContact CG1-CD1 3.79Å; V468-Y494 HydrophobicContact CG1-CG 3.92Å; P470-Y494 HydrophobicContact CB-CD1 4.18Å; P470-Y494 HydrophobicContact CB-CE1 4.12Å; Y494-V505 HydrophobicContact CD1-CG1 4.11Å; Y494-V505 HydrophobicContact CD2-CG1 4.4Å; Y494-V505 HydrophobicContact CE1-CG1 3.89Å; Y494-V505 HydrophobicContact CE2-CG1 4.16Å; Y494-V505 HydrophobicContact CG-CG1 4.38Å; Y494-Q506 HydrophobicContact CD2-CG 3.63Å; Y494-Q506 HydrophobicContact CE2-CG 4.02Å; Y494-E509 WeakPolarHBondContact CE2-OE2 3.09Å; Y494-E509 VanDerWaalsContact CZ-OE2 3.26Å; Y494-E509 VanDerWaalsContact OH-CD 3.3Å; Y494-E509 PolarHBondContact OH-OE2 3.44Å; Y494-L515 HydrophobicContact CD1-CD2 4.32Å; Y494-L515 HydrophobicContact CE1-CB 3.98Å; Y494-L515 HydrophobicContact CE1-CD2 4.15Å; Y494-L515 HydrophobicContact CE1-CG 4.45Å
495	Q	81.5	Confident	71.3	Confident	17 Å²	17	56.1 Å²	56.1	8%	0.079	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	132.4	176.1	-62.9	-175.6	-1.7	0	0	110	V468 T469 V471	V468-Q495 CarbonylContact C-O 3.47Å; V468-Q495 WeakPolarHBondContact CA-O 3.47Å; T469-Q495 PolarHBondContact N-O 2.98Å; T469-Q495 PolarHBondContact O-N 3.32Å; V471-Q495 HydrophobicContact CB-CG 4.43Å; V471-Q495 HydrophobicContact CG2-CB 4.36Å; V471-Q495 VanDerWaalsContact CG2-CD 3.45Å; V471-Q495 HydrophobicContact CG2-CG 3.92Å
496	A	82.4	Confident	73.9	Confident	4 Å²	4	52.3 Å²	52.3	3%	0.033	27%	0.273	C	S	.	.			trans	-152.8	166.4	174.5	0	0	0	0	0	111.3	V468 S498 V502	V468-A496 HydrophobicContact CB-CB 4.17Å; V468-A496 HydrophobicContact CG2-CB 3.64Å; A496-S498 VanDerWaalsContact C-N 3.28Å; A496-V502 HydrophobicContact CB-CG2 3.65Å
497	S	74.1	Confident	76.7	Confident	61 Å²	61	44.7 Å²	44.7	43%	0.427	24%	0.237	S	C	.	.	S	Bend	trans	-75.9	-12.5	173.9	50	0	0	0	0	114.2	D197 W198	D197-S497 WeakPolarHBondContact CB-O 3.23Å; W198-S497 VanDerWaalsContact O-CA 3.24Å; W198-S497 WeakPolarHBondContact O-CA 3.49Å
498	S	79.3	Confident	79.1	Confident	36 Å²	36	39 Å²	39	25%	0.252	21%	0.214	S	C	.	.			trans	-135.4	127.2	176.3	169.7	0	0	0	0	110.4	A496 D500 E501 V502	A496-S498 VanDerWaalsContact C-N 3.28Å; S498-D500 VanDerWaalsContact C-N 3.25Å; S498-D500 PolarHBondContact O-N 3.25Å; S498-E501 PolarHBondContact O-N 3.04Å; S498-E501 VanDerWaalsContact O-N 3.15Å; S498-V502 PolarHBondContact O-N 3.48Å
499	P	80.8	Confident	81.3	Confident	28 Å²	28	34.6 Å²	34.6	18%	0.182	19%	0.194	C	C	.	.	H	α-helix	trans	-69.7	-26.5	-177.8	28.8	-33.2	0	0	0	111.6	D197 M401 E501 V502 S503	D197-P499 VanDerWaalsContact OD1-CD 3.32Å; D197-P499 WeakPolarHBondContact OD1-CD 3.16Å; M401-P499 HydrophobicContact CB-CB 4.48Å; M401-P499 HydrophobicContact CE-CG 4.05Å; M401-P499 HydrophobicContact CG-CB 3.76Å; M401-P499 HydrophobicContact CG-CG 3.86Å; P499-E501 PolarHBondContact O-N 3.35Å; P499-V502 PolarHBondContact O-N 3.13Å; P499-V502 VanDerWaalsContact O-N 3.16Å; P499-S503 PolarHBondContact O-N 3.49Å
500	D	85.3	Confident	83.1	Confident	25 Å²	25	34.2 Å²	34.2	13%	0.134	20%	0.198	C	C	.	.	H	α-helix	trans	-56.5	-39.3	172.9	-61.7	10.6	0	0	0	110.3	M401 S498 S503 L504 R596	M401-D500 WeakPolarHBondContact CG-OD1 3.32Å; S498-D500 VanDerWaalsContact C-N 3.25Å; S498-D500 PolarHBondContact O-N 3.25Å; D500-S503 PolarHBondContact O-N 3.29Å; D500-S503 PolarHBondContact O-OG 3Å; D500-L504 WeakPolarHBondContact O-CG 3.5Å; D500-L504 PolarHBondContact O-N 2.96Å; D500-L504 VanDerWaalsContact O-N 3.16Å; D500-R596 IonicContact OD1-NH1 3.86Å; D500-R596 PolarHBondContact OD1-NH1 3.02Å; D500-R596 VanDerWaalsContact OD1-NH1 3.17Å; D500-R596 IonicContact OD2-NH1 3.31Å; D500-R596 PolarHBondContact OD2-NH1 3.45Å
501	E	89	Confident	85	Confident	14 Å²	14	28.9 Å²	28.9	7%	0.065	17%	0.165	C	C	.	.	H	α-helix	trans	-72.2	-39.1	178	-53.3	-162.2	148.1	0	0	112.6	H466 N467 V468 S498 P499 S503 L504 V505 M550 K567	H466-E501 HydrophobicContact CB-CB 4.32Å; N467-E501 PolarHBondContact N-OE2 3.42Å; V468-E501 HydrophobicContact CG2-CB 3.61Å; S498-E501 PolarHBondContact O-N 3.04Å; S498-E501 VanDerWaalsContact O-N 3.15Å; P499-E501 PolarHBondContact O-N 3.35Å; E501-S503 VanDerWaalsContact C-N 3.28Å; E501-S503 PolarHBondContact O-N 3.48Å; E501-L504 PolarHBondContact O-N 2.91Å; E501-V505 WeakPolarHBondContact O-CG2 3.46Å; E501-V505 PolarHBondContact O-N 2.96Å; E501-M550 VanDerWaalsContact OE1-SD 3.42Å; E501-K567 VanDerWaalsContact CG-NZ 3.33Å; E501-K567 VanDerWaalsContact OE1-CE 3.25Å; E501-K567 WeakPolarHBondContact OE1-CE 3.44Å; E501-K567 IonicContact OE1-NZ 3.63Å; E501-K567 PolarHBondContact OE1-NZ 2.84Å
502	V	89.6	Confident	86.5	Confident	22 Å²	22	28 Å²	28	13%	0.133	16%	0.162	C	C	.	.	H	α-helix	trans	-59.5	-44.8	175.5	177.6	0	0	0	0	109.7	V468 A496 S498 P499 L504 V505 Q506	V468-V502 HydrophobicContact CG2-CG2 4.37Å; A496-V502 HydrophobicContact CB-CG2 3.65Å; S498-V502 PolarHBondContact O-N 3.48Å; P499-V502 PolarHBondContact O-N 3.13Å; P499-V502 VanDerWaalsContact O-N 3.16Å; V502-L504 VanDerWaalsContact C-N 3.31Å; V502-L504 PolarHBondContact O-N 3.4Å; V502-V505 PolarHBondContact O-N 2.73Å; V502-Q506 HydrophobicContact CG1-CG 4.18Å; V502-Q506 WeakPolarHBondContact O-CB 3.49Å; V502-Q506 VanDerWaalsContact O-CG 3.24Å; V502-Q506 WeakPolarHBondContact O-CG 3.49Å; V502-Q506 PolarHBondContact O-N 3.21Å
503	S	91.4	Very high	87.2	Confident	4 Å²	4	26.6 Å²	26.6	3%	0.028	16%	0.156	C	C	.	.	H	α-helix	trans	-62.2	-37.6	177.9	78.2	0	0	0	0	112.8	M401 P499 D500 E501 W507	M401-S503 WeakPolarHBondContact O-CB 3.39Å; P499-S503 PolarHBondContact O-N 3.49Å; D500-S503 PolarHBondContact O-N 3.29Å; D500-S503 PolarHBondContact O-OG 3Å; E501-S503 VanDerWaalsContact C-N 3.28Å; E501-S503 PolarHBondContact O-N 3.48Å; S503-W507 VanDerWaalsContact O-CB 3.29Å; S503-W507 WeakPolarHBondContact O-CB 3.42Å; S503-W507 PolarHBondContact O-N 3.33Å
504	L	93.2	Very high	87.7	Confident	7 Å²	7	24.5 Å²	24.5	4%	0.037	14%	0.143	C	C	.	.	H	α-helix	trans	-66.4	-45.5	176.9	-73.5	167.3	0	0	0	111.2	F403 I462 D500 E501 V502 W507 T508 L598 T648 V650	F403-L504 HydrophobicContact CD2-CD2 3.6Å; F403-L504 HydrophobicContact CE2-CD2 3.71Å; I462-L504 HydrophobicContact CG2-CB 3.82Å; I462-L504 HydrophobicContact CG2-CD2 3.9Å; I462-L504 HydrophobicContact CG2-CG 4.34Å; D500-L504 WeakPolarHBondContact O-CG 3.5Å; D500-L504 PolarHBondContact O-N 2.96Å; D500-L504 VanDerWaalsContact O-N 3.16Å; E501-L504 PolarHBondContact O-N 2.91Å; V502-L504 VanDerWaalsContact C-N 3.31Å; V502-L504 PolarHBondContact O-N 3.4Å; L504-W507 WeakPolarHBondContact O-CB 3.15Å; L504-W507 PolarHBondContact O-N 3.11Å; L504-T508 WeakPolarHBondContact O-CG2 3.34Å; L504-T508 PolarHBondContact O-N 3.43Å; L504-L598 HydrophobicContact CD1-CD1 4.21Å; L504-T648 HydrophobicContact CD2-CG2 4.04Å; L504-V650 HydrophobicContact CD2-CG2 4.4Å
505	V	93.3	Very high	88	Confident	0 Å²	0	23.9 Å²	23.9	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-71	-38.2	179.9	175.4	0	0	0	0	112.1	H466 V468 Y494 E501 V502 W507 T508 E509 L515	H466-V505 HydrophobicContact CB-CG2 4.2Å; H466-V505 WeakPolarHBondContact CD2-CG2 3.45Å; V468-V505 HydrophobicContact CB-CG2 4.08Å; V468-V505 HydrophobicContact CG1-CB 4.46Å; V468-V505 HydrophobicContact CG1-CG1 4.41Å; V468-V505 HydrophobicContact CG1-CG2 4.45Å; V468-V505 HydrophobicContact CG2-CB 4.4Å; V468-V505 HydrophobicContact CG2-CG2 3.8Å; Y494-V505 HydrophobicContact CD1-CG1 4.11Å; Y494-V505 HydrophobicContact CD2-CG1 4.4Å; Y494-V505 HydrophobicContact CE1-CG1 3.89Å; Y494-V505 HydrophobicContact CE2-CG1 4.16Å; Y494-V505 HydrophobicContact CG-CG1 4.38Å; E501-V505 WeakPolarHBondContact O-CG2 3.46Å; E501-V505 PolarHBondContact O-N 2.96Å; V502-V505 PolarHBondContact O-N 2.73Å; V505-W507 VanDerWaalsContact C-N 3.26Å; V505-W507 PolarHBondContact O-N 2.83Å; V505-T508 WeakPolarHBondContact CA-OG1 3.44Å; V505-T508 PolarHBondContact O-N 2.63Å; V505-T508 PolarHBondContact O-OG1 3.41Å; V505-E509 PolarHBondContact O-N 3.37Å; V505-L515 HydrophobicContact CG1-CB 3.97Å; V505-L515 HydrophobicContact CG1-CD2 4.04Å
506	Q	91.9	Very high	88.4	Confident	97 Å²	97	23.9 Å²	23.9	45%	0.453	14%	0.142	S	C	.	.	H	α-helix	trans	-60.9	-39.6	171.4	-75.4	174.8	-24.8	0	0	111.3	Y494 V502 E509 S510	Y494-Q506 HydrophobicContact CD2-CG 3.63Å; Y494-Q506 HydrophobicContact CE2-CG 4.02Å; V502-Q506 HydrophobicContact CG1-CG 4.18Å; V502-Q506 WeakPolarHBondContact O-CB 3.49Å; V502-Q506 VanDerWaalsContact O-CG 3.24Å; V502-Q506 WeakPolarHBondContact O-CG 3.49Å; V502-Q506 PolarHBondContact O-N 3.21Å; Q506-E509 PolarHBondContact O-N 3.06Å; Q506-S510 PolarHBondContact O-N 3.19Å
507	W	92.7	Very high	88.6	Confident	16 Å²	16	24.6 Å²	24.6	6%	0.061	15%	0.15	C	C	.	.	H	α-helix	trans	-66	-44.3	174.3	171.1	77.1	0	0	0	111.9	F403 L406 V421 V459 I462 S503 L504 V505 E509 S510 V511	F403-W507 HydrophobicContact CB-CB 3.8Å; F403-W507 HydrophobicContact CB-CG 3.92Å; F403-W507 HydrophobicContact CD1-CB 4.39Å; F403-W507 AromaticContact CD1-CD1 3.37Å; F403-W507 AromaticContact CD1-CD2 3.77Å; F403-W507 HydrophobicContact CD1-CD2 3.77Å; F403-W507 AromaticContact CD1-CE2 3.65Å; F403-W507 AromaticContact CD1-CG 3.58Å; F403-W507 HydrophobicContact CD1-CG 3.58Å; F403-W507 HydrophobicContact CD1-CZ2 4.42Å; F403-W507 AromaticContact CD1-NE1 3.38Å; F403-W507 HydrophobicContact CD2-CB 4.5Å; F403-W507 HydrophobicContact CD2-CD2 4.19Å; F403-W507 HydrophobicContact CD2-CE3 4.42Å; F403-W507 HydrophobicContact CD2-CG 4.22Å; F403-W507 AromaticContact CE1-CD1 3.92Å; F403-W507 AromaticContact CE1-CD2 3.77Å; F403-W507 HydrophobicContact CE1-CD2 3.77Å; F403-W507 AromaticContact CE1-CE2 3.33Å; F403-W507 HydrophobicContact CE1-CE3 4.45Å; F403-W507 HydrophobicContact CE1-CG 4.1Å; F403-W507 HydrophobicContact CE1-CH2 4.34Å; F403-W507 AromaticContact CE1-CZ2 3.66Å; F403-W507 HydrophobicContact CE1-CZ2 3.66Å; F403-W507 AromaticContact CE1-NE1 3.44Å; F403-W507 HydrophobicContact CE2-CD2 4.15Å; F403-W507 HydrophobicContact CE2-CE3 4.16Å; F403-W507 HydrophobicContact CE2-CZ3 4.42Å; F403-W507 HydrophobicContact CG-CB 4Å; F403-W507 AromaticContact CG-CD1 3.86Å; F403-W507 AromaticContact CG-CD2 3.97Å; F403-W507 HydrophobicContact CG-CD2 3.97Å; F403-W507 AromaticContact CG-CG 3.64Å; F403-W507 HydrophobicContact CG-CG 3.64Å; F403-W507 AromaticContact CZ-CD2 3.96Å; F403-W507 HydrophobicContact CZ-CD2 3.96Å; F403-W507 AromaticContact CZ-CE2 3.77Å; F403-W507 HydrophobicContact CZ-CE3 4.18Å; F403-W507 HydrophobicContact CZ-CH2 4.02Å; F403-W507 AromaticContact CZ-CZ2 3.8Å; F403-W507 HydrophobicContact CZ-CZ2 3.8Å; F403-W507 HydrophobicContact CZ-CZ3 4.23Å; L406-W507 HydrophobicContact CD1-CH2 4.32Å; L406-W507 HydrophobicContact CD2-CH2 3.97Å; L406-W507 HydrophobicContact CD2-CZ2 4.15Å; V421-W507 HydrophobicContact CG1-CZ2 4.23Å; V459-W507 HydrophobicContact CG1-CZ3 4.43Å; V459-W507 HydrophobicContact CG2-CH2 3.81Å; V459-W507 HydrophobicContact CG2-CZ3 4.35Å; I462-W507 HydrophobicContact CB-CZ3 4.4Å; I462-W507 HydrophobicContact CD1-CH2 4.1Å; I462-W507 HydrophobicContact CD1-CZ3 3.57Å; I462-W507 HydrophobicContact CG2-CE3 4.31Å; I462-W507 HydrophobicContact CG2-CZ3 4.18Å; S503-W507 VanDerWaalsContact O-CB 3.29Å; S503-W507 WeakPolarHBondContact O-CB 3.42Å; S503-W507 PolarHBondContact O-N 3.33Å; L504-W507 WeakPolarHBondContact O-CB 3.15Å; L504-W507 PolarHBondContact O-N 3.11Å; V505-W507 VanDerWaalsContact C-N 3.26Å; V505-W507 PolarHBondContact O-N 2.83Å; W507-E509 PolarHBondContact O-N 2.8Å; W507-S510 WeakPolarHBondContact O-CB 3.45Å; W507-S510 PolarHBondContact O-N 3.2Å; W507-S510 PolarHBondContact O-OG 2.91Å; W507-V511 HydrophobicContact CD2-CG2 4.26Å; W507-V511 HydrophobicContact CZ2-CG2 3.99Å; W507-V511 WeakPolarHBondContact O-CG2 3.43Å; W507-V511 PolarHBondContact O-N 3.09Å; W507-V511 VanDerWaalsContact O-N 3.07Å
508	T	93	Very high	89.2	Confident	1 Å²	1	22.4 Å²	22.4	1%	0.006	13%	0.132	C	C	.	.	H	α-helix	trans	-60.6	-36.7	176.9	57.9	0	0	0	0	111.8	V459 I462 A463 L504 V505 V511 G512 L513	V459-T508 HydrophobicContact CG1-CG2 4.09Å; I462-T508 HydrophobicContact CB-CG2 4.08Å; I462-T508 HydrophobicContact CG2-CG2 3.69Å; A463-T508 HydrophobicContact CB-CG2 3.99Å; L504-T508 WeakPolarHBondContact O-CG2 3.34Å; L504-T508 PolarHBondContact O-N 3.43Å; V505-T508 WeakPolarHBondContact CA-OG1 3.44Å; V505-T508 PolarHBondContact O-N 2.63Å; V505-T508 PolarHBondContact O-OG1 3.41Å; T508-V511 PolarHBondContact O-N 3.31Å; T508-G512 PolarHBondContact O-N 2.96Å; T508-G512 VanDerWaalsContact O-N 3.11Å; T508-L513 CarbonylContact C-O 3.59Å; T508-L513 CarbonylContact O-C 3.52Å; T508-L513 PolarHBondContact O-N 3.28Å; T508-L513 VanDerWaalsContact O-O 3.09Å; T508-L513 PolarHBondContact OG1-O 3.27Å
509	E	90.9	Very high	89.3	Confident	58 Å²	58	24.6 Å²	24.6	27%	0.271	14%	0.142	S	C	.	.	H	α-helix	trans	-61.2	-45.6	172.3	172.5	169.5	-152	0	0	111.7	Y494 V505 Q506 W507 V511 G512 L513 T514	Y494-E509 WeakPolarHBondContact CE2-OE2 3.09Å; Y494-E509 VanDerWaalsContact CZ-OE2 3.26Å; Y494-E509 VanDerWaalsContact OH-CD 3.3Å; Y494-E509 PolarHBondContact OH-OE2 3.44Å; V505-E509 PolarHBondContact O-N 3.37Å; Q506-E509 PolarHBondContact O-N 3.06Å; W507-E509 PolarHBondContact O-N 2.8Å; E509-V511 PolarHBondContact O-N 3.36Å; E509-G512 WeakPolarHBondContact O-CA 3.43Å; E509-G512 PolarHBondContact O-N 2.81Å; E509-L513 WeakPolarHBondContact CA-O 3.33Å; E509-L513 PolarHBondContact N-O 2.93Å; E509-L513 VanDerWaalsContact N-O 3.14Å; E509-T514 HydrophobicContact CB-CG2 4.42Å; E509-T514 HydrophobicContact CG-CG2 3.93Å; E509-T514 WeakPolarHBondContact OE1-CG2 3.46Å
510	S	89.5	Confident	89.2	Confident	74 Å²	74	30.2 Å²	30.2	52%	0.517	17%	0.165	S	C	.	.	H	α-helix	trans	-61.5	-29.4	177.9	75.6	0	0	0	0	113.5	Q506 W507 G512	Q506-S510 PolarHBondContact O-N 3.19Å; W507-S510 WeakPolarHBondContact O-CB 3.45Å; W507-S510 PolarHBondContact O-N 3.2Å; W507-S510 PolarHBondContact O-OG 2.91Å; S510-G512 VanDerWaalsContact C-N 3.34Å
511	V	89.7	Confident	89.3	Confident	4 Å²	4	32.4 Å²	32.4	2%	0.024	18%	0.183	C	C	.	.	H	α-helix	trans	-87	-7.7	177.9	-178.5	0	0	0	0	111.7	V421 Q422 V425 V459 W507 T508 E509	V421-V511 HydrophobicContact CB-CG1 4.25Å; V421-V511 HydrophobicContact CG1-CG1 3.66Å; Q422-V511 HydrophobicContact CB-CG1 4.42Å; V425-V511 HydrophobicContact CB-CG1 4.24Å; V425-V511 HydrophobicContact CG2-CG1 3.75Å; V459-V511 HydrophobicContact CG1-CG1 4.48Å; V459-V511 HydrophobicContact CG2-CG1 4.5Å; W507-V511 HydrophobicContact CD2-CG2 4.26Å; W507-V511 HydrophobicContact CZ2-CG2 3.99Å; W507-V511 WeakPolarHBondContact O-CG2 3.43Å; W507-V511 PolarHBondContact O-N 3.09Å; W507-V511 VanDerWaalsContact O-N 3.07Å; T508-V511 PolarHBondContact O-N 3.31Å; E509-V511 PolarHBondContact O-N 3.36Å
512	G	86.6	Confident	89.3	Confident	14 Å²	14	33.4 Å²	33.4	14%	0.144	19%	0.191	C	C	.	.	T	Hydrogen-bonded Turn	trans	110.3	5.8	170.7	0	0	0	0	0	116.1	T508 E509 S510 T527 P528	T508-G512 PolarHBondContact O-N 2.96Å; T508-G512 VanDerWaalsContact O-N 3.11Å; E509-G512 WeakPolarHBondContact O-CA 3.43Å; E509-G512 PolarHBondContact O-N 2.81Å; S510-G512 VanDerWaalsContact C-N 3.34Å; G512-T527 CarbonylContact O-C 3.54Å; G512-P528 WeakPolarHBondContact O-CD 3.2Å; G512-P528 VanDerWaalsContact O-CG 3.23Å; G512-P528 WeakPolarHBondContact O-CG 3.45Å; G512-P528 VanDerWaalsContact O-N 3.08Å
513	L	90.7	Very high	89.5	Confident	0 Å²	0	32.3 Å²	32.3	0%	0	19%	0.185	C	C	.	.			trans	-107.5	102.2	171.5	-83.4	174.2	0	0	0	110.8	V425 Y429 V459 T508 E509 T527	V425-L513 HydrophobicContact CG1-CD1 4.39Å; V425-L513 HydrophobicContact CG1-CG 4.28Å; Y429-L513 HydrophobicContact CE2-CD1 4.15Å; Y429-L513 HydrophobicContact CE2-CD2 3.79Å; Y429-L513 HydrophobicContact CE2-CG 4.13Å; V459-L513 HydrophobicContact CB-CD1 4.45Å; V459-L513 HydrophobicContact CG1-CD1 3.81Å; T508-L513 CarbonylContact C-O 3.59Å; T508-L513 CarbonylContact O-C 3.52Å; T508-L513 PolarHBondContact O-N 3.28Å; T508-L513 VanDerWaalsContact O-O 3.09Å; T508-L513 PolarHBondContact OG1-O 3.27Å; E509-L513 WeakPolarHBondContact CA-O 3.33Å; E509-L513 PolarHBondContact N-O 2.93Å; E509-L513 VanDerWaalsContact N-O 3.14Å; L513-T527 HydrophobicContact CD2-CG2 4.36Å
514	T	91.8	Very high	89.6	Confident	18 Å²	18	35.6 Å²	35.6	11%	0.11	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	130.4	-169.7	-52.1	0	0	0	0	111.7	R492 E509 V516 L525 R526	R492-T514 VanDerWaalsContact NH1-CG2 3.27Å; E509-T514 HydrophobicContact CB-CG2 4.42Å; E509-T514 HydrophobicContact CG-CG2 3.93Å; E509-T514 WeakPolarHBondContact OE1-CG2 3.46Å; T514-V516 PolarHBondContact O-N 2.81Å; T514-L525 CarbonylContact O-C 3.52Å; T514-L525 WeakPolarHBondContact O-CA 3.42Å; T514-R526 PolarHBondContact N-O 2.63Å; T514-R526 PolarHBondContact O-N 2.84Å
515	L	91.5	Very high	89.5	Confident	1 Å²	1	35.3 Å²	35.3	1%	0.005	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	113.6	176	177.6	72	0	0	0	111.2	H466 V468 P470 R492 Y494 V505 R518 M523 L525	H466-L515 WeakPolarHBondContact CE1-CD2 3.42Å; V468-L515 HydrophobicContact CB-CD2 4.49Å; V468-L515 HydrophobicContact CG1-CD2 4.34Å; V468-L515 WeakPolarHBondContact O-CD2 3.37Å; P470-L515 HydrophobicContact CG-CD2 4.4Å; P470-L515 HydrophobicContact CG-CG 4.26Å; R492-L515 PolarHBondContact NH1-O 2.79Å; Y494-L515 HydrophobicContact CD1-CD2 4.32Å; Y494-L515 HydrophobicContact CE1-CB 3.98Å; Y494-L515 HydrophobicContact CE1-CD2 4.15Å; Y494-L515 HydrophobicContact CE1-CG 4.45Å; V505-L515 HydrophobicContact CG1-CB 3.97Å; V505-L515 HydrophobicContact CG1-CD2 4.04Å; L515-R518 HydrophobicContact CD1-CB 4.44Å; L515-M523 HydrophobicContact CD1-CG 3.62Å; L515-M523 HydrophobicContact CD1-SD 4.02Å; L515-L525 HydrophobicContact CB-CD2 4.14Å; L515-L525 HydrophobicContact CD1-CD2 3.73Å
516	V	89.9	Confident	89.5	Confident	18 Å²	18	37.8 Å²	37.8	11%	0.109	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	-39.5	-176.2	-171.9	0	0	0	0	112.7	P470 Y472 R492 T514 Q524 R526	P470-V516 WeakPolarHBondContact CG-O 3.36Å; Y472-V516 WeakPolarHBondContact OH-CG1 3.46Å; Y472-V516 PolarHBondContact OH-O 3.3Å; R492-V516 VanDerWaalsContact NH1-CA 3.33Å; T514-V516 PolarHBondContact O-N 2.81Å; V516-Q524 PolarHBondContact N-O 3.25Å; V516-R526 HydrophobicContact CG2-CB 3.53Å
517	G	86.4	Confident	89.4	Confident	19 Å²	19	33.3 Å²	33.3	20%	0.196	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	139.8	-176	0	0	0	0	0	110.5	M523 Q524	G517-M523 CarbonylContact O-C 3.57Å; G517-M523 WeakPolarHBondContact O-CA 3.2Å; G517-Q524 PolarHBondContact N-O 2.93Å; G517-Q524 PolarHBondContact O-N 3.34Å
518	R	86.3	Confident	89	Confident	14 Å²	14	34.5 Å²	34.5	5%	0.053	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.3	122.6	171.6	-172.6	-169.8	176.7	106.5	-0.1	110.6	H466 N467 V468 L515 S522 M523	H466-R518 PolarHBondContact CE1-NH1 3.29Å; H466-R518 VanDerWaalsContact CE1-NH1 3.31Å; H466-R518 PolarHBondContact ND1-NH1 3.14Å; H466-R518 PolarHBondContact O-NH1 3.26Å; H466-R518 PolarHBondContact O-NH2 2.81Å; N467-R518 PolarHBondContact OD1-NH2 2.9Å; N467-R518 VanDerWaalsContact OD1-NH2 3.07Å; V468-R518 WeakPolarHBondContact O-CD 3.37Å; L515-R518 HydrophobicContact CD1-CB 4.44Å; R518-S522 WeakPolarHBondContact CA-O 3.28Å; R518-M523 HydrophobicContact CG-CG 4.39Å
519	D	81.9	Confident	88.6	Confident	83 Å²	83	37.7 Å²	37.7	44%	0.444	22%	0.216	S	C	.	.			trans	-116.4	-173.8	169.6	-64	-36.9	0	0	0	110.1	S521 S522	D519-S521 PolarHBondContact O-N 2.62Å; D519-S522 PolarHBondContact N-O 2.83Å
520	Q	79.3	Confident	88.2	Confident	146 Å²	146	37.2 Å²	37.2	68%	0.682	23%	0.226	S	C	*	.	S	Bend	trans	-66.3	-24.6	176.9	-66.6	-176.7	8.6	0	0	113
521	S	85.9	Confident	88.2	Confident	71 Å²	71	39.1 Å²	39.1	50%	0.497	23%	0.227	S	C	.	.	S	Bend	trans	-121.3	-5.6	-172.4	58.3	0	0	0	0	114.6	D519 I537	D519-S521 PolarHBondContact O-N 2.62Å; S521-I537 PolarHBondContact O-N 2.97Å
522	S	90.8	Very high	88.2	Confident	34 Å²	34	42.9 Å²	42.9	24%	0.238	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.2	153.4	-176	62.2	0	0	0	0	112.2	R518 D519 F535	R518-S522 WeakPolarHBondContact CA-O 3.28Å; D519-S522 PolarHBondContact N-O 2.83Å; S522-F535 CarbonylContact C-O 3.56Å; S522-F535 WeakPolarHBondContact CA-O 3.35Å
523	M	92.9	Very high	88.5	Confident	0 Å²	0	43 Å²	43	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	140.1	176	-162.2	179.7	-37.3	0	0	110.5	L464 L515 G517 R518 F535 I537 I552	L464-M523 HydrophobicContact CD2-CE 4.42Å; L464-M523 HydrophobicContact CD2-SD 3.86Å; L464-M523 WeakPolarHBondContact O-CE 3.24Å; L515-M523 HydrophobicContact CD1-CG 3.62Å; L515-M523 HydrophobicContact CD1-SD 4.02Å; G517-M523 CarbonylContact O-C 3.57Å; G517-M523 WeakPolarHBondContact O-CA 3.2Å; R518-M523 HydrophobicContact CG-CG 4.39Å; M523-F535 HydrophobicContact CB-CB 4.31Å; M523-F535 PolarHBondContact N-O 2.86Å; M523-F535 PolarHBondContact O-N 2.79Å; M523-I537 HydrophobicContact CB-CD1 4.33Å; M523-I537 HydrophobicContact CB-CG1 4.42Å; M523-I537 HydrophobicContact CE-CD1 3.97Å; M523-I537 HydrophobicContact CE-CG1 4.25Å; M523-I552 HydrophobicContact CE-CD1 3.97Å
524	Q	92.9	Very high	88.6	Confident	73 Å²	73	46 Å²	46	34%	0.341	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	121.4	-177.7	-63.1	-178.9	-8.6	0	0	110.3	V516 G517 I532 L533	V516-Q524 PolarHBondContact N-O 3.25Å; G517-Q524 PolarHBondContact N-O 2.93Å; G517-Q524 PolarHBondContact O-N 3.34Å; Q524-I532 HydrophobicContact CB-CG2 4.15Å; Q524-L533 WeakPolarHBondContact CA-O 3.31Å
525	L	92.5	Very high	88.8	Confident	1 Å²	1	45.2 Å²	45.2	1%	0.005	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	132	178	-61.2	-178.2	0	0	0	110.3	A463 L464 T514 L515 I532 L533 F535	A463-L525 HydrophobicContact CB-CD1 3.94Å; A463-L525 HydrophobicContact CB-CD2 4.44Å; L464-L525 HydrophobicContact CD2-CD1 3.73Å; L464-L525 HydrophobicContact CD2-CG 4.45Å; L464-L525 HydrophobicContact CG-CD1 4.11Å; T514-L525 CarbonylContact O-C 3.52Å; T514-L525 WeakPolarHBondContact O-CA 3.42Å; L515-L525 HydrophobicContact CB-CD2 4.14Å; L515-L525 HydrophobicContact CD1-CD2 3.73Å; L525-I532 CarbonylContact O-C 3.59Å; L525-I532 WeakPolarHBondContact O-CA 3.35Å; L525-L533 PolarHBondContact N-O 3.24Å; L525-L533 PolarHBondContact O-N 2.62Å; L525-F535 HydrophobicContact CB-CE2 4.29Å; L525-F535 HydrophobicContact CD1-CD2 4.45Å; L525-F535 HydrophobicContact CD1-CE2 3.84Å; L525-F535 HydrophobicContact CG-CD2 4.39Å; L525-F535 HydrophobicContact CG-CE2 4.07Å
526	R	91.5	Very high	89	Confident	51 Å²	51	47.2 Å²	47.2	19%	0.192	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	128.3	170.7	-174.9	-174.4	-62.2	153.6	-1.2	109.3	D489 T514 V516	D489-R526 IonicContact OD1-CZ 3.12Å; D489-R526 IonicContact OD1-NH1 3.26Å; D489-R526 PolarHBondContact OD1-NH1 2.98Å; D489-R526 IonicContact OD1-NH2 3.66Å; D489-R526 IonicContact OD2-NH1 2.65Å; D489-R526 PolarHBondContact OD2-NH1 3.47Å; T514-R526 PolarHBondContact N-O 2.63Å; T514-R526 PolarHBondContact O-N 2.84Å; V516-R526 HydrophobicContact CG2-CB 3.53Å
527	T	90.1	Very high	89.2	Confident	4 Å²	4	46.9 Å²	46.9	3%	0.025	26%	0.264	C	S	.	.			trans	-80.2	165	177.1	58.3	0	0	0	0	111.7	Y429 G512 L513 T529 G530 Q531 L533	Y429-T527 HydrophobicContact CD1-CG2 3.72Å; Y429-T527 HydrophobicContact CE1-CG2 3.56Å; Y429-T527 HydrophobicContact CE2-CG2 4.45Å; Y429-T527 HydrophobicContact CG-CG2 4.24Å; G512-T527 CarbonylContact O-C 3.54Å; L513-T527 HydrophobicContact CD2-CG2 4.36Å; T527-T529 PolarHBondContact O-N 3.14Å; T527-T529 VanDerWaalsContact O-N 3.1Å; T527-T529 PolarHBondContact OG1-OG1 3.05Å; T527-T529 VanDerWaalsContact OG1-OG1 3.04Å; T527-G530 PolarHBondContact O-N 2.89Å; T527-Q531 PolarHBondContact N-O 3.36Å; T527-Q531 WeakPolarHBondContact OG1-CA 3.41Å; T527-Q531 WeakPolarHBondContact OG1-CB 3.23Å; T527-Q531 PolarHBondContact OG1-N 2.92Å; T527-Q531 PolarHBondContact OG1-O 3.16Å; T527-L533 HydrophobicContact CG2-CD1 3.61Å; T527-L533 HydrophobicContact CG2-CD2 4.41Å; T527-L533 HydrophobicContact CG2-CG 3.76Å
528	P	85.8	Confident	89.5	Confident	41 Å²	41	47.6 Å²	47.6	27%	0.266	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.1	-21.6	176.6	-18.8	28	0	0	0	113.6	V425 F426 Y429 G512 G530	V425-P528 HydrophobicContact CG1-CG 4.07Å; F426-P528 HydrophobicContact CD2-CB 3.66Å; F426-P528 HydrophobicContact CE2-CB 4.24Å; Y429-P528 HydrophobicContact CD2-CG 4.29Å; G512-P528 WeakPolarHBondContact O-CD 3.2Å; G512-P528 VanDerWaalsContact O-CG 3.23Å; G512-P528 WeakPolarHBondContact O-CG 3.45Å; G512-P528 VanDerWaalsContact O-N 3.08Å; P528-G530 VanDerWaalsContact C-N 3.32Å
529	T	84.3	Confident	89.8	Confident	68 Å²	68	48.4 Å²	48.4	42%	0.417	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.9	-1.1	178	56	0	0	0	0	112.9	T430 T527	T430-T529 HydrophobicContact CG2-CG2 3.62Å; T527-T529 PolarHBondContact O-N 3.14Å; T527-T529 VanDerWaalsContact O-N 3.1Å; T527-T529 PolarHBondContact OG1-OG1 3.05Å; T527-T529 VanDerWaalsContact OG1-OG1 3.04Å
530	G	82.3	Confident	90.1	Very high	47 Å²	47	46.6 Å²	46.6	49%	0.485	26%	0.258	S	S	.	.	S	Bend	trans	88.1	-3.7	-180	0	0	0	0	0	114.9	T527 P528	T527-G530 PolarHBondContact O-N 2.89Å; P528-G530 VanDerWaalsContact C-N 3.32Å
531	Q	88.7	Confident	90.6	Very high	115 Å²	115	40.2 Å²	40.2	54%	0.537	23%	0.228	S	C	.	.	P	Polyproline II helix	trans	-72.4	137.4	176.2	-174.5	-179.7	9.4	0	0	111	T527	T527-Q531 PolarHBondContact N-O 3.36Å; T527-Q531 WeakPolarHBondContact OG1-CA 3.41Å; T527-Q531 WeakPolarHBondContact OG1-CB 3.23Å; T527-Q531 PolarHBondContact OG1-N 2.92Å; T527-Q531 PolarHBondContact OG1-O 3.16Å
532	I	90.6	Very high	90.6	Very high	82 Å²	82	40.6 Å²	40.6	42%	0.421	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	125	174.9	-57.6	175.2	0	0	0	109.2	Q524 L525	Q524-I532 HydrophobicContact CB-CG2 4.15Å; L525-I532 CarbonylContact O-C 3.59Å; L525-I532 WeakPolarHBondContact O-CA 3.35Å
533	L	91.7	Very high	90.3	Very high	18 Å²	18	44 Å²	44	9%	0.094	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	126.5	172.4	-59.3	175.5	0	0	0	109	Y429 Q524 L525 T527 F535	Y429-L533 HydrophobicContact CE1-CD1 3.93Å; Q524-L533 WeakPolarHBondContact CA-O 3.31Å; L525-L533 PolarHBondContact N-O 3.24Å; L525-L533 PolarHBondContact O-N 2.62Å; T527-L533 HydrophobicContact CG2-CD1 3.61Å; T527-L533 HydrophobicContact CG2-CD2 4.41Å; T527-L533 HydrophobicContact CG2-CG 3.76Å; L533-F535 HydrophobicContact CB-CD2 4.47Å; L533-F535 HydrophobicContact CB-CE2 3.58Å; L533-F535 HydrophobicContact CB-CZ 4.04Å; L533-F535 HydrophobicContact CD1-CE2 4.45Å; L533-F535 HydrophobicContact CD1-CZ 4.34Å
534	N	94.3	Very high	89.5	Confident	61 Å²	61	46.9 Å²	46.9	33%	0.326	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	133.9	177.7	-66.5	-16.7	0	0	0	110.7	E557	N534-E557 HydrophobicContact CB-CB 4.25Å; N534-E557 HydrophobicContact CB-CG 4.18Å; N534-E557 WeakPolarHBondContact CB-OE2 3.28Å; N534-E557 PolarHBondContact ND2-OE2 3.22Å; N534-E557 WeakPolarHBondContact O-CB 3.42Å; N534-E557 PolarHBondContact O-N 3.21Å; N534-E557 VanDerWaalsContact O-N 3.09Å
535	F	95.1	Very high	88.2	Confident	3 Å²	3	48.8 Å²	48.8	1%	0.013	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	131.6	176.2	-60.7	-88.7	0	0	0	109.5	L464 S522 M523 L525 L533 R555 D556	L464-F535 HydrophobicContact CD1-CD1 4.44Å; L464-F535 HydrophobicContact CD1-CE1 4.14Å; L464-F535 HydrophobicContact CD1-CZ 4.39Å; L464-F535 HydrophobicContact CD2-CB 4.48Å; L464-F535 HydrophobicContact CD2-CD1 4.12Å; L464-F535 HydrophobicContact CD2-CD2 3.78Å; L464-F535 HydrophobicContact CD2-CE1 4.32Å; L464-F535 HydrophobicContact CD2-CE2 3.99Å; L464-F535 HydrophobicContact CD2-CG 3.85Å; L464-F535 HydrophobicContact CD2-CZ 4.27Å; S522-F535 CarbonylContact C-O 3.56Å; S522-F535 WeakPolarHBondContact CA-O 3.35Å; M523-F535 HydrophobicContact CB-CB 4.31Å; M523-F535 PolarHBondContact N-O 2.86Å; M523-F535 PolarHBondContact O-N 2.79Å; L525-F535 HydrophobicContact CB-CE2 4.29Å; L525-F535 HydrophobicContact CD1-CD2 4.45Å; L525-F535 HydrophobicContact CD1-CE2 3.84Å; L525-F535 HydrophobicContact CG-CD2 4.39Å; L525-F535 HydrophobicContact CG-CE2 4.07Å; L533-F535 HydrophobicContact CB-CD2 4.47Å; L533-F535 HydrophobicContact CB-CE2 3.58Å; L533-F535 HydrophobicContact CB-CZ 4.04Å; L533-F535 HydrophobicContact CD1-CE2 4.45Å; L533-F535 HydrophobicContact CD1-CZ 4.34Å; F535-R555 CarbonylContact C-O 3.45Å; F535-R555 WeakPolarHBondContact CA-O 3.25Å; F535-D556 HydrophobicContact CD1-CB 3.97Å; F535-D556 HydrophobicContact CE1-CB 3.77Å; F535-D556 WeakPolarHBondContact CE1-OD2 3.29Å
536	T	95.4	Very high	87.2	Confident	43 Å²	43	57.1 Å²	57.1	26%	0.264	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	125.5	169	-41.5	0	0	0	0	108.9	L538 V554 R555 E557	T536-L538 PolarHBondContact O-N 2.82Å; T536-V554 WeakPolarHBondContact O-CA 3.28Å; T536-R555 PolarHBondContact N-O 3.08Å; T536-R555 PolarHBondContact O-N 3.01Å; T536-E557 PolarHBondContact OG1-OE1 2.86Å
537	I	94.2	Very high	86.6	Confident	10 Å²	10	55.9 Å²	55.9	5%	0.051	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	113.7	174.5	-55.3	172.2	0	0	0	107.8	S521 M523 I540 I552	S521-I537 PolarHBondContact O-N 2.97Å; M523-I537 HydrophobicContact CB-CD1 4.33Å; M523-I537 HydrophobicContact CB-CG1 4.42Å; M523-I537 HydrophobicContact CE-CD1 3.97Å; M523-I537 HydrophobicContact CE-CG1 4.25Å; I537-I540 HydrophobicContact CG2-CD1 3.91Å; I537-I540 HydrophobicContact CG2-CG1 3.5Å; I537-I540 VanDerWaalsContact CG2-CG1 3.5Å; I537-I552 HydrophobicContact CD1-CD1 4.35Å; I537-I552 HydrophobicContact CG1-CD1 4.28Å; I537-I552 HydrophobicContact CG2-CD1 3.93Å; I537-I552 HydrophobicContact CG2-CG1 4Å
538	L	93.3	Very high	86.4	Confident	34 Å²	34	58.4 Å²	58.4	18%	0.178	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	-49.2	-178.3	-69.1	179.6	0	0	0	111.2	T536 I553 R555 I562 Y610	T536-L538 PolarHBondContact O-N 2.82Å; L538-I553 HydrophobicContact CB-CB 4.22Å; L538-I553 HydrophobicContact CB-CG2 3.96Å; L538-I553 HydrophobicContact CD1-CG2 3.97Å; L538-I553 PolarHBondContact N-O 2.91Å; L538-R555 HydrophobicContact CD1-CB 4.06Å; L538-R555 HydrophobicContact CG-CB 4.33Å; L538-I562 HydrophobicContact CD1-CD1 4.04Å; L538-I562 HydrophobicContact CD1-CG1 4.25Å; L538-I562 HydrophobicContact CD1-CG2 4.04Å; L538-Y610 HydrophobicContact CB-CE2 3.88Å; L538-Y610 WeakPolarHBondContact CB-OH 2.99Å; L538-Y610 HydrophobicContact CD1-CD1 4.24Å; L538-Y610 HydrophobicContact CD1-CD2 4.22Å; L538-Y610 HydrophobicContact CD1-CE1 3.89Å; L538-Y610 HydrophobicContact CD1-CE2 3.86Å; L538-Y610 HydrophobicContact CD1-CG 4.4Å; L538-Y610 HydrophobicContact CD2-CE1 4.37Å; L538-Y610 HydrophobicContact CG-CE2 4.42Å
539	Q	91.6	Very high	86.7	Confident	32 Å²	32	58.4 Å²	58.4	15%	0.15	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.4	147.4	176.1	-71.2	-62.9	-11.3	0	0	111.4	F541 I553 E614 Y617	Q539-F541 HydrophobicContact CB-CE2 4.37Å; Q539-F541 HydrophobicContact CB-CZ 4.05Å; Q539-I553 HydrophobicContact CB-CB 4.42Å; Q539-I553 HydrophobicContact CB-CD1 4.19Å; Q539-I553 HydrophobicContact CB-CG1 4.44Å; Q539-I553 PolarHBondContact N-O 2.9Å; Q539-I553 PolarHBondContact O-N 2.89Å; Q539-E614 WeakPolarHBondContact CG-OE2 3.42Å; Q539-E614 VanDerWaalsContact NE2-CD 3.3Å; Q539-E614 PolarHBondContact NE2-OE1 3.21Å; Q539-E614 PolarHBondContact NE2-OE2 2.87Å; Q539-Y617 HydrophobicContact CG-CE1 4.48Å
540	I	89.3	Confident	87.1	Confident	45 Å²	45	55.3 Å²	55.3	23%	0.231	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	130.1	173.5	-56.2	175.9	0	0	0	108.7	I537 P542 M550 I552	I537-I540 HydrophobicContact CG2-CD1 3.91Å; I537-I540 HydrophobicContact CG2-CG1 3.5Å; I537-I540 VanDerWaalsContact CG2-CG1 3.5Å; I540-P542 WeakPolarHBondContact O-CD 3.39Å; I540-M550 HydrophobicContact CG2-CE 4.33Å; I540-I552 HydrophobicContact CG1-CD1 4.28Å; I540-I552 HydrophobicContact CG1-CG1 4.18Å
541	F	90.5	Very high	87.6	Confident	12 Å²	12	53.1 Å²	53.1	5%	0.053	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	95.2	169.8	-50.7	-72.8	0	0	0	107.7	Q539 M550 G551 I553 F564 F613 Y617 I635 L638	Q539-F541 HydrophobicContact CB-CE2 4.37Å; Q539-F541 HydrophobicContact CB-CZ 4.05Å; F541-M550 WeakPolarHBondContact O-CG 3.31Å; F541-G551 PolarHBondContact N-O 3.45Å; F541-G551 PolarHBondContact O-N 3.41Å; F541-I553 HydrophobicContact CE2-CD1 3.94Å; F541-I553 HydrophobicContact CE2-CG1 3.97Å; F541-I553 HydrophobicContact CZ-CD1 4.12Å; F541-F564 AromaticContact CD2-CE2 3.78Å; F541-F564 HydrophobicContact CD2-CE2 3.78Å; F541-F564 HydrophobicContact CD2-CZ 4.4Å; F541-F564 HydrophobicContact CE2-CD2 4.43Å; F541-F564 AromaticContact CE2-CE2 3.81Å; F541-F564 HydrophobicContact CE2-CE2 3.81Å; F541-F613 HydrophobicContact CE1-CZ 4Å; F541-F613 AromaticContact CZ-CE1 3.82Å; F541-F613 HydrophobicContact CZ-CE1 3.82Å; F541-F613 AromaticContact CZ-CZ 3.52Å; F541-F613 HydrophobicContact CZ-CZ 3.52Å; F541-Y617 HydrophobicContact CE1-CE1 4.5Å; F541-Y617 HydrophobicContact CE1-CE2 4.05Å; F541-Y617 AromaticContact CE1-CZ 3.91Å; F541-I635 HydrophobicContact CD1-CD1 3.82Å; F541-I635 HydrophobicContact CD1-CG1 3.94Å; F541-I635 HydrophobicContact CD1-CG2 4.48Å; F541-I635 HydrophobicContact CE1-CD1 4.17Å; F541-I635 HydrophobicContact CE1-CG1 3.85Å; F541-L638 HydrophobicContact CE2-CD2 4.12Å
542	P	84.9	Confident	87.9	Confident	78 Å²	78	47.7 Å²	47.7	51%	0.506	24%	0.238	S	C	.	.			trans	-63.7	152.8	-174.5	27.1	-34.5	0	0	0	110.9	I540 T544	I540-P542 WeakPolarHBondContact O-CD 3.39Å; P542-T544 PolarHBondContact O-N 3.41Å
543	F	84.3	Confident	88.2	Confident	106 Å²	106	43.8 Å²	43.8	47%	0.465	22%	0.218	S	C	.	.			trans	-59.7	129.9	173.1	178.8	-92.8	0	0	0	110.7	R549 M550	F543-R549 WeakPolarHBondContact CA-O 3.34Å; F543-M550 HydrophobicContact CB-CB 4.25Å
544	T	76	Confident	88.3	Confident	61 Å²	61	43 Å²	43	37%	0.374	21%	0.214	S	C	.	.			trans	-121.9	152.3	166.9	72.6	0	0	0	0	110.2	P542 E546 S547 K548	P542-T544 PolarHBondContact O-N 3.41Å; T544-E546 PolarHBondContact O-N 2.91Å; T544-S547 PolarHBondContact N-OG 2.93Å; T544-S547 PolarHBondContact O-N 3.11Å; T544-S547 PolarHBondContact O-OG 3Å; T544-S547 WeakPolarHBondContact OG1-CB 3.38Å; T544-S547 PolarHBondContact OG1-N 3.34Å; T544-S547 VanDerWaalsContact OG1-N 3.12Å; T544-S547 PolarHBondContact OG1-OG 3.08Å; T544-K548 PolarHBondContact O-N 3.4Å
545	Y	65.3	Low	88.4	Confident	112 Å²	112	43.7 Å²	43.7	44%	0.439	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.2	-34.9	177.2	167	-92	0	0	0	112.1	K548 K679 R758	Y545-K548 WeakPolarHBondContact O-CG 3.29Å; Y545-K679 HydrophobicContact CD2-CD 4.49Å; Y545-K679 HydrophobicContact CE2-CD 4.16Å; Y545-R758 VanDerWaalsContact CZ-NH2 3.34Å; Y545-R758 PolarHBondContact OH-NH1 2.9Å; Y545-R758 PolarHBondContact OH-NH2 3.25Å
546	E	71.3	Confident	88.3	Confident	177 Å²	177	44 Å²	44	83%	0.827	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	-72.5	-43	-179.8	-65.1	167.8	-177.8	0	0	111.6	T544	T544-E546 PolarHBondContact O-N 2.91Å
547	S	80.4	Confident	88.1	Confident	24 Å²	24	47.1 Å²	47.1	17%	0.168	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.1	-28.2	-179	75	0	0	0	0	113.5	T544 R549	T544-S547 PolarHBondContact N-OG 2.93Å; T544-S547 PolarHBondContact O-N 3.11Å; T544-S547 PolarHBondContact O-OG 3Å; T544-S547 WeakPolarHBondContact OG1-CB 3.38Å; T544-S547 PolarHBondContact OG1-N 3.34Å; T544-S547 VanDerWaalsContact OG1-N 3.12Å; T544-S547 PolarHBondContact OG1-OG 3.08Å; S547-R549 WeakPolarHBondContact O-CG 3.31Å; S547-R549 PolarHBondContact O-N 3.38Å; S547-R549 VanDerWaalsContact O-N 3.11Å; S547-R549 PolarHBondContact O-NH1 2.85Å; S547-R549 PolarHBondContact OG-N 3.41Å; S547-R549 PolarHBondContact OG-O 3.36Å; S547-R549 VanDerWaalsContact OG-O 3.12Å
548	K	86	Confident	87.8	Confident	58 Å²	58	50.8 Å²	50.8	25%	0.252	25%	0.252	S	S	.	.			trans	51	26.5	-173.8	-54.5	-176.2	-179.1	-176.4	0	114.4	T544 Y545 G568 A569 V572 E681	T544-K548 PolarHBondContact O-N 3.4Å; Y545-K548 WeakPolarHBondContact O-CG 3.29Å; K548-G568 WeakPolarHBondContact O-CA 3.49Å; K548-A569 HydrophobicContact CB-CB 4.29Å; K548-A569 PolarHBondContact O-N 3.25Å; K548-A569 VanDerWaalsContact O-N 3.15Å; K548-V572 HydrophobicContact CB-CG2 4.08Å; K548-V572 HydrophobicContact CD-CG2 4.18Å; K548-E681 IonicContact NZ-OE1 3.88Å
549	R	90.8	Very high	87.4	Confident	41 Å²	41	53.6 Å²	53.6	16%	0.155	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.9	156.9	-178.3	66.7	-167.6	175.3	-97.7	11.8	111.1	F543 S547 M566 K567 M573 E639	F543-R549 WeakPolarHBondContact CA-O 3.34Å; S547-R549 WeakPolarHBondContact O-CG 3.31Å; S547-R549 PolarHBondContact O-N 3.38Å; S547-R549 VanDerWaalsContact O-N 3.11Å; S547-R549 PolarHBondContact O-NH1 2.85Å; S547-R549 PolarHBondContact OG-N 3.41Å; S547-R549 PolarHBondContact OG-O 3.36Å; S547-R549 VanDerWaalsContact OG-O 3.12Å; R549-M566 HydrophobicContact CB-SD 4.38Å; R549-M566 HydrophobicContact CG-SD 4.4Å; R549-K567 CarbonylContact C-O 3.59Å; R549-K567 WeakPolarHBondContact CA-O 3.3Å; R549-M573 HydrophobicContact CB-SD 4.44Å; R549-E639 IonicContact CZ-OE1 2.99Å; R549-E639 IonicContact CZ-OE2 2.69Å; R549-E639 VanDerWaalsContact CZ-OE2 3.26Å; R549-E639 VanDerWaalsContact NE-CD 3.25Å; R549-E639 IonicContact NE-OE1 3.15Å; R549-E639 PolarHBondContact NE-OE1 3.26Å; R549-E639 IonicContact NE-OE2 3.44Å; R549-E639 PolarHBondContact NE-OE2 3.08Å; R549-E639 VanDerWaalsContact NE-OE2 3.12Å; R549-E639 IonicContact NH2-OE1 3.87Å; R549-E639 IonicContact NH2-OE2 2.74Å; R549-E639 PolarHBondContact NH2-OE2 3.08Å
550	M	92.4	Very high	87.3	Confident	2 Å²	2	54.3 Å²	54.3	1%	0.01	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	137.1	174.8	178.9	-166	175.1	0	0	108.9	V465 H466 N467 E501 I540 F541 F543 M566 K567	V465-M550 HydrophobicContact CG1-SD 4.26Å; H466-M550 VanDerWaalsContact O-CE 3.3Å; H466-M550 WeakPolarHBondContact O-CE 3.26Å; N467-M550 HydrophobicContact CB-CE 4.41Å; N467-M550 WeakPolarHBondContact OD1-CE 3.26Å; E501-M550 VanDerWaalsContact OE1-SD 3.42Å; I540-M550 HydrophobicContact CG2-CE 4.33Å; F541-M550 WeakPolarHBondContact O-CG 3.31Å; F543-M550 HydrophobicContact CB-CB 4.25Å; M550-M566 VanDerWaalsContact O-CA 3.32Å; M550-M566 WeakPolarHBondContact O-CA 3.4Å; M550-M566 WeakPolarHBondContact O-CG 3.19Å; M550-K567 HydrophobicContact CB-CG 4.28Å; M550-K567 PolarHBondContact N-O 3.36Å; M550-K567 PolarHBondContact O-N 3.08Å
551	G	93.8	Very high	87.4	Confident	2 Å²	2	56.3 Å²	56.3	2%	0.021	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	153.4	174.8	0	0	0	0	0	112.6	F541 Y565	F541-G551 PolarHBondContact N-O 3.45Å; F541-G551 PolarHBondContact O-N 3.41Å; G551-Y565 CarbonylContact C-O 3.58Å; G551-Y565 VanDerWaalsContact CA-O 3.29Å; G551-Y565 WeakPolarHBondContact CA-O 3.3Å
552	I	95	Very high	87.6	Confident	0 Å²	0	55.9 Å²	55.9	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	135.6	173.2	-166.8	172.3	0	0	0	110	V465 M523 I537 I540 V554 F564 Y565	V465-I552 HydrophobicContact CB-CG2 4.34Å; V465-I552 HydrophobicContact CG1-CG2 4.42Å; V465-I552 HydrophobicContact CG2-CG2 3.93Å; M523-I552 HydrophobicContact CE-CD1 3.97Å; I537-I552 HydrophobicContact CD1-CD1 4.35Å; I537-I552 HydrophobicContact CG1-CD1 4.28Å; I537-I552 HydrophobicContact CG2-CD1 3.93Å; I537-I552 HydrophobicContact CG2-CG1 4Å; I540-I552 HydrophobicContact CG1-CD1 4.28Å; I540-I552 HydrophobicContact CG1-CG1 4.18Å; I552-V554 HydrophobicContact CD1-CG1 3.9Å; I552-V554 HydrophobicContact CG1-CG1 3.86Å; I552-V554 HydrophobicContact CG2-CG1 4.32Å; I552-F564 WeakPolarHBondContact O-CD2 3.43Å; I552-Y565 PolarHBondContact N-O 3.31Å; I552-Y565 PolarHBondContact O-N 3.32Å
553	I	95.9	Very high	88.1	Confident	0 Å²	0	52.6 Å²	52.6	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	120.9	170.8	-56.1	176.9	0	0	0	107.3	L538 Q539 F541 I562 F564 L605 Y610 F613 L638	L538-I553 HydrophobicContact CB-CB 4.22Å; L538-I553 HydrophobicContact CB-CG2 3.96Å; L538-I553 HydrophobicContact CD1-CG2 3.97Å; L538-I553 PolarHBondContact N-O 2.91Å; Q539-I553 HydrophobicContact CB-CB 4.42Å; Q539-I553 HydrophobicContact CB-CD1 4.19Å; Q539-I553 HydrophobicContact CB-CG1 4.44Å; Q539-I553 PolarHBondContact N-O 2.9Å; Q539-I553 PolarHBondContact O-N 2.89Å; F541-I553 HydrophobicContact CE2-CD1 3.94Å; F541-I553 HydrophobicContact CE2-CG1 3.97Å; F541-I553 HydrophobicContact CZ-CD1 4.12Å; I553-I562 HydrophobicContact CG2-CG2 3.68Å; I553-F564 HydrophobicContact CG1-CB 4.31Å; I553-F564 HydrophobicContact CG1-CD2 3.6Å; I553-F564 HydrophobicContact CG1-CE2 4.35Å; I553-F564 HydrophobicContact CG1-CG 4.33Å; I553-L605 HydrophobicContact CG2-CD1 4.48Å; I553-Y610 HydrophobicContact CD1-CD2 4.36Å; I553-Y610 HydrophobicContact CD1-CE2 4.33Å; I553-Y610 HydrophobicContact CG2-CD2 4.12Å; I553-Y610 HydrophobicContact CG2-CE2 4.16Å; I553-F613 HydrophobicContact CD1-CD1 4.21Å; I553-F613 HydrophobicContact CD1-CE1 3.95Å; I553-L638 HydrophobicContact CD1-CD1 4.37Å; I553-L638 HydrophobicContact CD1-CD2 4.27Å
554	V	95.4	Very high	88.7	Confident	3 Å²	3	47.5 Å²	47.5	2%	0.018	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	144	179.9	-63.2	0	0	0	0	110.5	L464 T536 I552 I562 T563 Y565	L464-V554 HydrophobicContact CD1-CG2 4.32Å; T536-V554 WeakPolarHBondContact O-CA 3.28Å; I552-V554 HydrophobicContact CD1-CG1 3.9Å; I552-V554 HydrophobicContact CG1-CG1 3.86Å; I552-V554 HydrophobicContact CG2-CG1 4.32Å; V554-I562 WeakPolarHBondContact O-CA 3.46Å; V554-T563 PolarHBondContact N-O 3.28Å; V554-T563 PolarHBondContact O-N 3.17Å; V554-Y565 HydrophobicContact CG2-CD2 3.76Å; V554-Y565 HydrophobicContact CG2-CE2 3.63Å
555	R	95.3	Very high	89.6	Confident	74 Å²	74	45.2 Å²	45.2	28%	0.279	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	123.5	168.5	-177.4	-177.2	-75.9	166.9	-6.1	108.6	F535 T536 L538 E561 I562 E607	F535-R555 CarbonylContact C-O 3.45Å; F535-R555 WeakPolarHBondContact CA-O 3.25Å; T536-R555 PolarHBondContact N-O 3.08Å; T536-R555 PolarHBondContact O-N 3.01Å; L538-R555 HydrophobicContact CD1-CB 4.06Å; L538-R555 HydrophobicContact CG-CB 4.33Å; R555-E561 WeakPolarHBondContact CA-O 3.32Å; R555-I562 HydrophobicContact CB-CG1 4.24Å; R555-I562 HydrophobicContact CG-CG1 4.16Å; R555-E607 IonicContact CZ-OE2 2.89Å; R555-E607 IonicContact NH2-OE1 3.25Å; R555-E607 PolarHBondContact NH2-OE1 3.16Å; R555-E607 IonicContact NH2-OE2 3.78Å; R555-E607 PolarHBondContact NH2-OE2 2.79Å
556	D	93.5	Very high	91.1	Very high	9 Å²	9	39.9 Å²	39.9	5%	0.048	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	119.7	173	-171.1	-33.2	0	0	0	108.9	K460 F535 S558 T559 G560 E561	K460-D556 IonicContact NZ-OD2 3.71Å; K460-D556 PolarHBondContact NZ-OD2 3.15Å; F535-D556 HydrophobicContact CD1-CB 3.97Å; F535-D556 HydrophobicContact CE1-CB 3.77Å; F535-D556 WeakPolarHBondContact CE1-OD2 3.29Å; D556-S558 PolarHBondContact O-N 3.46Å; D556-S558 WeakPolarHBondContact OD1-CB 3.39Å; D556-S558 PolarHBondContact OD1-N 2.94Å; D556-S558 PolarHBondContact OD1-OG 3.29Å; D556-T559 WeakPolarHBondContact CB-OG1 3.12Å; D556-G560 VanDerWaalsContact O-CA 3.23Å; D556-G560 WeakPolarHBondContact O-CA 3.14Å; D556-G560 PolarHBondContact O-N 3.39Å; D556-E561 PolarHBondContact N-O 3.36Å
557	E	91	Very high	92.2	Very high	110 Å²	110	32.2 Å²	32.2	51%	0.514	18%	0.177	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.8	-21.7	-176.6	-68	-173.3	177	0	0	112.6	N534 T536	N534-E557 HydrophobicContact CB-CB 4.25Å; N534-E557 HydrophobicContact CB-CG 4.18Å; N534-E557 WeakPolarHBondContact CB-OE2 3.28Å; N534-E557 PolarHBondContact ND2-OE2 3.22Å; N534-E557 WeakPolarHBondContact O-CB 3.42Å; N534-E557 PolarHBondContact O-N 3.21Å; N534-E557 VanDerWaalsContact O-N 3.09Å; T536-E557 PolarHBondContact OG1-OE1 2.86Å
558	S	86.9	Confident	92.7	Very high	87 Å²	87	31.1 Å²	31.1	61%	0.608	17%	0.17	S	C	*	.	T	Hydrogen-bonded Turn	trans	-82.3	-37.3	-178.2	69.5	0	0	0	0	112.9	D556	D556-S558 PolarHBondContact O-N 3.46Å; D556-S558 WeakPolarHBondContact OD1-CB 3.39Å; D556-S558 PolarHBondContact OD1-N 2.94Å; D556-S558 PolarHBondContact OD1-OG 3.29Å
559	T	86.8	Confident	92.9	Very high	92 Å²	92	29.5 Å²	29.5	56%	0.564	17%	0.167	S	C	*	.	T	Hydrogen-bonded Turn	trans	-104.8	-19.3	-177.3	60.2	0	0	0	0	113.2	D556 E561	D556-T559 WeakPolarHBondContact CB-OG1 3.12Å; T559-E561 PolarHBondContact O-N 3.18Å; T559-E561 PolarHBondContact OG1-N 3.36Å
560	G	87.7	Confident	92.6	Very high	47 Å²	47	30.2 Å²	30.2	49%	0.485	17%	0.174	S	C	.	.			trans	73.8	3.4	-172.3	0	0	0	0	0	114.2	D556	D556-G560 VanDerWaalsContact O-CA 3.23Å; D556-G560 WeakPolarHBondContact O-CA 3.14Å; D556-G560 PolarHBondContact O-N 3.39Å
561	E	91.6	Very high	92.2	Very high	88 Å²	88	35.7 Å²	35.7	41%	0.411	21%	0.208	S	C	.	.			trans	-72.7	134.8	-177.9	-168.6	-177.9	172.2	0	0	111.2	R555 D556 T559 S604	R555-E561 WeakPolarHBondContact CA-O 3.32Å; D556-E561 PolarHBondContact N-O 3.36Å; T559-E561 PolarHBondContact O-N 3.18Å; T559-E561 PolarHBondContact OG1-N 3.36Å; E561-S604 PolarHBondContact OE1-OG 2.86Å
562	I	95.4	Very high	92	Very high	3 Å²	3	37.4 Å²	37.4	2%	0.015	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	119.9	170.8	-59.5	178.3	0	0	0	108.4	L538 I553 V554 R555 L605 E607 Y610	L538-I562 HydrophobicContact CD1-CD1 4.04Å; L538-I562 HydrophobicContact CD1-CG1 4.25Å; L538-I562 HydrophobicContact CD1-CG2 4.04Å; I553-I562 HydrophobicContact CG2-CG2 3.68Å; V554-I562 WeakPolarHBondContact O-CA 3.46Å; R555-I562 HydrophobicContact CB-CG1 4.24Å; R555-I562 HydrophobicContact CG-CG1 4.16Å; I562-L605 HydrophobicContact CB-CB 4.43Å; I562-L605 HydrophobicContact CG2-CB 4.07Å; I562-L605 HydrophobicContact CG2-CD1 4.34Å; I562-L605 PolarHBondContact O-N 3.23Å; I562-E607 WeakPolarHBondContact CD1-OE2 3.48Å; I562-Y610 HydrophobicContact CD1-CD1 4.17Å; I562-Y610 HydrophobicContact CD1-CG 4.19Å
563	T	95.5	Very high	91.8	Very high	8 Å²	8	37.4 Å²	37.4	5%	0.049	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124	130.7	177.7	-42.2	0	0	0	0	109.6	V554 Y565 K602	V554-T563 PolarHBondContact N-O 3.28Å; V554-T563 PolarHBondContact O-N 3.17Å; T563-Y565 HydrophobicContact CG2-CD1 4.26Å; T563-Y565 HydrophobicContact CG2-CD2 4.09Å; T563-Y565 HydrophobicContact CG2-CE1 3.89Å; T563-Y565 HydrophobicContact CG2-CE2 3.69Å; T563-Y565 HydrophobicContact CG2-CG 4.34Å; T563-K602 HydrophobicContact CG2-CB 4.11Å
564	F	96.1	Very high	91.4	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	121.2	165.4	176	-126.1	0	0	0	109.2	F541 I552 I553 M566 K602 K603 L605 L638 M642	F541-F564 AromaticContact CD2-CE2 3.78Å; F541-F564 HydrophobicContact CD2-CE2 3.78Å; F541-F564 HydrophobicContact CD2-CZ 4.4Å; F541-F564 HydrophobicContact CE2-CD2 4.43Å; F541-F564 AromaticContact CE2-CE2 3.81Å; F541-F564 HydrophobicContact CE2-CE2 3.81Å; I552-F564 WeakPolarHBondContact O-CD2 3.43Å; I553-F564 HydrophobicContact CG1-CB 4.31Å; I553-F564 HydrophobicContact CG1-CD2 3.6Å; I553-F564 HydrophobicContact CG1-CE2 4.35Å; I553-F564 HydrophobicContact CG1-CG 4.33Å; F564-M566 HydrophobicContact CE1-CB 4.43Å; F564-M566 HydrophobicContact CE1-CE 3.74Å; F564-M566 HydrophobicContact CZ-CB 4.33Å; F564-M566 HydrophobicContact CZ-CE 3.46Å; F564-M566 VanDerWaalsContact CZ-CE 3.46Å; F564-K602 CarbonylContact O-C 3.55Å; F564-K602 VanDerWaalsContact O-CA 3.31Å; F564-K602 WeakPolarHBondContact O-CA 3.25Å; F564-K603 HydrophobicContact CB-CB 4.44Å; F564-K603 HydrophobicContact CD1-CB 4.41Å; F564-K603 PolarHBondContact N-O 3.3Å; F564-K603 PolarHBondContact O-N 3.43Å; F564-L605 HydrophobicContact CB-CD1 3.99Å; F564-L605 HydrophobicContact CB-CG 4.41Å; F564-L638 HydrophobicContact CB-CD2 4.38Å; F564-L638 HydrophobicContact CD1-CD2 3.4Å; F564-L638 VanDerWaalsContact CD1-CD2 3.4Å; F564-L638 HydrophobicContact CD1-CG 3.97Å; F564-L638 HydrophobicContact CD2-CD2 3.57Å; F564-L638 HydrophobicContact CE1-CD2 3.34Å; F564-L638 HydrophobicContact CE1-CG 4.11Å; F564-L638 HydrophobicContact CE2-CD2 3.51Å; F564-L638 HydrophobicContact CG-CD2 3.51Å; F564-L638 HydrophobicContact CG-CG 4.31Å; F564-L638 HydrophobicContact CZ-CD2 3.38Å; F564-M642 HydrophobicContact CD1-CE 3.85Å; F564-M642 HydrophobicContact CD1-SD 3.5Å; F564-M642 WeakPolarHBondContact CD1-SD 3.47Å; F564-M642 HydrophobicContact CE1-CE 3.7Å; F564-M642 HydrophobicContact CE1-SD 3.58Å; F564-M642 VanDerWaalsContact CE1-SD 3.58Å
565	Y	96.4	Very high	91.1	Very high	13 Å²	13	42.3 Å²	42.3	5%	0.051	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	146.7	175.2	-65.4	-81.7	0	0	0	110.7	A461 L464 V465 G551 I552 V554 T563 K602 L645	A461-Y565 HydrophobicContact CB-CD1 3.53Å; A461-Y565 HydrophobicContact CB-CE1 3.54Å; L464-Y565 HydrophobicContact CB-CD2 4.49Å; L464-Y565 HydrophobicContact CD1-CD2 4.4Å; L464-Y565 HydrophobicContact CD1-CE2 3.7Å; V465-Y565 HydrophobicContact CG2-CG 3.99Å; G551-Y565 CarbonylContact C-O 3.58Å; G551-Y565 VanDerWaalsContact CA-O 3.29Å; G551-Y565 WeakPolarHBondContact CA-O 3.3Å; I552-Y565 PolarHBondContact N-O 3.31Å; I552-Y565 PolarHBondContact O-N 3.32Å; V554-Y565 HydrophobicContact CG2-CD2 3.76Å; V554-Y565 HydrophobicContact CG2-CE2 3.63Å; T563-Y565 HydrophobicContact CG2-CD1 4.26Å; T563-Y565 HydrophobicContact CG2-CD2 4.09Å; T563-Y565 HydrophobicContact CG2-CE1 3.89Å; T563-Y565 HydrophobicContact CG2-CE2 3.69Å; T563-Y565 HydrophobicContact CG2-CG 4.34Å; Y565-K602 HydrophobicContact CD1-CB 3.66Å; Y565-K602 HydrophobicContact CE1-CB 3.83Å; Y565-K602 HydrophobicContact CE1-CD 4.45Å; Y565-L645 HydrophobicContact CE1-CD1 4.45Å
566	M	95.1	Very high	90.9	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	143.9	179.5	-179.7	179.3	-73.3	0	0	111.8	R549 M550 F564 M573 I576 V600 S601 E639 M642	R549-M566 HydrophobicContact CB-SD 4.38Å; R549-M566 HydrophobicContact CG-SD 4.4Å; M550-M566 VanDerWaalsContact O-CA 3.32Å; M550-M566 WeakPolarHBondContact O-CA 3.4Å; M550-M566 WeakPolarHBondContact O-CG 3.19Å; F564-M566 HydrophobicContact CE1-CB 4.43Å; F564-M566 HydrophobicContact CE1-CE 3.74Å; F564-M566 HydrophobicContact CZ-CB 4.33Å; F564-M566 HydrophobicContact CZ-CE 3.46Å; F564-M566 VanDerWaalsContact CZ-CE 3.46Å; M566-M573 HydrophobicContact CB-CE 4.41Å; M566-M573 HydrophobicContact CG-CE 3.88Å; M566-M573 HydrophobicContact CG-SD 3.98Å; M566-M573 HydrophobicContact SD-CE 3.76Å; M566-M573 HydrophobicContact SD-SD 3.55Å; M566-I576 HydrophobicContact SD-CD1 4.31Å; M566-I576 HydrophobicContact SD-CG2 4.22Å; M566-V600 WeakPolarHBondContact O-CA 3.5Å; M566-S601 PolarHBondContact N-O 3.32Å; M566-S601 PolarHBondContact O-N 3.2Å; M566-S601 PolarHBondContact O-OG 3.2Å; M566-E639 HydrophobicContact CE-CB 4.21Å; M566-E639 HydrophobicContact CE-CG 3.49Å; M566-E639 VanDerWaalsContact CE-CG 3.49Å; M566-E639 VanDerWaalsContact CE-OE1 3.26Å; M566-E639 WeakPolarHBondContact CE-OE1 3.48Å; M566-M642 HydrophobicContact CB-CE 3.34Å; M566-M642 HydrophobicContact CG-CE 4.34Å; M566-M642 HydrophobicContact SD-CE 4.25Å
567	K	94.8	Very high	90.9	Very high	15 Å²	15	39.6 Å²	39.6	7%	0.065	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	143.7	166.3	72	-173.2	178.9	-172.8	0	111.1	V465 E501 R549 M550 V599 V600	V465-K567 HydrophobicContact CB-CD 4.27Å; V465-K567 HydrophobicContact CG1-CB 4.12Å; V465-K567 HydrophobicContact CG1-CD 3.73Å; V465-K567 HydrophobicContact CG1-CG 3.65Å; V465-K567 WeakPolarHBondContact O-CD 3.5Å; V465-K567 VanDerWaalsContact O-CE 3.26Å; V465-K567 WeakPolarHBondContact O-CE 3.42Å; V465-K567 PolarHBondContact O-NZ 2.9Å; E501-K567 VanDerWaalsContact CG-NZ 3.33Å; E501-K567 VanDerWaalsContact OE1-CE 3.25Å; E501-K567 WeakPolarHBondContact OE1-CE 3.44Å; E501-K567 IonicContact OE1-NZ 3.63Å; E501-K567 PolarHBondContact OE1-NZ 2.84Å; R549-K567 CarbonylContact C-O 3.59Å; R549-K567 WeakPolarHBondContact CA-O 3.3Å; M550-K567 HydrophobicContact CB-CG 4.28Å; M550-K567 PolarHBondContact N-O 3.36Å; M550-K567 PolarHBondContact O-N 3.08Å; K567-V599 VanDerWaalsContact CA-O 3.26Å; K567-V599 WeakPolarHBondContact CA-O 3.46Å; K567-V600 HydrophobicContact CB-CG2 4.23Å
568	G	92.3	Very high	90.9	Very high	2 Å²	2	39.3 Å²	39.3	2%	0.021	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-166.7	179.2	179.8	0	0	0	0	0	114.1	K548 L598 V599	K548-G568 WeakPolarHBondContact O-CA 3.49Å; G568-L598 WeakPolarHBondContact O-CA 3.4Å; G568-V599 PolarHBondContact N-O 2.89Å; G568-V599 PolarHBondContact O-N 2.83Å
569	A	88.8	Confident	90.9	Very high	24 Å²	24	44.4 Å²	44.4	20%	0.198	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.6	145.6	175.1	0	0	0	0	0	111.8	K548 V571 V572 M573	K548-A569 HydrophobicContact CB-CB 4.29Å; K548-A569 PolarHBondContact O-N 3.25Å; K548-A569 VanDerWaalsContact O-N 3.15Å; A569-V571 PolarHBondContact O-N 3.49Å; A569-V572 PolarHBondContact O-N 2.92Å; A569-V572 VanDerWaalsContact O-N 3.17Å; A569-M573 WeakPolarHBondContact O-CB 3.28Å; A569-M573 VanDerWaalsContact O-CG 3.22Å; A569-M573 WeakPolarHBondContact O-CG 3.23Å; A569-M573 PolarHBondContact O-N 2.6Å
570	D	85.4	Confident	90.9	Very high	55 Å²	55	42.6 Å²	42.6	29%	0.294	25%	0.249	S	C	.	.	H	α-helix	trans	-48.5	-50.6	178.9	59.6	-21.6	0	0	0	114.1	V572 M573 A574 C587 V599	D570-V572 VanDerWaalsContact C-N 3.28Å; D570-V572 PolarHBondContact O-N 3.16Å; D570-M573 PolarHBondContact O-N 3Å; D570-A574 WeakPolarHBondContact O-CB 3.47Å; D570-A574 PolarHBondContact O-N 2.69Å; D570-C587 HydrophobicContact CB-CB 4Å; D570-V599 HydrophobicContact CB-CG2 4.15Å
571	V	84.3	Confident	90.8	Very high	118 Å²	118	46.4 Å²	46.4	72%	0.715	26%	0.258	S	S	*	.	H	α-helix	trans	-60.7	-35.6	-177.5	-175.9	0	0	0	0	112.9	A569	A569-V571 PolarHBondContact O-N 3.49Å
572	V	88.2	Confident	90.7	Very high	38 Å²	38	44.7 Å²	44.7	23%	0.23	25%	0.248	C	C	.	.	H	α-helix	trans	-82.7	-42.6	-179.3	178.3	0	0	0	0	110.2	K548 A569 D570 A574 G575 I576	K548-V572 HydrophobicContact CB-CG2 4.08Å; K548-V572 HydrophobicContact CD-CG2 4.18Å; A569-V572 PolarHBondContact O-N 2.92Å; A569-V572 VanDerWaalsContact O-N 3.17Å; D570-V572 VanDerWaalsContact C-N 3.28Å; D570-V572 PolarHBondContact O-N 3.16Å; V572-A574 VanDerWaalsContact C-N 3.32Å; V572-A574 PolarHBondContact O-N 3.15Å; V572-G575 PolarHBondContact O-N 2.8Å; V572-I576 HydrophobicContact CG1-CD1 3.93Å
573	M	90.8	Very high	90.4	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-69.9	-29.8	-176.6	-66.2	-62.8	-63.3	0	0	112	R549 M566 A569 D570 G575 I576 V577 V599 S601	R549-M573 HydrophobicContact CB-SD 4.44Å; M566-M573 HydrophobicContact CB-CE 4.41Å; M566-M573 HydrophobicContact CG-CE 3.88Å; M566-M573 HydrophobicContact CG-SD 3.98Å; M566-M573 HydrophobicContact SD-CE 3.76Å; M566-M573 HydrophobicContact SD-SD 3.55Å; A569-M573 WeakPolarHBondContact O-CB 3.28Å; A569-M573 VanDerWaalsContact O-CG 3.22Å; A569-M573 WeakPolarHBondContact O-CG 3.23Å; A569-M573 PolarHBondContact O-N 2.6Å; D570-M573 PolarHBondContact O-N 3Å; M573-G575 PolarHBondContact O-N 3.36Å; M573-I576 HydrophobicContact CE-CG2 4.42Å; M573-I576 PolarHBondContact O-N 2.92Å; M573-I576 HydrophobicContact SD-CD1 4.25Å; M573-V577 HydrophobicContact CE-CG1 4.01Å; M573-V577 WeakPolarHBondContact O-CG1 3.2Å; M573-V577 VanDerWaalsContact O-CG2 3.28Å; M573-V577 WeakPolarHBondContact O-CG2 3.42Å; M573-V577 PolarHBondContact O-N 3.13Å; M573-V599 HydrophobicContact CB-CB 3.66Å; M573-V599 HydrophobicContact CB-CG1 3.9Å; M573-V599 HydrophobicContact CB-CG2 3.93Å; M573-V599 HydrophobicContact CG-CB 3.89Å; M573-V599 HydrophobicContact CG-CG1 4.47Å; M573-V599 HydrophobicContact CG-CG2 4.43Å; M573-S601 WeakPolarHBondContact CE-OG 3.34Å
574	A	88.2	Confident	89.9	Confident	37 Å²	37	52 Å²	52	31%	0.306	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.6	-30.7	176.3	0	0	0	0	0	113.8	D570 V572 L583	D570-A574 WeakPolarHBondContact O-CB 3.47Å; D570-A574 PolarHBondContact O-N 2.69Å; V572-A574 VanDerWaalsContact C-N 3.32Å; V572-A574 PolarHBondContact O-N 3.15Å; A574-L583 HydrophobicContact CB-CD2 4.2Å
575	G	88.7	Confident	89.5	Confident	68 Å²	68	58.1 Å²	58.1	70%	0.701	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.7	-10.9	175.1	0	0	0	0	0	115.1	V572 M573	V572-G575 PolarHBondContact O-N 2.8Å; M573-G575 PolarHBondContact O-N 3.36Å
576	I	91.8	Very high	89.1	Confident	16 Å²	16	59.3 Å²	59.3	8%	0.082	32%	0.316	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101.2	-39.2	-175.8	-72.7	171.5	0	0	0	111.2	M566 V572 M573 E639 E641 M642	M566-I576 HydrophobicContact SD-CD1 4.31Å; M566-I576 HydrophobicContact SD-CG2 4.22Å; V572-I576 HydrophobicContact CG1-CD1 3.93Å; M573-I576 HydrophobicContact CE-CG2 4.42Å; M573-I576 PolarHBondContact O-N 2.92Å; M573-I576 HydrophobicContact SD-CD1 4.25Å; I576-E639 WeakPolarHBondContact CG2-O 3.46Å; I576-E641 PolarHBondContact O-N 2.72Å; I576-M642 HydrophobicContact CG2-CB 4.13Å; I576-M642 HydrophobicContact CG2-CG 3.64Å; I576-M642 PolarHBondContact O-N 3.15Å
577	V	92.6	Very high	88.7	Confident	11 Å²	11	59.4 Å²	59.4	7%	0.067	32%	0.317	C	S	.	.	B	Isolated β-bridge	trans	-79.6	156.6	-179.4	-57.2	0	0	0	0	111.2	M573 L583 V599 M642 L644	M573-V577 HydrophobicContact CE-CG1 4.01Å; M573-V577 WeakPolarHBondContact O-CG1 3.2Å; M573-V577 VanDerWaalsContact O-CG2 3.28Å; M573-V577 WeakPolarHBondContact O-CG2 3.42Å; M573-V577 PolarHBondContact O-N 3.13Å; V577-L583 HydrophobicContact CG2-CD2 3.72Å; V577-V599 HydrophobicContact CG1-CG1 4.44Å; V577-M642 CarbonylContact C-O 3.58Å; V577-M642 VanDerWaalsContact CA-O 3.31Å; V577-M642 WeakPolarHBondContact CA-O 3.2Å; V577-M642 HydrophobicContact CG1-CB 4.44Å; V577-L644 HydrophobicContact CB-CB 4.38Å
578	Q	90.8	Very high	88.1	Confident	103 Å²	103	60.1 Å²	60.1	48%	0.481	33%	0.328	S	S	.	.	P	Polyproline II helix	trans	-57.5	144.7	170.5	-66.3	174.5	9.1	0	0	110.6	N580 E641 M642	Q578-N580 PolarHBondContact O-N 2.87Å; Q578-N580 PolarHBondContact O-ND2 2.8Å; Q578-E641 HydrophobicContact CG-CB 4.4Å; Q578-E641 PolarHBondContact NE2-O 2.9Å; Q578-E641 VanDerWaalsContact NE2-O 3.14Å; Q578-M642 PolarHBondContact N-O 3.2Å
579	Y	87.7	Confident	87.7	Confident	195 Å²	195	61.6 Å²	61.6	77%	0.765	34%	0.336	S	S	*	.	P	Polyproline II helix	trans	-55.7	128.8	-177.7	176.1	-93.7	0	0	0	111.5	D581	Y579-D581 WeakPolarHBondContact CE1-OD1 3.49Å; Y579-D581 PolarHBondContact OH-OD1 3.24Å
580	N	85.8	Confident	87.6	Confident	54 Å²	54	60.5 Å²	60.5	29%	0.289	33%	0.326	S	S	.	.			trans	-138.6	125.2	179.8	-83	-83.1	0	0	0	109.5	Q578 W582 L583 L644	Q578-N580 PolarHBondContact O-N 2.87Å; Q578-N580 PolarHBondContact O-ND2 2.8Å; N580-W582 VanDerWaalsContact C-N 3.26Å; N580-W582 PolarHBondContact O-N 3.03Å; N580-W582 PolarHBondContact OD1-NE1 2.75Å; N580-L583 HydrophobicContact CB-CB 4.24Å; N580-L644 HydrophobicContact CB-CD2 4.08Å
581	D	85.7	Confident	87.3	Confident	126 Å²	126	59.8 Å²	59.8	67%	0.674	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.7	-26	-174.6	-65.4	-45.7	0	0	0	114.2	Y579	Y579-D581 WeakPolarHBondContact CE1-OD1 3.49Å; Y579-D581 PolarHBondContact OH-OD1 3.24Å
582	W	90.3	Very high	86.8	Confident	52 Å²	52	62.5 Å²	62.5	20%	0.197	33%	0.326	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.5	-12	-171.5	62.7	-88.8	0	0	0	114.1	H407 N580 E586 L644 L647	H407-W582 AromaticContact CE1-CE3 3.81Å; H407-W582 AromaticContact CE1-CZ3 3.81Å; H407-W582 AromaticContact ND1-CE3 3.64Å; H407-W582 AromaticContact ND1-CH2 3.82Å; H407-W582 AromaticContact ND1-CZ3 3.15Å; H407-W582 WeakPolarHBondContact ND1-CZ3 3.42Å; N580-W582 VanDerWaalsContact C-N 3.26Å; N580-W582 PolarHBondContact O-N 3.03Å; N580-W582 PolarHBondContact OD1-NE1 2.75Å; W582-E586 HydrophobicContact CE3-CB 4.01Å; W582-E586 HydrophobicContact CE3-CG 3.95Å; W582-E586 HydrophobicContact CZ3-CB 4.42Å; W582-E586 WeakPolarHBondContact O-CB 3.14Å; W582-E586 WeakPolarHBondContact O-CG 3.44Å; W582-E586 PolarHBondContact O-N 3.03Å; W582-L644 HydrophobicContact CH2-CD2 3.88Å; W582-L644 HydrophobicContact CZ2-CD2 3.49Å; W582-L644 VanDerWaalsContact CZ2-CD2 3.49Å; W582-L644 HydrophobicContact CZ2-CG 4.29Å; W582-L647 HydrophobicContact CE3-CD1 4.44Å; W582-L647 HydrophobicContact CH2-CD1 4.38Å; W582-L647 HydrophobicContact CH2-CG 4.12Å; W582-L647 HydrophobicContact CZ3-CD1 3.6Å; W582-L647 HydrophobicContact CZ3-CG 3.83Å
583	L	88.9	Confident	86.3	Confident	8 Å²	8	65.5 Å²	65.5	4%	0.042	34%	0.338	C	S	.	.	H	α-helix	trans	-60.4	-53.8	-170.1	174.4	61.7	0	0	0	111.9	A574 V577 N580 C587 V599 L644 L647	A574-L583 HydrophobicContact CB-CD2 4.2Å; V577-L583 HydrophobicContact CG2-CD2 3.72Å; N580-L583 HydrophobicContact CB-CB 4.24Å; L583-C587 VanDerWaalsContact O-CB 3.27Å; L583-C587 WeakPolarHBondContact O-CB 3.33Å; L583-C587 PolarHBondContact O-N 3.26Å; L583-C587 PolarHBondContact O-SG 3.4Å; L583-V599 HydrophobicContact CD1-CG1 4.29Å; L583-V599 HydrophobicContact CD1-CG2 4.14Å; L583-L644 HydrophobicContact CD1-CD2 4.16Å; L583-L647 HydrophobicContact CD1-CD1 4.41Å; L583-L647 HydrophobicContact CD1-CD2 3.57Å; L583-L647 HydrophobicContact CD1-CG 4.49Å
584	E	85.1	Confident	85.7	Confident	156 Å²	156	65.6 Å²	65.6	73%	0.729	34%	0.338	S	S	*	.	H	α-helix	trans	-66.1	-40.4	-176.6	-67.8	-171.9	170.2	0	0	112.3	G588	E584-G588 PolarHBondContact O-N 3.48Å
585	E	87.2	Confident	85.5	Confident	129 Å²	129	64.4 Å²	64.4	60%	0.603	33%	0.327	S	S	*	.	H	α-helix	trans	-65.7	-47.6	-179.3	-174.2	172.5	-174.1	0	0	111.5	G588 N589	E585-G588 CarbonylContact O-C 3.56Å; E585-G588 WeakPolarHBondContact O-CA 3.4Å; E585-G588 PolarHBondContact O-N 3.08Å; E585-N589 VanDerWaalsContact O-CG 3.28Å; E585-N589 PolarHBondContact O-N 3.46Å; E585-N589 PolarHBondContact O-OD1 3.22Å
586	E	88.4	Confident	85.4	Confident	39 Å²	39	63.5 Å²	63.5	18%	0.182	30%	0.302	C	S	.	.	H	α-helix	trans	-73	-36.1	-178.3	-68	-55.3	144.3	0	0	112.8	H407 W582 G588 N589 M590 L647	H407-E586 IonicContact NE2-OE2 3.13Å; W582-E586 HydrophobicContact CE3-CB 4.01Å; W582-E586 HydrophobicContact CE3-CG 3.95Å; W582-E586 HydrophobicContact CZ3-CB 4.42Å; W582-E586 WeakPolarHBondContact O-CB 3.14Å; W582-E586 WeakPolarHBondContact O-CG 3.44Å; W582-E586 PolarHBondContact O-N 3.03Å; E586-G588 VanDerWaalsContact C-N 3.26Å; E586-G588 PolarHBondContact O-N 3.28Å; E586-N589 VanDerWaalsContact CD-ND2 3.32Å; E586-N589 PolarHBondContact O-N 3.03Å; E586-N589 PolarHBondContact OE1-ND2 3.49Å; E586-N589 VanDerWaalsContact OE1-ND2 3.13Å; E586-N589 PolarHBondContact OE2-ND2 2.95Å; E586-N589 VanDerWaalsContact OE2-ND2 3.09Å; E586-M590 WeakPolarHBondContact O-CG 3.02Å; E586-M590 PolarHBondContact O-N 3.36Å; E586-L647 HydrophobicContact CB-CD1 4.14Å
587	C	87	Confident	85.3	Confident	2 Å²	2	63.7 Å²	63.7	1%	0.014	30%	0.304	C	S	.	.	H	α-helix	trans	-56.2	-44.4	167.5	-76.2	0	0	0	0	110.7	D570 L583 M590 A591 V597	D570-C587 HydrophobicContact CB-CB 4Å; L583-C587 VanDerWaalsContact O-CB 3.27Å; L583-C587 WeakPolarHBondContact O-CB 3.33Å; L583-C587 PolarHBondContact O-N 3.26Å; L583-C587 PolarHBondContact O-SG 3.4Å; C587-M590 PolarHBondContact O-N 2.83Å; C587-A591 VanDerWaalsContact O-CB 3.28Å; C587-A591 WeakPolarHBondContact O-CB 3.34Å; C587-A591 PolarHBondContact O-N 2.93Å; C587-V597 HydrophobicContact CB-CG1 4.45Å
588	G	81.6	Confident	85.3	Confident	30 Å²	30	64.9 Å²	64.9	31%	0.309	31%	0.31	S	S	.	.	H	α-helix	trans	-62.3	-39.9	174.8	0	0	0	0	0	113.9	E584 E585 E586 R592	E584-G588 PolarHBondContact O-N 3.48Å; E585-G588 CarbonylContact O-C 3.56Å; E585-G588 WeakPolarHBondContact O-CA 3.4Å; E585-G588 PolarHBondContact O-N 3.08Å; E586-G588 VanDerWaalsContact C-N 3.26Å; E586-G588 PolarHBondContact O-N 3.28Å; G588-R592 WeakPolarHBondContact O-CB 3.46Å; G588-R592 VanDerWaalsContact O-CG 3.29Å; G588-R592 WeakPolarHBondContact O-CG 3.09Å; G588-R592 PolarHBondContact O-N 3.38Å
589	N	85.2	Confident	85.5	Confident	33 Å²	33	60 Å²	60	18%	0.176	29%	0.287	C	S	.	.	H	α-helix	trans	-62.4	-51.5	176	-69	-19.8	0	0	0	111.6	E585 E586 A591 R592 E593	E585-N589 VanDerWaalsContact O-CG 3.28Å; E585-N589 PolarHBondContact O-N 3.46Å; E585-N589 PolarHBondContact O-OD1 3.22Å; E586-N589 VanDerWaalsContact CD-ND2 3.32Å; E586-N589 PolarHBondContact O-N 3.03Å; E586-N589 PolarHBondContact OE1-ND2 3.49Å; E586-N589 VanDerWaalsContact OE1-ND2 3.13Å; E586-N589 PolarHBondContact OE2-ND2 2.95Å; E586-N589 VanDerWaalsContact OE2-ND2 3.09Å; N589-A591 VanDerWaalsContact C-N 3.34Å; N589-A591 PolarHBondContact O-N 2.73Å; N589-R592 WeakPolarHBondContact O-CB 3.17Å; N589-R592 PolarHBondContact O-N 3.1Å; N589-R592 VanDerWaalsContact O-N 3.1Å; N589-R592 PolarHBondContact OD1-NH2 3.14Å; N589-E593 PolarHBondContact O-N 3.24Å
590	M	85.3	Confident	85.9	Confident	0 Å²	0	50.9 Å²	50.9	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-64.3	-38.4	180	-66.7	177.3	63.1	0	0	111.8	R405 H407 E586 C587 R592 E593 G594 L595 V597 L647	R405-M590 HydrophobicContact CB-CE 3.98Å; R405-M590 HydrophobicContact CG-CE 4.19Å; H407-M590 HydrophobicContact CB-SD 4.36Å; E586-M590 WeakPolarHBondContact O-CG 3.02Å; E586-M590 PolarHBondContact O-N 3.36Å; C587-M590 PolarHBondContact O-N 2.83Å; M590-R592 VanDerWaalsContact C-N 3.32Å; M590-R592 PolarHBondContact O-N 3.04Å; M590-E593 PolarHBondContact O-N 3.21Å; M590-G594 PolarHBondContact O-N 3.27Å; M590-G594 VanDerWaalsContact O-N 3.16Å; M590-L595 HydrophobicContact CB-CB 4.47Å; M590-L595 HydrophobicContact CB-CD1 4.43Å; M590-L595 HydrophobicContact CE-CD1 4.24Å; M590-L595 WeakPolarHBondContact O-CB 3.36Å; M590-L595 PolarHBondContact O-N 2.76Å; M590-V597 HydrophobicContact CB-CG2 3.48Å; M590-V597 VanDerWaalsContact CB-CG2 3.48Å; M590-V597 HydrophobicContact CE-CG1 4.47Å; M590-V597 HydrophobicContact CE-CG2 4.34Å; M590-L647 HydrophobicContact SD-CB 4.23Å; M590-L647 HydrophobicContact SD-CD1 4.32Å
591	A	79	Confident	86.3	Confident	41 Å²	41	48.3 Å²	48.3	34%	0.339	24%	0.238	S	C	.	.	H	α-helix	trans	-66.7	-31	173.8	0	0	0	0	0	112.9	C587 N589 G594	C587-A591 VanDerWaalsContact O-CB 3.28Å; C587-A591 WeakPolarHBondContact O-CB 3.34Å; C587-A591 PolarHBondContact O-N 2.93Å; N589-A591 VanDerWaalsContact C-N 3.34Å; N589-A591 PolarHBondContact O-N 2.73Å; A591-G594 WeakPolarHBondContact O-CA 3.46Å; A591-G594 PolarHBondContact O-N 3.35Å; A591-G594 VanDerWaalsContact O-N 3.12Å
592	R	75.2	Confident	86.8	Confident	174 Å²	174	43.2 Å²	43.2	66%	0.657	21%	0.21	S	C	*	.	H	α-helix	trans	-71.5	-32.4	173.6	-79.1	-173.1	-71.1	171.1	-10.9	113	G588 N589 M590 G594	G588-R592 WeakPolarHBondContact O-CB 3.46Å; G588-R592 VanDerWaalsContact O-CG 3.29Å; G588-R592 WeakPolarHBondContact O-CG 3.09Å; G588-R592 PolarHBondContact O-N 3.38Å; N589-R592 WeakPolarHBondContact O-CB 3.17Å; N589-R592 PolarHBondContact O-N 3.1Å; N589-R592 VanDerWaalsContact O-N 3.1Å; N589-R592 PolarHBondContact OD1-NH2 3.14Å; M590-R592 VanDerWaalsContact C-N 3.32Å; M590-R592 PolarHBondContact O-N 3.04Å; R592-G594 PolarHBondContact O-N 3.45Å
593	E	77.6	Confident	87	Confident	102 Å²	102	43.5 Å²	43.5	48%	0.477	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.5	-10.8	168.1	-67.5	177.2	-174.7	0	0	112.5	R405 N589 M590 L595 N689	R405-E593 IonicContact CZ-OE1 2.8Å; R405-E593 IonicContact CZ-OE2 3.36Å; R405-E593 IonicContact NH1-OE1 3.72Å; R405-E593 PolarHBondContact NH1-OE1 3.43Å; R405-E593 IonicContact NH1-OE2 2.66Å; R405-E593 PolarHBondContact NH1-OE2 2.59Å; N589-E593 PolarHBondContact O-N 3.24Å; M590-E593 PolarHBondContact O-N 3.21Å; E593-L595 HydrophobicContact CB-CG 4.41Å; E593-N689 PolarHBondContact O-OD1 2.92Å
594	G	77.3	Confident	87.2	Confident	1 Å²	1	46.1 Å²	46.1	1%	0.01	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	trans	75.9	36.3	179	0	0	0	0	0	113.7	M590 A591 R592 C685 N689	M590-G594 PolarHBondContact O-N 3.27Å; M590-G594 VanDerWaalsContact O-N 3.16Å; A591-G594 WeakPolarHBondContact O-CA 3.46Å; A591-G594 PolarHBondContact O-N 3.35Å; A591-G594 VanDerWaalsContact O-N 3.12Å; R592-G594 PolarHBondContact O-N 3.45Å; G594-C685 WeakPolarHBondContact CA-SG 3.45Å; G594-C685 PolarHBondContact O-SG 3.44Å; G594-N689 VanDerWaalsContact CA-OD1 3.3Å; G594-N689 WeakPolarHBondContact CA-OD1 3.46Å; G594-N689 PolarHBondContact O-ND2 3.16Å
595	L	85.3	Confident	87.6	Confident	13 Å²	13	39.7 Å²	39.7	7%	0.068	20%	0.202	C	C	.	.	P	Polyproline II helix	trans	-89.5	145.3	166.9	-55.7	177.7	0	0	0	109.5	R404 R405 M590 E593 E651	R404-L595 HydrophobicContact CB-CD1 4.41Å; R404-L595 HydrophobicContact CB-CD2 3.85Å; R404-L595 HydrophobicContact CG-CD2 4.02Å; R405-L595 HydrophobicContact CB-CD1 3.85Å; M590-L595 HydrophobicContact CB-CB 4.47Å; M590-L595 HydrophobicContact CB-CD1 4.43Å; M590-L595 HydrophobicContact CE-CD1 4.24Å; M590-L595 WeakPolarHBondContact O-CB 3.36Å; M590-L595 PolarHBondContact O-N 2.76Å; E593-L595 HydrophobicContact CB-CG 4.41Å; L595-E651 HydrophobicContact CD2-CB 3.82Å; L595-E651 HydrophobicContact CD2-CG 4.44Å
596	R	85.9	Confident	87.9	Confident	49 Å²	49	37.2 Å²	37.2	19%	0.185	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	117.7	164.4	-61.4	-178.2	-177.6	-169.4	3.4	107.7	D500 G649 V650 D652 T682	D500-R596 IonicContact OD1-NH1 3.86Å; D500-R596 PolarHBondContact OD1-NH1 3.02Å; D500-R596 VanDerWaalsContact OD1-NH1 3.17Å; D500-R596 IonicContact OD2-NH1 3.31Å; D500-R596 PolarHBondContact OD2-NH1 3.45Å; R596-G649 WeakPolarHBondContact O-CA 3.44Å; R596-V650 WeakPolarHBondContact CB-O 3.37Å; R596-V650 PolarHBondContact N-O 2.9Å; R596-V650 PolarHBondContact O-N 3.28Å; R596-D652 IonicContact NH2-OD2 3.83Å; R596-D652 PolarHBondContact NH2-OD2 3.25Å; R596-T682 VanDerWaalsContact NH2-CG2 3.32Å
597	V	88.9	Confident	88.1	Confident	19 Å²	19	39 Å²	39	12%	0.115	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	127.8	-175.6	-171	0	0	0	0	109.8	C587 M590 L647 T648	C587-V597 HydrophobicContact CB-CG1 4.45Å; M590-V597 HydrophobicContact CB-CG2 3.48Å; M590-V597 VanDerWaalsContact CB-CG2 3.48Å; M590-V597 HydrophobicContact CE-CG1 4.47Å; M590-V597 HydrophobicContact CE-CG2 4.34Å; V597-L647 HydrophobicContact CG1-CB 4.29Å; V597-T648 VanDerWaalsContact CA-O 3.28Å; V597-T648 WeakPolarHBondContact CA-O 3.44Å
598	L	92.9	Very high	88.4	Confident	37 Å²	37	46.6 Å²	46.6	19%	0.194	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	138.1	167.6	-62	170.4	0	0	0	109.6	L504 G568 L647 T648	L504-L598 HydrophobicContact CD1-CD1 4.21Å; G568-L598 WeakPolarHBondContact O-CA 3.4Å; L598-L647 WeakPolarHBondContact O-CA 3.42Å; L598-T648 WeakPolarHBondContact CB-OG1 3.24Å; L598-T648 PolarHBondContact N-O 3.03Å; L598-T648 PolarHBondContact O-N 3.2Å
599	V	94.9	Very high	88.9	Confident	0 Å²	0	50 Å²	50	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	127.5	174.8	-173.1	0	0	0	0	108.1	K567 G568 D570 M573 V577 L583 L644 L647	K567-V599 VanDerWaalsContact CA-O 3.26Å; K567-V599 WeakPolarHBondContact CA-O 3.46Å; G568-V599 PolarHBondContact N-O 2.89Å; G568-V599 PolarHBondContact O-N 2.83Å; D570-V599 HydrophobicContact CB-CG2 4.15Å; M573-V599 HydrophobicContact CB-CB 3.66Å; M573-V599 HydrophobicContact CB-CG1 3.9Å; M573-V599 HydrophobicContact CB-CG2 3.93Å; M573-V599 HydrophobicContact CG-CB 3.89Å; M573-V599 HydrophobicContact CG-CG1 4.47Å; M573-V599 HydrophobicContact CG-CG2 4.43Å; V577-V599 HydrophobicContact CG1-CG1 4.44Å; L583-V599 HydrophobicContact CD1-CG1 4.29Å; L583-V599 HydrophobicContact CD1-CG2 4.14Å; V599-L644 HydrophobicContact CG1-CD1 3.31Å; V599-L647 HydrophobicContact CB-CD2 4.12Å; V599-L647 HydrophobicContact CG1-CD2 4.02Å; V599-L647 HydrophobicContact CG2-CD2 3.74Å
600	V	95.9	Very high	89.3	Confident	4 Å²	4	49.5 Å²	49.5	2%	0.024	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	133.4	177.9	-174.7	0	0	0	0	109.4	A461 I462 M566 K567 L645 C646 T648	A461-V600 HydrophobicContact CB-CG1 3.93Å; I462-V600 HydrophobicContact CG1-CG2 4.27Å; M566-V600 WeakPolarHBondContact O-CA 3.5Å; K567-V600 HydrophobicContact CB-CG2 4.23Å; V600-L645 PolarHBondContact O-N 2.94Å; V600-C646 PolarHBondContact N-O 3.24Å; V600-C646 PolarHBondContact O-N 3.33Å; V600-T648 HydrophobicContact CG2-CG2 4.19Å
601	S	95.6	Very high	89.7	Confident	0 Å²	0	54.9 Å²	54.9	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	160.4	-176.4	59.1	0	0	0	0	111.7	M566 M573 M642 E643	M566-S601 PolarHBondContact N-O 3.32Å; M566-S601 PolarHBondContact O-N 3.2Å; M566-S601 PolarHBondContact O-OG 3.2Å; M573-S601 WeakPolarHBondContact CE-OG 3.34Å; S601-M642 WeakPolarHBondContact OG-CE 3.42Å; S601-E643 CarbonylContact C-O 3.51Å; S601-E643 WeakPolarHBondContact CA-O 3.28Å; S601-E643 WeakPolarHBondContact CB-O 3.26Å
602	K	95.1	Very high	90.4	Very high	19 Å²	19	57 Å²	57	8%	0.083	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	163	176.5	71.7	171.8	-174.1	-176.2	0	112.2	E457 T563 F564 Y565 E643 L645	E457-K602 IonicContact OE1-NZ 2.7Å; E457-K602 PolarHBondContact OE1-NZ 3.3Å; E457-K602 IonicContact OE2-NZ 3.8Å; E457-K602 PolarHBondContact OE2-NZ 3.23Å; T563-K602 HydrophobicContact CG2-CB 4.11Å; F564-K602 CarbonylContact O-C 3.55Å; F564-K602 VanDerWaalsContact O-CA 3.31Å; F564-K602 WeakPolarHBondContact O-CA 3.25Å; Y565-K602 HydrophobicContact CD1-CB 3.66Å; Y565-K602 HydrophobicContact CE1-CB 3.83Å; Y565-K602 HydrophobicContact CE1-CD 4.45Å; K602-E643 WeakPolarHBondContact CE-OE2 3.39Å; K602-E643 HydrophobicContact CG-CB 4.29Å; K602-E643 PolarHBondContact N-O 3.19Å; K602-E643 IonicContact NZ-OE2 2.86Å; K602-E643 WeakPolarHBondContact O-CB 3.4Å; K602-E643 PolarHBondContact O-N 2.73Å; K602-L645 HydrophobicContact CB-CD1 3.89Å; K602-L645 HydrophobicContact CB-CG 4.33Å; K602-L645 HydrophobicContact CD-CD1 4.04Å; K602-L645 HydrophobicContact CD-CD2 3.83Å; K602-L645 HydrophobicContact CD-CG 4.28Å; K602-L645 HydrophobicContact CG-CD1 3.89Å; K602-L645 HydrophobicContact CG-CD2 3.89Å; K602-L645 HydrophobicContact CG-CG 3.93Å
603	K	94.9	Very high	91.3	Very high	58 Å²	58	48.8 Å²	48.8	25%	0.252	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.5	117.4	169.4	-175.3	172.2	-175.4	170.7	0	108.9	F564 L605 L638 M640 M642	F564-K603 HydrophobicContact CB-CB 4.44Å; F564-K603 HydrophobicContact CD1-CB 4.41Å; F564-K603 PolarHBondContact N-O 3.3Å; F564-K603 PolarHBondContact O-N 3.43Å; K603-L605 HydrophobicContact CG-CD2 4.41Å; K603-L638 PolarHBondContact NZ-O 2.76Å; K603-L638 VanDerWaalsContact NZ-O 3.09Å; K603-M640 PolarHBondContact NZ-O 3.22Å; K603-M642 HydrophobicContact CB-SD 3.64Å; K603-M642 HydrophobicContact CD-SD 4.08Å
604	S	93.3	Very high	92	Very high	63 Å²	63	46.2 Å²	46.2	44%	0.441	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	136	174.3	-61.8	0	0	0	0	109.8	E561	E561-S604 PolarHBondContact OE1-OG 2.86Å
605	L	93.4	Very high	92.7	Very high	20 Å²	20	49.2 Å²	49.2	11%	0.105	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	138.9	-178.2	-62.3	173.9	0	0	0	109.6	I553 I562 F564 K603 L638	I553-L605 HydrophobicContact CG2-CD1 4.48Å; I562-L605 HydrophobicContact CB-CB 4.43Å; I562-L605 HydrophobicContact CG2-CB 4.07Å; I562-L605 HydrophobicContact CG2-CD1 4.34Å; I562-L605 PolarHBondContact O-N 3.23Å; F564-L605 HydrophobicContact CB-CD1 3.99Å; F564-L605 HydrophobicContact CB-CG 4.41Å; K603-L605 HydrophobicContact CG-CD2 4.41Å; L605-L638 HydrophobicContact CD1-CD1 4.11Å
606	T	94	Very high	93	Very high	77 Å²	77	52.7 Å²	52.7	47%	0.472	27%	0.267	S	S	.	.			trans	-77.5	157.2	166.1	59.6	0	0	0	0	110.4	E608 Q609 Y610	T606-E608 PolarHBondContact O-N 2.97Å; T606-Q609 PolarHBondContact O-N 3.24Å; T606-Q609 VanDerWaalsContact O-N 3.16Å; T606-Q609 WeakPolarHBondContact OG1-CB 3.43Å; T606-Q609 WeakPolarHBondContact OG1-CG 3.17Å; T606-Q609 PolarHBondContact OG1-N 3.27Å; T606-Q609 PolarHBondContact OG1-OE1 2.77Å; T606-Y610 PolarHBondContact O-N 2.83Å
607	E	92.1	Very high	93.2	Very high	77 Å²	77	51.1 Å²	51.1	36%	0.36	26%	0.261	S	S	.	.	H	α-helix	trans	-57.1	-39.3	178.5	-173.5	64.5	-150.8	0	0	111.9	R555 I562 Y610 Q611	R555-E607 IonicContact CZ-OE2 2.89Å; R555-E607 IonicContact NH2-OE1 3.25Å; R555-E607 PolarHBondContact NH2-OE1 3.16Å; R555-E607 IonicContact NH2-OE2 3.78Å; R555-E607 PolarHBondContact NH2-OE2 2.79Å; I562-E607 WeakPolarHBondContact CD1-OE2 3.48Å; E607-Y610 PolarHBondContact O-N 2.82Å; E607-Q611 WeakPolarHBondContact O-CG 3.48Å; E607-Q611 PolarHBondContact O-N 2.78Å; E607-Q611 PolarHBondContact OE1-NE2 2.9Å
608	E	93.1	Very high	93.1	Very high	161 Å²	161	53.2 Å²	53.2	75%	0.752	27%	0.274	S	S	*	.	H	α-helix	trans	-63.8	-43.9	176.9	-64.3	-179.2	-178.2	0	0	112.2	T606 Y610 Q611 D612	T606-E608 PolarHBondContact O-N 2.97Å; E608-Y610 VanDerWaalsContact C-N 3.33Å; E608-Y610 PolarHBondContact O-N 2.83Å; E608-Q611 PolarHBondContact O-N 3.36Å; E608-D612 PolarHBondContact O-N 2.97Å
609	Q	92.4	Very high	92.9	Very high	103 Å²	103	58.2 Å²	58.2	48%	0.481	30%	0.297	S	S	.	.	H	α-helix	trans	-63.8	-39.3	177.3	-74.7	168.6	-36.2	0	0	112	T606 F613	T606-Q609 PolarHBondContact O-N 3.24Å; T606-Q609 VanDerWaalsContact O-N 3.16Å; T606-Q609 WeakPolarHBondContact OG1-CB 3.43Å; T606-Q609 WeakPolarHBondContact OG1-CG 3.17Å; T606-Q609 PolarHBondContact OG1-N 3.27Å; T606-Q609 PolarHBondContact OG1-OE1 2.77Å; Q609-F613 WeakPolarHBondContact O-CB 3.49Å; Q609-F613 PolarHBondContact O-N 3.35Å; Q609-F613 VanDerWaalsContact O-N 3.1Å
610	Y	93.6	Very high	92.4	Very high	22 Å²	22	58.5 Å²	58.5	9%	0.086	30%	0.299	C	S	.	.	H	α-helix	trans	-67	-45.5	176.8	171.4	-105.6	0	0	0	111.7	L538 I553 I562 T606 E607 E608 D612 F613 E614	L538-Y610 HydrophobicContact CB-CE2 3.88Å; L538-Y610 WeakPolarHBondContact CB-OH 2.99Å; L538-Y610 HydrophobicContact CD1-CD1 4.24Å; L538-Y610 HydrophobicContact CD1-CD2 4.22Å; L538-Y610 HydrophobicContact CD1-CE1 3.89Å; L538-Y610 HydrophobicContact CD1-CE2 3.86Å; L538-Y610 HydrophobicContact CD1-CG 4.4Å; L538-Y610 HydrophobicContact CD2-CE1 4.37Å; L538-Y610 HydrophobicContact CG-CE2 4.42Å; I553-Y610 HydrophobicContact CD1-CD2 4.36Å; I553-Y610 HydrophobicContact CD1-CE2 4.33Å; I553-Y610 HydrophobicContact CG2-CD2 4.12Å; I553-Y610 HydrophobicContact CG2-CE2 4.16Å; I562-Y610 HydrophobicContact CD1-CD1 4.17Å; I562-Y610 HydrophobicContact CD1-CG 4.19Å; T606-Y610 PolarHBondContact O-N 2.83Å; E607-Y610 PolarHBondContact O-N 2.82Å; E608-Y610 VanDerWaalsContact C-N 3.33Å; E608-Y610 PolarHBondContact O-N 2.83Å; Y610-D612 PolarHBondContact O-N 3.03Å; Y610-F613 PolarHBondContact O-N 3.26Å; Y610-E614 WeakPolarHBondContact O-CB 3.25Å; Y610-E614 PolarHBondContact O-N 3.28Å; Y610-E614 PolarHBondContact OH-OE2 2.88Å; Y610-E614 VanDerWaalsContact OH-OE2 3.14Å
611	Q	93.8	Very high	91.6	Very high	112 Å²	112	62.9 Å²	62.9	52%	0.523	32%	0.318	S	S	.	.	H	α-helix	trans	-63.4	-40.6	179.5	-72.2	178.5	13.1	0	0	112.4	E607 E608 E614 A615	E607-Q611 WeakPolarHBondContact O-CG 3.48Å; E607-Q611 PolarHBondContact O-N 2.78Å; E607-Q611 PolarHBondContact OE1-NE2 2.9Å; E608-Q611 PolarHBondContact O-N 3.36Å; Q611-E614 PolarHBondContact O-N 2.8Å; Q611-A615 WeakPolarHBondContact O-CB 3.31Å; Q611-A615 PolarHBondContact O-N 3.44Å
612	D	93.6	Very high	90.8	Very high	85 Å²	85	69.3 Å²	69.3	46%	0.455	35%	0.351	S	S	.	.	H	α-helix	trans	-61.3	-45.6	173.2	175.6	71.8	0	0	0	111.9	E608 Y610 A615 R616	E608-D612 PolarHBondContact O-N 2.97Å; Y610-D612 PolarHBondContact O-N 3.03Å; D612-A615 PolarHBondContact O-N 3.18Å; D612-R616 WeakPolarHBondContact O-CG 3.37Å; D612-R616 PolarHBondContact O-N 3.41Å; D612-R616 VanDerWaalsContact O-N 3.13Å; D612-R616 IonicContact OD1-NE 2.87Å; D612-R616 IonicContact OD2-CZ 3.04Å; D612-R616 VanDerWaalsContact OD2-CZ 3.24Å; D612-R616 IonicContact OD2-NE 2.76Å; D612-R616 PolarHBondContact OD2-NE 2.98Å; D612-R616 IonicContact OD2-NH2 3.24Å; D612-R616 PolarHBondContact OD2-NH2 3.12Å
613	F	93.7	Very high	90.1	Very high	3 Å²	3	69.8 Å²	69.8	1%	0.013	36%	0.357	C	S	.	.	H	α-helix	trans	-60.6	-49	176.5	170.8	-93.8	0	0	0	112	F541 I553 Q609 Y610 A615 R616 Y617 V634 L638	F541-F613 HydrophobicContact CE1-CZ 4Å; F541-F613 AromaticContact CZ-CE1 3.82Å; F541-F613 HydrophobicContact CZ-CE1 3.82Å; F541-F613 AromaticContact CZ-CZ 3.52Å; F541-F613 HydrophobicContact CZ-CZ 3.52Å; I553-F613 HydrophobicContact CD1-CD1 4.21Å; I553-F613 HydrophobicContact CD1-CE1 3.95Å; Q609-F613 WeakPolarHBondContact O-CB 3.49Å; Q609-F613 PolarHBondContact O-N 3.35Å; Q609-F613 VanDerWaalsContact O-N 3.1Å; Y610-F613 PolarHBondContact O-N 3.26Å; F613-A615 VanDerWaalsContact C-N 3.32Å; F613-A615 PolarHBondContact O-N 3.08Å; F613-R616 PolarHBondContact O-N 2.89Å; F613-Y617 HydrophobicContact CE1-CG 4.33Å; F613-Y617 HydrophobicContact CZ-CD2 4.28Å; F613-Y617 HydrophobicContact CZ-CG 4.26Å; F613-Y617 VanDerWaalsContact O-CB 3.26Å; F613-Y617 WeakPolarHBondContact O-CB 3.36Å; F613-Y617 PolarHBondContact O-N 2.8Å; F613-V634 HydrophobicContact CD2-CG1 4.02Å; F613-V634 HydrophobicContact CE2-CG1 3.72Å; F613-V634 HydrophobicContact CZ-CG1 4.45Å; F613-L638 HydrophobicContact CD1-CD1 4.32Å; F613-L638 HydrophobicContact CD2-CB 4.34Å; F613-L638 HydrophobicContact CD2-CD1 3.69Å; F613-L638 HydrophobicContact CE2-CB 4.07Å; F613-L638 HydrophobicContact CE2-CD1 3.92Å; F613-L638 HydrophobicContact CE2-CG 4.46Å; F613-L638 HydrophobicContact CG-CD1 3.9Å; F613-L638 HydrophobicContact CZ-CD1 4.37Å
614	E	92.1	Very high	89.3	Confident	48 Å²	48	73.3 Å²	73.3	22%	0.224	38%	0.383	C	S	.	.	H	α-helix	trans	-58.7	-44.2	-179.1	-174.1	71.5	-161.4	0	0	110.7	Q539 Y610 Q611 Y617 V618	Q539-E614 WeakPolarHBondContact CG-OE2 3.42Å; Q539-E614 VanDerWaalsContact NE2-CD 3.3Å; Q539-E614 PolarHBondContact NE2-OE1 3.21Å; Q539-E614 PolarHBondContact NE2-OE2 2.87Å; Y610-E614 WeakPolarHBondContact O-CB 3.25Å; Y610-E614 PolarHBondContact O-N 3.28Å; Y610-E614 PolarHBondContact OH-OE2 2.88Å; Y610-E614 VanDerWaalsContact OH-OE2 3.14Å; Q611-E614 PolarHBondContact O-N 2.8Å; E614-Y617 PolarHBondContact O-N 3.05Å; E614-V618 WeakPolarHBondContact O-CB 3.19Å; E614-V618 VanDerWaalsContact O-CG2 3.32Å; E614-V618 WeakPolarHBondContact O-CG2 3.46Å; E614-V618 PolarHBondContact O-N 3.1Å
615	A	92	Very high	88.6	Confident	63 Å²	63	76.9 Å²	76.9	52%	0.521	39%	0.392	S	S	.	.	H	α-helix	trans	-60.3	-48.1	176.9	0	0	0	0	0	112.1	Q611 D612 F613 Y617 Q619	Q611-A615 WeakPolarHBondContact O-CB 3.31Å; Q611-A615 PolarHBondContact O-N 3.44Å; D612-A615 PolarHBondContact O-N 3.18Å; F613-A615 VanDerWaalsContact C-N 3.32Å; F613-A615 PolarHBondContact O-N 3.08Å; A615-Y617 VanDerWaalsContact C-N 3.33Å; A615-Y617 PolarHBondContact O-N 3.45Å; A615-Q619 WeakPolarHBondContact O-CB 3.46Å; A615-Q619 PolarHBondContact O-N 2.81Å
616	R	92.4	Very high	87.9	Confident	87 Å²	87	81.3 Å²	81.3	33%	0.328	42%	0.416	S	S	.	.	H	α-helix	trans	-63.7	-38.8	176.6	-71.9	-171.7	-75.5	125.7	-3	112.1	D612 F613 Q619 A620 V634 S637	D612-R616 WeakPolarHBondContact O-CG 3.37Å; D612-R616 PolarHBondContact O-N 3.41Å; D612-R616 VanDerWaalsContact O-N 3.13Å; D612-R616 IonicContact OD1-NE 2.87Å; D612-R616 IonicContact OD2-CZ 3.04Å; D612-R616 VanDerWaalsContact OD2-CZ 3.24Å; D612-R616 IonicContact OD2-NE 2.76Å; D612-R616 PolarHBondContact OD2-NE 2.98Å; D612-R616 IonicContact OD2-NH2 3.24Å; D612-R616 PolarHBondContact OD2-NH2 3.12Å; F613-R616 PolarHBondContact O-N 2.89Å; R616-Q619 PolarHBondContact O-N 3.18Å; R616-A620 WeakPolarHBondContact O-CB 3.47Å; R616-A620 PolarHBondContact O-N 3.29Å; R616-V634 HydrophobicContact CB-CG1 4.12Å; R616-V634 HydrophobicContact CB-CG2 4.31Å; R616-S637 PolarHBondContact NH1-OG 3.38Å
617	Y	89.6	Confident	87.2	Confident	15 Å²	15	85.1 Å²	85.1	6%	0.059	42%	0.422	C	S	.	.	H	α-helix	trans	-68.5	-44.7	-178.8	-176.4	-120.2	0	0	0	112.2	Q539 F541 F613 E614 A615 A620 K621 V631 V634 I635	Q539-Y617 HydrophobicContact CG-CE1 4.48Å; F541-Y617 HydrophobicContact CE1-CE1 4.5Å; F541-Y617 HydrophobicContact CE1-CE2 4.05Å; F541-Y617 AromaticContact CE1-CZ 3.91Å; F613-Y617 HydrophobicContact CE1-CG 4.33Å; F613-Y617 HydrophobicContact CZ-CD2 4.28Å; F613-Y617 HydrophobicContact CZ-CG 4.26Å; F613-Y617 VanDerWaalsContact O-CB 3.26Å; F613-Y617 WeakPolarHBondContact O-CB 3.36Å; F613-Y617 PolarHBondContact O-N 2.8Å; E614-Y617 PolarHBondContact O-N 3.05Å; A615-Y617 VanDerWaalsContact C-N 3.33Å; A615-Y617 PolarHBondContact O-N 3.45Å; Y617-A620 PolarHBondContact O-N 3.07Å; Y617-K621 HydrophobicContact CD1-CD 4.42Å; Y617-K621 HydrophobicContact CE1-CD 4.06Å; Y617-K621 PolarHBondContact O-N 3.05Å; Y617-K621 WeakPolarHBondContact OH-CE 3.23Å; Y617-K621 PolarHBondContact OH-NZ 3.43Å; Y617-V631 HydrophobicContact CE2-CG1 3.89Å; Y617-V634 HydrophobicContact CD2-CG1 4.38Å; Y617-I635 HydrophobicContact CE2-CD1 4.18Å; Y617-I635 HydrophobicContact CE2-CG1 4.09Å
618	V	87.4	Confident	86.7	Confident	63 Å²	63	86.2 Å²	86.2	38%	0.382	44%	0.438	S	S	.	.	H	α-helix	trans	-62.6	-43.7	174.3	171.7	0	0	0	0	110.6	E614 A620 K621 L622	E614-V618 WeakPolarHBondContact O-CB 3.19Å; E614-V618 VanDerWaalsContact O-CG2 3.32Å; E614-V618 WeakPolarHBondContact O-CG2 3.46Å; E614-V618 PolarHBondContact O-N 3.1Å; V618-A620 VanDerWaalsContact C-N 3.31Å; V618-A620 PolarHBondContact O-N 3.48Å; V618-K621 PolarHBondContact O-N 3.2Å; V618-L622 HydrophobicContact CG1-CD1 3.87Å; V618-L622 HydrophobicContact CG1-CG 4.42Å; V618-L622 WeakPolarHBondContact O-CG 3.37Å; V618-L622 PolarHBondContact O-N 2.92Å
619	Q	87.3	Confident	86.3	Confident	143 Å²	143	84.1 Å²	84.1	67%	0.668	43%	0.431	S	S	*	.	H	α-helix	trans	-60	-40.9	176.1	-171.5	-178	12.6	0	0	112.2	A615 R616 L622 S623	A615-Q619 WeakPolarHBondContact O-CB 3.46Å; A615-Q619 PolarHBondContact O-N 2.81Å; R616-Q619 PolarHBondContact O-N 3.18Å; Q619-L622 PolarHBondContact O-N 2.6Å; Q619-S623 PolarHBondContact O-N 3.41Å
620	A	85.1	Confident	86	Confident	6 Å²	6	83.3 Å²	83.3	5%	0.05	43%	0.426	C	S	.	.	H	α-helix	trans	-65.3	-42.3	176.4	0	0	0	0	0	112.2	R616 Y617 V618 L622 S623 K630 V631 V634	R616-A620 WeakPolarHBondContact O-CB 3.47Å; R616-A620 PolarHBondContact O-N 3.29Å; Y617-A620 PolarHBondContact O-N 3.07Å; V618-A620 VanDerWaalsContact C-N 3.31Å; V618-A620 PolarHBondContact O-N 3.48Å; A620-L622 VanDerWaalsContact C-N 3.32Å; A620-L622 PolarHBondContact O-N 3.2Å; A620-S623 WeakPolarHBondContact O-CB 3.36Å; A620-S623 PolarHBondContact O-N 3.01Å; A620-K630 HydrophobicContact CB-CB 4.05Å; A620-V631 HydrophobicContact CB-CG2 3.86Å; A620-V634 HydrophobicContact CB-CG2 4.14Å
621	K	78.4	Confident	85.6	Confident	96 Å²	96	83.5 Å²	83.5	42%	0.417	43%	0.429	S	S	.	.	H	α-helix	trans	-63.5	-34.5	177.2	-82.1	-178.1	169	173.1	0	113.5	Y617 V618 S623 R627 V631	Y617-K621 HydrophobicContact CD1-CD 4.42Å; Y617-K621 HydrophobicContact CE1-CD 4.06Å; Y617-K621 PolarHBondContact O-N 3.05Å; Y617-K621 WeakPolarHBondContact OH-CE 3.23Å; Y617-K621 PolarHBondContact OH-NZ 3.43Å; V618-K621 PolarHBondContact O-N 3.2Å; K621-S623 PolarHBondContact O-N 3.44Å; K621-R627 VanDerWaalsContact O-CD 3.24Å; K621-R627 WeakPolarHBondContact O-CD 3.28Å; K621-V631 HydrophobicContact CG-CG2 4.08Å
622	L	79.8	Confident	85.2	Confident	135 Å²	135	80.2 Å²	80.2	71%	0.707	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.7	-5.9	178.5	-67.1	172.9	0	0	0	113.3	V618 Q619 A620	V618-L622 HydrophobicContact CG1-CD1 3.87Å; V618-L622 HydrophobicContact CG1-CG 4.42Å; V618-L622 WeakPolarHBondContact O-CG 3.37Å; V618-L622 PolarHBondContact O-N 2.92Å; Q619-L622 PolarHBondContact O-N 2.6Å; A620-L622 VanDerWaalsContact C-N 3.32Å; A620-L622 PolarHBondContact O-N 3.2Å
623	S	81	Confident	85	Confident	29 Å²	29	79.9 Å²	79.9	20%	0.203	42%	0.423	C	S	.	.			trans	-71.4	134.1	-179	-152.1	0	0	0	0	112.4	Q619 A620 K621 H625 R627 K630	Q619-S623 PolarHBondContact O-N 3.41Å; A620-S623 WeakPolarHBondContact O-CB 3.36Å; A620-S623 PolarHBondContact O-N 3.01Å; K621-S623 PolarHBondContact O-N 3.44Å; S623-H625 PolarHBondContact OG-O 3.41Å; S623-R627 WeakPolarHBondContact O-CB 3.32Å; S623-K630 PolarHBondContact OG-NZ 3.08Å
624	V	76.9	Confident	84.9	Confident	131 Å²	131	80.7 Å²	80.7	79%	0.794	43%	0.428	S	S	*	.	S	Bend	trans	-80.7	-30.9	177.6	-177.1	0	0	0	0	111.8
625	H	79.3	Confident	84.8	Confident	138 Å²	138	79.8 Å²	79.8	64%	0.639	42%	0.424	S	S	*	.	S	Bend	trans	-108.8	133.2	-179.5	-58.7	-61.8	0	0	0	111.1	S623 R627 K630	S623-H625 PolarHBondContact OG-O 3.41Å; H625-R627 PolarHBondContact O-N 2.9Å; H625-K630 PolarHBondContact O-NZ 3.17Å
626	D	79.3	Confident	84.7	Confident	113 Å²	113	81.1 Å²	81.1	60%	0.604	42%	0.42	S	S	*	.	S	Bend	trans	51.7	37	177.4	-55.2	-40.9	0	0	0	114	S628 L629 K630	D626-S628 VanDerWaalsContact C-N 3.32Å; D626-S628 PolarHBondContact O-N 3.45Å; D626-L629 HydrophobicContact CB-CB 4.35Å; D626-L629 PolarHBondContact O-N 3.4Å; D626-L629 VanDerWaalsContact O-N 3.16Å; D626-K630 PolarHBondContact O-N 2.89Å
627	R	79.4	Confident	84.6	Confident	158 Å²	158	79.5 Å²	79.5	60%	0.596	42%	0.422	S	S	*	.	H	α-helix	trans	-51.1	-49.2	-178.5	-173.8	178.7	64.7	175.8	-0.3	112.3	K621 S623 H625 L629 K630 V631	K621-R627 VanDerWaalsContact O-CD 3.24Å; K621-R627 WeakPolarHBondContact O-CD 3.28Å; S623-R627 WeakPolarHBondContact O-CB 3.32Å; H625-R627 PolarHBondContact O-N 2.9Å; R627-L629 VanDerWaalsContact C-N 3.35Å; R627-L629 PolarHBondContact O-N 2.85Å; R627-K630 PolarHBondContact O-N 2.64Å; R627-V631 HydrophobicContact CG-CG2 4.36Å; R627-V631 WeakPolarHBondContact O-CB 3.38Å; R627-V631 WeakPolarHBondContact O-CG2 3.49Å; R627-V631 PolarHBondContact O-N 3.44Å
628	S	79.9	Confident	84.6	Confident	99 Å²	99	79.2 Å²	79.2	69%	0.692	42%	0.421	S	S	*	.	H	α-helix	trans	-59.4	-44.6	-179.1	45.4	0	0	0	0	112.2	D626 A632	D626-S628 VanDerWaalsContact C-N 3.32Å; D626-S628 PolarHBondContact O-N 3.45Å; S628-A632 WeakPolarHBondContact O-CB 3.41Å; S628-A632 PolarHBondContact O-N 3.02Å
629	L	85.4	Confident	84.7	Confident	117 Å²	117	76.7 Å²	76.7	61%	0.613	41%	0.405	S	S	*	.	H	α-helix	trans	-68.3	-46.8	-178.6	-163.9	121.7	0	0	0	111.6	D626 R627 V631 A632 T633	D626-L629 HydrophobicContact CB-CB 4.35Å; D626-L629 PolarHBondContact O-N 3.4Å; D626-L629 VanDerWaalsContact O-N 3.16Å; R627-L629 VanDerWaalsContact C-N 3.35Å; R627-L629 PolarHBondContact O-N 2.85Å; L629-V631 VanDerWaalsContact C-N 3.33Å; L629-V631 PolarHBondContact O-N 3.16Å; L629-A632 WeakPolarHBondContact O-CB 3.16Å; L629-A632 PolarHBondContact O-N 3.44Å; L629-T633 PolarHBondContact O-N 3.22Å; L629-T633 PolarHBondContact O-OG1 3.24Å
630	K	86.1	Confident	84.7	Confident	86 Å²	86	74.8 Å²	74.8	37%	0.374	40%	0.398	S	S	.	.	H	α-helix	trans	-61.4	-41.6	177.5	-70.1	176.9	-175.9	167.9	0	112.3	A620 S623 H625 D626 R627 T633 V634	A620-K630 HydrophobicContact CB-CB 4.05Å; S623-K630 PolarHBondContact OG-NZ 3.08Å; H625-K630 PolarHBondContact O-NZ 3.17Å; D626-K630 PolarHBondContact O-N 2.89Å; R627-K630 PolarHBondContact O-N 2.64Å; K630-T633 PolarHBondContact O-N 3.42Å; K630-V634 WeakPolarHBondContact O-CG2 3.22Å; K630-V634 PolarHBondContact O-N 2.66Å; K630-V634 VanDerWaalsContact O-N 3.13Å
631	V	85.1	Confident	84.9	Confident	26 Å²	26	81.8 Å²	81.8	16%	0.158	43%	0.429	C	S	.	.	H	α-helix	trans	-62.4	-44.9	176.2	169.3	0	0	0	0	110.2	Y617 A620 K621 R627 L629 T633 V634 I635	Y617-V631 HydrophobicContact CE2-CG1 3.89Å; A620-V631 HydrophobicContact CB-CG2 3.86Å; K621-V631 HydrophobicContact CG-CG2 4.08Å; R627-V631 HydrophobicContact CG-CG2 4.36Å; R627-V631 WeakPolarHBondContact O-CB 3.38Å; R627-V631 WeakPolarHBondContact O-CG2 3.49Å; R627-V631 PolarHBondContact O-N 3.44Å; L629-V631 VanDerWaalsContact C-N 3.33Å; L629-V631 PolarHBondContact O-N 3.16Å; V631-T633 PolarHBondContact O-N 2.94Å; V631-V634 PolarHBondContact O-N 3.31Å; V631-I635 HydrophobicContact CG1-CD1 3.86Å; V631-I635 VanDerWaalsContact O-CG1 3.3Å; V631-I635 WeakPolarHBondContact O-CG1 3.38Å; V631-I635 PolarHBondContact O-N 2.68Å; V631-I635 VanDerWaalsContact O-N 3.07Å
632	A	86.5	Confident	85.6	Confident	43 Å²	43	77.2 Å²	77.2	36%	0.355	41%	0.41	S	S	.	.	H	α-helix	trans	-60.3	-45.2	177	0	0	0	0	0	112.3	S628 L629 V634 I635 E636	S628-A632 WeakPolarHBondContact O-CB 3.41Å; S628-A632 PolarHBondContact O-N 3.02Å; L629-A632 WeakPolarHBondContact O-CB 3.16Å; L629-A632 PolarHBondContact O-N 3.44Å; A632-V634 VanDerWaalsContact C-N 3.34Å; A632-V634 PolarHBondContact O-N 3.42Å; A632-I635 PolarHBondContact O-N 2.97Å; A632-E636 WeakPolarHBondContact O-CG 3.27Å; A632-E636 PolarHBondContact O-N 3.08Å
633	T	89.1	Confident	86.2	Confident	79 Å²	79	74.8 Å²	74.8	49%	0.485	40%	0.395	S	S	.	.	H	α-helix	trans	-62.9	-38.4	179.1	-46.1	0	0	0	0	112.8	L629 K630 V631 E636 S637	L629-T633 PolarHBondContact O-N 3.22Å; L629-T633 PolarHBondContact O-OG1 3.24Å; K630-T633 PolarHBondContact O-N 3.42Å; V631-T633 PolarHBondContact O-N 2.94Å; T633-E636 PolarHBondContact O-N 3.41Å; T633-S637 PolarHBondContact O-N 3.09Å
634	V	91.4	Very high	86.9	Confident	19 Å²	19	74 Å²	74	12%	0.115	39%	0.388	C	S	.	.	H	α-helix	trans	-66.2	-42	175.9	174.2	0	0	0	0	110.6	F613 R616 Y617 A620 K630 V631 A632 S637	F613-V634 HydrophobicContact CD2-CG1 4.02Å; F613-V634 HydrophobicContact CE2-CG1 3.72Å; F613-V634 HydrophobicContact CZ-CG1 4.45Å; R616-V634 HydrophobicContact CB-CG1 4.12Å; R616-V634 HydrophobicContact CB-CG2 4.31Å; Y617-V634 HydrophobicContact CD2-CG1 4.38Å; A620-V634 HydrophobicContact CB-CG2 4.14Å; K630-V634 WeakPolarHBondContact O-CG2 3.22Å; K630-V634 PolarHBondContact O-N 2.66Å; K630-V634 VanDerWaalsContact O-N 3.13Å; V631-V634 PolarHBondContact O-N 3.31Å; A632-V634 VanDerWaalsContact C-N 3.34Å; A632-V634 PolarHBondContact O-N 3.42Å; V634-S637 PolarHBondContact O-N 2.73Å; V634-S637 PolarHBondContact O-OG 3.02Å
635	I	90.3	Very high	87.7	Confident	29 Å²	29	68.2 Å²	68.2	15%	0.149	35%	0.352	C	S	.	.	H	α-helix	trans	-61.5	-48.6	175.6	-66.6	168	0	0	0	110.2	F541 Y617 V631 A632 S637 L638 E639	F541-I635 HydrophobicContact CD1-CD1 3.82Å; F541-I635 HydrophobicContact CD1-CG1 3.94Å; F541-I635 HydrophobicContact CD1-CG2 4.48Å; F541-I635 HydrophobicContact CE1-CD1 4.17Å; F541-I635 HydrophobicContact CE1-CG1 3.85Å; Y617-I635 HydrophobicContact CE2-CD1 4.18Å; Y617-I635 HydrophobicContact CE2-CG1 4.09Å; V631-I635 HydrophobicContact CG1-CD1 3.86Å; V631-I635 VanDerWaalsContact O-CG1 3.3Å; V631-I635 WeakPolarHBondContact O-CG1 3.38Å; V631-I635 PolarHBondContact O-N 2.68Å; V631-I635 VanDerWaalsContact O-N 3.07Å; A632-I635 PolarHBondContact O-N 2.97Å; I635-S637 PolarHBondContact O-N 3.34Å; I635-S637 VanDerWaalsContact O-N 3.12Å; I635-L638 VanDerWaalsContact O-CB 3.24Å; I635-L638 WeakPolarHBondContact O-CB 3.48Å; I635-L638 PolarHBondContact O-N 3.32Å; I635-E639 HydrophobicContact CG2-CG 4.14Å; I635-E639 WeakPolarHBondContact CG2-OE1 3.1Å; I635-E639 WeakPolarHBondContact O-CG 3.34Å; I635-E639 PolarHBondContact O-N 3.07Å
636	E	89.1	Confident	88.4	Confident	91 Å²	91	61.6 Å²	61.6	43%	0.425	32%	0.322	S	S	.	.	H	α-helix	trans	-55.5	-33	178.7	-76.9	175.8	175.7	0	0	113	A632 T633 L638 E639	A632-E636 WeakPolarHBondContact O-CG 3.27Å; A632-E636 PolarHBondContact O-N 3.08Å; T633-E636 PolarHBondContact O-N 3.41Å; E636-L638 PolarHBondContact O-N 2.74Å; E636-E639 PolarHBondContact O-N 3.43Å; E636-E639 VanDerWaalsContact O-N 3.12Å
637	S	89.6	Confident	89.1	Confident	54 Å²	54	56.2 Å²	56.2	38%	0.378	29%	0.293	S	S	.	.	H	α-helix	trans	-62.8	-25.2	176.4	76.6	0	0	0	0	113.8	R616 T633 V634 I635	R616-S637 PolarHBondContact NH1-OG 3.38Å; T633-S637 PolarHBondContact O-N 3.09Å; V634-S637 PolarHBondContact O-N 2.73Å; V634-S637 PolarHBondContact O-OG 3.02Å; I635-S637 PolarHBondContact O-N 3.34Å; I635-S637 VanDerWaalsContact O-N 3.12Å
638	L	90	Very high	89.8	Confident	9 Å²	9	48.8 Å²	48.8	5%	0.047	27%	0.265	C	S	.	.	H	α-helix	trans	-82.1	-33.5	176.3	-164.8	102.5	0	0	0	111.1	F541 I553 F564 K603 L605 F613 I635 E636 M640	F541-L638 HydrophobicContact CE2-CD2 4.12Å; I553-L638 HydrophobicContact CD1-CD1 4.37Å; I553-L638 HydrophobicContact CD1-CD2 4.27Å; F564-L638 HydrophobicContact CB-CD2 4.38Å; F564-L638 HydrophobicContact CD1-CD2 3.4Å; F564-L638 VanDerWaalsContact CD1-CD2 3.4Å; F564-L638 HydrophobicContact CD1-CG 3.97Å; F564-L638 HydrophobicContact CD2-CD2 3.57Å; F564-L638 HydrophobicContact CE1-CD2 3.34Å; F564-L638 HydrophobicContact CE1-CG 4.11Å; F564-L638 HydrophobicContact CE2-CD2 3.51Å; F564-L638 HydrophobicContact CG-CD2 3.51Å; F564-L638 HydrophobicContact CG-CG 4.31Å; F564-L638 HydrophobicContact CZ-CD2 3.38Å; K603-L638 PolarHBondContact NZ-O 2.76Å; K603-L638 VanDerWaalsContact NZ-O 3.09Å; L605-L638 HydrophobicContact CD1-CD1 4.11Å; F613-L638 HydrophobicContact CD1-CD1 4.32Å; F613-L638 HydrophobicContact CD2-CB 4.34Å; F613-L638 HydrophobicContact CD2-CD1 3.69Å; F613-L638 HydrophobicContact CE2-CB 4.07Å; F613-L638 HydrophobicContact CE2-CD1 3.92Å; F613-L638 HydrophobicContact CE2-CG 4.46Å; F613-L638 HydrophobicContact CG-CD1 3.9Å; F613-L638 HydrophobicContact CZ-CD1 4.37Å; I635-L638 VanDerWaalsContact O-CB 3.24Å; I635-L638 WeakPolarHBondContact O-CB 3.48Å; I635-L638 PolarHBondContact O-N 3.32Å; E636-L638 PolarHBondContact O-N 2.74Å; L638-M640 VanDerWaalsContact C-N 3.27Å; L638-M640 PolarHBondContact O-N 3.32Å; L638-M640 VanDerWaalsContact O-N 3.15Å
639	E	90	Very high	90.4	Very high	10 Å²	10	44 Å²	44	5%	0.047	23%	0.232	C	C	.	.	S	Bend	trans	-84.6	32.3	-172	-55.2	179.6	144.4	0	0	114.5	R549 M566 I576 I635 E636	R549-E639 IonicContact CZ-OE1 2.99Å; R549-E639 IonicContact CZ-OE2 2.69Å; R549-E639 VanDerWaalsContact CZ-OE2 3.26Å; R549-E639 VanDerWaalsContact NE-CD 3.25Å; R549-E639 IonicContact NE-OE1 3.15Å; R549-E639 PolarHBondContact NE-OE1 3.26Å; R549-E639 IonicContact NE-OE2 3.44Å; R549-E639 PolarHBondContact NE-OE2 3.08Å; R549-E639 VanDerWaalsContact NE-OE2 3.12Å; R549-E639 IonicContact NH2-OE1 3.87Å; R549-E639 IonicContact NH2-OE2 2.74Å; R549-E639 PolarHBondContact NH2-OE2 3.08Å; M566-E639 HydrophobicContact CE-CB 4.21Å; M566-E639 HydrophobicContact CE-CG 3.49Å; M566-E639 VanDerWaalsContact CE-CG 3.49Å; M566-E639 VanDerWaalsContact CE-OE1 3.26Å; M566-E639 WeakPolarHBondContact CE-OE1 3.48Å; I576-E639 WeakPolarHBondContact CG2-O 3.46Å; I635-E639 HydrophobicContact CG2-CG 4.14Å; I635-E639 WeakPolarHBondContact CG2-OE1 3.1Å; I635-E639 WeakPolarHBondContact O-CG 3.34Å; I635-E639 PolarHBondContact O-N 3.07Å; E636-E639 PolarHBondContact O-N 3.43Å; E636-E639 VanDerWaalsContact O-N 3.12Å
640	M	87.4	Confident	90.6	Very high	102 Å²	102	38.5 Å²	38.5	50%	0.502	20%	0.203	S	C	.	.	S	Bend	trans	-114.4	139.6	178.6	-63.7	-69.8	158.3	0	0	111.1	K603 L638 M642	K603-M640 PolarHBondContact NZ-O 3.22Å; L638-M640 VanDerWaalsContact C-N 3.27Å; L638-M640 PolarHBondContact O-N 3.32Å; L638-M640 VanDerWaalsContact O-N 3.15Å; M640-M642 PolarHBondContact O-N 2.95Å
641	E	88.6	Confident	90.7	Very high	154 Å²	154	35.8 Å²	35.8	72%	0.72	19%	0.192	S	C	*	.	S	Bend	trans	56.1	41.2	174.2	-59	-176.2	158.6	0	0	114.5	I576 Q578	I576-E641 PolarHBondContact O-N 2.72Å; Q578-E641 HydrophobicContact CG-CB 4.4Å; Q578-E641 PolarHBondContact NE2-O 2.9Å; Q578-E641 VanDerWaalsContact NE2-O 3.14Å
642	M	93.3	Very high	90.8	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	19%	0.186	C	C	.	.	B	Isolated β-bridge	trans	-69	144.2	-179.3	-63.5	-96.2	-66.5	0	0	111.8	F564 M566 I576 V577 Q578 S601 K603 M640 L644	F564-M642 HydrophobicContact CD1-CE 3.85Å; F564-M642 HydrophobicContact CD1-SD 3.5Å; F564-M642 WeakPolarHBondContact CD1-SD 3.47Å; F564-M642 HydrophobicContact CE1-CE 3.7Å; F564-M642 HydrophobicContact CE1-SD 3.58Å; F564-M642 VanDerWaalsContact CE1-SD 3.58Å; M566-M642 HydrophobicContact CB-CE 3.34Å; M566-M642 HydrophobicContact CG-CE 4.34Å; M566-M642 HydrophobicContact SD-CE 4.25Å; I576-M642 HydrophobicContact CG2-CB 4.13Å; I576-M642 HydrophobicContact CG2-CG 3.64Å; I576-M642 PolarHBondContact O-N 3.15Å; V577-M642 CarbonylContact C-O 3.58Å; V577-M642 VanDerWaalsContact CA-O 3.31Å; V577-M642 WeakPolarHBondContact CA-O 3.2Å; V577-M642 HydrophobicContact CG1-CB 4.44Å; Q578-M642 PolarHBondContact N-O 3.2Å; S601-M642 WeakPolarHBondContact OG-CE 3.42Å; K603-M642 HydrophobicContact CB-SD 3.64Å; K603-M642 HydrophobicContact CD-SD 4.08Å; M640-M642 PolarHBondContact O-N 2.95Å; M642-L644 PolarHBondContact O-N 3.24Å
643	E	93.5	Very high	90.8	Very high	84 Å²	84	35.2 Å²	35.2	39%	0.393	18%	0.18	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	122.6	175.6	-173.4	-173.5	170.4	0	0	110.3	S601 K602 L645	S601-E643 CarbonylContact C-O 3.51Å; S601-E643 WeakPolarHBondContact CA-O 3.28Å; S601-E643 WeakPolarHBondContact CB-O 3.26Å; K602-E643 WeakPolarHBondContact CE-OE2 3.39Å; K602-E643 HydrophobicContact CG-CB 4.29Å; K602-E643 PolarHBondContact N-O 3.19Å; K602-E643 IonicContact NZ-OE2 2.86Å; K602-E643 WeakPolarHBondContact O-CB 3.4Å; K602-E643 PolarHBondContact O-N 2.73Å; E643-L645 PolarHBondContact O-N 3.03Å
644	L	94.3	Very high	90.9	Very high	12 Å²	12	32.6 Å²	32.6	6%	0.063	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	118.2	175.7	176.1	62.3	0	0	0	110.7	V577 N580 W582 L583 V599 M642	V577-L644 HydrophobicContact CB-CB 4.38Å; N580-L644 HydrophobicContact CB-CD2 4.08Å; W582-L644 HydrophobicContact CH2-CD2 3.88Å; W582-L644 HydrophobicContact CZ2-CD2 3.49Å; W582-L644 VanDerWaalsContact CZ2-CD2 3.49Å; W582-L644 HydrophobicContact CZ2-CG 4.29Å; L583-L644 HydrophobicContact CD1-CD2 4.16Å; V599-L644 HydrophobicContact CG1-CD1 3.31Å; M642-L644 PolarHBondContact O-N 3.24Å
645	L	93.6	Very high	90.9	Very high	9 Å²	9	32.5 Å²	32.5	5%	0.047	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	-59.9	177.3	-68.6	-179.4	0	0	0	111.8	L408 A461 Y565 V600 K602 E643	L408-L645 WeakPolarHBondContact CD2-O 3.43Å; A461-L645 HydrophobicContact CB-CD1 3.5Å; A461-L645 VanDerWaalsContact CB-CD1 3.5Å; Y565-L645 HydrophobicContact CE1-CD1 4.45Å; V600-L645 PolarHBondContact O-N 2.94Å; K602-L645 HydrophobicContact CB-CD1 3.89Å; K602-L645 HydrophobicContact CB-CG 4.33Å; K602-L645 HydrophobicContact CD-CD1 4.04Å; K602-L645 HydrophobicContact CD-CD2 3.83Å; K602-L645 HydrophobicContact CD-CG 4.28Å; K602-L645 HydrophobicContact CG-CD1 3.89Å; K602-L645 HydrophobicContact CG-CD2 3.89Å; K602-L645 HydrophobicContact CG-CG 3.93Å; E643-L645 PolarHBondContact O-N 3.03Å
646	C	94.3	Very high	90.9	Very high	0 Å²	0	34 Å²	34	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.4	165.4	-173.2	71	0	0	0	0	113.1	L406 H407 L408 A458 V600	L406-C646 HydrophobicContact CD1-CB 3.91Å; H407-C646 CarbonylContact O-C 3.46Å; H407-C646 WeakPolarHBondContact O-CA 3.44Å; H407-C646 WeakPolarHBondContact O-CB 3.36Å; L408-C646 HydrophobicContact CD2-CB 3.59Å; A458-C646 HydrophobicContact CB-CB 3.95Å; V600-C646 PolarHBondContact N-O 3.24Å; V600-C646 PolarHBondContact O-N 3.33Å
647	L	94.9	Very high	91.1	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	139.2	163	-48.4	-179.9	0	0	0	109.5	L406 H407 W582 L583 E586 M590 V597 L598 V599	L406-L647 WeakPolarHBondContact CA-O 3.21Å; H407-L647 HydrophobicContact CB-CB 3.96Å; H407-L647 HydrophobicContact CB-CD1 4.4Å; H407-L647 HydrophobicContact CB-CG 4.34Å; H407-L647 PolarHBondContact N-O 3.3Å; H407-L647 PolarHBondContact O-N 2.96Å; W582-L647 HydrophobicContact CE3-CD1 4.44Å; W582-L647 HydrophobicContact CH2-CD1 4.38Å; W582-L647 HydrophobicContact CH2-CG 4.12Å; W582-L647 HydrophobicContact CZ3-CD1 3.6Å; W582-L647 HydrophobicContact CZ3-CG 3.83Å; L583-L647 HydrophobicContact CD1-CD1 4.41Å; L583-L647 HydrophobicContact CD1-CD2 3.57Å; L583-L647 HydrophobicContact CD1-CG 4.49Å; E586-L647 HydrophobicContact CB-CD1 4.14Å; M590-L647 HydrophobicContact SD-CB 4.23Å; M590-L647 HydrophobicContact SD-CD1 4.32Å; V597-L647 HydrophobicContact CG1-CB 4.29Å; L598-L647 WeakPolarHBondContact O-CA 3.42Å; V599-L647 HydrophobicContact CB-CD2 4.12Å; V599-L647 HydrophobicContact CG1-CD2 4.02Å; V599-L647 HydrophobicContact CG2-CD2 3.74Å
648	T	94.3	Very high	91.4	Very high	1 Å²	1	31.2 Å²	31.2	1%	0.006	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	139.5	171.6	64.2	0	0	0	0	109.9	F403 R405 L406 I462 L504 V597 L598 V600	F403-T648 HydrophobicContact CE2-CG2 3.83Å; F403-T648 HydrophobicContact CZ-CG2 4.42Å; R405-T648 CarbonylContact O-C 3.57Å; L406-T648 HydrophobicContact CD1-CG2 4.29Å; I462-T648 HydrophobicContact CD1-CG2 3.58Å; I462-T648 HydrophobicContact CG1-CG2 4.19Å; L504-T648 HydrophobicContact CD2-CG2 4.04Å; V597-T648 VanDerWaalsContact CA-O 3.28Å; V597-T648 WeakPolarHBondContact CA-O 3.44Å; L598-T648 WeakPolarHBondContact CB-OG1 3.24Å; L598-T648 PolarHBondContact N-O 3.03Å; L598-T648 PolarHBondContact O-N 3.2Å; V600-T648 HydrophobicContact CG2-CG2 4.19Å
649	G	92.1	Very high	91.5	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	113	176.7	0	0	0	0	0	110.1	R404 R405 R596	R404-G649 PolarHBondContact N-O 3.12Å; R405-G649 PolarHBondContact N-O 3.39Å; R405-G649 PolarHBondContact O-N 3.29Å; R596-G649 WeakPolarHBondContact O-CA 3.44Å
650	V	90.3	Very high	91.7	Very high	1 Å²	1	37.7 Å²	37.7	1%	0.006	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	127.9	177.6	-179	0	0	0	0	109.2	M401 F403 L504 R596	M401-V650 HydrophobicContact CB-CG1 3.78Å; F403-V650 HydrophobicContact CD2-CG2 4.46Å; L504-V650 HydrophobicContact CD2-CG2 4.4Å; R596-V650 WeakPolarHBondContact CB-O 3.37Å; R596-V650 PolarHBondContact N-O 2.9Å; R596-V650 PolarHBondContact O-N 3.28Å
651	E	87.8	Confident	92.1	Very high	28 Å²	28	33.2 Å²	33.2	13%	0.131	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	130.3	175.7	-173.4	-177.1	-163.6	0	0	110.4	M401 V402 R404 L595 Q653	M401-E651 WeakPolarHBondContact CA-O 3.38Å; V402-E651 PolarHBondContact N-O 2.99Å; V402-E651 PolarHBondContact O-N 2.85Å; R404-E651 HydrophobicContact CG-CB 3.62Å; R404-E651 IonicContact CZ-OE2 3.49Å; R404-E651 IonicContact NE-OE2 2.68Å; R404-E651 PolarHBondContact NE-OE2 3.45Å; R404-E651 IonicContact NH2-OE2 3.42Å; R404-E651 PolarHBondContact NH2-OE2 2.94Å; L595-E651 HydrophobicContact CD2-CB 3.82Å; L595-E651 HydrophobicContact CD2-CG 4.44Å; E651-Q653 PolarHBondContact O-N 2.9Å
652	D	86.2	Confident	92.4	Very high	8 Å²	8	26.2 Å²	26.2	4%	0.043	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	101.4	165.1	-173.9	-3.6	0	0	0	107.6	K392 T397 M401 R596 L654	K392-D652 IonicContact NZ-OD2 3.59Å; K392-D652 PolarHBondContact NZ-OD2 2.86Å; K392-D652 VanDerWaalsContact NZ-OD2 3.09Å; T397-D652 WeakPolarHBondContact CB-OD1 3.31Å; T397-D652 HydrophobicContact CG2-CB 4.47Å; T397-D652 WeakPolarHBondContact CG2-OD1 3.39Å; T397-D652 PolarHBondContact OG1-OD1 3.03Å; M401-D652 HydrophobicContact CE-CB 4.13Å; M401-D652 HydrophobicContact SD-CB 3.72Å; R596-D652 IonicContact NH2-OD2 3.83Å; R596-D652 PolarHBondContact NH2-OD2 3.25Å; D652-L654 PolarHBondContact O-N 3.06Å
653	Q	87.6	Confident	92.4	Very high	50 Å²	50	30 Å²	30	23%	0.234	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.4	132.3	-170.2	-72.7	-161.4	16.6	0	0	112.2	T397 Q398 E400 V402 E651	T397-Q653 CarbonylContact C-O 3.54Å; T397-Q653 VanDerWaalsContact CA-O 3.24Å; T397-Q653 WeakPolarHBondContact CA-O 3.45Å; T397-Q653 WeakPolarHBondContact CB-O 3.38Å; Q398-Q653 PolarHBondContact N-O 2.83Å; E400-Q653 PolarHBondContact O-N 3.11Å; E400-Q653 VanDerWaalsContact O-N 3.11Å; V402-Q653 HydrophobicContact CB-CG 4.43Å; V402-Q653 HydrophobicContact CG2-CG 4.11Å; E651-Q653 PolarHBondContact O-N 2.9Å
654	L	91	Very high	92.4	Very high	23 Å²	23	27.7 Å²	27.7	12%	0.12	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.8	152.7	171.7	-63.1	177.5	0	0	0	111.3	L396 T397 D652 V658 R659 T686 N689 A690	L396-L654 CarbonylContact O-C 3.57Å; L396-L654 WeakPolarHBondContact O-CA 3.18Å; T397-L654 HydrophobicContact CG2-CD2 4.03Å; D652-L654 PolarHBondContact O-N 3.06Å; L654-V658 HydrophobicContact CB-CB 4.46Å; L654-R659 HydrophobicContact CD1-CG 4.08Å; L654-T686 HydrophobicContact CD2-CG2 4.11Å; L654-N689 HydrophobicContact CD1-CB 4.29Å; L654-N689 WeakPolarHBondContact CD1-O 3.48Å; L654-A690 HydrophobicContact CD1-CB 4.31Å; L654-A690 HydrophobicContact CD2-CB 4.27Å
655	Q	90.9	Very high	92.4	Very high	18 Å²	18	27.1 Å²	27.1	8%	0.084	14%	0.137	C	C	.	.	P	Polyproline II helix	trans	-61.9	157.5	167	-58.2	-165.3	5.3	0	0	111.5	G394 T395 L396 Q398 D657 V658	G394-Q655 PolarHBondContact O-NE2 3.45Å; T395-Q655 PolarHBondContact O-NE2 3.45Å; T395-Q655 VanDerWaalsContact O-NE2 3.09Å; L396-Q655 PolarHBondContact O-N 3.42Å; Q398-Q655 HydrophobicContact CG-CB 4.21Å; Q398-Q655 HydrophobicContact CG-CG 3.76Å; Q655-D657 PolarHBondContact O-N 3.11Å; Q655-V658 HydrophobicContact CB-CG2 3.59Å; Q655-V658 VanDerWaalsContact O-CG2 3.26Å; Q655-V658 WeakPolarHBondContact O-CG2 3.47Å; Q655-V658 PolarHBondContact O-N 3.17Å
656	T	91.4	Very high	92.3	Very high	60 Å²	60	31.8 Å²	31.8	37%	0.368	16%	0.155	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.1	132	177.4	-42.7	0	0	0	0	110.3	V658	T656-V658 PolarHBondContact O-N 3.19Å
657	D	92.8	Very high	92.3	Very high	86 Å²	86	35.5 Å²	35.5	46%	0.46	17%	0.174	S	C	.	.	T	Hydrogen-bonded Turn	trans	56	26.9	176.6	-53	-36.9	0	0	0	115.9	Q655 P660 T661 K821	Q655-D657 PolarHBondContact O-N 3.11Å; D657-P660 HydrophobicContact CB-CG 4.45Å; D657-P660 WeakPolarHBondContact O-CD 3.33Å; D657-T661 VanDerWaalsContact O-CB 3.26Å; D657-T661 WeakPolarHBondContact O-CB 3.33Å; D657-T661 PolarHBondContact O-N 3.22Å; D657-T661 VanDerWaalsContact O-N 3.11Å; D657-T661 PolarHBondContact O-OG1 3.16Å; D657-K821 HydrophobicContact CB-CB 3.94Å; D657-K821 HydrophobicContact CB-CD 4.27Å
658	V	94.5	Very high	92.2	Very high	1 Å²	1	35.5 Å²	35.5	1%	0.006	17%	0.174	C	C	.	.	H	α-helix	trans	-61.5	-46.9	173	167.8	0	0	0	0	111.6	L396 L654 Q655 T656 T661 L662 A690 F820	L396-V658 HydrophobicContact CD2-CG1 3.7Å; L654-V658 HydrophobicContact CB-CB 4.46Å; Q655-V658 HydrophobicContact CB-CG2 3.59Å; Q655-V658 VanDerWaalsContact O-CG2 3.26Å; Q655-V658 WeakPolarHBondContact O-CG2 3.47Å; Q655-V658 PolarHBondContact O-N 3.17Å; T656-V658 PolarHBondContact O-N 3.19Å; V658-T661 PolarHBondContact O-N 2.9Å; V658-L662 HydrophobicContact CG1-CD1 3.85Å; V658-L662 HydrophobicContact CG1-CG 4.33Å; V658-L662 WeakPolarHBondContact O-CG 3.48Å; V658-L662 PolarHBondContact O-N 2.94Å; V658-A690 HydrophobicContact CG1-CB 4.3Å; V658-F820 HydrophobicContact CB-CD1 4.43Å; V658-F820 HydrophobicContact CG1-CD1 4.37Å; V658-F820 HydrophobicContact CG1-CE1 4.46Å; V658-F820 HydrophobicContact CG2-CB 4.19Å; V658-F820 HydrophobicContact CG2-CD1 3.94Å; V658-F820 HydrophobicContact CG2-CG 4.31Å
659	R	92.9	Very high	92	Very high	95 Å²	95	36.8 Å²	36.8	36%	0.358	19%	0.188	S	C	.	.	H	α-helix	trans	-60.3	-53.7	-178.2	-52.9	169.6	177.3	170	5.4	111.9	L654 T661 L662 E663 N689	L654-R659 HydrophobicContact CD1-CG 4.08Å; R659-T661 VanDerWaalsContact C-N 3.26Å; R659-T661 PolarHBondContact O-N 3Å; R659-L662 PolarHBondContact O-N 2.92Å; R659-E663 WeakPolarHBondContact O-CG 3.43Å; R659-E663 PolarHBondContact O-N 3.3Å; R659-N689 PolarHBondContact NE-O 3.06Å
660	P	94.6	Very high	92.1	Very high	60 Å²	60	37 Å²	37	39%	0.39	19%	0.189	S	C	.	.	H	α-helix	trans	-59.3	-37.1	175.7	-22.8	33.9	0	0	0	112.9	D657 E663 I664	D657-P660 HydrophobicContact CB-CG 4.45Å; D657-P660 WeakPolarHBondContact O-CD 3.33Å; P660-E663 PolarHBondContact O-N 2.97Å; P660-I664 VanDerWaalsContact O-CG1 3.24Å; P660-I664 WeakPolarHBondContact O-CG1 3.21Å; P660-I664 PolarHBondContact O-N 3.4Å
661	T	95.3	Very high	92.3	Very high	7 Å²	7	41.1 Å²	41.1	4%	0.043	20%	0.204	C	C	.	.	H	α-helix	trans	-65	-45.3	179.6	-58.6	0	0	0	0	111.4	D657 V658 R659 E663 I664 L665 F820 K821	D657-T661 VanDerWaalsContact O-CB 3.26Å; D657-T661 WeakPolarHBondContact O-CB 3.33Å; D657-T661 PolarHBondContact O-N 3.22Å; D657-T661 VanDerWaalsContact O-N 3.11Å; D657-T661 PolarHBondContact O-OG1 3.16Å; V658-T661 PolarHBondContact O-N 2.9Å; R659-T661 VanDerWaalsContact C-N 3.26Å; R659-T661 PolarHBondContact O-N 3Å; T661-E663 VanDerWaalsContact C-N 3.32Å; T661-E663 PolarHBondContact O-N 2.71Å; T661-I664 PolarHBondContact O-N 3.1Å; T661-L665 HydrophobicContact CG2-CD1 4.11Å; T661-L665 WeakPolarHBondContact O-CG 3.38Å; T661-L665 PolarHBondContact O-N 2.72Å; T661-F820 HydrophobicContact CG2-CD1 4.05Å; T661-F820 HydrophobicContact CG2-CE1 3.81Å; T661-K821 WeakPolarHBondContact OG1-CA 3.36Å
662	L	94.8	Very high	92.6	Very high	7 Å²	7	40.1 Å²	40.1	4%	0.037	20%	0.2	C	C	.	.	H	α-helix	trans	-63.4	-37.5	176.3	-72.3	175.6	0	0	0	112.2	L396 V658 R659 L665 R666 V672 A690 F820	L396-L662 HydrophobicContact CD2-CD1 4.32Å; V658-L662 HydrophobicContact CG1-CD1 3.85Å; V658-L662 HydrophobicContact CG1-CG 4.33Å; V658-L662 WeakPolarHBondContact O-CG 3.48Å; V658-L662 PolarHBondContact O-N 2.94Å; R659-L662 PolarHBondContact O-N 2.92Å; L662-L665 HydrophobicContact CD2-CD1 4.34Å; L662-L665 PolarHBondContact O-N 3.09Å; L662-R666 WeakPolarHBondContact O-CB 3.43Å; L662-R666 PolarHBondContact O-N 3.38Å; L662-V672 HydrophobicContact CD2-CG1 3.93Å; L662-V672 HydrophobicContact CD2-CG2 4.24Å; L662-A690 HydrophobicContact CD1-CB 3.82Å; L662-A690 WeakPolarHBondContact CD1-O 3.41Å; L662-F820 HydrophobicContact CD2-CE1 3.96Å; L662-F820 HydrophobicContact CD2-CZ 3.81Å; L662-F820 HydrophobicContact CG-CE1 4.07Å; L662-F820 HydrophobicContact CG-CZ 4.4Å
663	E	93.1	Very high	93.1	Very high	79 Å²	79	40 Å²	40	37%	0.369	20%	0.199	S	C	.	.	H	α-helix	trans	-62.9	-45.8	173.6	-72.2	175.2	179.8	0	0	112.2	R659 P660 T661 L665 R666 N667	R659-E663 WeakPolarHBondContact O-CG 3.43Å; R659-E663 PolarHBondContact O-N 3.3Å; P660-E663 PolarHBondContact O-N 2.97Å; T661-E663 VanDerWaalsContact C-N 3.32Å; T661-E663 PolarHBondContact O-N 2.71Å; E663-L665 VanDerWaalsContact C-N 3.32Å; E663-L665 PolarHBondContact O-N 3.36Å; E663-R666 PolarHBondContact O-N 2.88Å; E663-N667 WeakPolarHBondContact O-CB 3.24Å; E663-N667 PolarHBondContact O-N 2.96Å; E663-N667 PolarHBondContact O-ND2 3.08Å
664	I	94.4	Very high	93.5	Very high	36 Å²	36	37.6 Å²	37.6	19%	0.185	19%	0.188	C	C	.	.	H	α-helix	trans	-57.8	-45.6	175.5	-71.1	168.3	0	0	0	110.5	P660 T661 N667 A668 M828 M903 P906	P660-I664 VanDerWaalsContact O-CG1 3.24Å; P660-I664 WeakPolarHBondContact O-CG1 3.21Å; P660-I664 PolarHBondContact O-N 3.4Å; T661-I664 PolarHBondContact O-N 3.1Å; I664-N667 PolarHBondContact O-N 2.97Å; I664-A668 WeakPolarHBondContact O-CB 3.44Å; I664-A668 PolarHBondContact O-N 2.82Å; I664-M828 HydrophobicContact CG2-CG 3.8Å; I664-M828 HydrophobicContact CG2-SD 4.4Å; I664-M903 HydrophobicContact CD1-CE 4.02Å; I664-P906 HydrophobicContact CG2-CB 3.96Å; I664-P906 HydrophobicContact CG2-CG 4.41Å; I664-P906 WeakPolarHBondContact O-CB 3.39Å
665	L	94.3	Very high	93.6	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-64.5	-42.1	179.6	-66	167.3	0	0	0	111.9	L388 T661 L662 E663 A668 G669 I670 V672 F820 L823 L827 M828	L388-L665 HydrophobicContact CD2-CD1 3.6Å; T661-L665 HydrophobicContact CG2-CD1 4.11Å; T661-L665 WeakPolarHBondContact O-CG 3.38Å; T661-L665 PolarHBondContact O-N 2.72Å; L662-L665 HydrophobicContact CD2-CD1 4.34Å; L662-L665 PolarHBondContact O-N 3.09Å; E663-L665 VanDerWaalsContact C-N 3.32Å; E663-L665 PolarHBondContact O-N 3.36Å; L665-A668 WeakPolarHBondContact O-CB 3.49Å; L665-A668 PolarHBondContact O-N 2.78Å; L665-G669 PolarHBondContact O-N 2.99Å; L665-I670 HydrophobicContact CB-CB 4.49Å; L665-I670 HydrophobicContact CD2-CD1 3.74Å; L665-I670 WeakPolarHBondContact O-CB 3.35Å; L665-I670 PolarHBondContact O-N 3.18Å; L665-V672 HydrophobicContact CB-CG2 4.45Å; L665-F820 HydrophobicContact CD1-CZ 4.49Å; L665-L823 HydrophobicContact CD1-CD2 4.19Å; L665-L827 HydrophobicContact CD2-CD1 3.67Å; L665-M828 HydrophobicContact CD2-CE 4.16Å
666	R	92.1	Very high	93.5	Very high	108 Å²	108	35.6 Å²	35.6	41%	0.408	18%	0.178	S	C	.	.	H	α-helix	trans	-63.2	-44.5	175.7	-174	174.1	65.4	176.8	-2.2	111.3	L662 E663 A668 G669	L662-R666 WeakPolarHBondContact O-CB 3.43Å; L662-R666 PolarHBondContact O-N 3.38Å; E663-R666 PolarHBondContact O-N 2.88Å; R666-A668 VanDerWaalsContact C-N 3.27Å; R666-A668 PolarHBondContact O-N 3.35Å; R666-G669 WeakPolarHBondContact O-CA 3.43Å; R666-G669 PolarHBondContact O-N 2.75Å
667	N	92.7	Very high	92.9	Very high	78 Å²	78	34.8 Å²	34.8	42%	0.417	18%	0.182	S	C	.	.	H	α-helix	trans	-66	-30.2	177.6	-66.7	-13.4	0	0	0	112.1	E663 I664 G669 P906	E663-N667 WeakPolarHBondContact O-CB 3.24Å; E663-N667 PolarHBondContact O-N 2.96Å; E663-N667 PolarHBondContact O-ND2 3.08Å; I664-N667 PolarHBondContact O-N 2.97Å; N667-G669 PolarHBondContact O-N 3.2Å; N667-P906 HydrophobicContact CB-CB 4.37Å; N667-P906 HydrophobicContact CB-CG 3.6Å
668	A	92.8	Very high	92	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	17%	0.17	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68	-9.6	170.5	0	0	0	0	0	114.1	I664 L665 R666 I670 M828 P906 Y909 K910	I664-A668 WeakPolarHBondContact O-CB 3.44Å; I664-A668 PolarHBondContact O-N 2.82Å; L665-A668 WeakPolarHBondContact O-CB 3.49Å; L665-A668 PolarHBondContact O-N 2.78Å; R666-A668 VanDerWaalsContact C-N 3.27Å; R666-A668 PolarHBondContact O-N 3.35Å; A668-I670 HydrophobicContact CB-CD1 4.31Å; A668-I670 HydrophobicContact CB-CG1 4.31Å; A668-M828 HydrophobicContact CB-CE 3.42Å; A668-M828 VanDerWaalsContact CB-CE 3.42Å; A668-M828 HydrophobicContact CB-SD 3.63Å; A668-P906 WeakPolarHBondContact CA-O 3.02Å; A668-P906 HydrophobicContact CB-CB 4.07Å; A668-Y909 HydrophobicContact CB-CD1 4.03Å; A668-Y909 HydrophobicContact CB-CG 4.17Å; A668-K910 WeakPolarHBondContact O-CA 3.22Å; A668-K910 WeakPolarHBondContact O-CB 3.42Å; A668-K910 PolarHBondContact O-N 2.77Å
669	G	91.6	Very high	90.8	Very high	28 Å²	28	35.4 Å²	35.4	29%	0.289	18%	0.182	S	C	.	.	T	Hydrogen-bonded Turn	trans	84.3	18.2	-177.3	0	0	0	0	0	114	L665 R666 N667	L665-G669 PolarHBondContact O-N 2.99Å; R666-G669 WeakPolarHBondContact O-CA 3.43Å; R666-G669 PolarHBondContact O-N 2.75Å; N667-G669 PolarHBondContact O-N 3.2Å
670	I	94.2	Very high	90.2	Very high	5 Å²	5	32.9 Å²	32.9	3%	0.026	18%	0.176	C	C	.	.	P	Polyproline II helix	trans	-87	129.5	174.4	-56.8	171.8	0	0	0	108.5	I385 S386 L388 L665 A668 L827 M828 Y909	I385-I670 HydrophobicContact CG2-CG2 4.41Å; S386-I670 WeakPolarHBondContact O-CA 3.11Å; L388-I670 HydrophobicContact CB-CG2 3.72Å; L665-I670 HydrophobicContact CB-CB 4.49Å; L665-I670 HydrophobicContact CD2-CD1 3.74Å; L665-I670 WeakPolarHBondContact O-CB 3.35Å; L665-I670 PolarHBondContact O-N 3.18Å; A668-I670 HydrophobicContact CB-CD1 4.31Å; A668-I670 HydrophobicContact CB-CG1 4.31Å; I670-L827 HydrophobicContact CD1-CD1 4.08Å; I670-M828 HydrophobicContact CD1-CE 3.87Å; I670-Y909 HydrophobicContact CD1-CD1 4.34Å; I670-Y909 HydrophobicContact CD1-CE1 3.86Å; I670-Y909 HydrophobicContact CG1-CD1 4.37Å; I670-Y909 HydrophobicContact CG1-CE1 3.98Å
671	R	93.4	Very high	89.4	Confident	86 Å²	86	34.7 Å²	34.7	33%	0.325	18%	0.179	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	124.6	174.6	-68.5	178.6	174.2	178.5	-16.8	109.4	S386 Y387 L388 C749	S386-R671 PolarHBondContact O-N 3.18Å; Y387-R671 CarbonylContact C-O 3.56Å; Y387-R671 WeakPolarHBondContact CA-O 3.5Å; Y387-R671 HydrophobicContact CD1-CB 3.71Å; Y387-R671 HydrophobicContact CE1-CB 3.8Å; Y387-R671 HydrophobicContact CE1-CG 4.29Å; Y387-R671 PolarHBondContact OH-NH1 3.41Å; L388-R671 PolarHBondContact N-O 2.89Å; R671-C749 VanDerWaalsContact CZ-O 3.26Å; R671-C749 PolarHBondContact NH1-O 3.18Å
672	V	95	Very high	88.5	Confident	8 Å²	8	35.7 Å²	35.7	5%	0.048	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	125.6	-176.3	-173.6	0	0	0	0	110	L388 T390 L662 L665 L692	L388-V672 HydrophobicContact CB-CG2 4.27Å; L388-V672 HydrophobicContact CD2-CG1 4.34Å; L388-V672 HydrophobicContact CD2-CG2 4.24Å; L388-V672 CarbonylContact O-C 3.6Å; L388-V672 VanDerWaalsContact O-CA 3.29Å; L388-V672 WeakPolarHBondContact O-CA 3.24Å; T390-V672 HydrophobicContact CG2-CG1 3.97Å; L662-V672 HydrophobicContact CD2-CG1 3.93Å; L662-V672 HydrophobicContact CD2-CG2 4.24Å; L665-V672 HydrophobicContact CB-CG2 4.45Å; V672-L692 HydrophobicContact CB-CD1 3.62Å; V672-L692 HydrophobicContact CG1-CD1 3.72Å
673	W	96.1	Very high	88.1	Confident	4 Å²	4	35.3 Å²	35.3	2%	0.015	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	127.8	176.6	-72.2	24.2	0	0	0	108.4	L388 L389 T390 M745 A748 V754 I767 L771	L388-W673 PolarHBondContact O-N 3.03Å; L389-W673 CarbonylContact C-O 3.59Å; L389-W673 WeakPolarHBondContact CA-O 3.47Å; L389-W673 HydrophobicContact CG-CB 4.45Å; T390-W673 PolarHBondContact N-O 3.34Å; W673-M745 HydrophobicContact CH2-CE 4.12Å; W673-M745 HydrophobicContact CZ3-CE 4.4Å; W673-A748 HydrophobicContact CH2-CB 3.85Å; W673-A748 HydrophobicContact CZ2-CB 4.29Å; W673-A748 WeakPolarHBondContact CZ2-O 3.33Å; W673-V754 CarbonylContact C-O 3.56Å; W673-V754 VanDerWaalsContact CA-O 3.29Å; W673-V754 WeakPolarHBondContact CA-O 3.35Å; W673-V754 HydrophobicContact CD2-CB 3.72Å; W673-V754 HydrophobicContact CD2-CG1 4.3Å; W673-V754 HydrophobicContact CD2-CG2 3.98Å; W673-V754 HydrophobicContact CE3-CB 4.15Å; W673-V754 HydrophobicContact CE3-CG1 4.22Å; W673-V754 HydrophobicContact CG-CB 3.88Å; W673-V754 HydrophobicContact CG-CG2 4.38Å; W673-V754 HydrophobicContact CH2-CG2 4.29Å; W673-V754 HydrophobicContact CZ2-CB 4.32Å; W673-V754 HydrophobicContact CZ2-CG2 3.69Å; W673-V754 HydrophobicContact CZ3-CG1 4.44Å; W673-I767 HydrophobicContact CE3-CG2 3.91Å; W673-I767 HydrophobicContact CZ3-CG2 3.8Å; W673-L771 HydrophobicContact CD2-CD1 4.23Å; W673-L771 HydrophobicContact CE3-CD1 3.85Å; W673-L771 HydrophobicContact CH2-CD1 4.35Å; W673-L771 HydrophobicContact CH2-CD2 3.66Å; W673-L771 HydrophobicContact CH2-CG 4.29Å; W673-L771 HydrophobicContact CZ2-CD2 3.93Å; W673-L771 HydrophobicContact CZ3-CD1 3.91Å; W673-L771 HydrophobicContact CZ3-CD2 4.02Å; W673-L771 HydrophobicContact CZ3-CG 4.15Å
674	M	95.6	Very high	87.7	Confident	0 Å²	0	32.2 Å²	32.2	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	120.2	175.7	-176.5	-175	-61.4	0	0	108.9	T390 K392 L396 T686 A687 L692 V754 V755 C756	T390-M674 WeakPolarHBondContact O-CA 3.48Å; K392-M674 HydrophobicContact CB-CG 4.32Å; K392-M674 HydrophobicContact CB-SD 4.04Å; K392-M674 HydrophobicContact CG-SD 4.05Å; L396-M674 HydrophobicContact CD1-CE 3.36Å; L396-M674 HydrophobicContact CD1-CG 4.47Å; L396-M674 HydrophobicContact CD1-SD 4.4Å; M674-T686 HydrophobicContact CE-CG2 4.46Å; M674-A687 HydrophobicContact CE-CB 3.98Å; M674-A687 HydrophobicContact SD-CB 4.45Å; M674-L692 HydrophobicContact CB-CD2 3.72Å; M674-L692 HydrophobicContact CE-CD2 3.73Å; M674-V754 PolarHBondContact N-O 3.25Å; M674-V755 HydrophobicContact CB-CG1 4.37Å; M674-V755 HydrophobicContact CB-CG2 4.32Å; M674-V755 CarbonylContact O-C 3.5Å; M674-V755 WeakPolarHBondContact O-CA 3.44Å; M674-V755 HydrophobicContact SD-CG1 4.29Å; M674-C756 PolarHBondContact O-N 3.1Å
675	L	93.8	Very high	87.1	Confident	0 Å²	0	31.3 Å²	31.3	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	109.3	178.1	-57.9	-172.1	0	0	0	109.2	L389 T390 C756 K764 I767 M791	L389-L675 HydrophobicContact CB-CD1 4.35Å; L389-L675 HydrophobicContact CD2-CD1 3.45Å; L389-L675 VanDerWaalsContact CD2-CD1 3.45Å; L389-L675 HydrophobicContact CD2-CG 4.13Å; T390-L675 PolarHBondContact O-N 3.02Å; L675-C756 HydrophobicContact CD2-CB 3.56Å; L675-C756 VanDerWaalsContact CD2-SG 3.57Å; L675-K764 HydrophobicContact CB-CD 4.2Å; L675-K764 HydrophobicContact CB-CG 4.13Å; L675-K764 HydrophobicContact CD1-CB 4.11Å; L675-K764 HydrophobicContact CD1-CG 4.31Å; L675-K764 WeakPolarHBondContact O-CE 3.41Å; L675-K764 PolarHBondContact O-NZ 3.43Å; L675-I767 HydrophobicContact CD1-CB 4.31Å; L675-I767 HydrophobicContact CD1-CD1 4.02Å; L675-I767 HydrophobicContact CD1-CG2 4.31Å; L675-I767 HydrophobicContact CD2-CD1 3.67Å; L675-I767 HydrophobicContact CD2-CG2 4.43Å; L675-M791 HydrophobicContact CB-SD 4.42Å; L675-M791 HydrophobicContact CD1-SD 3.79Å
676	T	88.4	Confident	86.8	Confident	0 Å²	0	31.5 Å²	31.5	0%	0	17%	0.167	C	C	.	.			trans	-129.6	149.9	-174.4	-175.7	0	0	0	0	112.6	K392 D678 A683 C756 C757 R758 C759	K392-T676 HydrophobicContact CB-CG2 4.45Å; T676-D678 HydrophobicContact CG2-CB 3.98Å; T676-D678 WeakPolarHBondContact OG1-CB 3.41Å; T676-D678 PolarHBondContact OG1-N 3.1Å; T676-D678 VanDerWaalsContact OG1-N 3.07Å; T676-A683 HydrophobicContact CG2-CB 3.59Å; T676-C756 PolarHBondContact N-O 3.32Å; T676-C757 HydrophobicContact CG2-CB 4.45Å; T676-C757 CarbonylContact O-C 3.37Å; T676-C757 WeakPolarHBondContact O-CA 3.3Å; T676-R758 PolarHBondContact O-N 3.4Å; T676-C759 PolarHBondContact O-N 3.24Å
677	G	77.6	Confident	86.7	Confident	43 Å²	43	26.4 Å²	26.4	44%	0.443	15%	0.148	S	C	.	.	S	Bend	trans	-74.1	-12.6	167.2	0	0	0	0	0	112.9	R758	G677-R758 WeakPolarHBondContact O-CA 3.28Å
678	D	74.1	Confident	86.4	Confident	38 Å²	38	26.2 Å²	26.2	20%	0.203	14%	0.144	C	C	.	.	S	Bend	trans	-67.9	162.4	-176.2	-78.7	12.1	0	0	0	113.3	K392 T676 T682 C757 R758	K392-D678 VanDerWaalsContact CD-OD2 3.27Å; K392-D678 WeakPolarHBondContact CD-OD2 3.37Å; K392-D678 WeakPolarHBondContact CE-OD2 3.39Å; K392-D678 IonicContact NZ-OD2 2.74Å; K392-D678 PolarHBondContact NZ-OD2 3Å; T676-D678 HydrophobicContact CG2-CB 3.98Å; T676-D678 WeakPolarHBondContact OG1-CB 3.41Å; T676-D678 PolarHBondContact OG1-N 3.1Å; T676-D678 VanDerWaalsContact OG1-N 3.07Å; D678-T682 HydrophobicContact CB-CG2 4.43Å; D678-T682 WeakPolarHBondContact OD2-CG2 3.47Å; D678-C757 VanDerWaalsContact O-CB 3.23Å; D678-C757 WeakPolarHBondContact O-CB 3.01Å; D678-R758 PolarHBondContact O-N 3.11Å
679	K	70.5	Confident	86.2	Confident	61 Å²	61	26.9 Å²	26.9	27%	0.265	15%	0.147	S	C	.	.			trans	-65.4	159.6	173.2	-56.4	-178.6	-170.1	177.4	0	111.1	Y545 E681 T682 A683	Y545-K679 HydrophobicContact CD2-CD 4.49Å; Y545-K679 HydrophobicContact CE2-CD 4.16Å; K679-E681 VanDerWaalsContact C-N 3.31Å; K679-E681 WeakPolarHBondContact CB-OE2 3.46Å; K679-E681 PolarHBondContact O-N 2.85Å; K679-T682 PolarHBondContact O-N 2.82Å; K679-A683 WeakPolarHBondContact O-CB 3.45Å; K679-A683 PolarHBondContact O-N 2.81Å
680	L	80.2	Confident	86.1	Confident	43 Å²	43	25.6 Å²	25.6	23%	0.225	13%	0.133	C	C	.	.	H	α-helix	trans	-59	-41.8	-175.5	-178.8	126.5	0	0	0	112.5	T684 I701 V727	L680-T684 VanDerWaalsContact O-CB 3.29Å; L680-T684 WeakPolarHBondContact O-CB 3.3Å; L680-T684 PolarHBondContact O-N 2.88Å; L680-T684 PolarHBondContact O-OG1 3.21Å; L680-I701 HydrophobicContact CD1-CG2 3.91Å; L680-I701 HydrophobicContact CD2-CG2 4.26Å; L680-V727 HydrophobicContact CD1-CG1 3.74Å; L680-V727 HydrophobicContact CG-CG1 4.03Å
681	E	77.4	Confident	85.8	Confident	97 Å²	97	27.2 Å²	27.2	45%	0.453	14%	0.141	S	C	.	.	H	α-helix	trans	-64.8	-50.2	-177.5	-54.8	87.2	166	0	0	110.6	K548 K679 T684 C685	K548-E681 IonicContact NZ-OE1 3.88Å; K679-E681 VanDerWaalsContact C-N 3.31Å; K679-E681 WeakPolarHBondContact CB-OE2 3.46Å; K679-E681 PolarHBondContact O-N 2.85Å; E681-T684 PolarHBondContact O-N 3.35Å; E681-C685 VanDerWaalsContact O-CB 3.25Å; E681-C685 WeakPolarHBondContact O-CB 3.38Å; E681-C685 PolarHBondContact O-N 2.86Å
682	T	77.5	Confident	85.7	Confident	28 Å²	28	23.9 Å²	23.9	17%	0.172	13%	0.129	C	C	.	.	H	α-helix	trans	-62.1	-47.2	177.2	-52.2	0	0	0	0	111.7	R596 D678 K679 T684 C685 T686	R596-T682 VanDerWaalsContact NH2-CG2 3.32Å; D678-T682 HydrophobicContact CB-CG2 4.43Å; D678-T682 WeakPolarHBondContact OD2-CG2 3.47Å; K679-T682 PolarHBondContact O-N 2.82Å; T682-T684 VanDerWaalsContact C-N 3.32Å; T682-T684 PolarHBondContact O-N 3.48Å; T682-C685 WeakPolarHBondContact O-CB 3.43Å; T682-C685 PolarHBondContact O-N 3.41Å; T682-T686 PolarHBondContact O-N 3.24Å; T682-T686 PolarHBondContact O-OG1 2.96Å
683	A	84.5	Confident	85.3	Confident	0 Å²	0	23.6 Å²	23.6	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-60.9	-42.2	179.1	0	0	0	0	0	111.9	T676 K679 A687 V755 C757	T676-A683 HydrophobicContact CG2-CB 3.59Å; K679-A683 WeakPolarHBondContact O-CB 3.45Å; K679-A683 PolarHBondContact O-N 2.81Å; A683-A687 VanDerWaalsContact O-CB 3.27Å; A683-A687 WeakPolarHBondContact O-CB 3.47Å; A683-A687 PolarHBondContact O-N 3.49Å; A683-V755 HydrophobicContact CB-CG1 3.86Å; A683-C757 HydrophobicContact CB-CB 4.03Å
684	T	85.5	Confident	84.7	Confident	14 Å²	14	26.1 Å²	26.1	9%	0.086	14%	0.144	C	C	.	.	H	α-helix	trans	-66	-42	177.5	-56.6	0	0	0	0	111.4	L680 E681 T682 A687 K688 I699	L680-T684 VanDerWaalsContact O-CB 3.29Å; L680-T684 WeakPolarHBondContact O-CB 3.3Å; L680-T684 PolarHBondContact O-N 2.88Å; L680-T684 PolarHBondContact O-OG1 3.21Å; E681-T684 PolarHBondContact O-N 3.35Å; T682-T684 VanDerWaalsContact C-N 3.32Å; T682-T684 PolarHBondContact O-N 3.48Å; T684-A687 PolarHBondContact O-N 2.98Å; T684-K688 WeakPolarHBondContact O-CG 3.47Å; T684-K688 PolarHBondContact O-N 2.71Å; T684-I699 HydrophobicContact CG2-CD1 4.21Å
685	C	82.8	Confident	83.8	Confident	17 Å²	17	36.2 Å²	36.2	12%	0.115	18%	0.182	C	C	.	.	H	α-helix	trans	-59.6	-51.6	175.8	177.7	0	0	0	0	111.3	G594 E681 T682 A687 K688 N689	G594-C685 WeakPolarHBondContact CA-SG 3.45Å; G594-C685 PolarHBondContact O-SG 3.44Å; E681-C685 VanDerWaalsContact O-CB 3.25Å; E681-C685 WeakPolarHBondContact O-CB 3.38Å; E681-C685 PolarHBondContact O-N 2.86Å; T682-C685 WeakPolarHBondContact O-CB 3.43Å; T682-C685 PolarHBondContact O-N 3.41Å; C685-A687 VanDerWaalsContact C-N 3.35Å; C685-A687 PolarHBondContact O-N 3.09Å; C685-K688 PolarHBondContact O-N 3.28Å; C685-N689 PolarHBondContact O-N 3.22Å
686	T	87.4	Confident	83.2	Confident	4 Å²	4	43.9 Å²	43.9	3%	0.025	22%	0.223	C	C	.	.	H	α-helix	trans	-63.6	-38.8	177.2	-54	0	0	0	0	112.2	K392 T397 L654 M674 T682 K688 N689 A690	K392-T686 HydrophobicContact CD-CG2 4.08Å; K392-T686 HydrophobicContact CG-CG2 3.58Å; T397-T686 HydrophobicContact CG2-CG2 3.84Å; L654-T686 HydrophobicContact CD2-CG2 4.11Å; M674-T686 HydrophobicContact CE-CG2 4.46Å; T682-T686 PolarHBondContact O-N 3.24Å; T682-T686 PolarHBondContact O-OG1 2.96Å; T686-K688 VanDerWaalsContact C-N 3.32Å; T686-K688 PolarHBondContact O-N 3.38Å; T686-N689 PolarHBondContact O-N 3.1Å; T686-A690 VanDerWaalsContact O-CB 3.23Å; T686-A690 WeakPolarHBondContact O-CB 3.3Å; T686-A690 PolarHBondContact O-N 2.96Å
687	A	89.7	Confident	82.9	Confident	0 Å²	0	45.4 Å²	45.4	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-62.9	-36.5	176.9	0	0	0	0	0	112.9	M674 A683 T684 C685 H691 L692 I693 V755	M674-A687 HydrophobicContact CE-CB 3.98Å; M674-A687 HydrophobicContact SD-CB 4.45Å; A683-A687 VanDerWaalsContact O-CB 3.27Å; A683-A687 WeakPolarHBondContact O-CB 3.47Å; A683-A687 PolarHBondContact O-N 3.49Å; T684-A687 PolarHBondContact O-N 2.98Å; C685-A687 VanDerWaalsContact C-N 3.35Å; C685-A687 PolarHBondContact O-N 3.09Å; A687-H691 PolarHBondContact O-N 3.16Å; A687-L692 HydrophobicContact CB-CB 4.45Å; A687-L692 HydrophobicContact CB-CD2 4.32Å; A687-L692 WeakPolarHBondContact O-CB 3.5Å; A687-L692 PolarHBondContact O-N 3.37Å; A687-I693 HydrophobicContact CB-CD1 3.9Å; A687-I693 HydrophobicContact CB-CG1 4.16Å; A687-I693 PolarHBondContact O-N 3.14Å; A687-V755 HydrophobicContact CB-CG2 3.82Å
688	K	87.1	Confident	83.4	Confident	75 Å²	75	49.3 Å²	49.3	33%	0.326	24%	0.241	S	C	.	.	H	α-helix	trans	-68.9	-45.8	172.5	-72.5	175.2	178.9	178.7	0	111.6	T684 C685 T686 A690 H691 I699	T684-K688 WeakPolarHBondContact O-CG 3.47Å; T684-K688 PolarHBondContact O-N 2.71Å; C685-K688 PolarHBondContact O-N 3.28Å; T686-K688 VanDerWaalsContact C-N 3.32Å; T686-K688 PolarHBondContact O-N 3.38Å; K688-A690 VanDerWaalsContact C-N 3.34Å; K688-A690 PolarHBondContact O-N 3.28Å; K688-H691 PolarHBondContact O-N 3.35Å; K688-H691 VanDerWaalsContact O-N 3.1Å; K688-H691 PolarHBondContact O-ND1 3.31Å; K688-I699 HydrophobicContact CG-CD1 4.49Å
689	N	87.1	Confident	84.1	Confident	14 Å²	14	49.7 Å²	49.7	8%	0.075	24%	0.242	C	C	.	.	H	α-helix	trans	-63.3	-38.2	178.8	-78.4	-8.2	0	0	0	113.2	E593 G594 L654 R659 C685 T686 H691	E593-N689 PolarHBondContact O-OD1 2.92Å; G594-N689 VanDerWaalsContact CA-OD1 3.3Å; G594-N689 WeakPolarHBondContact CA-OD1 3.46Å; G594-N689 PolarHBondContact O-ND2 3.16Å; L654-N689 HydrophobicContact CD1-CB 4.29Å; L654-N689 WeakPolarHBondContact CD1-O 3.48Å; R659-N689 PolarHBondContact NE-O 3.06Å; C685-N689 PolarHBondContact O-N 3.22Å; T686-N689 PolarHBondContact O-N 3.1Å; N689-H691 PolarHBondContact O-N 3.07Å
690	A	89.6	Confident	85.1	Confident	0 Å²	0	47.5 Å²	47.5	0%	0	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.5	-5.5	177.9	0	0	0	0	0	112.8	L654 V658 L662 T686 K688 L692	L654-A690 HydrophobicContact CD1-CB 4.31Å; L654-A690 HydrophobicContact CD2-CB 4.27Å; V658-A690 HydrophobicContact CG1-CB 4.3Å; L662-A690 HydrophobicContact CD1-CB 3.82Å; L662-A690 WeakPolarHBondContact CD1-O 3.41Å; T686-A690 VanDerWaalsContact O-CB 3.23Å; T686-A690 WeakPolarHBondContact O-CB 3.3Å; T686-A690 PolarHBondContact O-N 2.96Å; K688-A690 VanDerWaalsContact C-N 3.34Å; K688-A690 PolarHBondContact O-N 3.28Å; A690-L692 PolarHBondContact O-N 3.3Å
691	H	89.4	Confident	85.7	Confident	40 Å²	40	49.5 Å²	49.5	19%	0.185	24%	0.243	C	C	.	.	T	Hydrogen-bonded Turn	trans	55.1	27.6	-170.2	-64.9	-39.1	0	0	0	113.6	A687 K688 N689 I693	A687-H691 PolarHBondContact O-N 3.16Å; K688-H691 PolarHBondContact O-N 3.35Å; K688-H691 VanDerWaalsContact O-N 3.1Å; K688-H691 PolarHBondContact O-ND1 3.31Å; N689-H691 PolarHBondContact O-N 3.07Å; H691-I693 VanDerWaalsContact C-N 3.28Å
692	L	89.7	Confident	86.3	Confident	15 Å²	15	45.1 Å²	45.1	8%	0.079	22%	0.222	C	C	.	.	S	Bend	trans	-65.4	-41	166.5	179.9	64.5	0	0	0	109.8	V672 M674 A687 A690 A753 V755	V672-L692 HydrophobicContact CB-CD1 3.62Å; V672-L692 HydrophobicContact CG1-CD1 3.72Å; M674-L692 HydrophobicContact CB-CD2 3.72Å; M674-L692 HydrophobicContact CE-CD2 3.73Å; A687-L692 HydrophobicContact CB-CB 4.45Å; A687-L692 HydrophobicContact CB-CD2 4.32Å; A687-L692 WeakPolarHBondContact O-CB 3.5Å; A687-L692 PolarHBondContact O-N 3.37Å; A690-L692 PolarHBondContact O-N 3.3Å; L692-A753 HydrophobicContact CD1-CB 4.2Å; L692-A753 HydrophobicContact CG-CB 4.07Å; L692-V755 HydrophobicContact CD2-CG2 4.16Å
693	I	88.4	Confident	86.9	Confident	2 Å²	2	51.8 Å²	51.8	1%	0.01	24%	0.244	C	C	.	.	S	Bend	trans	-104.2	124.7	169.7	-55.7	175	0	0	0	107.7	A687 H691 Q697 I699 A725 V755	A687-I693 HydrophobicContact CB-CD1 3.9Å; A687-I693 HydrophobicContact CB-CG1 4.16Å; A687-I693 PolarHBondContact O-N 3.14Å; H691-I693 VanDerWaalsContact C-N 3.28Å; I693-Q697 HydrophobicContact CG2-CB 4.17Å; I693-I699 HydrophobicContact CD1-CD1 4.01Å; I693-I699 HydrophobicContact CD1-CG1 4.25Å; I693-I699 HydrophobicContact CG2-CD1 3.99Å; I693-I699 HydrophobicContact CG2-CG1 3.86Å; I693-A725 HydrophobicContact CD1-CB 3.87Å; I693-A725 HydrophobicContact CG1-CB 3.82Å; I693-A725 HydrophobicContact CG2-CB 4.12Å; I693-V755 HydrophobicContact CD1-CG2 4.27Å
694	T	82.9	Confident	87	Confident	58 Å²	58	58.7 Å²	58.7	36%	0.356	28%	0.276	S	S	.	.			trans	-69.4	146.7	178.3	-6.2	0	0	0	0	110.6	N696 Q697	T694-N696 PolarHBondContact O-N 3.18Å; T694-N696 VanDerWaalsContact O-N 3.11Å; T694-Q697 VanDerWaalsContact O-CB 3.25Å; T694-Q697 WeakPolarHBondContact O-CB 3.5Å; T694-Q697 PolarHBondContact O-N 3.37Å; T694-Q697 PolarHBondContact OG1-OE1 3.27Å
695	R	76.1	Confident	87.2	Confident	211 Å²	211	58.1 Å²	58.1	80%	0.796	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.6	-32.3	-174.4	-70.1	-177.1	177.2	170.8	0.4	114.6
696	N	80.6	Confident	87.6	Confident	162 Å²	162	62 Å²	62	87%	0.866	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.6	7.5	-178.6	-61.9	0.5	0	0	0	113.1	T694	T694-N696 PolarHBondContact O-N 3.18Å; T694-N696 VanDerWaalsContact O-N 3.11Å
697	Q	83.6	Confident	87.8	Confident	31 Å²	31	64.8 Å²	64.8	15%	0.145	31%	0.314	C	S	.	.	S	Bend	trans	-90.6	133.2	-175.3	-172.2	176.1	5.4	0	0	110.9	I693 T694 I699 D723	I693-Q697 HydrophobicContact CG2-CB 4.17Å; T694-Q697 VanDerWaalsContact O-CB 3.25Å; T694-Q697 WeakPolarHBondContact O-CB 3.5Å; T694-Q697 PolarHBondContact O-N 3.37Å; T694-Q697 PolarHBondContact OG1-OE1 3.27Å; Q697-I699 PolarHBondContact O-N 3.13Å; Q697-D723 PolarHBondContact NE2-O 2.87Å
698	D	87.1	Confident	88	Confident	126 Å²	126	71.7 Å²	71.7	67%	0.674	34%	0.34	S	S	*	.			trans	-66.5	133.8	177	-77.7	-17.5	0	0	0	111.5	C724 A725	D698-C724 HydrophobicContact CB-CB 4.29Å; D698-C724 CarbonylContact O-C 3.59Å; D698-C724 WeakPolarHBondContact O-CA 3.33Å; D698-C724 WeakPolarHBondContact O-CB 3.43Å; D698-A725 PolarHBondContact O-N 2.8Å
699	I	89.4	Confident	88.2	Confident	46 Å²	46	70.3 Å²	70.3	24%	0.236	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	123.1	176	-53.9	179.1	0	0	0	108.1	T684 K688 I693 Q697 I701 V727	T684-I699 HydrophobicContact CG2-CD1 4.21Å; K688-I699 HydrophobicContact CG-CD1 4.49Å; I693-I699 HydrophobicContact CD1-CD1 4.01Å; I693-I699 HydrophobicContact CD1-CG1 4.25Å; I693-I699 HydrophobicContact CG2-CD1 3.99Å; I693-I699 HydrophobicContact CG2-CG1 3.86Å; Q697-I699 PolarHBondContact O-N 3.13Å; I699-I701 HydrophobicContact CG2-CG1 4.15Å; I699-V727 HydrophobicContact CG2-CG2 3.53Å
700	H	92.1	Very high	88.4	Confident	14 Å²	14	73.3 Å²	73.3	7%	0.065	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	105	167.7	-176.3	53.4	0	0	0	109.9	F702 F718 K721 C724 A725 V727	H700-F702 PolarHBondContact O-N 3.11Å; H700-F718 HydrophobicContact CB-CD2 4.38Å; H700-F718 HydrophobicContact CB-CE2 4.34Å; H700-F718 AromaticContact CD2-CD2 3.05Å; H700-F718 WeakPolarHBondContact CD2-CD2 3.28Å; H700-F718 AromaticContact CD2-CE2 3.6Å; H700-F718 AromaticContact CD2-CG 3.72Å; H700-F718 AromaticContact CG-CD2 3.87Å; H700-F718 AromaticContact NE2-CD2 3.62Å; H700-F718 AromaticContact NE2-CG 3.87Å; H700-K721 HydrophobicContact CB-CD 4.08Å; H700-K721 PolarHBondContact ND1-NZ 3.13Å; H700-C724 HydrophobicContact CB-CB 4.38Å; H700-A725 PolarHBondContact N-O 2.76Å; H700-V727 PolarHBondContact O-N 3.23Å
701	I	91.3	Very high	88.5	Confident	85 Å²	85	73.3 Å²	73.3	44%	0.436	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	115.2	169.7	-61.4	169.7	0	0	0	107.8	L680 I699 R703 V727	L680-I701 HydrophobicContact CD1-CG2 3.91Å; L680-I701 HydrophobicContact CD2-CG2 4.26Å; I699-I701 HydrophobicContact CG2-CG1 4.15Å; I701-R703 PolarHBondContact O-N 3.03Å; I701-V727 HydrophobicContact CG1-CB 4.39Å
702	F	91.3	Very high	88.7	Confident	5 Å²	5	74.8 Å²	74.8	2%	0.022	37%	0.367	C	S	.	.	P	Polyproline II helix	trans	-71.8	124.2	176.5	-158.4	-86.1	0	0	0	108.8	H700 V705 E714 L715 L726 V727 I728	H700-F702 PolarHBondContact O-N 3.11Å; F702-V705 HydrophobicContact CE1-CG1 4.07Å; F702-V705 HydrophobicContact CE1-CG2 3.96Å; F702-E714 HydrophobicContact CE1-CB 4.2Å; F702-E714 HydrophobicContact CE2-CB 4.26Å; F702-E714 HydrophobicContact CZ-CB 3.84Å; F702-L715 HydrophobicContact CE2-CD2 4.4Å; F702-L715 HydrophobicContact CZ-CG 4.37Å; F702-L726 HydrophobicContact CB-CD1 4.19Å; F702-L726 HydrophobicContact CD2-CD1 4.21Å; F702-V727 WeakPolarHBondContact CB-O 3.32Å; F702-V727 PolarHBondContact N-O 3.2Å; F702-I728 HydrophobicContact CB-CB 3.96Å; F702-I728 HydrophobicContact CB-CD1 4.26Å; F702-I728 HydrophobicContact CB-CG1 3.92Å; F702-I728 HydrophobicContact CD1-CD1 3.85Å; F702-I728 HydrophobicContact CD1-CG1 4.07Å; F702-I728 HydrophobicContact CD2-CD1 4.33Å; F702-I728 HydrophobicContact CE1-CD1 4.28Å; F702-I728 HydrophobicContact CG-CD1 3.88Å; F702-I728 HydrophobicContact CG-CG1 4.05Å
703	R	89.3	Confident	88.8	Confident	169 Å²	169	79.8 Å²	79.8	64%	0.638	39%	0.393	S	S	*	.	P	Polyproline II helix	trans	-66.5	155	-178	-64.1	-160.4	-177	132.4	-13.3	111.3	I701 V705 E714	I701-R703 PolarHBondContact O-N 3.03Å; R703-V705 PolarHBondContact O-N 2.86Å; R703-E714 HydrophobicContact CB-CG 4.2Å; R703-E714 VanDerWaalsContact CD-OE1 3.25Å; R703-E714 WeakPolarHBondContact CD-OE1 3.19Å; R703-E714 IonicContact CZ-OE1 3.6Å; R703-E714 IonicContact NE-OE1 2.6Å; R703-E714 IonicContact NH1-OE1 3.58Å; R703-E714 PolarHBondContact NH1-OE1 2.95Å
704	Q	87.6	Confident	89	Confident	144 Å²	144	81 Å²	81	67%	0.673	40%	0.398	S	S	*	.	P	Polyproline II helix	trans	-65.7	119.7	175.3	-168.6	172	3.1	0	0	109.7	S732	Q704-S732 WeakPolarHBondContact CA-OG 3.46Å
705	V	90.1	Very high	89.5	Confident	3 Å²	3	78.2 Å²	78.2	2%	0.018	38%	0.381	C	S	.	.			trans	-118.4	138.2	178.6	-61	0	0	0	0	110.5	F702 R703 E710 A711 E714 S732 V735	F702-V705 HydrophobicContact CE1-CG1 4.07Å; F702-V705 HydrophobicContact CE1-CG2 3.96Å; R703-V705 PolarHBondContact O-N 2.86Å; V705-E710 HydrophobicContact CB-CB 4.07Å; V705-E710 HydrophobicContact CG1-CB 3.93Å; V705-A711 HydrophobicContact CB-CB 4.41Å; V705-A711 HydrophobicContact CG2-CB 4.12Å; V705-E714 HydrophobicContact CG1-CB 4.35Å; V705-E714 HydrophobicContact CG1-CG 3.99Å; V705-S732 PolarHBondContact N-OG 2.7Å; V705-S732 VanDerWaalsContact N-OG 3.09Å; V705-V735 HydrophobicContact CG2-CB 4.26Å; V705-V735 HydrophobicContact CG2-CG1 4.33Å
706	T	89.9	Confident	90.2	Very high	98 Å²	98	70.4 Å²	70.4	60%	0.601	36%	0.356	S	S	*	.			trans	-119.8	-27.7	177.4	61.6	0	0	0	0	111.9	E710	T706-E710 PolarHBondContact N-OE2 2.97Å; T706-E710 PolarHBondContact OG1-OE2 3.36Å
707	T	92.3	Very high	90.6	Very high	63 Å²	63	64.8 Å²	64.8	39%	0.387	33%	0.331	S	S	.	.	S	Bend	trans	-109.2	156.6	-177.8	70.8	0	0	0	0	112.6	G709 E710 A711	T707-G709 PolarHBondContact O-N 3.29Å; T707-E710 PolarHBondContact N-OE2 2.96Å; T707-E710 PolarHBondContact O-N 2.96Å; T707-E710 VanDerWaalsContact OG1-CG 3.32Å; T707-E710 WeakPolarHBondContact OG1-CG 3.22Å; T707-E710 PolarHBondContact OG1-N 3.45Å; T707-E710 PolarHBondContact OG1-OE1 3.26Å; T707-A711 PolarHBondContact O-N 3.09Å; T707-A711 VanDerWaalsContact O-N 3.13Å
708	R	92.6	Very high	91	Very high	145 Å²	145	63.6 Å²	63.6	55%	0.547	33%	0.326	S	S	.	.	H	α-helix	trans	-59.4	-34	175.4	178.7	-179.2	174	-175.4	0.5	112.7	H712 Y739 Y740	R708-H712 PolarHBondContact O-N 2.66Å; R708-Y739 HydrophobicContact CB-CD1 4.4Å; R708-Y739 HydrophobicContact CB-CD2 4.17Å; R708-Y739 HydrophobicContact CB-CE2 4.42Å; R708-Y739 HydrophobicContact CB-CG 4.17Å; R708-Y739 HydrophobicContact CG-CD1 4.26Å; R708-Y739 HydrophobicContact CG-CG 4.08Å; R708-Y740 HydrophobicContact CG-CE2 3.76Å; R708-Y740 VanDerWaalsContact CG-OH 3.31Å; R708-Y740 WeakPolarHBondContact CG-OH 3.47Å; R708-Y740 PolarHBondContact NE-OH 3.38Å; R708-Y740 VanDerWaalsContact NE-OH 3.17Å; R708-Y740 WeakPolarHBondContact O-CE2 3.48Å; R708-Y740 PolarHBondContact O-OH 2.79Å
709	G	92.1	Very high	91.2	Very high	45 Å²	45	63.1 Å²	63.1	46%	0.464	32%	0.315	S	S	.	.	H	α-helix	trans	-69	-46.8	-179.4	0	0	0	0	0	112.1	T707 H712 L713	T707-G709 PolarHBondContact O-N 3.29Å; G709-H712 WeakPolarHBondContact O-CB 3.13Å; G709-H712 PolarHBondContact O-N 2.94Å; G709-L713 PolarHBondContact O-N 3.07Å; G709-L713 VanDerWaalsContact O-N 3.14Å
710	E	92.3	Very high	91.1	Very high	78 Å²	78	70.9 Å²	70.9	36%	0.364	34%	0.341	S	S	.	.	H	α-helix	trans	-59.2	-47.4	175.1	-72.3	158.2	-155.4	0	0	111.7	V705 T706 T707 H712 L713 E714	V705-E710 HydrophobicContact CB-CB 4.07Å; V705-E710 HydrophobicContact CG1-CB 3.93Å; T706-E710 PolarHBondContact N-OE2 2.97Å; T706-E710 PolarHBondContact OG1-OE2 3.36Å; T707-E710 PolarHBondContact N-OE2 2.96Å; T707-E710 PolarHBondContact O-N 2.96Å; T707-E710 VanDerWaalsContact OG1-CG 3.32Å; T707-E710 WeakPolarHBondContact OG1-CG 3.22Å; T707-E710 PolarHBondContact OG1-N 3.45Å; T707-E710 PolarHBondContact OG1-OE1 3.26Å; E710-H712 VanDerWaalsContact C-N 3.26Å; E710-H712 PolarHBondContact O-N 3.41Å; E710-L713 PolarHBondContact O-N 2.93Å; E710-L713 VanDerWaalsContact O-N 3.17Å; E710-E714 PolarHBondContact O-N 3.2Å
711	A	91.6	Very high	90.8	Very high	0 Å²	0	75.1 Å²	75.1	0%	0	36%	0.359	C	S	.	.	H	α-helix	trans	-57.3	-39.8	177.9	0	0	0	0	0	112.1	V705 T707 L715 V735 Y740	V705-A711 HydrophobicContact CB-CB 4.41Å; V705-A711 HydrophobicContact CG2-CB 4.12Å; T707-A711 PolarHBondContact O-N 3.09Å; T707-A711 VanDerWaalsContact O-N 3.13Å; A711-L715 VanDerWaalsContact O-CB 3.29Å; A711-L715 WeakPolarHBondContact O-CB 3.08Å; A711-L715 WeakPolarHBondContact O-CD1 3.45Å; A711-L715 WeakPolarHBondContact O-CG 3.39Å; A711-L715 PolarHBondContact O-N 3.12Å; A711-V735 HydrophobicContact CB-CG1 4.09Å; A711-Y740 HydrophobicContact CB-CD2 4.21Å; A711-Y740 HydrophobicContact CB-CE2 4.23Å
712	H	92.7	Very high	90.4	Very high	70 Å²	70	78.4 Å²	78.4	32%	0.324	37%	0.372	S	S	.	.	H	α-helix	trans	-66.4	-43	177.6	-174.9	66	0	0	0	112.9	R708 G709 E710 N716 Y740	R708-H712 PolarHBondContact O-N 2.66Å; G709-H712 WeakPolarHBondContact O-CB 3.13Å; G709-H712 PolarHBondContact O-N 2.94Å; E710-H712 VanDerWaalsContact C-N 3.26Å; E710-H712 PolarHBondContact O-N 3.41Å; H712-N716 PolarHBondContact CD2-ND2 3.24Å; H712-N716 PolarHBondContact CE1-ND2 3.12Å; H712-N716 PolarHBondContact NE2-ND2 3.4Å; H712-N716 WeakPolarHBondContact O-CB 3.39Å; H712-N716 PolarHBondContact O-N 3.14Å; H712-N716 PolarHBondContact O-ND2 2.82Å; H712-Y740 HydrophobicContact CB-CE2 4.07Å; H712-Y740 AromaticContact ND1-CE1 4Å
713	L	92.4	Very high	90	Very high	121 Å²	121	84.2 Å²	84.2	63%	0.634	40%	0.404	S	S	*	.	H	α-helix	trans	-64	-45.1	178.8	-71	170.3	0	0	0	111.4	G709 E710 N716 A717	G709-L713 PolarHBondContact O-N 3.07Å; G709-L713 VanDerWaalsContact O-N 3.14Å; E710-L713 PolarHBondContact O-N 2.93Å; E710-L713 VanDerWaalsContact O-N 3.17Å; L713-N716 PolarHBondContact O-N 3.19Å; L713-A717 PolarHBondContact O-N 3.17Å
714	E	92.6	Very high	90.1	Very high	26 Å²	26	76.4 Å²	76.4	12%	0.121	38%	0.375	C	S	.	.	H	α-helix	trans	-68.2	-39.7	178.4	-72.2	-62.7	153.6	0	0	112.1	F702 R703 V705 E710 N716 A717 F718	F702-E714 HydrophobicContact CE1-CB 4.2Å; F702-E714 HydrophobicContact CE2-CB 4.26Å; F702-E714 HydrophobicContact CZ-CB 3.84Å; R703-E714 HydrophobicContact CB-CG 4.2Å; R703-E714 VanDerWaalsContact CD-OE1 3.25Å; R703-E714 WeakPolarHBondContact CD-OE1 3.19Å; R703-E714 IonicContact CZ-OE1 3.6Å; R703-E714 IonicContact NE-OE1 2.6Å; R703-E714 IonicContact NH1-OE1 3.58Å; R703-E714 PolarHBondContact NH1-OE1 2.95Å; V705-E714 HydrophobicContact CG1-CB 4.35Å; V705-E714 HydrophobicContact CG1-CG 3.99Å; E710-E714 PolarHBondContact O-N 3.2Å; E714-N716 VanDerWaalsContact C-N 3.32Å; E714-N716 PolarHBondContact O-N 3.19Å; E714-A717 WeakPolarHBondContact O-CB 3.39Å; E714-A717 PolarHBondContact O-N 3.48Å; E714-F718 WeakPolarHBondContact O-CB 3.43Å; E714-F718 PolarHBondContact O-N 2.96Å
715	L	92.3	Very high	90.3	Very high	0 Å²	0	69.5 Å²	69.5	0%	0	34%	0.343	C	S	.	.	H	α-helix	trans	-59.8	-41	172.7	-80.3	166.5	0	0	0	112.4	F702 A711 F718 R719 Y740 F744 L747	F702-L715 HydrophobicContact CE2-CD2 4.4Å; F702-L715 HydrophobicContact CZ-CG 4.37Å; A711-L715 VanDerWaalsContact O-CB 3.29Å; A711-L715 WeakPolarHBondContact O-CB 3.08Å; A711-L715 WeakPolarHBondContact O-CD1 3.45Å; A711-L715 WeakPolarHBondContact O-CG 3.39Å; A711-L715 PolarHBondContact O-N 3.12Å; L715-F718 PolarHBondContact O-N 3.27Å; L715-R719 WeakPolarHBondContact O-CB 3.24Å; L715-R719 PolarHBondContact O-N 3.47Å; L715-Y740 HydrophobicContact CD1-CD2 3.81Å; L715-Y740 HydrophobicContact CD1-CG 3.71Å; L715-F744 HydrophobicContact CD2-CB 4.08Å; L715-F744 HydrophobicContact CD2-CD2 3.96Å; L715-L747 HydrophobicContact CD2-CD1 4.16Å
716	N	91.1	Very high	90.5	Very high	48 Å²	48	69.4 Å²	69.4	26%	0.257	34%	0.342	S	S	.	.	H	α-helix	trans	-67.5	-35.8	176.1	-76.5	-28.9	0	0	0	112.4	H712 L713 E714	H712-N716 PolarHBondContact CD2-ND2 3.24Å; H712-N716 PolarHBondContact CE1-ND2 3.12Å; H712-N716 PolarHBondContact NE2-ND2 3.4Å; H712-N716 WeakPolarHBondContact O-CB 3.39Å; H712-N716 PolarHBondContact O-N 3.14Å; H712-N716 PolarHBondContact O-ND2 2.82Å; L713-N716 PolarHBondContact O-N 3.19Å; E714-N716 VanDerWaalsContact C-N 3.32Å; E714-N716 PolarHBondContact O-N 3.19Å
717	A	89.9	Confident	90.7	Very high	43 Å²	43	64.7 Å²	64.7	36%	0.355	31%	0.313	S	S	.	.	H	α-helix	trans	-65.9	-43.4	173.4	0	0	0	0	0	111	L713 E714 R719 R720	L713-A717 PolarHBondContact O-N 3.17Å; E714-A717 WeakPolarHBondContact O-CB 3.39Å; E714-A717 PolarHBondContact O-N 3.48Å; A717-R719 PolarHBondContact O-N 2.93Å; A717-R720 PolarHBondContact O-N 3.34Å
718	F	91.4	Very high	90.8	Very high	6 Å²	6	61.7 Å²	61.7	3%	0.026	30%	0.295	C	S	.	.	H	α-helix	trans	-63.7	-40.3	178.3	-179.7	-138.2	0	0	0	112.5	H700 E714 L715 R720 K721 L726 L747 C751	H700-F718 HydrophobicContact CB-CD2 4.38Å; H700-F718 HydrophobicContact CB-CE2 4.34Å; H700-F718 AromaticContact CD2-CD2 3.05Å; H700-F718 WeakPolarHBondContact CD2-CD2 3.28Å; H700-F718 AromaticContact CD2-CE2 3.6Å; H700-F718 AromaticContact CD2-CG 3.72Å; H700-F718 AromaticContact CG-CD2 3.87Å; H700-F718 AromaticContact NE2-CD2 3.62Å; H700-F718 AromaticContact NE2-CG 3.87Å; E714-F718 WeakPolarHBondContact O-CB 3.43Å; E714-F718 PolarHBondContact O-N 2.96Å; L715-F718 PolarHBondContact O-N 3.27Å; F718-R720 PolarHBondContact O-N 2.9Å; F718-K721 PolarHBondContact O-N 2.86Å; F718-L726 HydrophobicContact CE1-CD1 4.23Å; F718-L726 HydrophobicContact CE1-CD2 4.07Å; F718-L726 HydrophobicContact CE2-CB 4.48Å; F718-L726 HydrophobicContact CE2-CD1 4.02Å; F718-L726 HydrophobicContact CZ-CB 4.07Å; F718-L726 HydrophobicContact CZ-CD1 3.8Å; F718-L726 HydrophobicContact CZ-CD2 3.92Å; F718-L726 HydrophobicContact CZ-CG 4.14Å; F718-L747 HydrophobicContact CD1-CB 3.91Å; F718-L747 HydrophobicContact CD1-CD1 3.89Å; F718-L747 HydrophobicContact CD1-CG 4.47Å; F718-L747 HydrophobicContact CE1-CB 3.6Å; F718-L747 HydrophobicContact CE1-CD1 4.46Å; F718-C751 WeakPolarHBondContact CZ-SG 3.32Å
719	R	90.4	Very high	90.7	Very high	116 Å²	116	55.7 Å²	55.7	44%	0.438	28%	0.275	S	S	.	.	H	α-helix	trans	-55.8	-25.6	178.4	-173.9	176.4	-65.8	171.9	3.5	113.8	L715 A717 K721 E743 L747	L715-R719 WeakPolarHBondContact O-CB 3.24Å; L715-R719 PolarHBondContact O-N 3.47Å; A717-R719 PolarHBondContact O-N 2.93Å; R719-K721 VanDerWaalsContact C-N 3.32Å; R719-E743 IonicContact NH2-OE2 2.84Å; R719-E743 PolarHBondContact NH2-OE2 3.07Å; R719-L747 HydrophobicContact CB-CD1 4.26Å; R719-L747 HydrophobicContact CB-CD2 4.23Å; R719-L747 HydrophobicContact CG-CD2 4.13Å
720	R	88.1	Confident	90.5	Very high	209 Å²	209	53.5 Å²	53.5	79%	0.789	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.1	-10.8	179.3	-62.1	178	-174.3	178.6	0.9	113.4	A717 F718	A717-R720 PolarHBondContact O-N 3.34Å; F718-R720 PolarHBondContact O-N 2.9Å
721	K	86.2	Confident	90.2	Very high	103 Å²	103	53.4 Å²	53.4	45%	0.448	26%	0.255	S	S	.	.			trans	-95.3	136.3	-179.4	-64.8	-169.9	171	-167.5	0	110.4	H700 F718 R719	H700-K721 HydrophobicContact CB-CD 4.08Å; H700-K721 PolarHBondContact ND1-NZ 3.13Å; F718-K721 PolarHBondContact O-N 2.86Å; R719-K721 VanDerWaalsContact C-N 3.32Å
722	H	82.4	Confident	90.2	Very high	154 Å²	154	53.5 Å²	53.5	71%	0.713	26%	0.255	S	S	*	.			trans	-119	149.7	175.3	-64.4	-63.5	0	0	0	109.8	C724	H722-C724 PolarHBondContact O-N 2.75Å; H722-C724 VanDerWaalsContact O-N 3.08Å
723	D	83.2	Confident	90.1	Very high	127 Å²	127	50.3 Å²	50.3	68%	0.679	24%	0.24	S	C	*	.	S	Bend	trans	55.8	21.8	177.1	-154	24.9	0	0	0	116.5	Q697	Q697-D723 PolarHBondContact NE2-O 2.87Å
724	C	90.4	Very high	90.1	Very high	5 Å²	5	49.9 Å²	49.9	3%	0.034	24%	0.235	C	C	.	.	P	Polyproline II helix	trans	-93	144.8	177	63.5	0	0	0	0	112.3	D698 H700 H722	D698-C724 HydrophobicContact CB-CB 4.29Å; D698-C724 CarbonylContact O-C 3.59Å; D698-C724 WeakPolarHBondContact O-CA 3.33Å; D698-C724 WeakPolarHBondContact O-CB 3.43Å; H700-C724 HydrophobicContact CB-CB 4.38Å; H722-C724 PolarHBondContact O-N 2.75Å; H722-C724 VanDerWaalsContact O-N 3.08Å
725	A	91.9	Very high	90	Very high	0 Å²	0	49.7 Å²	49.7	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	137	166.8	0	0	0	0	0	109.9	I693 D698 H700 A753	I693-A725 HydrophobicContact CD1-CB 3.87Å; I693-A725 HydrophobicContact CG1-CB 3.82Å; I693-A725 HydrophobicContact CG2-CB 4.12Å; D698-A725 PolarHBondContact O-N 2.8Å; H700-A725 PolarHBondContact N-O 2.76Å; A725-A753 WeakPolarHBondContact CA-O 3.25Å; A725-A753 HydrophobicContact CB-CB 4.43Å
726	L	94.9	Very high	90.1	Very high	0 Å²	0	49.7 Å²	49.7	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	130.8	179.1	174.9	64.2	0	0	0	110.3	F702 F718 F744 A748 A753 V754 V755	F702-L726 HydrophobicContact CB-CD1 4.19Å; F702-L726 HydrophobicContact CD2-CD1 4.21Å; F718-L726 HydrophobicContact CE1-CD1 4.23Å; F718-L726 HydrophobicContact CE1-CD2 4.07Å; F718-L726 HydrophobicContact CE2-CB 4.48Å; F718-L726 HydrophobicContact CE2-CD1 4.02Å; F718-L726 HydrophobicContact CZ-CB 4.07Å; F718-L726 HydrophobicContact CZ-CD1 3.8Å; F718-L726 HydrophobicContact CZ-CD2 3.92Å; F718-L726 HydrophobicContact CZ-CG 4.14Å; L726-F744 HydrophobicContact CD2-CE2 4.05Å; L726-F744 HydrophobicContact CD2-CZ 4.1Å; L726-A748 HydrophobicContact CD2-CB 4.04Å; L726-A753 PolarHBondContact N-O 3.37Å; L726-A753 VanDerWaalsContact N-O 3.12Å; L726-V754 HydrophobicContact CB-CG1 4.33Å; L726-V754 HydrophobicContact CB-CG2 4.29Å; L726-V754 HydrophobicContact CD2-CG1 4.14Å; L726-V754 HydrophobicContact CG-CG1 4.36Å; L726-V754 CarbonylContact O-C 3.55Å; L726-V754 WeakPolarHBondContact O-CA 3.12Å; L726-V755 PolarHBondContact O-N 2.94Å
727	V	94	Very high	90.1	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	120.8	169.1	-175.2	0	0	0	0	108.5	L680 I699 H700 I701 F702 V755	L680-V727 HydrophobicContact CD1-CG1 3.74Å; L680-V727 HydrophobicContact CG-CG1 4.03Å; I699-V727 HydrophobicContact CG2-CG2 3.53Å; H700-V727 PolarHBondContact O-N 3.23Å; I701-V727 HydrophobicContact CG1-CB 4.39Å; F702-V727 WeakPolarHBondContact CB-O 3.32Å; F702-V727 PolarHBondContact N-O 3.2Å; V727-V755 CarbonylContact C-O 3.44Å; V727-V755 VanDerWaalsContact CA-O 3.29Å; V727-V755 WeakPolarHBondContact CA-O 3.36Å; V727-V755 HydrophobicContact CG1-CB 4.46Å; V727-V755 HydrophobicContact CG2-CB 4.21Å
728	I	94.4	Very high	90.1	Very high	0 Å²	0	52.9 Å²	52.9	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	143.2	-177.4	-172	165.7	0	0	0	111.5	F702 L733 F744 V755 C756 C757	F702-I728 HydrophobicContact CB-CB 3.96Å; F702-I728 HydrophobicContact CB-CD1 4.26Å; F702-I728 HydrophobicContact CB-CG1 3.92Å; F702-I728 HydrophobicContact CD1-CD1 3.85Å; F702-I728 HydrophobicContact CD1-CG1 4.07Å; F702-I728 HydrophobicContact CD2-CD1 4.33Å; F702-I728 HydrophobicContact CE1-CD1 4.28Å; F702-I728 HydrophobicContact CG-CD1 3.88Å; F702-I728 HydrophobicContact CG-CG1 4.05Å; I728-L733 HydrophobicContact CD1-CB 4.1Å; I728-L733 HydrophobicContact CD1-CD1 4.35Å; I728-L733 HydrophobicContact CG1-CB 4.27Å; I728-F744 HydrophobicContact CD1-CE2 3.57Å; I728-F744 HydrophobicContact CD1-CZ 3.74Å; I728-F744 HydrophobicContact CG2-CZ 4.46Å; I728-V755 PolarHBondContact N-O 2.82Å; I728-C756 HydrophobicContact CG2-CB 4.33Å; I728-C756 CarbonylContact O-C 3.06Å; I728-C756 WeakPolarHBondContact O-CA 3.34Å; I728-C757 PolarHBondContact O-N 2.97Å; I728-C757 PolarHBondContact O-SG 2.93Å
729	S	90.4	Very high	90.2	Very high	18 Å²	18	57.7 Å²	57.7	13%	0.126	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	147.6	174.4	-174.5	0	0	0	0	111.8	D731 S732 L733 C757	S729-D731 VanDerWaalsContact C-N 3.29Å; S729-D731 PolarHBondContact O-N 3.11Å; S729-S732 PolarHBondContact O-N 3.28Å; S729-S732 VanDerWaalsContact O-N 3.09Å; S729-L733 WeakPolarHBondContact O-CB 3.38Å; S729-L733 PolarHBondContact O-N 3.38Å; S729-C757 CarbonylContact C-O 3.53Å; S729-C757 WeakPolarHBondContact CA-O 3.26Å
730	G	87	Confident	90.4	Very high	0 Å²	0	53.5 Å²	53.5	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-50.1	-42.5	179.6	0	0	0	0	0	114.2	S732 L733 E734 C757 Q763	G730-S732 PolarHBondContact O-N 2.98Å; G730-L733 WeakPolarHBondContact O-CB 3.21Å; G730-L733 PolarHBondContact O-N 3.09Å; G730-E734 PolarHBondContact O-N 2.85Å; G730-C757 PolarHBondContact N-O 2.85Å; G730-Q763 PolarHBondContact O-NE2 3.05Å
731	D	86.9	Confident	90.6	Very high	76 Å²	76	46.1 Å²	46.1	41%	0.406	22%	0.217	S	C	.	.	H	α-helix	trans	-62	-44.1	179.3	-57.5	-25.3	0	0	0	111.8	S729 E734 V735	S729-D731 VanDerWaalsContact C-N 3.29Å; S729-D731 PolarHBondContact O-N 3.11Å; D731-E734 PolarHBondContact O-N 3.44Å; D731-V735 WeakPolarHBondContact O-CG2 3.47Å; D731-V735 PolarHBondContact O-N 3.25Å
732	S	91.3	Very high	90.8	Very high	1 Å²	1	48.5 Å²	48.5	1%	0.007	23%	0.225	C	C	.	.	H	α-helix	trans	-72	-36.7	179.2	-62.2	0	0	0	0	111.7	Q704 V705 S729 G730 E734 V735 C736	Q704-S732 WeakPolarHBondContact CA-OG 3.46Å; V705-S732 PolarHBondContact N-OG 2.7Å; V705-S732 VanDerWaalsContact N-OG 3.09Å; S729-S732 PolarHBondContact O-N 3.28Å; S729-S732 VanDerWaalsContact O-N 3.09Å; G730-S732 PolarHBondContact O-N 2.98Å; S732-E734 VanDerWaalsContact C-N 3.35Å; S732-V735 PolarHBondContact O-N 3.48Å; S732-C736 WeakPolarHBondContact O-CB 3.44Å; S732-C736 PolarHBondContact O-N 3.24Å; S732-C736 PolarHBondContact O-SG 2.97Å
733	L	91.7	Very high	91.2	Very high	3 Å²	3	44.2 Å²	44.2	2%	0.016	21%	0.205	C	C	.	.	H	α-helix	trans	-60.3	-45.4	173.1	177.9	66.1	0	0	0	110.5	I728 S729 G730 V735 C736 L737 F744 I767	I728-L733 HydrophobicContact CD1-CB 4.1Å; I728-L733 HydrophobicContact CD1-CD1 4.35Å; I728-L733 HydrophobicContact CG1-CB 4.27Å; S729-L733 WeakPolarHBondContact O-CB 3.38Å; S729-L733 PolarHBondContact O-N 3.38Å; G730-L733 WeakPolarHBondContact O-CB 3.21Å; G730-L733 PolarHBondContact O-N 3.09Å; L733-V735 VanDerWaalsContact C-N 3.34Å; L733-V735 PolarHBondContact O-N 3.29Å; L733-C736 PolarHBondContact O-N 3.27Å; L733-C736 VanDerWaalsContact O-N 3.14Å; L733-L737 HydrophobicContact CD1-CD1 4Å; L733-L737 HydrophobicContact CD1-CD2 4.19Å; L733-L737 HydrophobicContact CD1-CG 3.86Å; L733-L737 HydrophobicContact CD2-CD1 4.36Å; L733-L737 HydrophobicContact CG-CD1 3.85Å; L733-L737 HydrophobicContact CG-CG 4.08Å; L733-L737 WeakPolarHBondContact O-CB 3.27Å; L733-L737 VanDerWaalsContact O-CG 3.27Å; L733-L737 WeakPolarHBondContact O-CG 3.35Å; L733-L737 PolarHBondContact O-N 3.37Å; L733-F744 HydrophobicContact CD1-CD1 4.13Å; L733-F744 HydrophobicContact CD1-CE1 3.29Å; L733-F744 HydrophobicContact CD1-CZ 3.58Å; L733-I767 HydrophobicContact CD2-CD1 3.55Å; L733-I767 HydrophobicContact CD2-CG1 3.9Å
734	E	90.6	Very high	91.7	Very high	113 Å²	113	38.3 Å²	38.3	53%	0.528	17%	0.173	S	C	.	.	H	α-helix	trans	-59.6	-43.9	179.3	-173.3	176	165.2	0	0	112.1	G730 D731 S732 C736 L737 K738	G730-E734 PolarHBondContact O-N 2.85Å; D731-E734 PolarHBondContact O-N 3.44Å; S732-E734 VanDerWaalsContact C-N 3.35Å; E734-C736 VanDerWaalsContact C-N 3.35Å; E734-C736 PolarHBondContact O-N 3.35Å; E734-L737 PolarHBondContact O-N 3.36Å; E734-K738 VanDerWaalsContact O-CB 3.23Å; E734-K738 WeakPolarHBondContact O-CB 3.29Å; E734-K738 PolarHBondContact O-N 2.52Å
735	V	92.3	Very high	91.8	Very high	22 Å²	22	38.3 Å²	38.3	13%	0.133	17%	0.173	C	C	.	.	H	α-helix	trans	-62.6	-43.4	175.4	178.4	0	0	0	0	110.9	V705 A711 D731 S732 L733 K738 Y739	V705-V735 HydrophobicContact CG2-CB 4.26Å; V705-V735 HydrophobicContact CG2-CG1 4.33Å; A711-V735 HydrophobicContact CB-CG1 4.09Å; D731-V735 WeakPolarHBondContact O-CG2 3.47Å; D731-V735 PolarHBondContact O-N 3.25Å; S732-V735 PolarHBondContact O-N 3.48Å; L733-V735 VanDerWaalsContact C-N 3.34Å; L733-V735 PolarHBondContact O-N 3.29Å; V735-K738 PolarHBondContact O-N 3.47Å; V735-Y739 HydrophobicContact CG1-CD2 3.95Å; V735-Y739 HydrophobicContact CG1-CE2 4.27Å; V735-Y739 WeakPolarHBondContact O-CD2 3.29Å; V735-Y739 PolarHBondContact O-N 3.39Å; V735-Y739 VanDerWaalsContact O-N 3.15Å
736	C	92.9	Very high	91.7	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-64	-46.1	177.9	-68.2	0	0	0	0	111.8	S732 L733 E734 K738 Y739 Y740 E741 F744	S732-C736 WeakPolarHBondContact O-CB 3.44Å; S732-C736 PolarHBondContact O-N 3.24Å; S732-C736 PolarHBondContact O-SG 2.97Å; L733-C736 PolarHBondContact O-N 3.27Å; L733-C736 VanDerWaalsContact O-N 3.14Å; E734-C736 VanDerWaalsContact C-N 3.35Å; E734-C736 PolarHBondContact O-N 3.35Å; C736-K738 VanDerWaalsContact C-N 3.29Å; C736-K738 PolarHBondContact O-N 3.38Å; C736-Y739 PolarHBondContact O-N 3.12Å; C736-Y740 CarbonylContact O-C 3.52Å; C736-Y740 VanDerWaalsContact O-CA 3.31Å; C736-Y740 WeakPolarHBondContact O-CA 3.08Å; C736-Y740 PolarHBondContact O-N 2.87Å; C736-E741 PolarHBondContact O-N 2.86Å; C736-E741 VanDerWaalsContact O-N 3.16Å; C736-F744 HydrophobicContact CB-CB 4.32Å; C736-F744 HydrophobicContact CB-CD2 4.14Å; C736-F744 HydrophobicContact CB-CG 4.09Å
737	L	91.3	Very high	91.6	Very high	10 Å²	10	44.1 Å²	44.1	5%	0.052	20%	0.201	C	C	.	.	H	α-helix	trans	-65.3	-33.2	177.7	-66.1	-177.1	0	0	0	111.8	L733 E734 E741 F744 M745 Q766 L770	L733-L737 HydrophobicContact CD1-CD1 4Å; L733-L737 HydrophobicContact CD1-CD2 4.19Å; L733-L737 HydrophobicContact CD1-CG 3.86Å; L733-L737 HydrophobicContact CD2-CD1 4.36Å; L733-L737 HydrophobicContact CG-CD1 3.85Å; L733-L737 HydrophobicContact CG-CG 4.08Å; L733-L737 WeakPolarHBondContact O-CB 3.27Å; L733-L737 VanDerWaalsContact O-CG 3.27Å; L733-L737 WeakPolarHBondContact O-CG 3.35Å; L733-L737 PolarHBondContact O-N 3.37Å; E734-L737 PolarHBondContact O-N 3.36Å; L737-E741 HydrophobicContact CD2-CG 4.04Å; L737-E741 VanDerWaalsContact O-CB 3.29Å; L737-E741 WeakPolarHBondContact O-CB 3.29Å; L737-F744 HydrophobicContact CD2-CD1 4.07Å; L737-F744 HydrophobicContact CD2-CE1 4.5Å; L737-M745 HydrophobicContact CD2-CG 4.42Å; L737-M745 HydrophobicContact CD2-SD 4.28Å; L737-Q766 HydrophobicContact CD1-CG 4.47Å; L737-L770 HydrophobicContact CD1-CD1 3.96Å; L737-L770 HydrophobicContact CD2-CD1 3.53Å; L737-L770 HydrophobicContact CG-CD1 4.31Å
738	K	91.4	Very high	91.5	Very high	147 Å²	147	44.1 Å²	44.1	64%	0.639	20%	0.201	S	C	*	.	H	α-helix	trans	-71.1	-39.3	178.9	-175.1	175.3	-177.9	177.5	0	113.7	E734 V735 C736	E734-K738 VanDerWaalsContact O-CB 3.23Å; E734-K738 WeakPolarHBondContact O-CB 3.29Å; E734-K738 PolarHBondContact O-N 2.52Å; V735-K738 PolarHBondContact O-N 3.47Å; C736-K738 VanDerWaalsContact C-N 3.29Å; C736-K738 PolarHBondContact O-N 3.38Å
739	Y	92.7	Very high	91.4	Very high	108 Å²	108	45 Å²	45	42%	0.424	21%	0.206	S	C	.	.	H	α-helix	trans	-110.7	-28.9	-171.7	-64	-69.3	0	0	0	114.8	R708 V735 C736	R708-Y739 HydrophobicContact CB-CD1 4.4Å; R708-Y739 HydrophobicContact CB-CD2 4.17Å; R708-Y739 HydrophobicContact CB-CE2 4.42Å; R708-Y739 HydrophobicContact CB-CG 4.17Å; R708-Y739 HydrophobicContact CG-CD1 4.26Å; R708-Y739 HydrophobicContact CG-CG 4.08Å; V735-Y739 HydrophobicContact CG1-CD2 3.95Å; V735-Y739 HydrophobicContact CG1-CE2 4.27Å; V735-Y739 WeakPolarHBondContact O-CD2 3.29Å; V735-Y739 PolarHBondContact O-N 3.39Å; V735-Y739 VanDerWaalsContact O-N 3.15Å; C736-Y739 PolarHBondContact O-N 3.12Å
740	Y	93.5	Very high	91.3	Very high	28 Å²	28	49.6 Å²	49.6	11%	0.11	23%	0.226	C	C	.	.	H	α-helix	trans	-136.9	36.4	-172.6	-60.5	-74.1	0	0	0	112.4	R708 A711 H712 L715 C736 Y742 E743 F744	R708-Y740 HydrophobicContact CG-CE2 3.76Å; R708-Y740 VanDerWaalsContact CG-OH 3.31Å; R708-Y740 WeakPolarHBondContact CG-OH 3.47Å; R708-Y740 PolarHBondContact NE-OH 3.38Å; R708-Y740 VanDerWaalsContact NE-OH 3.17Å; R708-Y740 WeakPolarHBondContact O-CE2 3.48Å; R708-Y740 PolarHBondContact O-OH 2.79Å; A711-Y740 HydrophobicContact CB-CD2 4.21Å; A711-Y740 HydrophobicContact CB-CE2 4.23Å; H712-Y740 HydrophobicContact CB-CE2 4.07Å; H712-Y740 AromaticContact ND1-CE1 4Å; L715-Y740 HydrophobicContact CD1-CD2 3.81Å; L715-Y740 HydrophobicContact CD1-CG 3.71Å; C736-Y740 CarbonylContact O-C 3.52Å; C736-Y740 VanDerWaalsContact O-CA 3.31Å; C736-Y740 WeakPolarHBondContact O-CA 3.08Å; C736-Y740 PolarHBondContact O-N 2.87Å; Y740-Y742 VanDerWaalsContact C-N 3.28Å; Y740-Y742 PolarHBondContact O-N 2.94Å; Y740-E743 PolarHBondContact O-N 3.01Å; Y740-F744 WeakPolarHBondContact O-CB 3.32Å; Y740-F744 PolarHBondContact O-N 3.44Å
741	E	92.4	Very high	91.4	Very high	54 Å²	54	50 Å²	50	25%	0.252	23%	0.228	S	C	.	.	H	α-helix	trans	-49.1	-47.9	-174.4	-158.9	-169.6	81	0	0	113.2	C736 L737 M745 L770 R774	C736-E741 PolarHBondContact O-N 2.86Å; C736-E741 VanDerWaalsContact O-N 3.16Å; L737-E741 HydrophobicContact CD2-CG 4.04Å; L737-E741 VanDerWaalsContact O-CB 3.29Å; L737-E741 WeakPolarHBondContact O-CB 3.29Å; E741-M745 WeakPolarHBondContact O-CB 3.41Å; E741-M745 VanDerWaalsContact O-CG 3.25Å; E741-M745 WeakPolarHBondContact O-CG 3.49Å; E741-M745 PolarHBondContact O-N 3.09Å; E741-M745 VanDerWaalsContact O-N 3.08Å; E741-L770 VanDerWaalsContact CD-CD2 3.41Å; E741-L770 HydrophobicContact CG-CD1 4.16Å; E741-L770 HydrophobicContact CG-CD2 4.08Å; E741-L770 WeakPolarHBondContact OE1-CD2 3.44Å; E741-R774 IonicContact OE1-CZ 3.32Å; E741-R774 IonicContact OE1-NE 2.76Å; E741-R774 IonicContact OE1-NH2 3.67Å; E741-R774 PolarHBondContact OE1-NH2 2.97Å
742	Y	90.8	Very high	91.4	Very high	153 Å²	153	48.8 Å²	48.8	60%	0.6	23%	0.225	S	C	*	.	H	α-helix	trans	-65.3	-52.1	-176.6	-177.3	-93.4	0	0	0	112	Y740 F744 M745 E746	Y740-Y742 VanDerWaalsContact C-N 3.28Å; Y740-Y742 PolarHBondContact O-N 2.94Å; Y742-F744 PolarHBondContact O-N 3.2Å; Y742-M745 PolarHBondContact O-N 3.3Å; Y742-E746 PolarHBondContact O-N 3.27Å
743	E	91.3	Very high	91.4	Very high	63 Å²	63	48.8 Å²	48.8	29%	0.294	23%	0.225	S	C	.	.	H	α-helix	trans	-65.1	-41.5	-177	-62.2	-178.9	-161.9	0	0	111.7	R719 Y740 L747	R719-E743 IonicContact NH2-OE2 2.84Å; R719-E743 PolarHBondContact NH2-OE2 3.07Å; Y740-E743 PolarHBondContact O-N 3.01Å; E743-L747 WeakPolarHBondContact O-CG 3.43Å; E743-L747 PolarHBondContact O-N 3.49Å
744	F	93.3	Very high	91.6	Very high	4 Å²	4	48.7 Å²	48.7	2%	0.018	23%	0.225	C	C	.	.	H	α-helix	trans	-63.5	-48.9	177.7	174.3	-98.6	0	0	0	111.3	L715 L726 I728 L733 C736 L737 Y740 Y742 E746 L747 A748	L715-F744 HydrophobicContact CD2-CB 4.08Å; L715-F744 HydrophobicContact CD2-CD2 3.96Å; L726-F744 HydrophobicContact CD2-CE2 4.05Å; L726-F744 HydrophobicContact CD2-CZ 4.1Å; I728-F744 HydrophobicContact CD1-CE2 3.57Å; I728-F744 HydrophobicContact CD1-CZ 3.74Å; I728-F744 HydrophobicContact CG2-CZ 4.46Å; L733-F744 HydrophobicContact CD1-CD1 4.13Å; L733-F744 HydrophobicContact CD1-CE1 3.29Å; L733-F744 HydrophobicContact CD1-CZ 3.58Å; C736-F744 HydrophobicContact CB-CB 4.32Å; C736-F744 HydrophobicContact CB-CD2 4.14Å; C736-F744 HydrophobicContact CB-CG 4.09Å; L737-F744 HydrophobicContact CD2-CD1 4.07Å; L737-F744 HydrophobicContact CD2-CE1 4.5Å; Y740-F744 WeakPolarHBondContact O-CB 3.32Å; Y740-F744 PolarHBondContact O-N 3.44Å; Y742-F744 PolarHBondContact O-N 3.2Å; F744-E746 VanDerWaalsContact C-N 3.31Å; F744-E746 PolarHBondContact O-N 2.74Å; F744-L747 PolarHBondContact O-N 3.09Å; F744-A748 HydrophobicContact CE1-CB 4.22Å; F744-A748 HydrophobicContact CZ-CB 4.22Å; F744-A748 WeakPolarHBondContact O-CB 3.38Å; F744-A748 PolarHBondContact O-N 3.34Å
745	M	92.3	Very high	91.8	Very high	4 Å²	4	43.3 Å²	43.3	2%	0.02	20%	0.199	C	C	.	.	H	α-helix	trans	-65.3	-34.9	-178.1	-72.7	-55.9	-58.9	0	0	112.3	W673 L737 E741 Y742 C749 L770 L771	W673-M745 HydrophobicContact CH2-CE 4.12Å; W673-M745 HydrophobicContact CZ3-CE 4.4Å; L737-M745 HydrophobicContact CD2-CG 4.42Å; L737-M745 HydrophobicContact CD2-SD 4.28Å; E741-M745 WeakPolarHBondContact O-CB 3.41Å; E741-M745 VanDerWaalsContact O-CG 3.25Å; E741-M745 WeakPolarHBondContact O-CG 3.49Å; E741-M745 PolarHBondContact O-N 3.09Å; E741-M745 VanDerWaalsContact O-N 3.08Å; Y742-M745 PolarHBondContact O-N 3.3Å; M745-C749 VanDerWaalsContact O-CB 3.22Å; M745-C749 WeakPolarHBondContact O-CB 3.46Å; M745-C749 PolarHBondContact O-N 3.14Å; M745-C749 PolarHBondContact O-SG 2.8Å; M745-L770 HydrophobicContact CE-CB 4.13Å; M745-L770 HydrophobicContact CG-CB 4.48Å; M745-L770 HydrophobicContact SD-CB 4.34Å; M745-L770 HydrophobicContact SD-CD1 4.47Å; M745-L771 HydrophobicContact CE-CD2 3.71Å; M745-L771 HydrophobicContact CE-CG 3.9Å
746	E	91	Very high	91.9	Very high	103 Å²	103	42.4 Å²	42.4	48%	0.481	19%	0.194	S	C	.	.	H	α-helix	trans	-61.7	-47.6	174.3	-173.7	177.6	-167.5	0	0	111.5	Y742 F744 Q750	Y742-E746 PolarHBondContact O-N 3.27Å; F744-E746 VanDerWaalsContact C-N 3.31Å; F744-E746 PolarHBondContact O-N 2.74Å; E746-Q750 WeakPolarHBondContact O-CG 3.48Å; E746-Q750 PolarHBondContact O-N 2.89Å
747	L	91.4	Very high	91.7	Very high	20 Å²	20	42.4 Å²	42.4	11%	0.105	19%	0.194	C	C	.	.	H	α-helix	trans	-66.6	-47.6	178.2	-67.5	173	0	0	0	112	L715 F718 R719 E743 F744 C749 Q750	L715-L747 HydrophobicContact CD2-CD1 4.16Å; F718-L747 HydrophobicContact CD1-CB 3.91Å; F718-L747 HydrophobicContact CD1-CD1 3.89Å; F718-L747 HydrophobicContact CD1-CG 4.47Å; F718-L747 HydrophobicContact CE1-CB 3.6Å; F718-L747 HydrophobicContact CE1-CD1 4.46Å; R719-L747 HydrophobicContact CB-CD1 4.26Å; R719-L747 HydrophobicContact CB-CD2 4.23Å; R719-L747 HydrophobicContact CG-CD2 4.13Å; E743-L747 WeakPolarHBondContact O-CG 3.43Å; E743-L747 PolarHBondContact O-N 3.49Å; F744-L747 PolarHBondContact O-N 3.09Å; L747-C749 VanDerWaalsContact C-N 3.27Å; L747-C749 PolarHBondContact O-N 3.1Å; L747-Q750 WeakPolarHBondContact O-CB 3.35Å; L747-Q750 PolarHBondContact O-N 3.12Å
748	A	92.6	Very high	91.2	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-60.9	-36.9	179.3	0	0	0	0	0	111.9	W673 L726 F744 Q750 C751	W673-A748 HydrophobicContact CH2-CB 3.85Å; W673-A748 HydrophobicContact CZ2-CB 4.29Å; W673-A748 WeakPolarHBondContact CZ2-O 3.33Å; L726-A748 HydrophobicContact CD2-CB 4.04Å; F744-A748 HydrophobicContact CE1-CB 4.22Å; F744-A748 HydrophobicContact CZ-CB 4.22Å; F744-A748 WeakPolarHBondContact O-CB 3.38Å; F744-A748 PolarHBondContact O-N 3.34Å; A748-Q750 PolarHBondContact O-N 3.5Å; A748-C751 WeakPolarHBondContact O-CB 3.47Å; A748-C751 PolarHBondContact O-N 3.35Å
749	C	91.3	Very high	90.8	Very high	17 Å²	17	38.9 Å²	38.9	12%	0.115	18%	0.177	C	C	.	.	H	α-helix	trans	-67	-19.3	174.3	-74.3	0	0	0	0	113.3	R671 M745 L747	R671-C749 VanDerWaalsContact CZ-O 3.26Å; R671-C749 PolarHBondContact NH1-O 3.18Å; M745-C749 VanDerWaalsContact O-CB 3.22Å; M745-C749 WeakPolarHBondContact O-CB 3.46Å; M745-C749 PolarHBondContact O-N 3.14Å; M745-C749 PolarHBondContact O-SG 2.8Å; L747-C749 VanDerWaalsContact C-N 3.27Å; L747-C749 PolarHBondContact O-N 3.1Å
750	Q	88.9	Confident	90.1	Very high	115 Å²	115	36.6 Å²	36.6	54%	0.537	17%	0.174	S	C	.	.	H	α-helix	trans	-80.9	-21.7	176	-67.3	173.3	20.5	0	0	112	E746 L747 A748	E746-Q750 WeakPolarHBondContact O-CG 3.48Å; E746-Q750 PolarHBondContact O-N 2.89Å; L747-Q750 WeakPolarHBondContact O-CB 3.35Å; L747-Q750 PolarHBondContact O-N 3.12Å; A748-Q750 PolarHBondContact O-N 3.5Å
751	C	90.1	Very high	89.4	Confident	8 Å²	8	36.7 Å²	36.7	5%	0.054	18%	0.179	C	C	.	.	S	Bend	trans	-66	142.2	179.8	-61.5	0	0	0	0	112.3	F718 A748 V754	F718-C751 WeakPolarHBondContact CZ-SG 3.32Å; A748-C751 WeakPolarHBondContact O-CB 3.47Å; A748-C751 PolarHBondContact O-N 3.35Å; C751-V754 HydrophobicContact CB-CG2 3.9Å
752	P	86.8	Confident	88.9	Confident	51 Å²	51	38.2 Å²	38.2	33%	0.331	19%	0.192	S	C	.	.	S	Bend	trans	-67.4	-35.2	174.4	25.6	-34.4	0	0	0	112.9
753	A	91	Very high	88.6	Confident	2 Å²	2	31.6 Å²	31.6	2%	0.017	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	146	175.3	0	0	0	0	0	110.2	L692 A725 L726	L692-A753 HydrophobicContact CD1-CB 4.2Å; L692-A753 HydrophobicContact CG-CB 4.07Å; A725-A753 WeakPolarHBondContact CA-O 3.25Å; A725-A753 HydrophobicContact CB-CB 4.43Å; L726-A753 PolarHBondContact N-O 3.37Å; L726-A753 VanDerWaalsContact N-O 3.12Å
754	V	95.1	Very high	88.5	Confident	1 Å²	1	28.8 Å²	28.8	1%	0.006	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	133.2	176.5	-178.6	0	0	0	0	108.5	W673 M674 L726 C751	W673-V754 CarbonylContact C-O 3.56Å; W673-V754 VanDerWaalsContact CA-O 3.29Å; W673-V754 WeakPolarHBondContact CA-O 3.35Å; W673-V754 HydrophobicContact CD2-CB 3.72Å; W673-V754 HydrophobicContact CD2-CG1 4.3Å; W673-V754 HydrophobicContact CD2-CG2 3.98Å; W673-V754 HydrophobicContact CE3-CB 4.15Å; W673-V754 HydrophobicContact CE3-CG1 4.22Å; W673-V754 HydrophobicContact CG-CB 3.88Å; W673-V754 HydrophobicContact CG-CG2 4.38Å; W673-V754 HydrophobicContact CH2-CG2 4.29Å; W673-V754 HydrophobicContact CZ2-CB 4.32Å; W673-V754 HydrophobicContact CZ2-CG2 3.69Å; W673-V754 HydrophobicContact CZ3-CG1 4.44Å; M674-V754 PolarHBondContact N-O 3.25Å; L726-V754 HydrophobicContact CB-CG1 4.33Å; L726-V754 HydrophobicContact CB-CG2 4.29Å; L726-V754 HydrophobicContact CD2-CG1 4.14Å; L726-V754 HydrophobicContact CG-CG1 4.36Å; L726-V754 CarbonylContact O-C 3.55Å; L726-V754 WeakPolarHBondContact O-CA 3.12Å; C751-V754 HydrophobicContact CB-CG2 3.9Å
755	V	95.4	Very high	88.4	Confident	0 Å²	0	29.5 Å²	29.5	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	114.9	175.7	-176.4	0	0	0	0	107.9	M674 A683 A687 L692 I693 L726 V727 I728	M674-V755 HydrophobicContact CB-CG1 4.37Å; M674-V755 HydrophobicContact CB-CG2 4.32Å; M674-V755 CarbonylContact O-C 3.5Å; M674-V755 WeakPolarHBondContact O-CA 3.44Å; M674-V755 HydrophobicContact SD-CG1 4.29Å; A683-V755 HydrophobicContact CB-CG1 3.86Å; A687-V755 HydrophobicContact CB-CG2 3.82Å; L692-V755 HydrophobicContact CD2-CG2 4.16Å; I693-V755 HydrophobicContact CD1-CG2 4.27Å; L726-V755 PolarHBondContact O-N 2.94Å; V727-V755 CarbonylContact C-O 3.44Å; V727-V755 VanDerWaalsContact CA-O 3.29Å; V727-V755 WeakPolarHBondContact CA-O 3.36Å; V727-V755 HydrophobicContact CG1-CB 4.46Å; V727-V755 HydrophobicContact CG2-CB 4.21Å; I728-V755 PolarHBondContact N-O 2.82Å
756	C	93.9	Very high	88.3	Confident	3 Å²	3	33.3 Å²	33.3	2%	0.02	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	123.4	172.8	-54.2	0	0	0	0	108.6	M674 L675 T676 I728 C759 I767	M674-C756 PolarHBondContact O-N 3.1Å; L675-C756 HydrophobicContact CD2-CB 3.56Å; L675-C756 VanDerWaalsContact CD2-SG 3.57Å; T676-C756 PolarHBondContact N-O 3.32Å; I728-C756 HydrophobicContact CG2-CB 4.33Å; I728-C756 CarbonylContact O-C 3.06Å; I728-C756 WeakPolarHBondContact O-CA 3.34Å; C756-C759 WeakPolarHBondContact CB-SG 3.41Å; C756-I767 HydrophobicContact CB-CD1 4.42Å
757	C	88.2	Confident	88.4	Confident	0 Å²	0	28.6 Å²	28.6	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	154.8	-177.6	13.3	0	0	0	0	110.5	T676 D678 A683 I728 S729 G730 C759	T676-C757 HydrophobicContact CG2-CB 4.45Å; T676-C757 CarbonylContact O-C 3.37Å; T676-C757 WeakPolarHBondContact O-CA 3.3Å; D678-C757 VanDerWaalsContact O-CB 3.23Å; D678-C757 WeakPolarHBondContact O-CB 3.01Å; A683-C757 HydrophobicContact CB-CB 4.03Å; I728-C757 PolarHBondContact O-N 2.97Å; I728-C757 PolarHBondContact O-SG 2.93Å; S729-C757 CarbonylContact C-O 3.53Å; S729-C757 WeakPolarHBondContact CA-O 3.26Å; G730-C757 PolarHBondContact N-O 2.85Å; C757-C759 PolarHBondContact O-N 2.9Å
758	R	82	Confident	88.5	Confident	75 Å²	75	27.7 Å²	27.7	28%	0.283	15%	0.15	S	C	.	.	S	Bend	trans	51.6	38	-173.2	-55.2	-170.7	-174.4	-178.9	4.8	114	Y545 T676 G677 D678	Y545-R758 VanDerWaalsContact CZ-NH2 3.34Å; Y545-R758 PolarHBondContact OH-NH1 2.9Å; Y545-R758 PolarHBondContact OH-NH2 3.25Å; T676-R758 PolarHBondContact O-N 3.4Å; G677-R758 WeakPolarHBondContact O-CA 3.28Å; D678-R758 PolarHBondContact O-N 3.11Å
759	C	82.1	Confident	88.5	Confident	7 Å²	7	34 Å²	34	5%	0.047	17%	0.174	C	C	.	.			trans	-78.1	128.9	176.6	-63.7	0	0	0	0	110.1	T676 C756 C757 K764	T676-C759 PolarHBondContact O-N 3.24Å; C756-C759 WeakPolarHBondContact CB-SG 3.41Å; C757-C759 PolarHBondContact O-N 2.9Å; C759-K764 HydrophobicContact CB-CG 3.81Å
760	T	79.5	Confident	88.6	Confident	60 Å²	60	33.5 Å²	33.5	37%	0.368	17%	0.171	S	C	.	.			trans	-71.4	156.7	165.8	67.7	0	0	0	0	110.3	T762 Q763 K764	T760-T762 PolarHBondContact O-N 2.93Å; T760-T762 PolarHBondContact OG1-OG1 3.32Å; T760-Q763 WeakPolarHBondContact O-CB 3.09Å; T760-Q763 PolarHBondContact O-N 3.41Å; T760-Q763 VanDerWaalsContact O-N 3.08Å; T760-Q763 WeakPolarHBondContact OG1-CB 3.32Å; T760-Q763 VanDerWaalsContact OG1-CG 3.23Å; T760-Q763 WeakPolarHBondContact OG1-CG 3.45Å; T760-Q763 PolarHBondContact OG1-N 2.9Å; T760-K764 WeakPolarHBondContact O-CG 3.37Å; T760-K764 PolarHBondContact O-N 3.14Å
761	P	79	Confident	88.8	Confident	31 Å²	31	28 Å²	28	20%	0.201	15%	0.145	C	C	.	.	H	α-helix	trans	-51.4	-42.2	174.8	-30.4	37.3	0	0	0	113.2	Q763 K764 A765 N787 S790	P761-Q763 PolarHBondContact O-N 3.18Å; P761-K764 PolarHBondContact O-N 3.12Å; P761-A765 PolarHBondContact O-N 2.87Å; P761-A765 VanDerWaalsContact O-N 3.13Å; P761-N787 WeakPolarHBondContact CB-O 3.46Å; P761-N787 HydrophobicContact CG-CB 4.16Å; P761-S790 PolarHBondContact O-OG 3.43Å
762	T	80.7	Confident	88.8	Confident	86 Å²	86	29.1 Å²	29.1	53%	0.528	15%	0.149	S	C	.	.	H	α-helix	trans	-65.3	-39.9	178.6	53.2	0	0	0	0	112.5	T760 A765 Q766	T760-T762 PolarHBondContact O-N 2.93Å; T760-T762 PolarHBondContact OG1-OG1 3.32Å; T762-A765 PolarHBondContact O-N 2.8Å; T762-Q766 WeakPolarHBondContact O-CB 3.44Å; T762-Q766 PolarHBondContact O-N 2.71Å
763	Q	85.1	Confident	89	Confident	14 Å²	14	31.3 Å²	31.3	7%	0.065	16%	0.155	C	C	.	.	H	α-helix	trans	-64.1	-41.2	173.7	-74.5	171.1	-16.3	0	0	111.5	G730 T760 P761 A765 Q766 I767	G730-Q763 PolarHBondContact O-NE2 3.05Å; T760-Q763 WeakPolarHBondContact O-CB 3.09Å; T760-Q763 PolarHBondContact O-N 3.41Å; T760-Q763 VanDerWaalsContact O-N 3.08Å; T760-Q763 WeakPolarHBondContact OG1-CB 3.32Å; T760-Q763 VanDerWaalsContact OG1-CG 3.23Å; T760-Q763 WeakPolarHBondContact OG1-CG 3.45Å; T760-Q763 PolarHBondContact OG1-N 2.9Å; P761-Q763 PolarHBondContact O-N 3.18Å; Q763-A765 VanDerWaalsContact C-N 3.34Å; Q763-A765 PolarHBondContact O-N 3.16Å; Q763-Q766 WeakPolarHBondContact O-CB 3.41Å; Q763-Q766 PolarHBondContact O-N 3.45Å; Q763-Q766 VanDerWaalsContact O-N 3.16Å; Q763-I767 WeakPolarHBondContact O-CG1 3.35Å; Q763-I767 PolarHBondContact O-N 3.45Å
764	K	89.7	Confident	88.9	Confident	4 Å²	4	36.5 Å²	36.5	2%	0.017	17%	0.174	C	C	.	.	H	α-helix	trans	-57.4	-47.9	176.2	-62.9	-169.6	-171.4	-175.5	0	111.1	D391 L675 C759 T760 P761 Q766 I767 V768 D788 M791	D391-K764 IonicContact OD1-NZ 2.82Å; D391-K764 PolarHBondContact OD1-NZ 3.37Å; L675-K764 HydrophobicContact CB-CD 4.2Å; L675-K764 HydrophobicContact CB-CG 4.13Å; L675-K764 HydrophobicContact CD1-CB 4.11Å; L675-K764 HydrophobicContact CD1-CG 4.31Å; L675-K764 WeakPolarHBondContact O-CE 3.41Å; L675-K764 PolarHBondContact O-NZ 3.43Å; C759-K764 HydrophobicContact CB-CG 3.81Å; T760-K764 WeakPolarHBondContact O-CG 3.37Å; T760-K764 PolarHBondContact O-N 3.14Å; P761-K764 PolarHBondContact O-N 3.12Å; K764-Q766 PolarHBondContact O-N 3.01Å; K764-I767 PolarHBondContact O-N 2.77Å; K764-V768 WeakPolarHBondContact O-CG2 3.24Å; K764-V768 PolarHBondContact O-N 2.82Å; K764-D788 IonicContact NZ-OD1 3.77Å; K764-D788 PolarHBondContact NZ-OD1 3.46Å; K764-M791 HydrophobicContact CB-CB 3.97Å; K764-M791 HydrophobicContact CB-CG 4.18Å; K764-M791 HydrophobicContact CB-SD 4.26Å; K764-M791 HydrophobicContact CD-SD 4.29Å
765	A	89.3	Confident	88.6	Confident	18 Å²	18	38.3 Å²	38.3	15%	0.149	19%	0.185	C	C	.	.	H	α-helix	trans	-62.6	-40.2	176.1	0	0	0	0	0	112.5	P761 T762 Q763 I767 V768 R769 E794	P761-A765 PolarHBondContact O-N 2.87Å; P761-A765 VanDerWaalsContact O-N 3.13Å; T762-A765 PolarHBondContact O-N 2.8Å; Q763-A765 VanDerWaalsContact C-N 3.34Å; Q763-A765 PolarHBondContact O-N 3.16Å; A765-I767 PolarHBondContact O-N 2.84Å; A765-V768 WeakPolarHBondContact O-CB 3.29Å; A765-V768 PolarHBondContact O-N 3.14Å; A765-R769 PolarHBondContact O-N 3.5Å; A765-E794 HydrophobicContact CB-CB 4.26Å
766	Q	90.8	Very high	88.2	Confident	85 Å²	85	41.6 Å²	41.6	40%	0.397	22%	0.219	S	C	.	.	H	α-helix	trans	-61.3	-42	177	-173.4	177.6	-2.1	0	0	112.1	L737 T762 Q763 K764 V768 R769 L770	L737-Q766 HydrophobicContact CD1-CG 4.47Å; T762-Q766 WeakPolarHBondContact O-CB 3.44Å; T762-Q766 PolarHBondContact O-N 2.71Å; Q763-Q766 WeakPolarHBondContact O-CB 3.41Å; Q763-Q766 PolarHBondContact O-N 3.45Å; Q763-Q766 VanDerWaalsContact O-N 3.16Å; K764-Q766 PolarHBondContact O-N 3.01Å; Q766-V768 PolarHBondContact O-N 2.87Å; Q766-R769 PolarHBondContact O-N 2.72Å; Q766-L770 HydrophobicContact CG-CD1 4.07Å; Q766-L770 HydrophobicContact CG-CG 4.39Å; Q766-L770 WeakPolarHBondContact O-CB 3.47Å; Q766-L770 VanDerWaalsContact O-CG 3.28Å; Q766-L770 WeakPolarHBondContact O-CG 3.14Å; Q766-L770 PolarHBondContact O-N 3.4Å
767	I	93.3	Very high	88.1	Confident	4 Å²	4	46 Å²	46	2%	0.021	24%	0.238	C	C	.	.	H	α-helix	trans	-60.8	-45.6	176.7	-64.7	163.8	0	0	0	110.8	L389 W673 L675 L733 C756 Q763 K764 A765 R769 L770 L771	L389-I767 HydrophobicContact CD2-CG2 4.05Å; W673-I767 HydrophobicContact CE3-CG2 3.91Å; W673-I767 HydrophobicContact CZ3-CG2 3.8Å; L675-I767 HydrophobicContact CD1-CB 4.31Å; L675-I767 HydrophobicContact CD1-CD1 4.02Å; L675-I767 HydrophobicContact CD1-CG2 4.31Å; L675-I767 HydrophobicContact CD2-CD1 3.67Å; L675-I767 HydrophobicContact CD2-CG2 4.43Å; L733-I767 HydrophobicContact CD2-CD1 3.55Å; L733-I767 HydrophobicContact CD2-CG1 3.9Å; C756-I767 HydrophobicContact CB-CD1 4.42Å; Q763-I767 WeakPolarHBondContact O-CG1 3.35Å; Q763-I767 PolarHBondContact O-N 3.45Å; K764-I767 PolarHBondContact O-N 2.77Å; A765-I767 PolarHBondContact O-N 2.84Å; I767-R769 VanDerWaalsContact C-N 3.33Å; I767-R769 PolarHBondContact O-N 3.23Å; I767-L770 PolarHBondContact O-N 2.89Å; I767-L771 HydrophobicContact CG2-CD1 4.21Å; I767-L771 WeakPolarHBondContact O-CG 3.39Å; I767-L771 PolarHBondContact O-N 3.48Å
768	V	93.8	Very high	88.3	Confident	0 Å²	0	46.7 Å²	46.7	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-57.2	-49	177.5	175.5	0	0	0	0	110.7	L389 K764 A765 Q766 L771 Q772 M791 E794 A795	L389-V768 HydrophobicContact CD1-CG2 4.07Å; L389-V768 HydrophobicContact CD2-CG2 3.67Å; L389-V768 HydrophobicContact CG-CG2 4.34Å; K764-V768 WeakPolarHBondContact O-CG2 3.24Å; K764-V768 PolarHBondContact O-N 2.82Å; A765-V768 WeakPolarHBondContact O-CB 3.29Å; A765-V768 PolarHBondContact O-N 3.14Å; Q766-V768 PolarHBondContact O-N 2.87Å; V768-L771 WeakPolarHBondContact O-CB 3.37Å; V768-L771 PolarHBondContact O-N 3.46Å; V768-Q772 WeakPolarHBondContact O-CG 3.28Å; V768-Q772 PolarHBondContact O-N 3.46Å; V768-Q772 VanDerWaalsContact O-N 3.07Å; V768-M791 HydrophobicContact CG2-CG 3.56Å; V768-E794 HydrophobicContact CB-CG 4.46Å; V768-E794 HydrophobicContact CG1-CB 4.33Å; V768-E794 HydrophobicContact CG1-CG 4.34Å; V768-A795 VanDerWaalsContact CG1-CA 3.48Å; V768-A795 HydrophobicContact CG1-CB 3.87Å
769	R	92.2	Very high	88.9	Confident	132 Å²	132	43.1 Å²	43.1	50%	0.498	23%	0.228	S	C	.	.	H	α-helix	trans	-62.5	-44.3	-179.8	-177	176.1	169.7	-174.1	-4.5	112.2	A765 Q766 I767 L771 Q772 E773 E794	A765-R769 PolarHBondContact O-N 3.5Å; Q766-R769 PolarHBondContact O-N 2.72Å; I767-R769 VanDerWaalsContact C-N 3.33Å; I767-R769 PolarHBondContact O-N 3.23Å; R769-L771 VanDerWaalsContact C-N 3.34Å; R769-L771 PolarHBondContact O-N 2.99Å; R769-Q772 PolarHBondContact O-N 3.18Å; R769-E773 HydrophobicContact CG-CG 4.41Å; R769-E773 IonicContact CZ-OE1 2.71Å; R769-E773 IonicContact NE-OE1 3.86Å; R769-E773 PolarHBondContact NE-OE1 2.94Å; R769-E773 IonicContact NH2-OE1 2.72Å; R769-E773 PolarHBondContact NH2-OE1 3.39Å; R769-E773 VanDerWaalsContact NH2-OE1 3.15Å; R769-E773 WeakPolarHBondContact O-CG 3.2Å; R769-E773 PolarHBondContact O-N 3.47Å; R769-E794 HydrophobicContact CB-CG 4.04Å
770	L	92.8	Very high	89.6	Confident	8 Å²	8	42.8 Å²	42.8	4%	0.042	23%	0.226	C	C	.	.	H	α-helix	trans	-63.3	-39.8	177.6	-72.1	174.6	0	0	0	111.8	L737 E741 M745 Q766 I767 Q772 E773 R774	L737-L770 HydrophobicContact CD1-CD1 3.96Å; L737-L770 HydrophobicContact CD2-CD1 3.53Å; L737-L770 HydrophobicContact CG-CD1 4.31Å; E741-L770 VanDerWaalsContact CD-CD2 3.41Å; E741-L770 HydrophobicContact CG-CD1 4.16Å; E741-L770 HydrophobicContact CG-CD2 4.08Å; E741-L770 WeakPolarHBondContact OE1-CD2 3.44Å; M745-L770 HydrophobicContact CE-CB 4.13Å; M745-L770 HydrophobicContact CG-CB 4.48Å; M745-L770 HydrophobicContact SD-CB 4.34Å; M745-L770 HydrophobicContact SD-CD1 4.47Å; Q766-L770 HydrophobicContact CG-CD1 4.07Å; Q766-L770 HydrophobicContact CG-CG 4.39Å; Q766-L770 WeakPolarHBondContact O-CB 3.47Å; Q766-L770 VanDerWaalsContact O-CG 3.28Å; Q766-L770 WeakPolarHBondContact O-CG 3.14Å; Q766-L770 PolarHBondContact O-N 3.4Å; I767-L770 PolarHBondContact O-N 2.89Å; L770-Q772 PolarHBondContact O-N 2.82Å; L770-E773 PolarHBondContact O-N 3.32Å; L770-R774 WeakPolarHBondContact O-CB 3.43Å; L770-R774 WeakPolarHBondContact O-CG 3.39Å; L770-R774 PolarHBondContact O-N 3.21Å
771	L	93.5	Very high	90.4	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-60.8	-44.4	174.3	-79.6	172.6	0	0	0	112	Y387 L389 W673 M745 I767 V768 R769 T775 T779	Y387-L771 HydrophobicContact CD1-CD2 4.41Å; Y387-L771 HydrophobicContact CE1-CD2 4.28Å; L389-L771 HydrophobicContact CD1-CD1 4.2Å; L389-L771 HydrophobicContact CD2-CD1 3.93Å; L389-L771 HydrophobicContact CG-CD1 4.35Å; W673-L771 HydrophobicContact CD2-CD1 4.23Å; W673-L771 HydrophobicContact CE3-CD1 3.85Å; W673-L771 HydrophobicContact CH2-CD1 4.35Å; W673-L771 HydrophobicContact CH2-CD2 3.66Å; W673-L771 HydrophobicContact CH2-CG 4.29Å; W673-L771 HydrophobicContact CZ2-CD2 3.93Å; W673-L771 HydrophobicContact CZ3-CD1 3.91Å; W673-L771 HydrophobicContact CZ3-CD2 4.02Å; W673-L771 HydrophobicContact CZ3-CG 4.15Å; M745-L771 HydrophobicContact CE-CD2 3.71Å; M745-L771 HydrophobicContact CE-CG 3.9Å; I767-L771 HydrophobicContact CG2-CD1 4.21Å; I767-L771 WeakPolarHBondContact O-CG 3.39Å; I767-L771 PolarHBondContact O-N 3.48Å; V768-L771 WeakPolarHBondContact O-CB 3.37Å; V768-L771 PolarHBondContact O-N 3.46Å; R769-L771 VanDerWaalsContact C-N 3.34Å; R769-L771 PolarHBondContact O-N 2.99Å; L771-T775 HydrophobicContact CD2-CG2 4.4Å; L771-T775 VanDerWaalsContact O-CB 3.32Å; L771-T775 WeakPolarHBondContact O-CB 3.4Å; L771-T775 WeakPolarHBondContact O-CG2 3.49Å; L771-T775 PolarHBondContact O-N 3.23Å; L771-T775 PolarHBondContact O-OG1 3.2Å; L771-T779 HydrophobicContact CB-CG2 3.96Å
772	Q	91.7	Very high	91.2	Very high	30 Å²	30	38.5 Å²	38.5	14%	0.14	20%	0.199	C	C	.	.	H	α-helix	trans	-62.7	-51.3	177.3	-70	168	-19.4	0	0	111.5	V768 R769 L770 R774 G776 T779 E794 D796	V768-Q772 WeakPolarHBondContact O-CG 3.28Å; V768-Q772 PolarHBondContact O-N 3.46Å; V768-Q772 VanDerWaalsContact O-N 3.07Å; R769-Q772 PolarHBondContact O-N 3.18Å; L770-Q772 PolarHBondContact O-N 2.82Å; Q772-R774 PolarHBondContact O-N 2.72Å; Q772-G776 WeakPolarHBondContact O-CA 3.4Å; Q772-G776 PolarHBondContact O-N 2.93Å; Q772-T779 HydrophobicContact CG-CG2 3.72Å; Q772-T779 WeakPolarHBondContact CG-OG1 3.46Å; Q772-T779 PolarHBondContact NE2-OG1 3.07Å; Q772-E794 PolarHBondContact NE2-O 2.88Å; Q772-D796 VanDerWaalsContact NE2-N 3.17Å; Q772-D796 PolarHBondContact NE2-OD2 2.98Å
773	E	89.8	Confident	91.7	Very high	98 Å²	98	34.4 Å²	34.4	46%	0.458	17%	0.174	S	C	.	.	H	α-helix	trans	-65.9	-35.7	-176.7	-71.9	-177.2	-172.9	0	0	112.6	R769 L770	R769-E773 HydrophobicContact CG-CG 4.41Å; R769-E773 IonicContact CZ-OE1 2.71Å; R769-E773 IonicContact NE-OE1 3.86Å; R769-E773 PolarHBondContact NE-OE1 2.94Å; R769-E773 IonicContact NH2-OE1 2.72Å; R769-E773 PolarHBondContact NH2-OE1 3.39Å; R769-E773 VanDerWaalsContact NH2-OE1 3.15Å; R769-E773 WeakPolarHBondContact O-CG 3.2Å; R769-E773 PolarHBondContact O-N 3.47Å; L770-E773 PolarHBondContact O-N 3.32Å
774	R	88.7	Confident	91.7	Very high	111 Å²	111	33.7 Å²	33.7	42%	0.419	17%	0.171	S	C	.	.	H	α-helix	trans	-88	-39.8	-175.3	-62.2	-72	172.6	-101.7	-0.4	113	E741 L770 Q772	E741-R774 IonicContact OE1-CZ 3.32Å; E741-R774 IonicContact OE1-NE 2.76Å; E741-R774 IonicContact OE1-NH2 3.67Å; E741-R774 PolarHBondContact OE1-NH2 2.97Å; L770-R774 WeakPolarHBondContact O-CB 3.43Å; L770-R774 WeakPolarHBondContact O-CG 3.39Å; L770-R774 PolarHBondContact O-N 3.21Å; Q772-R774 PolarHBondContact O-N 2.72Å
775	T	88.7	Confident	91	Very high	38 Å²	38	33.6 Å²	33.6	23%	0.233	17%	0.171	C	C	.	.	H	α-helix	trans	-92.5	-22.6	-176.2	72.7	0	0	0	0	112.9	Y387 L771 K777	Y387-T775 HydrophobicContact CE2-CG2 3.84Å; L771-T775 HydrophobicContact CD2-CG2 4.4Å; L771-T775 VanDerWaalsContact O-CB 3.32Å; L771-T775 WeakPolarHBondContact O-CB 3.4Å; L771-T775 WeakPolarHBondContact O-CG2 3.49Å; L771-T775 PolarHBondContact O-N 3.23Å; L771-T775 PolarHBondContact O-OG1 3.2Å; T775-K777 PolarHBondContact O-N 2.91Å; T775-K777 VanDerWaalsContact O-N 3.16Å; T775-K777 PolarHBondContact OG1-N 2.82Å
776	G	87.6	Confident	90	Very high	69 Å²	69	33.6 Å²	33.6	71%	0.711	17%	0.172	S	C	*	.			trans	61.8	14.2	-171	0	0	0	0	0	113.5	Q772	Q772-G776 WeakPolarHBondContact O-CA 3.4Å; Q772-G776 PolarHBondContact O-N 2.93Å
777	K	90.8	Very high	89.4	Confident	96 Å²	96	31.4 Å²	31.4	42%	0.417	16%	0.163	S	C	.	.			trans	-101.2	153.4	-179.8	-59.4	-173.1	-173.2	170.7	0	110.8	Y387 T775	Y387-K777 HydrophobicContact CD2-CB 4.26Å; Y387-K777 HydrophobicContact CE2-CB 4.26Å; Y387-K777 HydrophobicContact CE2-CD 4Å; T775-K777 PolarHBondContact O-N 2.91Å; T775-K777 VanDerWaalsContact O-N 3.16Å; T775-K777 PolarHBondContact OG1-N 2.82Å
778	L	93.3	Very high	88.9	Confident	14 Å²	14	31.4 Å²	31.4	7%	0.073	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	131.7	179.5	-65.7	176	0	0	0	111.7	L295 Q381 R384 S386 Y387 D796	L295-L778 HydrophobicContact CB-CD1 4.27Å; L295-L778 HydrophobicContact CB-CD2 4.09Å; L295-L778 HydrophobicContact CD2-CD1 3.96Å; L295-L778 HydrophobicContact CD2-CD2 4.26Å; L295-L778 HydrophobicContact CD2-CG 4.04Å; Q381-L778 HydrophobicContact CB-CD1 4.32Å; Q381-L778 HydrophobicContact CG-CD1 4.3Å; R384-L778 HydrophobicContact CB-CD1 3.76Å; S386-L778 PolarHBondContact N-O 3.33Å; Y387-L778 PolarHBondContact N-O 3.25Å; L778-D796 WeakPolarHBondContact CA-OD2 3.22Å; L778-D796 HydrophobicContact CD2-CB 3.85Å
779	T	95.3	Very high	88.3	Confident	0 Å²	0	32 Å²	32	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	142.3	175.4	61.1	0	0	0	0	110.8	Y387 L389 L771 Q772 D796 C797	Y387-T779 CarbonylContact O-C 3.46Å; Y387-T779 WeakPolarHBondContact O-CA 3.38Å; L389-T779 HydrophobicContact CD1-CG2 4.32Å; L771-T779 HydrophobicContact CB-CG2 3.96Å; Q772-T779 HydrophobicContact CG-CG2 3.72Å; Q772-T779 WeakPolarHBondContact CG-OG1 3.46Å; Q772-T779 PolarHBondContact NE2-OG1 3.07Å; T779-D796 PolarHBondContact N-OD2 2.98Å; T779-D796 WeakPolarHBondContact O-CB 3.27Å; T779-D796 PolarHBondContact O-N 3.15Å; T779-D796 PolarHBondContact OG1-N 3.45Å; T779-D796 PolarHBondContact OG1-OD2 2.94Å; T779-C797 PolarHBondContact O-N 3.36Å; T779-C797 VanDerWaalsContact O-N 3.16Å
780	C	96	Very high	87.9	Confident	0 Å²	0	26.2 Å²	26.2	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	132.8	169.7	-175.6	0	0	0	0	108.8	I385 Y387 L388 L389 C797	I385-C780 HydrophobicContact CB-CB 4.31Å; I385-C780 HydrophobicContact CD1-CB 3.56Å; I385-C780 HydrophobicContact CG1-CB 3.88Å; I385-C780 HydrophobicContact CG2-CB 3.47Å; I385-C780 VanDerWaalsContact CG2-CB 3.47Å; Y387-C780 PolarHBondContact O-N 3.47Å; L388-C780 CarbonylContact C-O 3.5Å; L388-C780 WeakPolarHBondContact CA-O 3.21Å; L388-C780 HydrophobicContact CD1-CB 3.73Å; L389-C780 PolarHBondContact N-O 2.82Å; C780-C797 CarbonylContact C-O 3.51Å; C780-C797 WeakPolarHBondContact CA-O 3.45Å; C780-C797 HydrophobicContact CB-CB 4.44Å
781	A	95.8	Very high	87.8	Confident	0 Å²	0	25.9 Å²	25.9	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	137.4	175.1	0	0	0	0	0	110.3	L389 M791 I792 A795 C797 V799	L389-A781 CarbonylContact O-C 3.11Å; L389-A781 VanDerWaalsContact O-CA 3.28Å; L389-A781 WeakPolarHBondContact O-CA 3.34Å; A781-M791 HydrophobicContact CB-CE 4.17Å; A781-M791 HydrophobicContact CB-CG 3.77Å; A781-M791 WeakPolarHBondContact CB-O 3.4Å; A781-M791 HydrophobicContact CB-SD 4.28Å; A781-I792 HydrophobicContact CB-CG1 4.35Å; A781-A795 HydrophobicContact CB-CB 3.47Å; A781-A795 VanDerWaalsContact CB-CB 3.47Å; A781-C797 PolarHBondContact N-O 3.2Å; A781-V799 PolarHBondContact O-N 2.88Å
782	V	95.6	Very high	87.7	Confident	1 Å²	1	25.9 Å²	25.9	1%	0.006	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	130.6	179.4	-166.1	0	0	0	0	109.5	L388 L389 T390 D391 T395 M791 V799 V801 F820 L823	L388-V782 HydrophobicContact CD1-CG2 3.53Å; L388-V782 HydrophobicContact CG-CG2 4.32Å; L389-V782 PolarHBondContact O-N 2.87Å; T390-V782 WeakPolarHBondContact CA-O 3.33Å; D391-V782 PolarHBondContact N-O 3.15Å; T395-V782 HydrophobicContact CG2-CB 4.34Å; T395-V782 HydrophobicContact CG2-CG1 3.76Å; V782-M791 WeakPolarHBondContact O-CE 3.44Å; V782-V799 VanDerWaalsContact CA-O 3.28Å; V782-V799 WeakPolarHBondContact CA-O 3.14Å; V782-V799 HydrophobicContact CG1-CB 4.38Å; V782-V799 HydrophobicContact CG1-CG1 4.46Å; V782-V799 HydrophobicContact CG2-CB 4.2Å; V782-V801 HydrophobicContact CG1-CG2 3.68Å; V782-F820 HydrophobicContact CG1-CD2 4.37Å; V782-F820 HydrophobicContact CG1-CE2 4.47Å; V782-L823 HydrophobicContact CG2-CD2 3.94Å
783	G	91.4	Very high	87.5	Confident	0 Å²	0	25.6 Å²	25.6	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-163.1	166.1	177.7	0	0	0	0	0	111.4	T395 D788 V799 G800 V801 A809	T395-G783 VanDerWaalsContact OG1-CA 3.3Å; T395-G783 WeakPolarHBondContact OG1-CA 3.49Å; G783-D788 WeakPolarHBondContact CA-OD2 3.27Å; G783-V799 PolarHBondContact N-O 2.97Å; G783-G800 CarbonylContact O-C 3.57Å; G783-G800 VanDerWaalsContact O-CA 3.28Å; G783-G800 WeakPolarHBondContact O-CA 3.47Å; G783-V801 PolarHBondContact O-N 3.36Å; G783-A809 WeakPolarHBondContact O-CB 3.41Å
784	D	85.5	Confident	87.5	Confident	0 Å²	0	23.4 Å²	23.4	0%	0	13%	0.133	C	C	.	.			trans	-122.1	-32	179.3	71.5	-48.9	0	0	0	112.8	G394 T395 V801 A809	G394-D784 VanDerWaalsContact C-OD2 3.3Å; G394-D784 WeakPolarHBondContact CA-OD2 3.39Å; T395-D784 PolarHBondContact OG1-N 3.08Å; T395-D784 PolarHBondContact OG1-OD1 3.32Å; D784-V801 WeakPolarHBondContact CA-O 3.41Å; D784-V801 HydrophobicContact CB-CB 4.09Å; D784-V801 VanDerWaalsContact CB-O 3.25Å; D784-V801 WeakPolarHBondContact CB-O 3.31Å; D784-A809 WeakPolarHBondContact O-CB 3.32Å
785	G	75.9	Confident	87.7	Confident	2 Å²	2	18.1 Å²	18.1	2%	0.021	11%	0.114	C	C	.	.	S	Bend	trans	-84.6	169.1	-177.8	0	0	0	0	0	115.9	N787 D788	G785-N787 PolarHBondContact O-N 3.07Å; G785-D788 PolarHBondContact O-N 3.34Å
786	G	68.7	Low	87.9	Confident	18 Å²	18	18.4 Å²	18.4	19%	0.186	11%	0.114	C	C	.	.	G	3₁₀ helix	trans	-60.7	-31.8	175.4	0	0	0	0	0	113.7	D788 V789	G786-D788 PolarHBondContact O-N 3.21Å; G786-V789 WeakPolarHBondContact O-CB 3.45Å; G786-V789 VanDerWaalsContact O-CG2 3.31Å; G786-V789 WeakPolarHBondContact O-CG2 3.49Å; G786-V789 PolarHBondContact O-N 3.43Å
787	N	76.3	Confident	88.1	Confident	39 Å²	39	15.1 Å²	15.1	21%	0.209	8%	0.08	C	C	.	.	G	3₁₀ helix	trans	-59.8	-31.7	178.2	-73.2	-9.6	0	0	0	113.8	L192 D193 P761 G785 V789 S790	L192-N787 PolarHBondContact O-OD1 3.47Å; L192-N787 VanDerWaalsContact O-OD1 3.11Å; D193-N787 VanDerWaalsContact C-CG 3.48Å; D193-N787 WeakPolarHBondContact CA-OD1 3.42Å; D193-N787 PolarHBondContact O-ND2 3.18Å; P761-N787 WeakPolarHBondContact CB-O 3.46Å; P761-N787 HydrophobicContact CG-CB 4.16Å; G785-N787 PolarHBondContact O-N 3.07Å; N787-V789 VanDerWaalsContact C-N 3.34Å; N787-S790 PolarHBondContact O-OG 3.46Å
788	D	83.5	Confident	88.3	Confident	3 Å²	3	10.6 Å²	10.6	2%	0.016	6%	0.06	C	C	.	.	G	3₁₀ helix	trans	-88	-9.7	-173	-58.4	-38	0	0	0	112.3	D391 K764 G783 G785 G786 S790 M791 I792	D391-D788 VanDerWaalsContact CB-OD2 3.32Å; D391-D788 WeakPolarHBondContact CB-OD2 3.46Å; K764-D788 IonicContact NZ-OD1 3.77Å; K764-D788 PolarHBondContact NZ-OD1 3.46Å; G783-D788 WeakPolarHBondContact CA-OD2 3.27Å; G785-D788 PolarHBondContact O-N 3.34Å; G786-D788 PolarHBondContact O-N 3.21Å; D788-S790 PolarHBondContact O-N 3.42Å; D788-M791 HydrophobicContact CB-CE 4Å; D788-M791 WeakPolarHBondContact O-CB 3.5Å; D788-M791 PolarHBondContact O-N 3.02Å; D788-I792 HydrophobicContact CB-CD1 4.02Å; D788-I792 HydrophobicContact CB-CG1 4.41Å; D788-I792 WeakPolarHBondContact O-CB 3.31Å; D788-I792 VanDerWaalsContact O-CG1 3.23Å; D788-I792 WeakPolarHBondContact O-CG1 3.4Å; D788-I792 PolarHBondContact O-N 3.27Å
789	V	81.8	Confident	88.4	Confident	12 Å²	12	9.9 Å²	9.9	7%	0.073	6%	0.057	C	C	.	.	H	α-helix	trans	-53.9	-42.6	179.7	171.5	0	0	0	0	111.1	G786 N787 I792 Q793 A812	G786-V789 WeakPolarHBondContact O-CB 3.45Å; G786-V789 VanDerWaalsContact O-CG2 3.31Å; G786-V789 WeakPolarHBondContact O-CG2 3.49Å; G786-V789 PolarHBondContact O-N 3.43Å; N787-V789 VanDerWaalsContact C-N 3.34Å; V789-I792 PolarHBondContact O-N 3.24Å; V789-Q793 HydrophobicContact CG1-CG 4.32Å; V789-Q793 WeakPolarHBondContact O-CB 3.28Å; V789-Q793 VanDerWaalsContact O-CG 3.26Å; V789-Q793 WeakPolarHBondContact O-CG 3.31Å; V789-Q793 PolarHBondContact O-N 3.43Å; V789-A812 HydrophobicContact CB-CB 4.42Å; V789-A812 HydrophobicContact CG1-CB 3.69Å; V789-A812 HydrophobicContact CG2-CB 4.1Å
790	S	84.3	Confident	88.2	Confident	12 Å²	12	9.9 Å²	9.9	8%	0.084	6%	0.057	C	C	.	.	H	α-helix	trans	-63.2	-45.3	178	59.4	0	0	0	0	112.4	P761 N787 D788 E794	P761-S790 PolarHBondContact O-OG 3.43Å; N787-S790 PolarHBondContact O-OG 3.46Å; D788-S790 PolarHBondContact O-N 3.42Å; S790-E794 WeakPolarHBondContact O-CB 3.37Å; S790-E794 PolarHBondContact O-N 3.06Å; S790-E794 VanDerWaalsContact O-N 3.14Å
791	M	90.1	Very high	88	Confident	0 Å²	0	9.9 Å²	9.9	0%	0	6%	0.057	C	C	.	.	H	α-helix	trans	-63.4	-44.5	175.5	-174.3	-172.6	55.4	0	0	112.1	L389 L675 K764 V768 A781 V782 D788 E794 A795	L389-M791 HydrophobicContact CB-SD 4.06Å; L675-M791 HydrophobicContact CB-SD 4.42Å; L675-M791 HydrophobicContact CD1-SD 3.79Å; K764-M791 HydrophobicContact CB-CB 3.97Å; K764-M791 HydrophobicContact CB-CG 4.18Å; K764-M791 HydrophobicContact CB-SD 4.26Å; K764-M791 HydrophobicContact CD-SD 4.29Å; V768-M791 HydrophobicContact CG2-CG 3.56Å; A781-M791 HydrophobicContact CB-CE 4.17Å; A781-M791 HydrophobicContact CB-CG 3.77Å; A781-M791 WeakPolarHBondContact CB-O 3.4Å; A781-M791 HydrophobicContact CB-SD 4.28Å; V782-M791 WeakPolarHBondContact O-CE 3.44Å; D788-M791 HydrophobicContact CB-CE 4Å; D788-M791 WeakPolarHBondContact O-CB 3.5Å; D788-M791 PolarHBondContact O-N 3.02Å; M791-E794 PolarHBondContact O-N 3.44Å; M791-A795 PolarHBondContact O-N 3.36Å; M791-A795 VanDerWaalsContact O-N 3.1Å
792	I	90.6	Very high	87.3	Confident	0 Å²	0	12.6 Å²	12.6	0%	0	7%	0.07	C	C	.	.	H	α-helix	trans	-65.1	-41.6	-179.4	-72.5	171.4	0	0	0	111.5	K292 A781 D788 V789 A809	K292-I792 PolarHBondContact NZ-O 3.33Å; A781-I792 HydrophobicContact CB-CG1 4.35Å; D788-I792 HydrophobicContact CB-CD1 4.02Å; D788-I792 HydrophobicContact CB-CG1 4.41Å; D788-I792 WeakPolarHBondContact O-CB 3.31Å; D788-I792 VanDerWaalsContact O-CG1 3.23Å; D788-I792 WeakPolarHBondContact O-CG1 3.4Å; D788-I792 PolarHBondContact O-N 3.27Å; V789-I792 PolarHBondContact O-N 3.24Å; I792-A809 HydrophobicContact CD1-CB 3.69Å
793	Q	87.6	Confident	86.1	Confident	24 Å²	24	13.7 Å²	13.7	11%	0.112	8%	0.081	C	C	.	.	H	α-helix	trans	-72.4	-34.3	179.1	-73.8	-175.8	5.7	0	0	112.5	S287 K292 V789	S287-Q793 VanDerWaalsContact C-OE1 3.24Å; S287-Q793 PolarHBondContact O-OE1 2.98Å; S287-Q793 PolarHBondContact OG-OE1 3.41Å; K292-Q793 VanDerWaalsContact CE-O 3.24Å; K292-Q793 WeakPolarHBondContact CE-O 3.31Å; V789-Q793 HydrophobicContact CG1-CG 4.32Å; V789-Q793 WeakPolarHBondContact O-CB 3.28Å; V789-Q793 VanDerWaalsContact O-CG 3.26Å; V789-Q793 WeakPolarHBondContact O-CG 3.31Å; V789-Q793 PolarHBondContact O-N 3.43Å
794	E	89.8	Confident	84.7	Confident	52 Å²	52	20.6 Å²	20.6	24%	0.243	11%	0.111	C	C	.	.	H	α-helix	trans	-75.1	-30.7	178.9	-164.6	60.8	-156.7	0	0	112.7	A765 V768 R769 Q772 S790 M791	A765-E794 HydrophobicContact CB-CB 4.26Å; V768-E794 HydrophobicContact CB-CG 4.46Å; V768-E794 HydrophobicContact CG1-CB 4.33Å; V768-E794 HydrophobicContact CG1-CG 4.34Å; R769-E794 HydrophobicContact CB-CG 4.04Å; Q772-E794 PolarHBondContact NE2-O 2.88Å; S790-E794 WeakPolarHBondContact O-CB 3.37Å; S790-E794 PolarHBondContact O-N 3.06Å; S790-E794 VanDerWaalsContact O-N 3.14Å; M791-E794 PolarHBondContact O-N 3.44Å
795	A	92.7	Very high	83.4	Confident	1 Å²	1	20.9 Å²	20.9	1%	0.008	11%	0.112	C	C	.	.	S	Bend	trans	-64.4	154.1	178.6	0	0	0	0	0	113.1	K292 V768 A781 M791 C797	K292-A795 VanDerWaalsContact CE-O 3.24Å; K292-A795 WeakPolarHBondContact CE-O 3.42Å; K292-A795 PolarHBondContact NZ-O 2.8Å; V768-A795 VanDerWaalsContact CG1-CA 3.48Å; V768-A795 HydrophobicContact CG1-CB 3.87Å; A781-A795 HydrophobicContact CB-CB 3.47Å; A781-A795 VanDerWaalsContact CB-CB 3.47Å; M791-A795 PolarHBondContact O-N 3.36Å; M791-A795 VanDerWaalsContact O-N 3.1Å; A795-C797 PolarHBondContact O-N 3.05Å
796	D	92.9	Very high	82.7	Confident	43 Å²	43	21.6 Å²	21.6	23%	0.23	12%	0.119	C	C	.	.	S	Bend	trans	-63.9	-35.5	176.1	-63.5	-69.4	0	0	0	110.9	K292 Q381 Q772 L778 T779	K292-D796 WeakPolarHBondContact CD-O 3.43Å; Q381-D796 PolarHBondContact OE1-O 3.23Å; Q381-D796 VanDerWaalsContact OE1-O 3.1Å; Q772-D796 VanDerWaalsContact NE2-N 3.17Å; Q772-D796 PolarHBondContact NE2-OD2 2.98Å; L778-D796 WeakPolarHBondContact CA-OD2 3.22Å; L778-D796 HydrophobicContact CD2-CB 3.85Å; T779-D796 PolarHBondContact N-OD2 2.98Å; T779-D796 WeakPolarHBondContact O-CB 3.27Å; T779-D796 PolarHBondContact O-N 3.15Å; T779-D796 PolarHBondContact OG1-N 3.45Å; T779-D796 PolarHBondContact OG1-OD2 2.94Å
797	C	93.6	Very high	82.7	Confident	1 Å²	1	26.4 Å²	26.4	1%	0.007	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	121	172.1	179.2	0	0	0	0	110.4	I378 L382 I385 T779 C780 A781 A795	I378-C797 HydrophobicContact CD1-CB 4.49Å; L382-C797 WeakPolarHBondContact CD2-SG 3.48Å; I385-C797 HydrophobicContact CD1-CB 4.19Å; T779-C797 PolarHBondContact O-N 3.36Å; T779-C797 VanDerWaalsContact O-N 3.16Å; C780-C797 CarbonylContact C-O 3.51Å; C780-C797 WeakPolarHBondContact CA-O 3.45Å; C780-C797 HydrophobicContact CB-CB 4.44Å; A781-C797 PolarHBondContact N-O 3.2Å; A795-C797 PolarHBondContact O-N 3.05Å
798	G	93.8	Very high	82.4	Confident	0 Å²	0	27.8 Å²	27.8	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	125.7	175	0	0	0	0	0	111.6	D814 F815	G798-D814 PolarHBondContact N-OD2 3.06Å; G798-D814 WeakPolarHBondContact O-CA 3.25Å; G798-D814 WeakPolarHBondContact O-CB 3.32Å; G798-D814 PolarHBondContact O-N 2.94Å; G798-F815 PolarHBondContact O-N 3.38Å; G798-F815 VanDerWaalsContact O-N 3.1Å
799	V	94.9	Very high	82	Confident	0 Å²	0	27.6 Å²	27.6	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	120	175	-175.8	0	0	0	0	109.4	A781 V782 G783 F815 V817 L823 L826	A781-V799 PolarHBondContact O-N 2.88Å; V782-V799 VanDerWaalsContact CA-O 3.28Å; V782-V799 WeakPolarHBondContact CA-O 3.14Å; V782-V799 HydrophobicContact CG1-CB 4.38Å; V782-V799 HydrophobicContact CG1-CG1 4.46Å; V782-V799 HydrophobicContact CG2-CB 4.2Å; G783-V799 PolarHBondContact N-O 2.97Å; V799-F815 CarbonylContact C-O 3.55Å; V799-F815 VanDerWaalsContact CA-O 3.22Å; V799-F815 WeakPolarHBondContact CA-O 3.29Å; V799-F815 HydrophobicContact CG2-CB 4.39Å; V799-V817 HydrophobicContact CG1-CG1 4.27Å; V799-V817 HydrophobicContact CG1-CG2 3.81Å; V799-L823 HydrophobicContact CG1-CD1 4.43Å; V799-L823 HydrophobicContact CG2-CD1 4.18Å; V799-L826 HydrophobicContact CG2-CD2 4.45Å
800	G	92.6	Very high	81.9	Confident	0 Å²	0	27.1 Å²	27.1	0%	0	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	131.4	173.8	0	0	0	0	0	110.4	G783 S813 F815 S816 V817	G783-G800 CarbonylContact O-C 3.57Å; G783-G800 VanDerWaalsContact O-CA 3.28Å; G783-G800 WeakPolarHBondContact O-CA 3.47Å; G800-S813 PolarHBondContact N-OG 3Å; G800-F815 PolarHBondContact N-O 3.4Å; G800-S816 CarbonylContact O-C 3.56Å; G800-S816 VanDerWaalsContact O-CA 3.31Å; G800-S816 WeakPolarHBondContact O-CA 3.29Å; G800-V817 PolarHBondContact O-N 2.9Å
801	V	90.4	Very high	81.4	Confident	0 Å²	0	29.1 Å²	29.1	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	134.2	169.1	-177.4	0	0	0	0	108.5	T395 V782 G783 D784 G803 V817	T395-V801 HydrophobicContact CG2-CG2 4.26Å; V782-V801 HydrophobicContact CG1-CG2 3.68Å; G783-V801 PolarHBondContact O-N 3.36Å; D784-V801 WeakPolarHBondContact CA-O 3.41Å; D784-V801 HydrophobicContact CB-CB 4.09Å; D784-V801 VanDerWaalsContact CB-O 3.25Å; D784-V801 WeakPolarHBondContact CB-O 3.31Å; V801-G803 PolarHBondContact O-N 2.93Å; V801-G803 VanDerWaalsContact O-N 3.08Å; V801-V817 CarbonylContact C-O 3.53Å; V801-V817 VanDerWaalsContact CA-O 3.3Å; V801-V817 WeakPolarHBondContact CA-O 3.49Å; V801-V817 HydrophobicContact CG2-CG2 4Å
802	E	82.4	Confident	80.7	Confident	57 Å²	57	30.6 Å²	30.6	27%	0.266	16%	0.158	S	C	.	.			trans	-77.9	89	173.7	-64.4	-169.1	-163.4	0	0	109.8	K807 S816 V817	E802-K807 IonicContact OE2-NZ 3.53Å; E802-S816 WeakPolarHBondContact CG-OG 3.43Å; E802-S816 PolarHBondContact OE1-OG 2.93Å; E802-S816 VanDerWaalsContact OE1-OG 3.08Å; E802-V817 PolarHBondContact N-O 3.47Å
803	G	69.5	Low	80.6	Confident	23 Å²	23	30.8 Å²	30.8	24%	0.237	16%	0.159	C	C	.	.	B	Isolated β-bridge	trans	-91	176.6	179	0	0	0	0	0	114.7	V801 E805	V801-G803 PolarHBondContact O-N 2.93Å; V801-G803 VanDerWaalsContact O-N 3.08Å; G803-E805 PolarHBondContact O-N 3.45Å
804	K	62.4	Low	80.7	Confident	145 Å²	145	30.4 Å²	30.4	63%	0.63	16%	0.158	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68.6	-20.1	173.3	-67.7	178	-177.5	168.4	0	112	E400 G806	E400-K804 IonicContact OE2-NZ 3.92Å; E400-K804 PolarHBondContact OE2-NZ 2.91Å; K804-G806 PolarHBondContact O-N 3.2Å
805	E	57.5	Low	80.9	Confident	7 Å²	7	28 Å²	28	3%	0.033	15%	0.147	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75	-5.6	-179.5	-71.9	170.2	-160	0	0	114.2	D190 G194 T196 T393 N399 G803	D190-E805 VanDerWaalsContact CB-O 3.32Å; D190-E805 WeakPolarHBondContact CB-O 3.47Å; G194-E805 VanDerWaalsContact O-OE1 3.1Å; T196-E805 HydrophobicContact CG2-CG 3.31Å; T393-E805 WeakPolarHBondContact CG2-OE1 3.37Å; N399-E805 PolarHBondContact ND2-OE1 2.81Å; G803-E805 PolarHBondContact O-N 3.45Å
806	G	62.6	Low	80.8	Confident	16 Å²	16	27.9 Å²	27.9	17%	0.165	15%	0.146	C	C	.	.	B	Isolated β-bridge	trans	115	-172	177.1	0	0	0	0	0	113	K804	K804-G806 PolarHBondContact O-N 3.2Å
807	K	67.1	Low	80.9	Confident	120 Å²	120	25.9 Å²	25.9	52%	0.522	14%	0.136	S	C	.	.	S	Bend	trans	-107	14.8	-170.7	-62	-169.2	176.9	-163.5	0	114	E802 S810 L811	E802-K807 IonicContact OE2-NZ 3.53Å; K807-S810 WeakPolarHBondContact O-CB 3.49Å; K807-S810 PolarHBondContact O-N 3.06Å; K807-L811 HydrophobicContact CB-CD1 4.27Å; K807-L811 HydrophobicContact CB-CG 4.4Å; K807-L811 VanDerWaalsContact O-CB 3.27Å; K807-L811 WeakPolarHBondContact O-CB 3.3Å; K807-L811 WeakPolarHBondContact O-CD1 3.45Å; K807-L811 WeakPolarHBondContact O-CG 3.23Å; K807-L811 PolarHBondContact O-N 2.85Å
808	Q	69.8	Low	80.7	Confident	67 Å²	67	27.9 Å²	27.9	31%	0.313	15%	0.148	S	C	.	.	H	α-helix	trans	-69	-49.1	-171.3	-67.1	-63.8	-4.1	0	0	112.6	Q191 S810 L811 A812	Q191-Q808 HydrophobicContact CB-CG 4.29Å; Q191-Q808 VanDerWaalsContact CD-NE2 3.25Å; Q191-Q808 HydrophobicContact CG-CG 3.94Å; Q808-S810 VanDerWaalsContact C-N 3.33Å; Q808-S810 PolarHBondContact O-N 3.38Å; Q808-L811 PolarHBondContact O-N 2.87Å; Q808-L811 VanDerWaalsContact O-N 3.12Å; Q808-A812 WeakPolarHBondContact O-CB 3.47Å; Q808-A812 PolarHBondContact O-N 3.25Å
809	A	75.6	Confident	80.6	Confident	0 Å²	0	30.7 Å²	30.7	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-58.9	-46.3	173.2	0	0	0	0	0	111.1	G783 D784 I792 L811 A812 S813	G783-A809 WeakPolarHBondContact O-CB 3.41Å; D784-A809 WeakPolarHBondContact O-CB 3.32Å; I792-A809 HydrophobicContact CD1-CB 3.69Å; A809-L811 VanDerWaalsContact C-N 3.29Å; A809-L811 PolarHBondContact O-N 3.21Å; A809-A812 PolarHBondContact O-N 3.09Å; A809-S813 WeakPolarHBondContact O-CB 3.16Å; A809-S813 PolarHBondContact O-N 2.86Å; A809-S813 PolarHBondContact O-OG 3.37Å
810	S	79.3	Confident	80.6	Confident	2 Å²	2	30.8 Å²	30.8	1%	0.014	16%	0.161	C	C	.	.	H	α-helix	trans	-53.8	-42.5	173.4	167.1	0	0	0	0	112.7	R374 K807 Q808 S813 S816	R374-S810 WeakPolarHBondContact CD-O 3.46Å; R374-S810 PolarHBondContact NE-O 3.46Å; K807-S810 WeakPolarHBondContact O-CB 3.49Å; K807-S810 PolarHBondContact O-N 3.06Å; Q808-S810 VanDerWaalsContact C-N 3.33Å; Q808-S810 PolarHBondContact O-N 3.38Å; S810-S813 PolarHBondContact O-OG 3.47Å; S810-S816 WeakPolarHBondContact CB-OG 3.5Å; S810-S816 WeakPolarHBondContact OG-CB 3.06Å; S810-S816 PolarHBondContact OG-OG 3.45Å
811	L	75.2	Confident	80.6	Confident	53 Å²	53	33.5 Å²	33.5	28%	0.277	17%	0.173	S	C	.	.	H	α-helix	trans	-71.7	-31.1	-179.6	-75.9	164.8	0	0	0	113.6	K807 Q808 A809	K807-L811 HydrophobicContact CB-CD1 4.27Å; K807-L811 HydrophobicContact CB-CG 4.4Å; K807-L811 VanDerWaalsContact O-CB 3.27Å; K807-L811 WeakPolarHBondContact O-CB 3.3Å; K807-L811 WeakPolarHBondContact O-CD1 3.45Å; K807-L811 WeakPolarHBondContact O-CG 3.23Å; K807-L811 PolarHBondContact O-N 2.85Å; Q808-L811 PolarHBondContact O-N 2.87Å; Q808-L811 VanDerWaalsContact O-N 3.12Å; A809-L811 VanDerWaalsContact C-N 3.29Å; A809-L811 PolarHBondContact O-N 3.21Å
812	A	75.6	Confident	80.9	Confident	32 Å²	32	34.3 Å²	34.3	26%	0.264	18%	0.177	S	C	.	.	H	α-helix	trans	-92.1	-17.4	-179.7	0	0	0	0	0	113.9	V789 Q808 A809	V789-A812 HydrophobicContact CB-CB 4.42Å; V789-A812 HydrophobicContact CG1-CB 3.69Å; V789-A812 HydrophobicContact CG2-CB 4.1Å; Q808-A812 WeakPolarHBondContact O-CB 3.47Å; Q808-A812 PolarHBondContact O-N 3.25Å; A809-A812 PolarHBondContact O-N 3.09Å
813	S	87.6	Confident	81.5	Confident	3 Å²	3	31.7 Å²	31.7	2%	0.021	16%	0.164	C	C	.	.	S	Bend	trans	-74.1	161.9	-179.2	67.7	0	0	0	0	114.2	R374 G800 A809 S810 F815	R374-S813 WeakPolarHBondContact CB-O 3.24Å; R374-S813 WeakPolarHBondContact CD-O 3.44Å; G800-S813 PolarHBondContact N-OG 3Å; A809-S813 WeakPolarHBondContact O-CB 3.16Å; A809-S813 PolarHBondContact O-N 2.86Å; A809-S813 PolarHBondContact O-OG 3.37Å; S810-S813 PolarHBondContact O-OG 3.47Å; S813-F815 PolarHBondContact OG-O 3.34Å; S813-F815 VanDerWaalsContact OG-O 3.08Å
814	D	90.2	Very high	82.7	Confident	17 Å²	17	30.6 Å²	30.6	9%	0.091	15%	0.153	C	C	.	.	S	Bend	trans	-77.5	-38.3	172.9	-61.2	-51	0	0	0	111.3	K292 R374 A375 I378 G798	K292-D814 WeakPolarHBondContact CD-OD2 3.37Å; K292-D814 WeakPolarHBondContact CE-OD2 3.2Å; K292-D814 IonicContact NZ-OD1 3.74Å; K292-D814 IonicContact NZ-OD2 3.71Å; K292-D814 PolarHBondContact NZ-OD2 3.09Å; R374-D814 WeakPolarHBondContact CA-O 3.3Å; R374-D814 PolarHBondContact N-O 2.65Å; A375-D814 HydrophobicContact CB-CB 3.71Å; A375-D814 VanDerWaalsContact CB-OD1 3.3Å; A375-D814 WeakPolarHBondContact CB-OD1 3.28Å; A375-D814 PolarHBondContact N-O 3.22Å; A375-D814 VanDerWaalsContact N-O 3.08Å; I378-D814 HydrophobicContact CD1-CB 3.77Å; G798-D814 PolarHBondContact N-OD2 3.06Å; G798-D814 WeakPolarHBondContact O-CA 3.25Å; G798-D814 WeakPolarHBondContact O-CB 3.32Å; G798-D814 PolarHBondContact O-N 2.94Å
815	F	92.4	Very high	84.2	Confident	0 Å²	0	25.1 Å²	25.1	0%	0	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	128.7	177	-58.7	-88.1	0	0	0	109.8	I362 V373 I378 L382 G798 V799 G800 S813 L826	I362-F815 HydrophobicContact CD1-CE1 4.13Å; V373-F815 HydrophobicContact CB-CD1 4.38Å; V373-F815 HydrophobicContact CB-CE1 4.42Å; V373-F815 HydrophobicContact CG1-CD1 4.05Å; V373-F815 HydrophobicContact CG1-CE1 3.69Å; V373-F815 HydrophobicContact CG2-CD1 3.98Å; V373-F815 HydrophobicContact CG2-CE1 4.08Å; I378-F815 HydrophobicContact CD1-CE2 4.07Å; I378-F815 HydrophobicContact CG1-CE2 3.97Å; I378-F815 HydrophobicContact CG1-CZ 4.23Å; L382-F815 HydrophobicContact CD1-CD1 4.42Å; L382-F815 HydrophobicContact CD1-CE1 3.84Å; L382-F815 HydrophobicContact CD1-CE2 3.97Å; L382-F815 HydrophobicContact CD1-CZ 3.6Å; L382-F815 HydrophobicContact CD2-CD2 4.12Å; L382-F815 HydrophobicContact CD2-CE2 3.86Å; L382-F815 HydrophobicContact CD2-CZ 4.35Å; L382-F815 HydrophobicContact CG-CE2 3.98Å; L382-F815 HydrophobicContact CG-CZ 4.02Å; G798-F815 PolarHBondContact O-N 3.38Å; G798-F815 VanDerWaalsContact O-N 3.1Å; V799-F815 CarbonylContact C-O 3.55Å; V799-F815 VanDerWaalsContact CA-O 3.22Å; V799-F815 WeakPolarHBondContact CA-O 3.29Å; V799-F815 HydrophobicContact CG2-CB 4.39Å; G800-F815 PolarHBondContact N-O 3.4Å; S813-F815 PolarHBondContact OG-O 3.34Å; S813-F815 VanDerWaalsContact OG-O 3.08Å; F815-L826 HydrophobicContact CB-CD2 4.27Å; F815-L826 HydrophobicContact CG-CD2 4.47Å
816	S	91.9	Very high	86	Confident	0 Å²	0	24.8 Å²	24.8	0%	0	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	128.7	171	-172.9	0	0	0	0	109.5	T371 V372 G800 E802 S810	T371-S816 CarbonylContact C-O 3.3Å; T371-S816 WeakPolarHBondContact CA-O 3.2Å; T371-S816 WeakPolarHBondContact CG2-O 3.41Å; V372-S816 PolarHBondContact N-O 3.36Å; V372-S816 PolarHBondContact O-N 3.24Å; G800-S816 CarbonylContact O-C 3.56Å; G800-S816 VanDerWaalsContact O-CA 3.31Å; G800-S816 WeakPolarHBondContact O-CA 3.29Å; E802-S816 WeakPolarHBondContact CG-OG 3.43Å; E802-S816 PolarHBondContact OE1-OG 2.93Å; E802-S816 VanDerWaalsContact OE1-OG 3.08Å; S810-S816 WeakPolarHBondContact CB-OG 3.5Å; S810-S816 WeakPolarHBondContact OG-CB 3.06Å; S810-S816 PolarHBondContact OG-OG 3.45Å
817	V	93.6	Very high	87.6	Confident	1 Å²	1	24 Å²	24	1%	0.006	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	155.8	171.8	-62.8	0	0	0	0	109.6	T371 V799 G800 V801 E802 H822 L826	T371-V817 HydrophobicContact CG2-CG1 4.17Å; V799-V817 HydrophobicContact CG1-CG1 4.27Å; V799-V817 HydrophobicContact CG1-CG2 3.81Å; G800-V817 PolarHBondContact O-N 2.9Å; V801-V817 CarbonylContact C-O 3.53Å; V801-V817 VanDerWaalsContact CA-O 3.3Å; V801-V817 WeakPolarHBondContact CA-O 3.49Å; V801-V817 HydrophobicContact CG2-CG2 4Å; E802-V817 PolarHBondContact N-O 3.47Å; V817-H822 HydrophobicContact CB-CB 4.26Å; V817-H822 HydrophobicContact CG1-CB 4.41Å; V817-L826 HydrophobicContact CG1-CD2 4.15Å
818	T	90.5	Very high	88.9	Confident	42 Å²	42	18.4 Å²	18.4	26%	0.258	10%	0.095	S	C	.	.	S	Bend	trans	-82.9	-27.3	-178.5	49.4	0	0	0	0	113.6	P369 H822	P369-T818 WeakPolarHBondContact O-CG2 3.36Å; P369-T818 PolarHBondContact O-OG1 3.28Å; T818-H822 PolarHBondContact OG1-CD2 3.25Å; T818-H822 PolarHBondContact OG1-NE2 3.43Å
819	Q	91.8	Very high	90.1	Very high	60 Å²	60	15.5 Å²	15.5	28%	0.28	8%	0.082	S	C	.	.	S	Bend	trans	-147.2	152.9	-176.5	-63.5	-172.4	-26.3	0	0	110.4	K821 H822	Q819-K821 VanDerWaalsContact C-N 3.29Å; Q819-K821 HydrophobicContact CB-CG 4.26Å; Q819-K821 PolarHBondContact O-N 3.25Å; Q819-H822 WeakPolarHBondContact O-CB 3.45Å; Q819-H822 PolarHBondContact O-N 3.15Å
820	F	93.7	Very high	91	Very high	1 Å²	1	16.5 Å²	16.5	0%	0.004	9%	0.086	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.6	-37.1	180	-172.6	-93.9	0	0	0	113.2	T395 L396 V658 T661 L662 L665 V782 H822 L823	T395-F820 HydrophobicContact CG2-CD2 3.87Å; T395-F820 HydrophobicContact CG2-CE2 4.31Å; T395-F820 WeakPolarHBondContact O-CB 3.31Å; L396-F820 HydrophobicContact CD2-CD1 4.25Å; L396-F820 HydrophobicContact CD2-CD2 4.04Å; L396-F820 HydrophobicContact CD2-CE1 3.95Å; L396-F820 HydrophobicContact CD2-CE2 3.73Å; L396-F820 HydrophobicContact CD2-CG 4.29Å; L396-F820 HydrophobicContact CD2-CZ 3.69Å; V658-F820 HydrophobicContact CB-CD1 4.43Å; V658-F820 HydrophobicContact CG1-CD1 4.37Å; V658-F820 HydrophobicContact CG1-CE1 4.46Å; V658-F820 HydrophobicContact CG2-CB 4.19Å; V658-F820 HydrophobicContact CG2-CD1 3.94Å; V658-F820 HydrophobicContact CG2-CG 4.31Å; T661-F820 HydrophobicContact CG2-CD1 4.05Å; T661-F820 HydrophobicContact CG2-CE1 3.81Å; L662-F820 HydrophobicContact CD2-CE1 3.96Å; L662-F820 HydrophobicContact CD2-CZ 3.81Å; L662-F820 HydrophobicContact CG-CE1 4.07Å; L662-F820 HydrophobicContact CG-CZ 4.4Å; L665-F820 HydrophobicContact CD1-CZ 4.49Å; V782-F820 HydrophobicContact CG1-CD2 4.37Å; V782-F820 HydrophobicContact CG1-CE2 4.47Å; F820-H822 PolarHBondContact O-N 3.19Å; F820-H822 VanDerWaalsContact O-N 3.08Å; F820-L823 HydrophobicContact CE2-CD2 3.98Å; F820-L823 HydrophobicContact CZ-CD2 4.07Å; F820-L823 WeakPolarHBondContact O-CB 3.45Å; F820-L823 PolarHBondContact O-N 3.05Å
821	K	94.2	Very high	91.8	Very high	58 Å²	58	16.4 Å²	16.4	25%	0.252	9%	0.085	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.8	-27.3	-179.9	74.9	-171.2	-171.7	-159.4	0	114.6	D657 T661 Q819 L823 G824	D657-K821 HydrophobicContact CB-CB 3.94Å; D657-K821 HydrophobicContact CB-CD 4.27Å; T661-K821 WeakPolarHBondContact OG1-CA 3.36Å; Q819-K821 VanDerWaalsContact C-N 3.29Å; Q819-K821 HydrophobicContact CB-CG 4.26Å; Q819-K821 PolarHBondContact O-N 3.25Å; K821-L823 PolarHBondContact O-N 2.95Å; K821-G824 PolarHBondContact O-N 3.02Å
822	H	95.3	Very high	92.6	Very high	17 Å²	17	14 Å²	14	8%	0.079	7%	0.073	C	C	.	.	H	α-helix	trans	-68.9	-20.4	179.3	-64.4	-43.7	0	0	0	112.3	K367 I368 V817 T818 Q819 F820 G824 R825 L826	K367-H822 PolarHBondContact O-ND1 2.88Å; I368-H822 HydrophobicContact CB-CB 4.24Å; I368-H822 HydrophobicContact CG2-CB 3.65Å; V817-H822 HydrophobicContact CB-CB 4.26Å; V817-H822 HydrophobicContact CG1-CB 4.41Å; T818-H822 PolarHBondContact OG1-CD2 3.25Å; T818-H822 PolarHBondContact OG1-NE2 3.43Å; Q819-H822 WeakPolarHBondContact O-CB 3.45Å; Q819-H822 PolarHBondContact O-N 3.15Å; F820-H822 PolarHBondContact O-N 3.19Å; F820-H822 VanDerWaalsContact O-N 3.08Å; H822-G824 VanDerWaalsContact C-N 3.31Å; H822-G824 PolarHBondContact O-N 2.94Å; H822-R825 PolarHBondContact O-N 3.47Å; H822-L826 WeakPolarHBondContact O-CB 3.36Å; H822-L826 PolarHBondContact O-N 3.5Å
823	L	95.1	Very high	93.5	Very high	1 Å²	1	13 Å²	13	1%	0.005	6%	0.063	C	C	.	.	H	α-helix	trans	-59.6	-40.4	175.2	-174.7	64.9	0	0	0	112.3	L388 L665 V782 V799 F820 K821 R825 L826 L827	L388-L823 HydrophobicContact CD1-CD2 4.05Å; L388-L823 HydrophobicContact CD2-CD2 3.69Å; L665-L823 HydrophobicContact CD1-CD2 4.19Å; V782-L823 HydrophobicContact CG2-CD2 3.94Å; V799-L823 HydrophobicContact CG1-CD1 4.43Å; V799-L823 HydrophobicContact CG2-CD1 4.18Å; F820-L823 HydrophobicContact CE2-CD2 3.98Å; F820-L823 HydrophobicContact CZ-CD2 4.07Å; F820-L823 WeakPolarHBondContact O-CB 3.45Å; F820-L823 PolarHBondContact O-N 3.05Å; K821-L823 PolarHBondContact O-N 2.95Å; L823-R825 VanDerWaalsContact C-N 3.32Å; L823-R825 PolarHBondContact O-N 2.87Å; L823-L826 HydrophobicContact CD1-CD2 4.48Å; L823-L826 PolarHBondContact O-N 3.2Å; L823-L827 HydrophobicContact CD1-CD1 3.97Å; L823-L827 HydrophobicContact CD1-CG 4.06Å; L823-L827 HydrophobicContact CG-CD1 4.03Å; L823-L827 HydrophobicContact CG-CG 4.39Å; L823-L827 WeakPolarHBondContact O-CG 3.35Å; L823-L827 PolarHBondContact O-N 2.87Å
824	G	94.4	Very high	93.8	Very high	0 Å²	0	13 Å²	13	0%	0	6%	0.063	C	C	.	.	H	α-helix	trans	-56.4	-48.4	178	0	0	0	0	0	111.3	K821 H822 M828	K821-G824 PolarHBondContact O-N 3.02Å; H822-G824 VanDerWaalsContact C-N 3.31Å; H822-G824 PolarHBondContact O-N 2.94Å; G824-M828 VanDerWaalsContact O-CB 3.23Å; G824-M828 WeakPolarHBondContact O-CB 3.36Å; G824-M828 WeakPolarHBondContact O-CG 3.45Å; G824-M828 PolarHBondContact O-N 3.06Å
825	R	95.2	Very high	94	Very high	30 Å²	30	12.3 Å²	12.3	11%	0.113	6%	0.059	C	C	.	.	H	α-helix	trans	-70.6	-38.8	177.9	-176.6	166.3	175.3	93.6	-3.4	113.1	D365 K367 I368 H822 L823 L827 V829 H830 S899 M903	D365-R825 IonicContact OD1-CZ 2.97Å; D365-R825 IonicContact OD1-NE 2.63Å; D365-R825 IonicContact OD1-NH2 3.79Å; D365-R825 PolarHBondContact OD1-NH2 3.29Å; D365-R825 IonicContact OD2-CZ 2.71Å; D365-R825 IonicContact OD2-NE 3.21Å; D365-R825 PolarHBondContact OD2-NE 3.22Å; D365-R825 IonicContact OD2-NH2 2.71Å; D365-R825 PolarHBondContact OD2-NH2 3.04Å; K367-R825 VanDerWaalsContact CD-CZ 3.45Å; I368-R825 HydrophobicContact CG2-CB 4.04Å; I368-R825 HydrophobicContact CG2-CG 4.2Å; H822-R825 PolarHBondContact O-N 3.47Å; L823-R825 VanDerWaalsContact C-N 3.32Å; L823-R825 PolarHBondContact O-N 2.87Å; R825-L827 VanDerWaalsContact C-N 3.29Å; R825-L827 PolarHBondContact O-N 3.3Å; R825-V829 HydrophobicContact CG-CB 4.27Å; R825-V829 HydrophobicContact CG-CG2 4.04Å; R825-V829 WeakPolarHBondContact O-CB 3.49Å; R825-V829 PolarHBondContact O-N 3.3Å; R825-V829 VanDerWaalsContact O-N 3.08Å; R825-H830 PolarHBondContact O-N 2.88Å; R825-S899 PolarHBondContact NH1-OG 3.4Å; R825-S899 VanDerWaalsContact NH1-OG 3.08Å; R825-M903 HydrophobicContact CB-SD 4.12Å
826	L	96	Very high	93.9	Very high	0 Å²	0	14.6 Å²	14.6	0%	0	7%	0.069	C	C	.	.	I	π-helix	trans	-56.7	-44.2	177	-179.1	62.7	0	0	0	111.3	I362 L382 V799 F815 V817 H822 L823 H830 G831	I362-L826 HydrophobicContact CD1-CD1 4.38Å; I362-L826 HydrophobicContact CG2-CD1 3.88Å; L382-L826 HydrophobicContact CD1-CD1 3.92Å; L382-L826 HydrophobicContact CD1-CG 4.13Å; L382-L826 HydrophobicContact CD2-CG 4.47Å; V799-L826 HydrophobicContact CG2-CD2 4.45Å; F815-L826 HydrophobicContact CB-CD2 4.27Å; F815-L826 HydrophobicContact CG-CD2 4.47Å; V817-L826 HydrophobicContact CG1-CD2 4.15Å; H822-L826 WeakPolarHBondContact O-CB 3.36Å; H822-L826 PolarHBondContact O-N 3.5Å; L823-L826 HydrophobicContact CD1-CD2 4.48Å; L823-L826 PolarHBondContact O-N 3.2Å; L826-H830 WeakPolarHBondContact O-CB 3.46Å; L826-H830 PolarHBondContact O-N 3.32Å; L826-G831 PolarHBondContact O-N 3.44Å
827	L	95.6	Very high	94	Very high	0 Å²	0	15.3 Å²	15.3	0%	0	7%	0.072	C	C	.	.	I	π-helix	trans	-80.7	-54.4	-179.1	-62.1	-177.8	0	0	0	112.6	L382 I385 L665 I670 L823 R825 V829 G831 R832 Y909	L382-L827 HydrophobicContact CB-CD2 4.07Å; L382-L827 HydrophobicContact CD2-CD2 3.71Å; L382-L827 HydrophobicContact CG-CD2 4.5Å; L382-L827 WeakPolarHBondContact O-CD2 3.23Å; I385-L827 HydrophobicContact CD1-CD2 3.46Å; I385-L827 VanDerWaalsContact CD1-CD2 3.46Å; L665-L827 HydrophobicContact CD2-CD1 3.67Å; I670-L827 HydrophobicContact CD1-CD1 4.08Å; L823-L827 HydrophobicContact CD1-CD1 3.97Å; L823-L827 HydrophobicContact CD1-CG 4.06Å; L823-L827 HydrophobicContact CG-CD1 4.03Å; L823-L827 HydrophobicContact CG-CG 4.39Å; L823-L827 WeakPolarHBondContact O-CG 3.35Å; L823-L827 PolarHBondContact O-N 2.87Å; R825-L827 VanDerWaalsContact C-N 3.29Å; R825-L827 PolarHBondContact O-N 3.3Å; L827-V829 PolarHBondContact O-N 3.48Å; L827-G831 PolarHBondContact O-N 3.15Å; L827-R832 PolarHBondContact O-N 3.18Å; L827-Y909 HydrophobicContact CB-CE2 4.43Å
828	M	94.8	Very high	94	Very high	2 Å²	2	15.3 Å²	15.3	1%	0.01	7%	0.072	C	C	.	.	I	π-helix	trans	-68.4	-33.4	-171.4	-63.5	-54.9	118	0	0	113	I664 L665 A668 I670 G824 R832 M903 P906 Y909	I664-M828 HydrophobicContact CG2-CG 3.8Å; I664-M828 HydrophobicContact CG2-SD 4.4Å; L665-M828 HydrophobicContact CD2-CE 4.16Å; A668-M828 HydrophobicContact CB-CE 3.42Å; A668-M828 VanDerWaalsContact CB-CE 3.42Å; A668-M828 HydrophobicContact CB-SD 3.63Å; I670-M828 HydrophobicContact CD1-CE 3.87Å; G824-M828 VanDerWaalsContact O-CB 3.23Å; G824-M828 WeakPolarHBondContact O-CB 3.36Å; G824-M828 WeakPolarHBondContact O-CG 3.45Å; G824-M828 PolarHBondContact O-N 3.06Å; M828-R832 VanDerWaalsContact O-CB 3.28Å; M828-R832 WeakPolarHBondContact O-CB 3.33Å; M828-R832 WeakPolarHBondContact O-CD 3.28Å; M828-M903 HydrophobicContact CB-SD 4Å; M828-M903 HydrophobicContact CG-SD 4.5Å; M828-P906 HydrophobicContact SD-CB 3.98Å; M828-Y909 HydrophobicContact CE-CD1 4.26Å; M828-Y909 HydrophobicContact CE-CD2 3.8Å; M828-Y909 HydrophobicContact CE-CE2 4.19Å; M828-Y909 HydrophobicContact CE-CG 3.84Å; M828-Y909 HydrophobicContact SD-CD2 4.01Å; M828-Y909 HydrophobicContact SD-CG 3.98Å
829	V	94.6	Very high	94.1	Very high	6 Å²	6	13.3 Å²	13.3	4%	0.036	6%	0.06	C	C	.	.	I	π-helix	trans	-99.9	-64.6	-178.8	-176.6	0	0	0	0	110.6	R825 L827 N833 A902 M903	R825-V829 HydrophobicContact CG-CB 4.27Å; R825-V829 HydrophobicContact CG-CG2 4.04Å; R825-V829 WeakPolarHBondContact O-CB 3.49Å; R825-V829 PolarHBondContact O-N 3.3Å; R825-V829 VanDerWaalsContact O-N 3.08Å; L827-V829 PolarHBondContact O-N 3.48Å; V829-N833 WeakPolarHBondContact O-CB 3.42Å; V829-N833 PolarHBondContact O-N 3.48Å; V829-N833 PolarHBondContact O-ND2 2.98Å; V829-N833 VanDerWaalsContact O-ND2 3.07Å; V829-A902 HydrophobicContact CG2-CB 4.25Å; V829-M903 HydrophobicContact CG2-CG 4.08Å; V829-M903 HydrophobicContact CG2-SD 4.12Å
830	H	95.2	Very high	94	Very high	21 Å²	21	12 Å²	12	10%	0.097	6%	0.059	C	C	.	.	I	π-helix	trans	-71.4	-50.9	-170.8	-68.9	-70.6	0	0	0	112	I362 D365 R825 L826 R832 N833 S834	I362-H830 HydrophobicContact CD1-CB 4.15Å; I362-H830 HydrophobicContact CG1-CB 3.71Å; D365-H830 IonicContact OD2-CD2 2.82Å; D365-H830 IonicContact OD2-CE1 3.17Å; D365-H830 IonicContact OD2-NE2 3.19Å; D365-H830 PolarHBondContact OD2-NE2 3.34Å; R825-H830 PolarHBondContact O-N 2.88Å; L826-H830 WeakPolarHBondContact O-CB 3.46Å; L826-H830 PolarHBondContact O-N 3.32Å; H830-R832 PolarHBondContact O-N 3.23Å; H830-N833 PolarHBondContact O-N 3.38Å; H830-S834 WeakPolarHBondContact O-CB 3.42Å; H830-S834 PolarHBondContact O-N 3.44Å; H830-S834 PolarHBondContact O-OG 2.86Å; H830-S834 VanDerWaalsContact O-OG 3.1Å
831	G	94.3	Very high	94	Very high	0 Å²	0	12 Å²	12	0%	0	6%	0.059	C	C	.	.	I	π-helix	trans	-59.4	-47.2	-179.6	0	0	0	0	0	113.3	G383 L826 L827 N833 S834 Y835	G383-G831 VanDerWaalsContact CA-O 3.28Å; G383-G831 WeakPolarHBondContact CA-O 3.5Å; G383-G831 PolarHBondContact N-O 2.95Å; L826-G831 PolarHBondContact O-N 3.44Å; L827-G831 PolarHBondContact O-N 3.15Å; G831-N833 PolarHBondContact O-N 3.38Å; G831-S834 PolarHBondContact O-N 3.14Å; G831-Y835 PolarHBondContact O-N 3.18Å
832	R	93.5	Very high	93.9	Very high	2 Å²	2	9.2 Å²	9.2	1%	0.008	5%	0.047	C	C	.	.	H	α-helix	trans	-56.4	-49.2	173.8	163.9	170.5	-172.3	-58.1	5.1	112.4	L827 M828 H830 K836 D896 Y909 L912	L827-R832 PolarHBondContact O-N 3.18Å; M828-R832 VanDerWaalsContact O-CB 3.28Å; M828-R832 WeakPolarHBondContact O-CB 3.33Å; M828-R832 WeakPolarHBondContact O-CD 3.28Å; H830-R832 PolarHBondContact O-N 3.23Å; R832-K836 PolarHBondContact O-N 2.92Å; R832-D896 IonicContact CZ-OD1 2.86Å; R832-D896 IonicContact CZ-OD2 2.66Å; R832-D896 IonicContact NH1-OD1 3.6Å; R832-D896 PolarHBondContact NH1-OD1 3.45Å; R832-D896 IonicContact NH1-OD2 3.54Å; R832-D896 PolarHBondContact NH1-OD2 3.43Å; R832-D896 IonicContact NH2-OD1 3.92Å; R832-D896 PolarHBondContact NH2-OD1 2.99Å; R832-D896 IonicContact NH2-OD2 2.82Å; R832-D896 PolarHBondContact NH2-OD2 2.87Å; R832-Y909 HydrophobicContact CB-CD2 4.45Å; R832-L912 HydrophobicContact CB-CD1 3.75Å; R832-L912 HydrophobicContact CG-CD1 3.67Å
833	N	93.3	Very high	93.7	Very high	13 Å²	13	9.4 Å²	9.4	7%	0.07	5%	0.048	C	C	.	.	H	α-helix	trans	-65.7	-45.5	-178.5	-72.4	-18.4	0	0	0	110.9	V829 H830 G831 Y835 K836 R837	V829-N833 WeakPolarHBondContact O-CB 3.42Å; V829-N833 PolarHBondContact O-N 3.48Å; V829-N833 PolarHBondContact O-ND2 2.98Å; V829-N833 VanDerWaalsContact O-ND2 3.07Å; H830-N833 PolarHBondContact O-N 3.38Å; G831-N833 PolarHBondContact O-N 3.38Å; N833-Y835 PolarHBondContact O-N 3.22Å; N833-K836 PolarHBondContact O-N 3.39Å; N833-R837 VanDerWaalsContact O-CB 3.22Å; N833-R837 WeakPolarHBondContact O-CB 3.43Å; N833-R837 WeakPolarHBondContact O-CD 3.32Å; N833-R837 WeakPolarHBondContact O-CG 3.48Å; N833-R837 PolarHBondContact O-N 2.95Å
834	S	94.1	Very high	93.5	Very high	3 Å²	3	9.5 Å²	9.5	2%	0.021	5%	0.048	C	C	.	.	H	α-helix	trans	-54.9	-50	176.1	-68	0	0	0	0	111.7	F358 P379 H830 G831 S838	F358-S834 WeakPolarHBondContact CB-OG 3.2Å; F358-S834 WeakPolarHBondContact CG-OG 3.33Å; P379-S834 WeakPolarHBondContact O-CB 3.39Å; H830-S834 WeakPolarHBondContact O-CB 3.42Å; H830-S834 PolarHBondContact O-N 3.44Å; H830-S834 PolarHBondContact O-OG 2.86Å; H830-S834 VanDerWaalsContact O-OG 3.1Å; G831-S834 PolarHBondContact O-N 3.14Å; S834-S838 WeakPolarHBondContact O-CB 3.34Å; S834-S838 PolarHBondContact O-N 2.97Å; S834-S838 PolarHBondContact O-OG 2.82Å; S834-S838 VanDerWaalsContact O-OG 3.11Å
835	Y	93.7	Very high	93.5	Very high	1 Å²	1	9.5 Å²	9.5	0%	0.004	5%	0.048	C	C	.	.	H	α-helix	trans	-63	-46.8	179.1	179	-114	0	0	0	113	F296 R384 G831 N833 A839 L912 G915 P917	F296-Y835 HydrophobicContact CD2-CD2 4.03Å; F296-Y835 AromaticContact CD2-CE2 3.77Å; F296-Y835 HydrophobicContact CD2-CE2 3.77Å; F296-Y835 HydrophobicContact CE2-CE2 4.31Å; R384-Y835 VanDerWaalsContact CD-CE2 3.48Å; R384-Y835 HydrophobicContact CG-CD1 4.18Å; R384-Y835 HydrophobicContact CG-CD2 4.25Å; R384-Y835 HydrophobicContact CG-CE1 4.2Å; R384-Y835 HydrophobicContact CG-CE2 4.28Å; R384-Y835 HydrophobicContact CG-CG 4.23Å; G831-Y835 PolarHBondContact O-N 3.18Å; N833-Y835 PolarHBondContact O-N 3.22Å; Y835-A839 WeakPolarHBondContact O-CB 3.49Å; Y835-A839 PolarHBondContact O-N 2.87Å; Y835-L912 HydrophobicContact CD1-CB 4.29Å; Y835-L912 HydrophobicContact CD1-CD2 3.93Å; Y835-L912 HydrophobicContact CD1-CG 4.5Å; Y835-L912 HydrophobicContact CE1-CB 4.45Å; Y835-L912 HydrophobicContact CE1-CD2 4.2Å; Y835-G915 VanDerWaalsContact OH-CA 3.31Å; Y835-G915 WeakPolarHBondContact OH-CA 3.4Å; Y835-P917 HydrophobicContact CD1-CG 4.38Å; Y835-P917 HydrophobicContact CE1-CB 4.15Å; Y835-P917 HydrophobicContact CE1-CG 3.67Å
836	K	91.8	Very high	93.3	Very high	48 Å²	48	8.2 Å²	8.2	21%	0.209	4%	0.044	C	C	.	.	H	α-helix	trans	-63.8	-43.3	179.8	-78.5	-171.6	167.1	-174.6	0	112.5	R832 N833 A839 A840 D896 L912	R832-K836 PolarHBondContact O-N 2.92Å; N833-K836 PolarHBondContact O-N 3.39Å; K836-A839 PolarHBondContact O-N 2.87Å; K836-A840 PolarHBondContact O-N 2.93Å; K836-D896 WeakPolarHBondContact CD-OD2 3.42Å; K836-D896 IonicContact NZ-OD2 2.72Å; K836-D896 PolarHBondContact NZ-OD2 3.19Å; K836-L912 HydrophobicContact CD-CD2 4.34Å; K836-L912 HydrophobicContact CG-CD2 3.95Å
837	R	93.2	Very high	93.2	Very high	16 Å²	16	8.2 Å²	8.2	6%	0.06	4%	0.044	C	C	.	.	H	α-helix	trans	-66.4	-43.1	-179.6	-69.8	162.7	174.2	-161.9	-14	111.5	F358 M361 N833 A840 L841 V892 L893 D894	F358-R837 HydrophobicContact CE1-CB 3.95Å; F358-R837 HydrophobicContact CE1-CG 4.47Å; F358-R837 HydrophobicContact CZ-CB 3.69Å; M361-R837 PolarHBondContact SD-NH1 2.94Å; M361-R837 VanDerWaalsContact SD-NH1 3.44Å; N833-R837 VanDerWaalsContact O-CB 3.22Å; N833-R837 WeakPolarHBondContact O-CB 3.43Å; N833-R837 WeakPolarHBondContact O-CD 3.32Å; N833-R837 WeakPolarHBondContact O-CG 3.48Å; N833-R837 PolarHBondContact O-N 2.95Å; R837-A840 PolarHBondContact O-N 2.82Å; R837-L841 VanDerWaalsContact O-CB 3.28Å; R837-L841 WeakPolarHBondContact O-CB 3.29Å; R837-L841 PolarHBondContact O-N 3.01Å; R837-V892 VanDerWaalsContact CD-O 3.24Å; R837-V892 WeakPolarHBondContact CD-O 3.38Å; R837-V892 VanDerWaalsContact CZ-O 3.27Å; R837-V892 PolarHBondContact NE-O 3.3Å; R837-V892 PolarHBondContact NH1-O 2.87Å; R837-V892 VanDerWaalsContact NH1-O 3.09Å; R837-L893 PolarHBondContact NH2-O 3.48Å; R837-L893 VanDerWaalsContact NH2-O 3.07Å; R837-D894 PolarHBondContact NE-O 3.48Å; R837-D894 PolarHBondContact NH2-O 3.35Å
838	S	93.5	Very high	93	Very high	0 Å²	0	8.3 Å²	8.3	0%	0	4%	0.044	C	C	.	.	H	α-helix	trans	-64.9	-39.6	175.3	-66.7	0	0	0	0	112.8	F296 F358 E380 S834 L841 S842	F296-S838 WeakPolarHBondContact CZ-O 3.35Å; F358-S838 VanDerWaalsContact CE2-OG 3.24Å; F358-S838 WeakPolarHBondContact CE2-OG 3.4Å; E380-S838 VanDerWaalsContact CG-OG 3.32Å; E380-S838 WeakPolarHBondContact CG-OG 3.35Å; E380-S838 WeakPolarHBondContact OE1-CB 3.46Å; E380-S838 PolarHBondContact OE1-OG 2.92Å; S834-S838 WeakPolarHBondContact O-CB 3.34Å; S834-S838 PolarHBondContact O-N 2.97Å; S834-S838 PolarHBondContact O-OG 2.82Å; S834-S838 VanDerWaalsContact O-OG 3.11Å; S838-L841 PolarHBondContact O-N 2.95Å; S838-S842 VanDerWaalsContact O-CB 3.3Å; S838-S842 WeakPolarHBondContact O-CB 3.26Å; S838-S842 PolarHBondContact O-N 3.27Å
839	A	92.3	Very high	92.8	Very high	1 Å²	1	8.9 Å²	8.9	1%	0.008	5%	0.048	C	C	.	.	H	α-helix	trans	-61.9	-45	175.2	0	0	0	0	0	111.8	F296 Y835 K836 Q843 P917 L918	F296-A839 HydrophobicContact CE2-CB 4.21Å; Y835-A839 WeakPolarHBondContact O-CB 3.49Å; Y835-A839 PolarHBondContact O-N 2.87Å; K836-A839 PolarHBondContact O-N 2.87Å; A839-Q843 WeakPolarHBondContact O-CG 3.46Å; A839-Q843 PolarHBondContact O-N 3.2Å; A839-Q843 VanDerWaalsContact O-N 3.09Å; A839-P917 HydrophobicContact CB-CB 3.67Å; A839-L918 HydrophobicContact CB-CB 4.45Å
840	A	91.1	Very high	92.8	Very high	32 Å²	32	9.4 Å²	9.4	26%	0.264	5%	0.051	S	C	.	.	H	α-helix	trans	-62.7	-50.1	175.7	0	0	0	0	0	111.4	K836 R837 S842 Q843 F844	K836-A840 PolarHBondContact O-N 2.93Å; R837-A840 PolarHBondContact O-N 2.82Å; A840-S842 VanDerWaalsContact C-N 3.33Å; A840-S842 PolarHBondContact O-N 3.26Å; A840-Q843 PolarHBondContact O-N 3.27Å; A840-F844 WeakPolarHBondContact O-CD2 3.26Å; A840-F844 PolarHBondContact O-N 3.46Å
841	L	92.7	Very high	92.7	Very high	0 Å²	0	8.5 Å²	8.5	0%	0	5%	0.047	C	C	.	.	H	α-helix	trans	-56	-46.4	177.8	-179.1	63.6	0	0	0	111.8	N350 L351 R837 S838 Q843 F844 V845 V888 V892	N350-L841 HydrophobicContact CB-CD1 4.37Å; N350-L841 HydrophobicContact CB-CD2 4.15Å; N350-L841 HydrophobicContact CB-CG 4.34Å; L351-L841 HydrophobicContact CD2-CD2 4.34Å; R837-L841 VanDerWaalsContact O-CB 3.28Å; R837-L841 WeakPolarHBondContact O-CB 3.29Å; R837-L841 PolarHBondContact O-N 3.01Å; S838-L841 PolarHBondContact O-N 2.95Å; L841-Q843 PolarHBondContact O-N 3.48Å; L841-F844 PolarHBondContact O-N 3.04Å; L841-V845 HydrophobicContact CD1-CG2 4.29Å; L841-V845 VanDerWaalsContact O-CG2 3.3Å; L841-V845 WeakPolarHBondContact O-CG2 3.42Å; L841-V845 PolarHBondContact O-N 2.93Å; L841-V888 HydrophobicContact CD1-CG1 3.73Å; L841-V888 VanDerWaalsContact CD1-O 3.23Å; L841-V888 WeakPolarHBondContact CD1-O 3.47Å; L841-V892 HydrophobicContact CD2-CG2 3.87Å
842	S	92.5	Very high	92.6	Very high	0 Å²	0	9 Å²	9	0%	0	5%	0.049	C	C	.	.	H	α-helix	trans	-61.8	-43.6	178.4	-179.3	0	0	0	0	112.2	S838 A840 I846	S838-S842 VanDerWaalsContact O-CB 3.3Å; S838-S842 WeakPolarHBondContact O-CB 3.26Å; S838-S842 PolarHBondContact O-N 3.27Å; A840-S842 VanDerWaalsContact C-N 3.33Å; A840-S842 PolarHBondContact O-N 3.26Å; S842-I846 WeakPolarHBondContact O-CD1 3.49Å; S842-I846 VanDerWaalsContact O-CG1 3.25Å; S842-I846 WeakPolarHBondContact O-CG1 3.22Å; S842-I846 PolarHBondContact O-N 3.43Å
843	Q	91.4	Very high	92.6	Very high	22 Å²	22	9.2 Å²	9.2	10%	0.103	5%	0.051	C	C	.	.	H	α-helix	trans	-65.6	-42.6	179.4	-75.9	173.1	-8.9	0	0	111.6	A839 A840 L841 I846 H847 P917 L918 T922 W926	A839-Q843 WeakPolarHBondContact O-CG 3.46Å; A839-Q843 PolarHBondContact O-N 3.2Å; A839-Q843 VanDerWaalsContact O-N 3.09Å; A840-Q843 PolarHBondContact O-N 3.27Å; L841-Q843 PolarHBondContact O-N 3.48Å; Q843-I846 PolarHBondContact O-N 2.96Å; Q843-H847 VanDerWaalsContact O-CB 3.22Å; Q843-H847 WeakPolarHBondContact O-CB 3.45Å; Q843-H847 PolarHBondContact O-N 3.47Å; Q843-P917 PolarHBondContact NE2-O 2.69Å; Q843-L918 HydrophobicContact CG-CD1 4.37Å; Q843-T922 PolarHBondContact NE2-OG1 3.49Å; Q843-W926 HydrophobicContact CB-CD2 4.46Å; Q843-W926 HydrophobicContact CB-CG 4.26Å; Q843-W926 VanDerWaalsContact CD-CD1 3.49Å
844	F	91.6	Very high	92.6	Very high	2 Å²	2	9.6 Å²	9.6	1%	0.009	5%	0.054	C	C	.	.	H	α-helix	trans	-64.6	-42.4	177.1	-93.1	-79	0	0	0	112.9	A840 L841 I846 H847 R848 V888 L891 W926 M967 V968 T971	A840-F844 WeakPolarHBondContact O-CD2 3.26Å; A840-F844 PolarHBondContact O-N 3.46Å; L841-F844 PolarHBondContact O-N 3.04Å; F844-I846 VanDerWaalsContact C-N 3.31Å; F844-I846 PolarHBondContact O-N 3.4Å; F844-H847 WeakPolarHBondContact O-CB 3.4Å; F844-H847 PolarHBondContact O-N 2.89Å; F844-R848 PolarHBondContact O-N 2.93Å; F844-V888 HydrophobicContact CB-CG1 4.09Å; F844-L891 HydrophobicContact CB-CD1 4.02Å; F844-L891 HydrophobicContact CD1-CD1 4.5Å; F844-L891 HydrophobicContact CD2-CD1 3.38Å; F844-L891 HydrophobicContact CE2-CD1 3.94Å; F844-L891 HydrophobicContact CG-CD1 3.71Å; F844-W926 HydrophobicContact CD1-CH2 4.49Å; F844-W926 HydrophobicContact CD2-CH2 4.32Å; F844-W926 AromaticContact CE1-CH2 3.93Å; F844-W926 HydrophobicContact CE1-CH2 3.93Å; F844-W926 HydrophobicContact CE1-CZ3 4.28Å; F844-W926 AromaticContact CE2-CH2 3.73Å; F844-W926 HydrophobicContact CE2-CH2 3.73Å; F844-W926 HydrophobicContact CE2-CZ2 4.02Å; F844-W926 AromaticContact CZ-CH2 3.51Å; F844-W926 HydrophobicContact CZ-CH2 3.51Å; F844-W926 HydrophobicContact CZ-CZ2 4.25Å; F844-W926 HydrophobicContact CZ-CZ3 4.3Å; F844-M967 HydrophobicContact CE1-CG 4Å; F844-V968 HydrophobicContact CD1-CG2 4.27Å; F844-V968 HydrophobicContact CE1-CG2 4.16Å; F844-T971 HydrophobicContact CE2-CG2 3.58Å; F844-T971 HydrophobicContact CZ-CG2 3.58Å
845	V	92.4	Very high	92.6	Very high	0 Å²	0	9.4 Å²	9.4	0%	0	5%	0.053	C	C	.	.	H	α-helix	trans	-66.9	-34.1	177.6	174.4	0	0	0	0	111.8	P344 L347 N350 L841 R848 V888	P344-V845 HydrophobicContact CB-CG1 3.79Å; P344-V845 HydrophobicContact CG-CG1 4.22Å; L347-V845 HydrophobicContact CB-CG1 3.88Å; L347-V845 HydrophobicContact CD1-CB 4.05Å; L347-V845 HydrophobicContact CD1-CG1 4.1Å; N350-V845 HydrophobicContact CB-CG2 4.3Å; L841-V845 HydrophobicContact CD1-CG2 4.29Å; L841-V845 VanDerWaalsContact O-CG2 3.3Å; L841-V845 WeakPolarHBondContact O-CG2 3.42Å; L841-V845 PolarHBondContact O-N 2.93Å; V845-R848 VanDerWaalsContact O-CG 3.26Å; V845-R848 WeakPolarHBondContact O-CG 3.28Å; V845-V888 HydrophobicContact CG2-CG1 3.61Å
846	I	92.3	Very high	92.6	Very high	4 Å²	4	10 Å²	10	2%	0.021	6%	0.056	C	C	.	.	H	α-helix	trans	-69.7	-44.2	172.2	-69.3	166.1	0	0	0	110.4	L307 P344 L347 S842 Q843 F844 R848 S849 L850 F923	L307-I846 HydrophobicContact CD1-CD1 4.32Å; L307-I846 HydrophobicContact CD1-CG1 4.23Å; L307-I846 HydrophobicContact CD1-CG2 4.01Å; L307-I846 HydrophobicContact CD2-CG2 4.44Å; P344-I846 HydrophobicContact CG-CG1 4.05Å; L347-I846 HydrophobicContact CD2-CD1 4.29Å; L347-I846 HydrophobicContact CD2-CG1 4.16Å; S842-I846 WeakPolarHBondContact O-CD1 3.49Å; S842-I846 VanDerWaalsContact O-CG1 3.25Å; S842-I846 WeakPolarHBondContact O-CG1 3.22Å; S842-I846 PolarHBondContact O-N 3.43Å; Q843-I846 PolarHBondContact O-N 2.96Å; F844-I846 VanDerWaalsContact C-N 3.31Å; F844-I846 PolarHBondContact O-N 3.4Å; I846-R848 PolarHBondContact O-N 3.33Å; I846-S849 WeakPolarHBondContact O-CB 3.47Å; I846-S849 PolarHBondContact O-N 2.97Å; I846-L850 HydrophobicContact CG2-CD1 3.66Å; I846-L850 HydrophobicContact CG2-CG 4.18Å; I846-L850 WeakPolarHBondContact O-CG 3.29Å; I846-L850 PolarHBondContact O-N 3.24Å; I846-F923 HydrophobicContact CD1-CE2 4.44Å; I846-F923 HydrophobicContact CG2-CE2 4.13Å
847	H	92.6	Very high	92.6	Very high	0 Å²	0	8.7 Å²	8.7	0%	0	5%	0.054	C	C	.	.	H	α-helix	trans	-56.2	-52.9	-178.1	169.1	67.9	0	0	0	112.2	Q843 F844 S849 L850 C851 W926 S930 Q933 E964	Q843-H847 VanDerWaalsContact O-CB 3.22Å; Q843-H847 WeakPolarHBondContact O-CB 3.45Å; Q843-H847 PolarHBondContact O-N 3.47Å; F844-H847 WeakPolarHBondContact O-CB 3.4Å; F844-H847 PolarHBondContact O-N 2.89Å; H847-S849 VanDerWaalsContact C-N 3.25Å; H847-S849 PolarHBondContact O-N 3.27Å; H847-L850 PolarHBondContact O-N 3.29Å; H847-C851 PolarHBondContact CE1-SG 3.47Å; H847-C851 PolarHBondContact O-N 3.49Å; H847-C851 PolarHBondContact O-SG 2.76Å; H847-W926 HydrophobicContact CB-CE3 3.96Å; H847-W926 HydrophobicContact CB-CZ3 4.36Å; H847-W926 AromaticContact CG-CE3 3.83Å; H847-W926 AromaticContact CG-CZ3 3.99Å; H847-W926 AromaticContact ND1-CE3 3.86Å; H847-S930 VanDerWaalsContact CA-OG 3.27Å; H847-S930 WeakPolarHBondContact CA-OG 3.09Å; H847-S930 PolarHBondContact ND1-OG 3.34Å; H847-S930 PolarHBondContact O-OG 2.97Å; H847-Q933 PolarHBondContact CE1-OE1 3.45Å; H847-Q933 PolarHBondContact NE2-OE1 3.3Å; H847-E964 IonicContact CD2-OE1 3.71Å; H847-E964 IonicContact CD2-OE2 3.55Å; H847-E964 IonicContact NE2-OE1 2.65Å
848	R	91.5	Very high	92.5	Very high	2 Å²	2	9.4 Å²	9.4	1%	0.008	6%	0.06	C	C	.	.	H	α-helix	trans	-57.8	-38	179.2	72.4	176	-176.8	171.4	-1	113	S346 F844 V845 I846 C851 I852 Y879 S880 T884 E964	S346-R848 VanDerWaalsContact CB-NH2 3.3Å; S346-R848 PolarHBondContact OG-NH2 2.9Å; F844-R848 PolarHBondContact O-N 2.93Å; V845-R848 VanDerWaalsContact O-CG 3.26Å; V845-R848 WeakPolarHBondContact O-CG 3.28Å; I846-R848 PolarHBondContact O-N 3.33Å; R848-C851 PolarHBondContact O-N 3.29Å; R848-I852 PolarHBondContact O-N 2.83Å; R848-Y879 HydrophobicContact CB-CE1 4.42Å; R848-Y879 WeakPolarHBondContact CB-OH 3.47Å; R848-Y879 PolarHBondContact O-OH 2.87Å; R848-S880 PolarHBondContact NH1-O 3.45Å; R848-S880 PolarHBondContact NH2-O 3.19Å; R848-T884 PolarHBondContact NH1-O 3.36Å; R848-T884 PolarHBondContact NH1-OG1 3.29Å; R848-E964 WeakPolarHBondContact CA-OE1 3.12Å
849	S	91.4	Very high	92.5	Very high	14 Å²	14	9.8 Å²	9.8	10%	0.098	6%	0.061	C	C	.	.	H	α-helix	trans	-70.9	-41.1	-179.7	-105	0	0	0	0	111.8	H341 P344 I846 H847 S853	H341-S849 WeakPolarHBondContact O-CB 3.42Å; H341-S849 PolarHBondContact O-OG 3.43Å; P344-S849 WeakPolarHBondContact CB-OG 3.29Å; I846-S849 WeakPolarHBondContact O-CB 3.47Å; I846-S849 PolarHBondContact O-N 2.97Å; H847-S849 VanDerWaalsContact C-N 3.25Å; H847-S849 PolarHBondContact O-N 3.27Å; S849-S853 PolarHBondContact O-N 3.48Å; S849-S853 VanDerWaalsContact O-N 3.16Å
850	L	93.6	Very high	92.4	Very high	17 Å²	17	9.7 Å²	9.7	9%	0.089	6%	0.061	C	C	.	.	H	α-helix	trans	-68.1	-34.5	174.5	-72.9	174.4	0	0	0	112.5	L307 I342 I846 H847 S853 T854 V927	L307-L850 HydrophobicContact CD2-CD1 4.29Å; L307-L850 HydrophobicContact CD2-CD2 4.06Å; I342-L850 HydrophobicContact CB-CD2 4.46Å; I342-L850 HydrophobicContact CG1-CD2 4.4Å; I342-L850 HydrophobicContact CG2-CD2 3.95Å; I846-L850 HydrophobicContact CG2-CD1 3.66Å; I846-L850 HydrophobicContact CG2-CG 4.18Å; I846-L850 WeakPolarHBondContact O-CG 3.29Å; I846-L850 PolarHBondContact O-N 3.24Å; H847-L850 PolarHBondContact O-N 3.29Å; L850-S853 PolarHBondContact O-N 3.49Å; L850-T854 WeakPolarHBondContact O-CB 3.37Å; L850-T854 PolarHBondContact O-N 3.45Å; L850-T854 PolarHBondContact O-OG1 3.46Å; L850-V927 HydrophobicContact CD1-CB 4.3Å; L850-V927 HydrophobicContact CD1-CG1 4.36Å; L850-V927 HydrophobicContact CD1-CG2 3.75Å
851	C	93.8	Very high	92.3	Very high	1 Å²	1	10.7 Å²	10.7	1%	0.007	7%	0.066	C	C	.	.	H	α-helix	trans	-57.4	-52.3	174.2	-71.9	0	0	0	0	110.9	H847 R848 S853 T854 M855 L960	H847-C851 PolarHBondContact CE1-SG 3.47Å; H847-C851 PolarHBondContact O-N 3.49Å; H847-C851 PolarHBondContact O-SG 2.76Å; R848-C851 PolarHBondContact O-N 3.29Å; C851-S853 PolarHBondContact O-N 3.49Å; C851-T854 PolarHBondContact O-N 3.44Å; C851-M855 WeakPolarHBondContact O-CG 3.49Å; C851-M855 PolarHBondContact O-N 3.23Å; C851-L960 HydrophobicContact CB-CD1 4.15Å
852	I	92.6	Very high	92.1	Very high	10 Å²	10	14.4 Å²	14.4	5%	0.051	9%	0.089	C	C	.	.	H	α-helix	trans	-59.1	-46.2	176.9	-72.8	-173.5	0	0	0	111.8	R848 T854 M855 Q856 I876 Y879 L960	R848-I852 PolarHBondContact O-N 2.83Å; I852-T854 VanDerWaalsContact C-N 3.26Å; I852-T854 PolarHBondContact O-N 3.08Å; I852-M855 WeakPolarHBondContact O-CB 3.19Å; I852-M855 PolarHBondContact O-N 3.05Å; I852-Q856 WeakPolarHBondContact O-CB 3.47Å; I852-Q856 PolarHBondContact O-N 3.05Å; I852-I876 HydrophobicContact CG2-CD1 4.3Å; I852-Y879 HydrophobicContact CD1-CD1 3.15Å; I852-Y879 HydrophobicContact CD1-CD2 4.2Å; I852-Y879 HydrophobicContact CD1-CE1 3.12Å; I852-Y879 HydrophobicContact CD1-CE2 4.18Å; I852-Y879 HydrophobicContact CD1-CG 3.7Å; I852-Y879 HydrophobicContact CG1-CD1 4.38Å; I852-Y879 HydrophobicContact CG1-CE1 3.93Å; I852-L960 HydrophobicContact CD1-CD2 3.95Å; I852-L960 HydrophobicContact CG1-CD2 3.56Å
853	S	92.7	Very high	91.8	Very high	8 Å²	8	18 Å²	18	6%	0.056	10%	0.104	C	C	.	.	H	α-helix	trans	-63.6	-35.1	179.7	-175.1	0	0	0	0	112.5	F339 I342 S849 L850 C851 Q856 A857	F339-S853 WeakPolarHBondContact CD1-OG 3.41Å; I342-S853 WeakPolarHBondContact CD1-OG 3.45Å; I342-S853 VanDerWaalsContact CG1-CB 3.48Å; I342-S853 WeakPolarHBondContact CG1-OG 3.41Å; S849-S853 PolarHBondContact O-N 3.48Å; S849-S853 VanDerWaalsContact O-N 3.16Å; L850-S853 PolarHBondContact O-N 3.49Å; C851-S853 PolarHBondContact O-N 3.49Å; S853-Q856 PolarHBondContact O-N 3.38Å; S853-A857 WeakPolarHBondContact O-CB 3.46Å; S853-A857 PolarHBondContact O-N 3.03Å
854	T	94.4	Very high	91.6	Very high	20 Å²	20	27 Å²	27	12%	0.123	14%	0.139	C	C	.	.	H	α-helix	trans	-68.7	-43.9	176.9	-55.3	0	0	0	0	110.3	L850 C851 I852 Q856 A857 V858 I931	L850-T854 WeakPolarHBondContact O-CB 3.37Å; L850-T854 PolarHBondContact O-N 3.45Å; L850-T854 PolarHBondContact O-OG1 3.46Å; C851-T854 PolarHBondContact O-N 3.44Å; I852-T854 VanDerWaalsContact C-N 3.26Å; I852-T854 PolarHBondContact O-N 3.08Å; T854-Q856 VanDerWaalsContact C-N 3.28Å; T854-Q856 PolarHBondContact O-N 3.18Å; T854-A857 PolarHBondContact O-N 3.39Å; T854-A857 VanDerWaalsContact O-N 3.12Å; T854-V858 HydrophobicContact CG2-CG2 4.5Å; T854-V858 WeakPolarHBondContact O-CG2 3.35Å; T854-V858 PolarHBondContact O-N 3.35Å; T854-I931 HydrophobicContact CG2-CG2 4.33Å
855	M	93.8	Very high	91.4	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-56.4	-45.4	173.3	-67.8	176.5	71.7	0	0	111	C851 I852 A857 V858 F859 L870 Y871 G934 I937 M938 L960	C851-M855 WeakPolarHBondContact O-CG 3.49Å; C851-M855 PolarHBondContact O-N 3.23Å; I852-M855 WeakPolarHBondContact O-CB 3.19Å; I852-M855 PolarHBondContact O-N 3.05Å; M855-A857 VanDerWaalsContact C-N 3.34Å; M855-A857 PolarHBondContact O-N 2.9Å; M855-V858 PolarHBondContact O-N 2.98Å; M855-F859 VanDerWaalsContact O-CB 3.26Å; M855-F859 WeakPolarHBondContact O-CB 3.32Å; M855-F859 PolarHBondContact O-N 3.35Å; M855-L870 HydrophobicContact CB-CD2 4.23Å; M855-Y871 HydrophobicContact CE-CE2 4.42Å; M855-Y871 WeakPolarHBondContact CE-OH 3.49Å; M855-G934 VanDerWaalsContact CG-O 3.27Å; M855-G934 WeakPolarHBondContact CG-O 3.34Å; M855-I937 HydrophobicContact CE-CB 4.21Å; M855-I937 HydrophobicContact CE-CG2 3.47Å; M855-I937 VanDerWaalsContact CE-CG2 3.47Å; M855-I937 HydrophobicContact SD-CB 4.37Å; M855-I937 HydrophobicContact SD-CG2 4.09Å; M855-M938 HydrophobicContact CB-CB 4.22Å; M855-M938 HydrophobicContact CB-CE 3.93Å; M855-M938 HydrophobicContact CE-CE 4.04Å; M855-M938 HydrophobicContact CG-CB 4.23Å; M855-L960 HydrophobicContact SD-CB 4.3Å; M855-L960 HydrophobicContact SD-CD1 3.88Å; M855-L960 HydrophobicContact SD-CD2 4.04Å; M855-L960 HydrophobicContact SD-CG 4.29Å
856	Q	92.8	Very high	91.1	Very high	13 Å²	13	31 Å²	31	6%	0.061	16%	0.163	C	C	.	.	H	α-helix	trans	-61.5	-40.3	175.8	-178.2	62.1	58.5	0	0	112.3	L338 F339 I852 S853 T854 F859 S860 V868	L338-Q856 HydrophobicContact CD1-CG 4.09Å; L338-Q856 HydrophobicContact CD2-CG 4.16Å; L338-Q856 HydrophobicContact CG-CG 3.8Å; F339-Q856 HydrophobicContact CD1-CG 4.25Å; F339-Q856 HydrophobicContact CE1-CB 4.2Å; F339-Q856 HydrophobicContact CE1-CG 3.88Å; I852-Q856 WeakPolarHBondContact O-CB 3.47Å; I852-Q856 PolarHBondContact O-N 3.05Å; S853-Q856 PolarHBondContact O-N 3.38Å; T854-Q856 VanDerWaalsContact C-N 3.28Å; T854-Q856 PolarHBondContact O-N 3.18Å; Q856-F859 PolarHBondContact O-N 3.4Å; Q856-S860 PolarHBondContact NE2-OG 2.96Å; Q856-S860 VanDerWaalsContact NE2-OG 3.17Å; Q856-S860 WeakPolarHBondContact O-CB 3.35Å; Q856-S860 PolarHBondContact O-N 3.35Å; Q856-S860 PolarHBondContact O-OG 2.96Å; Q856-V868 PolarHBondContact NE2-O 3.48Å
857	A	92.5	Very high	90.8	Very high	21 Å²	21	31.8 Å²	31.8	17%	0.174	17%	0.169	C	C	.	.	H	α-helix	trans	-67.9	-43.5	179.9	0	0	0	0	0	111.9	F339 S853 T854 M855 S861	F339-A857 HydrophobicContact CE1-CB 3.72Å; F339-A857 HydrophobicContact CZ-CB 3.99Å; S853-A857 WeakPolarHBondContact O-CB 3.46Å; S853-A857 PolarHBondContact O-N 3.03Å; T854-A857 PolarHBondContact O-N 3.39Å; T854-A857 VanDerWaalsContact O-N 3.12Å; M855-A857 VanDerWaalsContact C-N 3.34Å; M855-A857 PolarHBondContact O-N 2.9Å; A857-S861 WeakPolarHBondContact O-CB 3.2Å; A857-S861 PolarHBondContact O-N 3.05Å; A857-S861 PolarHBondContact O-OG 3.44Å
858	V	92.3	Very high	90.5	Very high	31 Å²	31	35.2 Å²	35.2	19%	0.188	19%	0.189	C	C	.	.	H	α-helix	trans	-63.3	-45.5	175	175.2	0	0	0	0	110.2	T854 M855 S861 V862 M938	T854-V858 HydrophobicContact CG2-CG2 4.5Å; T854-V858 WeakPolarHBondContact O-CG2 3.35Å; T854-V858 PolarHBondContact O-N 3.35Å; M855-V858 PolarHBondContact O-N 2.98Å; V858-S861 PolarHBondContact O-N 3.39Å; V858-V862 WeakPolarHBondContact O-CG2 3.29Å; V858-V862 PolarHBondContact O-N 3.42Å; V858-M938 HydrophobicContact CB-CB 4.19Å; V858-M938 HydrophobicContact CB-CG 3.81Å; V858-M938 HydrophobicContact CG1-CB 4.09Å; V858-M938 HydrophobicContact CG1-CG 3.59Å
859	F	91.5	Very high	90.3	Very high	7 Å²	7	36.4 Å²	36.4	3%	0.031	20%	0.197	C	C	.	.	H	α-helix	trans	-56.1	-55.7	175.3	176.8	-104.1	0	0	0	111.5	M855 Q856 S861 V862 F863 L870 M938 F949	M855-F859 VanDerWaalsContact O-CB 3.26Å; M855-F859 WeakPolarHBondContact O-CB 3.32Å; M855-F859 PolarHBondContact O-N 3.35Å; Q856-F859 PolarHBondContact O-N 3.4Å; F859-S861 PolarHBondContact O-N 2.96Å; F859-V862 PolarHBondContact O-N 3.42Å; F859-V862 VanDerWaalsContact O-N 3.13Å; F859-F863 AromaticContact CD2-CD2 3.52Å; F859-F863 HydrophobicContact CD2-CD2 3.52Å; F859-F863 AromaticContact CD2-CE2 3.47Å; F859-F863 HydrophobicContact CD2-CE2 3.47Å; F859-F863 VanDerWaalsContact CD2-CE2 3.47Å; F859-F863 HydrophobicContact CE1-CD2 4.39Å; F859-F863 AromaticContact CE2-CD2 3.24Å; F859-F863 HydrophobicContact CE2-CD2 3.24Å; F859-F863 AromaticContact CE2-CE2 3.06Å; F859-F863 HydrophobicContact CE2-CE2 3.06Å; F859-F863 HydrophobicContact CE2-CG 4.12Å; F859-F863 AromaticContact CE2-CZ 3.79Å; F859-F863 HydrophobicContact CE2-CZ 3.79Å; F859-F863 HydrophobicContact CG-CD2 4.2Å; F859-F863 AromaticContact CZ-CD2 3.73Å; F859-F863 HydrophobicContact CZ-CD2 3.73Å; F859-F863 AromaticContact CZ-CE2 3.9Å; F859-F863 HydrophobicContact CZ-CE2 3.9Å; F859-F863 HydrophobicContact CZ-CG 4.18Å; F859-F863 HydrophobicContact CZ-CZ 4.46Å; F859-F863 WeakPolarHBondContact O-CD2 3.29Å; F859-F863 PolarHBondContact O-N 2.64Å; F859-L870 HydrophobicContact CB-CD1 4.47Å; F859-L870 HydrophobicContact CD1-CB 4.14Å; F859-L870 HydrophobicContact CD1-CD1 4.36Å; F859-L870 HydrophobicContact CD2-CD1 3.78Å; F859-L870 HydrophobicContact CE2-CD1 4.08Å; F859-L870 HydrophobicContact CG-CB 4.37Å; F859-L870 HydrophobicContact CG-CD1 3.94Å; F859-L870 HydrophobicContact CZ-CD1 4.49Å; F859-M938 HydrophobicContact CB-CE 4Å; F859-M938 HydrophobicContact CB-CG 4.44Å; F859-M938 HydrophobicContact CB-SD 4.08Å; F859-M938 HydrophobicContact CD2-SD 4.34Å; F859-F949 AromaticContact CE2-CE2 3.6Å; F859-F949 HydrophobicContact CE2-CE2 3.6Å; F859-F949 HydrophobicContact CE2-CZ 4.29Å; F859-F949 AromaticContact CZ-CE2 3.64Å; F859-F949 HydrophobicContact CZ-CE2 3.64Å; F859-F949 HydrophobicContact CZ-CZ 4Å
860	S	91	Very high	90.2	Very high	0 Å²	0	36 Å²	36	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-58.5	-36.3	178.6	-72.8	0	0	0	0	112.4	M318 Q856 F863 F865 A866	M318-S860 VanDerWaalsContact CE-CB 3.4Å; Q856-S860 PolarHBondContact NE2-OG 2.96Å; Q856-S860 VanDerWaalsContact NE2-OG 3.17Å; Q856-S860 WeakPolarHBondContact O-CB 3.35Å; Q856-S860 PolarHBondContact O-N 3.35Å; Q856-S860 PolarHBondContact O-OG 2.96Å; S860-F863 CarbonylContact O-C 3.57Å; S860-F863 PolarHBondContact O-N 3.03Å; S860-F865 WeakPolarHBondContact O-CA 3.36Å; S860-F865 PolarHBondContact O-N 3.44Å; S860-A866 PolarHBondContact OG-O 2.91Å; S860-A866 VanDerWaalsContact OG-O 3.1Å
861	S	89.7	Confident	89.9	Confident	52 Å²	52	35.6 Å²	35.6	36%	0.364	19%	0.191	S	C	.	.	H	α-helix	trans	-66.4	-37.5	178.3	-57.5	0	0	0	0	112.8	A857 V858 F859	A857-S861 WeakPolarHBondContact O-CB 3.2Å; A857-S861 PolarHBondContact O-N 3.05Å; A857-S861 PolarHBondContact O-OG 3.44Å; V858-S861 PolarHBondContact O-N 3.39Å; F859-S861 PolarHBondContact O-N 2.96Å
862	V	88	Confident	89.2	Confident	79 Å²	79	40.6 Å²	40.6	48%	0.479	22%	0.215	S	C	.	.	H	α-helix	trans	-74.3	-36.9	178.4	177.2	0	0	0	0	111.4	V858 F859 Y864 M942	V858-V862 WeakPolarHBondContact O-CG2 3.29Å; V858-V862 PolarHBondContact O-N 3.42Å; F859-V862 PolarHBondContact O-N 3.42Å; F859-V862 VanDerWaalsContact O-N 3.13Å; V862-Y864 VanDerWaalsContact C-N 3.28Å; V862-Y864 PolarHBondContact O-N 3.45Å; V862-Y864 VanDerWaalsContact O-N 3.16Å; V862-M942 HydrophobicContact CB-CE 4.38Å; V862-M942 HydrophobicContact CG1-CE 3.58Å
863	F	86.8	Confident	88.5	Confident	76 Å²	76	41.4 Å²	41.4	33%	0.333	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.8	53.8	178.7	-71.5	-91.2	0	0	0	112.3	F859 S860 F865 A866 M942	F859-F863 AromaticContact CD2-CD2 3.52Å; F859-F863 HydrophobicContact CD2-CD2 3.52Å; F859-F863 AromaticContact CD2-CE2 3.47Å; F859-F863 HydrophobicContact CD2-CE2 3.47Å; F859-F863 VanDerWaalsContact CD2-CE2 3.47Å; F859-F863 HydrophobicContact CE1-CD2 4.39Å; F859-F863 AromaticContact CE2-CD2 3.24Å; F859-F863 HydrophobicContact CE2-CD2 3.24Å; F859-F863 AromaticContact CE2-CE2 3.06Å; F859-F863 HydrophobicContact CE2-CE2 3.06Å; F859-F863 HydrophobicContact CE2-CG 4.12Å; F859-F863 AromaticContact CE2-CZ 3.79Å; F859-F863 HydrophobicContact CE2-CZ 3.79Å; F859-F863 HydrophobicContact CG-CD2 4.2Å; F859-F863 AromaticContact CZ-CD2 3.73Å; F859-F863 HydrophobicContact CZ-CD2 3.73Å; F859-F863 AromaticContact CZ-CE2 3.9Å; F859-F863 HydrophobicContact CZ-CE2 3.9Å; F859-F863 HydrophobicContact CZ-CG 4.18Å; F859-F863 HydrophobicContact CZ-CZ 4.46Å; F859-F863 WeakPolarHBondContact O-CD2 3.29Å; F859-F863 PolarHBondContact O-N 2.64Å; S860-F863 CarbonylContact O-C 3.57Å; S860-F863 PolarHBondContact O-N 3.03Å; F863-F865 PolarHBondContact O-N 2.84Å; F863-F865 VanDerWaalsContact O-N 3.1Å; F863-A866 VanDerWaalsContact O-CB 3.24Å; F863-A866 WeakPolarHBondContact O-CB 3.33Å; F863-A866 PolarHBondContact O-N 3.36Å; F863-M942 HydrophobicContact CD2-CE 4.4Å; F863-M942 HydrophobicContact CE2-CE 3.42Å; F863-M942 VanDerWaalsContact CE2-CE 3.42Å; F863-M942 HydrophobicContact CE2-SD 4.02Å; F863-M942 HydrophobicContact CZ-CE 3.78Å; F863-M942 HydrophobicContact CZ-SD 4.44Å
864	Y	86.9	Confident	88	Confident	211 Å²	211	47 Å²	47	83%	0.827	25%	0.25	S	C	*	.	T	Hydrogen-bonded Turn	trans	51.3	36.1	173.4	-58	-79.8	0	0	0	115.1	V862 A866	V862-Y864 VanDerWaalsContact C-N 3.28Å; V862-Y864 PolarHBondContact O-N 3.45Å; V862-Y864 VanDerWaalsContact O-N 3.16Å; Y864-A866 PolarHBondContact O-N 3.28Å
865	F	87.9	Confident	87.5	Confident	49 Å²	49	46.2 Å²	46.2	22%	0.215	25%	0.245	C	C	.	.	T	Hydrogen-bonded Turn	trans	57	35.7	-177.7	-51.7	-80.3	0	0	0	112.7	M318 L321 Q322 F335 S860 F863	M318-F865 HydrophobicContact CE-CD1 3.75Å; M318-F865 HydrophobicContact CE-CE1 4.4Å; M318-F865 HydrophobicContact SD-CD1 4.02Å; M318-F865 HydrophobicContact SD-CE1 4.31Å; L321-F865 HydrophobicContact CB-CD1 4.08Å; L321-F865 HydrophobicContact CB-CE1 3.77Å; L321-F865 HydrophobicContact CB-CE2 4.21Å; L321-F865 HydrophobicContact CB-CG 4.45Å; L321-F865 HydrophobicContact CB-CZ 3.85Å; L321-F865 HydrophobicContact CD1-CD1 4.4Å; L321-F865 HydrophobicContact CD1-CE1 3.58Å; L321-F865 HydrophobicContact CD1-CZ 3.98Å; L321-F865 HydrophobicContact CG-CE1 4.31Å; L321-F865 HydrophobicContact CG-CZ 4.44Å; Q322-F865 HydrophobicContact CB-CB 4.37Å; F335-F865 WeakPolarHBondContact CZ-O 3.17Å; S860-F865 WeakPolarHBondContact O-CA 3.36Å; S860-F865 PolarHBondContact O-N 3.44Å; F863-F865 PolarHBondContact O-N 2.84Å; F863-F865 VanDerWaalsContact O-N 3.1Å
866	A	85.3	Confident	87	Confident	37 Å²	37	47.4 Å²	47.4	31%	0.306	25%	0.251	S	S	.	.			trans	-74.6	137	174	0	0	0	0	0	111.5	S860 F863 Y864 V868	S860-A866 PolarHBondContact OG-O 2.91Å; S860-A866 VanDerWaalsContact OG-O 3.1Å; F863-A866 VanDerWaalsContact O-CB 3.24Å; F863-A866 WeakPolarHBondContact O-CB 3.33Å; F863-A866 PolarHBondContact O-N 3.36Å; Y864-A866 PolarHBondContact O-N 3.28Å; A866-V868 HydrophobicContact CB-CG2 4.14Å; A866-V868 PolarHBondContact O-N 3.46Å
867	S	85.4	Confident	86.4	Confident	19 Å²	19	48.7 Å²	48.7	13%	0.133	26%	0.257	C	S	.	.			trans	-83.6	53.6	177.1	69.1	0	0	0	0	111.8
868	V	86.8	Confident	86	Confident	72 Å²	72	47.9 Å²	47.9	44%	0.436	25%	0.251	S	S	.	.			trans	-104.6	128.1	179.9	-179.6	0	0	0	0	109.7	Q856 A866 L870	Q856-V868 PolarHBondContact NE2-O 3.48Å; A866-V868 HydrophobicContact CB-CG2 4.14Å; A866-V868 PolarHBondContact O-N 3.46Å; V868-L870 PolarHBondContact O-N 3.26Å
869	P	87.8	Confident	85.7	Confident	27 Å²	27	46.6 Å²	46.6	18%	0.175	24%	0.243	C	C	.	.			trans	-69.1	128.7	176.2	27.4	-32.5	0	0	0	111.4	L338 Q872	L338-P869 HydrophobicContact CD1-CB 3.94Å; P869-Q872 HydrophobicContact CB-CG 4.25Å; P869-Q872 HydrophobicContact CG-CG 3.85Å
870	L	88.2	Confident	85.1	Confident	5 Å²	5	47.9 Å²	47.9	3%	0.026	25%	0.253	C	S	.	.	S	Bend	trans	-64.5	-47.5	175.5	173.7	71.3	0	0	0	111.4	M855 F859 V868 M938	M855-L870 HydrophobicContact CB-CD2 4.23Å; F859-L870 HydrophobicContact CB-CD1 4.47Å; F859-L870 HydrophobicContact CD1-CB 4.14Å; F859-L870 HydrophobicContact CD1-CD1 4.36Å; F859-L870 HydrophobicContact CD2-CD1 3.78Å; F859-L870 HydrophobicContact CE2-CD1 4.08Å; F859-L870 HydrophobicContact CG-CB 4.37Å; F859-L870 HydrophobicContact CG-CD1 3.94Å; F859-L870 HydrophobicContact CZ-CD1 4.49Å; V868-L870 PolarHBondContact O-N 3.26Å; L870-M938 HydrophobicContact CD1-CE 3.68Å; L870-M938 HydrophobicContact CD2-CE 3.18Å; L870-M938 HydrophobicContact CG-CE 4.04Å
871	Y	87.4	Confident	84.6	Confident	9 Å²	9	50.8 Å²	50.8	4%	0.035	27%	0.271	C	S	.	.	S	Bend	trans	-112.5	129.7	177.8	-56.1	-50.1	0	0	0	109.5	M855 V953 S956 F957 L960	M855-Y871 HydrophobicContact CE-CE2 4.42Å; M855-Y871 WeakPolarHBondContact CE-OH 3.49Å; Y871-V953 HydrophobicContact CD1-CG1 4.02Å; Y871-V953 HydrophobicContact CE1-CG1 4.1Å; Y871-S956 PolarHBondContact OH-OG 3.44Å; Y871-F957 HydrophobicContact CD1-CD2 4.03Å; Y871-F957 HydrophobicContact CD2-CD2 4.36Å; Y871-F957 HydrophobicContact CE1-CB 3.82Å; Y871-F957 AromaticContact CE1-CD2 3.8Å; Y871-F957 HydrophobicContact CE1-CD2 3.8Å; Y871-F957 HydrophobicContact CE1-CG 4.24Å; Y871-F957 HydrophobicContact CE2-CD2 4.12Å; Y871-F957 HydrophobicContact CG-CD2 4.31Å; Y871-F957 AromaticContact CZ-CD2 3.83Å; Y871-F957 PolarHBondContact OH-N 3.42Å; Y871-L960 HydrophobicContact CE2-CD2 4.26Å
872	Q	79.2	Confident	84.4	Confident	106 Å²	106	51.9 Å²	51.9	50%	0.495	27%	0.272	S	S	.	.			trans	-117.3	152.9	-176.3	-63.5	-172.4	6	0	0	112.2	P869 F874 L875	P869-Q872 HydrophobicContact CB-CG 4.25Å; P869-Q872 HydrophobicContact CG-CG 3.85Å; Q872-F874 PolarHBondContact O-N 2.84Å; Q872-L875 PolarHBondContact O-N 3.5Å
873	G	79.3	Confident	84.4	Confident	28 Å²	28	48.7 Å²	48.7	29%	0.289	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	57	-119.6	168	0	0	0	0	0	114.6	L875 I876	G873-L875 VanDerWaalsContact C-N 3.32Å; G873-L875 PolarHBondContact O-N 3.06Å; G873-I876 WeakPolarHBondContact O-CG2 3.26Å
874	F	82.1	Confident	84.5	Confident	126 Å²	126	45.1 Å²	45.1	55%	0.553	24%	0.236	S	C	*	.	H	α-helix	trans	-69.3	-23.7	-173.6	-70.1	-72.8	0	0	0	114.1	Q872 G878 L997 F1000	Q872-F874 PolarHBondContact O-N 2.84Å; F874-G878 PolarHBondContact O-N 3.47Å; F874-L997 HydrophobicContact CB-CD2 3.91Å; F874-F1000 HydrophobicContact CD2-CE2 4.33Å
875	L	83.9	Confident	84.6	Confident	3 Å²	3	36.9 Å²	36.9	2%	0.016	21%	0.205	C	C	.	.	H	α-helix	trans	-63.8	-44.5	-179.9	-68.3	175.5	0	0	0	111.9	Q872 G873 Y879 V953 F957 L997 F1000 I1001	Q872-L875 PolarHBondContact O-N 3.5Å; G873-L875 VanDerWaalsContact C-N 3.32Å; G873-L875 PolarHBondContact O-N 3.06Å; L875-Y879 WeakPolarHBondContact O-CB 3.34Å; L875-Y879 PolarHBondContact O-N 3.41Å; L875-V953 HydrophobicContact CD1-CG1 4Å; L875-F957 HydrophobicContact CB-CE2 4.23Å; L875-F957 HydrophobicContact CB-CZ 4.15Å; L875-F957 HydrophobicContact CD2-CD1 4.15Å; L875-F957 HydrophobicContact CD2-CE1 3.76Å; L875-F957 HydrophobicContact CD2-CZ 4.06Å; L875-F957 WeakPolarHBondContact O-CZ 3.2Å; L875-L997 HydrophobicContact CD2-CD1 3.97Å; L875-F1000 HydrophobicContact CD1-CB 4.08Å; L875-F1000 HydrophobicContact CG-CB 4.36Å; L875-I1001 HydrophobicContact CD2-CD1 3.96Å; L875-I1001 HydrophobicContact CD2-CG1 4.44Å
876	I	81.9	Confident	84.6	Confident	25 Å²	25	38.5 Å²	38.5	13%	0.128	21%	0.213	C	C	.	.	H	α-helix	trans	-76.1	-35.8	-177.9	-161.5	130.7	0	0	0	112.6	H341 I852 G873 S880	H341-I876 WeakPolarHBondContact NE2-CD1 3.39Å; I852-I876 HydrophobicContact CG2-CD1 4.3Å; G873-I876 WeakPolarHBondContact O-CG2 3.26Å; I876-S880 PolarHBondContact O-N 3.29Å; I876-S880 PolarHBondContact O-OG 3.02Å
877	I	81.3	Confident	84.9	Confident	39 Å²	39	36.9 Å²	36.9	20%	0.2	20%	0.199	C	C	.	.	H	α-helix	trans	-61.5	-56	171.1	-64.6	171.8	0	0	0	108.4	T104 Y879 S880 T881	T104-I877 HydrophobicContact CG2-CD1 3.76Å; T104-I877 HydrophobicContact CG2-CG1 4.28Å; I877-Y879 VanDerWaalsContact C-N 3.32Å; I877-Y879 PolarHBondContact O-N 2.98Å; I877-S880 PolarHBondContact O-N 3.39Å; I877-S880 VanDerWaalsContact O-N 3.15Å; I877-S880 PolarHBondContact O-OG 3.5Å; I877-S880 VanDerWaalsContact O-OG 3.14Å; I877-T881 HydrophobicContact CG2-CG2 4.49Å; I877-T881 PolarHBondContact O-N 3.02Å; I877-T881 PolarHBondContact O-OG1 2.93Å
878	G	83.6	Confident	85.1	Confident	5 Å²	5	36 Å²	36	5%	0.052	19%	0.193	C	C	.	.	H	α-helix	trans	-57.4	-40.8	-177.3	0	0	0	0	0	113	F874 S880 I882 Y883	F874-G878 PolarHBondContact O-N 3.47Å; G878-S880 PolarHBondContact O-N 2.82Å; G878-I882 CarbonylContact O-C 3.44Å; G878-I882 WeakPolarHBondContact O-CA 3.27Å; G878-I882 WeakPolarHBondContact O-CB 3.4Å; G878-I882 PolarHBondContact O-N 3.05Å; G878-Y883 WeakPolarHBondContact O-CD2 3.38Å; G878-Y883 PolarHBondContact O-N 3.41Å
879	Y	86.1	Confident	85.3	Confident	4 Å²	4	34.4 Å²	34.4	2%	0.016	18%	0.18	C	C	.	.	I	π-helix	trans	-58	-49.9	175.9	177.2	-92.8	0	0	0	112.8	R848 I852 L875 I877 T884 F957 L960 I961 E964	R848-Y879 HydrophobicContact CB-CE1 4.42Å; R848-Y879 WeakPolarHBondContact CB-OH 3.47Å; R848-Y879 PolarHBondContact O-OH 2.87Å; I852-Y879 HydrophobicContact CD1-CD1 3.15Å; I852-Y879 HydrophobicContact CD1-CD2 4.2Å; I852-Y879 HydrophobicContact CD1-CE1 3.12Å; I852-Y879 HydrophobicContact CD1-CE2 4.18Å; I852-Y879 HydrophobicContact CD1-CG 3.7Å; I852-Y879 HydrophobicContact CG1-CD1 4.38Å; I852-Y879 HydrophobicContact CG1-CE1 3.93Å; L875-Y879 WeakPolarHBondContact O-CB 3.34Å; L875-Y879 PolarHBondContact O-N 3.41Å; I877-Y879 VanDerWaalsContact C-N 3.32Å; I877-Y879 PolarHBondContact O-N 2.98Å; Y879-T884 HydrophobicContact CD2-CG2 3.84Å; Y879-T884 HydrophobicContact CE1-CG2 4.45Å; Y879-T884 HydrophobicContact CE2-CG2 3.48Å; Y879-T884 VanDerWaalsContact CE2-CG2 3.48Å; Y879-T884 HydrophobicContact CG-CG2 4.48Å; Y879-T884 PolarHBondContact O-N 3.46Å; Y879-T884 PolarHBondContact O-OG1 3.42Å; Y879-F957 HydrophobicContact CD2-CE2 4.34Å; Y879-L960 HydrophobicContact CD2-CD2 4.05Å; Y879-L960 HydrophobicContact CE2-CD1 4.44Å; Y879-L960 HydrophobicContact CE2-CD2 3.55Å; Y879-L960 HydrophobicContact CE2-CG 3.69Å; Y879-I961 HydrophobicContact CD2-CG1 4.2Å; Y879-I961 HydrophobicContact CE2-CG1 4.48Å; Y879-E964 WeakPolarHBondContact OH-CG 3.48Å
880	S	78.4	Confident	85.4	Confident	34 Å²	34	33.5 Å²	33.5	24%	0.238	17%	0.174	C	C	.	.	I	π-helix	trans	-79.5	-29.1	-171.4	64.4	0	0	0	0	113.7	R848 I876 I877 G878	R848-S880 PolarHBondContact NH1-O 3.45Å; R848-S880 PolarHBondContact NH2-O 3.19Å; I876-S880 PolarHBondContact O-N 3.29Å; I876-S880 PolarHBondContact O-OG 3.02Å; I877-S880 PolarHBondContact O-N 3.39Å; I877-S880 VanDerWaalsContact O-N 3.15Å; I877-S880 PolarHBondContact O-OG 3.5Å; I877-S880 VanDerWaalsContact O-OG 3.14Å; G878-S880 PolarHBondContact O-N 2.82Å
881	T	81	Confident	85.5	Confident	61 Å²	61	33.5 Å²	33.5	37%	0.374	17%	0.174	S	C	.	.	I	π-helix	trans	-105.3	-30.7	-174.5	61.5	0	0	0	0	114.4	I877 M885	I877-T881 HydrophobicContact CG2-CG2 4.49Å; I877-T881 PolarHBondContact O-N 3.02Å; I877-T881 PolarHBondContact O-OG1 2.93Å; T881-M885 WeakPolarHBondContact O-CB 3.28Å
882	I	84.9	Confident	85.8	Confident	75 Å²	75	33.1 Å²	33.1	39%	0.385	17%	0.173	S	C	.	.	I	π-helix	trans	-115.1	-66.4	-173.2	-57	174.9	0	0	0	110.7	G878 T884 M885 C989	G878-I882 CarbonylContact O-C 3.44Å; G878-I882 WeakPolarHBondContact O-CA 3.27Å; G878-I882 WeakPolarHBondContact O-CB 3.4Å; G878-I882 PolarHBondContact O-N 3.05Å; I882-T884 VanDerWaalsContact C-N 3.3Å; I882-T884 PolarHBondContact O-N 2.9Å; I882-M885 PolarHBondContact O-N 3.27Å; I882-C989 HydrophobicContact CG2-CB 3.99Å
883	Y	88.8	Confident	86.3	Confident	11 Å²	11	29.7 Å²	29.7	4%	0.043	16%	0.158	C	C	.	.	I	π-helix	trans	-69.9	-19.8	-164.3	-50.6	-45.2	0	0	0	115.4	G878 F957 I961 S986 Y990 S993 L997	G878-Y883 WeakPolarHBondContact O-CD2 3.38Å; G878-Y883 PolarHBondContact O-N 3.41Å; Y883-F957 HydrophobicContact CD2-CE1 4.2Å; Y883-F957 AromaticContact CD2-CZ 3.98Å; Y883-F957 HydrophobicContact CD2-CZ 3.98Å; Y883-F957 HydrophobicContact CE2-CE1 4Å; Y883-F957 AromaticContact CE2-CZ 3.94Å; Y883-F957 HydrophobicContact CE2-CZ 3.94Å; Y883-I961 HydrophobicContact CD2-CD1 3.84Å; Y883-I961 HydrophobicContact CG-CD1 4.09Å; Y883-S986 PolarHBondContact O-OG 2.9Å; Y883-Y990 HydrophobicContact CD1-CD2 4.41Å; Y883-Y990 HydrophobicContact CE1-CD2 4.37Å; Y883-S993 WeakPolarHBondContact CE1-OG 3.11Å; Y883-S993 VanDerWaalsContact CZ-OG 3.29Å; Y883-S993 WeakPolarHBondContact OH-CB 3.37Å; Y883-S993 PolarHBondContact OH-OG 3.28Å; Y883-L997 WeakPolarHBondContact OH-CD1 3.48Å
884	T	88.9	Confident	86.8	Confident	2 Å²	2	29.4 Å²	29.4	1%	0.012	15%	0.15	C	C	.	.	T	Hydrogen-bonded Turn	trans	-123.6	3.1	178.1	66.1	0	0	0	0	112.9	R848 Y879 I882 V888 E964	R848-T884 PolarHBondContact NH1-O 3.36Å; R848-T884 PolarHBondContact NH1-OG1 3.29Å; Y879-T884 HydrophobicContact CD2-CG2 3.84Å; Y879-T884 HydrophobicContact CE1-CG2 4.45Å; Y879-T884 HydrophobicContact CE2-CG2 3.48Å; Y879-T884 VanDerWaalsContact CE2-CG2 3.48Å; Y879-T884 HydrophobicContact CG-CG2 4.48Å; Y879-T884 PolarHBondContact O-N 3.46Å; Y879-T884 PolarHBondContact O-OG1 3.42Å; I882-T884 VanDerWaalsContact C-N 3.3Å; I882-T884 PolarHBondContact O-N 2.9Å; T884-V888 WeakPolarHBondContact O-CB 3.5Å; T884-V888 WeakPolarHBondContact O-CG2 3.32Å; T884-E964 HydrophobicContact CG2-CB 4.31Å
885	M	87.5	Confident	87	Confident	38 Å²	38	28.4 Å²	28.4	19%	0.187	15%	0.145	C	C	.	.	H	α-helix	trans	-75.1	-55.2	-175.9	-174.2	-74.5	-146.2	0	0	111.6	M353 T881 I882 V888 F889	M353-M885 HydrophobicContact CE-CE 3.88Å; M353-M885 HydrophobicContact SD-CE 4.32Å; T881-M885 WeakPolarHBondContact O-CB 3.28Å; I882-M885 PolarHBondContact O-N 3.27Å; M885-V888 PolarHBondContact O-N 3.03Å; M885-F889 WeakPolarHBondContact O-CB 3.36Å; M885-F889 PolarHBondContact O-N 3.3Å; M885-F889 HydrophobicContact SD-CB 4.07Å
886	F	90	Very high	87	Confident	83 Å²	83	29.3 Å²	29.3	36%	0.364	15%	0.15	S	C	.	.	H	α-helix	trans	-59.4	-46.7	-175.2	-62	-72.4	0	0	0	114	F889 S890 L985	F886-F889 PolarHBondContact O-N 3.25Å; F886-S890 WeakPolarHBondContact O-CB 3.41Å; F886-S890 PolarHBondContact O-N 3.44Å; F886-L985 HydrophobicContact CD1-CD2 4.39Å; F886-L985 HydrophobicContact CD2-CD2 4.09Å; F886-L985 HydrophobicContact CD2-CG 4.45Å; F886-L985 HydrophobicContact CE1-CD2 4.33Å; F886-L985 HydrophobicContact CE2-CD2 4.02Å; F886-L985 HydrophobicContact CG-CD2 4.27Å; F886-L985 HydrophobicContact CZ-CD2 4.15Å
887	P	89.6	Confident	87.3	Confident	2 Å²	2	28.5 Å²	28.5	1%	0.013	15%	0.146	C	C	.	.	H	α-helix	trans	-64.6	-46	-179.9	-19.8	32.5	0	0	0	112	S890 L965 V968 E983 S986	P887-S890 WeakPolarHBondContact O-CB 3.46Å; P887-S890 PolarHBondContact O-N 3.46Å; P887-S890 PolarHBondContact O-OG 2.97Å; P887-L965 HydrophobicContact CB-CD2 3.97Å; P887-L965 HydrophobicContact CG-CD2 3.36Å; P887-V968 HydrophobicContact CB-CG1 4.29Å; P887-V968 HydrophobicContact CB-CG2 4.46Å; P887-E983 HydrophobicContact CB-CG 4.16Å; P887-S986 WeakPolarHBondContact CD-OG 3.29Å; P887-S986 WeakPolarHBondContact CG-OG 3.28Å
888	V	89.6	Confident	87.7	Confident	2 Å²	2	34.1 Å²	34.1	1%	0.012	17%	0.169	C	C	.	.	H	α-helix	trans	-66	-43.3	179.8	173.7	0	0	0	0	110.7	L841 F844 V845 T884 M885 S890 L891 V968	L841-V888 HydrophobicContact CD1-CG1 3.73Å; L841-V888 VanDerWaalsContact CD1-O 3.23Å; L841-V888 WeakPolarHBondContact CD1-O 3.47Å; F844-V888 HydrophobicContact CB-CG1 4.09Å; V845-V888 HydrophobicContact CG2-CG1 3.61Å; T884-V888 WeakPolarHBondContact O-CB 3.5Å; T884-V888 WeakPolarHBondContact O-CG2 3.32Å; M885-V888 PolarHBondContact O-N 3.03Å; V888-S890 PolarHBondContact O-N 2.98Å; V888-L891 VanDerWaalsContact O-CB 3.28Å; V888-L891 WeakPolarHBondContact O-CB 3.47Å; V888-L891 VanDerWaalsContact O-CG 3.3Å; V888-L891 WeakPolarHBondContact O-CG 3.37Å; V888-L891 PolarHBondContact O-N 3.34Å; V888-V968 HydrophobicContact CG2-CG2 4.12Å
889	F	91.4	Very high	87.9	Confident	38 Å²	38	35.1 Å²	35.1	17%	0.167	18%	0.175	C	C	.	.	H	α-helix	trans	-65.3	-29.5	176.4	-171.5	-107.7	0	0	0	112.3	M353 V357 M885 F886 L891 V892	M353-F889 HydrophobicContact CB-CD2 4.45Å; M353-F889 HydrophobicContact CB-CE2 3.45Å; M353-F889 VanDerWaalsContact CB-CE2 3.45Å; M353-F889 HydrophobicContact CB-CZ 3.71Å; M353-F889 HydrophobicContact CE-CE1 4.3Å; M353-F889 HydrophobicContact CE-CE2 4.32Å; M353-F889 HydrophobicContact CE-CZ 4.07Å; V357-F889 HydrophobicContact CG2-CE1 4.27Å; V357-F889 HydrophobicContact CG2-CZ 3.87Å; M885-F889 WeakPolarHBondContact O-CB 3.36Å; M885-F889 PolarHBondContact O-N 3.3Å; M885-F889 HydrophobicContact SD-CB 4.07Å; F886-F889 PolarHBondContact O-N 3.25Å; F889-L891 PolarHBondContact O-N 2.89Å; F889-L891 VanDerWaalsContact O-N 3.09Å; F889-V892 HydrophobicContact CD2-CG2 4.17Å; F889-V892 HydrophobicContact CE2-CG2 4Å; F889-V892 HydrophobicContact CZ-CG2 4.4Å; F889-V892 VanDerWaalsContact O-CB 3.29Å; F889-V892 WeakPolarHBondContact O-CB 3.38Å; F889-V892 WeakPolarHBondContact O-CG2 3.31Å; F889-V892 PolarHBondContact O-N 3.29Å; F889-V892 VanDerWaalsContact O-N 3.09Å
890	S	91.4	Very high	88.1	Confident	8 Å²	8	39.7 Å²	39.7	6%	0.056	20%	0.197	C	C	.	.	H	α-helix	trans	-61.3	-19.1	177.1	86.4	0	0	0	0	113.7	F886 P887 V888 V892 L893	F886-S890 WeakPolarHBondContact O-CB 3.41Å; F886-S890 PolarHBondContact O-N 3.44Å; P887-S890 WeakPolarHBondContact O-CB 3.46Å; P887-S890 PolarHBondContact O-N 3.46Å; P887-S890 PolarHBondContact O-OG 2.97Å; V888-S890 PolarHBondContact O-N 2.98Å; S890-V892 PolarHBondContact O-N 2.96Å; S890-V892 VanDerWaalsContact O-N 3.1Å; S890-L893 WeakPolarHBondContact O-CB 3.42Å; S890-L893 PolarHBondContact O-N 3.46Å
891	L	90.3	Very high	88.7	Confident	4 Å²	4	39.6 Å²	39.6	2%	0.021	20%	0.195	C	C	.	.	G	3₁₀ helix	trans	-59.8	-19.4	173.6	-64.6	175.6	0	0	0	113.4	F844 V888 F889 L893 D894 V968 V972 M979	F844-L891 HydrophobicContact CB-CD1 4.02Å; F844-L891 HydrophobicContact CD1-CD1 4.5Å; F844-L891 HydrophobicContact CD2-CD1 3.38Å; F844-L891 HydrophobicContact CE2-CD1 3.94Å; F844-L891 HydrophobicContact CG-CD1 3.71Å; V888-L891 VanDerWaalsContact O-CB 3.28Å; V888-L891 WeakPolarHBondContact O-CB 3.47Å; V888-L891 VanDerWaalsContact O-CG 3.3Å; V888-L891 WeakPolarHBondContact O-CG 3.37Å; V888-L891 PolarHBondContact O-N 3.34Å; F889-L891 PolarHBondContact O-N 2.89Å; F889-L891 VanDerWaalsContact O-N 3.09Å; L891-L893 PolarHBondContact O-N 3.01Å; L891-L893 VanDerWaalsContact O-N 3.14Å; L891-D894 WeakPolarHBondContact O-CB 3.41Å; L891-D894 PolarHBondContact O-N 3.45Å; L891-D894 VanDerWaalsContact O-N 3.12Å; L891-V968 HydrophobicContact CD2-CG1 4.3Å; L891-V972 HydrophobicContact CD2-CG2 4.2Å; L891-M979 HydrophobicContact CD2-CE 4.44Å
892	V	92.2	Very high	89.2	Confident	2 Å²	2	36.9 Å²	36.9	1%	0.012	18%	0.178	C	C	.	.	G	3₁₀ helix	trans	-59.2	-19.8	170.1	174.1	0	0	0	0	111.7	V357 F358 R837 L841 F889 S890	V357-V892 HydrophobicContact CB-CG1 3.74Å; V357-V892 HydrophobicContact CG1-CG1 3.47Å; V357-V892 VanDerWaalsContact CG1-CG1 3.47Å; V357-V892 HydrophobicContact CG2-CG1 4.43Å; F358-V892 HydrophobicContact CD1-CG1 4.04Å; F358-V892 HydrophobicContact CE1-CB 4.24Å; F358-V892 HydrophobicContact CE1-CG1 3.41Å; F358-V892 VanDerWaalsContact CE1-CG1 3.41Å; F358-V892 HydrophobicContact CZ-CB 4.46Å; F358-V892 HydrophobicContact CZ-CG1 3.91Å; F358-V892 HydrophobicContact CZ-CG2 4.35Å; R837-V892 VanDerWaalsContact CD-O 3.24Å; R837-V892 WeakPolarHBondContact CD-O 3.38Å; R837-V892 VanDerWaalsContact CZ-O 3.27Å; R837-V892 PolarHBondContact NE-O 3.3Å; R837-V892 PolarHBondContact NH1-O 2.87Å; R837-V892 VanDerWaalsContact NH1-O 3.09Å; L841-V892 HydrophobicContact CD2-CG2 3.87Å; F889-V892 HydrophobicContact CD2-CG2 4.17Å; F889-V892 HydrophobicContact CE2-CG2 4Å; F889-V892 HydrophobicContact CZ-CG2 4.4Å; F889-V892 VanDerWaalsContact O-CB 3.29Å; F889-V892 WeakPolarHBondContact O-CB 3.38Å; F889-V892 WeakPolarHBondContact O-CG2 3.31Å; F889-V892 PolarHBondContact O-N 3.29Å; F889-V892 VanDerWaalsContact O-N 3.09Å; S890-V892 PolarHBondContact O-N 2.96Å; S890-V892 VanDerWaalsContact O-N 3.1Å
893	L	90.6	Very high	89.5	Confident	33 Å²	33	35.8 Å²	35.8	17%	0.173	17%	0.172	C	C	.	.	G	3₁₀ helix	trans	-94.1	-14.5	178.4	-61	168.7	0	0	0	113.9	M361 R837 S890 L891 H976 L978 M979	M361-L893 HydrophobicContact CE-CD2 3.34Å; R837-L893 PolarHBondContact NH2-O 3.48Å; R837-L893 VanDerWaalsContact NH2-O 3.07Å; S890-L893 WeakPolarHBondContact O-CB 3.42Å; S890-L893 PolarHBondContact O-N 3.46Å; L891-L893 PolarHBondContact O-N 3.01Å; L891-L893 VanDerWaalsContact O-N 3.14Å; L893-H976 HydrophobicContact CB-CB 4.44Å; L893-L978 HydrophobicContact CD1-CB 3.6Å; L893-L978 HydrophobicContact CD1-CD1 3.78Å; L893-L978 HydrophobicContact CD1-CG 4.34Å; L893-M979 HydrophobicContact CB-CG 4.4Å; L893-M979 HydrophobicContact CB-SD 4.37Å; L893-M979 HydrophobicContact CD1-CG 4.37Å
894	D	89.4	Confident	89.7	Confident	23 Å²	23	41 Å²	41	12%	0.123	20%	0.2	C	C	.	.			trans	-62.3	144.8	-172.9	-171.3	35	0	0	0	112	R837 L891 Q973 T974 M979	R837-D894 PolarHBondContact NE-O 3.48Å; R837-D894 PolarHBondContact NH2-O 3.35Å; L891-D894 WeakPolarHBondContact O-CB 3.41Å; L891-D894 PolarHBondContact O-N 3.45Å; L891-D894 VanDerWaalsContact O-N 3.12Å; D894-Q973 PolarHBondContact OD1-N 3.34Å; D894-Q973 VanDerWaalsContact OD1-N 3.1Å; D894-T974 PolarHBondContact OD1-N 3.47Å; D894-M979 HydrophobicContact CB-CE 4.46Å
895	K	85.5	Confident	89.8	Confident	105 Å²	105	45 Å²	45	46%	0.457	22%	0.216	S	C	.	.			trans	-133.3	123.5	178.9	-66.4	177.7	-175.8	175.4	0	108.4	T974	K895-T974 PolarHBondContact N-OG1 2.82Å; K895-T974 VanDerWaalsContact N-OG1 3.16Å; K895-T974 WeakPolarHBondContact O-CG2 3.14Å; K895-T974 PolarHBondContact O-OG1 2.94Å; K895-T974 VanDerWaalsContact O-OG1 3.06Å
896	D	84.5	Confident	90	Very high	22 Å²	22	43.5 Å²	43.5	12%	0.118	21%	0.209	C	C	.	.	S	Bend	trans	-84.3	-28.3	175.3	64.6	-29.2	0	0	0	112.6	R832 K836 Q973 Y1041	R832-D896 IonicContact CZ-OD1 2.86Å; R832-D896 IonicContact CZ-OD2 2.66Å; R832-D896 IonicContact NH1-OD1 3.6Å; R832-D896 PolarHBondContact NH1-OD1 3.45Å; R832-D896 IonicContact NH1-OD2 3.54Å; R832-D896 PolarHBondContact NH1-OD2 3.43Å; R832-D896 IonicContact NH2-OD1 3.92Å; R832-D896 PolarHBondContact NH2-OD1 2.99Å; R832-D896 IonicContact NH2-OD2 2.82Å; R832-D896 PolarHBondContact NH2-OD2 2.87Å; K836-D896 WeakPolarHBondContact CD-OD2 3.42Å; K836-D896 IonicContact NZ-OD2 2.72Å; K836-D896 PolarHBondContact NZ-OD2 3.19Å; D896-Q973 VanDerWaalsContact CA-OE1 3.31Å; D896-Y1041 HydrophobicContact CB-CE2 4.34Å
897	V	87.8	Confident	90	Very high	7 Å²	7	44.2 Å²	44.2	4%	0.042	21%	0.213	C	C	.	.	S	Bend	trans	-138.7	153.5	174.5	-62.7	0	0	0	0	111.4	A902 L908 Y1041	V897-A902 HydrophobicContact CG2-CB 4.08Å; V897-L908 HydrophobicContact CG1-CD1 4.37Å; V897-L908 HydrophobicContact CG2-CD1 4.49Å; V897-Y1041 HydrophobicContact CG1-CD2 4.3Å; V897-Y1041 HydrophobicContact CG1-CG 4.48Å
898	K	89.3	Confident	90	Very high	158 Å²	158	44.6 Å²	44.6	69%	0.687	22%	0.215	S	C	*	.			trans	-67.4	156.3	171.8	-65.6	-177.3	-178.4	176.1	0	110.8	E900 V901 A902	K898-E900 VanDerWaalsContact C-N 3.26Å; K898-E900 PolarHBondContact O-N 3.49Å; K898-V901 HydrophobicContact CB-CG2 4.29Å; K898-V901 PolarHBondContact O-N 3.16Å; K898-A902 PolarHBondContact O-N 2.91Å; K898-A902 VanDerWaalsContact O-N 3.17Å
899	S	89.7	Confident	90.2	Very high	26 Å²	26	44.5 Å²	44.5	18%	0.182	21%	0.214	C	C	.	.	H	α-helix	trans	-66.8	-29.2	-174	84	0	0	0	0	113.2	R825 M903	R825-S899 PolarHBondContact NH1-OG 3.4Å; R825-S899 VanDerWaalsContact NH1-OG 3.08Å; S899-M903 WeakPolarHBondContact O-CG 3.22Å; S899-M903 PolarHBondContact O-N 3.43Å
900	E	90.3	Very high	90.1	Very high	100 Å²	100	48.6 Å²	48.6	47%	0.467	23%	0.232	S	C	.	.	H	α-helix	trans	-69.7	-44	178.2	-62.1	65.3	-139.7	0	0	110.5	K367 K898 A902 M903 L904	K367-E900 IonicContact NZ-OE1 3.9Å; K367-E900 PolarHBondContact NZ-OE1 2.9Å; K898-E900 VanDerWaalsContact C-N 3.26Å; K898-E900 PolarHBondContact O-N 3.49Å; E900-A902 VanDerWaalsContact C-N 3.33Å; E900-A902 PolarHBondContact O-N 3.18Å; E900-M903 PolarHBondContact O-N 2.99Å; E900-L904 PolarHBondContact O-N 2.93Å
901	V	90.8	Very high	89.8	Confident	32 Å²	32	50.8 Å²	50.8	19%	0.194	24%	0.243	C	C	.	.	H	α-helix	trans	-65.6	-38.2	178.3	-178.6	0	0	0	0	110.9	K898 M903 L904 Y905	K898-V901 HydrophobicContact CB-CG2 4.29Å; K898-V901 PolarHBondContact O-N 3.16Å; V901-M903 VanDerWaalsContact C-N 3.29Å; V901-M903 PolarHBondContact O-N 3.45Å; V901-L904 PolarHBondContact O-N 2.94Å; V901-Y905 HydrophobicContact CG1-CD2 3.88Å; V901-Y905 HydrophobicContact CG1-CE2 4.4Å; V901-Y905 PolarHBondContact O-N 3.28Å
902	A	90.2	Very high	89.7	Confident	3 Å²	3	50.7 Å²	50.7	3%	0.025	24%	0.243	C	C	.	.	H	α-helix	trans	-65.4	-30.3	176.4	0	0	0	0	0	113.2	V829 V897 K898 E900	V829-A902 HydrophobicContact CG2-CB 4.25Å; V897-A902 HydrophobicContact CG2-CB 4.08Å; K898-A902 PolarHBondContact O-N 2.91Å; K898-A902 VanDerWaalsContact O-N 3.17Å; E900-A902 VanDerWaalsContact C-N 3.33Å; E900-A902 PolarHBondContact O-N 3.18Å
903	M	92.4	Very high	89.5	Confident	53 Å²	53	52.5 Å²	52.5	26%	0.261	25%	0.252	S	S	.	.	H	α-helix	trans	-79.6	-34	174.4	-69.8	-64.1	-63.2	0	0	112.3	I664 R825 M828 V829 S899 E900 V901	I664-M903 HydrophobicContact CD1-CE 4.02Å; R825-M903 HydrophobicContact CB-SD 4.12Å; M828-M903 HydrophobicContact CB-SD 4Å; M828-M903 HydrophobicContact CG-SD 4.5Å; V829-M903 HydrophobicContact CG2-CG 4.08Å; V829-M903 HydrophobicContact CG2-SD 4.12Å; S899-M903 WeakPolarHBondContact O-CG 3.22Å; S899-M903 PolarHBondContact O-N 3.43Å; E900-M903 PolarHBondContact O-N 2.99Å; V901-M903 VanDerWaalsContact C-N 3.29Å; V901-M903 PolarHBondContact O-N 3.45Å
904	L	91.7	Very high	89.1	Confident	120 Å²	120	57.9 Å²	57.9	63%	0.628	27%	0.274	S	S	*	.	H	α-helix	trans	-72.4	-36.2	179	-173.4	64.3	0	0	0	112.5	E900 V901 P906	E900-L904 PolarHBondContact O-N 2.93Å; V901-L904 PolarHBondContact O-N 2.94Å; L904-P906 VanDerWaalsContact C-CD 3.44Å; L904-P906 VanDerWaalsContact O-CD 3.24Å; L904-P906 WeakPolarHBondContact O-CD 3.26Å
905	Y	91.5	Very high	88.7	Confident	86 Å²	86	57.1 Å²	57.1	34%	0.337	27%	0.272	S	S	.	.			trans	-118.6	74.3	-178.5	-61.1	-72.2	0	0	0	111.9	V901 E907 L908 L1044	V901-Y905 HydrophobicContact CG1-CD2 3.88Å; V901-Y905 HydrophobicContact CG1-CE2 4.4Å; V901-Y905 PolarHBondContact O-N 3.28Å; Y905-E907 WeakPolarHBondContact CA-OE2 3.37Å; Y905-E907 PolarHBondContact O-N 3.26Å; Y905-E907 VanDerWaalsContact O-N 3.16Å; Y905-L908 WeakPolarHBondContact O-CB 3.41Å; Y905-L908 WeakPolarHBondContact O-CG 3.44Å; Y905-L908 PolarHBondContact O-N 3.23Å; Y905-L1044 HydrophobicContact CD1-CD2 4.01Å; Y905-L1044 HydrophobicContact CD2-CB 4.39Å; Y905-L1044 HydrophobicContact CD2-CD1 4.06Å; Y905-L1044 HydrophobicContact CD2-CD2 4.21Å; Y905-L1044 HydrophobicContact CD2-CG 4.46Å; Y905-L1044 HydrophobicContact CE1-CD2 3.98Å; Y905-L1044 HydrophobicContact CE2-CB 4.41Å; Y905-L1044 HydrophobicContact CE2-CD2 4.17Å; Y905-L1044 HydrophobicContact CG-CD1 3.92Å; Y905-L1044 HydrophobicContact CG-CD2 4.11Å
906	P	91.6	Very high	88.4	Confident	7 Å²	7	58.1 Å²	58.1	5%	0.045	27%	0.272	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-17	-179.9	25.5	-33.8	0	0	0	113.7	I664 N667 A668 M828 L904 L908 Y909	I664-P906 HydrophobicContact CG2-CB 3.96Å; I664-P906 HydrophobicContact CG2-CG 4.41Å; I664-P906 WeakPolarHBondContact O-CB 3.39Å; N667-P906 HydrophobicContact CB-CB 4.37Å; N667-P906 HydrophobicContact CB-CG 3.6Å; A668-P906 WeakPolarHBondContact CA-O 3.02Å; A668-P906 HydrophobicContact CB-CB 4.07Å; M828-P906 HydrophobicContact SD-CB 3.98Å; L904-P906 VanDerWaalsContact C-CD 3.44Å; L904-P906 VanDerWaalsContact O-CD 3.24Å; L904-P906 WeakPolarHBondContact O-CD 3.26Å; P906-L908 PolarHBondContact O-N 3.18Å; P906-Y909 WeakPolarHBondContact O-CB 3.28Å; P906-Y909 PolarHBondContact O-N 2.99Å
907	E	90.4	Very high	88.3	Confident	98 Å²	98	58.6 Å²	58.6	46%	0.458	28%	0.277	S	S	.	.	H	α-helix	trans	-59.7	-22.4	176.1	-56.2	85.4	175.6	0	0	112.5	Y905 Y909 K910	Y905-E907 WeakPolarHBondContact CA-OE2 3.37Å; Y905-E907 PolarHBondContact O-N 3.26Å; Y905-E907 VanDerWaalsContact O-N 3.16Å; E907-Y909 PolarHBondContact O-N 2.95Å; E907-K910 VanDerWaalsContact O-CB 3.24Å; E907-K910 WeakPolarHBondContact O-CB 3.4Å; E907-K910 PolarHBondContact O-N 3.49Å
908	L	90.4	Very high	88.2	Confident	9 Å²	9	58.9 Å²	58.9	5%	0.047	28%	0.278	C	S	.	.	H	α-helix	trans	-59.9	-24.4	172.7	-69.1	177.4	0	0	0	113.1	V897 Y905 P906 L1044	V897-L908 HydrophobicContact CG1-CD1 4.37Å; V897-L908 HydrophobicContact CG2-CD1 4.49Å; Y905-L908 WeakPolarHBondContact O-CB 3.41Å; Y905-L908 WeakPolarHBondContact O-CG 3.44Å; Y905-L908 PolarHBondContact O-N 3.23Å; P906-L908 PolarHBondContact O-N 3.18Å; L908-L1044 HydrophobicContact CD1-CD1 3.94Å; L908-L1044 HydrophobicContact CD2-CD1 3.82Å; L908-L1044 HydrophobicContact CG-CD1 3.96Å
909	Y	92.3	Very high	88.1	Confident	1 Å²	1	53.1 Å²	53.1	0%	0.004	26%	0.258	C	S	.	.	H	α-helix	trans	-74.8	-37.2	174.3	-170.4	-86.5	0	0	0	111.6	L382 G383 R384 I385 A668 I670 L827 M828 R832 P906 E907 D911 L912 L913	L382-Y909 WeakPolarHBondContact O-CE2 3.46Å; L382-Y909 PolarHBondContact O-OH 3.44Å; G383-Y909 VanDerWaalsContact C-CZ 3.5Å; G383-Y909 VanDerWaalsContact C-OH 3.23Å; R384-Y909 PolarHBondContact N-OH 3.05Å; R384-Y909 VanDerWaalsContact N-OH 3.16Å; I385-Y909 PolarHBondContact N-OH 2.84Å; A668-Y909 HydrophobicContact CB-CD1 4.03Å; A668-Y909 HydrophobicContact CB-CG 4.17Å; I670-Y909 HydrophobicContact CD1-CD1 4.34Å; I670-Y909 HydrophobicContact CD1-CE1 3.86Å; I670-Y909 HydrophobicContact CG1-CD1 4.37Å; I670-Y909 HydrophobicContact CG1-CE1 3.98Å; L827-Y909 HydrophobicContact CB-CE2 4.43Å; M828-Y909 HydrophobicContact CE-CD1 4.26Å; M828-Y909 HydrophobicContact CE-CD2 3.8Å; M828-Y909 HydrophobicContact CE-CE2 4.19Å; M828-Y909 HydrophobicContact CE-CG 3.84Å; M828-Y909 HydrophobicContact SD-CD2 4.01Å; M828-Y909 HydrophobicContact SD-CG 3.98Å; R832-Y909 HydrophobicContact CB-CD2 4.45Å; P906-Y909 WeakPolarHBondContact O-CB 3.28Å; P906-Y909 PolarHBondContact O-N 2.99Å; E907-Y909 PolarHBondContact O-N 2.95Å; Y909-D911 PolarHBondContact O-N 3.23Å; Y909-D911 VanDerWaalsContact O-N 3.14Å; Y909-L912 HydrophobicContact CD2-CD1 4.38Å; Y909-L912 VanDerWaalsContact O-CB 3.26Å; Y909-L912 WeakPolarHBondContact O-CB 3.1Å; Y909-L912 PolarHBondContact O-N 3.14Å; Y909-L913 HydrophobicContact CD1-CD2 4.31Å; Y909-L913 HydrophobicContact CE1-CD2 3.81Å
910	K	89.2	Confident	88	Confident	123 Å²	123	57.9 Å²	57.9	54%	0.535	28%	0.275	S	S	.	.	H	α-helix	trans	-57.1	-32.8	179.9	-166.9	175.4	-178.9	173.3	0	112.7	A668 E907 L912 L913	A668-K910 WeakPolarHBondContact O-CA 3.22Å; A668-K910 WeakPolarHBondContact O-CB 3.42Å; A668-K910 PolarHBondContact O-N 2.77Å; E907-K910 VanDerWaalsContact O-CB 3.24Å; E907-K910 WeakPolarHBondContact O-CB 3.4Å; E907-K910 PolarHBondContact O-N 3.49Å; K910-L912 PolarHBondContact O-N 3.27Å; K910-L913 PolarHBondContact O-N 2.95Å
911	D	85.9	Confident	87.9	Confident	54 Å²	54	60.6 Å²	60.6	29%	0.289	29%	0.286	S	S	.	.	H	α-helix	trans	-64.7	-25.8	175.8	-88.9	-25.3	0	0	0	113.5	Y909 R916 S1040	Y909-D911 PolarHBondContact O-N 3.23Å; Y909-D911 VanDerWaalsContact O-N 3.14Å; D911-R916 IonicContact OD1-NH1 3.84Å; D911-R916 PolarHBondContact OD1-NH1 3.39Å; D911-S1040 PolarHBondContact OD2-OG 3.27Å
912	L	88.6	Confident	87.8	Confident	3 Å²	3	60.8 Å²	60.8	2%	0.016	29%	0.287	C	S	.	.	H	α-helix	trans	-81.3	-28.7	-178.2	-56.8	175.1	0	0	0	113	G383 R832 Y835 K836 Y909 K910 K914 G915 P917	G383-L912 WeakPolarHBondContact O-CB 3.49Å; R832-L912 HydrophobicContact CB-CD1 3.75Å; R832-L912 HydrophobicContact CG-CD1 3.67Å; Y835-L912 HydrophobicContact CD1-CB 4.29Å; Y835-L912 HydrophobicContact CD1-CD2 3.93Å; Y835-L912 HydrophobicContact CD1-CG 4.5Å; Y835-L912 HydrophobicContact CE1-CB 4.45Å; Y835-L912 HydrophobicContact CE1-CD2 4.2Å; K836-L912 HydrophobicContact CD-CD2 4.34Å; K836-L912 HydrophobicContact CG-CD2 3.95Å; Y909-L912 HydrophobicContact CD2-CD1 4.38Å; Y909-L912 VanDerWaalsContact O-CB 3.26Å; Y909-L912 WeakPolarHBondContact O-CB 3.1Å; Y909-L912 PolarHBondContact O-N 3.14Å; K910-L912 PolarHBondContact O-N 3.27Å; L912-K914 PolarHBondContact O-N 3.36Å; L912-K914 VanDerWaalsContact O-N 3.09Å; L912-G915 PolarHBondContact O-N 3.43Å; L912-P917 HydrophobicContact CD2-CG 4.19Å
913	L	87.1	Confident	87.8	Confident	39 Å²	39	61.6 Å²	61.6	20%	0.204	29%	0.29	C	S	.	.	H	α-helix	trans	-54.1	-34.3	-179.4	-62.4	179.3	0	0	0	111.9	I385 Y909 K910 G915	I385-L913 VanDerWaalsContact O-CD2 3.26Å; I385-L913 WeakPolarHBondContact O-CD2 3.21Å; Y909-L913 HydrophobicContact CD1-CD2 4.31Å; Y909-L913 HydrophobicContact CE1-CD2 3.81Å; K910-L913 PolarHBondContact O-N 2.95Å; L913-G915 PolarHBondContact O-N 3.39Å
914	K	82.4	Confident	87.8	Confident	147 Å²	147	63.9 Å²	63.9	64%	0.639	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.1	-4	178.2	-65.5	-177	-179.8	-178.9	0	114.6	L912 R916	L912-K914 PolarHBondContact O-N 3.36Å; L912-K914 VanDerWaalsContact O-N 3.09Å; K914-R916 HydrophobicContact CB-CG 4.02Å; K914-R916 PolarHBondContact O-N 3.2Å
915	G	81.3	Confident	87.8	Confident	7 Å²	7	61 Å²	61	7%	0.072	29%	0.287	C	S	.	.	T	Hydrogen-bonded Turn	trans	65.1	21.1	-179.6	0	0	0	0	0	114.7	Y835 L912 L913 P917 L918 S919	Y835-G915 VanDerWaalsContact OH-CA 3.31Å; Y835-G915 WeakPolarHBondContact OH-CA 3.4Å; L912-G915 PolarHBondContact O-N 3.43Å; L913-G915 PolarHBondContact O-N 3.39Å; G915-P917 VanDerWaalsContact C-CD 3.41Å; G915-L918 PolarHBondContact O-N 3.16Å; G915-S919 PolarHBondContact O-N 2.91Å
916	R	80.1	Confident	87.8	Confident	125 Å²	125	58.6 Å²	58.6	47%	0.472	28%	0.278	S	S	.	.	G	3₁₀ helix	trans	-54.6	-39.6	-174.5	-71.8	173.9	172.4	170	-4.2	114.7	D911 K914 L918 S919	D911-R916 IonicContact OD1-NH1 3.84Å; D911-R916 PolarHBondContact OD1-NH1 3.39Å; K914-R916 HydrophobicContact CB-CG 4.02Å; K914-R916 PolarHBondContact O-N 3.2Å; R916-L918 VanDerWaalsContact C-N 3.32Å; R916-L918 PolarHBondContact O-N 3.34Å; R916-S919 WeakPolarHBondContact O-CB 3.42Å; R916-S919 PolarHBondContact O-N 3.1Å; R916-S919 PolarHBondContact O-OG 3.37Å
917	P	82	Confident	87.8	Confident	33 Å²	33	59.5 Å²	59.5	21%	0.214	28%	0.283	C	S	.	.	G	3₁₀ helix	trans	-56.1	-42.9	-179.7	-29.1	38.3	0	0	0	113.5	Y835 A839 Q843 L912 G915 T922	Y835-P917 HydrophobicContact CD1-CG 4.38Å; Y835-P917 HydrophobicContact CE1-CB 4.15Å; Y835-P917 HydrophobicContact CE1-CG 3.67Å; A839-P917 HydrophobicContact CB-CB 3.67Å; Q843-P917 PolarHBondContact NE2-O 2.69Å; L912-P917 HydrophobicContact CD2-CG 4.19Å; G915-P917 VanDerWaalsContact C-CD 3.41Å; P917-T922 PolarHBondContact O-OG1 2.7Å
918	L	84.8	Confident	88	Confident	13 Å²	13	59.8 Å²	59.8	7%	0.068	29%	0.287	C	S	.	.	G	3₁₀ helix	trans	-105.9	37.3	179.8	-159.8	76.1	0	0	0	112.5	F296 E299 V300 L303 A839 Q843 G915 R916	F296-L918 HydrophobicContact CD2-CD2 4.05Å; F296-L918 HydrophobicContact CE2-CD1 4.45Å; F296-L918 HydrophobicContact CE2-CD2 3.7Å; F296-L918 HydrophobicContact CE2-CG 4.45Å; F296-L918 HydrophobicContact CZ-CD2 4.22Å; E299-L918 HydrophobicContact CB-CD2 3.92Å; V300-L918 HydrophobicContact CG2-CD2 3.98Å; L303-L918 HydrophobicContact CD1-CD1 3.96Å; L303-L918 HydrophobicContact CD1-CD2 4.14Å; L303-L918 HydrophobicContact CD1-CG 3.92Å; A839-L918 HydrophobicContact CB-CB 4.45Å; Q843-L918 HydrophobicContact CG-CD1 4.37Å; G915-L918 PolarHBondContact O-N 3.16Å; R916-L918 VanDerWaalsContact C-N 3.32Å; R916-L918 PolarHBondContact O-N 3.34Å
919	S	87.8	Confident	88.1	Confident	36 Å²	36	60.7 Å²	60.7	25%	0.252	29%	0.292	S	S	.	.			trans	-75.4	158.5	176.7	71.8	0	0	0	0	113.1	G915 R916 K921 T922 F923	G915-S919 PolarHBondContact O-N 2.91Å; R916-S919 WeakPolarHBondContact O-CB 3.42Å; R916-S919 PolarHBondContact O-N 3.1Å; R916-S919 PolarHBondContact O-OG 3.37Å; S919-K921 PolarHBondContact O-N 2.94Å; S919-T922 PolarHBondContact N-OG1 3.18Å; S919-T922 VanDerWaalsContact N-OG1 3.09Å; S919-T922 PolarHBondContact O-N 2.85Å; S919-T922 VanDerWaalsContact O-N 3.17Å; S919-T922 PolarHBondContact O-OG1 3.38Å; S919-T922 PolarHBondContact OG-N 2.99Å; S919-T922 VanDerWaalsContact OG-N 3.16Å; S919-T922 PolarHBondContact OG-OG1 2.87Å; S919-F923 WeakPolarHBondContact O-CB 3.49Å; S919-F923 PolarHBondContact O-N 3.07Å
920	F	87	Confident	88.3	Confident	127 Å²	127	60.7 Å²	60.7	56%	0.557	29%	0.292	S	S	*	.	H	α-helix	trans	-56.5	-32.7	171.1	-69.2	-63.2	0	0	0	113.1	L303 I306 L924	L303-F920 HydrophobicContact CD2-CD1 4.14Å; L303-F920 HydrophobicContact CD2-CE1 3.97Å; I306-F920 HydrophobicContact CD1-CD1 4.1Å; I306-F920 HydrophobicContact CD1-CE1 3.36Å; I306-F920 HydrophobicContact CD1-CZ 4.21Å; F920-L924 WeakPolarHBondContact O-CB 3.27Å; F920-L924 PolarHBondContact O-N 2.76Å
921	K	89.4	Confident	88.5	Confident	156 Å²	156	58.4 Å²	58.4	68%	0.678	29%	0.285	S	S	*	.	H	α-helix	trans	-66	-47.7	176.9	-176.8	177	-178.2	173.2	0	111.7	S919 L924 I925	S919-K921 PolarHBondContact O-N 2.94Å; K921-L924 PolarHBondContact O-N 2.85Å; K921-I925 HydrophobicContact CG-CD1 4.27Å; K921-I925 VanDerWaalsContact O-CG1 3.3Å; K921-I925 WeakPolarHBondContact O-CG1 3.48Å; K921-I925 PolarHBondContact O-N 3.44Å; K921-I925 VanDerWaalsContact O-N 3.11Å
922	T	88.9	Confident	89	Confident	37 Å²	37	59.6 Å²	59.6	23%	0.227	29%	0.286	C	S	.	.	H	α-helix	trans	-67.1	-40.4	178.5	45.1	0	0	0	0	110.8	Q843 P917 S919 I925 W926	Q843-T922 PolarHBondContact NE2-OG1 3.49Å; P917-T922 PolarHBondContact O-OG1 2.7Å; S919-T922 PolarHBondContact N-OG1 3.18Å; S919-T922 VanDerWaalsContact N-OG1 3.09Å; S919-T922 PolarHBondContact O-N 2.85Å; S919-T922 VanDerWaalsContact O-N 3.17Å; S919-T922 PolarHBondContact O-OG1 3.38Å; S919-T922 PolarHBondContact OG-N 2.99Å; S919-T922 VanDerWaalsContact OG-N 3.16Å; S919-T922 PolarHBondContact OG-OG1 2.87Å; T922-I925 PolarHBondContact O-N 3.33Å; T922-W926 PolarHBondContact O-N 3.41Å; T922-W926 VanDerWaalsContact O-N 3.11Å
923	F	90.1	Very high	89.3	Confident	20 Å²	20	59.4 Å²	59.4	9%	0.088	29%	0.285	C	S	.	.	H	α-helix	trans	-55.5	-52.7	171.8	173.4	-102.4	0	0	0	112.2	L303 I306 L307 I846 S919 I925 W926 V927	L303-F923 HydrophobicContact CD1-CD2 4.24Å; L303-F923 HydrophobicContact CD2-CB 4.29Å; L303-F923 HydrophobicContact CD2-CD1 4.19Å; L303-F923 HydrophobicContact CD2-CD2 3.99Å; L303-F923 HydrophobicContact CD2-CE2 4.35Å; L303-F923 HydrophobicContact CD2-CG 3.89Å; I306-F923 HydrophobicContact CG2-CE1 4.34Å; L307-F923 HydrophobicContact CD1-CE2 4.4Å; L307-F923 HydrophobicContact CD2-CE2 4.11Å; L307-F923 HydrophobicContact CD2-CZ 3.71Å; L307-F923 HydrophobicContact CG-CE2 4.25Å; L307-F923 HydrophobicContact CG-CZ 3.97Å; I846-F923 HydrophobicContact CD1-CE2 4.44Å; I846-F923 HydrophobicContact CG2-CE2 4.13Å; S919-F923 WeakPolarHBondContact O-CB 3.49Å; S919-F923 PolarHBondContact O-N 3.07Å; F923-I925 VanDerWaalsContact C-N 3.32Å; F923-I925 PolarHBondContact O-N 2.83Å; F923-W926 WeakPolarHBondContact O-CB 3.33Å; F923-W926 PolarHBondContact O-N 3.47Å; F923-V927 HydrophobicContact CD1-CG2 4.22Å; F923-V927 HydrophobicContact CD2-CG2 4.43Å; F923-V927 HydrophobicContact CE1-CG2 3.83Å; F923-V927 HydrophobicContact CE2-CG2 4.07Å; F923-V927 HydrophobicContact CZ-CG2 3.75Å; F923-V927 WeakPolarHBondContact O-CG2 3.09Å; F923-V927 PolarHBondContact O-N 3.35Å
924	L	91.6	Very high	89.6	Confident	101 Å²	101	57.6 Å²	57.6	53%	0.529	28%	0.275	S	S	.	.	H	α-helix	trans	-61	-38.9	-179.2	-172.7	70.3	0	0	0	112.6	F920 K921 W926 V927 L928	F920-L924 WeakPolarHBondContact O-CB 3.27Å; F920-L924 PolarHBondContact O-N 2.76Å; K921-L924 PolarHBondContact O-N 2.85Å; L924-W926 VanDerWaalsContact C-N 3.32Å; L924-W926 PolarHBondContact O-N 3.46Å; L924-V927 PolarHBondContact O-N 2.7Å; L924-L928 HydrophobicContact CG-CD1 4.48Å; L924-L928 WeakPolarHBondContact O-CG 3.34Å; L924-L928 PolarHBondContact O-N 3.05Å
925	I	91.3	Very high	90.2	Very high	59 Å²	59	52.5 Å²	52.5	30%	0.303	26%	0.258	S	S	.	.	H	α-helix	trans	-58.6	-46.8	174.2	-69.9	165.5	0	0	0	110.2	K921 T922 F923 L928 I929	K921-I925 HydrophobicContact CG-CD1 4.27Å; K921-I925 VanDerWaalsContact O-CG1 3.3Å; K921-I925 WeakPolarHBondContact O-CG1 3.48Å; K921-I925 PolarHBondContact O-N 3.44Å; K921-I925 VanDerWaalsContact O-N 3.11Å; T922-I925 PolarHBondContact O-N 3.33Å; F923-I925 VanDerWaalsContact C-N 3.32Å; F923-I925 PolarHBondContact O-N 2.83Å; I925-L928 PolarHBondContact O-N 3.31Å; I925-I929 HydrophobicContact CG2-CD1 3.88Å; I925-I929 HydrophobicContact CG2-CG1 4.48Å; I925-I929 VanDerWaalsContact O-CG1 3.25Å; I925-I929 WeakPolarHBondContact O-CG1 3.39Å; I925-I929 PolarHBondContact O-N 2.95Å
926	W	92	Very high	90.9	Very high	35 Å²	35	54.3 Å²	54.3	13%	0.133	27%	0.266	C	S	.	.	H	α-helix	trans	-64.8	-37.5	177.3	-80.9	111.1	0	0	0	113.1	Q843 F844 H847 T922 F923 L924 L928 I929 S930 M967	Q843-W926 HydrophobicContact CB-CD2 4.46Å; Q843-W926 HydrophobicContact CB-CG 4.26Å; Q843-W926 VanDerWaalsContact CD-CD1 3.49Å; F844-W926 HydrophobicContact CD1-CH2 4.49Å; F844-W926 HydrophobicContact CD2-CH2 4.32Å; F844-W926 AromaticContact CE1-CH2 3.93Å; F844-W926 HydrophobicContact CE1-CH2 3.93Å; F844-W926 HydrophobicContact CE1-CZ3 4.28Å; F844-W926 AromaticContact CE2-CH2 3.73Å; F844-W926 HydrophobicContact CE2-CH2 3.73Å; F844-W926 HydrophobicContact CE2-CZ2 4.02Å; F844-W926 AromaticContact CZ-CH2 3.51Å; F844-W926 HydrophobicContact CZ-CH2 3.51Å; F844-W926 HydrophobicContact CZ-CZ2 4.25Å; F844-W926 HydrophobicContact CZ-CZ3 4.3Å; H847-W926 HydrophobicContact CB-CE3 3.96Å; H847-W926 HydrophobicContact CB-CZ3 4.36Å; H847-W926 AromaticContact CG-CE3 3.83Å; H847-W926 AromaticContact CG-CZ3 3.99Å; H847-W926 AromaticContact ND1-CE3 3.86Å; T922-W926 PolarHBondContact O-N 3.41Å; T922-W926 VanDerWaalsContact O-N 3.11Å; F923-W926 WeakPolarHBondContact O-CB 3.33Å; F923-W926 PolarHBondContact O-N 3.47Å; L924-W926 VanDerWaalsContact C-N 3.32Å; L924-W926 PolarHBondContact O-N 3.46Å; W926-L928 VanDerWaalsContact C-N 3.35Å; W926-I929 HydrophobicContact CE3-CD1 4.27Å; W926-I929 HydrophobicContact CE3-CG2 4.48Å; W926-I929 PolarHBondContact O-N 2.57Å; W926-S930 PolarHBondContact O-N 3.4Å; W926-S930 PolarHBondContact O-OG 2.78Å; W926-M967 HydrophobicContact CH2-CE 3.63Å; W926-M967 HydrophobicContact CZ3-CE 3.57Å
927	V	92.4	Very high	91.5	Very high	27 Å²	27	48.4 Å²	48.4	16%	0.164	24%	0.243	C	C	.	.	H	α-helix	trans	-60.2	-45.5	173.1	176	0	0	0	0	110.9	L850 F923 L924 I929 S930 I931	L850-V927 HydrophobicContact CD1-CB 4.3Å; L850-V927 HydrophobicContact CD1-CG1 4.36Å; L850-V927 HydrophobicContact CD1-CG2 3.75Å; F923-V927 HydrophobicContact CD1-CG2 4.22Å; F923-V927 HydrophobicContact CD2-CG2 4.43Å; F923-V927 HydrophobicContact CE1-CG2 3.83Å; F923-V927 HydrophobicContact CE2-CG2 4.07Å; F923-V927 HydrophobicContact CZ-CG2 3.75Å; F923-V927 WeakPolarHBondContact O-CG2 3.09Å; F923-V927 PolarHBondContact O-N 3.35Å; L924-V927 PolarHBondContact O-N 2.7Å; V927-I929 VanDerWaalsContact C-N 3.34Å; V927-I929 PolarHBondContact O-N 3.07Å; V927-S930 WeakPolarHBondContact O-CB 3.29Å; V927-S930 PolarHBondContact O-N 2.84Å; V927-I931 HydrophobicContact CG1-CD1 3.86Å; V927-I931 HydrophobicContact CG1-CG1 4.45Å; V927-I931 WeakPolarHBondContact O-CG1 3.29Å; V927-I931 PolarHBondContact O-N 2.99Å
928	L	93.7	Very high	92.1	Very high	103 Å²	103	46.8 Å²	46.8	54%	0.539	23%	0.233	S	C	.	.	H	α-helix	trans	-64	-39.3	177.9	-69.8	170.7	0	0	0	112.2	L924 I925 W926 I931 Y932	L924-L928 HydrophobicContact CG-CD1 4.48Å; L924-L928 WeakPolarHBondContact O-CG 3.34Å; L924-L928 PolarHBondContact O-N 3.05Å; I925-L928 PolarHBondContact O-N 3.31Å; W926-L928 VanDerWaalsContact C-N 3.35Å; L928-I931 PolarHBondContact O-N 3.35Å; L928-Y932 WeakPolarHBondContact O-CB 3.48Å; L928-Y932 PolarHBondContact O-N 3.19Å
929	I	93.4	Very high	92.4	Very high	29 Å²	29	52.7 Å²	52.7	15%	0.149	26%	0.255	C	S	.	.	H	α-helix	trans	-60.7	-46.6	173.6	-67.9	169.8	0	0	0	110.2	I925 W926 V927 I931 Y932 Q933 M967 L1026	I925-I929 HydrophobicContact CG2-CD1 3.88Å; I925-I929 HydrophobicContact CG2-CG1 4.48Å; I925-I929 VanDerWaalsContact O-CG1 3.25Å; I925-I929 WeakPolarHBondContact O-CG1 3.39Å; I925-I929 PolarHBondContact O-N 2.95Å; W926-I929 HydrophobicContact CE3-CD1 4.27Å; W926-I929 HydrophobicContact CE3-CG2 4.48Å; W926-I929 PolarHBondContact O-N 2.57Å; V927-I929 VanDerWaalsContact C-N 3.34Å; V927-I929 PolarHBondContact O-N 3.07Å; I929-I931 PolarHBondContact O-N 2.96Å; I929-Y932 PolarHBondContact O-N 2.97Å; I929-Q933 WeakPolarHBondContact O-CG 3.4Å; I929-Q933 PolarHBondContact O-N 3.44Å; I929-M967 HydrophobicContact CG2-CE 4.5Å; I929-L1026 HydrophobicContact CG1-CD2 4.09Å; I929-L1026 HydrophobicContact CG2-CD1 3.71Å; I929-L1026 HydrophobicContact CG2-CD2 4.37Å
930	S	94.8	Very high	92.6	Very high	0 Å²	0	51.6 Å²	51.6	0%	0	25%	0.25	C	S	.	.	H	α-helix	trans	-59.9	-43.8	176.6	-67.7	0	0	0	0	112.9	H847 W926 V927 G934	H847-S930 VanDerWaalsContact CA-OG 3.27Å; H847-S930 WeakPolarHBondContact CA-OG 3.09Å; H847-S930 PolarHBondContact ND1-OG 3.34Å; H847-S930 PolarHBondContact O-OG 2.97Å; W926-S930 PolarHBondContact O-N 3.4Å; W926-S930 PolarHBondContact O-OG 2.78Å; V927-S930 WeakPolarHBondContact O-CB 3.29Å; V927-S930 PolarHBondContact O-N 2.84Å; S930-G934 PolarHBondContact O-N 3.48Å
931	I	94.9	Very high	92.7	Very high	76 Å²	76	45.6 Å²	45.6	39%	0.39	22%	0.224	S	C	.	.	H	α-helix	trans	-63.2	-47.6	178.9	-68.6	167.4	0	0	0	109.5	T854 V927 L928 I929 S935	T854-I931 HydrophobicContact CG2-CG2 4.33Å; V927-I931 HydrophobicContact CG1-CD1 3.86Å; V927-I931 HydrophobicContact CG1-CG1 4.45Å; V927-I931 WeakPolarHBondContact O-CG1 3.29Å; V927-I931 PolarHBondContact O-N 2.99Å; L928-I931 PolarHBondContact O-N 3.35Å; I929-I931 PolarHBondContact O-N 2.96Å; I931-S935 VanDerWaalsContact O-CB 3.26Å; I931-S935 WeakPolarHBondContact O-CB 3.13Å; I931-S935 PolarHBondContact O-N 3.48Å; I931-S935 PolarHBondContact O-OG 3.3Å; I931-S935 VanDerWaalsContact O-OG 3.04Å
932	Y	95.3	Very high	92.6	Very high	78 Å²	78	40.2 Å²	40.2	31%	0.306	20%	0.202	S	C	.	.	H	α-helix	trans	-57.3	-53.9	177.4	171.3	-99.7	0	0	0	112.1	L928 I929 S935 I936 V1021 S1022 L1026	L928-Y932 WeakPolarHBondContact O-CB 3.48Å; L928-Y932 PolarHBondContact O-N 3.19Å; I929-Y932 PolarHBondContact O-N 2.97Å; Y932-S935 PolarHBondContact O-N 3.37Å; Y932-I936 HydrophobicContact CD2-CG1 4.11Å; Y932-I936 HydrophobicContact CE1-CG1 4.32Å; Y932-I936 HydrophobicContact CE2-CD1 4.13Å; Y932-I936 HydrophobicContact CE2-CG1 3.71Å; Y932-I936 WeakPolarHBondContact O-CB 3.32Å; Y932-I936 VanDerWaalsContact O-CG1 3.29Å; Y932-I936 WeakPolarHBondContact O-CG1 3.37Å; Y932-I936 PolarHBondContact O-N 3.48Å; Y932-V1021 PolarHBondContact OH-O 3.01Å; Y932-S1022 WeakPolarHBondContact CE1-O 3.33Å; Y932-L1026 HydrophobicContact CD1-CD1 4.19Å; Y932-L1026 HydrophobicContact CD1-CD2 4.3Å; Y932-L1026 HydrophobicContact CD1-CG 4.26Å; Y932-L1026 HydrophobicContact CE1-CD1 4.42Å; Y932-L1026 HydrophobicContact CE1-CG 4.26Å
933	Q	94.6	Very high	92.5	Very high	0 Å²	0	44 Å²	44	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-66	-44.5	-176.9	-68.4	-173	-62	0	0	111.8	H847 I929 S935 I936 I937 S1022 L1026	H847-Q933 PolarHBondContact CE1-OE1 3.45Å; H847-Q933 PolarHBondContact NE2-OE1 3.3Å; I929-Q933 WeakPolarHBondContact O-CG 3.4Å; I929-Q933 PolarHBondContact O-N 3.44Å; Q933-S935 VanDerWaalsContact C-N 3.34Å; Q933-S935 PolarHBondContact O-N 3.03Å; Q933-I936 PolarHBondContact O-N 2.86Å; Q933-I937 WeakPolarHBondContact O-CB 3.18Å; Q933-I937 WeakPolarHBondContact O-CD1 3.24Å; Q933-I937 WeakPolarHBondContact O-CG1 3.49Å; Q933-I937 PolarHBondContact O-N 2.99Å; Q933-S1022 WeakPolarHBondContact CG-OG 3.49Å; Q933-S1022 PolarHBondContact NE2-O 3.05Å; Q933-L1026 VanDerWaalsContact CD-CD1 3.49Å; Q933-L1026 HydrophobicContact CG-CD1 3.65Å
934	G	94.8	Very high	92.2	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-60.9	-41.7	177.2	0	0	0	0	0	112.7	M855 S930 M938	M855-G934 VanDerWaalsContact CG-O 3.27Å; M855-G934 WeakPolarHBondContact CG-O 3.34Å; S930-G934 PolarHBondContact O-N 3.48Å; G934-M938 WeakPolarHBondContact O-CB 3.4Å; G934-M938 PolarHBondContact O-N 2.68Å; G934-M938 VanDerWaalsContact O-N 3.14Å
935	S	94.4	Very high	91.6	Very high	40 Å²	40	44.7 Å²	44.7	28%	0.28	22%	0.221	S	C	.	.	H	α-helix	trans	-66.4	-45	176	-67.8	0	0	0	0	112.6	I931 Y932 Q933 M938 Y939	I931-S935 VanDerWaalsContact O-CB 3.26Å; I931-S935 WeakPolarHBondContact O-CB 3.13Å; I931-S935 PolarHBondContact O-N 3.48Å; I931-S935 PolarHBondContact O-OG 3.3Å; I931-S935 VanDerWaalsContact O-OG 3.04Å; Y932-S935 PolarHBondContact O-N 3.37Å; Q933-S935 VanDerWaalsContact C-N 3.34Å; Q933-S935 PolarHBondContact O-N 3.03Å; S935-M938 PolarHBondContact O-N 2.82Å; S935-Y939 WeakPolarHBondContact O-CB 3.49Å; S935-Y939 PolarHBondContact O-N 2.91Å
936	I	94.8	Very high	90.4	Very high	46 Å²	46	46.4 Å²	46.4	24%	0.236	23%	0.227	C	C	.	.	H	α-helix	trans	-63.6	-42.7	179	-69.9	-65.5	0	0	0	111.5	Y932 Q933 G940 V1021	Y932-I936 HydrophobicContact CD2-CG1 4.11Å; Y932-I936 HydrophobicContact CE1-CG1 4.32Å; Y932-I936 HydrophobicContact CE2-CD1 4.13Å; Y932-I936 HydrophobicContact CE2-CG1 3.71Å; Y932-I936 WeakPolarHBondContact O-CB 3.32Å; Y932-I936 VanDerWaalsContact O-CG1 3.29Å; Y932-I936 WeakPolarHBondContact O-CG1 3.37Å; Y932-I936 PolarHBondContact O-N 3.48Å; Q933-I936 PolarHBondContact O-N 2.86Å; I936-G940 WeakPolarHBondContact O-CA 3.29Å; I936-G940 PolarHBondContact O-N 3.33Å; I936-V1021 HydrophobicContact CG2-CB 4.39Å; I936-V1021 HydrophobicContact CG2-CG1 3.95Å
937	I	94.6	Very high	89.2	Confident	0 Å²	0	50.2 Å²	50.2	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-64.1	-48.3	179.8	-64.3	162.9	0	0	0	110.5	M855 Q933 A941 L960 T963 I1018	M855-I937 HydrophobicContact CE-CB 4.21Å; M855-I937 HydrophobicContact CE-CG2 3.47Å; M855-I937 VanDerWaalsContact CE-CG2 3.47Å; M855-I937 HydrophobicContact SD-CB 4.37Å; M855-I937 HydrophobicContact SD-CG2 4.09Å; Q933-I937 WeakPolarHBondContact O-CB 3.18Å; Q933-I937 WeakPolarHBondContact O-CD1 3.24Å; Q933-I937 WeakPolarHBondContact O-CG1 3.49Å; Q933-I937 PolarHBondContact O-N 2.99Å; I937-A941 VanDerWaalsContact O-CB 3.29Å; I937-A941 WeakPolarHBondContact O-CB 3.23Å; I937-A941 PolarHBondContact O-N 2.97Å; I937-L960 HydrophobicContact CD1-CD1 4.25Å; I937-T963 HydrophobicContact CD1-CG2 4.18Å; I937-I1018 HydrophobicContact CB-CG2 4.28Å; I937-I1018 HydrophobicContact CG1-CG2 4.12Å; I937-I1018 HydrophobicContact CG2-CG2 4.31Å
938	M	93.7	Very high	88.6	Confident	0 Å²	0	53.9 Å²	53.9	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-69.2	-49.2	-178.7	179.5	52.6	63.2	0	0	112	M855 V858 F859 L870 G934 S935 G940 A941 M942	M855-M938 HydrophobicContact CB-CB 4.22Å; M855-M938 HydrophobicContact CB-CE 3.93Å; M855-M938 HydrophobicContact CE-CE 4.04Å; M855-M938 HydrophobicContact CG-CB 4.23Å; V858-M938 HydrophobicContact CB-CB 4.19Å; V858-M938 HydrophobicContact CB-CG 3.81Å; V858-M938 HydrophobicContact CG1-CB 4.09Å; V858-M938 HydrophobicContact CG1-CG 3.59Å; F859-M938 HydrophobicContact CB-CE 4Å; F859-M938 HydrophobicContact CB-CG 4.44Å; F859-M938 HydrophobicContact CB-SD 4.08Å; F859-M938 HydrophobicContact CD2-SD 4.34Å; L870-M938 HydrophobicContact CD1-CE 3.68Å; L870-M938 HydrophobicContact CD2-CE 3.18Å; L870-M938 HydrophobicContact CG-CE 4.04Å; G934-M938 WeakPolarHBondContact O-CB 3.4Å; G934-M938 PolarHBondContact O-N 2.68Å; G934-M938 VanDerWaalsContact O-N 3.14Å; S935-M938 PolarHBondContact O-N 2.82Å; M938-G940 VanDerWaalsContact C-N 3.33Å; M938-G940 PolarHBondContact O-N 3.42Å; M938-A941 PolarHBondContact O-N 3.26Å; M938-M942 WeakPolarHBondContact O-CG 3.38Å; M938-M942 PolarHBondContact O-N 3.12Å; M938-M942 HydrophobicContact SD-CG 4.12Å
939	Y	91.6	Very high	88	Confident	136 Å²	136	53.3 Å²	53.3	53%	0.533	27%	0.268	S	S	.	.	H	α-helix	trans	-63.8	-40.5	179.9	-173.9	-108.1	0	0	0	111.6	S935 M942 L943	S935-Y939 WeakPolarHBondContact O-CB 3.49Å; S935-Y939 PolarHBondContact O-N 2.91Å; Y939-M942 PolarHBondContact O-N 3.28Å; Y939-L943 HydrophobicContact CD1-CD1 3.76Å; Y939-L943 HydrophobicContact CD1-CG 4.23Å; Y939-L943 HydrophobicContact CE1-CD1 3.35Å; Y939-L943 HydrophobicContact CE1-CD2 4.4Å; Y939-L943 HydrophobicContact CE1-CG 3.92Å; Y939-L943 WeakPolarHBondContact O-CG 3.4Å; Y939-L943 PolarHBondContact O-N 3.38Å
940	G	90.8	Very high	87.4	Confident	14 Å²	14	54.6 Å²	54.6	14%	0.144	28%	0.277	C	S	.	.	H	α-helix	trans	-62.9	-42	174.2	0	0	0	0	0	112.9	I936 M938 M942 L943 L944	I936-G940 WeakPolarHBondContact O-CA 3.29Å; I936-G940 PolarHBondContact O-N 3.33Å; M938-G940 VanDerWaalsContact C-N 3.33Å; M938-G940 PolarHBondContact O-N 3.42Å; G940-M942 VanDerWaalsContact C-N 3.31Å; G940-M942 PolarHBondContact O-N 3.15Å; G940-L943 PolarHBondContact O-N 3.1Å; G940-L944 WeakPolarHBondContact O-CB 3.45Å; G940-L944 WeakPolarHBondContact O-CG 3.37Å; G940-L944 PolarHBondContact O-N 3.3Å
941	A	89.6	Confident	87	Confident	0 Å²	0	55.7 Å²	55.7	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-63.6	-36.3	174.9	0	0	0	0	0	112.3	I937 M938 F945 I952 I955 I1018	I937-A941 VanDerWaalsContact O-CB 3.29Å; I937-A941 WeakPolarHBondContact O-CB 3.23Å; I937-A941 PolarHBondContact O-N 2.97Å; M938-A941 PolarHBondContact O-N 3.26Å; A941-F945 PolarHBondContact O-N 2.87Å; A941-I952 HydrophobicContact CB-CG2 4.33Å; A941-I955 HydrophobicContact CB-CG2 4.32Å; A941-I1018 HydrophobicContact CB-CD1 4.47Å
942	M	86.4	Confident	86.5	Confident	44 Å²	44	52.1 Å²	52.1	22%	0.217	26%	0.264	C	S	.	.	H	α-helix	trans	-71.8	-35.2	175.3	-68.6	-65.5	-76.6	0	0	112.9	V862 F863 M938 Y939 G940 F945 I952	V862-M942 HydrophobicContact CB-CE 4.38Å; V862-M942 HydrophobicContact CG1-CE 3.58Å; F863-M942 HydrophobicContact CD2-CE 4.4Å; F863-M942 HydrophobicContact CE2-CE 3.42Å; F863-M942 VanDerWaalsContact CE2-CE 3.42Å; F863-M942 HydrophobicContact CE2-SD 4.02Å; F863-M942 HydrophobicContact CZ-CE 3.78Å; F863-M942 HydrophobicContact CZ-SD 4.44Å; M938-M942 WeakPolarHBondContact O-CG 3.38Å; M938-M942 PolarHBondContact O-N 3.12Å; M938-M942 HydrophobicContact SD-CG 4.12Å; Y939-M942 PolarHBondContact O-N 3.28Å; G940-M942 VanDerWaalsContact C-N 3.31Å; G940-M942 PolarHBondContact O-N 3.15Å; M942-F945 WeakPolarHBondContact O-CB 3.33Å; M942-I952 HydrophobicContact SD-CD1 3.63Å; M942-I952 HydrophobicContact SD-CG1 4.44Å; M942-I952 HydrophobicContact SD-CG2 4.34Å
943	L	86.8	Confident	86.2	Confident	115 Å²	115	48.9 Å²	48.9	60%	0.602	25%	0.252	S	S	*	.	H	α-helix	trans	-71.1	-36.8	175.8	-76.6	179.7	0	0	0	112.7	Y939 G940 F945	Y939-L943 HydrophobicContact CD1-CD1 3.76Å; Y939-L943 HydrophobicContact CD1-CG 4.23Å; Y939-L943 HydrophobicContact CE1-CD1 3.35Å; Y939-L943 HydrophobicContact CE1-CD2 4.4Å; Y939-L943 HydrophobicContact CE1-CG 3.92Å; Y939-L943 WeakPolarHBondContact O-CG 3.4Å; Y939-L943 PolarHBondContact O-N 3.38Å; G940-L943 PolarHBondContact O-N 3.1Å; L943-F945 PolarHBondContact O-N 3.49Å
944	L	84.4	Confident	85.8	Confident	49 Å²	49	48.9 Å²	48.9	26%	0.257	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.9	12.9	179.9	-59.9	-179.7	0	0	0	112.8	G940 W1013 K1014 I1018	G940-L944 WeakPolarHBondContact O-CB 3.45Å; G940-L944 WeakPolarHBondContact O-CG 3.37Å; G940-L944 PolarHBondContact O-N 3.3Å; L944-W1013 HydrophobicContact CD1-CH2 4.33Å; L944-W1013 HydrophobicContact CD1-CZ3 4.22Å; L944-W1013 HydrophobicContact CD2-CH2 3.77Å; L944-W1013 HydrophobicContact CD2-CZ3 4.28Å; L944-K1014 HydrophobicContact CB-CD 4.16Å; L944-K1014 HydrophobicContact CB-CG 4.25Å; L944-K1014 HydrophobicContact CD1-CB 4.1Å; L944-K1014 HydrophobicContact CD1-CG 4.09Å; L944-K1014 PolarHBondContact O-NZ 3.29Å; L944-I1018 HydrophobicContact CD1-CD1 4.06Å; L944-I1018 HydrophobicContact CD1-CG1 4.05Å
945	F	79.2	Confident	85.6	Confident	87 Å²	87	49 Å²	49	38%	0.382	25%	0.253	S	S	.	.			trans	-63.9	137.9	-178.9	177.8	-119.7	0	0	0	112.3	A941 M942 L943 E948 I952	A941-F945 PolarHBondContact O-N 2.87Å; M942-F945 WeakPolarHBondContact O-CB 3.33Å; L943-F945 PolarHBondContact O-N 3.49Å; F945-E948 WeakPolarHBondContact CE2-O 3.48Å; F945-I952 HydrophobicContact CD2-CD1 3.33Å; F945-I952 HydrophobicContact CD2-CG1 3.08Å; F945-I952 HydrophobicContact CE2-CD1 3.28Å; F945-I952 HydrophobicContact CE2-CG1 3.36Å; F945-I952 HydrophobicContact CG-CD1 4.07Å; F945-I952 HydrophobicContact CG-CG1 4.07Å; F945-I952 HydrophobicContact CZ-CD1 4.05Å
946	E	65.3	Low	85.5	Confident	95 Å²	95	47.1 Å²	47.1	44%	0.444	24%	0.24	S	C	.	.			trans	-125.3	160.2	166.3	-76.1	170.7	-152.1	0	0	108.4	E948 K1014	E946-E948 PolarHBondContact O-N 3.49Å; E946-K1014 VanDerWaalsContact CD-NZ 3.25Å; E946-K1014 IonicContact OE1-NZ 3.33Å; E946-K1014 PolarHBondContact OE1-NZ 3.25Å; E946-K1014 IonicContact OE2-NZ 2.98Å
947	S	67.9	Low	85.3	Confident	116 Å²	116	44.9 Å²	44.9	81%	0.811	23%	0.228	S	C	*	.	S	Bend	trans	-32	-12.8	-161.1	38.9	0	0	0	0	122.5
948	E	79.9	Confident	85.2	Confident	103 Å²	103	45.3 Å²	45.3	48%	0.481	23%	0.231	S	C	.	.			trans	-121.6	132	-176.4	-62.7	-168.8	-178.5	0	0	114.3	F945 E946 V950 H951	F945-E948 WeakPolarHBondContact CE2-O 3.48Å; E946-E948 PolarHBondContact O-N 3.49Å; E948-V950 PolarHBondContact O-N 3.43Å; E948-H951 WeakPolarHBondContact O-CB 3.21Å; E948-H951 PolarHBondContact O-N 2.86Å
949	F	80.4	Confident	85.1	Confident	92 Å²	92	45.3 Å²	45.3	40%	0.404	23%	0.231	S	C	.	.	H	α-helix	trans	-56.7	-34.2	179.4	177.8	-103	0	0	0	113.8	F859 H951 I952 V953	F859-F949 AromaticContact CE2-CE2 3.6Å; F859-F949 HydrophobicContact CE2-CE2 3.6Å; F859-F949 HydrophobicContact CE2-CZ 4.29Å; F859-F949 AromaticContact CZ-CE2 3.64Å; F859-F949 HydrophobicContact CZ-CE2 3.64Å; F859-F949 HydrophobicContact CZ-CZ 4Å; F949-H951 PolarHBondContact O-N 3.25Å; F949-I952 HydrophobicContact CD2-CD1 4.22Å; F949-I952 WeakPolarHBondContact O-CB 3.32Å; F949-I952 PolarHBondContact O-N 2.96Å; F949-V953 HydrophobicContact CD1-CG2 4.2Å; F949-V953 HydrophobicContact CE1-CG2 3.66Å; F949-V953 HydrophobicContact CZ-CG2 3.86Å; F949-V953 PolarHBondContact O-N 3.29Å
950	V	81.8	Confident	85.3	Confident	56 Å²	56	38.9 Å²	38.9	34%	0.339	21%	0.206	S	C	.	.	H	α-helix	trans	-60.3	-31.8	178.5	-177.5	0	0	0	0	111.2	E948 V953 A954 D1002	E948-V950 PolarHBondContact O-N 3.43Å; V950-V953 PolarHBondContact O-N 2.96Å; V950-A954 WeakPolarHBondContact O-CB 3.48Å; V950-A954 PolarHBondContact O-N 3.34Å; V950-D1002 HydrophobicContact CG1-CB 4.38Å
951	H	85.3	Confident	85.4	Confident	22 Å²	22	38.2 Å²	38.2	10%	0.102	20%	0.199	C	C	.	.	H	α-helix	trans	-67.9	-34.7	175.5	-60.8	162.8	0	0	0	112.7	E948 F949 A954 I955 D1002 F1005	E948-H951 WeakPolarHBondContact O-CB 3.21Å; E948-H951 PolarHBondContact O-N 2.86Å; F949-H951 PolarHBondContact O-N 3.25Å; H951-A954 PolarHBondContact O-N 3.49Å; H951-I955 WeakPolarHBondContact O-CB 3.26Å; H951-I955 VanDerWaalsContact O-CG1 3.23Å; H951-I955 WeakPolarHBondContact O-CG1 3.3Å; H951-I955 PolarHBondContact O-N 2.98Å; H951-D1002 IonicContact NE2-OD2 3.62Å; H951-F1005 HydrophobicContact CB-CD1 4.26Å; H951-F1005 HydrophobicContact CB-CE1 3.81Å; H951-F1005 HydrophobicContact CB-CZ 4.11Å; H951-F1005 AromaticContact CD2-CD1 3.54Å; H951-F1005 AromaticContact CD2-CE1 3.95Å; H951-F1005 AromaticContact CD2-CG 3.57Å; H951-F1005 AromaticContact CG-CD1 3.98Å; H951-F1005 AromaticContact CG-CE1 3.9Å; H951-F1005 AromaticContact NE2-CD2 3.88Å; H951-F1005 AromaticContact NE2-CG 3.7Å
952	I	86.1	Confident	85.5	Confident	2 Å²	2	41 Å²	41	1%	0.01	21%	0.213	C	C	.	.	H	α-helix	trans	-61.2	-51.1	173.7	-61.4	170.1	0	0	0	109	A941 M942 F945 F949 A954 I955 S956	A941-I952 HydrophobicContact CB-CG2 4.33Å; M942-I952 HydrophobicContact SD-CD1 3.63Å; M942-I952 HydrophobicContact SD-CG1 4.44Å; M942-I952 HydrophobicContact SD-CG2 4.34Å; F945-I952 HydrophobicContact CD2-CD1 3.33Å; F945-I952 HydrophobicContact CD2-CG1 3.08Å; F945-I952 HydrophobicContact CE2-CD1 3.28Å; F945-I952 HydrophobicContact CE2-CG1 3.36Å; F945-I952 HydrophobicContact CG-CD1 4.07Å; F945-I952 HydrophobicContact CG-CG1 4.07Å; F945-I952 HydrophobicContact CZ-CD1 4.05Å; F949-I952 HydrophobicContact CD2-CD1 4.22Å; F949-I952 WeakPolarHBondContact O-CB 3.32Å; F949-I952 PolarHBondContact O-N 2.96Å; I952-A954 VanDerWaalsContact C-N 3.32Å; I952-A954 PolarHBondContact O-N 3.19Å; I952-I955 PolarHBondContact O-N 3.42Å; I952-S956 VanDerWaalsContact O-CB 3.26Å; I952-S956 WeakPolarHBondContact O-CB 3.34Å; I952-S956 PolarHBondContact O-N 3.29Å; I952-S956 PolarHBondContact O-OG 2.9Å
953	V	88.1	Confident	85.9	Confident	10 Å²	10	39 Å²	39	6%	0.061	20%	0.203	C	C	.	.	H	α-helix	trans	-59.3	-44.9	-177.7	176.4	0	0	0	0	110.4	Y871 L875 F949 V950 S956 F957	Y871-V953 HydrophobicContact CD1-CG1 4.02Å; Y871-V953 HydrophobicContact CE1-CG1 4.1Å; L875-V953 HydrophobicContact CD1-CG1 4Å; F949-V953 HydrophobicContact CD1-CG2 4.2Å; F949-V953 HydrophobicContact CE1-CG2 3.66Å; F949-V953 HydrophobicContact CZ-CG2 3.86Å; F949-V953 PolarHBondContact O-N 3.29Å; V950-V953 PolarHBondContact O-N 2.96Å; V953-S956 PolarHBondContact O-OG 3.07Å; V953-F957 WeakPolarHBondContact O-CB 3.39Å; V953-F957 PolarHBondContact O-N 3.13Å
954	A	87.1	Confident	86.1	Confident	0 Å²	0	33.6 Å²	33.6	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-61.1	-54.2	176.9	0	0	0	0	0	111.8	V950 H951 I952 S956 F957 T958 I1001 F1005 F1011	V950-A954 WeakPolarHBondContact O-CB 3.48Å; V950-A954 PolarHBondContact O-N 3.34Å; H951-A954 PolarHBondContact O-N 3.49Å; I952-A954 VanDerWaalsContact C-N 3.32Å; I952-A954 PolarHBondContact O-N 3.19Å; A954-S956 PolarHBondContact O-N 3.45Å; A954-F957 PolarHBondContact O-N 3.13Å; A954-T958 WeakPolarHBondContact O-CB 3.14Å; A954-T958 PolarHBondContact O-N 3.44Å; A954-T958 PolarHBondContact O-OG1 2.89Å; A954-I1001 HydrophobicContact CB-CG2 4.08Å; A954-F1005 HydrophobicContact CB-CD1 4.49Å; A954-F1011 HydrophobicContact CB-CE2 4.25Å
955	I	89.4	Confident	86.5	Confident	2 Å²	2	32 Å²	32	1%	0.01	17%	0.167	C	C	.	.	H	α-helix	trans	-62.1	-47.4	-177.6	-65	167.5	0	0	0	110.9	A941 H951 I952 S959 F1005 F1011 K1014 V1015 I1018	A941-I955 HydrophobicContact CB-CG2 4.32Å; H951-I955 WeakPolarHBondContact O-CB 3.26Å; H951-I955 VanDerWaalsContact O-CG1 3.23Å; H951-I955 WeakPolarHBondContact O-CG1 3.3Å; H951-I955 PolarHBondContact O-N 2.98Å; I952-I955 PolarHBondContact O-N 3.42Å; I955-S959 WeakPolarHBondContact O-CB 3.41Å; I955-S959 PolarHBondContact O-N 2.9Å; I955-S959 PolarHBondContact O-OG 2.73Å; I955-F1005 HydrophobicContact CD1-CE1 4.01Å; I955-F1005 HydrophobicContact CD1-CZ 4.01Å; I955-F1005 HydrophobicContact CG1-CE1 3.88Å; I955-F1005 HydrophobicContact CG1-CZ 4.33Å; I955-F1011 HydrophobicContact CG1-CD2 3.98Å; I955-F1011 HydrophobicContact CG1-CE2 4.17Å; I955-K1014 HydrophobicContact CD1-CD 3.91Å; I955-V1015 HydrophobicContact CG2-CG2 4.21Å; I955-I1018 HydrophobicContact CG2-CD1 3.53Å
956	S	91.9	Very high	87.1	Confident	0 Å²	0	31.3 Å²	31.3	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-69.6	-38.1	-175.5	74	0	0	0	0	111.8	Y871 I952 V953 A954 L960	Y871-S956 PolarHBondContact OH-OG 3.44Å; I952-S956 VanDerWaalsContact O-CB 3.26Å; I952-S956 WeakPolarHBondContact O-CB 3.34Å; I952-S956 PolarHBondContact O-N 3.29Å; I952-S956 PolarHBondContact O-OG 2.9Å; V953-S956 PolarHBondContact O-OG 3.07Å; A954-S956 PolarHBondContact O-N 3.45Å; S956-L960 VanDerWaalsContact O-CB 3.24Å; S956-L960 WeakPolarHBondContact O-CB 3.26Å; S956-L960 PolarHBondContact O-N 3.23Å
957	F	91.6	Very high	88.3	Confident	0 Å²	0	27.6 Å²	27.6	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-72.7	-43.6	-179.6	-167.5	-110	0	0	0	112.1	Y871 L875 Y879 Y883 V953 A954 L960 I961 Y990	Y871-F957 HydrophobicContact CD1-CD2 4.03Å; Y871-F957 HydrophobicContact CD2-CD2 4.36Å; Y871-F957 HydrophobicContact CE1-CB 3.82Å; Y871-F957 AromaticContact CE1-CD2 3.8Å; Y871-F957 HydrophobicContact CE1-CD2 3.8Å; Y871-F957 HydrophobicContact CE1-CG 4.24Å; Y871-F957 HydrophobicContact CE2-CD2 4.12Å; Y871-F957 HydrophobicContact CG-CD2 4.31Å; Y871-F957 AromaticContact CZ-CD2 3.83Å; Y871-F957 PolarHBondContact OH-N 3.42Å; L875-F957 HydrophobicContact CB-CE2 4.23Å; L875-F957 HydrophobicContact CB-CZ 4.15Å; L875-F957 HydrophobicContact CD2-CD1 4.15Å; L875-F957 HydrophobicContact CD2-CE1 3.76Å; L875-F957 HydrophobicContact CD2-CZ 4.06Å; L875-F957 WeakPolarHBondContact O-CZ 3.2Å; Y879-F957 HydrophobicContact CD2-CE2 4.34Å; Y883-F957 HydrophobicContact CD2-CE1 4.2Å; Y883-F957 AromaticContact CD2-CZ 3.98Å; Y883-F957 HydrophobicContact CD2-CZ 3.98Å; Y883-F957 HydrophobicContact CE2-CE1 4Å; Y883-F957 AromaticContact CE2-CZ 3.94Å; Y883-F957 HydrophobicContact CE2-CZ 3.94Å; V953-F957 WeakPolarHBondContact O-CB 3.39Å; V953-F957 PolarHBondContact O-N 3.13Å; A954-F957 PolarHBondContact O-N 3.13Å; F957-L960 WeakPolarHBondContact O-CB 3.19Å; F957-L960 PolarHBondContact O-N 3.23Å; F957-I961 HydrophobicContact CD1-CD1 3.9Å; F957-I961 HydrophobicContact CE1-CD1 3.53Å; F957-I961 HydrophobicContact CZ-CD1 3.97Å; F957-I961 PolarHBondContact O-N 3.28Å; F957-Y990 AromaticContact CD1-CE2 3.99Å; F957-Y990 HydrophobicContact CD1-CE2 3.99Å; F957-Y990 HydrophobicContact CE1-CD2 4.49Å; F957-Y990 AromaticContact CE1-CE2 3.95Å; F957-Y990 HydrophobicContact CE1-CE2 3.95Å
958	T	91.5	Very high	89.3	Confident	9 Å²	9	22.1 Å²	22.1	6%	0.055	11%	0.111	C	C	.	.	H	α-helix	trans	-64.1	-43.4	174.7	-49.6	0	0	0	0	111.3	A954 L960 I961 L962 Y990 F1011 V1015	A954-T958 WeakPolarHBondContact O-CB 3.14Å; A954-T958 PolarHBondContact O-N 3.44Å; A954-T958 PolarHBondContact O-OG1 2.89Å; T958-L960 VanDerWaalsContact C-N 3.3Å; T958-L960 PolarHBondContact O-N 2.95Å; T958-I961 PolarHBondContact O-N 3.17Å; T958-L962 HydrophobicContact CG2-CD1 4.07Å; T958-L962 HydrophobicContact CG2-CG 4.45Å; T958-L962 WeakPolarHBondContact O-CG 3.48Å; T958-L962 PolarHBondContact O-N 3.46Å; T958-Y990 HydrophobicContact CG2-CE1 3.95Å; T958-Y990 PolarHBondContact OG1-OH 3.02Å; T958-F1011 HydrophobicContact CG2-CE1 4.32Å; T958-F1011 HydrophobicContact CG2-CZ 3.9Å; T958-F1011 WeakPolarHBondContact OG1-CZ 3.41Å; T958-V1015 HydrophobicContact CG2-CG1 3.99Å; T958-V1015 HydrophobicContact CG2-CG2 4.48Å
959	S	93.1	Very high	89.8	Confident	0 Å²	0	18.2 Å²	18.2	0%	0	10%	0.097	C	C	.	.	H	α-helix	trans	-62.1	-38.6	176.5	-60.3	0	0	0	0	111.8	I955 T963 T1019	I955-S959 WeakPolarHBondContact O-CB 3.41Å; I955-S959 PolarHBondContact O-N 2.9Å; I955-S959 PolarHBondContact O-OG 2.73Å; S959-T963 WeakPolarHBondContact O-CB 3.25Å; S959-T963 PolarHBondContact O-N 3.47Å; S959-T963 PolarHBondContact O-OG1 3.48Å; S959-T1019 WeakPolarHBondContact O-CG2 3.47Å
960	L	93.9	Very high	90.2	Very high	0 Å²	0	16.1 Å²	16.1	0%	0	9%	0.089	C	C	.	.	H	α-helix	trans	-62.5	-49.3	175.6	176.1	66.9	0	0	0	111.8	C851 I852 M855 Y871 Y879 I937 S956 F957 T958 T963 E964	C851-L960 HydrophobicContact CB-CD1 4.15Å; I852-L960 HydrophobicContact CD1-CD2 3.95Å; I852-L960 HydrophobicContact CG1-CD2 3.56Å; M855-L960 HydrophobicContact SD-CB 4.3Å; M855-L960 HydrophobicContact SD-CD1 3.88Å; M855-L960 HydrophobicContact SD-CD2 4.04Å; M855-L960 HydrophobicContact SD-CG 4.29Å; Y871-L960 HydrophobicContact CE2-CD2 4.26Å; Y879-L960 HydrophobicContact CD2-CD2 4.05Å; Y879-L960 HydrophobicContact CE2-CD1 4.44Å; Y879-L960 HydrophobicContact CE2-CD2 3.55Å; Y879-L960 HydrophobicContact CE2-CG 3.69Å; I937-L960 HydrophobicContact CD1-CD1 4.25Å; S956-L960 VanDerWaalsContact O-CB 3.24Å; S956-L960 WeakPolarHBondContact O-CB 3.26Å; S956-L960 PolarHBondContact O-N 3.23Å; F957-L960 WeakPolarHBondContact O-CB 3.19Å; F957-L960 PolarHBondContact O-N 3.23Å; T958-L960 VanDerWaalsContact C-N 3.3Å; T958-L960 PolarHBondContact O-N 2.95Å; L960-T963 PolarHBondContact O-N 2.89Å; L960-E964 HydrophobicContact CD1-CG 4.44Å; L960-E964 WeakPolarHBondContact O-CG 3.42Å; L960-E964 PolarHBondContact O-N 3.44Å
961	I	93.2	Very high	90.3	Very high	0 Å²	0	14.7 Å²	14.7	0%	0	8%	0.081	C	C	.	.	H	α-helix	trans	-62	-47.7	179.9	-68.7	171.6	0	0	0	110.8	Y879 Y883 F957 T958 T963 E964 L965 Y990	Y879-I961 HydrophobicContact CD2-CG1 4.2Å; Y879-I961 HydrophobicContact CE2-CG1 4.48Å; Y883-I961 HydrophobicContact CD2-CD1 3.84Å; Y883-I961 HydrophobicContact CG-CD1 4.09Å; F957-I961 HydrophobicContact CD1-CD1 3.9Å; F957-I961 HydrophobicContact CE1-CD1 3.53Å; F957-I961 HydrophobicContact CZ-CD1 3.97Å; F957-I961 PolarHBondContact O-N 3.28Å; T958-I961 PolarHBondContact O-N 3.17Å; I961-T963 VanDerWaalsContact C-N 3.35Å; I961-T963 PolarHBondContact O-N 3.37Å; I961-E964 PolarHBondContact O-N 2.9Å; I961-L965 HydrophobicContact CG2-CD1 4.07Å; I961-L965 HydrophobicContact CG2-CG 4.41Å; I961-L965 WeakPolarHBondContact O-CG 3.48Å; I961-L965 PolarHBondContact O-N 2.88Å; I961-Y990 HydrophobicContact CD1-CD2 3.31Å; I961-Y990 HydrophobicContact CD1-CE2 3.48Å; I961-Y990 VanDerWaalsContact CD1-CE2 3.48Å; I961-Y990 HydrophobicContact CD1-CG 3.91Å
962	L	93.3	Very high	90.4	Very high	59 Å²	59	14.2 Å²	14.2	31%	0.309	8%	0.079	S	C	.	.	H	α-helix	trans	-64.9	-37.9	179.4	-68.7	177.6	0	0	0	112.4	T958 L965 L966 L987 V1015 T1019	T958-L962 HydrophobicContact CG2-CD1 4.07Å; T958-L962 HydrophobicContact CG2-CG 4.45Å; T958-L962 WeakPolarHBondContact O-CG 3.48Å; T958-L962 PolarHBondContact O-N 3.46Å; L962-L965 PolarHBondContact O-N 3.12Å; L962-L966 VanDerWaalsContact O-CB 3.27Å; L962-L966 WeakPolarHBondContact O-CB 3.33Å; L962-L966 PolarHBondContact O-N 2.9Å; L962-L987 HydrophobicContact CD2-CD1 4.05Å; L962-V1015 HydrophobicContact CD1-CG1 3.65Å; L962-T1019 HydrophobicContact CB-CG2 3.79Å; L962-T1019 HydrophobicContact CD1-CG2 4.43Å
963	T	93.1	Very high	90.3	Very high	1 Å²	1	17.7 Å²	17.7	1%	0.006	10%	0.096	C	C	.	.	H	α-helix	trans	-60.3	-46.2	174.6	-62.2	0	0	0	0	110.7	I937 S959 L960 I961 L966 M967 S1022	I937-T963 HydrophobicContact CD1-CG2 4.18Å; S959-T963 WeakPolarHBondContact O-CB 3.25Å; S959-T963 PolarHBondContact O-N 3.47Å; S959-T963 PolarHBondContact O-OG1 3.48Å; L960-T963 PolarHBondContact O-N 2.89Å; I961-T963 VanDerWaalsContact C-N 3.35Å; I961-T963 PolarHBondContact O-N 3.37Å; T963-L966 PolarHBondContact O-N 3.28Å; T963-M967 VanDerWaalsContact O-CB 3.24Å; T963-M967 WeakPolarHBondContact O-CB 3.26Å; T963-M967 PolarHBondContact O-N 3.45Å; T963-S1022 WeakPolarHBondContact CG2-OG 3.22Å
964	E	92.3	Very high	90.3	Very high	3 Å²	3	20.1 Å²	20.1	1%	0.014	11%	0.111	C	C	.	.	H	α-helix	trans	-64.9	-44.9	179	-70.1	-67	156.4	0	0	112.1	H847 R848 Y879 T884 L960 I961 L966 M967 V968	H847-E964 IonicContact CD2-OE1 3.71Å; H847-E964 IonicContact CD2-OE2 3.55Å; H847-E964 IonicContact NE2-OE1 2.65Å; R848-E964 WeakPolarHBondContact CA-OE1 3.12Å; Y879-E964 WeakPolarHBondContact OH-CG 3.48Å; T884-E964 HydrophobicContact CG2-CB 4.31Å; L960-E964 HydrophobicContact CD1-CG 4.44Å; L960-E964 WeakPolarHBondContact O-CG 3.42Å; L960-E964 PolarHBondContact O-N 3.44Å; I961-E964 PolarHBondContact O-N 2.9Å; E964-L966 PolarHBondContact O-N 3.35Å; E964-M967 PolarHBondContact O-N 3.02Å; E964-V968 WeakPolarHBondContact O-CG2 3.07Å; E964-V968 PolarHBondContact O-N 3.22Å
965	L	92.1	Very high	90.4	Very high	16 Å²	16	26.2 Å²	26.2	8%	0.084	13%	0.134	C	C	.	.	H	α-helix	trans	-58.9	-47.7	175.8	-68.3	177.6	0	0	0	111.3	P887 I961 L962 M967 V968 A969 L987	P887-L965 HydrophobicContact CB-CD2 3.97Å; P887-L965 HydrophobicContact CG-CD2 3.36Å; I961-L965 HydrophobicContact CG2-CD1 4.07Å; I961-L965 HydrophobicContact CG2-CG 4.41Å; I961-L965 WeakPolarHBondContact O-CG 3.48Å; I961-L965 PolarHBondContact O-N 2.88Å; L962-L965 PolarHBondContact O-N 3.12Å; L965-M967 VanDerWaalsContact C-N 3.34Å; L965-M967 PolarHBondContact O-N 2.99Å; L965-V968 PolarHBondContact O-N 3.27Å; L965-A969 PolarHBondContact O-N 3.47Å; L965-L987 HydrophobicContact CD1-CB 4.36Å; L965-L987 HydrophobicContact CD1-CD1 4.35Å
966	L	91.8	Very high	90.4	Very high	72 Å²	72	29.3 Å²	29.3	38%	0.377	15%	0.148	S	C	.	.	H	α-helix	trans	-64.6	-39	178.1	-174.2	61.1	0	0	0	111.6	L962 T963 E964 V968 A969 L970 C1023	L962-L966 VanDerWaalsContact O-CB 3.27Å; L962-L966 WeakPolarHBondContact O-CB 3.33Å; L962-L966 PolarHBondContact O-N 2.9Å; T963-L966 PolarHBondContact O-N 3.28Å; E964-L966 PolarHBondContact O-N 3.35Å; L966-V968 VanDerWaalsContact C-N 3.35Å; L966-V968 PolarHBondContact O-N 3Å; L966-A969 PolarHBondContact O-N 3.31Å; L966-L970 HydrophobicContact CD1-CD1 4.34Å; L966-L970 HydrophobicContact CD1-CG 4.22Å; L966-L970 HydrophobicContact CG-CD1 3.96Å; L966-L970 HydrophobicContact CG-CG 4.28Å; L966-L970 WeakPolarHBondContact O-CB 3.38Å; L966-L970 WeakPolarHBondContact O-CG 3.43Å; L966-L970 PolarHBondContact O-N 3.27Å; L966-C1023 HydrophobicContact CD2-CB 3.77Å; L966-C1023 HydrophobicContact CG-CB 4.47Å
967	M	90.5	Very high	90.4	Very high	16 Å²	16	37.1 Å²	37.1	8%	0.079	18%	0.178	C	C	.	.	H	α-helix	trans	-66	-37.3	179.7	-171.6	57.8	-175.7	0	0	112.2	F844 W926 I929 T963 E964 L965 T971	F844-M967 HydrophobicContact CE1-CG 4Å; W926-M967 HydrophobicContact CH2-CE 3.63Å; W926-M967 HydrophobicContact CZ3-CE 3.57Å; I929-M967 HydrophobicContact CG2-CE 4.5Å; T963-M967 VanDerWaalsContact O-CB 3.24Å; T963-M967 WeakPolarHBondContact O-CB 3.26Å; T963-M967 PolarHBondContact O-N 3.45Å; E964-M967 PolarHBondContact O-N 3.02Å; L965-M967 VanDerWaalsContact C-N 3.34Å; L965-M967 PolarHBondContact O-N 2.99Å; M967-T971 WeakPolarHBondContact O-CB 3.44Å; M967-T971 PolarHBondContact O-N 3.45Å; M967-T971 PolarHBondContact O-OG1 3.15Å
968	V	90.1	Very high	90.4	Very high	1 Å²	1	40.6 Å²	40.6	1%	0.006	20%	0.196	C	C	.	.	H	α-helix	trans	-61.2	-55.7	170	172.4	0	0	0	0	109.5	F844 P887 V888 L891 E964 L965 L966 L970 T971 V972	F844-V968 HydrophobicContact CD1-CG2 4.27Å; F844-V968 HydrophobicContact CE1-CG2 4.16Å; P887-V968 HydrophobicContact CB-CG1 4.29Å; P887-V968 HydrophobicContact CB-CG2 4.46Å; V888-V968 HydrophobicContact CG2-CG2 4.12Å; L891-V968 HydrophobicContact CD2-CG1 4.3Å; E964-V968 WeakPolarHBondContact O-CG2 3.07Å; E964-V968 PolarHBondContact O-N 3.22Å; L965-V968 PolarHBondContact O-N 3.27Å; L966-V968 VanDerWaalsContact C-N 3.35Å; L966-V968 PolarHBondContact O-N 3Å; V968-L970 VanDerWaalsContact C-N 3.27Å; V968-L970 PolarHBondContact O-N 2.83Å; V968-T971 WeakPolarHBondContact O-CA 3.39Å; V968-T971 PolarHBondContact O-N 3.33Å; V968-V972 HydrophobicContact CG1-CG2 4.34Å; V968-V972 WeakPolarHBondContact O-CG2 3.46Å; V968-V972 PolarHBondContact O-N 3.15Å; V968-V972 VanDerWaalsContact O-N 3.1Å
969	A	89.9	Confident	90.4	Very high	21 Å²	21	40.1 Å²	40.1	17%	0.174	19%	0.193	C	C	.	.	H	α-helix	trans	-53.4	-40.8	-179.6	0	0	0	0	0	113.3	L965 L966 T971 W975 E983	L965-A969 PolarHBondContact O-N 3.47Å; L966-A969 PolarHBondContact O-N 3.31Å; A969-T971 PolarHBondContact O-N 2.96Å; A969-W975 HydrophobicContact CB-CH2 3.76Å; A969-W975 HydrophobicContact CB-CZ2 4Å; A969-E983 WeakPolarHBondContact CA-OE1 3.19Å; A969-E983 WeakPolarHBondContact CB-OE1 3.49Å; A969-E983 PolarHBondContact N-OE1 3Å
970	L	87.4	Confident	90.4	Very high	48 Å²	48	44 Å²	44	25%	0.251	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.8	-10.7	178.4	-67.6	176.4	0	0	0	113.7	L966 V968 Y1027 K1030	L966-L970 HydrophobicContact CD1-CD1 4.34Å; L966-L970 HydrophobicContact CD1-CG 4.22Å; L966-L970 HydrophobicContact CG-CD1 3.96Å; L966-L970 HydrophobicContact CG-CG 4.28Å; L966-L970 WeakPolarHBondContact O-CB 3.38Å; L966-L970 WeakPolarHBondContact O-CG 3.43Å; L966-L970 PolarHBondContact O-N 3.27Å; V968-L970 VanDerWaalsContact C-N 3.27Å; V968-L970 PolarHBondContact O-N 2.83Å; L970-Y1027 HydrophobicContact CB-CD2 4.49Å; L970-Y1027 HydrophobicContact CD1-CD2 4.19Å; L970-Y1027 HydrophobicContact CD2-CD2 3.7Å; L970-Y1027 HydrophobicContact CD2-CE2 3.83Å; L970-Y1027 HydrophobicContact CD2-CG 4.5Å; L970-Y1027 HydrophobicContact CG-CD2 4.34Å; L970-K1030 PolarHBondContact O-NZ 3.21Å
971	T	85.3	Confident	90.4	Very high	26 Å²	26	47.3 Å²	47.3	16%	0.16	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	-108.2	-25.5	-174.9	-51.3	0	0	0	0	114.8	F844 M967 V968 A969 Q973 K1030	F844-T971 HydrophobicContact CE2-CG2 3.58Å; F844-T971 HydrophobicContact CZ-CG2 3.58Å; M967-T971 WeakPolarHBondContact O-CB 3.44Å; M967-T971 PolarHBondContact O-N 3.45Å; M967-T971 PolarHBondContact O-OG1 3.15Å; V968-T971 WeakPolarHBondContact O-CA 3.39Å; V968-T971 PolarHBondContact O-N 3.33Å; A969-T971 PolarHBondContact O-N 2.96Å; T971-Q973 PolarHBondContact O-N 3.14Å; T971-K1030 VanDerWaalsContact CA-NZ 3.28Å; T971-K1030 PolarHBondContact OG1-NZ 3.49Å
972	V	87.3	Confident	90.3	Very high	12 Å²	12	47.7 Å²	47.7	7%	0.073	24%	0.237	C	C	.	.			trans	-52.3	135.5	168.2	178.2	0	0	0	0	110.6	L891 V968 T974 W975 M979	L891-V972 HydrophobicContact CD2-CG2 4.2Å; V968-V972 HydrophobicContact CG1-CG2 4.34Å; V968-V972 WeakPolarHBondContact O-CG2 3.46Å; V968-V972 PolarHBondContact O-N 3.15Å; V968-V972 VanDerWaalsContact O-N 3.1Å; V972-T974 VanDerWaalsContact CG1-O 3.31Å; V972-T974 WeakPolarHBondContact CG1-O 3.48Å; V972-W975 HydrophobicContact CG1-CD2 4.27Å; V972-W975 HydrophobicContact CG1-CG 4.39Å; V972-M979 HydrophobicContact CB-CE 4.07Å; V972-M979 HydrophobicContact CG1-CE 3.59Å; V972-M979 HydrophobicContact CG1-SD 4.09Å; V972-M979 HydrophobicContact CG2-CE 3.26Å
973	Q	84.3	Confident	90.3	Very high	75 Å²	75	46.5 Å²	46.5	35%	0.35	23%	0.23	S	C	.	.	S	Bend	trans	-95.7	-42.9	175.5	-58.9	-168.4	27	0	0	111.1	D894 D896 T971 Y1041	D894-Q973 PolarHBondContact OD1-N 3.34Å; D894-Q973 VanDerWaalsContact OD1-N 3.1Å; D896-Q973 VanDerWaalsContact CA-OE1 3.31Å; T971-Q973 PolarHBondContact O-N 3.14Å; Q973-Y1041 PolarHBondContact NE2-OH 3.23Å; Q973-Y1041 VanDerWaalsContact NE2-OH 3.09Å; Q973-Y1041 VanDerWaalsContact OE1-CE2 3.3Å; Q973-Y1041 PolarHBondContact OE1-OH 3.1Å
974	T	86.5	Confident	90.3	Very high	62 Å²	62	51.7 Å²	51.7	38%	0.38	26%	0.257	S	S	.	.	S	Bend	trans	-125.1	123.1	177	58.1	0	0	0	0	110.6	D894 K895 V972 H976	D894-T974 PolarHBondContact OD1-N 3.47Å; K895-T974 PolarHBondContact N-OG1 2.82Å; K895-T974 VanDerWaalsContact N-OG1 3.16Å; K895-T974 WeakPolarHBondContact O-CG2 3.14Å; K895-T974 PolarHBondContact O-OG1 2.94Å; K895-T974 VanDerWaalsContact O-OG1 3.06Å; V972-T974 VanDerWaalsContact CG1-O 3.31Å; V972-T974 WeakPolarHBondContact CG1-O 3.48Å; T974-H976 PolarHBondContact O-N 3.3Å
975	W	89.4	Confident	90.4	Very high	127 Å²	127	55 Å²	55	48%	0.481	27%	0.274	S	S	.	.			trans	-74.7	120.9	177.9	-73.4	92.9	0	0	0	111.4	A969 V972 M979 I980 E983	A969-W975 HydrophobicContact CB-CH2 3.76Å; A969-W975 HydrophobicContact CB-CZ2 4Å; V972-W975 HydrophobicContact CG1-CD2 4.27Å; V972-W975 HydrophobicContact CG1-CG 4.39Å; W975-M979 HydrophobicContact CE3-CB 4.45Å; W975-I980 HydrophobicContact CE3-CD1 4.37Å; W975-I980 HydrophobicContact CE3-CG1 3.56Å; W975-I980 HydrophobicContact CZ3-CG1 3.93Å; W975-E983 WeakPolarHBondContact CH2-OE1 3.4Å
976	H	90	Very high	90.4	Very high	68 Å²	68	54.2 Å²	54.2	32%	0.315	27%	0.27	S	S	.	.			trans	-102.7	145.5	165.7	-173.1	-84.7	0	0	0	109.3	L893 T974 L978 M979	L893-H976 HydrophobicContact CB-CB 4.44Å; T974-H976 PolarHBondContact O-N 3.3Å; H976-L978 VanDerWaalsContact C-N 3.27Å; H976-L978 PolarHBondContact ND1-N 2.84Å; H976-L978 PolarHBondContact O-N 2.99Å; H976-M979 HydrophobicContact CB-CG 4.03Å; H976-M979 HydrophobicContact CB-SD 3.93Å; H976-M979 VanDerWaalsContact O-CB 3.31Å; H976-M979 WeakPolarHBondContact O-CB 3.37Å; H976-M979 PolarHBondContact O-N 3.47Å
977	W	91.4	Very high	90.4	Very high	164 Å²	164	53.7 Å²	53.7	62%	0.621	27%	0.267	S	S	*	.	H	α-helix	trans	-56.7	-38.7	-175.2	71.8	-92	0	0	0	113.2	M979 I980 V981	W977-M979 PolarHBondContact O-N 2.85Å; W977-I980 PolarHBondContact O-N 3.05Å; W977-V981 HydrophobicContact CE3-CG2 3.86Å; W977-V981 HydrophobicContact CZ3-CG2 4.1Å; W977-V981 WeakPolarHBondContact O-CG2 3.03Å; W977-V981 PolarHBondContact O-N 3.03Å
978	L	91.3	Very high	90.5	Very high	72 Å²	72	55.5 Å²	55.5	38%	0.377	28%	0.284	S	S	.	.	H	α-helix	trans	-60.2	-27.1	174.5	-72.4	170.1	0	0	0	113.9	L893 H976 G982	L893-L978 HydrophobicContact CD1-CB 3.6Å; L893-L978 HydrophobicContact CD1-CD1 3.78Å; L893-L978 HydrophobicContact CD1-CG 4.34Å; H976-L978 VanDerWaalsContact C-N 3.27Å; H976-L978 PolarHBondContact ND1-N 2.84Å; H976-L978 PolarHBondContact O-N 2.99Å; L978-G982 PolarHBondContact O-N 3.49Å
979	M	92.3	Very high	90.5	Very high	0 Å²	0	57.2 Å²	57.2	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-73.2	-42.8	178.6	-56.7	174.6	75.8	0	0	110.3	L891 L893 D894 V972 W975 H976 W977 V981 G982 E983	L891-M979 HydrophobicContact CD2-CE 4.44Å; L893-M979 HydrophobicContact CB-CG 4.4Å; L893-M979 HydrophobicContact CB-SD 4.37Å; L893-M979 HydrophobicContact CD1-CG 4.37Å; D894-M979 HydrophobicContact CB-CE 4.46Å; V972-M979 HydrophobicContact CB-CE 4.07Å; V972-M979 HydrophobicContact CG1-CE 3.59Å; V972-M979 HydrophobicContact CG1-SD 4.09Å; V972-M979 HydrophobicContact CG2-CE 3.26Å; W975-M979 HydrophobicContact CE3-CB 4.45Å; H976-M979 HydrophobicContact CB-CG 4.03Å; H976-M979 HydrophobicContact CB-SD 3.93Å; H976-M979 VanDerWaalsContact O-CB 3.31Å; H976-M979 WeakPolarHBondContact O-CB 3.37Å; H976-M979 PolarHBondContact O-N 3.47Å; W977-M979 PolarHBondContact O-N 2.85Å; M979-V981 VanDerWaalsContact C-N 3.35Å; M979-G982 PolarHBondContact O-N 2.99Å; M979-G982 VanDerWaalsContact O-N 3.15Å; M979-E983 PolarHBondContact O-N 2.88Å
980	I	92.4	Very high	90.5	Very high	81 Å²	81	56.6 Å²	56.6	42%	0.415	29%	0.289	S	S	.	.	H	α-helix	trans	-61.3	-46.6	173.9	-55.7	171.8	0	0	0	109.8	W975 W977 G982 E983 L984	W975-I980 HydrophobicContact CE3-CD1 4.37Å; W975-I980 HydrophobicContact CE3-CG1 3.56Å; W975-I980 HydrophobicContact CZ3-CG1 3.93Å; W977-I980 PolarHBondContact O-N 3.05Å; I980-G982 VanDerWaalsContact C-N 3.28Å; I980-G982 PolarHBondContact O-N 3.5Å; I980-E983 PolarHBondContact O-N 2.91Å; I980-L984 HydrophobicContact CG2-CD1 4Å; I980-L984 HydrophobicContact CG2-CG 4.45Å; I980-L984 WeakPolarHBondContact O-CG 3.37Å; I980-L984 PolarHBondContact O-N 3.3Å
981	V	93.7	Very high	90.6	Very high	70 Å²	70	59 Å²	59	42%	0.424	30%	0.301	S	S	.	.	H	α-helix	trans	-59.9	-41	174.9	173.3	0	0	0	0	111	W977 M979 L984 L985	W977-V981 HydrophobicContact CE3-CG2 3.86Å; W977-V981 HydrophobicContact CZ3-CG2 4.1Å; W977-V981 WeakPolarHBondContact O-CG2 3.03Å; W977-V981 PolarHBondContact O-N 3.03Å; M979-V981 VanDerWaalsContact C-N 3.35Å; V981-L984 PolarHBondContact O-N 3.29Å; V981-L985 WeakPolarHBondContact O-CB 3.45Å; V981-L985 PolarHBondContact O-N 2.96Å
982	G	92.6	Very high	90.7	Very high	7 Å²	7	60 Å²	60	7%	0.072	31%	0.313	C	S	.	.	H	α-helix	trans	-60.5	-44.5	176.7	0	0	0	0	0	113.1	L978 M979 I980 S986	L978-G982 PolarHBondContact O-N 3.49Å; M979-G982 PolarHBondContact O-N 2.99Å; M979-G982 VanDerWaalsContact O-N 3.15Å; I980-G982 VanDerWaalsContact C-N 3.28Å; I980-G982 PolarHBondContact O-N 3.5Å; G982-S986 WeakPolarHBondContact O-CB 3.41Å; G982-S986 PolarHBondContact O-N 2.86Å
983	E	92.4	Very high	90.6	Very high	35 Å²	35	60.2 Å²	60.2	16%	0.164	31%	0.314	C	S	.	.	H	α-helix	trans	-64.3	-48.9	175.5	-74.9	-172.6	-168.7	0	0	112.3	P887 A969 W975 M979 I980 L985 S986 L987	P887-E983 HydrophobicContact CB-CG 4.16Å; A969-E983 WeakPolarHBondContact CA-OE1 3.19Å; A969-E983 WeakPolarHBondContact CB-OE1 3.49Å; A969-E983 PolarHBondContact N-OE1 3Å; W975-E983 WeakPolarHBondContact CH2-OE1 3.4Å; M979-E983 PolarHBondContact O-N 2.88Å; I980-E983 PolarHBondContact O-N 2.91Å; E983-L985 PolarHBondContact O-N 2.63Å; E983-S986 WeakPolarHBondContact O-CB 3.37Å; E983-S986 PolarHBondContact O-N 3.46Å; E983-L987 PolarHBondContact O-N 3.23Å
984	L	93.4	Very high	90.5	Very high	109 Å²	109	57.7 Å²	57.7	57%	0.571	30%	0.303	S	S	*	.	H	α-helix	trans	-64	-41	179.5	-68.8	175.3	0	0	0	112.1	I980 V981 L987 A988	I980-L984 HydrophobicContact CG2-CD1 4Å; I980-L984 HydrophobicContact CG2-CG 4.45Å; I980-L984 WeakPolarHBondContact O-CG 3.37Å; I980-L984 PolarHBondContact O-N 3.3Å; V981-L984 PolarHBondContact O-N 3.29Å; L984-L987 PolarHBondContact O-N 3.17Å; L984-A988 WeakPolarHBondContact O-CB 3.38Å; L984-A988 PolarHBondContact O-N 3.43Å
985	L	93.6	Very high	90.2	Very high	73 Å²	73	59.8 Å²	59.8	38%	0.382	32%	0.316	S	S	.	.	H	α-helix	trans	-64	-42.3	177	-178.5	64.5	0	0	0	110.9	F886 V981 E983 L987 A988 C989	F886-L985 HydrophobicContact CD1-CD2 4.39Å; F886-L985 HydrophobicContact CD2-CD2 4.09Å; F886-L985 HydrophobicContact CD2-CG 4.45Å; F886-L985 HydrophobicContact CE1-CD2 4.33Å; F886-L985 HydrophobicContact CE2-CD2 4.02Å; F886-L985 HydrophobicContact CG-CD2 4.27Å; F886-L985 HydrophobicContact CZ-CD2 4.15Å; V981-L985 WeakPolarHBondContact O-CB 3.45Å; V981-L985 PolarHBondContact O-N 2.96Å; E983-L985 PolarHBondContact O-N 2.63Å; L985-L987 VanDerWaalsContact C-N 3.34Å; L985-L987 PolarHBondContact O-N 3.3Å; L985-A988 PolarHBondContact O-N 3.45Å; L985-C989 WeakPolarHBondContact O-CB 3.32Å; L985-C989 PolarHBondContact O-N 3.27Å; L985-C989 PolarHBondContact O-SG 3.36Å
986	S	93.3	Very high	89.7	Confident	0 Å²	0	61.6 Å²	61.6	0%	0	33%	0.327	C	S	.	.	H	α-helix	trans	-61	-44.5	176.5	-128.9	0	0	0	0	112	Y883 P887 G982 E983 C989 Y990	Y883-S986 PolarHBondContact O-OG 2.9Å; P887-S986 WeakPolarHBondContact CD-OG 3.29Å; P887-S986 WeakPolarHBondContact CG-OG 3.28Å; G982-S986 WeakPolarHBondContact O-CB 3.41Å; G982-S986 PolarHBondContact O-N 2.86Å; E983-S986 WeakPolarHBondContact O-CB 3.37Å; E983-S986 PolarHBondContact O-N 3.46Å; S986-C989 PolarHBondContact O-N 3Å; S986-Y990 PolarHBondContact O-N 3.27Å
987	L	91.8	Very high	89.2	Confident	61 Å²	61	59.2 Å²	59.2	32%	0.319	32%	0.317	S	S	.	.	H	α-helix	trans	-64.1	-43.7	176.5	-175.1	64.8	0	0	0	111.3	L962 L965 E983 L984 L985 Y990 I991	L962-L987 HydrophobicContact CD2-CD1 4.05Å; L965-L987 HydrophobicContact CD1-CB 4.36Å; L965-L987 HydrophobicContact CD1-CD1 4.35Å; E983-L987 PolarHBondContact O-N 3.23Å; L984-L987 PolarHBondContact O-N 3.17Å; L985-L987 VanDerWaalsContact C-N 3.34Å; L985-L987 PolarHBondContact O-N 3.3Å; L987-Y990 PolarHBondContact O-N 2.84Å; L987-I991 HydrophobicContact CD1-CD1 4.43Å; L987-I991 HydrophobicContact CG-CD1 4.04Å; L987-I991 VanDerWaalsContact O-CG1 3.32Å; L987-I991 WeakPolarHBondContact O-CG1 3.37Å; L987-I991 PolarHBondContact O-N 3.42Å
988	A	91.8	Very high	88.3	Confident	53 Å²	53	57.5 Å²	57.5	44%	0.438	32%	0.316	S	S	.	.	H	α-helix	trans	-63.4	-42.9	176.7	0	0	0	0	0	112.2	L984 L985 Y990 I991 A992	L984-A988 WeakPolarHBondContact O-CB 3.38Å; L984-A988 PolarHBondContact O-N 3.43Å; L985-A988 PolarHBondContact O-N 3.45Å; A988-Y990 VanDerWaalsContact C-N 3.31Å; A988-Y990 PolarHBondContact O-N 3.15Å; A988-I991 PolarHBondContact O-N 3.34Å; A988-A992 VanDerWaalsContact O-CB 3.28Å; A988-A992 WeakPolarHBondContact O-CB 3.39Å; A988-A992 PolarHBondContact O-N 3.33Å
989	C	91.3	Very high	87.3	Confident	37 Å²	37	61.4 Å²	61.4	25%	0.25	33%	0.332	C	S	.	.	H	α-helix	trans	-61.7	-39.5	174.8	-74.1	0	0	0	0	111.8	I882 L985 S986 S993	I882-C989 HydrophobicContact CG2-CB 3.99Å; L985-C989 WeakPolarHBondContact O-CB 3.32Å; L985-C989 PolarHBondContact O-N 3.27Å; L985-C989 PolarHBondContact O-SG 3.36Å; S986-C989 PolarHBondContact O-N 3Å; C989-S993 WeakPolarHBondContact O-CB 3.28Å; C989-S993 PolarHBondContact O-N 3.46Å; C989-S993 PolarHBondContact O-OG 2.93Å
990	Y	89.9	Confident	86.5	Confident	8 Å²	8	64.2 Å²	64.2	3%	0.031	34%	0.344	C	S	.	.	H	α-helix	trans	-64.2	-51.6	174.8	174.8	-113.3	0	0	0	111.4	Y883 F957 T958 I961 S986 L987 A988 A992 S993 L994	Y883-Y990 HydrophobicContact CD1-CD2 4.41Å; Y883-Y990 HydrophobicContact CE1-CD2 4.37Å; F957-Y990 AromaticContact CD1-CE2 3.99Å; F957-Y990 HydrophobicContact CD1-CE2 3.99Å; F957-Y990 HydrophobicContact CE1-CD2 4.49Å; F957-Y990 AromaticContact CE1-CE2 3.95Å; F957-Y990 HydrophobicContact CE1-CE2 3.95Å; T958-Y990 HydrophobicContact CG2-CE1 3.95Å; T958-Y990 PolarHBondContact OG1-OH 3.02Å; I961-Y990 HydrophobicContact CD1-CD2 3.31Å; I961-Y990 HydrophobicContact CD1-CE2 3.48Å; I961-Y990 VanDerWaalsContact CD1-CE2 3.48Å; I961-Y990 HydrophobicContact CD1-CG 3.91Å; S986-Y990 PolarHBondContact O-N 3.27Å; L987-Y990 PolarHBondContact O-N 2.84Å; A988-Y990 VanDerWaalsContact C-N 3.31Å; A988-Y990 PolarHBondContact O-N 3.15Å; Y990-A992 VanDerWaalsContact C-N 3.32Å; Y990-A992 PolarHBondContact O-N 3.24Å; Y990-S993 PolarHBondContact O-N 3.22Å; Y990-S993 PolarHBondContact O-OG 2.89Å; Y990-L994 HydrophobicContact CE1-CD1 4.23Å; Y990-L994 HydrophobicContact CE2-CD2 4.05Å; Y990-L994 PolarHBondContact O-N 3.12Å
991	I	87.9	Confident	85.7	Confident	98 Å²	98	60.5 Å²	60.5	50%	0.503	33%	0.325	S	S	.	.	H	α-helix	trans	-57.6	-44.8	177.9	-66.7	166.6	0	0	0	111	L987 A988 S993 L994	L987-I991 HydrophobicContact CD1-CD1 4.43Å; L987-I991 HydrophobicContact CG-CD1 4.04Å; L987-I991 VanDerWaalsContact O-CG1 3.32Å; L987-I991 WeakPolarHBondContact O-CG1 3.37Å; L987-I991 PolarHBondContact O-N 3.42Å; A988-I991 PolarHBondContact O-N 3.34Å; I991-S993 VanDerWaalsContact C-N 3.29Å; I991-S993 PolarHBondContact O-N 2.93Å; I991-L994 WeakPolarHBondContact O-CB 3.5Å; I991-L994 PolarHBondContact O-N 2.83Å
992	A	87.8	Confident	85.1	Confident	49 Å²	49	59.6 Å²	59.6	41%	0.405	32%	0.318	S	S	.	.	H	α-helix	trans	-62.1	-37.4	177.2	0	0	0	0	0	112.1	A988 Y990 L994 V995 F996	A988-A992 VanDerWaalsContact O-CB 3.28Å; A988-A992 WeakPolarHBondContact O-CB 3.39Å; A988-A992 PolarHBondContact O-N 3.33Å; Y990-A992 VanDerWaalsContact C-N 3.32Å; Y990-A992 PolarHBondContact O-N 3.24Å; A992-L994 VanDerWaalsContact C-N 3.26Å; A992-L994 PolarHBondContact O-N 3.48Å; A992-V995 WeakPolarHBondContact O-CB 3.19Å; A992-V995 PolarHBondContact O-N 3.15Å; A992-F996 WeakPolarHBondContact O-CD2 3.35Å
993	S	86.3	Confident	84.4	Confident	15 Å²	15	62.2 Å²	62.2	11%	0.105	33%	0.332	C	S	.	.	H	α-helix	trans	-68.7	-22.5	179.1	73.9	0	0	0	0	114	Y883 C989 Y990 I991 V995 F996 L997	Y883-S993 WeakPolarHBondContact CE1-OG 3.11Å; Y883-S993 VanDerWaalsContact CZ-OG 3.29Å; Y883-S993 WeakPolarHBondContact OH-CB 3.37Å; Y883-S993 PolarHBondContact OH-OG 3.28Å; C989-S993 WeakPolarHBondContact O-CB 3.28Å; C989-S993 PolarHBondContact O-N 3.46Å; C989-S993 PolarHBondContact O-OG 2.93Å; Y990-S993 PolarHBondContact O-N 3.22Å; Y990-S993 PolarHBondContact O-OG 2.89Å; I991-S993 VanDerWaalsContact C-N 3.29Å; I991-S993 PolarHBondContact O-N 2.93Å; S993-V995 PolarHBondContact O-N 3.25Å; S993-F996 PolarHBondContact O-N 3.48Å; S993-F996 VanDerWaalsContact O-N 3.1Å; S993-L997 WeakPolarHBondContact O-CB 3.27Å; S993-L997 WeakPolarHBondContact O-CG 3.4Å; S993-L997 PolarHBondContact O-N 3.45Å
994	L	82.2	Confident	83.8	Confident	22 Å²	22	69.6 Å²	69.6	12%	0.115	36%	0.36	C	S	.	.	H	α-helix	trans	-63.2	-25	173.6	-62.3	177.1	0	0	0	112.3	Y990 I991 A992 I1001 I1006	Y990-L994 HydrophobicContact CE1-CD1 4.23Å; Y990-L994 HydrophobicContact CE2-CD2 4.05Å; Y990-L994 PolarHBondContact O-N 3.12Å; I991-L994 WeakPolarHBondContact O-CB 3.5Å; I991-L994 PolarHBondContact O-N 2.83Å; A992-L994 VanDerWaalsContact C-N 3.26Å; A992-L994 PolarHBondContact O-N 3.48Å; L994-I1001 HydrophobicContact CD2-CD1 3.71Å; L994-I1001 HydrophobicContact CD2-CG2 4.19Å; L994-I1006 HydrophobicContact CD1-CD1 4.01Å; L994-I1006 HydrophobicContact CD1-CG2 4.29Å; L994-I1006 HydrophobicContact CD2-CD1 3.74Å; L994-I1006 HydrophobicContact CG-CD1 4.47Å
995	V	79.6	Confident	83.2	Confident	107 Å²	107	65.3 Å²	65.3	65%	0.648	34%	0.337	S	S	*	.	H	α-helix	trans	-71	-35	174.8	-176.9	0	0	0	0	111.4	A992 S993	A992-V995 WeakPolarHBondContact O-CB 3.19Å; A992-V995 PolarHBondContact O-N 3.15Å; S993-V995 PolarHBondContact O-N 3.25Å
996	F	79.3	Confident	82.7	Confident	164 Å²	164	63.2 Å²	63.2	72%	0.719	33%	0.326	S	S	*	.	H	α-helix	trans	-92.1	-29.3	-175.5	-63.6	-77.3	0	0	0	113.1	A992 S993 H998	A992-F996 WeakPolarHBondContact O-CD2 3.35Å; S993-F996 PolarHBondContact O-N 3.48Å; S993-F996 VanDerWaalsContact O-N 3.1Å; F996-H998 VanDerWaalsContact C-N 3.29Å; F996-H998 PolarHBondContact O-N 3.25Å; F996-H998 PolarHBondContact O-ND1 3.24Å
997	L	78.3	Confident	82.1	Confident	18 Å²	18	68.7 Å²	68.7	9%	0.094	36%	0.359	C	S	.	.			trans	-90	31.5	-174.9	-66.4	169.4	0	0	0	114.2	F874 L875 Y883 S993 E999 F1000 I1001	F874-L997 HydrophobicContact CB-CD2 3.91Å; L875-L997 HydrophobicContact CD2-CD1 3.97Å; Y883-L997 WeakPolarHBondContact OH-CD1 3.48Å; S993-L997 WeakPolarHBondContact O-CB 3.27Å; S993-L997 WeakPolarHBondContact O-CG 3.4Å; S993-L997 PolarHBondContact O-N 3.45Å; L997-E999 PolarHBondContact O-N 2.86Å; L997-E999 VanDerWaalsContact O-N 3.11Å; L997-F1000 HydrophobicContact CB-CD2 4.46Å; L997-F1000 HydrophobicContact CD2-CD2 3.74Å; L997-F1000 HydrophobicContact CD2-CE2 4.19Å; L997-F1000 PolarHBondContact O-N 2.96Å; L997-I1001 PolarHBondContact O-N 2.6Å; L997-I1001 VanDerWaalsContact O-N 3.11Å
998	H	73.1	Confident	81.9	Confident	128 Å²	128	68.9 Å²	68.9	59%	0.593	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.1	-24.7	179.8	66.9	-74.3	0	0	0	114.1	F996 F1000	F996-H998 VanDerWaalsContact C-N 3.29Å; F996-H998 PolarHBondContact O-N 3.25Å; F996-H998 PolarHBondContact O-ND1 3.24Å; H998-F1000 VanDerWaalsContact C-N 3.32Å
999	E	71.1	Confident	81.6	Confident	154 Å²	154	72 Å²	72	72%	0.72	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.9	-21.2	174.8	-65.6	-172.6	165.2	0	0	113.7	L997	L997-E999 PolarHBondContact O-N 2.86Å; L997-E999 VanDerWaalsContact O-N 3.11Å
1000	F	74.4	Confident	81.4	Confident	60 Å²	60	71.7 Å²	71.7	26%	0.263	38%	0.375	S	S	.	.	T	Hydrogen-bonded Turn	trans	-111.4	-21.1	-173.7	-60.6	-78	0	0	0	113.6	F874 L875 L997 H998	F874-F1000 HydrophobicContact CD2-CE2 4.33Å; L875-F1000 HydrophobicContact CD1-CB 4.08Å; L875-F1000 HydrophobicContact CG-CB 4.36Å; L997-F1000 HydrophobicContact CB-CD2 4.46Å; L997-F1000 HydrophobicContact CD2-CD2 3.74Å; L997-F1000 HydrophobicContact CD2-CE2 4.19Å; L997-F1000 PolarHBondContact O-N 2.96Å; H998-F1000 VanDerWaalsContact C-N 3.32Å
1001	I	77	Confident	81.3	Confident	3 Å²	3	71.9 Å²	71.9	2%	0.015	38%	0.376	C	S	.	.	S	Bend	trans	-139.5	127.3	-173.4	-58.8	179.9	0	0	0	109	L875 A954 L994 L997 V1003 I1006	L875-I1001 HydrophobicContact CD2-CD1 3.96Å; L875-I1001 HydrophobicContact CD2-CG1 4.44Å; A954-I1001 HydrophobicContact CB-CG2 4.08Å; L994-I1001 HydrophobicContact CD2-CD1 3.71Å; L994-I1001 HydrophobicContact CD2-CG2 4.19Å; L997-I1001 PolarHBondContact O-N 2.6Å; L997-I1001 VanDerWaalsContact O-N 3.11Å; I1001-V1003 PolarHBondContact O-N 3.29Å; I1001-I1006 HydrophobicContact CG2-CD1 3.22Å; I1001-I1006 HydrophobicContact CG2-CG1 4.08Å
1002	D	79.8	Confident	81.3	Confident	51 Å²	51	72.6 Å²	72.6	27%	0.273	38%	0.38	S	S	.	.			trans	-73.8	111.3	173.4	-177.6	8.9	0	0	0	111.2	V950 H951 Y1004 F1005 I1006	V950-D1002 HydrophobicContact CG1-CB 4.38Å; H951-D1002 IonicContact NE2-OD2 3.62Å; D1002-Y1004 VanDerWaalsContact C-N 3.34Å; D1002-Y1004 PolarHBondContact OD1-N 3.28Å; D1002-F1005 HydrophobicContact CB-CB 4.07Å; D1002-F1005 WeakPolarHBondContact OD2-CB 3.41Å; D1002-I1006 PolarHBondContact O-N 3.14Å
1003	V	78.1	Confident	81.5	Confident	61 Å²	61	76.3 Å²	76.3	37%	0.37	38%	0.383	S	S	.	.	H	α-helix	trans	-68	-34.2	-178.7	-178	0	0	0	0	111.6	I1001 I1006 T1007	I1001-V1003 PolarHBondContact O-N 3.29Å; V1003-I1006 PolarHBondContact O-N 3.29Å; V1003-T1007 PolarHBondContact O-N 2.83Å
1004	Y	80.1	Confident	81.7	Confident	191 Å²	191	75.8 Å²	75.8	75%	0.749	38%	0.379	S	S	*	.	H	α-helix	trans	-67.5	-43.4	179.8	-69.9	-78.3	0	0	0	110.7	D1002 I1006 T1007 T1008	D1002-Y1004 VanDerWaalsContact C-N 3.34Å; D1002-Y1004 PolarHBondContact OD1-N 3.28Å; Y1004-I1006 PolarHBondContact O-N 3.1Å; Y1004-T1007 PolarHBondContact O-N 3.28Å; Y1004-T1007 PolarHBondContact O-OG1 3.2Å; Y1004-T1008 PolarHBondContact O-OG1 3.41Å
1005	F	81.7	Confident	82.2	Confident	18 Å²	18	74.9 Å²	74.9	8%	0.079	38%	0.375	C	S	.	.	H	α-helix	trans	-60.1	-42.6	175.7	-177.4	-116	0	0	0	113.1	H951 A954 I955 D1002 T1007 T1008 F1011	H951-F1005 HydrophobicContact CB-CD1 4.26Å; H951-F1005 HydrophobicContact CB-CE1 3.81Å; H951-F1005 HydrophobicContact CB-CZ 4.11Å; H951-F1005 AromaticContact CD2-CD1 3.54Å; H951-F1005 AromaticContact CD2-CE1 3.95Å; H951-F1005 AromaticContact CD2-CG 3.57Å; H951-F1005 AromaticContact CG-CD1 3.98Å; H951-F1005 AromaticContact CG-CE1 3.9Å; H951-F1005 AromaticContact NE2-CD2 3.88Å; H951-F1005 AromaticContact NE2-CG 3.7Å; A954-F1005 HydrophobicContact CB-CD1 4.49Å; I955-F1005 HydrophobicContact CD1-CE1 4.01Å; I955-F1005 HydrophobicContact CD1-CZ 4.01Å; I955-F1005 HydrophobicContact CG1-CE1 3.88Å; I955-F1005 HydrophobicContact CG1-CZ 4.33Å; D1002-F1005 HydrophobicContact CB-CB 4.07Å; D1002-F1005 WeakPolarHBondContact OD2-CB 3.41Å; F1005-T1007 VanDerWaalsContact C-N 3.27Å; F1005-T1007 PolarHBondContact O-N 3.1Å; F1005-T1008 VanDerWaalsContact O-CB 3.22Å; F1005-T1008 WeakPolarHBondContact O-CB 3.41Å; F1005-T1008 PolarHBondContact O-N 3.02Å; F1005-T1008 PolarHBondContact O-OG1 3.17Å; F1005-F1011 AromaticContact CD1-CD2 3.93Å; F1005-F1011 HydrophobicContact CD1-CD2 3.93Å; F1005-F1011 HydrophobicContact CE1-CB 4.33Å; F1005-F1011 AromaticContact CE1-CD2 3.66Å; F1005-F1011 HydrophobicContact CE1-CD2 3.66Å; F1005-F1011 HydrophobicContact CE1-CG 4.46Å; F1005-F1011 HydrophobicContact CZ-CB 4.39Å; F1005-F1011 HydrophobicContact CZ-CD2 4.41Å; F1005-F1011 VanDerWaalsContact O-CB 3.3Å; F1005-F1011 WeakPolarHBondContact O-CB 3.35Å
1006	I	82.4	Confident	82.8	Confident	30 Å²	30	73.3 Å²	73.3	15%	0.154	37%	0.365	C	S	.	.	H	α-helix	trans	-60.1	-35.3	179.9	-74	-173.6	0	0	0	113	L994 I1001 D1002 V1003 Y1004 T1008 F1011	L994-I1006 HydrophobicContact CD1-CD1 4.01Å; L994-I1006 HydrophobicContact CD1-CG2 4.29Å; L994-I1006 HydrophobicContact CD2-CD1 3.74Å; L994-I1006 HydrophobicContact CG-CD1 4.47Å; I1001-I1006 HydrophobicContact CG2-CD1 3.22Å; I1001-I1006 HydrophobicContact CG2-CG1 4.08Å; D1002-I1006 PolarHBondContact O-N 3.14Å; V1003-I1006 PolarHBondContact O-N 3.29Å; Y1004-I1006 PolarHBondContact O-N 3.1Å; I1006-T1008 PolarHBondContact O-N 2.98Å; I1006-F1011 HydrophobicContact CB-CD1 4.35Å; I1006-F1011 HydrophobicContact CB-CE1 4.22Å; I1006-F1011 HydrophobicContact CB-CZ 4.41Å; I1006-F1011 HydrophobicContact CD1-CZ 4.27Å; I1006-F1011 HydrophobicContact CG1-CD1 4.49Å; I1006-F1011 HydrophobicContact CG1-CD2 4.35Å; I1006-F1011 HydrophobicContact CG1-CE1 4.09Å; I1006-F1011 HydrophobicContact CG1-CE2 3.93Å; I1006-F1011 HydrophobicContact CG1-CZ 3.77Å; I1006-F1011 HydrophobicContact CG2-CD1 4.23Å; I1006-F1011 HydrophobicContact CG2-CE1 3.85Å; I1006-F1011 HydrophobicContact CG2-CZ 4.32Å; I1006-F1011 WeakPolarHBondContact O-CD1 3.05Å
1007	T	81.3	Confident	83.4	Confident	114 Å²	114	67.3 Å²	67.3	70%	0.699	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.9	-6.5	179.8	59.4	0	0	0	0	113.8	V1003 Y1004 F1005	V1003-T1007 PolarHBondContact O-N 2.83Å; Y1004-T1007 PolarHBondContact O-N 3.28Å; Y1004-T1007 PolarHBondContact O-OG1 3.2Å; F1005-T1007 VanDerWaalsContact C-N 3.27Å; F1005-T1007 PolarHBondContact O-N 3.1Å
1008	T	87	Confident	84.2	Confident	65 Å²	65	66.8 Å²	66.8	40%	0.399	34%	0.343	S	S	.	.	S	Bend	trans	-80.7	143.5	-176	-54.4	0	0	0	0	111.7	Y1004 F1005 I1006 S1010 F1011 L1012	Y1004-T1008 PolarHBondContact O-OG1 3.41Å; F1005-T1008 VanDerWaalsContact O-CB 3.22Å; F1005-T1008 WeakPolarHBondContact O-CB 3.41Å; F1005-T1008 PolarHBondContact O-N 3.02Å; F1005-T1008 PolarHBondContact O-OG1 3.17Å; I1006-T1008 PolarHBondContact O-N 2.98Å; T1008-S1010 PolarHBondContact O-N 3.12Å; T1008-F1011 WeakPolarHBondContact O-CB 3.07Å; T1008-F1011 PolarHBondContact O-N 3.16Å; T1008-L1012 PolarHBondContact O-N 3.05Å
1009	V	85.6	Confident	85.1	Confident	119 Å²	119	61.5 Å²	61.5	72%	0.721	32%	0.32	S	S	*	.	H	α-helix	trans	-58.5	-32.7	175.3	-178.9	0	0	0	0	111.7	F1011 L1012 W1013	V1009-F1011 VanDerWaalsContact C-N 3.35Å; V1009-F1011 PolarHBondContact O-N 3.49Å; V1009-L1012 PolarHBondContact O-N 2.89Å; V1009-W1013 PolarHBondContact O-N 3.46Å
1010	S	85.6	Confident	86.1	Confident	31 Å²	31	58.8 Å²	58.8	22%	0.217	31%	0.31	C	S	.	.	H	α-helix	trans	-56.5	-45.6	174.4	-168.7	0	0	0	0	112.3	T1008 W1013 K1014	T1008-S1010 PolarHBondContact O-N 3.12Å; S1010-W1013 VanDerWaalsContact CA-CD1 3.45Å; S1010-W1013 PolarHBondContact O-NE1 3.24Å; S1010-K1014 WeakPolarHBondContact O-CB 3.34Å; S1010-K1014 WeakPolarHBondContact O-CG 3.46Å; S1010-K1014 PolarHBondContact O-N 3.28Å; S1010-K1014 WeakPolarHBondContact OG-CE 3.31Å
1011	F	88.3	Confident	87	Confident	12 Å²	12	59.4 Å²	59.4	5%	0.053	32%	0.319	C	S	.	.	H	α-helix	trans	-64.3	-46.1	177.6	172.1	-95.5	0	0	0	111.5	A954 I955 T958 F1005 I1006 T1008 V1009 W1013 K1014 V1015	A954-F1011 HydrophobicContact CB-CE2 4.25Å; I955-F1011 HydrophobicContact CG1-CD2 3.98Å; I955-F1011 HydrophobicContact CG1-CE2 4.17Å; T958-F1011 HydrophobicContact CG2-CE1 4.32Å; T958-F1011 HydrophobicContact CG2-CZ 3.9Å; T958-F1011 WeakPolarHBondContact OG1-CZ 3.41Å; F1005-F1011 AromaticContact CD1-CD2 3.93Å; F1005-F1011 HydrophobicContact CD1-CD2 3.93Å; F1005-F1011 HydrophobicContact CE1-CB 4.33Å; F1005-F1011 AromaticContact CE1-CD2 3.66Å; F1005-F1011 HydrophobicContact CE1-CD2 3.66Å; F1005-F1011 HydrophobicContact CE1-CG 4.46Å; F1005-F1011 HydrophobicContact CZ-CB 4.39Å; F1005-F1011 HydrophobicContact CZ-CD2 4.41Å; F1005-F1011 VanDerWaalsContact O-CB 3.3Å; F1005-F1011 WeakPolarHBondContact O-CB 3.35Å; I1006-F1011 HydrophobicContact CB-CD1 4.35Å; I1006-F1011 HydrophobicContact CB-CE1 4.22Å; I1006-F1011 HydrophobicContact CB-CZ 4.41Å; I1006-F1011 HydrophobicContact CD1-CZ 4.27Å; I1006-F1011 HydrophobicContact CG1-CD1 4.49Å; I1006-F1011 HydrophobicContact CG1-CD2 4.35Å; I1006-F1011 HydrophobicContact CG1-CE1 4.09Å; I1006-F1011 HydrophobicContact CG1-CE2 3.93Å; I1006-F1011 HydrophobicContact CG1-CZ 3.77Å; I1006-F1011 HydrophobicContact CG2-CD1 4.23Å; I1006-F1011 HydrophobicContact CG2-CE1 3.85Å; I1006-F1011 HydrophobicContact CG2-CZ 4.32Å; I1006-F1011 WeakPolarHBondContact O-CD1 3.05Å; T1008-F1011 WeakPolarHBondContact O-CB 3.07Å; T1008-F1011 PolarHBondContact O-N 3.16Å; V1009-F1011 VanDerWaalsContact C-N 3.35Å; V1009-F1011 PolarHBondContact O-N 3.49Å; F1011-W1013 PolarHBondContact O-N 3.48Å; F1011-K1014 PolarHBondContact O-N 3.25Å; F1011-V1015 HydrophobicContact CD1-CG2 4.34Å; F1011-V1015 HydrophobicContact CD2-CG2 4.09Å; F1011-V1015 HydrophobicContact CE1-CG2 3.98Å; F1011-V1015 HydrophobicContact CE2-CG2 3.71Å; F1011-V1015 HydrophobicContact CG-CG2 4.4Å; F1011-V1015 HydrophobicContact CZ-CG2 3.67Å; F1011-V1015 WeakPolarHBondContact O-CG2 3.47Å; F1011-V1015 PolarHBondContact O-N 3.2Å
1012	L	89.2	Confident	87.7	Confident	112 Å²	112	59.3 Å²	59.3	59%	0.586	32%	0.318	S	S	*	.	H	α-helix	trans	-60	-46.7	-176.3	-176.3	63.4	0	0	0	112.5	T1008 V1009 T1016	T1008-L1012 PolarHBondContact O-N 3.05Å; V1009-L1012 PolarHBondContact O-N 2.89Å; L1012-T1016 VanDerWaalsContact O-CB 3.29Å; L1012-T1016 WeakPolarHBondContact O-CB 3.29Å; L1012-T1016 PolarHBondContact O-N 3.31Å; L1012-T1016 PolarHBondContact O-OG1 3.32Å
1013	W	91.3	Very high	88.2	Confident	127 Å²	127	57 Å²	57	48%	0.481	31%	0.306	S	S	.	.	H	α-helix	trans	-69.7	-37.8	-179.9	82.2	-101.9	0	0	0	111.8	L944 V1009 S1010 F1011 T1016 A1017	L944-W1013 HydrophobicContact CD1-CH2 4.33Å; L944-W1013 HydrophobicContact CD1-CZ3 4.22Å; L944-W1013 HydrophobicContact CD2-CH2 3.77Å; L944-W1013 HydrophobicContact CD2-CZ3 4.28Å; V1009-W1013 PolarHBondContact O-N 3.46Å; S1010-W1013 VanDerWaalsContact CA-CD1 3.45Å; S1010-W1013 PolarHBondContact O-NE1 3.24Å; F1011-W1013 PolarHBondContact O-N 3.48Å; W1013-T1016 PolarHBondContact O-N 2.62Å; W1013-A1017 HydrophobicContact CE3-CB 4.3Å; W1013-A1017 HydrophobicContact CZ3-CB 4.46Å; W1013-A1017 VanDerWaalsContact O-CB 3.32Å; W1013-A1017 WeakPolarHBondContact O-CB 3.43Å; W1013-A1017 PolarHBondContact O-N 3.4Å
1014	K	91.3	Very high	88.7	Confident	4 Å²	4	58 Å²	58	2%	0.017	31%	0.309	C	S	.	.	H	α-helix	trans	-60.6	-49.4	177.8	-72.2	177.4	-175.8	-168.9	0	110.8	L944 E946 I955 S1010 F1011 A1017 I1018	L944-K1014 HydrophobicContact CB-CD 4.16Å; L944-K1014 HydrophobicContact CB-CG 4.25Å; L944-K1014 HydrophobicContact CD1-CB 4.1Å; L944-K1014 HydrophobicContact CD1-CG 4.09Å; L944-K1014 PolarHBondContact O-NZ 3.29Å; E946-K1014 VanDerWaalsContact CD-NZ 3.25Å; E946-K1014 IonicContact OE1-NZ 3.33Å; E946-K1014 PolarHBondContact OE1-NZ 3.25Å; E946-K1014 IonicContact OE2-NZ 2.98Å; I955-K1014 HydrophobicContact CD1-CD 3.91Å; S1010-K1014 WeakPolarHBondContact O-CB 3.34Å; S1010-K1014 WeakPolarHBondContact O-CG 3.46Å; S1010-K1014 PolarHBondContact O-N 3.28Å; S1010-K1014 WeakPolarHBondContact OG-CE 3.31Å; F1011-K1014 PolarHBondContact O-N 3.25Å; K1014-A1017 PolarHBondContact O-N 3.27Å; K1014-I1018 WeakPolarHBondContact O-CG1 3.49Å; K1014-I1018 PolarHBondContact O-N 2.99Å; K1014-I1018 VanDerWaalsContact O-N 3.07Å
1015	V	91.6	Very high	89.1	Confident	4 Å²	4	51.3 Å²	51.3	2%	0.024	29%	0.289	C	S	.	.	H	α-helix	trans	-63.4	-43.1	177.2	171.9	0	0	0	0	111.2	I955 T958 L962 F1011 A1017 I1018 T1019	I955-V1015 HydrophobicContact CG2-CG2 4.21Å; T958-V1015 HydrophobicContact CG2-CG1 3.99Å; T958-V1015 HydrophobicContact CG2-CG2 4.48Å; L962-V1015 HydrophobicContact CD1-CG1 3.65Å; F1011-V1015 HydrophobicContact CD1-CG2 4.34Å; F1011-V1015 HydrophobicContact CD2-CG2 4.09Å; F1011-V1015 HydrophobicContact CE1-CG2 3.98Å; F1011-V1015 HydrophobicContact CE2-CG2 3.71Å; F1011-V1015 HydrophobicContact CG-CG2 4.4Å; F1011-V1015 HydrophobicContact CZ-CG2 3.67Å; F1011-V1015 WeakPolarHBondContact O-CG2 3.47Å; F1011-V1015 PolarHBondContact O-N 3.2Å; V1015-A1017 PolarHBondContact O-N 3Å; V1015-I1018 PolarHBondContact O-N 3.41Å; V1015-T1019 HydrophobicContact CG1-CG2 4.24Å; V1015-T1019 WeakPolarHBondContact O-CB 3.48Å; V1015-T1019 VanDerWaalsContact O-CG2 3.23Å; V1015-T1019 WeakPolarHBondContact O-CG2 3.02Å; V1015-T1019 PolarHBondContact O-N 2.73Å; V1015-T1019 PolarHBondContact O-OG1 2.71Å
1016	T	91.9	Very high	89.5	Confident	73 Å²	73	51.8 Å²	51.8	45%	0.448	29%	0.292	S	S	.	.	H	α-helix	trans	-63.8	-41.2	178.7	-56.1	0	0	0	0	111.7	L1012 W1013 T1019 L1020	L1012-T1016 VanDerWaalsContact O-CB 3.29Å; L1012-T1016 WeakPolarHBondContact O-CB 3.29Å; L1012-T1016 PolarHBondContact O-N 3.31Å; L1012-T1016 PolarHBondContact O-OG1 3.32Å; W1013-T1016 PolarHBondContact O-N 2.62Å; T1016-T1019 WeakPolarHBondContact CA-OG1 3.41Å; T1016-T1019 PolarHBondContact O-OG1 3.37Å; T1016-L1020 VanDerWaalsContact O-CB 3.26Å; T1016-L1020 WeakPolarHBondContact O-CB 3.37Å; T1016-L1020 PolarHBondContact O-N 3.25Å
1017	A	93.3	Very high	89.7	Confident	38 Å²	38	55.5 Å²	55.5	31%	0.314	31%	0.305	S	S	.	.	H	α-helix	trans	-64.6	-47.6	177.8	0	0	0	0	0	111.7	W1013 K1014 V1015 L1020 V1021	W1013-A1017 HydrophobicContact CE3-CB 4.3Å; W1013-A1017 HydrophobicContact CZ3-CB 4.46Å; W1013-A1017 VanDerWaalsContact O-CB 3.32Å; W1013-A1017 WeakPolarHBondContact O-CB 3.43Å; W1013-A1017 PolarHBondContact O-N 3.4Å; K1014-A1017 PolarHBondContact O-N 3.27Å; V1015-A1017 PolarHBondContact O-N 3Å; A1017-L1020 PolarHBondContact O-N 3.34Å; A1017-V1021 VanDerWaalsContact O-CG2 3.32Å; A1017-V1021 WeakPolarHBondContact O-CG2 3.45Å; A1017-V1021 PolarHBondContact O-N 3.22Å
1018	I	93.5	Very high	90	Very high	7 Å²	7	54 Å²	54	4%	0.036	29%	0.292	C	S	.	.	H	α-helix	trans	-62.6	-47.2	179.5	-67.2	168.3	0	0	0	111	I937 A941 L944 I955 K1014 V1015 L1020 V1021 S1022	I937-I1018 HydrophobicContact CB-CG2 4.28Å; I937-I1018 HydrophobicContact CG1-CG2 4.12Å; I937-I1018 HydrophobicContact CG2-CG2 4.31Å; A941-I1018 HydrophobicContact CB-CD1 4.47Å; L944-I1018 HydrophobicContact CD1-CD1 4.06Å; L944-I1018 HydrophobicContact CD1-CG1 4.05Å; I955-I1018 HydrophobicContact CG2-CD1 3.53Å; K1014-I1018 WeakPolarHBondContact O-CG1 3.49Å; K1014-I1018 PolarHBondContact O-N 2.99Å; K1014-I1018 VanDerWaalsContact O-N 3.07Å; V1015-I1018 PolarHBondContact O-N 3.41Å; I1018-L1020 VanDerWaalsContact C-N 3.35Å; I1018-L1020 PolarHBondContact O-N 3.5Å; I1018-V1021 PolarHBondContact O-N 2.97Å; I1018-S1022 VanDerWaalsContact O-CB 3.29Å; I1018-S1022 WeakPolarHBondContact O-CB 3.23Å; I1018-S1022 PolarHBondContact O-N 3.35Å
1019	T	92.6	Very high	89.9	Confident	17 Å²	17	56.2 Å²	56.2	10%	0.104	30%	0.301	C	S	.	.	H	α-helix	trans	-62.6	-40.4	179.8	50.7	0	0	0	0	112	S959 L962 V1015 T1016 S1022 C1023	S959-T1019 WeakPolarHBondContact O-CG2 3.47Å; L962-T1019 HydrophobicContact CB-CG2 3.79Å; L962-T1019 HydrophobicContact CD1-CG2 4.43Å; V1015-T1019 HydrophobicContact CG1-CG2 4.24Å; V1015-T1019 WeakPolarHBondContact O-CB 3.48Å; V1015-T1019 VanDerWaalsContact O-CG2 3.23Å; V1015-T1019 WeakPolarHBondContact O-CG2 3.02Å; V1015-T1019 PolarHBondContact O-N 2.73Å; V1015-T1019 PolarHBondContact O-OG1 2.71Å; T1016-T1019 WeakPolarHBondContact CA-OG1 3.41Å; T1016-T1019 PolarHBondContact O-OG1 3.37Å; T1019-S1022 PolarHBondContact O-N 3.36Å; T1019-C1023 PolarHBondContact O-N 3.38Å
1020	L	91.9	Very high	89.8	Confident	98 Å²	98	53.1 Å²	53.1	51%	0.513	28%	0.277	S	S	.	.	H	α-helix	trans	-66.1	-45.4	178	-167.9	118.6	0	0	0	112	T1016 A1017 I1018 S1022 C1023 L1024	T1016-L1020 VanDerWaalsContact O-CB 3.26Å; T1016-L1020 WeakPolarHBondContact O-CB 3.37Å; T1016-L1020 PolarHBondContact O-N 3.25Å; A1017-L1020 PolarHBondContact O-N 3.34Å; I1018-L1020 VanDerWaalsContact C-N 3.35Å; I1018-L1020 PolarHBondContact O-N 3.5Å; L1020-S1022 VanDerWaalsContact C-N 3.3Å; L1020-S1022 PolarHBondContact O-N 2.66Å; L1020-C1023 PolarHBondContact O-N 3.07Å; L1020-L1024 HydrophobicContact CD2-CD2 4.02Å; L1020-L1024 HydrophobicContact CG-CB 4.41Å; L1020-L1024 HydrophobicContact CG-CD2 4.42Å; L1020-L1024 WeakPolarHBondContact O-CB 3.17Å; L1020-L1024 PolarHBondContact O-N 3.2Å
1021	V	93.3	Very high	89.8	Confident	73 Å²	73	57 Å²	57	44%	0.442	29%	0.288	S	S	.	.	H	α-helix	trans	-66.6	-33.2	177.9	176.6	0	0	0	0	111.7	Y932 I936 A1017 I1018 P1025	Y932-V1021 PolarHBondContact OH-O 3.01Å; I936-V1021 HydrophobicContact CG2-CB 4.39Å; I936-V1021 HydrophobicContact CG2-CG1 3.95Å; A1017-V1021 VanDerWaalsContact O-CG2 3.32Å; A1017-V1021 WeakPolarHBondContact O-CG2 3.45Å; A1017-V1021 PolarHBondContact O-N 3.22Å; I1018-V1021 PolarHBondContact O-N 2.97Å; V1021-P1025 WeakPolarHBondContact O-CD 3.24Å
1022	S	92.6	Very high	89.7	Confident	0 Å²	0	59.9 Å²	59.9	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-67.4	-42.1	175.7	-175.8	0	0	0	0	112.6	Y932 Q933 T963 I1018 T1019 L1020	Y932-S1022 WeakPolarHBondContact CE1-O 3.33Å; Q933-S1022 WeakPolarHBondContact CG-OG 3.49Å; Q933-S1022 PolarHBondContact NE2-O 3.05Å; T963-S1022 WeakPolarHBondContact CG2-OG 3.22Å; I1018-S1022 VanDerWaalsContact O-CB 3.29Å; I1018-S1022 WeakPolarHBondContact O-CB 3.23Å; I1018-S1022 PolarHBondContact O-N 3.35Å; T1019-S1022 PolarHBondContact O-N 3.36Å; L1020-S1022 VanDerWaalsContact C-N 3.3Å; L1020-S1022 PolarHBondContact O-N 2.66Å
1023	C	90.2	Very high	89.5	Confident	4 Å²	4	62.2 Å²	62.2	3%	0.027	31%	0.305	C	S	.	.	H	α-helix	trans	-97.4	-37.2	-172.5	-73.8	0	0	0	0	115.2	L966 T1019 L1020 L1026 Y1027	L966-C1023 HydrophobicContact CD2-CB 3.77Å; L966-C1023 HydrophobicContact CG-CB 4.47Å; T1019-C1023 PolarHBondContact O-N 3.38Å; L1020-C1023 PolarHBondContact O-N 3.07Å; C1023-L1026 PolarHBondContact O-N 3.44Å; C1023-Y1027 PolarHBondContact O-N 3.25Å; C1023-Y1027 VanDerWaalsContact O-N 3.09Å
1024	L	88.8	Confident	89	Confident	81 Å²	81	61.6 Å²	61.6	42%	0.424	30%	0.302	S	S	.	.	H	α-helix	trans	-61.8	-45.4	-169	-176.1	70.9	0	0	0	113.5	L1020 L1026 Y1027 I1028	L1020-L1024 HydrophobicContact CD2-CD2 4.02Å; L1020-L1024 HydrophobicContact CG-CB 4.41Å; L1020-L1024 HydrophobicContact CG-CD2 4.42Å; L1020-L1024 WeakPolarHBondContact O-CB 3.17Å; L1020-L1024 PolarHBondContact O-N 3.2Å; L1024-L1026 VanDerWaalsContact C-N 3.29Å; L1024-L1026 PolarHBondContact O-N 3.28Å; L1024-Y1027 WeakPolarHBondContact O-CB 3.3Å; L1024-Y1027 PolarHBondContact O-N 3.05Å; L1024-I1028 HydrophobicContact CD1-CD1 4.47Å; L1024-I1028 HydrophobicContact CG-CD1 4.06Å; L1024-I1028 WeakPolarHBondContact O-CG1 3.39Å; L1024-I1028 PolarHBondContact O-N 3.27Å
1025	P	88.8	Confident	88.6	Confident	50 Å²	50	69.8 Å²	69.8	33%	0.325	33%	0.333	S	S	.	.	H	α-helix	trans	-62	-37.9	179.6	-25.9	38.7	0	0	0	112.7	V1021 I1028 L1029	V1021-P1025 WeakPolarHBondContact O-CD 3.24Å; P1025-I1028 PolarHBondContact O-N 3.32Å; P1025-L1029 WeakPolarHBondContact O-CG 3.38Å; P1025-L1029 PolarHBondContact O-N 3.19Å
1026	L	88.4	Confident	88.4	Confident	28 Å²	28	77.5 Å²	77.5	15%	0.147	37%	0.366	C	S	.	.	H	α-helix	trans	-66.8	-39.2	177.7	-63.4	173.8	0	0	0	111.7	I929 Y932 Q933 C1023 L1024 L1029 K1030	I929-L1026 HydrophobicContact CG1-CD2 4.09Å; I929-L1026 HydrophobicContact CG2-CD1 3.71Å; I929-L1026 HydrophobicContact CG2-CD2 4.37Å; Y932-L1026 HydrophobicContact CD1-CD1 4.19Å; Y932-L1026 HydrophobicContact CD1-CD2 4.3Å; Y932-L1026 HydrophobicContact CD1-CG 4.26Å; Y932-L1026 HydrophobicContact CE1-CD1 4.42Å; Y932-L1026 HydrophobicContact CE1-CG 4.26Å; Q933-L1026 VanDerWaalsContact CD-CD1 3.49Å; Q933-L1026 HydrophobicContact CG-CD1 3.65Å; C1023-L1026 PolarHBondContact O-N 3.44Å; L1024-L1026 VanDerWaalsContact C-N 3.29Å; L1024-L1026 PolarHBondContact O-N 3.28Å; L1026-L1029 PolarHBondContact O-N 3.03Å; L1026-K1030 VanDerWaalsContact O-CB 3.32Å; L1026-K1030 WeakPolarHBondContact O-CB 3.49Å; L1026-K1030 PolarHBondContact O-N 3.24Å
1027	Y	86.6	Confident	87.8	Confident	108 Å²	108	77.9 Å²	77.9	42%	0.424	37%	0.372	S	S	.	.	H	α-helix	trans	-63.1	-45.7	174.5	-179.5	-103.9	0	0	0	111.9	L970 C1023 L1024 L1029 K1030 Y1031	L970-Y1027 HydrophobicContact CB-CD2 4.49Å; L970-Y1027 HydrophobicContact CD1-CD2 4.19Å; L970-Y1027 HydrophobicContact CD2-CD2 3.7Å; L970-Y1027 HydrophobicContact CD2-CE2 3.83Å; L970-Y1027 HydrophobicContact CD2-CG 4.5Å; L970-Y1027 HydrophobicContact CG-CD2 4.34Å; C1023-Y1027 PolarHBondContact O-N 3.25Å; C1023-Y1027 VanDerWaalsContact O-N 3.09Å; L1024-Y1027 WeakPolarHBondContact O-CB 3.3Å; L1024-Y1027 PolarHBondContact O-N 3.05Å; Y1027-L1029 PolarHBondContact O-N 3.1Å; Y1027-K1030 PolarHBondContact O-N 3.06Å; Y1027-Y1031 WeakPolarHBondContact O-CB 3.26Å; Y1027-Y1031 PolarHBondContact O-N 3.43Å
1028	I	87.8	Confident	87.1	Confident	82 Å²	82	78.4 Å²	78.4	42%	0.421	37%	0.372	S	S	.	.	H	α-helix	trans	-59.5	-48.9	177.1	-66.5	167.5	0	0	0	110.2	L1024 P1025 K1030 Y1031 L1032	L1024-I1028 HydrophobicContact CD1-CD1 4.47Å; L1024-I1028 HydrophobicContact CG-CD1 4.06Å; L1024-I1028 WeakPolarHBondContact O-CG1 3.39Å; L1024-I1028 PolarHBondContact O-N 3.27Å; P1025-I1028 PolarHBondContact O-N 3.32Å; I1028-K1030 VanDerWaalsContact C-N 3.31Å; I1028-K1030 PolarHBondContact O-N 3.3Å; I1028-Y1031 PolarHBondContact O-N 3.34Å; I1028-L1032 HydrophobicContact CG2-CD1 3.9Å; I1028-L1032 HydrophobicContact CG2-CG 4.28Å; I1028-L1032 VanDerWaalsContact O-CG 3.28Å; I1028-L1032 WeakPolarHBondContact O-CG 3.42Å; I1028-L1032 PolarHBondContact O-N 3.31Å
1029	L	85.1	Confident	86.1	Confident	113 Å²	113	80.1 Å²	80.1	59%	0.592	38%	0.384	S	S	*	.	H	α-helix	trans	-58.5	-42.2	177.4	-74	171.9	0	0	0	112.3	P1025 L1026 Y1027 R1033	P1025-L1029 WeakPolarHBondContact O-CG 3.38Å; P1025-L1029 PolarHBondContact O-N 3.19Å; L1026-L1029 PolarHBondContact O-N 3.03Å; Y1027-L1029 PolarHBondContact O-N 3.1Å; L1029-R1033 WeakPolarHBondContact O-CB 3.14Å; L1029-R1033 PolarHBondContact O-N 3.08Å
1030	K	84.6	Confident	85.2	Confident	53 Å²	53	82.3 Å²	82.3	23%	0.23	40%	0.4	C	S	.	.	H	α-helix	trans	-65.4	-42.9	177.2	-174.6	179.6	-175.7	178.8	0	111.9	L970 T971 L1026 Y1027 I1028 R1033 R1034	L970-K1030 PolarHBondContact O-NZ 3.21Å; T971-K1030 VanDerWaalsContact CA-NZ 3.28Å; T971-K1030 PolarHBondContact OG1-NZ 3.49Å; L1026-K1030 VanDerWaalsContact O-CB 3.32Å; L1026-K1030 WeakPolarHBondContact O-CB 3.49Å; L1026-K1030 PolarHBondContact O-N 3.24Å; Y1027-K1030 PolarHBondContact O-N 3.06Å; I1028-K1030 VanDerWaalsContact C-N 3.31Å; I1028-K1030 PolarHBondContact O-N 3.3Å; K1030-R1033 PolarHBondContact O-N 3.12Å; K1030-R1034 WeakPolarHBondContact O-CG 3.43Å; K1030-R1034 PolarHBondContact O-N 3.2Å
1031	Y	85.3	Confident	84.3	Confident	114 Å²	114	79.6 Å²	79.6	45%	0.447	38%	0.383	S	S	.	.	H	α-helix	trans	-62.2	-48.8	176.5	176.3	-95.7	0	0	0	111.2	Y1027 I1028 R1033 R1034 R1035	Y1027-Y1031 WeakPolarHBondContact O-CB 3.26Å; Y1027-Y1031 PolarHBondContact O-N 3.43Å; I1028-Y1031 PolarHBondContact O-N 3.34Å; Y1031-R1033 VanDerWaalsContact C-N 3.33Å; Y1031-R1033 PolarHBondContact O-N 3.03Å; Y1031-R1034 PolarHBondContact O-N 3.25Å; Y1031-R1035 PolarHBondContact O-N 3.03Å; Y1031-R1035 PolarHBondContact OH-NH1 2.93Å
1032	L	86.2	Confident	83.3	Confident	71 Å²	71	77.7 Å²	77.7	37%	0.372	37%	0.373	S	S	.	.	H	α-helix	trans	-58.9	-44.8	176.2	-67.2	173.6	0	0	0	111.2	I1028 R1034 R1035 F1036	I1028-L1032 HydrophobicContact CG2-CD1 3.9Å; I1028-L1032 HydrophobicContact CG2-CG 4.28Å; I1028-L1032 VanDerWaalsContact O-CG 3.28Å; I1028-L1032 WeakPolarHBondContact O-CG 3.42Å; I1028-L1032 PolarHBondContact O-N 3.31Å; L1032-R1034 PolarHBondContact O-N 3.05Å; L1032-R1035 PolarHBondContact O-N 2.67Å; L1032-R1035 VanDerWaalsContact O-N 3.16Å; L1032-F1036 HydrophobicContact CB-CD2 4.3Å; L1032-F1036 HydrophobicContact CB-CE2 4.39Å; L1032-F1036 HydrophobicContact CD2-CE2 4.02Å; L1032-F1036 WeakPolarHBondContact O-CD2 3.33Å; L1032-F1036 PolarHBondContact O-N 3.11Å
1033	R	83.6	Confident	82.4	Confident	161 Å²	161	84.1 Å²	84.1	61%	0.608	40%	0.401	S	S	*	.	H	α-helix	trans	-61.5	-42.6	177.3	-174.7	177.2	178.5	-173.4	-1.9	112.4	L1029 K1030 Y1031 R1035 S1037	L1029-R1033 WeakPolarHBondContact O-CB 3.14Å; L1029-R1033 PolarHBondContact O-N 3.08Å; K1030-R1033 PolarHBondContact O-N 3.12Å; Y1031-R1033 VanDerWaalsContact C-N 3.33Å; Y1031-R1033 PolarHBondContact O-N 3.03Å; R1033-R1035 VanDerWaalsContact C-N 3.27Å; R1033-R1035 PolarHBondContact O-N 3.11Å; R1033-S1037 CarbonylContact O-C 3.51Å; R1033-S1037 WeakPolarHBondContact O-CA 3.35Å; R1033-S1037 PolarHBondContact O-N 3.26Å
1034	R	81.4	Confident	81.4	Confident	114 Å²	114	86.6 Å²	86.6	43%	0.43	41%	0.414	S	S	.	.	H	α-helix	trans	-63	-35.2	176.1	-78.4	-178.4	175	177.7	-1.2	111.9	K1030 Y1031 L1032 P1038	K1030-R1034 WeakPolarHBondContact O-CG 3.43Å; K1030-R1034 PolarHBondContact O-N 3.2Å; Y1031-R1034 PolarHBondContact O-N 3.25Å; L1032-R1034 PolarHBondContact O-N 3.05Å; R1034-P1038 WeakPolarHBondContact O-CA 3.37Å; R1034-P1038 WeakPolarHBondContact O-CB 3.37Å
1035	R	83.9	Confident	79.9	Confident	177 Å²	177	86.8 Å²	86.8	67%	0.668	42%	0.418	S	S	*	.	H	α-helix	trans	-74.9	-43.7	179.3	-168.4	168.6	-177.2	158.1	-3.4	113.1	Y1031 L1032 R1033	Y1031-R1035 PolarHBondContact O-N 3.03Å; Y1031-R1035 PolarHBondContact OH-NH1 2.93Å; L1032-R1035 PolarHBondContact O-N 2.67Å; L1032-R1035 VanDerWaalsContact O-N 3.16Å; R1033-R1035 VanDerWaalsContact C-N 3.27Å; R1033-R1035 PolarHBondContact O-N 3.11Å
1036	F	86.1	Confident	78	Confident	165 Å²	165	92.2 Å²	92.2	72%	0.724	45%	0.451	S	S	*	.	H	α-helix	trans	-87.1	-26.4	-176.8	-68.7	-64.2	0	0	0	114.3	L1032	L1032-F1036 HydrophobicContact CB-CD2 4.3Å; L1032-F1036 HydrophobicContact CB-CE2 4.39Å; L1032-F1036 HydrophobicContact CD2-CE2 4.02Å; L1032-F1036 WeakPolarHBondContact O-CD2 3.33Å; L1032-F1036 PolarHBondContact O-N 3.11Å
1037	S	80.1	Confident	77.5	Confident	81 Å²	81	95.5 Å²	95.5	57%	0.566	47%	0.466	S	S	*	.	S	Bend	trans	-141	69.5	-180	174.5	0	0	0	0	110.5	R1033	R1033-S1037 CarbonylContact O-C 3.51Å; R1033-S1037 WeakPolarHBondContact O-CA 3.35Å; R1033-S1037 PolarHBondContact O-N 3.26Å
1038	P	78.3	Confident	77	Confident	49 Å²	49	94.8 Å²	94.8	32%	0.318	47%	0.468	S	S	.	.			trans	-61.8	136.9	-178.2	23.9	-32.8	0	0	0	111.3	R1034 S1042	R1034-P1038 WeakPolarHBondContact O-CA 3.37Å; R1034-P1038 WeakPolarHBondContact O-CB 3.37Å; P1038-S1042 WeakPolarHBondContact CB-OG 3.5Å
1039	P	72.8	Confident	76.4	Confident	44 Å²	44	95.5 Å²	95.5	29%	0.286	47%	0.471	S	S	.	.			trans	-64.7	154.7	177.3	27.8	-34.9	0	0	0	112	Y1041 S1042	P1039-Y1041 HydrophobicContact CB-CD1 3.69Å; P1039-Y1041 HydrophobicContact CB-CE1 3.34Å; P1039-Y1041 HydrophobicContact CG-CD1 3.98Å; P1039-Y1041 HydrophobicContact CG-CE1 3.37Å; P1039-Y1041 HydrophobicContact CG-CE2 4.23Å; P1039-Y1041 PolarHBondContact O-N 2.93Å; P1039-Y1041 VanDerWaalsContact O-N 3.08Å; P1039-S1042 VanDerWaalsContact CD-OG 3.28Å; P1039-S1042 WeakPolarHBondContact CD-OG 3.42Å; P1039-S1042 PolarHBondContact O-N 3.27Å; P1039-S1042 PolarHBondContact O-OG 3.24Å
1040	S	73.3	Confident	75.9	Confident	62 Å²	62	94.5 Å²	94.5	43%	0.434	46%	0.464	S	S	.	.	G	3₁₀ helix	trans	-52	-38.6	-175	-44.5	0	0	0	0	113.4	D911 K1043	D911-S1040 PolarHBondContact OD2-OG 3.27Å; S1040-K1043 PolarHBondContact O-N 3.33Å
1041	Y	73.6	Confident	75.3	Confident	41 Å²	41	97.1 Å²	97.1	16%	0.161	48%	0.479	C	S	.	.	G	3₁₀ helix	trans	-71.6	-30.6	-178.6	68.7	-92.4	0	0	0	113.7	D896 V897 Q973 P1039 K1043 L1044	D896-Y1041 HydrophobicContact CB-CE2 4.34Å; V897-Y1041 HydrophobicContact CG1-CD2 4.3Å; V897-Y1041 HydrophobicContact CG1-CG 4.48Å; Q973-Y1041 PolarHBondContact NE2-OH 3.23Å; Q973-Y1041 VanDerWaalsContact NE2-OH 3.09Å; Q973-Y1041 VanDerWaalsContact OE1-CE2 3.3Å; Q973-Y1041 PolarHBondContact OE1-OH 3.1Å; P1039-Y1041 HydrophobicContact CB-CD1 3.69Å; P1039-Y1041 HydrophobicContact CB-CE1 3.34Å; P1039-Y1041 HydrophobicContact CG-CD1 3.98Å; P1039-Y1041 HydrophobicContact CG-CE1 3.37Å; P1039-Y1041 HydrophobicContact CG-CE2 4.23Å; P1039-Y1041 PolarHBondContact O-N 2.93Å; P1039-Y1041 VanDerWaalsContact O-N 3.08Å; Y1041-K1043 PolarHBondContact O-N 3.43Å; Y1041-L1044 PolarHBondContact O-N 3.44Å
1042	S	71.3	Confident	74.7	Confident	33 Å²	33	95.9 Å²	95.9	23%	0.231	48%	0.481	C	S	.	.	G	3₁₀ helix	trans	-73.1	-19.9	-179.4	65.7	0	0	0	0	112.2	P1038 P1039 L1044 T1045	P1038-S1042 WeakPolarHBondContact CB-OG 3.5Å; P1039-S1042 VanDerWaalsContact CD-OG 3.28Å; P1039-S1042 WeakPolarHBondContact CD-OG 3.42Å; P1039-S1042 PolarHBondContact O-N 3.27Å; P1039-S1042 PolarHBondContact O-OG 3.24Å; S1042-L1044 PolarHBondContact O-N 2.87Å; S1042-T1045 PolarHBondContact O-OG1 3.32Å
1043	K	73.9	Confident	73.8	Confident	136 Å²	136	97.7 Å²	97.7	59%	0.591	49%	0.488	S	S	*	.	G	3₁₀ helix	trans	-73.6	-15.7	173.9	-59.3	-178.7	179.3	-176.6	0	113.1	S1040 Y1041 T1046	S1040-K1043 PolarHBondContact O-N 3.33Å; Y1041-K1043 PolarHBondContact O-N 3.43Å; K1043-T1046 PolarHBondContact O-OG1 2.99Å
1044	L	70.1	Confident	73.1	Confident	55 Å²	55	92.8 Å²	92.8	29%	0.288	48%	0.479	S	S	.	.	S	Bend	trans	-99.1	-11.8	-177.3	-60.3	171.3	0	0	0	112.6	Y905 L908 Y1041 S1042	Y905-L1044 HydrophobicContact CD1-CD2 4.01Å; Y905-L1044 HydrophobicContact CD2-CB 4.39Å; Y905-L1044 HydrophobicContact CD2-CD1 4.06Å; Y905-L1044 HydrophobicContact CD2-CD2 4.21Å; Y905-L1044 HydrophobicContact CD2-CG 4.46Å; Y905-L1044 HydrophobicContact CE1-CD2 3.98Å; Y905-L1044 HydrophobicContact CE2-CB 4.41Å; Y905-L1044 HydrophobicContact CE2-CD2 4.17Å; Y905-L1044 HydrophobicContact CG-CD1 3.92Å; Y905-L1044 HydrophobicContact CG-CD2 4.11Å; L908-L1044 HydrophobicContact CD1-CD1 3.94Å; L908-L1044 HydrophobicContact CD2-CD1 3.82Å; L908-L1044 HydrophobicContact CG-CD1 3.96Å; Y1041-L1044 PolarHBondContact O-N 3.44Å; S1042-L1044 PolarHBondContact O-N 2.87Å
1045	T	57.7	Low	72.4	Confident	86 Å²	86	91.1 Å²	91.1	53%	0.528	48%	0.483	S	S	.	.			trans	-103.5	-10	-178.1	49.3	0	0	0	0	113.7	S1042	S1042-T1045 PolarHBondContact O-OG1 3.32Å
1046	T	47.9	Very low	71.4	Confident	164 Å²	164	83.3 Å²	83.3	100%	1.006	47%	0.467	S	S	*	.			trans	-82.3	0	164.6	45.9	0	0	0	0	109.2	K1043	K1043-T1046 PolarHBondContact O-OG1 2.99Å

Retrieved 1,046 of 1,046 residues in 504.6 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).