A0A087XWB3_POEFO Loading...

Glutamyl-tRNA(Gln) amidotransferase subunit B, mitochondrial

Allows the formation of correctly charged Asn-tRNA(Asn) or Gln-tRNA(Gln) through the transamidation of misacylated Asp-tRNA(Asn) or Glu-tRNA(Gln) in organisms which lack either or both of asparaginyl-tRNA or glutaminyl-tRNA synthetases. The reaction takes place in the presence of glutamine and ATP through an activated phospho-Asp-tRNA(Asn) or phospho-Glu-tRNA(Gln). Allows the formation of correctly charged Gln-tRNA(Gln) through the transamidation of misacylated Glu-tRNA(Gln) in the mitochondria. The reaction takes place in the presence of glutamine and ATP through an activated gamma-phospho-Glu-tRNA(Gln).

AlphaFold DB , UniProt , Accession A0A087XWB3, Species POEFO (Poecilia formosa, Amazon molly), Gene GATB, Length 549 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	32.3	Very low	28.9	Very low	252 Å²	252	161.5 Å²	161.5	100%	1.241	89%	0.886	S	S	*	*				0	137	0	-69.9	-174.2	-159.6	0	0	108.3
2	A	27.3	Very low	28.9	Very low	106 Å²	106	161.7 Å²	161.7	88%	0.876	88%	0.883	S	S	*	*			trans	-76.4	141.5	-170.6	0	0	0	0	0	113.1
3	A	25.4	Very low	28.7	Very low	96 Å²	96	162.8 Å²	162.8	79%	0.793	88%	0.878	S	S	*	*			trans	-177.9	149.7	131.3	0	0	0	0	0	111.3
4	S	30.1	Very low	28.6	Very low	123 Å²	123	161.3 Å²	161.3	86%	0.86	87%	0.87	S	S	*	*			trans	92.1	64.8	171	82.5	0	0	0	0	118.3
5	R	31.2	Very low	28.5	Very low	241 Å²	241	162.1 Å²	162.1	91%	0.909	87%	0.871	S	S	*	*			trans	-104.2	141.2	133.8	-76.9	179.3	174.8	-178.7	-1.6	106.8
6	I	30.8	Very low	28.4	Very low	176 Å²	176	164.5 Å²	164.5	90%	0.903	87%	0.871	S	S	*	*			trans	130.1	87.7	165.5	-65.2	155.5	0	0	0	110.5
7	A	28.7	Very low	28.1	Very low	92 Å²	92	164 Å²	164	76%	0.76	87%	0.868	S	S	*	*			trans	-169.2	80.3	145	0	0	0	0	0	104.6
8	A	25.8	Very low	28	Very low	84 Å²	84	162.8 Å²	162.8	69%	0.694	86%	0.86	S	S	*	*				66.4	95.9	102.8	0	0	0	0	0	109.9
9	R	30.2	Very low	28.4	Very low	253 Å²	253	160.5 Å²	160.5	96%	0.955	86%	0.855	S	S	*	*				57.2	50.3	54.2	-145.8	-173.4	-162.7	-173.3	4.6	111.9
10	E	28.6	Very low	28.2	Very low	175 Å²	175	162.8 Å²	162.8	82%	0.818	85%	0.853	S	S	*	*			trans	-143.4	149.9	160	-88.1	-176.8	165.6	0	0	108.4
11	L	28.1	Very low	28	Very low	178 Å²	178	166 Å²	166	93%	0.932	86%	0.855	S	S	*	*			trans	92.3	41.6	-176.8	-61.3	155.8	0	0	0	117.5
12	L	28.9	Very low	27.6	Very low	164 Å²	164	161 Å²	161	86%	0.859	83%	0.829	S	S	*	*			trans	-124.5	83.9	150.7	-90.8	165.7	0	0	0	108.8
13	H	26.1	Very low	27.6	Very low	177 Å²	177	164.1 Å²	164.1	82%	0.819	82%	0.823	S	S	*	*			trans	-169.2	143.3	156.3	-109.9	37.6	0	0	0	112.8
14	N	26.4	Very low	27.6	Very low	141 Å²	141	164.4 Å²	164.4	75%	0.754	82%	0.819	S	S	*	*			trans	88.8	114.3	179.6	-53.5	-41.4	0	0	0	113.4
15	I	27.9	Very low	27.3	Very low	173 Å²	173	163.6 Å²	163.6	89%	0.887	81%	0.813	S	S	*	*				-147.8	151.9	63.4	-78	159.8	0	0	0	113.2
16	K	26.3	Very low	26.9	Very low	201 Å²	201	158.6 Å²	158.6	87%	0.874	81%	0.814	S	S	*	*			trans	-59.2	165.5	-167	-70	165.6	174	177.2	0	118.8
17	L	24.5	Very low	26.7	Very low	156 Å²	156	157.8 Å²	157.8	82%	0.817	81%	0.81	S	S	*	*			trans	-116.4	159.2	-173.2	-119	166.5	0	0	0	110.3
18	I	25.2	Very low	26.4	Very low	143 Å²	143	162.6 Å²	162.6	73%	0.733	82%	0.815	S	S	*	*			trans	75.1	149.1	156.1	-0.4	-178.5	0	0	0	118.5
19	P	35.3	Very low	26.4	Very low	118 Å²	118	165 Å²	165	77%	0.766	81%	0.814	S	S	*	*			cis	-143.8	169.2	13.6	41.5	-19.8	0	0	0	122.3
20	Y	25.3	Very low	26	Very low	207 Å²	207	162.8 Å²	162.8	81%	0.812	81%	0.806	S	S	*	*			trans	-52.6	150.7	164.3	-103.6	-105.9	0	0	0	115.2
21	Y	23.9	Very low	25.7	Very low	230 Å²	230	167 Å²	167	90%	0.902	82%	0.815	S	S	*	*			trans	-139.4	143.4	149	-113.6	-88.8	0	0	0	110.8
22	Q	24.2	Very low	25.5	Very low	146 Å²	146	164.6 Å²	164.6	68%	0.682	80%	0.801	S	S	*	*			trans	-121.7	153.1	-171.5	-147.8	-169.7	13.5	0	0	110.1
23	K	26.7	Very low	25.3	Very low	172 Å²	172	161.2 Å²	161.2	75%	0.748	79%	0.791	S	S	*	*			trans	100.7	129	142	-97.1	175.9	-176.3	176.6	0	122.3
24	S	24.8	Very low	25.2	Very low	103 Å²	103	159.3 Å²	159.3	72%	0.72	79%	0.792	S	S	*	*			trans	82.7	142.1	139.8	-54.8	0	0	0	0	117.8
25	S	24.2	Very low	25.1	Very low	105 Å²	105	157.3 Å²	157.3	73%	0.734	79%	0.79	S	S	*	*			cis	173.7	143.4	-6.1	43.4	0	0	0	0	106.6
26	C	23.3	Very low	24.9	Very low	136 Å²	136	157.3 Å²	157.3	92%	0.919	78%	0.783	S	S	*	*			trans	-174	117.4	141.9	-99.2	0	0	0	0	111.4
27	L	25.3	Very low	24.8	Very low	159 Å²	159	155.4 Å²	155.4	83%	0.832	78%	0.775	S	S	*	*			trans	-89.5	139	162.4	-91	132.6	0	0	0	108.3
28	F	24	Very low	24.9	Very low	194 Å²	194	156.3 Å²	156.3	85%	0.851	78%	0.775	S	S	*	*			trans	-164.9	103.7	141.2	-103.5	-74.1	0	0	0	112.2
29	I	24.5	Very low	24.7	Very low	134 Å²	134	155.4 Å²	155.4	69%	0.687	78%	0.78	S	S	*	*				41.9	104.9	129.7	-51.7	179.4	0	0	0	120.4
30	R	22.6	Very low	24.2	Very low	206 Å²	206	155.1 Å²	155.1	78%	0.777	78%	0.781	S	S	*	*				56.1	116.3	119.5	-152.5	-175.5	-161.9	-173.1	5.1	120.4
31	W	23	Very low	24.3	Very low	265 Å²	265	150.6 Å²	150.6	100%	1.004	78%	0.78	S	S	*	*			trans	-139.8	150.8	141.4	-100.9	72.3	0	0	0	110.9
32	I	23.4	Very low	24.4	Very low	127 Å²	127	148.2 Å²	148.2	65%	0.651	78%	0.777	S	S	*	*			trans	-100.1	149.7	-158.6	-72.8	161.2	0	0	0	111.4
33	S	23.8	Very low	24.6	Very low	93 Å²	93	147 Å²	147	65%	0.65	78%	0.782	S	S	*	*			trans	61.9	123.2	149.3	178.2	0	0	0	0	119.6
34	T	25.1	Very low	24.7	Very low	136 Å²	136	146.8 Å²	146.8	83%	0.834	79%	0.788	S	S	*	*				-169.9	149.2	94.8	32.3	0	0	0	0	111.4
35	S	23.7	Very low	24.8	Very low	100 Å²	100	150.7 Å²	150.7	70%	0.699	80%	0.795	S	S	*	*			trans	-83.2	163.5	-176.9	49.7	0	0	0	0	112.8
36	K	24.5	Very low	25.1	Very low	173 Å²	173	155.6 Å²	155.6	75%	0.752	80%	0.803	S	S	*	*			trans	110.7	125.3	137.2	-91.5	172.1	174.4	-176.5	0	120.2
37	F	22.8	Very low	25.6	Very low	160 Å²	160	153.9 Å²	153.9	70%	0.702	79%	0.792	S	S	*	*			trans	101.2	96.8	144.9	-77.7	-68.4	0	0	0	121.2
38	Q	26.3	Very low	26.2	Very low	175 Å²	175	150.6 Å²	150.6	82%	0.818	79%	0.788	S	S	*	*			trans	13.8	126.1	136.8	-72.4	167.2	-38.2	0	0	119.6
39	C	21.8	Very low	27.2	Very low	125 Å²	125	149 Å²	149	85%	0.845	79%	0.787	S	S	*	*			trans	-124	130.5	141.8	-168.4	0	0	0	0	108.7
40	S	25.9	Very low	28.7	Very low	111 Å²	111	148.3 Å²	148.3	78%	0.776	78%	0.781	S	S	*	*			trans	-64.7	120.7	-176.1	49.4	0	0	0	0	113
41	S	26.8	Very low	31.6	Very low	113 Å²	113	146.5 Å²	146.5	79%	0.79	78%	0.782	S	S	*	*			trans	-99.3	108	158.7	57.8	0	0	0	0	108.5
42	Q	25.4	Very low	34.7	Very low	179 Å²	179	135 Å²	135	84%	0.836	74%	0.74	S	S	*	*			trans	-57.7	139.2	163.9	-72.9	177.7	-25.2	0	0	108.7	L44	Q42-L44 PolarHBondContact O-N 2.66Å
43	P	29.5	Very low	37.9	Very low	122 Å²	122	131.7 Å²	131.7	79%	0.792	73%	0.725	S	S	*	*			trans	-70.7	120	172.9	-0.3	16	0	0	0	107.8	E45	P43-E45 PolarHBondContact O-N 2.85Å
44	L	27.9	Very low	41.2	Very low	166 Å²	166	127.6 Å²	127.6	87%	0.869	70%	0.698	S	S	*	*			trans	-50.9	113.9	159.9	-90.7	132.2	0	0	0	107.7	Q42 K46	Q42-L44 PolarHBondContact O-N 2.66Å; L44-K46 PolarHBondContact O-N 3.33Å
45	E	26.6	Very low	44.6	Very low	185 Å²	185	121.8 Å²	121.8	86%	0.864	66%	0.662	S	S	*	*			trans	-48.4	115.2	165.2	-76.7	-178.8	146	0	0	107.7	P43 S47	P43-E45 PolarHBondContact O-N 2.85Å; E45-S47 PolarHBondContact O-N 3.04Å
46	K	31.8	Very low	48	Very low	209 Å²	209	117 Å²	117	91%	0.909	63%	0.629	S	S	*	*			trans	-61.3	93.6	163.3	-78.5	179.6	175.5	179.2	0	106.1	L44 A48	L44-K46 PolarHBondContact O-N 3.33Å; K46-A48 PolarHBondContact O-N 3Å; K46-A48 VanDerWaalsContact O-N 3.14Å
47	S	33.1	Very low	51.4	Low	99 Å²	99	109 Å²	109	69%	0.692	60%	0.596	S	S	*	*			trans	-49.3	124	163.3	117.4	0	0	0	0	106	E45 L49	E45-S47 PolarHBondContact O-N 3.04Å; S47-L49 VanDerWaalsContact C-N 3.31Å; S47-L49 PolarHBondContact O-N 3.44Å
48	A	38.6	Very low	54.9	Low	90 Å²	90	101.5 Å²	101.5	74%	0.744	56%	0.562	S	S	*	*			trans	-59.8	99.9	174.1	0	0	0	0	0	107.1	K46 Q50	K46-A48 PolarHBondContact O-N 3Å; K46-A48 VanDerWaalsContact O-N 3.14Å; A48-Q50 PolarHBondContact O-N 3.31Å
49	L	44.8	Very low	58.2	Low	160 Å²	160	95.1 Å²	95.1	84%	0.838	53%	0.533	S	S	*	.			trans	-53.4	106.5	164.1	-83.1	156.2	0	0	0	105.7	S47 Q51	S47-L49 VanDerWaalsContact C-N 3.31Å; S47-L49 PolarHBondContact O-N 3.44Å; L49-Q51 PolarHBondContact O-N 3.48Å
50	Q	55.3	Low	61.6	Low	121 Å²	121	89.2 Å²	89.2	57%	0.565	49%	0.493	S	S	*	.			trans	-55.1	115.9	179.9	-74.9	174.1	-20.5	0	0	108.2	A48 L52	A48-Q50 PolarHBondContact O-N 3.31Å; Q50-L52 PolarHBondContact O-N 3.07Å
51	Q	82.8	Confident	64.9	Low	167 Å²	167	84.9 Å²	84.9	78%	0.78	46%	0.46	S	S	*	.			trans	-62.7	130.1	-177.4	-171.3	171.8	-4.9	0	0	108.9	L49 P261	L49-Q51 PolarHBondContact O-N 3.48Å; Q51-P261 WeakPolarHBondContact O-CD 3.27Å
52	L	88.6	Confident	68.1	Low	24 Å²	24	79.5 Å²	79.5	13%	0.126	42%	0.423	C	S	.	.			trans	-59.8	138.4	173.1	-74	166.5	0	0	0	109.2	Q50 H259 R260 T292 V295 Q296	Q50-L52 PolarHBondContact O-N 3.07Å; L52-H259 WeakPolarHBondContact CA-O 3.4Å; L52-H259 VanDerWaalsContact CD2-C 3.48Å; L52-R260 HydrophobicContact CD2-CG 3.65Å; L52-T292 HydrophobicContact CB-CG2 4.35Å; L52-T292 HydrophobicContact CD1-CG2 3.99Å; L52-V295 HydrophobicContact CD1-CB 3.92Å; L52-V295 HydrophobicContact CD1-CG1 3.8Å; L52-V295 HydrophobicContact CD2-CG1 4.31Å; L52-Q296 HydrophobicContact CD1-CG 4.24Å
53	V	91.6	Very high	71.3	Confident	57 Å²	57	71.7 Å²	71.7	35%	0.345	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	134.7	178.8	-179.1	0	0	0	0	108.6	V258 H259 P261	V53-V258 WeakPolarHBondContact O-CA 3.41Å; V53-H259 PolarHBondContact N-O 3.03Å; V53-H259 PolarHBondContact O-N 3.03Å; V53-H259 PolarHBondContact O-ND1 3.05Å; V53-P261 HydrophobicContact CG2-CG 3.67Å
54	G	93.6	Very high	74.4	Confident	7 Å²	7	66.1 Å²	66.1	7%	0.072	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	146.3	173.7	0	0	0	0	0	111.6	S216	G54-S216 WeakPolarHBondContact O-CA 3.32Å
55	V	94.5	Very high	77.5	Confident	15 Å²	15	60 Å²	60	9%	0.091	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	128	177.5	-171.4	0	0	0	0	107.6	P213 M215 S257 L265	V55-P213 HydrophobicContact CG1-CB 3.75Å; V55-P213 WeakPolarHBondContact CG1-O 3.35Å; V55-M215 CarbonylContact C-O 3.58Å; V55-M215 WeakPolarHBondContact CA-O 3.48Å; V55-S257 PolarHBondContact N-O 2.97Å; V55-S257 PolarHBondContact O-N 3.29Å; V55-L265 HydrophobicContact CB-CD2 4.1Å; V55-L265 HydrophobicContact CG1-CD2 3.87Å; V55-L265 HydrophobicContact CG2-CD2 3.81Å
56	V	95.9	Very high	80.7	Confident	0 Å²	0	51.8 Å²	51.8	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	123.2	-169.4	-176.5	0	0	0	0	109.8	L58 P213 M215 A221 N255 V256 I284 I288	V56-L58 HydrophobicContact CG1-CD2 4.08Å; V56-P213 CarbonylContact O-C 3.59Å; V56-P213 WeakPolarHBondContact O-CA 3.26Å; V56-M215 HydrophobicContact CB-CB 3.98Å; V56-M215 PolarHBondContact N-O 3.26Å; V56-M215 WeakPolarHBondContact O-CE 3.31Å; V56-M215 PolarHBondContact O-N 3.01Å; V56-A221 HydrophobicContact CG1-CB 4.38Å; V56-N255 WeakPolarHBondContact CA-O 3.48Å; V56-V256 HydrophobicContact CG2-CG2 4.49Å; V56-I284 HydrophobicContact CG1-CD1 3.9Å; V56-I284 HydrophobicContact CG1-CG1 4.36Å; V56-I284 HydrophobicContact CG1-CG2 4.46Å; V56-I284 HydrophobicContact CG2-CG2 3.6Å; V56-I288 HydrophobicContact CG2-CD1 4.21Å
57	G	95.9	Very high	83.6	Confident	5 Å²	5	48.6 Å²	48.6	5%	0.052	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	150.8	165	0	0	0	0	0	110.2	N255	G57-N255 PolarHBondContact N-O 3Å; G57-N255 PolarHBondContact O-N 3.07Å
58	L	96	Very high	86.6	Confident	1 Å²	1	46.4 Å²	46.4	1%	0.005	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	141.5	-178.5	-62	176.9	0	0	0	110.8	V56 I60 M211 M215 A221 V225 V252 A254 L280 I284	V56-L58 HydrophobicContact CG1-CD2 4.08Å; L58-I60 HydrophobicContact CB-CD1 4.45Å; L58-I60 HydrophobicContact CB-CG1 4.26Å; L58-M211 HydrophobicContact CB-CB 4.35Å; L58-M211 HydrophobicContact CB-SD 4.12Å; L58-M211 HydrophobicContact CD1-SD 4.24Å; L58-M211 PolarHBondContact O-N 2.98Å; L58-M215 HydrophobicContact CB-CE 4.28Å; L58-M215 HydrophobicContact CD1-CE 3.67Å; L58-M215 HydrophobicContact CD1-SD 3.89Å; L58-M215 HydrophobicContact CG-CE 3.56Å; L58-M215 HydrophobicContact CG-SD 4.38Å; L58-A221 HydrophobicContact CD1-CB 4.11Å; L58-A221 HydrophobicContact CD2-CB 4.42Å; L58-V225 HydrophobicContact CD1-CG2 3.6Å; L58-V252 HydrophobicContact CD2-CG1 4.02Å; L58-A254 HydrophobicContact CD2-CB 3.94Å; L58-L280 HydrophobicContact CD2-CD1 4.21Å; L58-I284 HydrophobicContact CD2-CD1 4.43Å
59	E	95.7	Very high	89.4	Confident	42 Å²	42	42.1 Å²	42.1	20%	0.196	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	115.7	170	-174.4	178.6	129.7	0	0	107.6	H61 E208 V252 D253	E59-H61 IonicContact OE1-CE1 3.48Å; E59-H61 PolarHBondContact OE1-CE1 3.25Å; E59-H61 IonicContact OE1-NE2 2.93Å; E59-E208 HydrophobicContact CG-CG 4.07Å; E59-V252 WeakPolarHBondContact O-CA 3.47Å; E59-D253 HydrophobicContact CB-CB 4.39Å; E59-D253 PolarHBondContact N-O 3.4Å; E59-D253 PolarHBondContact O-N 3.19Å
60	I	94.3	Very high	91.9	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	121.1	-170.3	-56.6	176.9	0	0	0	108.9	L58 E208 L209 M211 V225 L228 L250 R251 V252	L58-I60 HydrophobicContact CB-CD1 4.45Å; L58-I60 HydrophobicContact CB-CG1 4.26Å; I60-E208 CarbonylContact O-C 3.53Å; I60-E208 WeakPolarHBondContact O-CA 3.47Å; I60-L209 HydrophobicContact CB-CB 4.47Å; I60-L209 PolarHBondContact N-O 2.92Å; I60-L209 PolarHBondContact O-N 3.41Å; I60-M211 HydrophobicContact CD1-CE 3.56Å; I60-M211 HydrophobicContact CD1-SD 4.05Å; I60-V225 HydrophobicContact CD1-CG2 3.87Å; I60-L228 HydrophobicContact CB-CD2 4.38Å; I60-L228 HydrophobicContact CD1-CD2 3.51Å; I60-L228 HydrophobicContact CG2-CD2 4.06Å; I60-L250 HydrophobicContact CG2-CD1 3.51Å; I60-L250 HydrophobicContact CG2-CG 4.19Å; I60-R251 CarbonylContact C-O 3.6Å; I60-R251 WeakPolarHBondContact CA-O 3.35Å; I60-V252 HydrophobicContact CG1-CG1 4.27Å; I60-V252 HydrophobicContact CG1-CG2 4.22Å; I60-V252 HydrophobicContact CG2-CG2 4.38Å
61	H	94	Very high	93.9	Very high	21 Å²	21	28.9 Å²	28.9	10%	0.097	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	113.5	172.7	-57.2	76.9	0	0	0	109	E59 E180 E208 L250 R251	E59-H61 IonicContact OE1-CE1 3.48Å; E59-H61 PolarHBondContact OE1-CE1 3.25Å; E59-H61 IonicContact OE1-NE2 2.93Å; H61-E180 IonicContact CD2-OE1 3.28Å; H61-E180 PolarHBondContact CD2-OE1 2.97Å; H61-E180 IonicContact NE2-OE1 2.78Å; H61-E208 IonicContact NE2-OE2 2.71Å; H61-L250 WeakPolarHBondContact O-CA 3.09Å; H61-R251 HydrophobicContact CB-CB 4.23Å; H61-R251 PolarHBondContact N-O 2.92Å; H61-R251 PolarHBondContact O-N 3.08Å
62	A	93.6	Very high	94.5	Very high	0 Å²	0	21.6 Å²	21.6	0%	0	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	122.5	176.8	0	0	0	0	0	110.1	I64 L206 M207 L209 L232 L250	A62-I64 PolarHBondContact O-N 3.25Å; A62-L206 WeakPolarHBondContact O-CA 3.33Å; A62-M207 HydrophobicContact CB-CE 4.24Å; A62-M207 PolarHBondContact N-O 3Å; A62-M207 PolarHBondContact O-N 3.27Å; A62-L209 HydrophobicContact CB-CD1 4.27Å; A62-L232 HydrophobicContact CB-CD1 3.84Å; A62-L250 HydrophobicContact CB-CD1 3.8Å
63	Q	93.8	Very high	94.8	Very high	15 Å²	15	23.8 Å²	23.8	7%	0.07	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	125	173.7	-174.1	-179.7	-33.7	0	0	110.2	F78 V204 L206 C238 Q249	Q63-F78 VanDerWaalsContact NE2-CZ 3.29Å; Q63-V204 HydrophobicContact CG-CG1 3.61Å; Q63-L206 HydrophobicContact CB-CD2 3.9Å; Q63-L206 HydrophobicContact CG-CD2 4.18Å; Q63-C238 PolarHBondContact O-SG 3.29Å; Q63-Q249 HydrophobicContact CB-CB 4.13Å; Q63-Q249 WeakPolarHBondContact CB-O 3.29Å; Q63-Q249 PolarHBondContact N-O 2.88Å
64	I	94.8	Very high	94.9	Very high	4 Å²	4	21.8 Å²	21.8	2%	0.021	14%	0.142	C	C	.	.			trans	-76	133.1	-177.2	-58.6	171.1	0	0	0	109.7	A62 S66 C104 A107 L179 G205 M207 T237	A62-I64 PolarHBondContact O-N 3.25Å; I64-S66 PolarHBondContact O-N 3.43Å; I64-S66 VanDerWaalsContact O-N 3.11Å; I64-C104 HydrophobicContact CD1-CB 3.99Å; I64-A107 HydrophobicContact CG2-CB 3.64Å; I64-L179 HydrophobicContact CD1-CD2 3.42Å; I64-L179 VanDerWaalsContact CD1-CD2 3.42Å; I64-G205 WeakPolarHBondContact CB-O 3.41Å; I64-G205 PolarHBondContact N-O 3.02Å; I64-M207 HydrophobicContact CD1-CB 4.3Å; I64-M207 HydrophobicContact CG1-CB 4.19Å; I64-T237 WeakPolarHBondContact CA-O 3.46Å
65	S	92.4	Very high	95	Very high	39 Å²	39	23.6 Å²	23.6	27%	0.273	15%	0.153	S	C	.	.			trans	-77.5	92.9	173.3	-173.3	0	0	0	0	110.3	T237	S65-T237 PolarHBondContact N-O 3.37Å
66	S	92.9	Very high	94.8	Very high	11 Å²	11	24.1 Å²	24.1	8%	0.077	16%	0.156	C	C	.	.			trans	-133.2	154.4	176.1	61.3	0	0	0	0	111.5	I64 T68	I64-S66 PolarHBondContact O-N 3.43Å; I64-S66 VanDerWaalsContact O-N 3.11Å; S66-T68 WeakPolarHBondContact CB-O 3.49Å; S66-T68 PolarHBondContact OG-O 3.36Å
67	N	93.5	Very high	94.3	Very high	142 Å²	142	30 Å²	30	76%	0.759	18%	0.184	S	C	*	.	S	Bend	trans	-74.3	-32.3	178	-66.2	-20.9	0	0	0	112.4	S75 V76	N67-S75 VanDerWaalsContact O-CA 3.31Å; N67-S75 WeakPolarHBondContact O-CA 3.3Å; N67-S75 PolarHBondContact O-OG 2.98Å; N67-V76 PolarHBondContact O-N 3.06Å; N67-V76 VanDerWaalsContact O-N 3.11Å
68	T	96.1	Very high	93.3	Very high	53 Å²	53	34.1 Å²	34.1	33%	0.325	20%	0.201	S	C	.	.	B	Isolated β-bridge	trans	-120.8	160	179.3	54.8	0	0	0	0	111.1	S66 S74 N101	S66-T68 WeakPolarHBondContact CB-O 3.49Å; S66-T68 PolarHBondContact OG-O 3.36Å; T68-S74 CarbonylContact C-O 3.29Å; T68-S74 WeakPolarHBondContact CA-O 3.49Å; T68-N101 PolarHBondContact O-ND2 2.68Å; T68-N101 PolarHBondContact OG1-ND2 2.81Å
69	K	96.7	Very high	92.6	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	25%	0.245	C	C	.	.			trans	-64.8	172.8	178.9	-72.6	-173.4	-172	178.8	0	112.9	F71 S72 S74 V76 L85 D90 N101 N200 A202 G203 V204	K69-F71 PolarHBondContact O-N 3.42Å; K69-S72 WeakPolarHBondContact CB-OG 3.37Å; K69-S72 PolarHBondContact N-O 3.47Å; K69-S74 PolarHBondContact N-O 3.29Å; K69-V76 HydrophobicContact CG-CG2 3.89Å; K69-L85 VanDerWaalsContact CE-O 3.3Å; K69-L85 WeakPolarHBondContact CE-O 3.44Å; K69-L85 PolarHBondContact NZ-O 2.75Å; K69-D90 WeakPolarHBondContact CD-OD2 3.31Å; K69-D90 VanDerWaalsContact NZ-CG 3.33Å; K69-D90 IonicContact NZ-OD1 2.71Å; K69-D90 IonicContact NZ-OD2 2.75Å; K69-D90 PolarHBondContact NZ-OD2 3Å; K69-N101 WeakPolarHBondContact O-CB 3.36Å; K69-N101 PolarHBondContact O-ND2 3.14Å; K69-N200 WeakPolarHBondContact CE-O 3.46Å; K69-N200 PolarHBondContact NZ-O 3.37Å; K69-N200 VanDerWaalsContact NZ-O 3.1Å; K69-A202 WeakPolarHBondContact CD-O 3.38Å; K69-A202 WeakPolarHBondContact CE-O 3.38Å; K69-A202 PolarHBondContact NZ-O 3.1Å; K69-G203 WeakPolarHBondContact CB-O 3.28Å; K69-V204 HydrophobicContact CG-CG2 4.29Å
70	L	97.2	Very high	92.2	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	24%	0.244	C	C	.	.	S	Bend	trans	-67.6	-37.8	-172.9	-177.4	57.9	0	0	0	113.1	L100 N101 C104 E180 Q181 G203	L70-L100 HydrophobicContact CD1-CD1 3.9Å; L70-N101 WeakPolarHBondContact O-CB 3.4Å; L70-N101 PolarHBondContact O-N 3.35Å; L70-C104 HydrophobicContact CD1-CB 3.47Å; L70-C104 VanDerWaalsContact CD1-CB 3.47Å; L70-E180 VanDerWaalsContact CD2-O 3.31Å; L70-E180 WeakPolarHBondContact CD2-O 3.29Å; L70-Q181 HydrophobicContact CD2-CG 4.18Å; L70-G203 PolarHBondContact N-O 2.93Å
71	F	97.3	Very high	92.2	Very high	3 Å²	3	46 Å²	46	1%	0.013	27%	0.272	C	S	.	.	S	Bend	trans	-127.2	5.8	-174.7	-64.8	-64.5	0	0	0	114.3	K69 F89 P98 V99 L100 F125 I141 Q181 L335	K69-F71 PolarHBondContact O-N 3.42Å; F71-F89 HydrophobicContact CB-CD1 4.3Å; F71-F89 HydrophobicContact CB-CE1 3.58Å; F71-F89 HydrophobicContact CB-CZ 4.06Å; F71-P98 HydrophobicContact CB-CB 3.78Å; F71-P98 HydrophobicContact CD1-CB 3.85Å; F71-P98 HydrophobicContact CG-CB 3.93Å; F71-V99 CarbonylContact C-O 3.58Å; F71-V99 VanDerWaalsContact C-O 3.29Å; F71-V99 WeakPolarHBondContact CA-O 3.29Å; F71-V99 PolarHBondContact O-N 3.33Å; F71-L100 HydrophobicContact CD1-CB 4.35Å; F71-L100 HydrophobicContact CD1-CD1 4.29Å; F71-L100 HydrophobicContact CE1-CB 4.17Å; F71-L100 HydrophobicContact CE1-CD1 3.61Å; F71-L100 HydrophobicContact CE1-CG 4.47Å; F71-L100 HydrophobicContact CZ-CD1 4.22Å; F71-F125 HydrophobicContact CE1-CE1 4.37Å; F71-F125 HydrophobicContact CE1-CZ 4.41Å; F71-F125 AromaticContact CZ-CD1 3.82Å; F71-F125 HydrophobicContact CZ-CD1 3.82Å; F71-F125 AromaticContact CZ-CE1 3.66Å; F71-F125 HydrophobicContact CZ-CE1 3.66Å; F71-F125 HydrophobicContact CZ-CG 4.4Å; F71-F125 HydrophobicContact CZ-CZ 4.13Å; F71-I141 HydrophobicContact CD2-CB 4.4Å; F71-I141 HydrophobicContact CD2-CD1 4.2Å; F71-I141 HydrophobicContact CE2-CB 3.73Å; F71-I141 HydrophobicContact CE2-CD1 4.24Å; F71-I141 HydrophobicContact CE2-CG2 3.57Å; F71-I141 HydrophobicContact CZ-CB 4.26Å; F71-I141 HydrophobicContact CZ-CG2 3.57Å; F71-Q181 HydrophobicContact CD2-CG 3.46Å; F71-Q181 VanDerWaalsContact CD2-CG 3.46Å; F71-Q181 HydrophobicContact CE2-CG 3.56Å; F71-L335 HydrophobicContact CD1-CD1 3.94Å; F71-L335 HydrophobicContact CD1-CD2 4.4Å; F71-L335 HydrophobicContact CE1-CD1 3.29Å; F71-L335 HydrophobicContact CE1-CD2 4.33Å; F71-L335 HydrophobicContact CE1-CG 4.45Å; F71-L335 HydrophobicContact CZ-CD1 3.81Å
72	S	95.9	Very high	92.2	Very high	15 Å²	15	49.6 Å²	49.6	11%	0.105	30%	0.298	C	S	.	.	S	Bend	trans	-141.8	161.5	-177.8	73.4	0	0	0	0	112.4	K69 S74 S87 D90	K69-S72 WeakPolarHBondContact CB-OG 3.37Å; K69-S72 PolarHBondContact N-O 3.47Å; S72-S74 VanDerWaalsContact C-N 3.27Å; S72-S74 PolarHBondContact O-N 3.29Å; S72-S87 VanDerWaalsContact CB-OG 3.3Å; S72-S87 WeakPolarHBondContact CB-OG 3.14Å; S72-S87 PolarHBondContact OG-OG 3.01Å; S72-D90 VanDerWaalsContact CB-OD1 3.26Å; S72-D90 WeakPolarHBondContact CB-OD1 3.41Å; S72-D90 VanDerWaalsContact OG-CG 3.29Å; S72-D90 PolarHBondContact OG-OD1 3.35Å; S72-D90 PolarHBondContact OG-OD2 3.4Å
73	G	94.7	Very high	92.2	Very high	70 Å²	70	53.3 Å²	53.3	72%	0.722	32%	0.318	S	S	*	.	S	Bend	trans	-80.2	1.7	179.8	0	0	0	0	0	115.1
74	S	95.3	Very high	92.3	Very high	14 Å²	14	55.6 Å²	55.6	10%	0.098	34%	0.335	C	S	.	.			trans	-65.6	144	179	-56.1	0	0	0	0	111.2	T68 K69 S72 S87 D90	T68-S74 CarbonylContact C-O 3.29Å; T68-S74 WeakPolarHBondContact CA-O 3.49Å; K69-S74 PolarHBondContact N-O 3.29Å; S72-S74 VanDerWaalsContact C-N 3.27Å; S72-S74 PolarHBondContact O-N 3.29Å; S74-S87 WeakPolarHBondContact OG-CB 3.29Å; S74-S87 PolarHBondContact OG-N 2.9Å; S74-S87 PolarHBondContact OG-OG 3.28Å; S74-D90 WeakPolarHBondContact CB-OD2 3.28Å; S74-D90 PolarHBondContact OG-OD2 2.95Å
75	S	94.4	Very high	92.3	Very high	45 Å²	45	56.7 Å²	56.7	32%	0.315	34%	0.341	S	S	.	.	B	Isolated β-bridge	trans	-70.4	150.8	176.2	-170.2	0	0	0	0	111.9	N67	N67-S75 VanDerWaalsContact O-CA 3.31Å; N67-S75 WeakPolarHBondContact O-CA 3.3Å; N67-S75 PolarHBondContact O-OG 2.98Å
76	V	90.1	Very high	92.4	Very high	26 Å²	26	56.9 Å²	56.9	16%	0.158	34%	0.34	C	S	.	.			trans	-104.8	111.1	171.3	-176.7	0	0	0	0	108.3	N67 K69 V204	N67-V76 PolarHBondContact O-N 3.06Å; N67-V76 VanDerWaalsContact O-N 3.11Å; K69-V76 HydrophobicContact CG-CG2 3.89Å; V76-V204 HydrophobicContact CG1-CG1 4.16Å; V76-V204 HydrophobicContact CG1-CG2 4.14Å; V76-V204 HydrophobicContact CG2-CG2 4.23Å
77	Q	84.8	Confident	92.5	Very high	124 Å²	124	57.9 Å²	57.9	58%	0.579	35%	0.347	S	S	*	.			trans	-142	148.7	175.1	-56.6	-179.7	-15.5	0	0	110.7	L85	Q77-L85 HydrophobicContact CB-CD1 3.85Å; Q77-L85 HydrophobicContact CG-CD1 4.38Å
78	F	76.6	Confident	92.7	Very high	91 Å²	91	58.3 Å²	58.3	40%	0.399	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.4	150.5	174.2	-66.1	-83.2	0	0	0	110.8	Q63 A80 Q249	Q63-F78 VanDerWaalsContact NE2-CZ 3.29Å; F78-A80 PolarHBondContact O-N 3.04Å; F78-A80 VanDerWaalsContact O-N 3.16Å; F78-Q249 HydrophobicContact CE1-CG 3.87Å; F78-Q249 HydrophobicContact CE2-CG 4.48Å; F78-Q249 HydrophobicContact CZ-CG 3.54Å
79	L	80.9	Confident	92.7	Very high	181 Å²	181	57.2 Å²	57.2	95%	0.948	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.4	23.9	174.7	-55.9	172.9	0	0	0	114.8
80	A	87.6	Confident	92.6	Very high	21 Å²	21	57.5 Å²	57.5	17%	0.174	34%	0.335	C	S	.	.	P	Polyproline II helix	trans	-68.1	152.8	170.8	0	0	0	0	0	111.3	F78 L85	F78-A80 PolarHBondContact O-N 3.04Å; F78-A80 VanDerWaalsContact O-N 3.16Å; A80-L85 HydrophobicContact CB-CD1 3.45Å; A80-L85 VanDerWaalsContact CB-CD1 3.45Å; A80-L85 HydrophobicContact CB-CG 3.81Å
81	P	93.7	Very high	92.5	Very high	90 Å²	90	59.4 Å²	59.4	58%	0.584	35%	0.35	S	S	*	.	P	Polyproline II helix	trans	-54	143.6	172.6	-25.3	34.2	0	0	0	111.6	N83 S84 N200	P81-N83 PolarHBondContact O-N 3.07Å; P81-S84 VanDerWaalsContact O-CB 3.27Å; P81-S84 WeakPolarHBondContact O-CB 3.4Å; P81-S84 PolarHBondContact O-N 3.03Å; P81-S84 PolarHBondContact O-OG 2.61Å; P81-N200 PolarHBondContact O-ND2 2.89Å
82	P	93.1	Very high	92.4	Very high	97 Å²	97	61.1 Å²	61.1	63%	0.63	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.2	136.1	-178.1	-28.1	35	0	0	0	113	S84 N200	P82-S84 PolarHBondContact O-N 3.33Å; P82-S84 VanDerWaalsContact O-N 3.17Å; P82-N200 WeakPolarHBondContact CA-ND2 3.33Å
83	N	94.4	Very high	92.4	Very high	79 Å²	79	64.3 Å²	64.3	42%	0.422	38%	0.379	S	S	.	.	T	Hydrogen-bonded Turn	trans	55.1	25.7	179.6	-60.2	-57.5	0	0	0	115.7	P81 V86 I197 D198 L199 N200	P81-N83 PolarHBondContact O-N 3.07Å; N83-V86 HydrophobicContact CB-CG2 4.4Å; N83-I197 PolarHBondContact ND2-O 3.1Å; N83-I197 VanDerWaalsContact ND2-O 3.11Å; N83-D198 PolarHBondContact N-OD1 3.23Å; N83-L199 WeakPolarHBondContact OD1-CB 3.49Å; N83-L199 PolarHBondContact OD1-N 2.97Å; N83-N200 WeakPolarHBondContact CA-OD1 3.34Å; N83-N200 PolarHBondContact N-ND2 3.06Å; N83-N200 PolarHBondContact N-OD1 2.92Å
84	S	95.3	Very high	92.4	Very high	62 Å²	62	67.2 Å²	67.2	43%	0.434	38%	0.384	S	S	.	.	S	Bend	trans	-91.1	-20.1	177.7	63.8	0	0	0	0	114.4	P81 P82 N200	P81-S84 VanDerWaalsContact O-CB 3.27Å; P81-S84 WeakPolarHBondContact O-CB 3.4Å; P81-S84 PolarHBondContact O-N 3.03Å; P81-S84 PolarHBondContact O-OG 2.61Å; P82-S84 PolarHBondContact O-N 3.33Å; P82-S84 VanDerWaalsContact O-N 3.17Å; S84-N200 PolarHBondContact N-OD1 3.34Å
85	L	95.1	Very high	92.3	Very high	27 Å²	27	70.5 Å²	70.5	14%	0.141	42%	0.421	C	S	.	.	S	Bend	trans	-111.1	50.2	-177.9	-59.3	-178.7	0	0	0	111	K69 Q77 A80 N200	K69-L85 VanDerWaalsContact CE-O 3.3Å; K69-L85 WeakPolarHBondContact CE-O 3.44Å; K69-L85 PolarHBondContact NZ-O 2.75Å; Q77-L85 HydrophobicContact CB-CD1 3.85Å; Q77-L85 HydrophobicContact CG-CD1 4.38Å; A80-L85 HydrophobicContact CB-CD1 3.45Å; A80-L85 VanDerWaalsContact CB-CD1 3.45Å; A80-L85 HydrophobicContact CB-CG 3.81Å; L85-N200 PolarHBondContact N-OD1 2.84Å
86	V	95.6	Very high	92.4	Very high	43 Å²	43	70.5 Å²	70.5	26%	0.261	42%	0.419	S	S	.	.			trans	-128.3	121.9	-170.6	-173	0	0	0	0	109.3	N83 D90 A91 L199	N83-V86 HydrophobicContact CB-CG2 4.4Å; V86-D90 HydrophobicContact CG1-CB 3.81Å; V86-A91 HydrophobicContact CG1-CB 3.99Å; V86-L199 HydrophobicContact CG1-CB 4.19Å; V86-L199 HydrophobicContact CG2-CB 3.88Å
87	S	95.1	Very high	92.7	Very high	32 Å²	32	74.5 Å²	74.5	22%	0.224	44%	0.439	C	S	.	.			trans	-90.6	169.7	171.3	64.7	0	0	0	0	110.8	S72 S74 F89 D90 A91	S72-S87 VanDerWaalsContact CB-OG 3.3Å; S72-S87 WeakPolarHBondContact CB-OG 3.14Å; S72-S87 PolarHBondContact OG-OG 3.01Å; S74-S87 WeakPolarHBondContact OG-CB 3.29Å; S74-S87 PolarHBondContact OG-N 2.9Å; S74-S87 PolarHBondContact OG-OG 3.28Å; S87-F89 PolarHBondContact O-N 2.61Å; S87-D90 PolarHBondContact N-OD2 3.31Å; S87-D90 PolarHBondContact O-N 2.9Å; S87-D90 VanDerWaalsContact O-N 3.09Å; S87-D90 PolarHBondContact OG-N 3.32Å; S87-D90 PolarHBondContact OG-OD1 3.39Å; S87-D90 PolarHBondContact OG-OD2 3.46Å; S87-A91 PolarHBondContact O-N 3.22Å
88	F	96.3	Very high	93.3	Very high	151 Å²	151	69 Å²	69	66%	0.662	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.6	-35.7	173.9	-60.5	-27	0	0	0	113	S92 L93 T96	F88-S92 PolarHBondContact O-N 2.99Å; F88-L93 HydrophobicContact CB-CB 4.31Å; F88-L93 HydrophobicContact CB-CD1 3.82Å; F88-L93 HydrophobicContact CD1-CD1 3.41Å; F88-L93 VanDerWaalsContact CD1-CD1 3.41Å; F88-L93 HydrophobicContact CE1-CD1 4.16Å; F88-L93 HydrophobicContact CG-CD1 3.78Å; F88-L93 PolarHBondContact O-N 3.08Å; F88-T96 HydrophobicContact CB-CG2 3.7Å
89	F	95.6	Very high	94.2	Very high	30 Å²	30	69.9 Å²	69.9	13%	0.132	43%	0.426	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.2	-43.8	175.6	179.1	-95.5	0	0	0	111.6	F71 S87 A91 S92 P98 I141	F71-F89 HydrophobicContact CB-CD1 4.3Å; F71-F89 HydrophobicContact CB-CE1 3.58Å; F71-F89 HydrophobicContact CB-CZ 4.06Å; S87-F89 PolarHBondContact O-N 2.61Å; F89-A91 VanDerWaalsContact C-N 3.26Å; F89-A91 PolarHBondContact O-N 3.3Å; F89-S92 WeakPolarHBondContact O-CA 3.26Å; F89-S92 PolarHBondContact O-N 3.17Å; F89-P98 HydrophobicContact CE1-CB 4.38Å; F89-P98 HydrophobicContact CE2-CB 3.77Å; F89-P98 HydrophobicContact CE2-CG 4.29Å; F89-P98 HydrophobicContact CZ-CB 3.58Å; F89-P98 HydrophobicContact CZ-CG 4.42Å; F89-I141 HydrophobicContact CZ-CD1 4.22Å
90	D	95	Very high	94.9	Very high	7 Å²	7	63.7 Å²	63.7	4%	0.037	39%	0.394	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-35.4	179.3	-54.8	-32.9	0	0	0	111.7	K69 S72 S74 V86 S87 S92 P136	K69-D90 WeakPolarHBondContact CD-OD2 3.31Å; K69-D90 VanDerWaalsContact NZ-CG 3.33Å; K69-D90 IonicContact NZ-OD1 2.71Å; K69-D90 IonicContact NZ-OD2 2.75Å; K69-D90 PolarHBondContact NZ-OD2 3Å; S72-D90 VanDerWaalsContact CB-OD1 3.26Å; S72-D90 WeakPolarHBondContact CB-OD1 3.41Å; S72-D90 VanDerWaalsContact OG-CG 3.29Å; S72-D90 PolarHBondContact OG-OD1 3.35Å; S72-D90 PolarHBondContact OG-OD2 3.4Å; S74-D90 WeakPolarHBondContact CB-OD2 3.28Å; S74-D90 PolarHBondContact OG-OD2 2.95Å; V86-D90 HydrophobicContact CG1-CB 3.81Å; S87-D90 PolarHBondContact N-OD2 3.31Å; S87-D90 PolarHBondContact O-N 2.9Å; S87-D90 VanDerWaalsContact O-N 3.09Å; S87-D90 PolarHBondContact OG-N 3.32Å; S87-D90 PolarHBondContact OG-OD1 3.39Å; S87-D90 PolarHBondContact OG-OD2 3.46Å; D90-S92 PolarHBondContact O-N 2.88Å; D90-P136 WeakPolarHBondContact O-CG 3.35Å
91	A	94.9	Very high	95.3	Very high	39 Å²	39	63.7 Å²	63.7	32%	0.322	39%	0.391	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.4	-0.6	173.7	0	0	0	0	0	113.7	V86 S87 F89 L93	V86-A91 HydrophobicContact CG1-CB 3.99Å; S87-A91 PolarHBondContact O-N 3.22Å; F89-A91 VanDerWaalsContact C-N 3.26Å; F89-A91 PolarHBondContact O-N 3.3Å; A91-L93 VanDerWaalsContact C-N 3.3Å; A91-L93 PolarHBondContact O-N 3.5Å
92	S	95.1	Very high	95.4	Very high	40 Å²	40	62.7 Å²	62.7	28%	0.28	38%	0.378	S	S	.	.	T	Hydrogen-bonded Turn	trans	54.8	40.2	-177.9	-53.9	0	0	0	0	113.9	F88 F89 D90 P136 A137	F88-S92 PolarHBondContact O-N 2.99Å; F89-S92 WeakPolarHBondContact O-CA 3.26Å; F89-S92 PolarHBondContact O-N 3.17Å; D90-S92 PolarHBondContact O-N 2.88Å; S92-P136 WeakPolarHBondContact OG-CB 3.4Å; S92-A137 WeakPolarHBondContact OG-CA 3.33Å; S92-A137 WeakPolarHBondContact OG-CB 3.46Å; S92-A137 PolarHBondContact OG-N 3.5Å
93	L	95.7	Very high	95.5	Very high	82 Å²	82	61.4 Å²	61.4	43%	0.429	36%	0.36	S	S	.	.			trans	-63.9	138.3	173.4	-76.3	173.4	0	0	0	110.5	F88 A91 G95 T96	F88-L93 HydrophobicContact CB-CB 4.31Å; F88-L93 HydrophobicContact CB-CD1 3.82Å; F88-L93 HydrophobicContact CD1-CD1 3.41Å; F88-L93 VanDerWaalsContact CD1-CD1 3.41Å; F88-L93 HydrophobicContact CE1-CD1 4.16Å; F88-L93 HydrophobicContact CG-CD1 3.78Å; F88-L93 PolarHBondContact O-N 3.08Å; A91-L93 VanDerWaalsContact C-N 3.3Å; A91-L93 PolarHBondContact O-N 3.5Å; L93-G95 PolarHBondContact O-N 3.16Å; L93-T96 HydrophobicContact CB-CG2 4.25Å; L93-T96 WeakPolarHBondContact O-CG2 3.4Å; L93-T96 PolarHBondContact O-N 3Å; L93-T96 PolarHBondContact O-OG1 3.32Å
94	P	95.7	Very high	95.6	Very high	130 Å²	130	57.6 Å²	57.6	84%	0.844	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55	134.3	-179.6	-27	34.8	0	0	0	112.7
95	G	94.1	Very high	95.7	Very high	83 Å²	83	54.8 Å²	54.8	86%	0.856	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	91.2	-0.8	178.4	0	0	0	0	0	115.4	L93	L93-G95 PolarHBondContact O-N 3.16Å
96	T	96.1	Very high	95.8	Very high	45 Å²	45	55.6 Å²	55.6	28%	0.276	32%	0.323	S	S	.	.			trans	-81.3	150.5	175	58.4	0	0	0	0	112.1	F88 L93	F88-T96 HydrophobicContact CB-CG2 3.7Å; L93-T96 HydrophobicContact CB-CG2 4.25Å; L93-T96 WeakPolarHBondContact O-CG2 3.4Å; L93-T96 PolarHBondContact O-N 3Å; L93-T96 PolarHBondContact O-OG1 3.32Å
97	L	96.1	Very high	95.8	Very high	111 Å²	111	53.6 Å²	53.6	58%	0.581	31%	0.311	S	S	*	.			trans	-130.5	146.7	-178.5	-66.3	175.7	0	0	0	111.4	N334	L97-N334 HydrophobicContact CD2-CB 4.06Å
98	P	96.3	Very high	95.9	Very high	9 Å²	9	52 Å²	52	6%	0.058	30%	0.3	C	S	.	.			trans	-74.9	141.8	179.3	29.9	-34.1	0	0	0	112.2	F71 F89 I141 N334 L335	F71-P98 HydrophobicContact CB-CB 3.78Å; F71-P98 HydrophobicContact CD1-CB 3.85Å; F71-P98 HydrophobicContact CG-CB 3.93Å; F89-P98 HydrophobicContact CE1-CB 4.38Å; F89-P98 HydrophobicContact CE2-CB 3.77Å; F89-P98 HydrophobicContact CE2-CG 4.29Å; F89-P98 HydrophobicContact CZ-CB 3.58Å; F89-P98 HydrophobicContact CZ-CG 4.42Å; P98-I141 HydrophobicContact CB-CD1 4.18Å; P98-I141 HydrophobicContact CG-CD1 4.35Å; P98-N334 HydrophobicContact CG-CB 3.95Å; P98-L335 HydrophobicContact CB-CD1 4.38Å; P98-L335 HydrophobicContact CB-CD2 4.03Å; P98-L335 HydrophobicContact CB-CG 4.25Å; P98-L335 HydrophobicContact CG-CD1 4.25Å; P98-L335 HydrophobicContact CG-CD2 3.83Å; P98-L335 HydrophobicContact CG-CG 3.75Å
99	V	95.6	Very high	96	Very high	109 Å²	109	44.9 Å²	44.9	66%	0.661	27%	0.269	S	S	*	.			trans	-127.4	111.5	171.8	-178.9	0	0	0	0	109.9	F71 N101	F71-V99 CarbonylContact C-O 3.58Å; F71-V99 VanDerWaalsContact C-O 3.29Å; F71-V99 WeakPolarHBondContact CA-O 3.29Å; F71-V99 PolarHBondContact O-N 3.33Å; V99-N101 PolarHBondContact O-N 3.01Å
100	L	96.4	Very high	96	Very high	50 Å²	50	44.5 Å²	44.5	26%	0.262	27%	0.267	S	S	.	.			trans	-64.2	132.3	-173.2	-179.9	63.8	0	0	0	113	L70 F71 V105 F125 L338	L70-L100 HydrophobicContact CD1-CD1 3.9Å; F71-L100 HydrophobicContact CD1-CB 4.35Å; F71-L100 HydrophobicContact CD1-CD1 4.29Å; F71-L100 HydrophobicContact CE1-CB 4.17Å; F71-L100 HydrophobicContact CE1-CD1 3.61Å; F71-L100 HydrophobicContact CE1-CG 4.47Å; F71-L100 HydrophobicContact CZ-CD1 4.22Å; L100-V105 HydrophobicContact CD1-CG2 4.03Å; L100-V105 HydrophobicContact CD2-CG2 3.65Å; L100-V105 HydrophobicContact CG-CG2 3.88Å; L100-F125 HydrophobicContact CD1-CE2 4.08Å; L100-F125 HydrophobicContact CD1-CZ 3.69Å; L100-F125 HydrophobicContact CD2-CE2 3.78Å; L100-F125 HydrophobicContact CD2-CZ 4.13Å; L100-L338 HydrophobicContact CD2-CD1 3.98Å; L100-L338 HydrophobicContact CD2-CD2 4.47Å
101	N	96.4	Very high	96.1	Very high	22 Å²	22	44.1 Å²	44.1	12%	0.118	27%	0.266	C	S	.	.			trans	-81.1	117	177.1	-171.8	-32.2	0	0	0	112.4	T68 K69 L70 V99 R103 C104 V105	T68-N101 PolarHBondContact O-ND2 2.68Å; T68-N101 PolarHBondContact OG1-ND2 2.81Å; K69-N101 WeakPolarHBondContact O-CB 3.36Å; K69-N101 PolarHBondContact O-ND2 3.14Å; L70-N101 WeakPolarHBondContact O-CB 3.4Å; L70-N101 PolarHBondContact O-N 3.35Å; V99-N101 PolarHBondContact O-N 3.01Å; N101-R103 PolarHBondContact O-N 3.29Å; N101-R103 WeakPolarHBondContact OD1-CB 3.29Å; N101-R103 PolarHBondContact OD1-N 3.22Å; N101-C104 HydrophobicContact CB-CB 4.18Å; N101-C104 WeakPolarHBondContact O-CB 3.28Å; N101-C104 PolarHBondContact O-N 2.97Å; N101-V105 PolarHBondContact O-N 3.45Å
102	K	95.3	Very high	96.2	Very high	69 Å²	69	42.3 Å²	42.3	30%	0.3	25%	0.25	S	S	.	.	H	α-helix	trans	-56.1	-44.2	178.2	174.3	170.6	165.7	167.9	0	113.1	C104 V105 E106 G354 A356 V357	K102-C104 VanDerWaalsContact C-N 3.26Å; K102-C104 PolarHBondContact O-N 3.06Å; K102-V105 WeakPolarHBondContact O-CB 3.44Å; K102-V105 PolarHBondContact O-N 3.45Å; K102-V105 VanDerWaalsContact O-N 3.11Å; K102-E106 WeakPolarHBondContact CE-OE1 3.41Å; K102-E106 HydrophobicContact CG-CG 4.29Å; K102-E106 IonicContact NZ-OE1 3.39Å; K102-E106 WeakPolarHBondContact O-CG 3.39Å; K102-E106 PolarHBondContact O-N 3.36Å; K102-G354 PolarHBondContact NZ-O 2.9Å; K102-A356 VanDerWaalsContact CE-O 3.31Å; K102-A356 WeakPolarHBondContact CE-O 3.31Å; K102-A356 PolarHBondContact NZ-O 3.16Å; K102-V357 HydrophobicContact CG-CG2 4.28Å
103	R	95.1	Very high	96.3	Very high	69 Å²	69	41.2 Å²	41.2	26%	0.26	24%	0.241	S	C	.	.	H	α-helix	trans	-61.2	-36.2	-179.4	171.9	60.3	-168	133.5	-6.2	111.8	N101 E106 A107 G236	N101-R103 PolarHBondContact O-N 3.29Å; N101-R103 WeakPolarHBondContact OD1-CB 3.29Å; N101-R103 PolarHBondContact OD1-N 3.22Å; R103-E106 PolarHBondContact O-N 2.9Å; R103-A107 WeakPolarHBondContact O-CB 3.5Å; R103-A107 PolarHBondContact O-N 3.1Å; R103-G236 PolarHBondContact NH2-O 3.48Å
104	C	96.9	Very high	96.4	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-65.6	-40.8	177.1	-67.5	0	0	0	0	111.7	I64 L70 N101 K102 A107 A108	I64-C104 HydrophobicContact CD1-CB 3.99Å; L70-C104 HydrophobicContact CD1-CB 3.47Å; L70-C104 VanDerWaalsContact CD1-CB 3.47Å; N101-C104 HydrophobicContact CB-CB 4.18Å; N101-C104 WeakPolarHBondContact O-CB 3.28Å; N101-C104 PolarHBondContact O-N 2.97Å; K102-C104 VanDerWaalsContact C-N 3.26Å; K102-C104 PolarHBondContact O-N 3.06Å; C104-A107 PolarHBondContact O-N 2.98Å; C104-A108 PolarHBondContact O-N 3.18Å; C104-A108 VanDerWaalsContact O-N 3.11Å
105	V	97.2	Very high	96.4	Very high	2 Å²	2	31.5 Å²	31.5	1%	0.012	18%	0.184	C	C	.	.	H	α-helix	trans	-64.4	-48	174.7	-179	0	0	0	0	111.3	L100 N101 K102 A107 A108 V109 L179 L338 V357	L100-V105 HydrophobicContact CD1-CG2 4.03Å; L100-V105 HydrophobicContact CD2-CG2 3.65Å; L100-V105 HydrophobicContact CG-CG2 3.88Å; N101-V105 PolarHBondContact O-N 3.45Å; K102-V105 WeakPolarHBondContact O-CB 3.44Å; K102-V105 PolarHBondContact O-N 3.45Å; K102-V105 VanDerWaalsContact O-N 3.11Å; V105-A107 VanDerWaalsContact C-N 3.26Å; V105-A107 PolarHBondContact O-N 2.91Å; V105-A108 PolarHBondContact O-N 3.14Å; V105-V109 HydrophobicContact CG1-CG2 4.24Å; V105-V109 WeakPolarHBondContact O-CG2 3.42Å; V105-V109 PolarHBondContact O-N 3.16Å; V105-L179 HydrophobicContact CG2-CD1 4.07Å; V105-L338 HydrophobicContact CG1-CD1 4.03Å; V105-L338 HydrophobicContact CG1-CD2 3.71Å; V105-L338 HydrophobicContact CG1-CG 4.42Å; V105-L338 HydrophobicContact CG2-CD1 4.2Å; V105-L338 HydrophobicContact CG2-CD2 4.01Å; V105-V357 HydrophobicContact CB-CG2 4.22Å; V105-V357 HydrophobicContact CG1-CB 4.48Å; V105-V357 HydrophobicContact CG1-CG1 4.36Å; V105-V357 HydrophobicContact CG1-CG2 3.86Å
106	E	96.4	Very high	96.5	Very high	45 Å²	45	33.6 Å²	33.6	21%	0.21	18%	0.175	C	C	.	.	H	α-helix	trans	-57.2	-42.4	177	-69.5	173.7	156.6	0	0	111.3	K102 R103 A108 V109 M110 V357 L362	K102-E106 WeakPolarHBondContact CE-OE1 3.41Å; K102-E106 HydrophobicContact CG-CG 4.29Å; K102-E106 IonicContact NZ-OE1 3.39Å; K102-E106 WeakPolarHBondContact O-CG 3.39Å; K102-E106 PolarHBondContact O-N 3.36Å; R103-E106 PolarHBondContact O-N 2.9Å; E106-A108 PolarHBondContact O-N 3.27Å; E106-V109 PolarHBondContact O-N 3.43Å; E106-M110 VanDerWaalsContact O-CB 3.31Å; E106-M110 WeakPolarHBondContact O-CB 3.32Å; E106-M110 WeakPolarHBondContact O-CG 3.34Å; E106-M110 PolarHBondContact O-N 3.39Å; E106-V357 HydrophobicContact CG-CG1 4.24Å; E106-V357 HydrophobicContact CG-CG2 4.19Å; E106-L362 HydrophobicContact CB-CD1 4.4Å; E106-L362 HydrophobicContact CB-CD2 4.11Å; E106-L362 HydrophobicContact CG-CD1 4.42Å; E106-L362 HydrophobicContact CG-CD2 4.15Å
107	A	96.7	Very high	96.6	Very high	0 Å²	0	32 Å²	32	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-61.5	-43.9	177.8	0	0	0	0	0	112.7	I64 R103 C104 V105 T111 T237	I64-A107 HydrophobicContact CG2-CB 3.64Å; R103-A107 WeakPolarHBondContact O-CB 3.5Å; R103-A107 PolarHBondContact O-N 3.1Å; C104-A107 PolarHBondContact O-N 2.98Å; V105-A107 VanDerWaalsContact C-N 3.26Å; V105-A107 PolarHBondContact O-N 2.91Å; A107-T111 WeakPolarHBondContact O-CB 3.39Å; A107-T111 PolarHBondContact O-N 3.22Å; A107-T111 PolarHBondContact O-OG1 3.4Å; A107-T237 HydrophobicContact CB-CG2 3.76Å
108	A	97.3	Very high	96.6	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-66.6	-42.2	176.5	0	0	0	0	0	112.1	C104 V105 E106 T111 G112 V148 L179 M207	C104-A108 PolarHBondContact O-N 3.18Å; C104-A108 VanDerWaalsContact O-N 3.11Å; V105-A108 PolarHBondContact O-N 3.14Å; E106-A108 PolarHBondContact O-N 3.27Å; A108-T111 PolarHBondContact O-N 3Å; A108-G112 PolarHBondContact O-N 3.35Å; A108-V148 HydrophobicContact CB-CB 4.42Å; A108-V148 HydrophobicContact CB-CG1 4.06Å; A108-V148 HydrophobicContact CB-CG2 4.47Å; A108-L179 HydrophobicContact CB-CD1 4.36Å; A108-L179 HydrophobicContact CB-CD2 3.77Å; A108-L179 HydrophobicContact CB-CG 3.99Å; A108-M207 HydrophobicContact CB-SD 4.4Å
109	V	97.5	Very high	96.7	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-66.3	-44.9	177.7	173.9	0	0	0	0	111.4	V105 E106 T111 G112 L113 I119 V148 V340 V357 L359 L362	V105-V109 HydrophobicContact CG1-CG2 4.24Å; V105-V109 WeakPolarHBondContact O-CG2 3.42Å; V105-V109 PolarHBondContact O-N 3.16Å; E106-V109 PolarHBondContact O-N 3.43Å; V109-T111 VanDerWaalsContact C-N 3.29Å; V109-T111 PolarHBondContact O-N 3.38Å; V109-G112 PolarHBondContact O-N 2.92Å; V109-L113 HydrophobicContact CG1-CD1 4.15Å; V109-L113 HydrophobicContact CG1-CG 4.41Å; V109-L113 WeakPolarHBondContact O-CG 3.47Å; V109-L113 PolarHBondContact O-N 2.92Å; V109-I119 HydrophobicContact CG1-CD1 4.42Å; V109-I119 HydrophobicContact CG1-CG1 4.38Å; V109-I119 HydrophobicContact CG1-CG2 4.26Å; V109-I119 HydrophobicContact CG2-CG2 4.27Å; V109-V148 HydrophobicContact CG2-CG1 3.68Å; V109-V340 HydrophobicContact CG2-CG2 4.32Å; V109-V357 HydrophobicContact CG2-CG1 4.38Å; V109-L359 HydrophobicContact CG1-CD2 3.59Å; V109-L362 HydrophobicContact CB-CD1 3.83Å; V109-L362 HydrophobicContact CG1-CD1 3.55Å
110	M	97.2	Very high	96.8	Very high	22 Å²	22	27.5 Å²	27.5	11%	0.108	14%	0.141	C	C	.	.	H	α-helix	trans	-58	-43.5	174.9	-74.2	174.8	75.5	0	0	111.4	E106 L113 A114 T237 L362 L366	E106-M110 VanDerWaalsContact O-CB 3.31Å; E106-M110 WeakPolarHBondContact O-CB 3.32Å; E106-M110 WeakPolarHBondContact O-CG 3.34Å; E106-M110 PolarHBondContact O-N 3.39Å; M110-L113 PolarHBondContact O-N 3.39Å; M110-A114 WeakPolarHBondContact O-CB 3.43Å; M110-A114 PolarHBondContact O-N 3.46Å; M110-T237 HydrophobicContact CB-CG2 4.38Å; M110-L362 HydrophobicContact CG-CB 4.22Å; M110-L362 HydrophobicContact CG-CD1 4.34Å; M110-L362 HydrophobicContact CG-CD2 3.85Å; M110-L362 HydrophobicContact CG-CG 4.36Å; M110-L362 HydrophobicContact SD-CD2 4.1Å; M110-L366 HydrophobicContact CB-CD2 4.11Å; M110-L366 HydrophobicContact CE-CD2 4.24Å; M110-L366 HydrophobicContact CG-CD2 4.3Å
111	T	97.1	Very high	96.7	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-64.9	-43.8	177.5	-55.2	0	0	0	0	111.1	A107 A108 V109 L113 A114 L115 I177 M207 L209 L232 T237	A107-T111 WeakPolarHBondContact O-CB 3.39Å; A107-T111 PolarHBondContact O-N 3.22Å; A107-T111 PolarHBondContact O-OG1 3.4Å; A108-T111 PolarHBondContact O-N 3Å; V109-T111 VanDerWaalsContact C-N 3.29Å; V109-T111 PolarHBondContact O-N 3.38Å; T111-L113 PolarHBondContact O-N 2.99Å; T111-A114 PolarHBondContact O-N 3.28Å; T111-L115 HydrophobicContact CG2-CD1 3.68Å; T111-L115 HydrophobicContact CG2-CG 4.41Å; T111-L115 WeakPolarHBondContact O-CB 3.49Å; T111-L115 VanDerWaalsContact O-CG 3.3Å; T111-L115 WeakPolarHBondContact O-CG 3.42Å; T111-L115 PolarHBondContact O-N 3.05Å; T111-I177 HydrophobicContact CG2-CD1 4.24Å; T111-M207 HydrophobicContact CG2-CE 3.7Å; T111-M207 HydrophobicContact CG2-SD 3.7Å; T111-M207 WeakPolarHBondContact OG1-CE 3.45Å; T111-L209 HydrophobicContact CG2-CD2 4.2Å; T111-L232 HydrophobicContact CG2-CD2 3.59Å; T111-T237 PolarHBondContact OG1-OG1 3.27Å
112	G	97.1	Very high	96.6	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-58.2	-45	173.7	0	0	0	0	0	112.6	A108 V109 L115 N116 C117	A108-G112 PolarHBondContact O-N 3.35Å; V109-G112 PolarHBondContact O-N 2.92Å; G112-L115 CarbonylContact O-C 3.53Å; G112-L115 PolarHBondContact O-N 2.98Å; G112-N116 PolarHBondContact O-N 3.27Å; G112-C117 VanDerWaalsContact O-CB 3.26Å; G112-C117 WeakPolarHBondContact O-CB 3.5Å; G112-C117 PolarHBondContact O-N 2.83Å
113	L	96.7	Very high	96.7	Very high	18 Å²	18	30.4 Å²	30.4	9%	0.094	15%	0.151	C	C	.	.	H	α-helix	trans	-63.7	-43.2	177.2	-69.3	172.1	0	0	0	112.1	V109 M110 T111 L115 N116 I119 L359 L362 R363 L366	V109-L113 HydrophobicContact CG1-CD1 4.15Å; V109-L113 HydrophobicContact CG1-CG 4.41Å; V109-L113 WeakPolarHBondContact O-CG 3.47Å; V109-L113 PolarHBondContact O-N 2.92Å; M110-L113 PolarHBondContact O-N 3.39Å; T111-L113 PolarHBondContact O-N 2.99Å; L113-L115 PolarHBondContact O-N 3.14Å; L113-N116 PolarHBondContact O-N 2.85Å; L113-N116 VanDerWaalsContact O-N 3.13Å; L113-I119 HydrophobicContact CD2-CD1 4.47Å; L113-I119 HydrophobicContact CD2-CG1 3.89Å; L113-I119 HydrophobicContact CG-CD1 4.35Å; L113-I119 HydrophobicContact CG-CG1 4.19Å; L113-L359 HydrophobicContact CD1-CD2 4.36Å; L113-L359 HydrophobicContact CD2-CD2 4.45Å; L113-L362 HydrophobicContact CD1-CB 4.18Å; L113-R363 HydrophobicContact CD1-CB 4.35Å; L113-L366 HydrophobicContact CB-CD1 3.91Å
114	A	96.3	Very high	96.8	Very high	7 Å²	7	28.6 Å²	28.6	6%	0.058	15%	0.147	C	C	.	.	H	α-helix	trans	-64.3	-30.4	178.4	0	0	0	0	0	113.1	M110 T111 N116 I231 L235 L369	M110-A114 WeakPolarHBondContact O-CB 3.43Å; M110-A114 PolarHBondContact O-N 3.46Å; T111-A114 PolarHBondContact O-N 3.28Å; A114-N116 VanDerWaalsContact C-N 3.3Å; A114-I231 HydrophobicContact CB-CG2 4.06Å; A114-L235 HydrophobicContact CB-CD1 3.68Å; A114-L235 HydrophobicContact CB-CD2 4.08Å; A114-L235 HydrophobicContact CB-CG 4.35Å; A114-L369 HydrophobicContact CB-CD1 4.31Å; A114-L369 HydrophobicContact CB-CD2 3.89Å
115	L	96.5	Very high	96.9	Very high	1 Å²	1	29 Å²	29	1%	0.005	15%	0.149	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.8	16.1	177.4	-62.3	173.6	0	0	0	112.6	T111 G112 L113 C117 G152 V153 L154 I174 I177 L209 L228 I231	T111-L115 HydrophobicContact CG2-CD1 3.68Å; T111-L115 HydrophobicContact CG2-CG 4.41Å; T111-L115 WeakPolarHBondContact O-CB 3.49Å; T111-L115 VanDerWaalsContact O-CG 3.3Å; T111-L115 WeakPolarHBondContact O-CG 3.42Å; T111-L115 PolarHBondContact O-N 3.05Å; G112-L115 CarbonylContact O-C 3.53Å; G112-L115 PolarHBondContact O-N 2.98Å; L113-L115 PolarHBondContact O-N 3.14Å; L115-C117 PolarHBondContact O-N 3.05Å; L115-C117 VanDerWaalsContact O-N 3.11Å; L115-G152 WeakPolarHBondContact O-CA 3.43Å; L115-V153 PolarHBondContact O-N 2.9Å; L115-L154 HydrophobicContact CD2-CB 4.33Å; L115-L154 HydrophobicContact CD2-CD1 3.77Å; L115-I174 HydrophobicContact CB-CD1 3.56Å; L115-I174 HydrophobicContact CD1-CD1 3.56Å; L115-I174 HydrophobicContact CD2-CD1 4.01Å; L115-I174 HydrophobicContact CG-CD1 3.89Å; L115-I177 HydrophobicContact CD1-CD1 4.01Å; L115-L209 HydrophobicContact CD1-CD2 3.7Å; L115-L228 HydrophobicContact CD1-CD1 3.82Å; L115-L228 HydrophobicContact CD2-CD1 4.25Å; L115-I231 HydrophobicContact CD2-CD1 3.86Å; L115-I231 HydrophobicContact CD2-CG2 4.48Å
116	N	96.1	Very high	96.9	Very high	127 Å²	127	28.9 Å²	28.9	68%	0.679	15%	0.148	S	C	*	.	T	Hydrogen-bonded Turn	trans	51.8	32.6	-179.8	-60.6	-45.1	0	0	0	114	G112 L113 A114	G112-N116 PolarHBondContact O-N 3.27Å; L113-N116 PolarHBondContact O-N 2.85Å; L113-N116 VanDerWaalsContact O-N 3.13Å; A114-N116 VanDerWaalsContact C-N 3.3Å
117	C	97.4	Very high	96.9	Very high	11 Å²	11	28.2 Å²	28.2	7%	0.074	14%	0.144	C	C	.	.			trans	-75.7	154.1	175.8	-56.4	0	0	0	0	111.1	G112 L115 I119 A149 V150 G152	G112-C117 VanDerWaalsContact O-CB 3.26Å; G112-C117 WeakPolarHBondContact O-CB 3.5Å; G112-C117 PolarHBondContact O-N 2.83Å; L115-C117 PolarHBondContact O-N 3.05Å; L115-C117 VanDerWaalsContact O-N 3.11Å; C117-I119 PolarHBondContact O-N 3.38Å; C117-A149 HydrophobicContact CB-CB 3.69Å; C117-V150 CarbonylContact C-O 3.59Å; C117-V150 WeakPolarHBondContact CA-O 3.21Å; C117-V150 WeakPolarHBondContact CB-O 3.19Å; C117-G152 WeakPolarHBondContact SG-CA 3.46Å
118	T	97.6	Very high	96.9	Very high	85 Å²	85	30.2 Å²	30.2	52%	0.521	15%	0.153	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	116	164.9	-58.8	0	0	0	0	109.5	A149 V150	T118-A149 WeakPolarHBondContact O-CA 3.2Å; T118-V150 PolarHBondContact N-O 3.11Å; T118-V150 PolarHBondContact O-N 3.3Å
119	I	97.7	Very high	96.8	Very high	22 Å²	22	32.1 Å²	32.1	11%	0.113	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	128.7	178.4	-50.8	-56.9	0	0	0	110.3	V109 L113 C117 K121 A149 V340 L359	V109-I119 HydrophobicContact CG1-CD1 4.42Å; V109-I119 HydrophobicContact CG1-CG1 4.38Å; V109-I119 HydrophobicContact CG1-CG2 4.26Å; V109-I119 HydrophobicContact CG2-CG2 4.27Å; L113-I119 HydrophobicContact CD2-CD1 4.47Å; L113-I119 HydrophobicContact CD2-CG1 3.89Å; L113-I119 HydrophobicContact CG-CD1 4.35Å; L113-I119 HydrophobicContact CG-CG1 4.19Å; C117-I119 PolarHBondContact O-N 3.38Å; I119-K121 PolarHBondContact O-N 3.48Å; I119-A149 HydrophobicContact CD1-CB 3.68Å; I119-V340 HydrophobicContact CG2-CG1 4.35Å; I119-L359 HydrophobicContact CB-CD2 4.2Å; I119-L359 HydrophobicContact CG1-CD2 4.06Å; I119-L359 HydrophobicContact CG2-CD2 4.08Å
120	N	97	Very high	96.5	Very high	27 Å²	27	35 Å²	35	14%	0.144	17%	0.173	C	C	.	.			trans	-76.1	112.1	173.9	-85.5	-52.5	0	0	0	110.7	K122 R146 P147 V148	N120-K122 PolarHBondContact O-N 3.38Å; N120-K122 VanDerWaalsContact O-N 3.12Å; N120-R146 HydrophobicContact CB-CG 4.45Å; N120-P147 WeakPolarHBondContact CB-O 3.49Å; N120-P147 PolarHBondContact ND2-O 3.18Å; N120-V148 PolarHBondContact N-O 3.42Å
121	K	94.6	Very high	96.3	Very high	108 Å²	108	41.9 Å²	41.9	47%	0.47	20%	0.202	S	C	.	.	S	Bend	trans	-59	-23.8	174.7	-60.9	-171.1	-178.9	-163.8	0	114	I119 L339 V340 E342	I119-K121 PolarHBondContact O-N 3.48Å; K121-L339 WeakPolarHBondContact O-CA 3.4Å; K121-V340 PolarHBondContact O-N 3.48Å; K121-E342 WeakPolarHBondContact CE-OE1 3.49Å; K121-E342 IonicContact NZ-OE1 3.33Å; K121-E342 PolarHBondContact NZ-OE1 3.25Å
122	K	96	Very high	96.1	Very high	93 Å²	93	48 Å²	48	40%	0.404	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130	123.4	173.5	178.6	176.4	-179.3	177.7	0	107.7	N120 R146 P337 L338 L339	N120-K122 PolarHBondContact O-N 3.38Å; N120-K122 VanDerWaalsContact O-N 3.12Å; K122-R146 WeakPolarHBondContact O-CD 3.43Å; K122-R146 WeakPolarHBondContact O-CG 3.35Å; K122-R146 VanDerWaalsContact O-CZ 3.28Å; K122-R146 PolarHBondContact O-NE 3.43Å; K122-P337 HydrophobicContact CG-CB 4.21Å; K122-L338 CarbonylContact C-O 3.56Å; K122-L338 WeakPolarHBondContact CA-O 3.45Å; K122-L339 HydrophobicContact CB-CD2 4.01Å; K122-L339 HydrophobicContact CD-CD2 4.44Å; K122-L339 HydrophobicContact CG-CD2 3.97Å
123	S	96.8	Very high	95.8	Very high	1 Å²	1	51.3 Å²	51.3	1%	0.007	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	152.8	176.8	176.2	0	0	0	0	109.6	Q143 R146 P337 L338	S123-Q143 PolarHBondContact OG-NE2 3.36Å; S123-R146 WeakPolarHBondContact CA-O 3.32Å; S123-R146 WeakPolarHBondContact CB-O 3.47Å; S123-R146 PolarHBondContact OG-O 3.4Å; S123-P337 CarbonylContact O-C 3.6Å; S123-L338 PolarHBondContact N-O 3.07Å; S123-L338 PolarHBondContact O-N 3.37Å
124	V	96.8	Very high	95.6	Very high	32 Å²	32	51.3 Å²	51.3	19%	0.194	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	146.3	-178.2	-59.8	0	0	0	0	110.4	R145 R146 P337	V124-R145 HydrophobicContact CG2-CB 4.35Å; V124-R146 HydrophobicContact CG2-CB 4.02Å; V124-R146 PolarHBondContact N-O 3.06Å; V124-P337 HydrophobicContact CG1-CB 4.25Å
125	F	98.1	Very high	95.6	Very high	7 Å²	7	51.5 Å²	51.5	3%	0.031	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	150.4	174.6	-71.2	-84.5	0	0	0	111.3	F71 L100 I141 T142 Q143 L179 E332 L335 L338	F71-F125 HydrophobicContact CE1-CE1 4.37Å; F71-F125 HydrophobicContact CE1-CZ 4.41Å; F71-F125 AromaticContact CZ-CD1 3.82Å; F71-F125 HydrophobicContact CZ-CD1 3.82Å; F71-F125 AromaticContact CZ-CE1 3.66Å; F71-F125 HydrophobicContact CZ-CE1 3.66Å; F71-F125 HydrophobicContact CZ-CG 4.4Å; F71-F125 HydrophobicContact CZ-CZ 4.13Å; L100-F125 HydrophobicContact CD1-CE2 4.08Å; L100-F125 HydrophobicContact CD1-CZ 3.69Å; L100-F125 HydrophobicContact CD2-CE2 3.78Å; L100-F125 HydrophobicContact CD2-CZ 4.13Å; F125-I141 HydrophobicContact CB-CG2 3.92Å; F125-I141 HydrophobicContact CD1-CG2 3.81Å; F125-I141 HydrophobicContact CG-CG2 4.16Å; F125-T142 CarbonylContact C-O 3.5Å; F125-T142 WeakPolarHBondContact CA-O 3.49Å; F125-Q143 HydrophobicContact CD1-CG 3.56Å; F125-Q143 HydrophobicContact CE1-CG 3.66Å; F125-Q143 HydrophobicContact CG-CG 4.23Å; F125-Q143 HydrophobicContact CZ-CG 4.39Å; F125-L179 HydrophobicContact CE1-CB 3.97Å; F125-L179 HydrophobicContact CZ-CB 4.36Å; F125-L179 HydrophobicContact CZ-CD1 4.18Å; F125-E332 HydrophobicContact CB-CB 3.96Å; F125-E332 HydrophobicContact CB-CG 4.48Å; F125-E332 PolarHBondContact O-N 3.27Å; F125-L335 HydrophobicContact CB-CD1 3.98Å; F125-L335 HydrophobicContact CD2-CD1 3.9Å; F125-L335 HydrophobicContact CG-CD1 3.9Å; F125-L338 HydrophobicContact CE2-CB 4.4Å
126	D	97.5	Very high	95.4	Very high	0 Å²	0	54 Å²	54	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	148.5	-174.9	-64.6	-52.9	0	0	0	109.6	I141 T142 Q144 R145 F329 M330	D126-I141 CarbonylContact O-C 3.56Å; D126-I141 WeakPolarHBondContact O-CA 3.26Å; D126-T142 PolarHBondContact N-O 3.31Å; D126-T142 PolarHBondContact O-N 3.26Å; D126-Q144 PolarHBondContact OD2-N 3.27Å; D126-R145 IonicContact OD1-CZ 2.84Å; D126-R145 IonicContact OD1-NE 3.93Å; D126-R145 PolarHBondContact OD1-NE 2.91Å; D126-R145 IonicContact OD1-NH2 2.79Å; D126-R145 PolarHBondContact OD1-NH2 3.02Å; D126-R145 PolarHBondContact OD2-N 2.75Å; D126-R145 IonicContact OD2-NE 3.5Å; D126-F329 HydrophobicContact CB-CD1 4.42Å; D126-M330 CarbonylContact C-O 3.49Å; D126-M330 VanDerWaalsContact CA-O 3.28Å; D126-M330 WeakPolarHBondContact CA-O 3.34Å
127	R	97.1	Very high	95.3	Very high	32 Å²	32	49.6 Å²	49.6	12%	0.121	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	120.6	169.8	-63.5	-174.8	-178.4	-178.4	4.1	109.5	H129 Y139 F329 M330 E332 N334	R127-H129 VanDerWaalsContact CB-CE1 3.47Å; R127-H129 WeakPolarHBondContact CB-CE1 3.33Å; R127-H129 PolarHBondContact O-ND1 2.72Å; R127-Y139 HydrophobicContact CB-CD2 3.93Å; R127-Y139 HydrophobicContact CB-CG 4.17Å; R127-Y139 HydrophobicContact CG-CD2 3.59Å; R127-Y139 HydrophobicContact CG-CE2 3.82Å; R127-Y139 HydrophobicContact CG-CG 4.18Å; R127-F329 WeakPolarHBondContact O-CA 3.42Å; R127-M330 PolarHBondContact N-O 2.9Å; R127-M330 PolarHBondContact O-N 3.33Å; R127-E332 HydrophobicContact CG-CB 4.38Å; R127-E332 WeakPolarHBondContact CG-OE2 3.5Å; R127-E332 IonicContact CZ-OE1 2.72Å; R127-E332 IonicContact CZ-OE2 2.67Å; R127-E332 VanDerWaalsContact NE-CD 3.34Å; R127-E332 IonicContact NE-OE1 2.64Å; R127-E332 PolarHBondContact NE-OE1 2.96Å; R127-E332 IonicContact NE-OE2 2.75Å; R127-E332 PolarHBondContact NE-OE2 3.2Å; R127-E332 IonicContact NH2-OE1 3.95Å; R127-E332 PolarHBondContact NH2-OE1 2.91Å; R127-E332 IonicContact NH2-OE2 3.56Å; R127-E332 PolarHBondContact NH2-OE2 3.31Å; R127-N334 PolarHBondContact NH2-ND2 3.44Å; R127-N334 VanDerWaalsContact NH2-ND2 3.11Å
128	K	96	Very high	95.1	Very high	42 Å²	42	49.6 Å²	49.6	18%	0.183	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	105.7	169.4	-179.3	-179.7	172	-171.4	0	108.2	Y130 Y139 Q140 T142 Y327 F329	K128-Y130 HydrophobicContact CD-CE1 4.38Å; K128-Y130 HydrophobicContact CG-CD1 4.2Å; K128-Y130 HydrophobicContact CG-CE1 4.28Å; K128-Y139 CarbonylContact O-C 3.55Å; K128-Y139 VanDerWaalsContact O-CA 3.24Å; K128-Y139 WeakPolarHBondContact O-CA 3.39Å; K128-Q140 HydrophobicContact CB-CB 4.4Å; K128-Q140 PolarHBondContact N-O 2.97Å; K128-Q140 PolarHBondContact O-N 2.9Å; K128-T142 HydrophobicContact CB-CG2 3.85Å; K128-T142 HydrophobicContact CD-CG2 4.39Å; K128-Y327 HydrophobicContact CG-CD1 4.18Å; K128-Y327 HydrophobicContact CG-CG 4.09Å; K128-F329 HydrophobicContact CB-CD1 4.12Å; K128-F329 HydrophobicContact CB-CE1 3.61Å; K128-F329 HydrophobicContact CB-CZ 4.09Å; K128-F329 HydrophobicContact CD-CE1 4.08Å; K128-F329 HydrophobicContact CD-CZ 3.89Å; K128-F329 HydrophobicContact CG-CE1 3.78Å; K128-F329 HydrophobicContact CG-CE2 4.42Å; K128-F329 HydrophobicContact CG-CZ 3.7Å
129	H	95.2	Very high	95	Very high	39 Å²	39	47.6 Å²	47.6	18%	0.181	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	120.7	-171.8	-62.3	86.4	0	0	0	111.6	R127 Y327 R328	R127-H129 VanDerWaalsContact CB-CE1 3.47Å; R127-H129 WeakPolarHBondContact CB-CE1 3.33Å; R127-H129 PolarHBondContact O-ND1 2.72Å; H129-Y327 WeakPolarHBondContact CA-O 3.17Å; H129-Y327 WeakPolarHBondContact CB-O 3.19Å; H129-Y327 PolarHBondContact N-O 3.43Å; H129-R328 PolarHBondContact CE1-O 2.86Å; H129-R328 PolarHBondContact ND1-O 3.16Å
130	Y	92.6	Very high	95	Very high	60 Å²	60	47 Å²	47	24%	0.235	23%	0.233	C	C	.	.			trans	-157.7	146.3	168	61	-81	0	0	0	109.4	K128 L135 G138 Q140 Y327	K128-Y130 HydrophobicContact CD-CE1 4.38Å; K128-Y130 HydrophobicContact CG-CD1 4.2Å; K128-Y130 HydrophobicContact CG-CE1 4.28Å; Y130-L135 HydrophobicContact CD1-CD2 4.2Å; Y130-L135 HydrophobicContact CD2-CD2 4.08Å; Y130-L135 HydrophobicContact CE1-CD2 3.77Å; Y130-L135 HydrophobicContact CE2-CD2 3.65Å; Y130-L135 HydrophobicContact CG-CD2 4.34Å; Y130-L135 VanDerWaalsContact CZ-CD2 3.47Å; Y130-G138 PolarHBondContact N-O 3.22Å; Y130-G138 CarbonylContact O-C 3.59Å; Y130-G138 VanDerWaalsContact O-O 3.1Å; Y130-Q140 HydrophobicContact CE1-CB 3.79Å; Y130-Y327 HydrophobicContact CD1-CD1 4.26Å; Y130-Y327 HydrophobicContact CD1-CE1 4.4Å; Y130-Y327 HydrophobicContact CG-CE1 4.43Å
131	F	93.1	Very high	95	Very high	167 Å²	167	45.8 Å²	45.8	73%	0.732	23%	0.226	S	C	*	.			trans	-97	121.3	-179	-63.3	-81.2	0	0	0	109.8
132	Y	91.9	Very high	95.1	Very high	130 Å²	130	40.7 Å²	40.7	51%	0.51	20%	0.204	S	C	.	.			trans	-151.2	150.8	171.6	-152.4	-98.3	0	0	0	109.6	D134 L135	Y132-D134 HydrophobicContact CD1-CB 4.39Å; Y132-D134 VanDerWaalsContact CD1-CG 3.45Å; Y132-D134 VanDerWaalsContact CD1-OD1 3.26Å; Y132-D134 WeakPolarHBondContact CD1-OD1 3.43Å; Y132-D134 PolarHBondContact O-N 3.4Å; Y132-L135 PolarHBondContact O-N 3.49Å; Y132-L135 VanDerWaalsContact O-N 3.09Å
133	A	91.8	Very high	95.1	Very high	68 Å²	68	36.3 Å²	36.3	56%	0.562	19%	0.185	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.2	-25.4	-171.7	0	0	0	0	0	113.7	I197	A133-I197 HydrophobicContact CB-CD1 3.63Å; A133-I197 HydrophobicContact CB-CG1 4.16Å
134	D	92.8	Very high	94.8	Very high	18 Å²	18	40.6 Å²	40.6	10%	0.096	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.3	1.7	177.7	65.9	19.4	0	0	0	114.3	Y132 P136 S183 G184	Y132-D134 HydrophobicContact CD1-CB 4.39Å; Y132-D134 VanDerWaalsContact CD1-CG 3.45Å; Y132-D134 VanDerWaalsContact CD1-OD1 3.26Å; Y132-D134 WeakPolarHBondContact CD1-OD1 3.43Å; Y132-D134 PolarHBondContact O-N 3.4Å; D134-P136 WeakPolarHBondContact O-CD 3.45Å; D134-S183 WeakPolarHBondContact OD1-CB 3.44Å; D134-G184 PolarHBondContact O-N 2.92Å
135	L	94.9	Very high	94.6	Very high	11 Å²	11	45.5 Å²	45.5	6%	0.058	22%	0.22	C	C	.	.			trans	-120.6	85	177.2	-172.5	73.1	0	0	0	109.9	Y130 Y132 A137 G138 Q140	Y130-L135 HydrophobicContact CD1-CD2 4.2Å; Y130-L135 HydrophobicContact CD2-CD2 4.08Å; Y130-L135 HydrophobicContact CE1-CD2 3.77Å; Y130-L135 HydrophobicContact CE2-CD2 3.65Å; Y130-L135 HydrophobicContact CG-CD2 4.34Å; Y130-L135 VanDerWaalsContact CZ-CD2 3.47Å; Y132-L135 PolarHBondContact O-N 3.49Å; Y132-L135 VanDerWaalsContact O-N 3.09Å; L135-A137 PolarHBondContact O-N 3.39Å; L135-A137 VanDerWaalsContact O-N 3.17Å; L135-G138 PolarHBondContact O-N 3.39Å; L135-G138 VanDerWaalsContact O-N 3.09Å; L135-Q140 HydrophobicContact CD1-CB 4.37Å; L135-Q140 HydrophobicContact CD2-CB 4.37Å
136	P	93	Very high	94.5	Very high	53 Å²	53	50.1 Å²	50.1	34%	0.344	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-27.9	-168.8	22.7	-32.3	0	0	0	113.7	D90 S92 D134 G138 L199	D90-P136 WeakPolarHBondContact O-CG 3.35Å; S92-P136 WeakPolarHBondContact OG-CB 3.4Å; D134-P136 WeakPolarHBondContact O-CD 3.45Å; P136-G138 VanDerWaalsContact C-N 3.27Å; P136-G138 PolarHBondContact O-N 3.49Å; P136-L199 HydrophobicContact CG-CD1 4.46Å; P136-L199 HydrophobicContact CG-CD2 4.26Å
137	A	93.1	Very high	94.5	Very high	36 Å²	36	50.5 Å²	50.5	30%	0.298	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.9	-16.1	179.9	0	0	0	0	0	113.6	S92 L135 Y139	S92-A137 WeakPolarHBondContact OG-CA 3.33Å; S92-A137 WeakPolarHBondContact OG-CB 3.46Å; S92-A137 PolarHBondContact OG-N 3.5Å; L135-A137 PolarHBondContact O-N 3.39Å; L135-A137 VanDerWaalsContact O-N 3.17Å; A137-Y139 HydrophobicContact CB-CD1 4.22Å; A137-Y139 HydrophobicContact CB-CD2 4.48Å; A137-Y139 HydrophobicContact CB-CE1 4.07Å; A137-Y139 HydrophobicContact CB-CE2 4.34Å; A137-Y139 HydrophobicContact CB-CG 4.43Å; A137-Y139 WeakPolarHBondContact O-CD1 3.47Å; A137-Y139 WeakPolarHBondContact O-CE1 3.28Å; A137-Y139 PolarHBondContact O-N 3.26Å
138	G	93.9	Very high	94.5	Very high	10 Å²	10	49 Å²	49	10%	0.103	23%	0.234	C	C	.	.	S	Bend	trans	68.5	8.8	-170.1	0	0	0	0	0	114.2	Y130 L135 P136	Y130-G138 PolarHBondContact N-O 3.22Å; Y130-G138 CarbonylContact O-C 3.59Å; Y130-G138 VanDerWaalsContact O-O 3.1Å; L135-G138 PolarHBondContact O-N 3.39Å; L135-G138 VanDerWaalsContact O-N 3.09Å; P136-G138 VanDerWaalsContact C-N 3.27Å; P136-G138 PolarHBondContact O-N 3.49Å
139	Y	95.3	Very high	94.5	Very high	44 Å²	44	47 Å²	47	17%	0.173	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.1	150.5	170.8	60.6	-95.2	0	0	0	110.7	R127 K128 A137 I141	R127-Y139 HydrophobicContact CB-CD2 3.93Å; R127-Y139 HydrophobicContact CB-CG 4.17Å; R127-Y139 HydrophobicContact CG-CD2 3.59Å; R127-Y139 HydrophobicContact CG-CE2 3.82Å; R127-Y139 HydrophobicContact CG-CG 4.18Å; K128-Y139 CarbonylContact O-C 3.55Å; K128-Y139 VanDerWaalsContact O-CA 3.24Å; K128-Y139 WeakPolarHBondContact O-CA 3.39Å; A137-Y139 HydrophobicContact CB-CD1 4.22Å; A137-Y139 HydrophobicContact CB-CD2 4.48Å; A137-Y139 HydrophobicContact CB-CE1 4.07Å; A137-Y139 HydrophobicContact CB-CE2 4.34Å; A137-Y139 HydrophobicContact CB-CG 4.43Å; A137-Y139 WeakPolarHBondContact O-CD1 3.47Å; A137-Y139 WeakPolarHBondContact O-CE1 3.28Å; A137-Y139 PolarHBondContact O-N 3.26Å; Y139-I141 HydrophobicContact CD2-CG1 4.22Å; Y139-I141 HydrophobicContact CE2-CD1 4.42Å; Y139-I141 HydrophobicContact CE2-CG1 3.94Å
140	Q	96.8	Very high	94.7	Very high	9 Å²	9	46.6 Å²	46.6	4%	0.042	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	128.8	174.3	-175.2	-169.5	25.7	0	0	108.1	K128 Y130 L135 E180 Q181	K128-Q140 HydrophobicContact CB-CB 4.4Å; K128-Q140 PolarHBondContact N-O 2.97Å; K128-Q140 PolarHBondContact O-N 2.9Å; Y130-Q140 HydrophobicContact CE1-CB 3.79Å; L135-Q140 HydrophobicContact CD1-CB 4.37Å; L135-Q140 HydrophobicContact CD2-CB 4.37Å; Q140-E180 VanDerWaalsContact NE2-CD 3.3Å; Q140-E180 PolarHBondContact NE2-OE1 2.7Å; Q140-E180 VanDerWaalsContact NE2-OE1 3.16Å; Q140-E180 PolarHBondContact NE2-OE2 2.94Å; Q140-Q181 HydrophobicContact CG-CB 4.35Å; Q140-Q181 WeakPolarHBondContact CG-O 3.19Å; Q140-Q181 PolarHBondContact NE2-O 3.23Å
141	I	97.4	Very high	94.9	Very high	1 Å²	1	49.2 Å²	49.2	1%	0.005	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	121.3	170.3	-56.2	173.1	0	0	0	108	F71 F89 P98 F125 D126 Y139 E180 Q181 E332 L335	F71-I141 HydrophobicContact CD2-CB 4.4Å; F71-I141 HydrophobicContact CD2-CD1 4.2Å; F71-I141 HydrophobicContact CE2-CB 3.73Å; F71-I141 HydrophobicContact CE2-CD1 4.24Å; F71-I141 HydrophobicContact CE2-CG2 3.57Å; F71-I141 HydrophobicContact CZ-CB 4.26Å; F71-I141 HydrophobicContact CZ-CG2 3.57Å; F89-I141 HydrophobicContact CZ-CD1 4.22Å; P98-I141 HydrophobicContact CB-CD1 4.18Å; P98-I141 HydrophobicContact CG-CD1 4.35Å; F125-I141 HydrophobicContact CB-CG2 3.92Å; F125-I141 HydrophobicContact CD1-CG2 3.81Å; F125-I141 HydrophobicContact CG-CG2 4.16Å; D126-I141 CarbonylContact O-C 3.56Å; D126-I141 WeakPolarHBondContact O-CA 3.26Å; Y139-I141 HydrophobicContact CD2-CG1 4.22Å; Y139-I141 HydrophobicContact CE2-CD1 4.42Å; Y139-I141 HydrophobicContact CE2-CG1 3.94Å; I141-E180 WeakPolarHBondContact O-CA 3.44Å; I141-Q181 HydrophobicContact CB-CG 4.22Å; I141-Q181 VanDerWaalsContact CB-OE1 3.24Å; I141-Q181 VanDerWaalsContact CG1-OE1 3.29Å; I141-Q181 PolarHBondContact O-N 3.44Å; I141-Q181 VanDerWaalsContact O-N 3.08Å; I141-E332 HydrophobicContact CG2-CG 4.5Å; I141-L335 HydrophobicContact CG2-CD1 4.22Å
142	T	97.1	Very high	95.1	Very high	2 Å²	2	41.3 Å²	41.3	1%	0.012	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	-169.3	-177.5	-173.8	0	0	0	0	110	F125 D126 K128 Q178 L179 E180 F329	F125-T142 CarbonylContact C-O 3.5Å; F125-T142 WeakPolarHBondContact CA-O 3.49Å; D126-T142 PolarHBondContact N-O 3.31Å; D126-T142 PolarHBondContact O-N 3.26Å; K128-T142 HydrophobicContact CB-CG2 3.85Å; K128-T142 HydrophobicContact CD-CG2 4.39Å; T142-Q178 PolarHBondContact OG1-NE2 3.27Å; T142-L179 CarbonylContact C-O 3.58Å; T142-L179 WeakPolarHBondContact CA-O 3.5Å; T142-E180 WeakPolarHBondContact OG1-CB 3.46Å; T142-E180 PolarHBondContact OG1-OE2 2.78Å; T142-F329 HydrophobicContact CG2-CE1 3.98Å
143	Q	96.8	Very high	95.3	Very high	0 Å²	0	37 Å²	37	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	99.2	176.7	-52.2	173.4	-48.7	0	0	110.7	S123 F125 Q178	S123-Q143 PolarHBondContact OG-NE2 3.36Å; F125-Q143 HydrophobicContact CD1-CG 3.56Å; F125-Q143 HydrophobicContact CE1-CG 3.66Å; F125-Q143 HydrophobicContact CG-CG 4.23Å; F125-Q143 HydrophobicContact CZ-CG 4.39Å; Q143-Q178 HydrophobicContact CB-CB 4.06Å; Q143-Q178 PolarHBondContact O-OE1 3.03Å
144	Q	90.5	Very high	95.5	Very high	91 Å²	91	33.8 Å²	33.8	43%	0.425	17%	0.17	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	-42.7	179.8	-168.4	-167.6	27	0	0	111.8	D126 F329	D126-Q144 PolarHBondContact OD2-N 3.27Å; Q144-F329 HydrophobicContact CB-CD1 3.87Å; Q144-F329 HydrophobicContact CB-CE1 3.87Å; Q144-F329 HydrophobicContact CG-CD1 4.25Å; Q144-F329 HydrophobicContact CG-CE1 4.13Å; Q144-F329 HydrophobicContact CG-CZ 4.38Å; Q144-F329 VanDerWaalsContact OE1-CD2 3.24Å
145	R	91.9	Very high	95.6	Very high	136 Å²	136	34.6 Å²	34.6	51%	0.513	18%	0.175	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	-37.2	-168.7	-69.3	177.2	-63.4	162.1	7.4	113.6	V124 D126 P331	V124-R145 HydrophobicContact CG2-CB 4.35Å; D126-R145 IonicContact OD1-CZ 2.84Å; D126-R145 IonicContact OD1-NE 3.93Å; D126-R145 PolarHBondContact OD1-NE 2.91Å; D126-R145 IonicContact OD1-NH2 2.79Å; D126-R145 PolarHBondContact OD1-NH2 3.02Å; D126-R145 PolarHBondContact OD2-N 2.75Å; D126-R145 IonicContact OD2-NE 3.5Å; R145-P331 VanDerWaalsContact NH1-CG 3.33Å
146	R	95.6	Very high	95.5	Very high	103 Å²	103	34.1 Å²	34.1	39%	0.389	17%	0.173	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-145	82	178.9	-159	165.6	-178.6	-174.8	-7.3	110.6	N120 K122 S123 V124	N120-R146 HydrophobicContact CB-CG 4.45Å; K122-R146 WeakPolarHBondContact O-CD 3.43Å; K122-R146 WeakPolarHBondContact O-CG 3.35Å; K122-R146 VanDerWaalsContact O-CZ 3.28Å; K122-R146 PolarHBondContact O-NE 3.43Å; S123-R146 WeakPolarHBondContact CA-O 3.32Å; S123-R146 WeakPolarHBondContact CB-O 3.47Å; S123-R146 PolarHBondContact OG-O 3.4Å; V124-R146 HydrophobicContact CG2-CB 4.02Å; V124-R146 PolarHBondContact N-O 3.06Å
147	P	97	Very high	95.4	Very high	8 Å²	8	32.1 Å²	32.1	5%	0.052	16%	0.16	C	C	.	.			trans	-65.6	168.3	-178.7	30.4	-37.5	0	0	0	111.7	N120 A149 V150 Q176 I177 Q178	N120-P147 WeakPolarHBondContact CB-O 3.49Å; N120-P147 PolarHBondContact ND2-O 3.18Å; P147-A149 PolarHBondContact O-N 3.38Å; P147-V150 HydrophobicContact CG-CG1 3.62Å; P147-Q176 HydrophobicContact CB-CB 4.28Å; P147-Q176 HydrophobicContact CG-CB 3.87Å; P147-I177 WeakPolarHBondContact CB-O 3.38Å; P147-Q178 HydrophobicContact CB-CB 3.95Å
148	V	97.2	Very high	95.1	Very high	1 Å²	1	31 Å²	31	1%	0.006	15%	0.149	C	C	.	.	S	Bend	trans	-62.9	-40.8	-178	169.5	0	0	0	0	112	A108 V109 N120 I177 L179 L338	A108-V148 HydrophobicContact CB-CB 4.42Å; A108-V148 HydrophobicContact CB-CG1 4.06Å; A108-V148 HydrophobicContact CB-CG2 4.47Å; V109-V148 HydrophobicContact CG2-CG1 3.68Å; N120-V148 PolarHBondContact N-O 3.42Å; V148-I177 PolarHBondContact N-O 3.28Å; V148-I177 VanDerWaalsContact N-O 3.15Å; V148-L179 HydrophobicContact CG2-CD1 3.92Å; V148-L179 HydrophobicContact CG2-CG 4.15Å; V148-L338 HydrophobicContact CG2-CD2 4.22Å
149	A	97.7	Very high	94.5	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	151.3	179.8	0	0	0	0	0	111.8	C117 T118 I119 P147 Q176 I177	C117-A149 HydrophobicContact CB-CB 3.69Å; T118-A149 WeakPolarHBondContact O-CA 3.2Å; I119-A149 HydrophobicContact CD1-CB 3.68Å; P147-A149 PolarHBondContact O-N 3.38Å; A149-Q176 CarbonylContact O-C 3.34Å; A149-Q176 WeakPolarHBondContact O-CA 3.4Å; A149-I177 HydrophobicContact CB-CB 4.16Å; A149-I177 HydrophobicContact CB-CD1 4.43Å; A149-I177 PolarHBondContact N-O 3.45Å; A149-I177 PolarHBondContact O-N 3.47Å
150	V	97.9	Very high	93.3	Very high	30 Å²	30	31.8 Å²	31.8	18%	0.182	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	163.8	-179.8	-63.5	0	0	0	0	110.8	C117 T118 P147 G152 K175 Q176	C117-V150 CarbonylContact C-O 3.59Å; C117-V150 WeakPolarHBondContact CA-O 3.21Å; C117-V150 WeakPolarHBondContact CB-O 3.19Å; T118-V150 PolarHBondContact N-O 3.11Å; T118-V150 PolarHBondContact O-N 3.3Å; P147-V150 HydrophobicContact CG-CG1 3.62Å; V150-G152 PolarHBondContact O-N 3.06Å; V150-K175 WeakPolarHBondContact CA-O 3.47Å; V150-Q176 HydrophobicContact CG1-CB 4.35Å
151	D	97.2	Very high	91.8	Very high	116 Å²	116	33.7 Å²	33.7	62%	0.62	18%	0.177	S	C	*	.	E	Extended strand (participates in β ladder)	trans	54.2	56.7	169.6	-54.3	-38.7	0	0	0	113.7	I174 K175	D151-I174 WeakPolarHBondContact CA-O 3.35Å; D151-I174 PolarHBondContact N-O 2.87Å; D151-K175 PolarHBondContact N-O 2.91Å
152	G	96.7	Very high	89.9	Confident	0 Å²	0	46 Å²	46	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	175.4	175.6	0	0	0	0	0	113.8	L115 C117 V150 Y173 I174	L115-G152 WeakPolarHBondContact O-CA 3.43Å; C117-G152 WeakPolarHBondContact SG-CA 3.46Å; V150-G152 PolarHBondContact O-N 3.06Å; G152-Y173 WeakPolarHBondContact O-CA 3.47Å; G152-I174 PolarHBondContact N-O 3.05Å; G152-I174 PolarHBondContact O-N 3.14Å
153	V	97.3	Very high	88.3	Confident	39 Å²	39	53.8 Å²	53.8	24%	0.236	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139	123.1	173.9	-176.2	0	0	0	0	109.4	L115 N171 Y173	L115-V153 PolarHBondContact O-N 2.9Å; V153-N171 HydrophobicContact CG1-CB 3.94Å; V153-Y173 HydrophobicContact CG2-CD1 3.65Å; V153-Y173 HydrophobicContact CG2-CE1 3.63Å
154	L	96.3	Very high	86.7	Confident	2 Å²	2	64.4 Å²	64.4	1%	0.01	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	120.4	167	174.3	66.2	0	0	0	109.1	L115 N171 V172 I174 M211 A224 E227 L228 I231	L115-L154 HydrophobicContact CD2-CB 4.33Å; L115-L154 HydrophobicContact CD2-CD1 3.77Å; L154-N171 CarbonylContact O-C 3.58Å; L154-N171 WeakPolarHBondContact O-CA 3.46Å; L154-V172 HydrophobicContact CB-CG1 3.8Å; L154-V172 HydrophobicContact CD2-CG1 4.05Å; L154-V172 HydrophobicContact CG-CG1 4.2Å; L154-V172 PolarHBondContact N-O 3.34Å; L154-V172 PolarHBondContact O-N 2.68Å; L154-I174 HydrophobicContact CB-CD1 4.04Å; L154-I174 HydrophobicContact CB-CG1 4.46Å; L154-M211 HydrophobicContact CD2-CE 3.56Å; L154-A224 HydrophobicContact CD2-CB 4.34Å; L154-A224 WeakPolarHBondContact CD2-O 3.24Å; L154-E227 HydrophobicContact CD1-CB 4.42Å; L154-E227 HydrophobicContact CD1-CG 3.97Å; L154-L228 HydrophobicContact CD2-CB 4.11Å; L154-I231 HydrophobicContact CD1-CD1 3.53Å
155	T	94.8	Very high	85.6	Confident	34 Å²	34	65.3 Å²	65.3	21%	0.209	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	117	171.4	-58.1	0	0	0	0	110.1	R169 K170 N171	T155-R169 HydrophobicContact CG2-CG 3.49Å; T155-R169 VanDerWaalsContact CG2-CG 3.49Å; T155-K170 CarbonylContact C-O 3.59Å; T155-K170 WeakPolarHBondContact CA-O 3.48Å; T155-N171 WeakPolarHBondContact CB-OD1 3.35Å; T155-N171 WeakPolarHBondContact CG2-OD1 3.45Å; T155-N171 PolarHBondContact OG1-OD1 3.13Å
156	Y	92.8	Very high	85.1	Confident	1 Å²	1	64.2 Å²	64.2	0%	0.004	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	157.1	-179.8	63.8	-83.3	0	0	0	111.2	F158 R169 K170 V172 E220 A223 A224	Y156-F158 HydrophobicContact CD2-CD1 4.27Å; Y156-F158 HydrophobicContact CE2-CD1 4.02Å; Y156-F158 HydrophobicContact CE2-CE1 4.29Å; Y156-R169 WeakPolarHBondContact O-CA 3.49Å; Y156-K170 HydrophobicContact CE1-CB 3.95Å; Y156-K170 HydrophobicContact CE2-CB 3.96Å; Y156-K170 PolarHBondContact N-O 3.06Å; Y156-K170 PolarHBondContact O-N 2.55Å; Y156-V172 HydrophobicContact CD1-CG1 4.05Å; Y156-V172 HydrophobicContact CE1-CB 4.06Å; Y156-V172 HydrophobicContact CE1-CG1 3.93Å; Y156-E220 HydrophobicContact CE2-CB 4.06Å; Y156-E220 HydrophobicContact CE2-CG 4.28Å; Y156-A223 HydrophobicContact CD2-CB 3.88Å; Y156-A223 HydrophobicContact CE2-CB 4.44Å; Y156-A224 HydrophobicContact CD1-CB 3.89Å; Y156-A224 HydrophobicContact CD2-CB 4.3Å; Y156-A224 HydrophobicContact CE1-CB 4.15Å; Y156-A224 HydrophobicContact CG-CB 3.97Å
157	S	90.3	Very high	84.4	Confident	11 Å²	11	61.5 Å²	61.5	8%	0.077	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	144.1	177.8	-59.2	0	0	0	0	110.3	M168 F389	S157-M168 CarbonylContact C-O 3.51Å; S157-M168 VanDerWaalsContact CA-O 3.24Å; S157-M168 WeakPolarHBondContact CA-O 3.47Å; S157-F389 WeakPolarHBondContact O-CE2 3.32Å; S157-F389 WeakPolarHBondContact O-CZ 3.25Å
158	F	86.5	Confident	83.9	Confident	14 Å²	14	64.5 Å²	64.5	6%	0.061	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	160.6	175.2	67.4	-80.3	0	0	0	110.6	Y156 M168 K170 E219 E220 A223	Y156-F158 HydrophobicContact CD2-CD1 4.27Å; Y156-F158 HydrophobicContact CE2-CD1 4.02Å; Y156-F158 HydrophobicContact CE2-CE1 4.29Å; F158-M168 HydrophobicContact CD1-CB 4.37Å; F158-M168 HydrophobicContact CE1-CB 3.97Å; F158-M168 HydrophobicContact CE2-CB 4.4Å; F158-M168 HydrophobicContact CZ-CB 4Å; F158-M168 HydrophobicContact CZ-SD 4.35Å; F158-M168 PolarHBondContact N-O 2.92Å; F158-M168 PolarHBondContact O-N 2.92Å; F158-K170 HydrophobicContact CE1-CD 3.97Å; F158-K170 HydrophobicContact CE1-CG 4.05Å; F158-K170 HydrophobicContact CZ-CD 4.42Å; F158-E219 HydrophobicContact CD2-CG 4.28Å; F158-E220 HydrophobicContact CD1-CG 4.35Å; F158-E220 HydrophobicContact CE1-CG 3.81Å; F158-E220 HydrophobicContact CE2-CG 4.28Å; F158-E220 HydrophobicContact CZ-CG 3.75Å; F158-A223 HydrophobicContact CB-CB 3.68Å
159	L	80.8	Confident	83.6	Confident	60 Å²	60	71.4 Å²	71.4	31%	0.314	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	111.6	178.3	-67.1	171.7	0	0	0	108.5	Q166 V167 F389	L159-Q166 WeakPolarHBondContact CA-O 3.37Å; L159-V167 HydrophobicContact CD2-CG2 3.85Å; L159-F389 HydrophobicContact CD1-CD1 4.4Å; L159-F389 HydrophobicContact CD1-CE1 4.17Å; L159-F389 HydrophobicContact CD2-CD1 4.47Å; L159-F389 HydrophobicContact CG-CD1 4.26Å; L159-F389 HydrophobicContact CG-CE1 3.97Å
160	G	70.6	Confident	83.4	Confident	9 Å²	9	74.7 Å²	74.7	9%	0.093	36%	0.355	C	S	.	.			trans	-158.7	-177.1	-173.7	0	0	0	0	0	113.1	Q166	G160-Q166 PolarHBondContact N-O 3.19Å; G160-Q166 WeakPolarHBondContact O-CB 3.41Å; G160-Q166 VanDerWaalsContact O-O 3.04Å
161	G	64.8	Low	83.3	Confident	49 Å²	49	77.3 Å²	77.3	51%	0.505	37%	0.368	S	S	.	.	S	Bend	trans	95.6	-170.9	177.6	0	0	0	0	0	114.9	K163	G161-K163 PolarHBondContact O-N 3.07Å; G161-K163 VanDerWaalsContact O-N 3.14Å
162	R	58.3	Low	83.2	Confident	261 Å²	261	71.8 Å²	71.8	99%	0.985	34%	0.338	S	S	*	.	S	Bend	trans	-60.5	-26.1	-174.1	-73.1	-173.2	179.5	-177.6	0.7	113.3
163	K	63.5	Low	83.3	Confident	164 Å²	164	78.1 Å²	78.1	71%	0.713	36%	0.363	S	S	*	.	S	Bend	trans	-115.2	123.3	168.5	-66.3	-178.5	-179.2	179.2	0	107.1	G161 N165 Q166	G161-K163 PolarHBondContact O-N 3.07Å; G161-K163 VanDerWaalsContact O-N 3.14Å; K163-N165 PolarHBondContact O-N 3.4Å; K163-Q166 PolarHBondContact O-N 3.04Å
164	R	62.8	Low	83.3	Confident	224 Å²	224	76.3 Å²	76.3	85%	0.845	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55	-11.9	-177.7	-85.4	-179.2	164.3	157.1	-4	115.9
165	N	68.3	Low	83.3	Confident	109 Å²	109	81.2 Å²	81.2	58%	0.583	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.7	8.6	-178.5	-63.7	10.5	0	0	0	113.4	K163	K163-N165 PolarHBondContact O-N 3.4Å
166	Q	80	Confident	83.4	Confident	113 Å²	113	81.4 Å²	81.4	53%	0.528	37%	0.372	S	S	.	.	P	Polyproline II helix	trans	-82.2	126.5	177.4	-179.7	173.4	30.6	0	0	110.2	L159 G160 K163 M168	L159-Q166 WeakPolarHBondContact CA-O 3.37Å; G160-Q166 PolarHBondContact N-O 3.19Å; G160-Q166 WeakPolarHBondContact O-CB 3.41Å; G160-Q166 VanDerWaalsContact O-O 3.04Å; K163-Q166 PolarHBondContact O-N 3.04Å; Q166-M168 PolarHBondContact O-N 3.03Å
167	V	82.4	Confident	83.6	Confident	47 Å²	47	81.3 Å²	81.3	29%	0.285	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	116.8	173	-176.8	0	0	0	0	108.5	L159 P385 E386	L159-V167 HydrophobicContact CD2-CG2 3.85Å; V167-P385 HydrophobicContact CG2-CB 4.37Å; V167-E386 HydrophobicContact CG2-CB 4.23Å
168	M	86.1	Confident	84	Confident	71 Å²	71	81.4 Å²	81.4	35%	0.35	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	134.3	172.3	-64	-165	68.4	0	0	109.3	S157 F158 Q166	S157-M168 CarbonylContact C-O 3.51Å; S157-M168 VanDerWaalsContact CA-O 3.24Å; S157-M168 WeakPolarHBondContact CA-O 3.47Å; F158-M168 HydrophobicContact CD1-CB 4.37Å; F158-M168 HydrophobicContact CE1-CB 3.97Å; F158-M168 HydrophobicContact CE2-CB 4.4Å; F158-M168 HydrophobicContact CZ-CB 4Å; F158-M168 HydrophobicContact CZ-SD 4.35Å; F158-M168 PolarHBondContact N-O 2.92Å; F158-M168 PolarHBondContact O-N 2.92Å; Q166-M168 PolarHBondContact O-N 3.03Å
169	R	90.1	Very high	84.5	Confident	145 Å²	145	80.7 Å²	80.7	55%	0.547	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	127.8	178.6	-167.8	170.9	-179.1	174.2	-2	108.9	T155 Y156	T155-R169 HydrophobicContact CG2-CG 3.49Å; T155-R169 VanDerWaalsContact CG2-CG 3.49Å; Y156-R169 WeakPolarHBondContact O-CA 3.49Å
170	K	93.3	Very high	85.3	Confident	70 Å²	70	78.1 Å²	78.1	30%	0.304	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	161	177.9	-79.3	-163.9	171.7	-167.7	0	110.4	T155 Y156 F158 E220	T155-K170 CarbonylContact C-O 3.59Å; T155-K170 WeakPolarHBondContact CA-O 3.48Å; Y156-K170 HydrophobicContact CE1-CB 3.95Å; Y156-K170 HydrophobicContact CE2-CB 3.96Å; Y156-K170 PolarHBondContact N-O 3.06Å; Y156-K170 PolarHBondContact O-N 2.55Å; F158-K170 HydrophobicContact CE1-CD 3.97Å; F158-K170 HydrophobicContact CE1-CG 4.05Å; F158-K170 HydrophobicContact CZ-CD 4.42Å; K170-E220 HydrophobicContact CD-CG 4.49Å; K170-E220 VanDerWaalsContact CE-OE1 3.23Å; K170-E220 WeakPolarHBondContact CE-OE1 3.26Å; K170-E220 VanDerWaalsContact NZ-CD 3.29Å; K170-E220 IonicContact NZ-OE1 3.36Å; K170-E220 PolarHBondContact NZ-OE1 3.13Å; K170-E220 IonicContact NZ-OE2 2.86Å; K170-E220 PolarHBondContact NZ-OE2 3.09Å
171	N	95.8	Very high	86.4	Confident	84 Å²	84	78.4 Å²	78.4	45%	0.449	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	144.4	176.9	-63.8	-25.3	0	0	0	109	V153 L154 T155	V153-N171 HydrophobicContact CG1-CB 3.94Å; L154-N171 CarbonylContact O-C 3.58Å; L154-N171 WeakPolarHBondContact O-CA 3.46Å; T155-N171 WeakPolarHBondContact CB-OD1 3.35Å; T155-N171 WeakPolarHBondContact CG2-OD1 3.45Å; T155-N171 PolarHBondContact OG1-OD1 3.13Å
172	V	96.4	Very high	87.8	Confident	0 Å²	0	76.3 Å²	76.3	0%	0	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	134	164.4	57.8	0	0	0	0	108.1	L154 Y156 M211 D214 M215 A224	L154-V172 HydrophobicContact CB-CG1 3.8Å; L154-V172 HydrophobicContact CD2-CG1 4.05Å; L154-V172 HydrophobicContact CG-CG1 4.2Å; L154-V172 PolarHBondContact N-O 3.34Å; L154-V172 PolarHBondContact O-N 2.68Å; Y156-V172 HydrophobicContact CD1-CG1 4.05Å; Y156-V172 HydrophobicContact CE1-CB 4.06Å; Y156-V172 HydrophobicContact CE1-CG1 3.93Å; V172-M211 HydrophobicContact CG1-SD 4.15Å; V172-M211 HydrophobicContact CG2-CB 3.92Å; V172-M211 HydrophobicContact CG2-CG 4.38Å; V172-M211 HydrophobicContact CG2-SD 4.42Å; V172-D214 HydrophobicContact CB-CB 4.4Å; V172-D214 HydrophobicContact CG2-CB 4.12Å; V172-M215 HydrophobicContact CG2-CE 4.05Å; V172-A224 HydrophobicContact CG1-CB 4.47Å
173	Y	97.6	Very high	89.4	Confident	133 Å²	133	64.9 Å²	64.9	52%	0.522	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	140.8	177.1	-69.5	-84.3	0	0	0	110.4	G152 V153 M211 E212 D214	G152-Y173 WeakPolarHBondContact O-CA 3.47Å; V153-Y173 HydrophobicContact CG2-CD1 3.65Å; V153-Y173 HydrophobicContact CG2-CE1 3.63Å; Y173-M211 WeakPolarHBondContact O-CA 3.49Å; Y173-E212 PolarHBondContact O-N 3.26Å; Y173-D214 WeakPolarHBondContact CD2-OD2 3.46Å; Y173-D214 PolarHBondContact N-OD2 3.42Å
174	I	97.4	Very high	90.8	Very high	1 Å²	1	57 Å²	57	1%	0.005	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	116.3	174.2	-63.7	156.2	0	0	0	106.8	L115 D151 G152 L154 I177	L115-I174 HydrophobicContact CB-CD1 3.56Å; L115-I174 HydrophobicContact CD1-CD1 3.56Å; L115-I174 HydrophobicContact CD2-CD1 4.01Å; L115-I174 HydrophobicContact CG-CD1 3.89Å; D151-I174 WeakPolarHBondContact CA-O 3.35Å; D151-I174 PolarHBondContact N-O 2.87Å; G152-I174 PolarHBondContact N-O 3.05Å; G152-I174 PolarHBondContact O-N 3.14Å; L154-I174 HydrophobicContact CB-CD1 4.04Å; L154-I174 HydrophobicContact CB-CG1 4.46Å; I174-I177 HydrophobicContact CG2-CG1 4Å
175	K	96.9	Very high	92.2	Very high	106 Å²	106	51.5 Å²	51.5	46%	0.461	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.7	-50.6	178.3	-175.1	175	-172.8	164.4	0	111	V150 D151 V210 E212	V150-K175 WeakPolarHBondContact CA-O 3.47Å; D151-K175 PolarHBondContact N-O 2.91Å; K175-V210 HydrophobicContact CB-CB 4.35Å; K175-V210 HydrophobicContact CB-CG1 4.28Å; K175-V210 WeakPolarHBondContact CB-O 3.41Å; K175-V210 HydrophobicContact CD-CG1 4.29Å; K175-V210 PolarHBondContact N-O 2.92Å; K175-E212 HydrophobicContact CB-CG 4.33Å; K175-E212 WeakPolarHBondContact CB-OE1 3.23Å; K175-E212 WeakPolarHBondContact CD-OE1 3.19Å; K175-E212 WeakPolarHBondContact CG-OE1 3.5Å
176	Q	97.1	Very high	93.3	Very high	37 Å²	37	47.7 Å²	47.7	17%	0.173	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-159.2	157.6	-176.5	61.6	-178.4	25.7	0	0	113.1	P147 A149 V150 V210	P147-Q176 HydrophobicContact CB-CB 4.28Å; P147-Q176 HydrophobicContact CG-CB 3.87Å; A149-Q176 CarbonylContact O-C 3.34Å; A149-Q176 WeakPolarHBondContact O-CA 3.4Å; V150-Q176 HydrophobicContact CG1-CB 4.35Å; Q176-V210 HydrophobicContact CG-CB 3.97Å; Q176-V210 HydrophobicContact CG-CG2 3.93Å; Q176-V210 PolarHBondContact O-N 2.96Å
177	I	97.8	Very high	93.7	Very high	0 Å²	0	45.8 Å²	45.8	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	117.6	168.7	-56.6	180	0	0	0	107.8	T111 L115 P147 V148 A149 I174 M207 E208 L209	T111-I177 HydrophobicContact CG2-CD1 4.24Å; L115-I177 HydrophobicContact CD1-CD1 4.01Å; P147-I177 WeakPolarHBondContact CB-O 3.38Å; V148-I177 PolarHBondContact N-O 3.28Å; V148-I177 VanDerWaalsContact N-O 3.15Å; A149-I177 HydrophobicContact CB-CB 4.16Å; A149-I177 HydrophobicContact CB-CD1 4.43Å; A149-I177 PolarHBondContact N-O 3.45Å; A149-I177 PolarHBondContact O-N 3.47Å; I174-I177 HydrophobicContact CG2-CG1 4Å; I177-M207 HydrophobicContact CG2-CG 3.38Å; I177-M207 HydrophobicContact CG2-SD 3.43Å; I177-M207 WeakPolarHBondContact CG2-SD 3.36Å; I177-E208 WeakPolarHBondContact CA-O 3.5Å; I177-L209 HydrophobicContact CD1-CD2 4.08Å; I177-L209 HydrophobicContact CG1-CD2 4.16Å; I177-L209 HydrophobicContact CG1-CG 4.23Å; I177-L209 HydrophobicContact CG2-CG 4.48Å
178	Q	97.4	Very high	94	Very high	12 Å²	12	49.4 Å²	49.4	6%	0.056	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	150.9	-178.7	64.3	-171.9	43.6	0	0	112	T142 Q143 P147 M207 E208	T142-Q178 PolarHBondContact OG1-NE2 3.27Å; Q143-Q178 HydrophobicContact CB-CB 4.06Å; Q143-Q178 PolarHBondContact O-OE1 3.03Å; P147-Q178 HydrophobicContact CB-CB 3.95Å; Q178-M207 CarbonylContact O-C 3.59Å; Q178-M207 WeakPolarHBondContact O-CA 3.38Å; Q178-E208 HydrophobicContact CG-CB 3.69Å; Q178-E208 HydrophobicContact CG-CG 4.32Å; Q178-E208 PolarHBondContact N-O 2.86Å; Q178-E208 PolarHBondContact NE2-OE1 3.19Å; Q178-E208 VanDerWaalsContact NE2-OE1 3.15Å; Q178-E208 PolarHBondContact NE2-OE2 2.98Å; Q178-E208 PolarHBondContact O-N 3.02Å
179	L	97.9	Very high	94.2	Very high	0 Å²	0	48 Å²	48	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	135.2	171.9	-73.1	171.8	0	0	0	110.4	I64 V105 A108 F125 T142 V148 L206	I64-L179 HydrophobicContact CD1-CD2 3.42Å; I64-L179 VanDerWaalsContact CD1-CD2 3.42Å; V105-L179 HydrophobicContact CG2-CD1 4.07Å; A108-L179 HydrophobicContact CB-CD1 4.36Å; A108-L179 HydrophobicContact CB-CD2 3.77Å; A108-L179 HydrophobicContact CB-CG 3.99Å; F125-L179 HydrophobicContact CE1-CB 3.97Å; F125-L179 HydrophobicContact CZ-CB 4.36Å; F125-L179 HydrophobicContact CZ-CD1 4.18Å; T142-L179 CarbonylContact C-O 3.58Å; T142-L179 WeakPolarHBondContact CA-O 3.5Å; V148-L179 HydrophobicContact CG2-CD1 3.92Å; V148-L179 HydrophobicContact CG2-CG 4.15Å; L179-L206 WeakPolarHBondContact CA-O 3.29Å
180	E	96.3	Very high	94.1	Very high	5 Å²	5	47.9 Å²	47.9	2%	0.023	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.7	163.8	174.7	66.7	169.7	-142.4	0	0	113.6	H61 L70 Q140 I141 T142 L206	H61-E180 IonicContact CD2-OE1 3.28Å; H61-E180 PolarHBondContact CD2-OE1 2.97Å; H61-E180 IonicContact NE2-OE1 2.78Å; L70-E180 VanDerWaalsContact CD2-O 3.31Å; L70-E180 WeakPolarHBondContact CD2-O 3.29Å; Q140-E180 VanDerWaalsContact NE2-CD 3.3Å; Q140-E180 PolarHBondContact NE2-OE1 2.7Å; Q140-E180 VanDerWaalsContact NE2-OE1 3.16Å; Q140-E180 PolarHBondContact NE2-OE2 2.94Å; I141-E180 WeakPolarHBondContact O-CA 3.44Å; T142-E180 WeakPolarHBondContact OG1-CB 3.46Å; T142-E180 PolarHBondContact OG1-OE2 2.78Å; E180-L206 HydrophobicContact CG-CB 3.85Å; E180-L206 HydrophobicContact CG-CD1 4.42Å; E180-L206 PolarHBondContact N-O 2.92Å; E180-L206 PolarHBondContact O-N 2.88Å
181	Q	94.4	Very high	93.9	Very high	16 Å²	16	50.7 Å²	50.7	8%	0.075	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	136.3	174.4	-64.6	176.7	-62.7	0	0	111.3	L70 F71 Q140 I141	L70-Q181 HydrophobicContact CD2-CG 4.18Å; F71-Q181 HydrophobicContact CD2-CG 3.46Å; F71-Q181 VanDerWaalsContact CD2-CG 3.46Å; F71-Q181 HydrophobicContact CE2-CG 3.56Å; Q140-Q181 HydrophobicContact CG-CB 4.35Å; Q140-Q181 WeakPolarHBondContact CG-O 3.19Å; Q140-Q181 PolarHBondContact NE2-O 3.23Å; I141-Q181 HydrophobicContact CB-CG 4.22Å; I141-Q181 VanDerWaalsContact CB-OE1 3.24Å; I141-Q181 VanDerWaalsContact CG1-OE1 3.29Å; I141-Q181 PolarHBondContact O-N 3.44Å; I141-Q181 VanDerWaalsContact O-N 3.08Å
182	D	94.1	Very high	93.7	Very high	5 Å²	5	51.4 Å²	51.4	3%	0.027	26%	0.257	C	S	.	.	P	Polyproline II helix	trans	-73	153.6	166	-153.2	-1.7	0	0	0	111.7	R201 A202 G203 V204 L206 R251	D182-R201 HydrophobicContact CB-CG 4.28Å; D182-R201 IonicContact OD1-CZ 3Å; D182-R201 IonicContact OD1-NE 2.69Å; D182-R201 WeakPolarHBondContact OD2-CD 3.47Å; D182-R201 WeakPolarHBondContact OD2-CG 3.44Å; D182-R201 IonicContact OD2-CZ 3.68Å; D182-R201 IonicContact OD2-NE 3.43Å; D182-R201 PolarHBondContact OD2-NE 3.46Å; D182-A202 WeakPolarHBondContact O-CA 3.49Å; D182-G203 PolarHBondContact O-N 3.03Å; D182-V204 HydrophobicContact CB-CB 4.17Å; D182-V204 PolarHBondContact N-O 3.23Å; D182-L206 HydrophobicContact CB-CD1 3.72Å; D182-L206 HydrophobicContact CB-CD2 4.06Å; D182-L206 HydrophobicContact CB-CG 3.78Å; D182-R251 VanDerWaalsContact CG-NH2 3.27Å; D182-R251 IonicContact OD1-CZ 2.62Å; D182-R251 IonicContact OD1-NH1 3.93Å; D182-R251 PolarHBondContact OD1-NH1 3.34Å; D182-R251 IonicContact OD1-NH2 2.95Å; D182-R251 PolarHBondContact OD1-NH2 2.85Å; D182-R251 IonicContact OD2-CZ 3.66Å; D182-R251 IonicContact OD2-NH1 2.74Å; D182-R251 PolarHBondContact OD2-NH1 2.98Å; D182-R251 IonicContact OD2-NH2 2.82Å; D182-R251 PolarHBondContact OD2-NH2 2.84Å
183	S	92.9	Very high	93.5	Very high	20 Å²	20	56.8 Å²	56.8	14%	0.14	29%	0.294	C	S	.	.	P	Polyproline II helix	trans	-84.8	165.1	170.3	72.9	0	0	0	0	111.5	D134 R201	D134-S183 WeakPolarHBondContact OD1-CB 3.44Å; S183-R201 PolarHBondContact O-NE 2.69Å
184	G	92.6	Very high	93.3	Very high	0 Å²	0	56 Å²	56	0%	0	30%	0.296	C	S	.	.			trans	-63.8	-171.8	169.7	0	0	0	0	0	112.5	D134 D198 R201	D134-G184 PolarHBondContact O-N 2.92Å; G184-D198 CarbonylContact C-O 3.47Å; G184-D198 WeakPolarHBondContact CA-O 3.46Å; G184-R201 PolarHBondContact O-NH2 3.48Å
185	K	90.9	Very high	93.1	Very high	108 Å²	108	59.2 Å²	59.2	47%	0.47	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	128.1	175.3	-168.9	-179.8	-175.5	-176.5	0	109.6	L187 D198	K185-L187 HydrophobicContact CD-CD2 4.03Å; K185-L187 HydrophobicContact CD-CG 4.45Å; K185-L187 HydrophobicContact CG-CD2 4.32Å; K185-L187 HydrophobicContact CG-CG 4.46Å; K185-D198 HydrophobicContact CB-CB 4.48Å; K185-D198 PolarHBondContact N-O 3.3Å; K185-D198 PolarHBondContact O-N 3.03Å
186	S	91.2	Very high	93	Very high	28 Å²	28	58.3 Å²	58.3	20%	0.196	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	126.4	168.6	-59.8	0	0	0	0	109.3	I197	S186-I197 WeakPolarHBondContact OG-CD1 3.4Å
187	L	89.4	Confident	92.9	Very high	74 Å²	74	58.9 Å²	58.9	39%	0.387	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	116.4	175.5	-64.7	169.7	0	0	0	108.1	K185 T195 L196	K185-L187 HydrophobicContact CD-CD2 4.03Å; K185-L187 HydrophobicContact CD-CG 4.45Å; K185-L187 HydrophobicContact CG-CD2 4.32Å; K185-L187 HydrophobicContact CG-CG 4.46Å; L187-T195 CarbonylContact O-C 3.52Å; L187-T195 WeakPolarHBondContact O-CA 3.19Å; L187-L196 HydrophobicContact CB-CB 4.28Å; L187-L196 PolarHBondContact N-O 2.91Å; L187-L196 PolarHBondContact O-N 3.38Å
188	H	89.1	Confident	92.7	Very high	123 Å²	123	60.1 Å²	60.1	57%	0.569	33%	0.326	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84.5	120.8	176.6	-62.9	-54.5	0	0	0	109.7	T195	H188-T195 PolarHBondContact CE1-OG1 2.78Å; H188-T195 PolarHBondContact ND1-OG1 3.38Å
189	D	89	Confident	92.6	Very high	41 Å²	41	60.8 Å²	60.8	22%	0.219	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	94	171.7	-178.8	-6.2	0	0	0	108.2	V191 N192 S193 Q194	D189-V191 PolarHBondContact O-N 3.34Å; D189-V191 WeakPolarHBondContact OD1-CB 3.4Å; D189-V191 PolarHBondContact OD1-N 2.91Å; D189-V191 VanDerWaalsContact OD1-N 3.09Å; D189-N192 PolarHBondContact O-N 3.4Å; D189-N192 PolarHBondContact OD1-N 3.42Å; D189-N192 PolarHBondContact OD2-ND2 2.9Å; D189-S193 WeakPolarHBondContact O-CA 3.46Å; D189-S193 PolarHBondContact O-N 3.46Å; D189-Q194 PolarHBondContact N-O 2.93Å; D189-Q194 PolarHBondContact O-N 3.07Å; D189-Q194 VanDerWaalsContact O-N 3.13Å
190	D	87.6	Confident	92.5	Very high	142 Å²	142	61.6 Å²	61.6	76%	0.759	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.8	-29.7	-179.1	-64.9	-31.6	0	0	0	112.1	S193	D190-S193 PolarHBondContact O-N 3.37Å
191	V	90.6	Very high	92.3	Very high	130 Å²	130	65.1 Å²	65.1	79%	0.788	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.3	-45.5	-177.6	-179.9	0	0	0	0	110.2	D189	D189-V191 PolarHBondContact O-N 3.34Å; D189-V191 WeakPolarHBondContact OD1-CB 3.4Å; D189-V191 PolarHBondContact OD1-N 2.91Å; D189-V191 VanDerWaalsContact OD1-N 3.09Å
192	N	90.8	Very high	92.3	Very high	99 Å²	99	64.6 Å²	64.6	53%	0.529	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.5	-1.2	-179.8	-64.5	-52.3	0	0	0	113.1	D189 Q194	D189-N192 PolarHBondContact O-N 3.4Å; D189-N192 PolarHBondContact OD1-N 3.42Å; D189-N192 PolarHBondContact OD2-ND2 2.9Å; N192-Q194 HydrophobicContact CB-CG 4.5Å; N192-Q194 WeakPolarHBondContact O-CG 3.24Å; N192-Q194 PolarHBondContact O-N 3.42Å
193	S	92.6	Very high	92.3	Very high	112 Å²	112	64.6 Å²	64.6	78%	0.783	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	52	40.3	-174.7	-60.8	0	0	0	0	112.4	D189 D190	D189-S193 WeakPolarHBondContact O-CA 3.46Å; D189-S193 PolarHBondContact O-N 3.46Å; D190-S193 PolarHBondContact O-N 3.37Å
194	Q	93.8	Very high	92.4	Very high	118 Å²	118	63.9 Å²	63.9	55%	0.551	34%	0.341	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-124.3	157.4	-178.3	-74.1	177.7	10.6	0	0	110.6	D189 N192	D189-Q194 PolarHBondContact N-O 2.93Å; D189-Q194 PolarHBondContact O-N 3.07Å; D189-Q194 VanDerWaalsContact O-N 3.13Å; N192-Q194 HydrophobicContact CB-CG 4.5Å; N192-Q194 WeakPolarHBondContact O-CG 3.24Å; N192-Q194 PolarHBondContact O-N 3.42Å
195	T	92.3	Very high	92.5	Very high	68 Å²	68	63.9 Å²	63.9	42%	0.417	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	121.9	170.4	-57.4	0	0	0	0	108.6	L187 H188 I197	L187-T195 CarbonylContact O-C 3.52Å; L187-T195 WeakPolarHBondContact O-CA 3.19Å; H188-T195 PolarHBondContact CE1-OG1 2.78Å; H188-T195 PolarHBondContact ND1-OG1 3.38Å; T195-I197 HydrophobicContact CG2-CD1 3.87Å
196	L	94.4	Very high	92.7	Very high	87 Å²	87	58.8 Å²	58.8	46%	0.455	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	130.8	177.6	-53.1	175	0	0	0	108.5	L187	L187-L196 HydrophobicContact CB-CB 4.28Å; L187-L196 PolarHBondContact N-O 2.91Å; L187-L196 PolarHBondContact O-N 3.38Å
197	I	94.9	Very high	93	Very high	49 Å²	49	57.5 Å²	57.5	25%	0.251	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	124.7	-177.7	-53.4	-59.8	0	0	0	109.7	N83 A133 S186 T195 L199	N83-I197 PolarHBondContact ND2-O 3.1Å; N83-I197 VanDerWaalsContact ND2-O 3.11Å; A133-I197 HydrophobicContact CB-CD1 3.63Å; A133-I197 HydrophobicContact CB-CG1 4.16Å; S186-I197 WeakPolarHBondContact OG-CD1 3.4Å; T195-I197 HydrophobicContact CG2-CD1 3.87Å; I197-L199 HydrophobicContact CG2-CD2 3.68Å; I197-L199 HydrophobicContact CG2-CG 4.19Å
198	D	94.9	Very high	93.3	Very high	26 Å²	26	54.6 Å²	54.6	14%	0.139	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	115.4	171	-178	11.5	0	0	0	110.4	N83 G184 K185 N200	N83-D198 PolarHBondContact N-OD1 3.23Å; G184-D198 CarbonylContact C-O 3.47Å; G184-D198 WeakPolarHBondContact CA-O 3.46Å; K185-D198 HydrophobicContact CB-CB 4.48Å; K185-D198 PolarHBondContact N-O 3.3Å; K185-D198 PolarHBondContact O-N 3.03Å; D198-N200 WeakPolarHBondContact OD1-CB 3.37Å; D198-N200 PolarHBondContact OD1-N 3.18Å; D198-N200 PolarHBondContact OD1-ND2 2.85Å; D198-N200 PolarHBondContact OD2-ND2 3.31Å
199	L	95.4	Very high	93.7	Very high	26 Å²	26	48.8 Å²	48.8	14%	0.136	27%	0.267	C	S	.	.			trans	-92	4.4	-177.8	-59.5	-179.6	0	0	0	113.5	N83 V86 P136 I197 R201 A202	N83-L199 WeakPolarHBondContact OD1-CB 3.49Å; N83-L199 PolarHBondContact OD1-N 2.97Å; V86-L199 HydrophobicContact CG1-CB 4.19Å; V86-L199 HydrophobicContact CG2-CB 3.88Å; P136-L199 HydrophobicContact CG-CD1 4.46Å; P136-L199 HydrophobicContact CG-CD2 4.26Å; I197-L199 HydrophobicContact CG2-CD2 3.68Å; I197-L199 HydrophobicContact CG2-CG 4.19Å; L199-R201 PolarHBondContact O-N 3.34Å; L199-A202 HydrophobicContact CB-CB 4.24Å; L199-A202 HydrophobicContact CD2-CB 4.22Å; L199-A202 WeakPolarHBondContact O-CB 3.41Å; L199-A202 PolarHBondContact O-N 2.86Å
200	N	94.3	Very high	94.1	Very high	16 Å²	16	48.1 Å²	48.1	9%	0.086	27%	0.265	C	S	.	.	S	Bend	trans	-51.8	-41.3	176.6	-77.3	-28.1	0	0	0	112.6	K69 P81 P82 N83 S84 L85 D198	K69-N200 WeakPolarHBondContact CE-O 3.46Å; K69-N200 PolarHBondContact NZ-O 3.37Å; K69-N200 VanDerWaalsContact NZ-O 3.1Å; P81-N200 PolarHBondContact O-ND2 2.89Å; P82-N200 WeakPolarHBondContact CA-ND2 3.33Å; N83-N200 WeakPolarHBondContact CA-OD1 3.34Å; N83-N200 PolarHBondContact N-ND2 3.06Å; N83-N200 PolarHBondContact N-OD1 2.92Å; S84-N200 PolarHBondContact N-OD1 3.34Å; L85-N200 PolarHBondContact N-OD1 2.84Å; D198-N200 WeakPolarHBondContact OD1-CB 3.37Å; D198-N200 PolarHBondContact OD1-N 3.18Å; D198-N200 PolarHBondContact OD1-ND2 2.85Å; D198-N200 PolarHBondContact OD2-ND2 3.31Å
201	R	92.6	Very high	94.5	Very high	79 Å²	79	41.6 Å²	41.6	30%	0.298	23%	0.23	S	C	.	.	S	Bend	trans	-80.7	-21.3	179.3	-165.9	177.8	69.9	168.5	-0	113.8	D182 S183 G184 L199 G203 V204	D182-R201 HydrophobicContact CB-CG 4.28Å; D182-R201 IonicContact OD1-CZ 3Å; D182-R201 IonicContact OD1-NE 2.69Å; D182-R201 WeakPolarHBondContact OD2-CD 3.47Å; D182-R201 WeakPolarHBondContact OD2-CG 3.44Å; D182-R201 IonicContact OD2-CZ 3.68Å; D182-R201 IonicContact OD2-NE 3.43Å; D182-R201 PolarHBondContact OD2-NE 3.46Å; S183-R201 PolarHBondContact O-NE 2.69Å; G184-R201 PolarHBondContact O-NH2 3.48Å; L199-R201 PolarHBondContact O-N 3.34Å; R201-G203 PolarHBondContact O-N 2.87Å; R201-V204 HydrophobicContact CG-CG2 4.42Å; R201-V204 WeakPolarHBondContact O-CB 3.35Å; R201-V204 WeakPolarHBondContact O-CG2 3.22Å; R201-V204 PolarHBondContact O-N 3.34Å; R201-V204 VanDerWaalsContact O-N 3.12Å
202	A	94.1	Very high	94.8	Very high	5 Å²	5	38.7 Å²	38.7	4%	0.041	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.6	126.4	-178.4	0	0	0	0	0	110.3	K69 D182 L199	K69-A202 WeakPolarHBondContact CD-O 3.38Å; K69-A202 WeakPolarHBondContact CE-O 3.38Å; K69-A202 PolarHBondContact NZ-O 3.1Å; D182-A202 WeakPolarHBondContact O-CA 3.49Å; L199-A202 HydrophobicContact CB-CB 4.24Å; L199-A202 HydrophobicContact CD2-CB 4.22Å; L199-A202 WeakPolarHBondContact O-CB 3.41Å; L199-A202 PolarHBondContact O-N 2.86Å
203	G	94.1	Very high	94.9	Very high	6 Å²	6	36.2 Å²	36.2	6%	0.062	20%	0.197	C	C	.	.	T	Hydrogen-bonded Turn	trans	86.7	-1.1	179.7	0	0	0	0	0	115.6	K69 L70 D182 R201	K69-G203 WeakPolarHBondContact CB-O 3.28Å; L70-G203 PolarHBondContact N-O 2.93Å; D182-G203 PolarHBondContact O-N 3.03Å; R201-G203 PolarHBondContact O-N 2.87Å
204	V	95.2	Very high	95	Very high	4 Å²	4	34.2 Å²	34.2	2%	0.024	18%	0.178	C	C	.	.			trans	-58.3	141.2	169.6	173.8	0	0	0	0	109.5	Q63 K69 V76 D182 R201 L206	Q63-V204 HydrophobicContact CG-CG1 3.61Å; K69-V204 HydrophobicContact CG-CG2 4.29Å; V76-V204 HydrophobicContact CG1-CG1 4.16Å; V76-V204 HydrophobicContact CG1-CG2 4.14Å; V76-V204 HydrophobicContact CG2-CG2 4.23Å; D182-V204 HydrophobicContact CB-CB 4.17Å; D182-V204 PolarHBondContact N-O 3.23Å; R201-V204 HydrophobicContact CG-CG2 4.42Å; R201-V204 WeakPolarHBondContact O-CB 3.35Å; R201-V204 WeakPolarHBondContact O-CG2 3.22Å; R201-V204 PolarHBondContact O-N 3.34Å; R201-V204 VanDerWaalsContact O-N 3.12Å; V204-L206 PolarHBondContact O-N 3.47Å
205	G	95.8	Very high	95	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	126.9	-179.3	0	0	0	0	0	112.4	I64	I64-G205 WeakPolarHBondContact CB-O 3.41Å; I64-G205 PolarHBondContact N-O 3.02Å
206	L	95.4	Very high	95	Very high	1 Å²	1	27.3 Å²	27.3	1%	0.005	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115	150	170.6	-56.2	-177.5	0	0	0	110.3	A62 Q63 L179 E180 D182 V204 R251	A62-L206 WeakPolarHBondContact O-CA 3.33Å; Q63-L206 HydrophobicContact CB-CD2 3.9Å; Q63-L206 HydrophobicContact CG-CD2 4.18Å; L179-L206 WeakPolarHBondContact CA-O 3.29Å; E180-L206 HydrophobicContact CG-CB 3.85Å; E180-L206 HydrophobicContact CG-CD1 4.42Å; E180-L206 PolarHBondContact N-O 2.92Å; E180-L206 PolarHBondContact O-N 2.88Å; D182-L206 HydrophobicContact CB-CD1 3.72Å; D182-L206 HydrophobicContact CB-CD2 4.06Å; D182-L206 HydrophobicContact CB-CG 3.78Å; V204-L206 PolarHBondContact O-N 3.47Å; L206-R251 VanDerWaalsContact CD2-NH2 3.28Å
207	M	95.8	Very high	94.9	Very high	2 Å²	2	24.8 Å²	24.8	1%	0.01	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	117.3	165	175.6	171.9	50	0	0	107.7	A62 I64 A108 T111 I177 Q178 L209 L232	A62-M207 HydrophobicContact CB-CE 4.24Å; A62-M207 PolarHBondContact N-O 3Å; A62-M207 PolarHBondContact O-N 3.27Å; I64-M207 HydrophobicContact CD1-CB 4.3Å; I64-M207 HydrophobicContact CG1-CB 4.19Å; A108-M207 HydrophobicContact CB-SD 4.4Å; T111-M207 HydrophobicContact CG2-CE 3.7Å; T111-M207 HydrophobicContact CG2-SD 3.7Å; T111-M207 WeakPolarHBondContact OG1-CE 3.45Å; I177-M207 HydrophobicContact CG2-CG 3.38Å; I177-M207 HydrophobicContact CG2-SD 3.43Å; I177-M207 WeakPolarHBondContact CG2-SD 3.36Å; Q178-M207 CarbonylContact O-C 3.59Å; Q178-M207 WeakPolarHBondContact O-CA 3.38Å; M207-L209 HydrophobicContact CE-CD1 4.17Å; M207-L209 HydrophobicContact CG-CD1 3.86Å; M207-L209 HydrophobicContact CG-CG 4.2Å; M207-L209 HydrophobicContact SD-CD1 4.36Å; M207-L232 HydrophobicContact CE-CD2 3.48Å; M207-L232 VanDerWaalsContact CE-CD2 3.48Å
208	E	96.8	Very high	94.8	Very high	13 Å²	13	22.4 Å²	22.4	6%	0.061	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	123.1	171.9	-179.4	-163.4	125	0	0	108.7	E59 I60 H61 I177 Q178 V210	E59-E208 HydrophobicContact CG-CG 4.07Å; I60-E208 CarbonylContact O-C 3.53Å; I60-E208 WeakPolarHBondContact O-CA 3.47Å; H61-E208 IonicContact NE2-OE2 2.71Å; I177-E208 WeakPolarHBondContact CA-O 3.5Å; Q178-E208 HydrophobicContact CG-CB 3.69Å; Q178-E208 HydrophobicContact CG-CG 4.32Å; Q178-E208 PolarHBondContact N-O 2.86Å; Q178-E208 PolarHBondContact NE2-OE1 3.19Å; Q178-E208 VanDerWaalsContact NE2-OE1 3.15Å; Q178-E208 PolarHBondContact NE2-OE2 2.98Å; Q178-E208 PolarHBondContact O-N 3.02Å; E208-V210 HydrophobicContact CG-CG2 4.32Å; E208-V210 VanDerWaalsContact OE1-CG2 3.3Å; E208-V210 WeakPolarHBondContact OE1-CG2 3.29Å
209	L	96.9	Very high	94.6	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	120.2	175.1	-55.4	93.2	0	0	0	108.7	I60 A62 T111 L115 I177 M207 L228	I60-L209 HydrophobicContact CB-CB 4.47Å; I60-L209 PolarHBondContact N-O 2.92Å; I60-L209 PolarHBondContact O-N 3.41Å; A62-L209 HydrophobicContact CB-CD1 4.27Å; T111-L209 HydrophobicContact CG2-CD2 4.2Å; L115-L209 HydrophobicContact CD1-CD2 3.7Å; I177-L209 HydrophobicContact CD1-CD2 4.08Å; I177-L209 HydrophobicContact CG1-CD2 4.16Å; I177-L209 HydrophobicContact CG1-CG 4.23Å; I177-L209 HydrophobicContact CG2-CG 4.48Å; M207-L209 HydrophobicContact CE-CD1 4.17Å; M207-L209 HydrophobicContact CG-CD1 3.86Å; M207-L209 HydrophobicContact CG-CG 4.2Å; M207-L209 HydrophobicContact SD-CD1 4.36Å; L209-L228 HydrophobicContact CD1-CD2 4.37Å; L209-L228 HydrophobicContact CD2-CD1 3.88Å; L209-L228 HydrophobicContact CD2-CD2 4.06Å
210	V	97.1	Very high	94.5	Very high	27 Å²	27	25.4 Å²	25.4	16%	0.164	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	117.6	177.5	-176.2	0	0	0	0	108.8	K175 Q176 E208	K175-V210 HydrophobicContact CB-CB 4.35Å; K175-V210 HydrophobicContact CB-CG1 4.28Å; K175-V210 WeakPolarHBondContact CB-O 3.41Å; K175-V210 HydrophobicContact CD-CG1 4.29Å; K175-V210 PolarHBondContact N-O 2.92Å; Q176-V210 HydrophobicContact CG-CB 3.97Å; Q176-V210 HydrophobicContact CG-CG2 3.93Å; Q176-V210 PolarHBondContact O-N 2.96Å; E208-V210 HydrophobicContact CG-CG2 4.32Å; E208-V210 VanDerWaalsContact OE1-CG2 3.3Å; E208-V210 WeakPolarHBondContact OE1-CG2 3.29Å
211	M	97	Very high	94.5	Very high	6 Å²	6	24.6 Å²	24.6	3%	0.03	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95	139.8	176.5	-64.8	-179	176.6	0	0	110.7	L58 I60 L154 V172 Y173 M215 L228	L58-M211 HydrophobicContact CB-CB 4.35Å; L58-M211 HydrophobicContact CB-SD 4.12Å; L58-M211 HydrophobicContact CD1-SD 4.24Å; L58-M211 PolarHBondContact O-N 2.98Å; I60-M211 HydrophobicContact CD1-CE 3.56Å; I60-M211 HydrophobicContact CD1-SD 4.05Å; L154-M211 HydrophobicContact CD2-CE 3.56Å; V172-M211 HydrophobicContact CG1-SD 4.15Å; V172-M211 HydrophobicContact CG2-CB 3.92Å; V172-M211 HydrophobicContact CG2-CG 4.38Å; V172-M211 HydrophobicContact CG2-SD 4.42Å; Y173-M211 WeakPolarHBondContact O-CA 3.49Å; M211-M215 HydrophobicContact SD-CE 4.41Å; M211-L228 HydrophobicContact CE-CD2 3.88Å
212	E	96.1	Very high	94.5	Very high	68 Å²	68	21.6 Å²	21.6	32%	0.318	12%	0.123	S	C	.	.	P	Polyproline II helix	trans	-65.4	156.5	171.6	-71.2	-63.7	164.9	0	0	110.9	Y173 K175 D214	Y173-E212 PolarHBondContact O-N 3.26Å; K175-E212 HydrophobicContact CB-CG 4.33Å; K175-E212 WeakPolarHBondContact CB-OE1 3.23Å; K175-E212 WeakPolarHBondContact CD-OE1 3.19Å; K175-E212 WeakPolarHBondContact CG-OE1 3.5Å; E212-D214 PolarHBondContact O-N 3.45Å
213	P	94.3	Very high	94.4	Very high	48 Å²	48	22 Å²	22	31%	0.312	13%	0.126	S	C	.	.	S	Bend	trans	-79.3	62	-174.4	35.8	-37.3	0	0	0	111.8	V55 V56 L265	V55-P213 HydrophobicContact CG1-CB 3.75Å; V55-P213 WeakPolarHBondContact CG1-O 3.35Å; V56-P213 CarbonylContact O-C 3.59Å; V56-P213 WeakPolarHBondContact O-CA 3.26Å; P213-L265 HydrophobicContact CG-CD1 4.15Å
214	D	93.3	Very high	94.5	Very high	70 Å²	70	21.8 Å²	21.8	37%	0.374	12%	0.123	S	C	.	.			trans	-96.9	-15.4	-176.2	-62.1	-44.2	0	0	0	114.1	V172 Y173 E212	V172-D214 HydrophobicContact CB-CB 4.4Å; V172-D214 HydrophobicContact CG2-CB 4.12Å; Y173-D214 WeakPolarHBondContact CD2-OD2 3.46Å; Y173-D214 PolarHBondContact N-OD2 3.42Å; E212-D214 PolarHBondContact O-N 3.45Å
215	M	94.1	Very high	94.4	Very high	1 Å²	1	21.6 Å²	21.6	1%	0.005	12%	0.122	C	C	.	.	B	Isolated β-bridge	trans	-85.2	148	-175.1	-69.8	162.7	-70.8	0	0	111	V55 V56 L58 V172 M211 E220 A221 A224	V55-M215 CarbonylContact C-O 3.58Å; V55-M215 WeakPolarHBondContact CA-O 3.48Å; V56-M215 HydrophobicContact CB-CB 3.98Å; V56-M215 PolarHBondContact N-O 3.26Å; V56-M215 WeakPolarHBondContact O-CE 3.31Å; V56-M215 PolarHBondContact O-N 3.01Å; L58-M215 HydrophobicContact CB-CE 4.28Å; L58-M215 HydrophobicContact CD1-CE 3.67Å; L58-M215 HydrophobicContact CD1-SD 3.89Å; L58-M215 HydrophobicContact CG-CE 3.56Å; L58-M215 HydrophobicContact CG-SD 4.38Å; V172-M215 HydrophobicContact CG2-CE 4.05Å; M211-M215 HydrophobicContact SD-CE 4.41Å; M215-E220 HydrophobicContact CB-CB 4.35Å; M215-E220 HydrophobicContact CG-CB 4.35Å; M215-A221 HydrophobicContact SD-CB 4.15Å; M215-A224 HydrophobicContact SD-CB 3.72Å
216	S	92.1	Very high	94.2	Very high	40 Å²	40	25.1 Å²	25.1	28%	0.28	14%	0.136	S	C	.	.			trans	-112.1	-15	-172.5	59.7	0	0	0	0	115.7	G54 E220	G54-S216 WeakPolarHBondContact O-CA 3.32Å; S216-E220 PolarHBondContact N-OE2 3.49Å; S216-E220 VanDerWaalsContact OG-CD 3.3Å; S216-E220 PolarHBondContact OG-OE1 3.19Å; S216-E220 PolarHBondContact OG-OE2 3.08Å
217	C	92.4	Very high	94.1	Very high	33 Å²	33	25.3 Å²	25.3	22%	0.223	14%	0.136	C	C	.	.	S	Bend	trans	-153.9	170	-178.5	66	0	0	0	0	112.2	E219 E220 A221	C217-E219 VanDerWaalsContact C-N 3.32Å; C217-E219 PolarHBondContact O-N 3.07Å; C217-E220 PolarHBondContact O-N 3.3Å; C217-A221 PolarHBondContact O-N 3.03Å
218	G	92.4	Very high	94	Very high	0 Å²	0	25.2 Å²	25.2	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-64.1	-32.7	179.5	0	0	0	0	0	114.2	A221 A222 A281 D285	G218-A221 PolarHBondContact O-N 2.99Å; G218-A222 WeakPolarHBondContact O-CB 3.4Å; G218-A222 PolarHBondContact O-N 3.16Å; G218-A281 WeakPolarHBondContact O-CB 3.24Å; G218-D285 WeakPolarHBondContact CA-OD1 3.34Å; G218-D285 PolarHBondContact N-OD1 3.1Å
219	E	91.9	Very high	93.7	Very high	104 Å²	104	25.1 Å²	25.1	49%	0.486	14%	0.135	S	C	.	.	H	α-helix	trans	-64.8	-43.6	176.7	-177.2	169.1	-147.1	0	0	111.9	F158 C217 A222 A223	F158-E219 HydrophobicContact CD2-CG 4.28Å; C217-E219 VanDerWaalsContact C-N 3.32Å; C217-E219 PolarHBondContact O-N 3.07Å; E219-A222 PolarHBondContact O-N 3.35Å; E219-A223 WeakPolarHBondContact O-CB 3.46Å; E219-A223 PolarHBondContact O-N 3.18Å
220	E	93.6	Very high	93.4	Very high	10 Å²	10	26.3 Å²	26.3	5%	0.047	14%	0.142	C	C	.	.	H	α-helix	trans	-63.9	-43.9	175.5	-75.6	176.9	-173.8	0	0	111.7	Y156 F158 K170 M215 S216 C217 A223 A224	Y156-E220 HydrophobicContact CE2-CB 4.06Å; Y156-E220 HydrophobicContact CE2-CG 4.28Å; F158-E220 HydrophobicContact CD1-CG 4.35Å; F158-E220 HydrophobicContact CE1-CG 3.81Å; F158-E220 HydrophobicContact CE2-CG 4.28Å; F158-E220 HydrophobicContact CZ-CG 3.75Å; K170-E220 HydrophobicContact CD-CG 4.49Å; K170-E220 VanDerWaalsContact CE-OE1 3.23Å; K170-E220 WeakPolarHBondContact CE-OE1 3.26Å; K170-E220 VanDerWaalsContact NZ-CD 3.29Å; K170-E220 IonicContact NZ-OE1 3.36Å; K170-E220 PolarHBondContact NZ-OE1 3.13Å; K170-E220 IonicContact NZ-OE2 2.86Å; K170-E220 PolarHBondContact NZ-OE2 3.09Å; M215-E220 HydrophobicContact CB-CB 4.35Å; M215-E220 HydrophobicContact CG-CB 4.35Å; S216-E220 PolarHBondContact N-OE2 3.49Å; S216-E220 VanDerWaalsContact OG-CD 3.3Å; S216-E220 PolarHBondContact OG-OE1 3.19Å; S216-E220 PolarHBondContact OG-OE2 3.08Å; C217-E220 PolarHBondContact O-N 3.3Å; E220-A223 PolarHBondContact O-N 3.37Å; E220-A224 WeakPolarHBondContact O-CB 3.27Å; E220-A224 PolarHBondContact O-N 3.5Å
221	A	93.8	Very high	93.3	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-61	-46.5	176.7	0	0	0	0	0	112.4	V56 L58 M215 C217 G218 A223 A224 V225 L280 I284	V56-A221 HydrophobicContact CG1-CB 4.38Å; L58-A221 HydrophobicContact CD1-CB 4.11Å; L58-A221 HydrophobicContact CD2-CB 4.42Å; M215-A221 HydrophobicContact SD-CB 4.15Å; C217-A221 PolarHBondContact O-N 3.03Å; G218-A221 PolarHBondContact O-N 2.99Å; A221-A223 VanDerWaalsContact C-N 3.3Å; A221-A223 PolarHBondContact O-N 3.13Å; A221-A224 PolarHBondContact O-N 3.27Å; A221-V225 WeakPolarHBondContact O-CG2 3.36Å; A221-V225 PolarHBondContact O-N 3.26Å; A221-L280 HydrophobicContact CB-CD2 4.45Å; A221-I284 HydrophobicContact CB-CD1 3.32Å
222	A	92.8	Very high	93.1	Very high	16 Å²	16	25.3 Å²	25.3	13%	0.132	14%	0.135	C	C	.	.	H	α-helix	trans	-63.7	-36	177	0	0	0	0	0	112.5	G218 E219 R226 L277 A281	G218-A222 WeakPolarHBondContact O-CB 3.4Å; G218-A222 PolarHBondContact O-N 3.16Å; E219-A222 PolarHBondContact O-N 3.35Å; A222-R226 WeakPolarHBondContact O-CB 3.2Å; A222-R226 PolarHBondContact O-N 3.34Å; A222-L277 HydrophobicContact CB-CB 4.43Å; A222-A281 HydrophobicContact CB-CB 4.18Å
223	A	92.6	Very high	92.7	Very high	14 Å²	14	24.4 Å²	24.4	12%	0.116	13%	0.131	C	C	.	.	H	α-helix	trans	-69	-41.4	175.8	0	0	0	0	0	112.5	Y156 F158 E219 E220 A221 R226 E227	Y156-A223 HydrophobicContact CD2-CB 3.88Å; Y156-A223 HydrophobicContact CE2-CB 4.44Å; F158-A223 HydrophobicContact CB-CB 3.68Å; E219-A223 WeakPolarHBondContact O-CB 3.46Å; E219-A223 PolarHBondContact O-N 3.18Å; E220-A223 PolarHBondContact O-N 3.37Å; A221-A223 VanDerWaalsContact C-N 3.3Å; A221-A223 PolarHBondContact O-N 3.13Å; A223-R226 PolarHBondContact O-N 3.5Å; A223-E227 PolarHBondContact O-N 3.02Å
224	A	94.7	Very high	92.6	Very high	0 Å²	0	23.3 Å²	23.3	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-61.3	-48.3	175.1	0	0	0	0	0	111.8	L154 Y156 V172 M215 E220 A221 R226 E227 L228	L154-A224 HydrophobicContact CD2-CB 4.34Å; L154-A224 WeakPolarHBondContact CD2-O 3.24Å; Y156-A224 HydrophobicContact CD1-CB 3.89Å; Y156-A224 HydrophobicContact CD2-CB 4.3Å; Y156-A224 HydrophobicContact CE1-CB 4.15Å; Y156-A224 HydrophobicContact CG-CB 3.97Å; V172-A224 HydrophobicContact CG1-CB 4.47Å; M215-A224 HydrophobicContact SD-CB 3.72Å; E220-A224 WeakPolarHBondContact O-CB 3.27Å; E220-A224 PolarHBondContact O-N 3.5Å; A221-A224 PolarHBondContact O-N 3.27Å; A224-R226 VanDerWaalsContact C-N 3.32Å; A224-R226 PolarHBondContact O-N 2.91Å; A224-E227 PolarHBondContact O-N 2.68Å; A224-L228 PolarHBondContact O-N 3.06Å
225	V	93.4	Very high	92.5	Very high	1 Å²	1	20.4 Å²	20.4	1%	0.006	11%	0.111	C	C	.	.	H	α-helix	trans	-63.1	-39.4	177.2	-179.3	0	0	0	0	111.3	L58 I60 A221 L228 Q229 L250 V252 L277 L280	L58-V225 HydrophobicContact CD1-CG2 3.6Å; I60-V225 HydrophobicContact CD1-CG2 3.87Å; A221-V225 WeakPolarHBondContact O-CG2 3.36Å; A221-V225 PolarHBondContact O-N 3.26Å; V225-L228 PolarHBondContact O-N 2.84Å; V225-Q229 WeakPolarHBondContact O-CB 3.44Å; V225-Q229 PolarHBondContact O-N 3.48Å; V225-L250 HydrophobicContact CG1-CD2 3.98Å; V225-V252 HydrophobicContact CG1-CG2 3.88Å; V225-V252 HydrophobicContact CG2-CG1 4.25Å; V225-V252 HydrophobicContact CG2-CG2 4.18Å; V225-L277 HydrophobicContact CB-CD2 3.58Å; V225-L277 HydrophobicContact CG1-CD2 3.45Å; V225-L277 VanDerWaalsContact CG1-CD2 3.45Å; V225-L280 HydrophobicContact CB-CD2 4.35Å; V225-L280 HydrophobicContact CG2-CD2 3.66Å
226	R	91.3	Very high	92.3	Very high	74 Å²	74	22.1 Å²	22.1	28%	0.279	13%	0.129	S	C	.	.	H	α-helix	trans	-62.8	-44.7	176.1	-177.4	177.1	-68.7	-120.4	-0.8	112.1	A222 A223 A224 L228 Q229 L230 L277	A222-R226 WeakPolarHBondContact O-CB 3.2Å; A222-R226 PolarHBondContact O-N 3.34Å; A223-R226 PolarHBondContact O-N 3.5Å; A224-R226 VanDerWaalsContact C-N 3.32Å; A224-R226 PolarHBondContact O-N 2.91Å; R226-L228 VanDerWaalsContact C-N 3.33Å; R226-Q229 WeakPolarHBondContact O-CB 3.31Å; R226-Q229 PolarHBondContact O-N 3.17Å; R226-L230 WeakPolarHBondContact O-CG 3.38Å; R226-L230 PolarHBondContact O-N 3.34Å; R226-L277 HydrophobicContact CB-CD1 4.01Å
227	E	93.1	Very high	92.3	Very high	4 Å²	4	20.3 Å²	20.3	2%	0.019	12%	0.116	C	C	.	.	H	α-helix	trans	-62.6	-43.6	177.2	-172.4	72.4	-159.4	0	0	110.9	L154 A223 A224 Q229 L230 I231 R374	L154-E227 HydrophobicContact CD1-CB 4.42Å; L154-E227 HydrophobicContact CD1-CG 3.97Å; A223-E227 PolarHBondContact O-N 3.02Å; A224-E227 PolarHBondContact O-N 2.68Å; E227-Q229 VanDerWaalsContact C-N 3.33Å; E227-Q229 PolarHBondContact O-N 3.09Å; E227-L230 PolarHBondContact O-N 3.47Å; E227-I231 HydrophobicContact CG-CD1 4.25Å; E227-I231 WeakPolarHBondContact O-CG1 3.44Å; E227-I231 PolarHBondContact O-N 3.38Å; E227-R374 IonicContact OE1-CZ 3.66Å; E227-R374 IonicContact OE1-NH1 2.63Å; E227-R374 IonicContact OE1-NH2 3.71Å; E227-R374 PolarHBondContact OE1-NH2 3.4Å; E227-R374 IonicContact OE2-CZ 3.64Å; E227-R374 VanDerWaalsContact OE2-CZ 3.28Å; E227-R374 IonicContact OE2-NH1 3.27Å; E227-R374 PolarHBondContact OE2-NH1 3.5Å; E227-R374 IonicContact OE2-NH2 2.77Å; E227-R374 PolarHBondContact OE2-NH2 2.87Å
228	L	94.1	Very high	92	Very high	0 Å²	0	18.9 Å²	18.9	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-60	-44.5	175.2	179.2	64.3	0	0	0	111.5	I60 L115 L154 L209 M211 A224 V225 R226 L230 I231 L232	I60-L228 HydrophobicContact CB-CD2 4.38Å; I60-L228 HydrophobicContact CD1-CD2 3.51Å; I60-L228 HydrophobicContact CG2-CD2 4.06Å; L115-L228 HydrophobicContact CD1-CD1 3.82Å; L115-L228 HydrophobicContact CD2-CD1 4.25Å; L154-L228 HydrophobicContact CD2-CB 4.11Å; L209-L228 HydrophobicContact CD1-CD2 4.37Å; L209-L228 HydrophobicContact CD2-CD1 3.88Å; L209-L228 HydrophobicContact CD2-CD2 4.06Å; M211-L228 HydrophobicContact CE-CD2 3.88Å; A224-L228 PolarHBondContact O-N 3.06Å; V225-L228 PolarHBondContact O-N 2.84Å; R226-L228 VanDerWaalsContact C-N 3.33Å; L228-L230 VanDerWaalsContact C-N 3.34Å; L228-L230 PolarHBondContact O-N 2.85Å; L228-I231 WeakPolarHBondContact O-CB 3.18Å; L228-I231 PolarHBondContact O-N 2.65Å; L228-I231 VanDerWaalsContact O-N 3.16Å; L228-L232 HydrophobicContact CD1-CD1 4.37Å; L228-L232 HydrophobicContact CD1-CD2 4.48Å; L228-L232 HydrophobicContact CD1-CG 4.16Å; L228-L232 HydrophobicContact CG-CD1 4.03Å; L228-L232 HydrophobicContact CG-CG 4.26Å; L228-L232 VanDerWaalsContact O-CG 3.3Å; L228-L232 WeakPolarHBondContact O-CG 3.46Å; L228-L232 PolarHBondContact O-N 3.05Å
229	Q	91.1	Very high	91	Very high	11 Å²	11	24.6 Å²	24.6	5%	0.051	13%	0.133	C	C	.	.	H	α-helix	trans	-55.1	-48.9	176.2	179.5	-179.7	20.8	0	0	111.3	V225 R226 E227 I231 L232 Q233 G240 N241 L250	V225-Q229 WeakPolarHBondContact O-CB 3.44Å; V225-Q229 PolarHBondContact O-N 3.48Å; R226-Q229 WeakPolarHBondContact O-CB 3.31Å; R226-Q229 PolarHBondContact O-N 3.17Å; E227-Q229 VanDerWaalsContact C-N 3.33Å; E227-Q229 PolarHBondContact O-N 3.09Å; Q229-I231 VanDerWaalsContact C-N 3.31Å; Q229-I231 PolarHBondContact O-N 3.1Å; Q229-L232 PolarHBondContact O-N 3.39Å; Q229-Q233 WeakPolarHBondContact O-CB 3.42Å; Q229-Q233 VanDerWaalsContact O-CG 3.31Å; Q229-Q233 WeakPolarHBondContact O-CG 3.39Å; Q229-Q233 PolarHBondContact O-N 3.05Å; Q229-G240 VanDerWaalsContact CG-O 3.24Å; Q229-G240 WeakPolarHBondContact CG-O 2.93Å; Q229-G240 PolarHBondContact NE2-O 3.4Å; Q229-N241 PolarHBondContact NE2-O 3.19Å; Q229-L250 HydrophobicContact CB-CD2 4.43Å
230	L	90.5	Very high	89.4	Confident	25 Å²	25	19.8 Å²	19.8	13%	0.131	11%	0.111	C	C	.	.	H	α-helix	trans	-61.7	-38.5	177.7	-67	170.2	0	0	0	112.3	R226 E227 L228 A234 P370 N393	R226-L230 WeakPolarHBondContact O-CG 3.38Å; R226-L230 PolarHBondContact O-N 3.34Å; E227-L230 PolarHBondContact O-N 3.47Å; L228-L230 VanDerWaalsContact C-N 3.34Å; L228-L230 PolarHBondContact O-N 2.85Å; L230-A234 VanDerWaalsContact O-CB 3.29Å; L230-A234 WeakPolarHBondContact O-CB 3.36Å; L230-A234 PolarHBondContact O-N 3.48Å; L230-P370 HydrophobicContact CB-CB 4.3Å; L230-P370 HydrophobicContact CB-CG 3.72Å; L230-N393 VanDerWaalsContact CD1-OD1 3.3Å; L230-N393 WeakPolarHBondContact CD1-OD1 3.25Å
231	I	93.8	Very high	87.5	Confident	9 Å²	9	22.8 Å²	22.8	5%	0.046	13%	0.128	C	C	.	.	H	α-helix	trans	-63.6	-50.7	175.2	-69.3	166	0	0	0	110	A114 L115 L154 E227 L228 Q229 Q233 A234 L235 L369 P370	A114-I231 HydrophobicContact CB-CG2 4.06Å; L115-I231 HydrophobicContact CD2-CD1 3.86Å; L115-I231 HydrophobicContact CD2-CG2 4.48Å; L154-I231 HydrophobicContact CD1-CD1 3.53Å; E227-I231 HydrophobicContact CG-CD1 4.25Å; E227-I231 WeakPolarHBondContact O-CG1 3.44Å; E227-I231 PolarHBondContact O-N 3.38Å; L228-I231 WeakPolarHBondContact O-CB 3.18Å; L228-I231 PolarHBondContact O-N 2.65Å; L228-I231 VanDerWaalsContact O-N 3.16Å; Q229-I231 VanDerWaalsContact C-N 3.31Å; Q229-I231 PolarHBondContact O-N 3.1Å; I231-Q233 VanDerWaalsContact C-N 3.3Å; I231-Q233 PolarHBondContact O-N 2.92Å; I231-A234 PolarHBondContact O-N 3.44Å; I231-A234 VanDerWaalsContact O-N 3.17Å; I231-L235 HydrophobicContact CG2-CD1 3.94Å; I231-L235 HydrophobicContact CG2-CG 4.32Å; I231-L235 VanDerWaalsContact O-CG 3.25Å; I231-L235 WeakPolarHBondContact O-CG 3.14Å; I231-L235 PolarHBondContact O-N 3.05Å; I231-L369 HydrophobicContact CG2-CD2 4.39Å; I231-P370 HydrophobicContact CG1-CG 4.1Å
232	L	93.3	Very high	85.1	Confident	3 Å²	3	27.6 Å²	27.6	2%	0.016	15%	0.152	C	C	.	.	H	α-helix	trans	-61	-38.9	-178.9	-65.6	175.4	0	0	0	112.5	A62 T111 M207 L228 Q229 L235 G236 T237 C238 L250	A62-L232 HydrophobicContact CB-CD1 3.84Å; T111-L232 HydrophobicContact CG2-CD2 3.59Å; M207-L232 HydrophobicContact CE-CD2 3.48Å; M207-L232 VanDerWaalsContact CE-CD2 3.48Å; L228-L232 HydrophobicContact CD1-CD1 4.37Å; L228-L232 HydrophobicContact CD1-CD2 4.48Å; L228-L232 HydrophobicContact CD1-CG 4.16Å; L228-L232 HydrophobicContact CG-CD1 4.03Å; L228-L232 HydrophobicContact CG-CG 4.26Å; L228-L232 VanDerWaalsContact O-CG 3.3Å; L228-L232 WeakPolarHBondContact O-CG 3.46Å; L228-L232 PolarHBondContact O-N 3.05Å; Q229-L232 PolarHBondContact O-N 3.39Å; L232-L235 PolarHBondContact O-N 3.38Å; L232-G236 PolarHBondContact O-N 3.11Å; L232-G236 VanDerWaalsContact O-N 3.13Å; L232-T237 WeakPolarHBondContact CD2-OG1 3.3Å; L232-T237 PolarHBondContact O-N 3.25Å; L232-T237 PolarHBondContact O-OG1 2.63Å; L232-C238 HydrophobicContact CB-CB 3.97Å; L232-C238 HydrophobicContact CD1-CB 4.3Å; L232-C238 PolarHBondContact O-N 3.14Å; L232-L250 HydrophobicContact CD1-CD1 4.38Å
233	Q	89.1	Confident	82.6	Confident	49 Å²	49	30.6 Å²	30.6	23%	0.229	17%	0.172	C	C	.	.	H	α-helix	trans	-65.1	-46.9	173.9	-72.9	-177.6	-53.6	0	0	111.6	Q229 I231 L235 G236 Q239 G240 N241	Q229-Q233 WeakPolarHBondContact O-CB 3.42Å; Q229-Q233 VanDerWaalsContact O-CG 3.31Å; Q229-Q233 WeakPolarHBondContact O-CG 3.39Å; Q229-Q233 PolarHBondContact O-N 3.05Å; I231-Q233 VanDerWaalsContact C-N 3.3Å; I231-Q233 PolarHBondContact O-N 2.92Å; Q233-L235 VanDerWaalsContact C-N 3.26Å; Q233-L235 PolarHBondContact O-N 2.89Å; Q233-G236 PolarHBondContact O-N 2.77Å; Q233-Q239 WeakPolarHBondContact CG-O 3.47Å; Q233-Q239 PolarHBondContact NE2-O 3.48Å; Q233-G240 VanDerWaalsContact NE2-C 3.29Å; Q233-G240 PolarHBondContact NE2-O 3Å; Q233-N241 PolarHBondContact NE2-OD1 3.3Å
234	A	90.5	Very high	80.3	Confident	25 Å²	25	30.3 Å²	30.3	21%	0.207	17%	0.168	C	C	.	.	H	α-helix	trans	-58.9	-40.3	177.7	0	0	0	0	0	111.5	L230 I231 G236 P367	L230-A234 VanDerWaalsContact O-CB 3.29Å; L230-A234 WeakPolarHBondContact O-CB 3.36Å; L230-A234 PolarHBondContact O-N 3.48Å; I231-A234 PolarHBondContact O-N 3.44Å; I231-A234 VanDerWaalsContact O-N 3.17Å; A234-G236 VanDerWaalsContact C-N 3.26Å; A234-G236 PolarHBondContact O-N 3.49Å; A234-P367 WeakPolarHBondContact O-CG 3.48Å
235	L	92.4	Very high	77.8	Confident	10 Å²	10	31.4 Å²	31.4	5%	0.052	18%	0.176	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.3	-13.6	176.5	-61.7	176.9	0	0	0	113.9	A114 I231 L232 Q233 T237 L366 P367 L369	A114-L235 HydrophobicContact CB-CD1 3.68Å; A114-L235 HydrophobicContact CB-CD2 4.08Å; A114-L235 HydrophobicContact CB-CG 4.35Å; I231-L235 HydrophobicContact CG2-CD1 3.94Å; I231-L235 HydrophobicContact CG2-CG 4.32Å; I231-L235 VanDerWaalsContact O-CG 3.25Å; I231-L235 WeakPolarHBondContact O-CG 3.14Å; I231-L235 PolarHBondContact O-N 3.05Å; L232-L235 PolarHBondContact O-N 3.38Å; Q233-L235 VanDerWaalsContact C-N 3.26Å; Q233-L235 PolarHBondContact O-N 2.89Å; L235-T237 HydrophobicContact CB-CG2 3.72Å; L235-T237 HydrophobicContact CD1-CG2 4.42Å; L235-T237 PolarHBondContact O-N 3.22Å; L235-L366 HydrophobicContact CD2-CD2 3.68Å; L235-P367 HydrophobicContact CD2-CG 4Å; L235-L369 HydrophobicContact CD2-CD2 4.21Å
236	G	90.4	Very high	75.2	Confident	37 Å²	37	35.8 Å²	35.8	38%	0.381	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	62.5	23.1	-171.3	0	0	0	0	0	113.4	R103 L232 Q233 A234	R103-G236 PolarHBondContact NH2-O 3.48Å; L232-G236 PolarHBondContact O-N 3.11Å; L232-G236 VanDerWaalsContact O-N 3.13Å; Q233-G236 PolarHBondContact O-N 2.77Å; A234-G236 VanDerWaalsContact C-N 3.26Å; A234-G236 PolarHBondContact O-N 3.49Å
237	T	90.4	Very high	73.4	Confident	1 Å²	1	37.7 Å²	37.7	1%	0.006	22%	0.224	C	C	.	.	S	Bend	trans	-86.9	-25.8	-179.8	55.6	0	0	0	0	112	I64 S65 A107 M110 T111 L232 L235	I64-T237 WeakPolarHBondContact CA-O 3.46Å; S65-T237 PolarHBondContact N-O 3.37Å; A107-T237 HydrophobicContact CB-CG2 3.76Å; M110-T237 HydrophobicContact CB-CG2 4.38Å; T111-T237 PolarHBondContact OG1-OG1 3.27Å; L232-T237 WeakPolarHBondContact CD2-OG1 3.3Å; L232-T237 PolarHBondContact O-N 3.25Å; L232-T237 PolarHBondContact O-OG1 2.63Å; L235-T237 HydrophobicContact CB-CG2 3.72Å; L235-T237 HydrophobicContact CD1-CG2 4.42Å; L235-T237 PolarHBondContact O-N 3.22Å
238	C	87.1	Confident	72	Confident	3 Å²	3	38.5 Å²	38.5	2%	0.02	23%	0.234	C	C	.	.			trans	-141.5	139.7	170.4	-172.8	0	0	0	0	108.9	Q63 L232	Q63-C238 PolarHBondContact O-SG 3.29Å; L232-C238 HydrophobicContact CB-CB 3.97Å; L232-C238 HydrophobicContact CD1-CB 4.3Å; L232-C238 PolarHBondContact O-N 3.14Å
239	Q	71.9	Confident	71.3	Confident	120 Å²	120	38.9 Å²	38.9	56%	0.561	24%	0.235	S	C	*	.			trans	-73.8	-36.1	-178	-68.5	-177.7	-0.7	0	0	112.7	Q233 N241	Q233-Q239 WeakPolarHBondContact CG-O 3.47Å; Q233-Q239 PolarHBondContact NE2-O 3.48Å; Q239-N241 PolarHBondContact O-N 2.95Å; Q239-N241 PolarHBondContact O-OD1 3.36Å
240	G	57	Low	71.1	Confident	4 Å²	4	38.9 Å²	38.9	4%	0.041	24%	0.236	C	C	.	.			trans	50	37.2	153.3	0	0	0	0	0	119.1	Q229 Q233	Q229-G240 VanDerWaalsContact CG-O 3.24Å; Q229-G240 WeakPolarHBondContact CG-O 2.93Å; Q229-G240 PolarHBondContact NE2-O 3.4Å; Q233-G240 VanDerWaalsContact NE2-C 3.29Å; Q233-G240 PolarHBondContact NE2-O 3Å
241	N	53.7	Low	71	Confident	73 Å²	73	40.7 Å²	40.7	39%	0.39	24%	0.241	S	C	.	.			trans	-70	163.9	177.7	-79	-2.8	0	0	0	114.5	Q229 Q233 Q239 S243 V244	Q229-N241 PolarHBondContact NE2-O 3.19Å; Q233-N241 PolarHBondContact NE2-OD1 3.3Å; Q239-N241 PolarHBondContact O-N 2.95Å; Q239-N241 PolarHBondContact O-OD1 3.36Å; N241-S243 VanDerWaalsContact C-N 3.26Å; N241-S243 PolarHBondContact O-N 2.9Å; N241-V244 HydrophobicContact CB-CG2 3.63Å; N241-V244 WeakPolarHBondContact O-CB 3.48Å; N241-V244 VanDerWaalsContact O-CG2 3.32Å; N241-V244 WeakPolarHBondContact O-CG2 3.33Å; N241-V244 PolarHBondContact O-N 3.24Å
242	M	43.3	Very low	70.9	Confident	101 Å²	101	40.8 Å²	40.8	50%	0.498	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-25	-176.1	-68.4	178.8	81.8	0	0	114.7	V244	M242-V244 VanDerWaalsContact C-N 3.28Å
243	S	41.7	Very low	70.9	Confident	79 Å²	79	41.6 Å²	41.6	55%	0.552	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78.3	-7.8	173.3	52.3	0	0	0	0	113.6	N241 A246	N241-S243 VanDerWaalsContact C-N 3.26Å; N241-S243 PolarHBondContact O-N 2.9Å; S243-A246 WeakPolarHBondContact O-CB 3.44Å; S243-A246 PolarHBondContact O-N 2.79Å; S243-A246 VanDerWaalsContact O-N 3.17Å
244	V	44.4	Very low	71.2	Confident	7 Å²	7	39.3 Å²	39.3	4%	0.042	24%	0.236	C	C	.	.	G	3₁₀ helix	trans	-90.3	-10.2	-160.4	176.9	0	0	0	0	114.5	N241 M242 A246 E247 G248 Q249	N241-V244 HydrophobicContact CB-CG2 3.63Å; N241-V244 WeakPolarHBondContact O-CB 3.48Å; N241-V244 VanDerWaalsContact O-CG2 3.32Å; N241-V244 WeakPolarHBondContact O-CG2 3.33Å; N241-V244 PolarHBondContact O-N 3.24Å; M242-V244 VanDerWaalsContact C-N 3.28Å; V244-A246 PolarHBondContact O-N 3.12Å; V244-A246 VanDerWaalsContact O-N 3.11Å; V244-E247 HydrophobicContact CG1-CB 4.25Å; V244-E247 PolarHBondContact O-N 2.79Å; V244-G248 PolarHBondContact O-N 2.77Å; V244-G248 VanDerWaalsContact O-N 3.15Å; V244-Q249 HydrophobicContact CG1-CB 3.49Å; V244-Q249 VanDerWaalsContact CG1-CB 3.49Å; V244-Q249 HydrophobicContact CG1-CG 3.52Å
245	C	42.3	Very low	71.4	Confident	24 Å²	24	39.1 Å²	39.1	16%	0.162	23%	0.231	C	C	.	.	G	3₁₀ helix	trans	-58.2	-21.7	160.3	-53.8	0	0	0	0	111.2	N275	C245-N275 CarbonylContact C-O 3.41Å; C245-N275 VanDerWaalsContact CB-C 3.49Å; C245-N275 WeakPolarHBondContact CB-O 3.49Å
246	A	38.2	Very low	71.6	Confident	93 Å²	93	38.6 Å²	38.6	77%	0.769	23%	0.229	S	C	*	.	G	3₁₀ helix	trans	-82.1	-19.5	172.6	0	0	0	0	0	114.4	S243 V244	S243-A246 WeakPolarHBondContact O-CB 3.44Å; S243-A246 PolarHBondContact O-N 2.79Å; S243-A246 VanDerWaalsContact O-N 3.17Å; V244-A246 PolarHBondContact O-N 3.12Å; V244-A246 VanDerWaalsContact O-N 3.11Å
247	E	52.4	Low	71.8	Confident	113 Å²	113	37.3 Å²	37.3	53%	0.528	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	-99.6	-7.1	-179	-66.1	-179.7	-174.8	0	0	113.5	V244	V244-E247 HydrophobicContact CG1-CB 4.25Å; V244-E247 PolarHBondContact O-N 2.79Å
248	G	64.9	Low	72	Confident	22 Å²	22	37.6 Å²	37.6	23%	0.227	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	83.9	9.7	170.5	0	0	0	0	0	116.2	V244 R251	V244-G248 PolarHBondContact O-N 2.77Å; V244-G248 VanDerWaalsContact O-N 3.15Å; G248-R251 PolarHBondContact O-NE 3.02Å
249	Q	78.6	Confident	72.2	Confident	7 Å²	7	39.2 Å²	39.2	3%	0.033	22%	0.222	C	C	.	.	S	Bend	trans	-74.7	-29.3	178.9	-54.4	-177.3	-4	0	0	113.2	Q63 F78 V244	Q63-Q249 HydrophobicContact CB-CB 4.13Å; Q63-Q249 WeakPolarHBondContact CB-O 3.29Å; Q63-Q249 PolarHBondContact N-O 2.88Å; F78-Q249 HydrophobicContact CE1-CG 3.87Å; F78-Q249 HydrophobicContact CE2-CG 4.48Å; F78-Q249 HydrophobicContact CZ-CG 3.54Å; V244-Q249 HydrophobicContact CG1-CB 3.49Å; V244-Q249 VanDerWaalsContact CG1-CB 3.49Å; V244-Q249 HydrophobicContact CG1-CG 3.52Å
250	L	86.7	Confident	73.1	Confident	12 Å²	12	38.5 Å²	38.5	6%	0.063	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	118	173.8	-168.4	71.9	0	0	0	108.3	I60 H61 A62 V225 Q229 L232	I60-L250 HydrophobicContact CG2-CD1 3.51Å; I60-L250 HydrophobicContact CG2-CG 4.19Å; H61-L250 WeakPolarHBondContact O-CA 3.09Å; A62-L250 HydrophobicContact CB-CD1 3.8Å; V225-L250 HydrophobicContact CG1-CD2 3.98Å; Q229-L250 HydrophobicContact CB-CD2 4.43Å; L232-L250 HydrophobicContact CD1-CD1 4.38Å
251	R	89.1	Confident	74.6	Confident	62 Å²	62	41.2 Å²	41.2	23%	0.234	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	139.1	178.7	-68.6	163.9	-88.4	-170.2	-17.6	109	I60 H61 D182 L206 G248	I60-R251 CarbonylContact C-O 3.6Å; I60-R251 WeakPolarHBondContact CA-O 3.35Å; H61-R251 HydrophobicContact CB-CB 4.23Å; H61-R251 PolarHBondContact N-O 2.92Å; H61-R251 PolarHBondContact O-N 3.08Å; D182-R251 VanDerWaalsContact CG-NH2 3.27Å; D182-R251 IonicContact OD1-CZ 2.62Å; D182-R251 IonicContact OD1-NH1 3.93Å; D182-R251 PolarHBondContact OD1-NH1 3.34Å; D182-R251 IonicContact OD1-NH2 2.95Å; D182-R251 PolarHBondContact OD1-NH2 2.85Å; D182-R251 IonicContact OD2-CZ 3.66Å; D182-R251 IonicContact OD2-NH1 2.74Å; D182-R251 PolarHBondContact OD2-NH1 2.98Å; D182-R251 IonicContact OD2-NH2 2.82Å; D182-R251 PolarHBondContact OD2-NH2 2.84Å; L206-R251 VanDerWaalsContact CD2-NH2 3.28Å; G248-R251 PolarHBondContact O-NE 3.02Å
252	V	91.8	Very high	76	Confident	11 Å²	11	41.9 Å²	41.9	7%	0.067	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	123.3	-178.6	-175.4	0	0	0	0	109.2	L58 E59 I60 V225 L280	L58-V252 HydrophobicContact CD2-CG1 4.02Å; E59-V252 WeakPolarHBondContact O-CA 3.47Å; I60-V252 HydrophobicContact CG1-CG1 4.27Å; I60-V252 HydrophobicContact CG1-CG2 4.22Å; I60-V252 HydrophobicContact CG2-CG2 4.38Å; V225-V252 HydrophobicContact CG1-CG2 3.88Å; V225-V252 HydrophobicContact CG2-CG1 4.25Å; V225-V252 HydrophobicContact CG2-CG2 4.18Å; V252-L280 HydrophobicContact CG1-CD1 3.93Å; V252-L280 HydrophobicContact CG1-CD2 4.16Å
253	D	93.1	Very high	78.2	Confident	21 Å²	21	41.4 Å²	41.4	11%	0.112	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	132.6	168	-74.8	-7.1	0	0	0	108.5	E59 K272	E59-D253 HydrophobicContact CB-CB 4.39Å; E59-D253 PolarHBondContact N-O 3.4Å; E59-D253 PolarHBondContact O-N 3.19Å; D253-K272 IonicContact OD2-NZ 3.68Å; D253-K272 PolarHBondContact OD2-NZ 2.97Å
254	A	94.8	Very high	80.4	Confident	0 Å²	0	43.3 Å²	43.3	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	126.5	-175.7	0	0	0	0	0	111.1	L58 V256 E270 V271 I274 L280 I284	L58-A254 HydrophobicContact CD2-CB 3.94Å; A254-V256 HydrophobicContact CB-CG2 4.44Å; A254-E270 CarbonylContact O-C 3.56Å; A254-E270 WeakPolarHBondContact O-CA 3.41Å; A254-V271 HydrophobicContact CB-CB 4.44Å; A254-V271 PolarHBondContact N-O 3.14Å; A254-V271 PolarHBondContact O-N 2.86Å; A254-I274 HydrophobicContact CB-CD1 3.95Å; A254-L280 HydrophobicContact CB-CD1 4.04Å; A254-I284 HydrophobicContact CB-CD1 4.18Å; A254-I284 HydrophobicContact CB-CG1 3.98Å
255	N	95.5	Very high	82.6	Confident	21 Å²	21	47.5 Å²	47.5	11%	0.112	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	110.3	174.3	-68.9	-85.2	0	0	0	108.5	V56 G57 R268	V56-N255 WeakPolarHBondContact CA-O 3.48Å; G57-N255 PolarHBondContact N-O 3Å; G57-N255 PolarHBondContact O-N 3.07Å; N255-R268 HydrophobicContact CB-CG 4.12Å; N255-R268 VanDerWaalsContact OD1-CD 3.29Å; N255-R268 WeakPolarHBondContact OD1-CD 3.38Å; N255-R268 PolarHBondContact OD1-NH1 2.92Å
256	V	95.3	Very high	84.9	Confident	0 Å²	0	47.9 Å²	47.9	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	134.8	-173.7	-176.6	0	0	0	0	110.4	V56 A254 T269 I284 E287 I288 Q291	V56-V256 HydrophobicContact CG2-CG2 4.49Å; A254-V256 HydrophobicContact CB-CG2 4.44Å; V256-T269 PolarHBondContact N-O 3.43Å; V256-T269 PolarHBondContact O-N 3.2Å; V256-I284 HydrophobicContact CG2-CG1 4.1Å; V256-I284 HydrophobicContact CG2-CG2 4.41Å; V256-E287 HydrophobicContact CB-CB 4.42Å; V256-E287 HydrophobicContact CB-CG 3.92Å; V256-E287 HydrophobicContact CG1-CB 4.19Å; V256-E287 HydrophobicContact CG1-CG 3.93Å; V256-E287 HydrophobicContact CG2-CB 4.48Å; V256-E287 HydrophobicContact CG2-CG 4.38Å; V256-I288 HydrophobicContact CG1-CG1 3.61Å; V256-Q291 PolarHBondContact O-NE2 2.8Å; V256-Q291 VanDerWaalsContact O-NE2 3.15Å
257	S	94.9	Very high	87.3	Confident	10 Å²	10	46.4 Å²	46.4	7%	0.07	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	156.9	172.7	-178.3	0	0	0	0	109.8	V55 G266	V55-S257 PolarHBondContact N-O 2.97Å; V55-S257 PolarHBondContact O-N 3.29Å; S257-G266 VanDerWaalsContact OG-CA 3.26Å; S257-G266 WeakPolarHBondContact OG-CA 3.42Å; S257-G266 PolarHBondContact OG-N 3.37Å; S257-G266 VanDerWaalsContact OG-N 3.12Å; S257-G266 PolarHBondContact OG-O 3.41Å
258	V	94.5	Very high	89.2	Confident	6 Å²	6	46.8 Å²	46.8	4%	0.036	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	144.2	170.2	-57.9	0	0	0	0	109.8	V53 I288 Q291 V295	V53-V258 WeakPolarHBondContact O-CA 3.41Å; V258-I288 HydrophobicContact CG1-CB 4.45Å; V258-I288 HydrophobicContact CG1-CG2 4.08Å; V258-Q291 HydrophobicContact CB-CB 4.39Å; V258-Q291 HydrophobicContact CG1-CB 3.87Å; V258-Q291 HydrophobicContact CG2-CB 3.61Å; V258-Q291 VanDerWaalsContact N-OE1 3.16Å; V258-V295 HydrophobicContact CG2-CG2 4.19Å
259	H	91.9	Very high	90.5	Very high	37 Å²	37	45.7 Å²	45.7	17%	0.171	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148	166.5	176.7	73.9	-9.7	0	0	0	111.1	L52 V53 E263	L52-H259 WeakPolarHBondContact CA-O 3.4Å; L52-H259 VanDerWaalsContact CD2-C 3.48Å; V53-H259 PolarHBondContact N-O 3.03Å; V53-H259 PolarHBondContact O-N 3.03Å; V53-H259 PolarHBondContact O-ND1 3.05Å; H259-E263 PolarHBondContact CD2-O 3.11Å
260	R	90.9	Very high	91.2	Very high	105 Å²	105	46.3 Å²	46.3	40%	0.396	26%	0.262	S	S	.	.			trans	-83.8	138.8	165.5	-60.7	-172.7	-173.9	120.8	0.1	109.3	L52 G262 E263	L52-R260 HydrophobicContact CD2-CG 3.65Å; R260-G262 PolarHBondContact O-N 3.15Å; R260-E263 HydrophobicContact CB-CB 4.4Å; R260-E263 HydrophobicContact CB-CG 4.1Å; R260-E263 IonicContact NH1-OE1 3.21Å; R260-E263 PolarHBondContact NH1-OE1 2.89Å; R260-E263 IonicContact NH1-OE2 2.75Å; R260-E263 WeakPolarHBondContact O-CB 3.32Å; R260-E263 PolarHBondContact O-N 3.11Å
261	P	88.2	Confident	91.4	Very high	62 Å²	62	45.7 Å²	45.7	40%	0.403	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.7	123.2	176.1	-27.1	35.2	0	0	0	112.1	Q51 V53	Q51-P261 WeakPolarHBondContact O-CD 3.27Å; V53-P261 HydrophobicContact CG2-CG 3.67Å
262	G	84.4	Confident	91.5	Very high	86 Å²	86	45.2 Å²	45.2	89%	0.887	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	93.7	-7.2	-177.8	0	0	0	0	0	115.1	R260	R260-G262 PolarHBondContact O-N 3.15Å
263	E	87.8	Confident	91	Very high	91 Å²	91	49 Å²	49	43%	0.425	28%	0.279	S	S	.	.	S	Bend	trans	-95.9	160.1	169.5	-66.1	-179.4	178.8	0	0	110.8	H259 R260	H259-E263 PolarHBondContact CD2-O 3.11Å; R260-E263 HydrophobicContact CB-CB 4.4Å; R260-E263 HydrophobicContact CB-CG 4.1Å; R260-E263 IonicContact NH1-OE1 3.21Å; R260-E263 PolarHBondContact NH1-OE1 2.89Å; R260-E263 IonicContact NH1-OE2 2.75Å; R260-E263 WeakPolarHBondContact O-CB 3.32Å; R260-E263 PolarHBondContact O-N 3.11Å
264	P	89.4	Confident	90.7	Very high	119 Å²	119	48.6 Å²	48.6	77%	0.773	28%	0.276	S	S	*	.	P	Polyproline II helix	trans	-57	155.7	171.8	-24	34.4	0	0	0	113	G266	P264-G266 PolarHBondContact O-N 3.17Å
265	L	90.2	Very high	90	Very high	95 Å²	95	52.7 Å²	52.7	50%	0.497	30%	0.298	S	S	.	.	P	Polyproline II helix	trans	-57.4	138.2	175	-61.4	-179.4	0	0	0	111	V55 P213	V55-L265 HydrophobicContact CB-CD2 4.1Å; V55-L265 HydrophobicContact CG1-CD2 3.87Å; V55-L265 HydrophobicContact CG2-CD2 3.81Å; P213-L265 HydrophobicContact CG-CD1 4.15Å
266	G	89.6	Confident	89.4	Confident	32 Å²	32	53.1 Å²	53.1	33%	0.33	30%	0.303	S	S	.	.			trans	-73	-177.8	176.5	0	0	0	0	0	113.2	S257 P264 R268	S257-G266 VanDerWaalsContact OG-CA 3.26Å; S257-G266 WeakPolarHBondContact OG-CA 3.42Å; S257-G266 PolarHBondContact OG-N 3.37Å; S257-G266 VanDerWaalsContact OG-N 3.12Å; S257-G266 PolarHBondContact OG-O 3.41Å; P264-G266 PolarHBondContact O-N 3.17Å; G266-R268 PolarHBondContact O-N 3.46Å
267	T	90.2	Very high	89	Confident	62 Å²	62	54.2 Å²	54.2	38%	0.38	31%	0.308	S	S	.	.			trans	-60.1	130.3	178	-49.9	0	0	0	0	111.4	V301 N303	T267-V301 VanDerWaalsContact CB-O 3.31Å; T267-V301 WeakPolarHBondContact CB-O 3.46Å; T267-V301 WeakPolarHBondContact CG2-O 3.48Å; T267-V301 PolarHBondContact OG1-O 3.31Å; T267-V301 VanDerWaalsContact OG1-O 3.05Å; T267-N303 HydrophobicContact CG2-CB 3.72Å
268	R	91.7	Very high	88.6	Confident	121 Å²	121	62.1 Å²	62.1	46%	0.457	34%	0.337	S	S	.	.			trans	-76.3	131.7	178.2	-176	-179.9	70.1	158.5	-7.8	111.3	N255 G266 N303	N255-R268 HydrophobicContact CB-CG 4.12Å; N255-R268 VanDerWaalsContact OD1-CD 3.29Å; N255-R268 WeakPolarHBondContact OD1-CD 3.38Å; N255-R268 PolarHBondContact OD1-NH1 2.92Å; G266-R268 PolarHBondContact O-N 3.46Å; R268-N303 PolarHBondContact O-OD1 3.35Å
269	T	92.1	Very high	88.4	Confident	0 Å²	0	65.6 Å²	65.6	0%	0	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	131.9	164.1	-58.4	0	0	0	0	109.2	V256 E287 Q291 E304 R306	V256-T269 PolarHBondContact N-O 3.43Å; V256-T269 PolarHBondContact O-N 3.2Å; T269-E287 HydrophobicContact CG2-CG 4.35Å; T269-Q291 PolarHBondContact OG1-NE2 2.82Å; T269-Q291 VanDerWaalsContact OG1-NE2 3.11Å; T269-E304 HydrophobicContact CG2-CG 4.22Å; T269-R306 HydrophobicContact CG2-CB 4.43Å; T269-R306 HydrophobicContact CG2-CG 3.74Å
270	E	92.9	Very high	88.4	Confident	19 Å²	19	63.9 Å²	63.9	9%	0.089	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	118.6	179.9	-177.6	-174	179.9	0	0	109.2	A254 K272 E304 T305 R306 K321	A254-E270 CarbonylContact O-C 3.56Å; A254-E270 WeakPolarHBondContact O-CA 3.41Å; E270-K272 HydrophobicContact CG-CG 4.41Å; E270-K272 WeakPolarHBondContact OE1-CE 3.39Å; E270-K272 IonicContact OE1-NZ 3.4Å; E270-K272 PolarHBondContact OE1-NZ 2.99Å; E270-E304 PolarHBondContact N-O 3.11Å; E270-T305 CarbonylContact O-C 3.54Å; E270-T305 WeakPolarHBondContact O-CA 3.13Å; E270-T305 PolarHBondContact OE2-OG1 2.99Å; E270-R306 PolarHBondContact O-N 3.44Å; E270-K321 WeakPolarHBondContact OE2-CE 3.1Å; E270-K321 IonicContact OE2-NZ 3.11Å; E270-K321 PolarHBondContact OE2-NZ 3.15Å
271	V	92	Very high	88.5	Confident	0 Å²	0	59.8 Å²	59.8	0%	0	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	119.5	179.8	-171.2	0	0	0	0	109.3	A254 I274 A283 E287 R306 T315	A254-V271 HydrophobicContact CB-CB 4.44Å; A254-V271 PolarHBondContact N-O 3.14Å; A254-V271 PolarHBondContact O-N 2.86Å; V271-I274 HydrophobicContact CB-CD1 4.38Å; V271-I274 HydrophobicContact CG1-CD1 4.09Å; V271-I274 HydrophobicContact CG1-CG1 4.39Å; V271-A283 HydrophobicContact CG1-CB 4.24Å; V271-E287 HydrophobicContact CG2-CB 4.42Å; V271-E287 HydrophobicContact CG2-CG 4.17Å; V271-R306 WeakPolarHBondContact CA-O 3.33Å; V271-T315 HydrophobicContact CG1-CG2 4.05Å; V271-T315 HydrophobicContact CG2-CG2 4.29Å
272	K	89.4	Confident	88.8	Confident	52 Å²	52	63.7 Å²	63.7	23%	0.226	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	175.7	179.2	-60.9	-170.4	178.8	-73.9	0	112	D253 E270 T305 R306 A307 Y308 M318	D253-K272 IonicContact OD2-NZ 3.68Å; D253-K272 PolarHBondContact OD2-NZ 2.97Å; E270-K272 HydrophobicContact CG-CG 4.41Å; E270-K272 WeakPolarHBondContact OE1-CE 3.39Å; E270-K272 IonicContact OE1-NZ 3.4Å; E270-K272 PolarHBondContact OE1-NZ 2.99Å; K272-T305 HydrophobicContact CD-CG2 3.75Å; K272-T305 HydrophobicContact CG-CG2 3.91Å; K272-R306 PolarHBondContact N-O 2.84Å; K272-A307 WeakPolarHBondContact O-CA 3.48Å; K272-Y308 PolarHBondContact O-N 3.48Å; K272-Y308 VanDerWaalsContact O-N 3.16Å; K272-M318 HydrophobicContact CB-CE 4.22Å; K272-M318 HydrophobicContact CD-CE 4.41Å
273	N	82.6	Confident	89.2	Confident	91 Å²	91	59.7 Å²	59.7	49%	0.487	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	64	44.8	177.1	-168.4	29.6	0	0	0	113.3	N275 A307	N273-N275 PolarHBondContact OD1-ND2 3.48Å; N273-N275 VanDerWaalsContact OD1-ND2 3.16Å; N273-A307 HydrophobicContact CB-CB 4.46Å
274	I	85.8	Confident	89.5	Confident	12 Å²	12	55.3 Å²	55.3	6%	0.062	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	101	-179.8	-55.9	178	0	0	0	109.3	A254 V271 L280 A283	A254-I274 HydrophobicContact CB-CD1 3.95Å; V271-I274 HydrophobicContact CB-CD1 4.38Å; V271-I274 HydrophobicContact CG1-CD1 4.09Å; V271-I274 HydrophobicContact CG1-CG1 4.39Å; I274-L280 HydrophobicContact CD1-CD1 3.67Å; I274-L280 VanDerWaalsContact CG2-CA 3.41Å; I274-L280 HydrophobicContact CG2-CB 3.6Å; I274-L280 HydrophobicContact CG2-CD1 4.08Å; I274-L280 HydrophobicContact CG2-CG 4.45Å; I274-L280 VanDerWaalsContact CG2-N 3.34Å; I274-A283 HydrophobicContact CD1-CB 4.33Å
275	N	79.8	Confident	89.8	Confident	85 Å²	85	53.1 Å²	53.1	46%	0.455	26%	0.257	S	S	.	.			trans	-96.2	9.3	-172.3	-58.4	-40.4	0	0	0	114.4	C245 N273	C245-N275 CarbonylContact C-O 3.41Å; C245-N275 VanDerWaalsContact CB-C 3.49Å; C245-N275 WeakPolarHBondContact CB-O 3.49Å; N273-N275 PolarHBondContact OD1-ND2 3.48Å; N273-N275 VanDerWaalsContact OD1-ND2 3.16Å
276	S	84	Confident	90	Very high	30 Å²	30	51.5 Å²	51.5	21%	0.21	25%	0.246	C	C	.	.	S	Bend	trans	-161	156.3	171.2	77.4	0	0	0	0	111.9	R278 Y279 L280	S276-R278 PolarHBondContact O-N 2.97Å; S276-R278 PolarHBondContact OG-N 3.26Å; S276-Y279 CarbonylContact O-C 3.55Å; S276-Y279 PolarHBondContact O-N 2.92Å; S276-Y279 VanDerWaalsContact O-N 3.09Å; S276-Y279 WeakPolarHBondContact OG-CB 3.5Å; S276-Y279 WeakPolarHBondContact OG-CD2 3.41Å; S276-Y279 PolarHBondContact OG-N 3.29Å; S276-L280 PolarHBondContact O-N 3.24Å
277	L	86.6	Confident	90.3	Very high	23 Å²	23	50 Å²	50	12%	0.12	23%	0.23	C	C	.	.	H	α-helix	trans	-59.5	-33.5	173.5	-64	178.2	0	0	0	113	A222 V225 R226 L280 A281	A222-L277 HydrophobicContact CB-CB 4.43Å; V225-L277 HydrophobicContact CB-CD2 3.58Å; V225-L277 HydrophobicContact CG1-CD2 3.45Å; V225-L277 VanDerWaalsContact CG1-CD2 3.45Å; R226-L277 HydrophobicContact CB-CD1 4.01Å; L277-L280 HydrophobicContact CD2-CD2 4.4Å; L277-L280 WeakPolarHBondContact O-CB 3.37Å; L277-L280 PolarHBondContact O-N 3.18Å; L277-A281 PolarHBondContact O-N 2.87Å; L277-A281 VanDerWaalsContact O-N 3.1Å
278	R	87.6	Confident	90.5	Very high	177 Å²	177	48.2 Å²	48.2	67%	0.668	22%	0.218	S	C	*	.	H	α-helix	trans	-67.5	-40.4	175.8	-174.6	-174.5	-65.1	164	1.2	111	S276 R282	S276-R278 PolarHBondContact O-N 2.97Å; S276-R278 PolarHBondContact OG-N 3.26Å; R278-R282 WeakPolarHBondContact O-CG 3.33Å; R278-R282 PolarHBondContact O-N 3.17Å
279	Y	90.4	Very high	90.6	Very high	78 Å²	78	48 Å²	48	31%	0.306	22%	0.222	S	C	.	.	H	α-helix	trans	-71	-35	176.2	-62.2	-21.7	0	0	0	111.5	S276 R282 A283 Y308	S276-Y279 CarbonylContact O-C 3.55Å; S276-Y279 PolarHBondContact O-N 2.92Å; S276-Y279 VanDerWaalsContact O-N 3.09Å; S276-Y279 WeakPolarHBondContact OG-CB 3.5Å; S276-Y279 WeakPolarHBondContact OG-CD2 3.41Å; S276-Y279 PolarHBondContact OG-N 3.29Å; Y279-R282 PolarHBondContact O-N 2.72Å; Y279-A283 WeakPolarHBondContact O-CB 3.49Å; Y279-A283 PolarHBondContact O-N 3.04Å; Y279-Y308 AromaticContact CD1-CE1 3.92Å; Y279-Y308 HydrophobicContact CD1-CE1 3.92Å; Y279-Y308 HydrophobicContact CD2-CE1 4.41Å; Y279-Y308 HydrophobicContact CG-CD1 4.38Å; Y279-Y308 AromaticContact CG-CE1 3.7Å; Y279-Y308 HydrophobicContact CG-CE1 3.7Å
280	L	91.8	Very high	90.8	Very high	2 Å²	2	50.4 Å²	50.4	1%	0.01	23%	0.231	C	C	.	.	H	α-helix	trans	-56.6	-53.3	172.5	-179.5	63.2	0	0	0	111.1	L58 A221 V225 V252 A254 I274 S276 L277 R282 A283 I284	L58-L280 HydrophobicContact CD2-CD1 4.21Å; A221-L280 HydrophobicContact CB-CD2 4.45Å; V225-L280 HydrophobicContact CB-CD2 4.35Å; V225-L280 HydrophobicContact CG2-CD2 3.66Å; V252-L280 HydrophobicContact CG1-CD1 3.93Å; V252-L280 HydrophobicContact CG1-CD2 4.16Å; A254-L280 HydrophobicContact CB-CD1 4.04Å; I274-L280 HydrophobicContact CD1-CD1 3.67Å; I274-L280 VanDerWaalsContact CG2-CA 3.41Å; I274-L280 HydrophobicContact CG2-CB 3.6Å; I274-L280 HydrophobicContact CG2-CD1 4.08Å; I274-L280 HydrophobicContact CG2-CG 4.45Å; I274-L280 VanDerWaalsContact CG2-N 3.34Å; S276-L280 PolarHBondContact O-N 3.24Å; L277-L280 HydrophobicContact CD2-CD2 4.4Å; L277-L280 WeakPolarHBondContact O-CB 3.37Å; L277-L280 PolarHBondContact O-N 3.18Å; L280-R282 PolarHBondContact O-N 2.74Å; L280-A283 PolarHBondContact O-N 3.38Å; L280-I284 HydrophobicContact CD1-CD1 3.61Å; L280-I284 HydrophobicContact CD1-CG1 4.33Å; L280-I284 HydrophobicContact CG-CD1 3.84Å; L280-I284 WeakPolarHBondContact O-CB 3.46Å; L280-I284 WeakPolarHBondContact O-CD1 3.49Å; L280-I284 WeakPolarHBondContact O-CG1 3.39Å; L280-I284 PolarHBondContact O-N 3.43Å
281	A	92.8	Very high	90.8	Very high	18 Å²	18	49.5 Å²	49.5	15%	0.149	23%	0.227	C	C	.	.	H	α-helix	trans	-58.2	-49.1	179.8	0	0	0	0	0	111.6	G218 A222 L277 A283 I284 D285	G218-A281 WeakPolarHBondContact O-CB 3.24Å; A222-A281 HydrophobicContact CB-CB 4.18Å; L277-A281 PolarHBondContact O-N 2.87Å; L277-A281 VanDerWaalsContact O-N 3.1Å; A281-A283 PolarHBondContact O-N 3.11Å; A281-I284 PolarHBondContact O-N 2.75Å; A281-D285 WeakPolarHBondContact O-CB 3.45Å; A281-D285 VanDerWaalsContact O-CG 3.22Å; A281-D285 PolarHBondContact O-N 3.4Å
282	R	93	Very high	90.9	Very high	145 Å²	145	50.8 Å²	50.8	55%	0.547	24%	0.235	S	C	.	.	H	α-helix	trans	-63.4	-42.4	179.5	-72.4	-179	176.9	-168.7	-2.2	113.3	R278 Y279 L280 I284 D285 F286 Y308	R278-R282 WeakPolarHBondContact O-CG 3.33Å; R278-R282 PolarHBondContact O-N 3.17Å; Y279-R282 PolarHBondContact O-N 2.72Å; L280-R282 PolarHBondContact O-N 2.74Å; R282-I284 VanDerWaalsContact C-N 3.34Å; R282-D285 PolarHBondContact O-N 3.2Å; R282-F286 VanDerWaalsContact O-CB 3.24Å; R282-F286 WeakPolarHBondContact O-CB 2.95Å; R282-F286 PolarHBondContact O-N 3.35Å; R282-Y308 HydrophobicContact CB-CE2 4.39Å
283	A	93.8	Very high	91.1	Very high	1 Å²	1	51.6 Å²	51.6	1%	0.008	24%	0.239	C	C	.	.	H	α-helix	trans	-62.6	-43.7	-179.9	0	0	0	0	0	111.3	V271 I274 Y279 L280 A281 E287 Y308	V271-A283 HydrophobicContact CG1-CB 4.24Å; I274-A283 HydrophobicContact CD1-CB 4.33Å; Y279-A283 WeakPolarHBondContact O-CB 3.49Å; Y279-A283 PolarHBondContact O-N 3.04Å; L280-A283 PolarHBondContact O-N 3.38Å; A281-A283 PolarHBondContact O-N 3.11Å; A283-E287 VanDerWaalsContact O-CB 3.3Å; A283-E287 WeakPolarHBondContact O-CB 3.18Å; A283-E287 PolarHBondContact O-N 2.74Å; A283-Y308 HydrophobicContact CB-CD2 3.35Å; A283-Y308 HydrophobicContact CB-CE2 3.87Å; A283-Y308 HydrophobicContact CB-CG 3.74Å
284	I	94.9	Very high	91.6	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-65.6	-49.4	177.4	-71	165	0	0	0	110.6	V56 L58 A221 A254 V256 L280 A281 R282 F286 E287 I288	V56-I284 HydrophobicContact CG1-CD1 3.9Å; V56-I284 HydrophobicContact CG1-CG1 4.36Å; V56-I284 HydrophobicContact CG1-CG2 4.46Å; V56-I284 HydrophobicContact CG2-CG2 3.6Å; L58-I284 HydrophobicContact CD2-CD1 4.43Å; A221-I284 HydrophobicContact CB-CD1 3.32Å; A254-I284 HydrophobicContact CB-CD1 4.18Å; A254-I284 HydrophobicContact CB-CG1 3.98Å; V256-I284 HydrophobicContact CG2-CG1 4.1Å; V256-I284 HydrophobicContact CG2-CG2 4.41Å; L280-I284 HydrophobicContact CD1-CD1 3.61Å; L280-I284 HydrophobicContact CD1-CG1 4.33Å; L280-I284 HydrophobicContact CG-CD1 3.84Å; L280-I284 WeakPolarHBondContact O-CB 3.46Å; L280-I284 WeakPolarHBondContact O-CD1 3.49Å; L280-I284 WeakPolarHBondContact O-CG1 3.39Å; L280-I284 PolarHBondContact O-N 3.43Å; A281-I284 PolarHBondContact O-N 2.75Å; R282-I284 VanDerWaalsContact C-N 3.34Å; I284-F286 VanDerWaalsContact C-N 3.32Å; I284-F286 PolarHBondContact O-N 3.43Å; I284-E287 PolarHBondContact O-N 2.97Å; I284-I288 HydrophobicContact CG2-CD1 3.65Å; I284-I288 HydrophobicContact CG2-CG1 4.32Å; I284-I288 WeakPolarHBondContact O-CB 3.41Å; I284-I288 VanDerWaalsContact O-CG1 3.29Å; I284-I288 WeakPolarHBondContact O-CG1 3.42Å; I284-I288 PolarHBondContact O-N 3.15Å
285	D	94.9	Very high	91.8	Very high	73 Å²	73	51 Å²	51	39%	0.39	24%	0.239	S	C	.	.	H	α-helix	trans	-63.1	-40.5	-178.1	-68	-22.7	0	0	0	111.4	G218 A281 R282 Q289	G218-D285 WeakPolarHBondContact CA-OD1 3.34Å; G218-D285 PolarHBondContact N-OD1 3.1Å; A281-D285 WeakPolarHBondContact O-CB 3.45Å; A281-D285 VanDerWaalsContact O-CG 3.22Å; A281-D285 PolarHBondContact O-N 3.4Å; R282-D285 PolarHBondContact O-N 3.2Å; D285-Q289 WeakPolarHBondContact O-CB 3.5Å; D285-Q289 PolarHBondContact O-N 2.97Å
286	F	94.8	Very high	92.4	Very high	61 Å²	61	53.5 Å²	53.5	27%	0.268	25%	0.248	S	C	.	.	H	α-helix	trans	-61.9	-46.2	173.9	-178.8	-88.7	0	0	0	111.6	R282 I284 Q289 R290 E314 T315	R282-F286 VanDerWaalsContact O-CB 3.24Å; R282-F286 WeakPolarHBondContact O-CB 2.95Å; R282-F286 PolarHBondContact O-N 3.35Å; I284-F286 VanDerWaalsContact C-N 3.32Å; I284-F286 PolarHBondContact O-N 3.43Å; F286-Q289 PolarHBondContact O-N 3.09Å; F286-R290 WeakPolarHBondContact O-CB 3.34Å; F286-R290 PolarHBondContact O-N 3.01Å; F286-E314 HydrophobicContact CE1-CB 4.06Å; F286-E314 HydrophobicContact CE2-CB 4.09Å; F286-E314 HydrophobicContact CE2-CG 3.76Å; F286-E314 HydrophobicContact CZ-CB 3.66Å; F286-E314 HydrophobicContact CZ-CG 3.74Å; F286-T315 HydrophobicContact CD1-CG2 3.96Å; F286-T315 VanDerWaalsContact CE1-N 3.3Å; F286-T315 WeakPolarHBondContact CE1-OG1 3.37Å
287	E	95	Very high	92.8	Very high	0 Å²	0	61.6 Å²	61.6	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-67.6	-39.5	-178.6	-172.9	56.5	-143.8	0	0	112	V256 T269 V271 A283 I284 Q289 R290 Q291 R306 T315	V256-E287 HydrophobicContact CB-CB 4.42Å; V256-E287 HydrophobicContact CB-CG 3.92Å; V256-E287 HydrophobicContact CG1-CB 4.19Å; V256-E287 HydrophobicContact CG1-CG 3.93Å; V256-E287 HydrophobicContact CG2-CB 4.48Å; V256-E287 HydrophobicContact CG2-CG 4.38Å; T269-E287 HydrophobicContact CG2-CG 4.35Å; V271-E287 HydrophobicContact CG2-CB 4.42Å; V271-E287 HydrophobicContact CG2-CG 4.17Å; A283-E287 VanDerWaalsContact O-CB 3.3Å; A283-E287 WeakPolarHBondContact O-CB 3.18Å; A283-E287 PolarHBondContact O-N 2.74Å; I284-E287 PolarHBondContact O-N 2.97Å; E287-Q289 VanDerWaalsContact C-N 3.33Å; E287-Q289 PolarHBondContact O-N 2.83Å; E287-R290 PolarHBondContact O-N 3.38Å; E287-R290 IonicContact OE1-CZ 3.31Å; E287-R290 IonicContact OE1-NE 3.72Å; E287-R290 PolarHBondContact OE1-NE 2.83Å; E287-R290 IonicContact OE1-NH2 3.2Å; E287-R290 PolarHBondContact OE1-NH2 3.27Å; E287-R290 IonicContact OE2-NE 2.78Å; E287-R290 PolarHBondContact OE2-NE 3Å; E287-Q291 WeakPolarHBondContact O-CG 3.41Å; E287-Q291 PolarHBondContact O-N 2.98Å; E287-Q291 WeakPolarHBondContact OE1-CG 3.43Å; E287-Q291 PolarHBondContact OE1-NE2 3.02Å; E287-Q291 VanDerWaalsContact OE1-NE2 3.11Å; E287-R306 WeakPolarHBondContact OE2-CD 3.32Å; E287-R306 IonicContact OE2-NE 3.48Å; E287-T315 HydrophobicContact CB-CG2 4.39Å; E287-T315 PolarHBondContact OE2-OG1 3.14Å
288	I	94.9	Very high	92.9	Very high	24 Å²	24	63.9 Å²	63.9	12%	0.123	30%	0.304	C	S	.	.	H	α-helix	trans	-59	-46.5	172.3	-70.3	168.9	0	0	0	110	V56 V256 V258 I284 T292	V56-I288 HydrophobicContact CG2-CD1 4.21Å; V256-I288 HydrophobicContact CG1-CG1 3.61Å; V258-I288 HydrophobicContact CG1-CB 4.45Å; V258-I288 HydrophobicContact CG1-CG2 4.08Å; I284-I288 HydrophobicContact CG2-CD1 3.65Å; I284-I288 HydrophobicContact CG2-CG1 4.32Å; I284-I288 WeakPolarHBondContact O-CB 3.41Å; I284-I288 VanDerWaalsContact O-CG1 3.29Å; I284-I288 WeakPolarHBondContact O-CG1 3.42Å; I284-I288 PolarHBondContact O-N 3.15Å; I288-T292 VanDerWaalsContact O-CB 3.25Å; I288-T292 WeakPolarHBondContact O-CB 3.29Å; I288-T292 PolarHBondContact O-N 3.09Å; I288-T292 PolarHBondContact O-OG1 3.29Å
289	Q	94.5	Very high	92.9	Very high	116 Å²	116	57.3 Å²	57.3	54%	0.542	29%	0.291	S	S	.	.	H	α-helix	trans	-62.7	-47.1	178.3	-175.8	-179.8	-17.9	0	0	111.3	D285 F286 E287 Q291 T292 E293	D285-Q289 WeakPolarHBondContact O-CB 3.5Å; D285-Q289 PolarHBondContact O-N 2.97Å; F286-Q289 PolarHBondContact O-N 3.09Å; E287-Q289 VanDerWaalsContact C-N 3.33Å; E287-Q289 PolarHBondContact O-N 2.83Å; Q289-Q291 PolarHBondContact O-N 3.21Å; Q289-T292 WeakPolarHBondContact O-CB 3.38Å; Q289-T292 PolarHBondContact O-N 3.47Å; Q289-E293 PolarHBondContact NE2-OE1 3.19Å; Q289-E293 WeakPolarHBondContact O-CG 3.33Å; Q289-E293 PolarHBondContact O-N 3.02Å
290	R	94.6	Very high	92.8	Very high	51 Å²	51	57.6 Å²	57.6	19%	0.192	31%	0.309	C	S	.	.	H	α-helix	trans	-56	-52.2	178.1	-173.2	-160.4	77.6	117.3	-6.6	111.3	F286 E287 T292 E293 V294 E304	F286-R290 WeakPolarHBondContact O-CB 3.34Å; F286-R290 PolarHBondContact O-N 3.01Å; E287-R290 PolarHBondContact O-N 3.38Å; E287-R290 IonicContact OE1-CZ 3.31Å; E287-R290 IonicContact OE1-NE 3.72Å; E287-R290 PolarHBondContact OE1-NE 2.83Å; E287-R290 IonicContact OE1-NH2 3.2Å; E287-R290 PolarHBondContact OE1-NH2 3.27Å; E287-R290 IonicContact OE2-NE 2.78Å; E287-R290 PolarHBondContact OE2-NE 3Å; R290-T292 VanDerWaalsContact C-N 3.31Å; R290-T292 PolarHBondContact O-N 3.3Å; R290-E293 PolarHBondContact O-N 2.91Å; R290-V294 WeakPolarHBondContact O-CG2 3.3Å; R290-V294 PolarHBondContact O-N 3.26Å; R290-E304 IonicContact CZ-OE1 3.49Å; R290-E304 IonicContact NH1-OE1 3.57Å; R290-E304 PolarHBondContact NH1-OE1 3.44Å; R290-E304 IonicContact NH2-OE1 3.38Å; R290-E304 PolarHBondContact NH2-OE1 3.32Å; R290-E304 VanDerWaalsContact NH2-OE1 3.11Å
291	Q	94.2	Very high	92.7	Very high	1 Å²	1	58.2 Å²	58.2	1%	0.005	31%	0.313	C	S	.	.	H	α-helix	trans	-63.9	-39.1	-179.9	-68.2	-175.4	20.8	0	0	111.6	V256 V258 T269 E287 Q289 E293 V294 V295 V301	V256-Q291 PolarHBondContact O-NE2 2.8Å; V256-Q291 VanDerWaalsContact O-NE2 3.15Å; V258-Q291 HydrophobicContact CB-CB 4.39Å; V258-Q291 HydrophobicContact CG1-CB 3.87Å; V258-Q291 HydrophobicContact CG2-CB 3.61Å; V258-Q291 VanDerWaalsContact N-OE1 3.16Å; T269-Q291 PolarHBondContact OG1-NE2 2.82Å; T269-Q291 VanDerWaalsContact OG1-NE2 3.11Å; E287-Q291 WeakPolarHBondContact O-CG 3.41Å; E287-Q291 PolarHBondContact O-N 2.98Å; E287-Q291 WeakPolarHBondContact OE1-CG 3.43Å; E287-Q291 PolarHBondContact OE1-NE2 3.02Å; E287-Q291 VanDerWaalsContact OE1-NE2 3.11Å; Q289-Q291 PolarHBondContact O-N 3.21Å; Q291-E293 VanDerWaalsContact C-N 3.34Å; Q291-E293 PolarHBondContact O-N 2.93Å; Q291-V294 PolarHBondContact O-N 2.96Å; Q291-V295 WeakPolarHBondContact O-CG2 3.4Å; Q291-V295 PolarHBondContact O-N 3.11Å; Q291-V301 HydrophobicContact CB-CG2 4.01Å; Q291-V301 HydrophobicContact CG-CG1 3.97Å; Q291-V301 HydrophobicContact CG-CG2 4.01Å
292	T	93.4	Very high	92.4	Very high	26 Å²	26	62.7 Å²	62.7	16%	0.16	33%	0.334	C	S	.	.	H	α-helix	trans	-58.2	-46.5	175.1	-62.5	0	0	0	0	111.1	L52 I288 Q289 R290 V295 Q296	L52-T292 HydrophobicContact CB-CG2 4.35Å; L52-T292 HydrophobicContact CD1-CG2 3.99Å; I288-T292 VanDerWaalsContact O-CB 3.25Å; I288-T292 WeakPolarHBondContact O-CB 3.29Å; I288-T292 PolarHBondContact O-N 3.09Å; I288-T292 PolarHBondContact O-OG1 3.29Å; Q289-T292 WeakPolarHBondContact O-CB 3.38Å; Q289-T292 PolarHBondContact O-N 3.47Å; R290-T292 VanDerWaalsContact C-N 3.31Å; R290-T292 PolarHBondContact O-N 3.3Å; T292-V295 PolarHBondContact O-N 3.43Å; T292-Q296 HydrophobicContact CG2-CG 4.36Å; T292-Q296 VanDerWaalsContact O-CB 3.28Å; T292-Q296 WeakPolarHBondContact O-CB 3.31Å; T292-Q296 WeakPolarHBondContact O-CG 3.46Å; T292-Q296 PolarHBondContact O-N 2.81Å
293	E	93.6	Very high	92.1	Very high	70 Å²	70	59.4 Å²	59.4	33%	0.327	33%	0.327	S	S	.	.	H	α-helix	trans	-64.5	-40.4	177.8	-71.7	-175.8	-152.9	0	0	112.6	Q289 R290 Q291 R297	Q289-E293 PolarHBondContact NE2-OE1 3.19Å; Q289-E293 WeakPolarHBondContact O-CG 3.33Å; Q289-E293 PolarHBondContact O-N 3.02Å; R290-E293 PolarHBondContact O-N 2.91Å; Q291-E293 VanDerWaalsContact C-N 3.34Å; Q291-E293 PolarHBondContact O-N 2.93Å; E293-R297 WeakPolarHBondContact O-CB 3.43Å; E293-R297 VanDerWaalsContact O-CG 3.24Å; E293-R297 WeakPolarHBondContact O-CG 3.48Å; E293-R297 PolarHBondContact O-N 2.94Å; E293-R297 IonicContact OE2-NH2 2.85Å; E293-R297 PolarHBondContact OE2-NH2 2.97Å; E293-R297 VanDerWaalsContact OE2-NH2 3.07Å
294	V	92.7	Very high	91.7	Very high	44 Å²	44	60 Å²	60	27%	0.267	33%	0.33	S	S	.	.	H	α-helix	trans	-61.9	-49.6	176.9	171.4	0	0	0	0	110.7	R290 Q291 R297 G298 G299 V301	R290-V294 WeakPolarHBondContact O-CG2 3.3Å; R290-V294 PolarHBondContact O-N 3.26Å; Q291-V294 PolarHBondContact O-N 2.96Å; V294-R297 PolarHBondContact O-N 3.3Å; V294-G298 PolarHBondContact O-N 2.91Å; V294-G299 WeakPolarHBondContact O-CA 3.36Å; V294-G299 PolarHBondContact O-N 2.98Å; V294-V301 HydrophobicContact CB-CG2 4.35Å; V294-V301 HydrophobicContact CG1-CG2 4.09Å
295	V	91.4	Very high	91.4	Very high	45 Å²	45	60 Å²	60	27%	0.273	33%	0.33	S	S	.	.	H	α-helix	trans	-66.4	-39.3	-179.4	175.5	0	0	0	0	111.2	L52 V258 Q291 T292 R297 G298 V301	L52-V295 HydrophobicContact CD1-CB 3.92Å; L52-V295 HydrophobicContact CD1-CG1 3.8Å; L52-V295 HydrophobicContact CD2-CG1 4.31Å; V258-V295 HydrophobicContact CG2-CG2 4.19Å; Q291-V295 WeakPolarHBondContact O-CG2 3.4Å; Q291-V295 PolarHBondContact O-N 3.11Å; T292-V295 PolarHBondContact O-N 3.43Å; V295-R297 VanDerWaalsContact C-N 3.3Å; V295-R297 PolarHBondContact O-N 3.4Å; V295-G298 PolarHBondContact O-N 3.27Å; V295-V301 HydrophobicContact CG2-CG2 3.98Å
296	Q	90.8	Very high	91.3	Very high	139 Å²	139	57.9 Å²	57.9	65%	0.65	32%	0.316	S	S	*	.	H	α-helix	trans	-65.7	-31.4	177.1	-77	177.9	-2.6	0	0	113.1	L52 T292 G298	L52-Q296 HydrophobicContact CD1-CG 4.24Å; T292-Q296 HydrophobicContact CG2-CG 4.36Å; T292-Q296 VanDerWaalsContact O-CB 3.28Å; T292-Q296 WeakPolarHBondContact O-CB 3.31Å; T292-Q296 WeakPolarHBondContact O-CG 3.46Å; T292-Q296 PolarHBondContact O-N 2.81Å; Q296-G298 PolarHBondContact O-N 3.05Å
297	R	92.4	Very high	91.1	Very high	199 Å²	199	55.7 Å²	55.7	75%	0.751	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.9	1.7	173.4	-67.3	176.5	-159.9	-168.7	11.1	113.3	E293 V294 V295 G299	E293-R297 WeakPolarHBondContact O-CB 3.43Å; E293-R297 VanDerWaalsContact O-CG 3.24Å; E293-R297 WeakPolarHBondContact O-CG 3.48Å; E293-R297 PolarHBondContact O-N 2.94Å; E293-R297 IonicContact OE2-NH2 2.85Å; E293-R297 PolarHBondContact OE2-NH2 2.97Å; E293-R297 VanDerWaalsContact OE2-NH2 3.07Å; V294-R297 PolarHBondContact O-N 3.3Å; V295-R297 VanDerWaalsContact C-N 3.3Å; V295-R297 PolarHBondContact O-N 3.4Å; R297-G299 VanDerWaalsContact C-N 3.31Å
298	G	88.9	Confident	90.9	Very high	72 Å²	72	56.1 Å²	56.1	74%	0.742	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.2	14	-177.4	0	0	0	0	0	114.2	V294 V295 Q296	V294-G298 PolarHBondContact O-N 2.91Å; V295-G298 PolarHBondContact O-N 3.27Å; Q296-G298 PolarHBondContact O-N 3.05Å
299	G	89.2	Confident	90.6	Very high	38 Å²	38	57.6 Å²	57.6	39%	0.392	32%	0.32	S	S	.	.			trans	-82.7	166.6	173.4	0	0	0	0	0	112.6	V294 R297	V294-G299 WeakPolarHBondContact O-CA 3.36Å; V294-G299 PolarHBondContact O-N 2.98Å; R297-G299 VanDerWaalsContact C-N 3.31Å
300	A	88.3	Confident	90.2	Very high	85 Å²	85	55.2 Å²	55.2	70%	0.702	32%	0.316	S	S	*	.			trans	-104.3	134.7	174	0	0	0	0	0	110.7
301	V	89	Confident	89.8	Confident	15 Å²	15	62.1 Å²	62.1	9%	0.091	35%	0.347	C	S	.	.			trans	-75.3	128.3	172.7	178.9	0	0	0	0	108.8	T267 Q291 V294 V295	T267-V301 VanDerWaalsContact CB-O 3.31Å; T267-V301 WeakPolarHBondContact CB-O 3.46Å; T267-V301 WeakPolarHBondContact CG2-O 3.48Å; T267-V301 PolarHBondContact OG1-O 3.31Å; T267-V301 VanDerWaalsContact OG1-O 3.05Å; Q291-V301 HydrophobicContact CB-CG2 4.01Å; Q291-V301 HydrophobicContact CG-CG1 3.97Å; Q291-V301 HydrophobicContact CG-CG2 4.01Å; V294-V301 HydrophobicContact CB-CG2 4.35Å; V294-V301 HydrophobicContact CG1-CG2 4.09Å; V295-V301 HydrophobicContact CG2-CG2 3.98Å
302	L	86.6	Confident	89.5	Confident	111 Å²	111	65 Å²	65	58%	0.581	37%	0.367	S	S	*	.			trans	-83.5	146.9	176.8	-60	176.4	0	0	0	110.9	E304	L302-E304 PolarHBondContact O-N 3.39Å
303	N	86.4	Confident	89.3	Confident	77 Å²	77	64.8 Å²	64.8	41%	0.412	37%	0.371	S	S	.	.			trans	-83.4	90.7	174.5	-174.9	2.4	0	0	0	109.4	T267 R268 K321	T267-N303 HydrophobicContact CG2-CB 3.72Å; R268-N303 PolarHBondContact O-OD1 3.35Å; N303-K321 WeakPolarHBondContact O-CB 3.38Å
304	E	86	Confident	89.2	Confident	12 Å²	12	66.2 Å²	66.2	6%	0.056	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	156.6	-174.7	57.2	-179.3	165.9	0	0	111.3	T269 E270 R290 L302 R306 A317	T269-E304 HydrophobicContact CG2-CG 4.22Å; E270-E304 PolarHBondContact N-O 3.11Å; R290-E304 IonicContact CZ-OE1 3.49Å; R290-E304 IonicContact NH1-OE1 3.57Å; R290-E304 PolarHBondContact NH1-OE1 3.44Å; R290-E304 IonicContact NH2-OE1 3.38Å; R290-E304 PolarHBondContact NH2-OE1 3.32Å; R290-E304 VanDerWaalsContact NH2-OE1 3.11Å; L302-E304 PolarHBondContact O-N 3.39Å; E304-R306 HydrophobicContact CG-CG 3.89Å; E304-R306 IonicContact OE1-CZ 2.79Å; E304-R306 IonicContact OE1-NE 2.7Å; E304-R306 IonicContact OE1-NH1 3.51Å; E304-R306 PolarHBondContact OE1-NH1 3.22Å; E304-R306 IonicContact OE2-NH1 2.87Å; E304-R306 PolarHBondContact OE2-NH1 3.12Å; E304-A317 WeakPolarHBondContact OE2-CB 3.21Å
305	T	87.9	Confident	89.1	Confident	0 Å²	0	64.3 Å²	64.3	0%	0	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	122	166.6	-57.5	0	0	0	0	108.3	E270 K272 M318 R319 K321	E270-T305 CarbonylContact O-C 3.54Å; E270-T305 WeakPolarHBondContact O-CA 3.13Å; E270-T305 PolarHBondContact OE2-OG1 2.99Å; K272-T305 HydrophobicContact CD-CG2 3.75Å; K272-T305 HydrophobicContact CG-CG2 3.91Å; T305-M318 HydrophobicContact CG2-CE 3.75Å; T305-M318 PolarHBondContact O-N 3.1Å; T305-M318 VanDerWaalsContact O-N 3.11Å; T305-R319 PolarHBondContact N-O 3Å; T305-K321 WeakPolarHBondContact OG1-CE 3.25Å
306	R	91.8	Very high	89	Confident	30 Å²	30	65.7 Å²	65.7	11%	0.113	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	153.4	178.7	-55.7	-176.5	74.9	80.3	1.8	110.2	T269 E270 V271 K272 E287 E304 T315 V316	T269-R306 HydrophobicContact CG2-CB 4.43Å; T269-R306 HydrophobicContact CG2-CG 3.74Å; E270-R306 PolarHBondContact O-N 3.44Å; V271-R306 WeakPolarHBondContact CA-O 3.33Å; K272-R306 PolarHBondContact N-O 2.84Å; E287-R306 WeakPolarHBondContact OE2-CD 3.32Å; E287-R306 IonicContact OE2-NE 3.48Å; E304-R306 HydrophobicContact CG-CG 3.89Å; E304-R306 IonicContact OE1-CZ 2.79Å; E304-R306 IonicContact OE1-NE 2.7Å; E304-R306 IonicContact OE1-NH1 3.51Å; E304-R306 PolarHBondContact OE1-NH1 3.22Å; E304-R306 IonicContact OE2-NH1 2.87Å; E304-R306 PolarHBondContact OE2-NH1 3.12Å; R306-T315 PolarHBondContact NE-OG1 3.38Å; R306-T315 PolarHBondContact NH2-O 3.35Å; R306-V316 CarbonylContact C-O 3.55Å; R306-V316 WeakPolarHBondContact CA-O 3.41Å; R306-V316 WeakPolarHBondContact CB-O 3.47Å
307	A	90.9	Very high	88.9	Confident	15 Å²	15	61.5 Å²	61.5	12%	0.124	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	144.5	168	0	0	0	0	0	109.9	K272 N273 T315 V316 M318	K272-A307 WeakPolarHBondContact O-CA 3.48Å; N273-A307 HydrophobicContact CB-CB 4.46Å; A307-T315 CarbonylContact O-C 3.58Å; A307-T315 WeakPolarHBondContact O-CA 3.5Å; A307-V316 PolarHBondContact N-O 2.78Å; A307-V316 PolarHBondContact O-N 3.21Å; A307-M318 HydrophobicContact CB-CE 3.87Å; A307-M318 HydrophobicContact CB-CG 3.75Å; A307-M318 HydrophobicContact CB-SD 3.54Å; A307-M318 VanDerWaalsContact CB-SD 3.54Å
308	Y	91	Very high	88.3	Confident	8 Å²	8	57.1 Å²	57.1	3%	0.031	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	124.3	169.8	-179.6	-103.9	0	0	0	110.4	K272 Y279 R282 A283	K272-Y308 PolarHBondContact O-N 3.48Å; K272-Y308 VanDerWaalsContact O-N 3.16Å; Y279-Y308 AromaticContact CD1-CE1 3.92Å; Y279-Y308 HydrophobicContact CD1-CE1 3.92Å; Y279-Y308 HydrophobicContact CD2-CE1 4.41Å; Y279-Y308 HydrophobicContact CG-CD1 4.38Å; Y279-Y308 AromaticContact CG-CE1 3.7Å; Y279-Y308 HydrophobicContact CG-CE1 3.7Å; R282-Y308 HydrophobicContact CB-CE2 4.39Å; A283-Y308 HydrophobicContact CB-CD2 3.35Å; A283-Y308 HydrophobicContact CB-CE2 3.87Å; A283-Y308 HydrophobicContact CB-CG 3.74Å
309	D	89.4	Confident	87.6	Confident	56 Å²	56	58.8 Å²	58.8	30%	0.299	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	114.6	170.5	172.8	24	0	0	0	110	K311 S312 G313 E314 V316	D309-K311 PolarHBondContact O-N 2.85Å; D309-K311 PolarHBondContact OD1-N 2.9Å; D309-S312 WeakPolarHBondContact CB-OG 3.32Å; D309-S312 VanDerWaalsContact CG-OG 3.24Å; D309-S312 WeakPolarHBondContact OD2-CB 3.39Å; D309-S312 PolarHBondContact OD2-N 2.71Å; D309-S312 PolarHBondContact OD2-OG 2.91Å; D309-G313 WeakPolarHBondContact O-CA 3.48Å; D309-G313 PolarHBondContact O-N 2.99Å; D309-E314 PolarHBondContact N-O 3.27Å; D309-V316 HydrophobicContact CB-CG2 4.31Å
310	S	85	Confident	86.2	Confident	66 Å²	66	61.5 Å²	61.5	46%	0.462	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.5	-20.4	-178.4	61.8	0	0	0	0	113.9
311	K	87.4	Confident	84.7	Confident	196 Å²	196	60.4 Å²	60.4	85%	0.852	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.6	-49.3	179.8	-66.5	-179.8	-179.3	175.2	0	111.9	D309	D309-K311 PolarHBondContact O-N 2.85Å; D309-K311 PolarHBondContact OD1-N 2.9Å
312	S	88.1	Confident	82.7	Confident	60 Å²	60	68.6 Å²	68.6	42%	0.42	36%	0.359	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79	-28.5	176.5	55.7	0	0	0	0	112.6	D309 E314	D309-S312 WeakPolarHBondContact CB-OG 3.32Å; D309-S312 VanDerWaalsContact CG-OG 3.24Å; D309-S312 WeakPolarHBondContact OD2-CB 3.39Å; D309-S312 PolarHBondContact OD2-N 2.71Å; D309-S312 PolarHBondContact OD2-OG 2.91Å; S312-E314 VanDerWaalsContact C-N 3.27Å; S312-E314 PolarHBondContact OG-N 3.24Å
313	G	88.8	Confident	81.1	Confident	23 Å²	23	65.7 Å²	65.7	24%	0.237	36%	0.355	C	S	.	.	T	Hydrogen-bonded Turn	trans	77	15.2	-171.3	0	0	0	0	0	113.2	D309	D309-G313 WeakPolarHBondContact O-CA 3.48Å; D309-G313 PolarHBondContact O-N 2.99Å
314	E	91.4	Very high	79.7	Confident	100 Å²	100	70.6 Å²	70.6	47%	0.467	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	158.6	-175.8	-57.7	-175.6	168.7	0	0	111.4	F286 D309 S312	F286-E314 HydrophobicContact CE1-CB 4.06Å; F286-E314 HydrophobicContact CE2-CB 4.09Å; F286-E314 HydrophobicContact CE2-CG 3.76Å; F286-E314 HydrophobicContact CZ-CB 3.66Å; F286-E314 HydrophobicContact CZ-CG 3.74Å; D309-E314 PolarHBondContact N-O 3.27Å; S312-E314 VanDerWaalsContact C-N 3.27Å; S312-E314 PolarHBondContact OG-N 3.24Å
315	T	90.1	Very high	78.8	Confident	4 Å²	4	75.4 Å²	75.4	3%	0.025	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	130.2	166.2	61.8	0	0	0	0	109.1	V271 F286 E287 R306 A307	V271-T315 HydrophobicContact CG1-CG2 4.05Å; V271-T315 HydrophobicContact CG2-CG2 4.29Å; F286-T315 HydrophobicContact CD1-CG2 3.96Å; F286-T315 VanDerWaalsContact CE1-N 3.3Å; F286-T315 WeakPolarHBondContact CE1-OG1 3.37Å; E287-T315 HydrophobicContact CB-CG2 4.39Å; E287-T315 PolarHBondContact OE2-OG1 3.14Å; R306-T315 PolarHBondContact NE-OG1 3.38Å; R306-T315 PolarHBondContact NH2-O 3.35Å; A307-T315 CarbonylContact O-C 3.58Å; A307-T315 WeakPolarHBondContact O-CA 3.5Å
316	V	89.9	Confident	78.5	Confident	74 Å²	74	81.3 Å²	81.3	45%	0.448	43%	0.434	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	134.9	179.6	-175.4	0	0	0	0	109.2	R306 A307 D309 M318	R306-V316 CarbonylContact C-O 3.55Å; R306-V316 WeakPolarHBondContact CA-O 3.41Å; R306-V316 WeakPolarHBondContact CB-O 3.47Å; A307-V316 PolarHBondContact N-O 2.78Å; A307-V316 PolarHBondContact O-N 3.21Å; D309-V316 HydrophobicContact CB-CG2 4.31Å; V316-M318 PolarHBondContact O-N 3.48Å
317	A	89	Confident	78.3	Confident	51 Å²	51	83.1 Å²	83.1	42%	0.421	44%	0.442	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.2	129.2	175.8	0	0	0	0	0	110.1	E304	E304-A317 WeakPolarHBondContact OE2-CB 3.21Å
318	M	80.1	Confident	78.3	Confident	107 Å²	107	88.8 Å²	88.8	53%	0.527	46%	0.46	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	-53	174.6	-70.5	-166.2	-70.1	0	0	111.8	K272 T305 A307 V316	K272-M318 HydrophobicContact CB-CE 4.22Å; K272-M318 HydrophobicContact CD-CE 4.41Å; T305-M318 HydrophobicContact CG2-CE 3.75Å; T305-M318 PolarHBondContact O-N 3.1Å; T305-M318 VanDerWaalsContact O-N 3.11Å; A307-M318 HydrophobicContact CB-CE 3.87Å; A307-M318 HydrophobicContact CB-CG 3.75Å; A307-M318 HydrophobicContact CB-SD 3.54Å; A307-M318 VanDerWaalsContact CB-SD 3.54Å; V316-M318 PolarHBondContact O-N 3.48Å
319	R	72.9	Confident	78.4	Confident	107 Å²	107	92 Å²	92	40%	0.404	47%	0.474	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.4	140	-176.7	64.8	-179.6	-176.1	166.7	1.9	110.3	T305	T305-R319 PolarHBondContact N-O 3Å
320	D	60.3	Low	78.6	Confident	95 Å²	95	93.2 Å²	93.2	51%	0.508	48%	0.479	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	138.3	164.7	-67.4	-40.1	0	0	0	109.2	E322	D320-E322 HydrophobicContact CB-CG 3.89Å; D320-E322 PolarHBondContact O-N 2.84Å
321	K	57.7	Low	79.1	Confident	62 Å²	62	93 Å²	93	27%	0.27	48%	0.476	S	S	.	.			trans	-79	56	170.1	-67.6	-177.3	178.5	173.6	0	109.7	E270 N303 T305 G323	E270-K321 WeakPolarHBondContact OE2-CE 3.1Å; E270-K321 IonicContact OE2-NZ 3.11Å; E270-K321 PolarHBondContact OE2-NZ 3.15Å; N303-K321 WeakPolarHBondContact O-CB 3.38Å; T305-K321 WeakPolarHBondContact OG1-CE 3.25Å; K321-G323 PolarHBondContact O-N 2.92Å
322	E	45	Very low	79.6	Confident	187 Å²	187	84 Å²	84	87%	0.874	44%	0.437	S	S	*	.			trans	-66.8	4.9	178.3	-77.3	-166	151	0	0	113.9	D320	D320-E322 HydrophobicContact CB-CG 3.89Å; D320-E322 PolarHBondContact O-N 2.84Å
323	G	53.8	Low	79.9	Confident	49 Å²	49	85.5 Å²	85.5	51%	0.505	45%	0.445	S	S	.	.	S	Bend	trans	-160.8	144.7	160.9	0	0	0	0	0	110.8	K321 Q325	K321-G323 PolarHBondContact O-N 2.92Å; G323-Q325 PolarHBondContact O-N 3.3Å
324	L	56.8	Low	80.3	Confident	180 Å²	180	87.8 Å²	87.8	94%	0.942	45%	0.452	S	S	*	.			trans	-59.6	109.1	162.7	-74.5	161.3	0	0	0	106.9	D326	L324-D326 PolarHBondContact O-N 2.86Å
325	Q	67.1	Low	80.5	Confident	113 Å²	113	84 Å²	84	53%	0.528	44%	0.435	S	S	.	.			trans	-61.5	110.3	172.2	-83.5	-177.4	-25.1	0	0	108	G323 Y327	G323-Q325 PolarHBondContact O-N 3.3Å; Q325-Y327 HydrophobicContact CB-CE1 4.45Å; Q325-Y327 HydrophobicContact CB-CE2 4.31Å; Q325-Y327 WeakPolarHBondContact O-CD2 3.36Å; Q325-Y327 PolarHBondContact O-N 2.82Å; Q325-Y327 VanDerWaalsContact O-N 3.09Å; Q325-Y327 PolarHBondContact OE1-OH 3.41Å; Q325-Y327 VanDerWaalsContact OE1-OH 3.13Å
326	D	82.9	Confident	80.6	Confident	124 Å²	124	88.6 Å²	88.6	66%	0.663	47%	0.465	S	S	*	.			trans	-75.9	98	176	-176.7	6.1	0	0	0	109.3	L324 R328	L324-D326 PolarHBondContact O-N 2.86Å; D326-R328 PolarHBondContact O-N 2.74Å; D326-R328 WeakPolarHBondContact OD1-CA 3.2Å; D326-R328 PolarHBondContact OD1-N 2.84Å
327	Y	86.4	Confident	80.8	Confident	68 Å²	68	88.2 Å²	88.2	27%	0.267	46%	0.464	S	S	.	.			trans	-71.8	-1.1	176.3	-66.8	-65.8	0	0	0	113.5	K128 H129 Y130 Q325 F329	K128-Y327 HydrophobicContact CG-CD1 4.18Å; K128-Y327 HydrophobicContact CG-CG 4.09Å; H129-Y327 WeakPolarHBondContact CA-O 3.17Å; H129-Y327 WeakPolarHBondContact CB-O 3.19Å; H129-Y327 PolarHBondContact N-O 3.43Å; Y130-Y327 HydrophobicContact CD1-CD1 4.26Å; Y130-Y327 HydrophobicContact CD1-CE1 4.4Å; Y130-Y327 HydrophobicContact CG-CE1 4.43Å; Q325-Y327 HydrophobicContact CB-CE1 4.45Å; Q325-Y327 HydrophobicContact CB-CE2 4.31Å; Q325-Y327 WeakPolarHBondContact O-CD2 3.36Å; Q325-Y327 PolarHBondContact O-N 2.82Å; Q325-Y327 VanDerWaalsContact O-N 3.09Å; Q325-Y327 PolarHBondContact OE1-OH 3.41Å; Q325-Y327 VanDerWaalsContact OE1-OH 3.13Å; Y327-F329 HydrophobicContact CD2-CE2 4.32Å; Y327-F329 HydrophobicContact CG-CE2 4.4Å; Y327-F329 PolarHBondContact O-N 3.04Å
328	R	91.1	Very high	81.2	Confident	135 Å²	135	86.7 Å²	86.7	51%	0.509	45%	0.449	S	S	.	.			trans	45.3	58.3	175	-63.7	177.2	-67.3	167.7	2.2	112.3	H129 D326 M330	H129-R328 PolarHBondContact CE1-O 2.86Å; H129-R328 PolarHBondContact ND1-O 3.16Å; D326-R328 PolarHBondContact O-N 2.74Å; D326-R328 WeakPolarHBondContact OD1-CA 3.2Å; D326-R328 PolarHBondContact OD1-N 2.84Å; R328-M330 PolarHBondContact O-N 2.82Å
329	F	92.5	Very high	81.9	Confident	74 Å²	74	85.6 Å²	85.6	33%	0.325	44%	0.444	S	S	.	.			trans	-60.8	132.2	-179	-76.5	-91.6	0	0	0	111.3	D126 R127 K128 T142 Q144 Y327	D126-F329 HydrophobicContact CB-CD1 4.42Å; R127-F329 WeakPolarHBondContact O-CA 3.42Å; K128-F329 HydrophobicContact CB-CD1 4.12Å; K128-F329 HydrophobicContact CB-CE1 3.61Å; K128-F329 HydrophobicContact CB-CZ 4.09Å; K128-F329 HydrophobicContact CD-CE1 4.08Å; K128-F329 HydrophobicContact CD-CZ 3.89Å; K128-F329 HydrophobicContact CG-CE1 3.78Å; K128-F329 HydrophobicContact CG-CE2 4.42Å; K128-F329 HydrophobicContact CG-CZ 3.7Å; T142-F329 HydrophobicContact CG2-CE1 3.98Å; Q144-F329 HydrophobicContact CB-CD1 3.87Å; Q144-F329 HydrophobicContact CB-CE1 3.87Å; Q144-F329 HydrophobicContact CG-CD1 4.25Å; Q144-F329 HydrophobicContact CG-CE1 4.13Å; Q144-F329 HydrophobicContact CG-CZ 4.38Å; Q144-F329 VanDerWaalsContact OE1-CD2 3.24Å; Y327-F329 HydrophobicContact CD2-CE2 4.32Å; Y327-F329 HydrophobicContact CG-CE2 4.4Å; Y327-F329 PolarHBondContact O-N 3.04Å
330	M	94.8	Very high	82.9	Confident	83 Å²	83	80.8 Å²	80.8	41%	0.409	43%	0.427	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	144.4	179.6	-173.3	178.6	67.9	0	0	110	D126 R127 R328 E332	D126-M330 CarbonylContact C-O 3.49Å; D126-M330 VanDerWaalsContact CA-O 3.28Å; D126-M330 WeakPolarHBondContact CA-O 3.34Å; R127-M330 PolarHBondContact N-O 2.9Å; R127-M330 PolarHBondContact O-N 3.33Å; R328-M330 PolarHBondContact O-N 2.82Å; M330-E332 PolarHBondContact O-N 3.4Å
331	P	96.2	Very high	84.5	Confident	62 Å²	62	77.9 Å²	77.9	40%	0.403	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-45.9	137.1	166.7	-5.2	-4.3	0	0	0	112.7	R145 P333	R145-P331 VanDerWaalsContact NH1-CG 3.33Å; P331-P333 WeakPolarHBondContact O-CD 3.39Å
332	E	96.4	Very high	86.2	Confident	7 Å²	7	78.2 Å²	78.2	3%	0.033	41%	0.412	C	S	.	.			trans	-76.3	105	167.5	173.9	51.8	-100.6	0	0	109.1	F125 R127 I141 M330 N334 L335	F125-E332 HydrophobicContact CB-CB 3.96Å; F125-E332 HydrophobicContact CB-CG 4.48Å; F125-E332 PolarHBondContact O-N 3.27Å; R127-E332 HydrophobicContact CG-CB 4.38Å; R127-E332 WeakPolarHBondContact CG-OE2 3.5Å; R127-E332 IonicContact CZ-OE1 2.72Å; R127-E332 IonicContact CZ-OE2 2.67Å; R127-E332 VanDerWaalsContact NE-CD 3.34Å; R127-E332 IonicContact NE-OE1 2.64Å; R127-E332 PolarHBondContact NE-OE1 2.96Å; R127-E332 IonicContact NE-OE2 2.75Å; R127-E332 PolarHBondContact NE-OE2 3.2Å; R127-E332 IonicContact NH2-OE1 3.95Å; R127-E332 PolarHBondContact NH2-OE1 2.91Å; R127-E332 IonicContact NH2-OE2 3.56Å; R127-E332 PolarHBondContact NH2-OE2 3.31Å; I141-E332 HydrophobicContact CG2-CG 4.5Å; M330-E332 PolarHBondContact O-N 3.4Å; E332-N334 VanDerWaalsContact C-N 3.28Å; E332-N334 PolarHBondContact O-N 3.05Å; E332-N334 WeakPolarHBondContact OE1-CB 3.4Å; E332-N334 PolarHBondContact OE1-N 3.41Å; E332-N334 PolarHBondContact OE1-ND2 3.36Å; E332-L335 HydrophobicContact CG-CB 3.95Å; E332-L335 HydrophobicContact CG-CD1 3.86Å; E332-L335 HydrophobicContact CG-CG 3.88Å
333	P	95.7	Very high	88.4	Confident	90 Å²	90	72.6 Å²	72.6	58%	0.584	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.1	-22	-176.4	31.4	-38.6	0	0	0	113.4	P331 L335	P331-P333 WeakPolarHBondContact O-CD 3.39Å; P333-L335 VanDerWaalsContact C-N 3.29Å; P333-L335 PolarHBondContact O-N 2.92Å
334	N	95.8	Very high	90	Very high	71 Å²	71	76.4 Å²	76.4	38%	0.38	39%	0.393	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.2	-7.8	-175.3	-61.9	-30.4	0	0	0	112.9	L97 P98 R127 E332	L97-N334 HydrophobicContact CD2-CB 4.06Å; P98-N334 HydrophobicContact CG-CB 3.95Å; R127-N334 PolarHBondContact NH2-ND2 3.44Å; R127-N334 VanDerWaalsContact NH2-ND2 3.11Å; E332-N334 VanDerWaalsContact C-N 3.28Å; E332-N334 PolarHBondContact O-N 3.05Å; E332-N334 WeakPolarHBondContact OE1-CB 3.4Å; E332-N334 PolarHBondContact OE1-N 3.41Å; E332-N334 PolarHBondContact OE1-ND2 3.36Å
335	L	95.4	Very high	91.5	Very high	22 Å²	22	72.5 Å²	72.5	12%	0.115	39%	0.386	C	S	.	.	S	Bend	trans	-114.5	125	176.3	-69.9	173.4	0	0	0	110	F71 P98 F125 I141 E332 P333	F71-L335 HydrophobicContact CD1-CD1 3.94Å; F71-L335 HydrophobicContact CD1-CD2 4.4Å; F71-L335 HydrophobicContact CE1-CD1 3.29Å; F71-L335 HydrophobicContact CE1-CD2 4.33Å; F71-L335 HydrophobicContact CE1-CG 4.45Å; F71-L335 HydrophobicContact CZ-CD1 3.81Å; P98-L335 HydrophobicContact CB-CD1 4.38Å; P98-L335 HydrophobicContact CB-CD2 4.03Å; P98-L335 HydrophobicContact CB-CG 4.25Å; P98-L335 HydrophobicContact CG-CD1 4.25Å; P98-L335 HydrophobicContact CG-CD2 3.83Å; P98-L335 HydrophobicContact CG-CG 3.75Å; F125-L335 HydrophobicContact CB-CD1 3.98Å; F125-L335 HydrophobicContact CD2-CD1 3.9Å; F125-L335 HydrophobicContact CG-CD1 3.9Å; I141-L335 HydrophobicContact CG2-CD1 4.22Å; E332-L335 HydrophobicContact CG-CB 3.95Å; E332-L335 HydrophobicContact CG-CD1 3.86Å; E332-L335 HydrophobicContact CG-CG 3.88Å; P333-L335 VanDerWaalsContact C-N 3.29Å; P333-L335 PolarHBondContact O-N 2.92Å
336	P	93.8	Very high	92.6	Very high	100 Å²	100	69.5 Å²	69.5	65%	0.649	38%	0.378	S	S	*	.	P	Polyproline II helix	trans	-65.1	161.7	169.1	29.8	-34	0	0	0	110.4	L338	P336-L338 PolarHBondContact O-N 3.22Å
337	P	94.3	Very high	92.9	Very high	65 Å²	65	65 Å²	65	42%	0.422	35%	0.354	S	S	.	.	P	Polyproline II helix	trans	-55.3	133.9	173.1	-23.4	33.7	0	0	0	111.3	K122 S123 V124 L339	K122-P337 HydrophobicContact CG-CB 4.21Å; S123-P337 CarbonylContact O-C 3.6Å; V124-P337 HydrophobicContact CG1-CB 4.25Å; P337-L339 PolarHBondContact O-N 3.43Å
338	L	95.5	Very high	92.9	Very high	20 Å²	20	64.8 Å²	64.8	11%	0.105	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	123.5	171.9	171	62	0	0	0	108.8	L100 V105 K122 S123 F125 V148 P336 V340	L100-L338 HydrophobicContact CD2-CD1 3.98Å; L100-L338 HydrophobicContact CD2-CD2 4.47Å; V105-L338 HydrophobicContact CG1-CD1 4.03Å; V105-L338 HydrophobicContact CG1-CD2 3.71Å; V105-L338 HydrophobicContact CG1-CG 4.42Å; V105-L338 HydrophobicContact CG2-CD1 4.2Å; V105-L338 HydrophobicContact CG2-CD2 4.01Å; K122-L338 CarbonylContact C-O 3.56Å; K122-L338 WeakPolarHBondContact CA-O 3.45Å; S123-L338 PolarHBondContact N-O 3.07Å; S123-L338 PolarHBondContact O-N 3.37Å; F125-L338 HydrophobicContact CE2-CB 4.4Å; V148-L338 HydrophobicContact CG2-CD2 4.22Å; P336-L338 PolarHBondContact O-N 3.22Å; L338-V340 HydrophobicContact CG-CG2 4.45Å
339	L	95.2	Very high	92.6	Very high	84 Å²	84	63.7 Å²	63.7	44%	0.44	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	130	175.1	-59.2	179.9	0	0	0	110	K121 K122 P337 F341	K121-L339 WeakPolarHBondContact O-CA 3.4Å; K122-L339 HydrophobicContact CB-CD2 4.01Å; K122-L339 HydrophobicContact CD-CD2 4.44Å; K122-L339 HydrophobicContact CG-CD2 3.97Å; P337-L339 PolarHBondContact O-N 3.43Å; L339-F341 HydrophobicContact CB-CE2 3.86Å; L339-F341 HydrophobicContact CB-CZ 3.77Å; L339-F341 HydrophobicContact CD1-CZ 4.17Å
340	V	94.4	Very high	92.1	Very high	5 Å²	5	64.2 Å²	64.2	3%	0.03	41%	0.407	C	S	.	.			trans	-113.8	127.4	174.9	-179.3	0	0	0	0	107.7	V109 I119 K121 L338 V357 L359	V109-V340 HydrophobicContact CG2-CG2 4.32Å; I119-V340 HydrophobicContact CG2-CG1 4.35Å; K121-V340 PolarHBondContact O-N 3.48Å; L338-V340 HydrophobicContact CG-CG2 4.45Å; V340-V357 HydrophobicContact CG1-CG1 4.32Å; V340-L359 HydrophobicContact CG1-CD1 4.16Å; V340-L359 HydrophobicContact CG1-CD2 3.89Å; V340-L359 HydrophobicContact CG1-CG 3.74Å
341	F	94.6	Very high	91.6	Very high	35 Å²	35	62.9 Å²	62.9	15%	0.154	40%	0.403	C	S	.	.	B	Isolated β-bridge	trans	-104.8	152	-171.6	-62.8	-83.7	0	0	0	110.6	L339 S346 L347 P348 A356 V357 L358 L359	L339-F341 HydrophobicContact CB-CE2 3.86Å; L339-F341 HydrophobicContact CB-CZ 3.77Å; L339-F341 HydrophobicContact CD1-CZ 4.17Å; F341-S346 WeakPolarHBondContact CD1-O 3.34Å; F341-L347 HydrophobicContact CB-CD2 4.17Å; F341-L347 HydrophobicContact CD1-CD2 4.21Å; F341-L347 HydrophobicContact CD2-CD2 3.75Å; F341-L347 HydrophobicContact CE2-CD2 4.16Å; F341-L347 HydrophobicContact CG-CD2 3.77Å; F341-P348 HydrophobicContact CE1-CG 4.13Å; F341-P348 HydrophobicContact CZ-CG 4.17Å; F341-A356 HydrophobicContact CD2-CB 4.05Å; F341-A356 HydrophobicContact CE2-CB 4.4Å; F341-V357 PolarHBondContact N-O 2.77Å; F341-L358 HydrophobicContact CB-CD2 3.85Å; F341-L358 WeakPolarHBondContact O-CA 3.41Å; F341-L359 WeakPolarHBondContact O-CG 3.37Å; F341-L359 PolarHBondContact O-N 3.27Å
342	E	92.8	Very high	91.1	Very high	69 Å²	69	66.3 Å²	66.3	32%	0.322	41%	0.414	S	S	.	.	S	Bend	trans	-74.7	-50	179.9	-70.6	-71.1	-178.8	0	0	110.9	K121 S346 L359 C360	K121-E342 WeakPolarHBondContact CE-OE1 3.49Å; K121-E342 IonicContact NZ-OE1 3.33Å; K121-E342 PolarHBondContact NZ-OE1 3.25Å; E342-S346 PolarHBondContact N-OG 3.27Å; E342-L359 PolarHBondContact O-N 3.15Å; E342-L359 WeakPolarHBondContact OE2-CD1 3.18Å; E342-C360 WeakPolarHBondContact O-CB 3.38Å; E342-C360 PolarHBondContact O-N 3.47Å; E342-C360 PolarHBondContact O-SG 3.4Å; E342-C360 VanDerWaalsContact O-SG 3.39Å
343	D	91.4	Very high	90.4	Very high	68 Å²	68	67.7 Å²	67.7	36%	0.364	43%	0.426	S	S	.	.	S	Bend	trans	-150	176.4	-175.6	58.4	37.8	0	0	0	111.5	A345 S346	D343-A345 PolarHBondContact O-N 3.1Å; D343-A345 WeakPolarHBondContact OD1-CA 3.46Å; D343-A345 WeakPolarHBondContact OD1-CB 3.48Å; D343-A345 PolarHBondContact OD1-N 3.28Å; D343-S346 PolarHBondContact N-OG 2.78Å; D343-S346 PolarHBondContact O-N 2.73Å; D343-S346 PolarHBondContact O-OG 2.83Å; D343-S346 PolarHBondContact OD1-N 3.46Å
344	E	88.1	Confident	89.8	Confident	129 Å²	129	66.1 Å²	66.1	60%	0.603	43%	0.426	S	S	*	.	G	3₁₀ helix	trans	-62.1	-29.2	177.2	-66.8	-175.2	-175.7	0	0	113.2	S346 L347 A353 L358	E344-S346 VanDerWaalsContact C-N 3.27Å; E344-S346 PolarHBondContact O-N 2.92Å; E344-L347 HydrophobicContact CB-CD1 4.4Å; E344-L347 WeakPolarHBondContact O-CB 3.42Å; E344-L347 WeakPolarHBondContact O-CG 3.32Å; E344-L347 PolarHBondContact O-N 2.98Å; E344-A353 HydrophobicContact CG-CB 4.18Å; E344-L358 HydrophobicContact CG-CD1 3.63Å
345	A	87.8	Confident	89.2	Confident	98 Å²	98	69.3 Å²	69.3	81%	0.81	44%	0.439	S	S	*	.	G	3₁₀ helix	trans	-71.3	-25.1	179.4	0	0	0	0	0	112.4	D343 L347	D343-A345 PolarHBondContact O-N 3.1Å; D343-A345 WeakPolarHBondContact OD1-CA 3.46Å; D343-A345 WeakPolarHBondContact OD1-CB 3.48Å; D343-A345 PolarHBondContact OD1-N 3.28Å; A345-L347 VanDerWaalsContact C-N 3.27Å; A345-L347 PolarHBondContact O-N 3.42Å
346	S	89.1	Confident	88.9	Confident	51 Å²	51	68.6 Å²	68.6	36%	0.357	44%	0.437	S	S	.	.	G	3₁₀ helix	trans	-80.6	-2.3	175.2	70.8	0	0	0	0	114.3	F341 E342 D343 E344	F341-S346 WeakPolarHBondContact CD1-O 3.34Å; E342-S346 PolarHBondContact N-OG 3.27Å; D343-S346 PolarHBondContact N-OG 2.78Å; D343-S346 PolarHBondContact O-N 2.73Å; D343-S346 PolarHBondContact O-OG 2.83Å; D343-S346 PolarHBondContact OD1-N 3.46Å; E344-S346 VanDerWaalsContact C-N 3.27Å; E344-S346 PolarHBondContact O-N 2.92Å
347	L	89.1	Confident	88.8	Confident	29 Å²	29	64.3 Å²	64.3	15%	0.152	41%	0.408	C	S	.	.	S	Bend	trans	-72.9	138.9	179.2	-68	173.5	0	0	0	111.9	F341 E344 A345 V351 A353 A356 L358	F341-L347 HydrophobicContact CB-CD2 4.17Å; F341-L347 HydrophobicContact CD1-CD2 4.21Å; F341-L347 HydrophobicContact CD2-CD2 3.75Å; F341-L347 HydrophobicContact CE2-CD2 4.16Å; F341-L347 HydrophobicContact CG-CD2 3.77Å; E344-L347 HydrophobicContact CB-CD1 4.4Å; E344-L347 WeakPolarHBondContact O-CB 3.42Å; E344-L347 WeakPolarHBondContact O-CG 3.32Å; E344-L347 PolarHBondContact O-N 2.98Å; A345-L347 VanDerWaalsContact C-N 3.27Å; A345-L347 PolarHBondContact O-N 3.42Å; L347-V351 HydrophobicContact CD2-CG1 4.27Å; L347-A353 HydrophobicContact CD1-CB 4.14Å; L347-A356 HydrophobicContact CD2-CB 3.4Å; L347-A356 VanDerWaalsContact CD2-CB 3.4Å; L347-L358 HydrophobicContact CD1-CD2 4.37Å; L347-L358 HydrophobicContact CD2-CD2 4.01Å; L347-L358 HydrophobicContact CG-CD2 4.27Å
348	P	87.6	Confident	88.8	Confident	64 Å²	64	61.7 Å²	61.7	42%	0.416	39%	0.391	S	S	.	.	P	Polyproline II helix	trans	-62.3	149.2	169.8	-19	31.4	0	0	0	111.6	F341 G350 V351	F341-P348 HydrophobicContact CE1-CG 4.13Å; F341-P348 HydrophobicContact CZ-CG 4.17Å; P348-G350 PolarHBondContact O-N 2.93Å; P348-V351 HydrophobicContact CB-CG2 4.09Å; P348-V351 HydrophobicContact CG-CG2 4.23Å; P348-V351 PolarHBondContact O-N 2.9Å; P348-V351 VanDerWaalsContact O-N 3.12Å
349	A	84.8	Confident	88.7	Confident	112 Å²	112	61 Å²	61	93%	0.926	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.1	126.3	175.5	0	0	0	0	0	111.1
350	G	82.3	Confident	88.6	Confident	84 Å²	84	59.8 Å²	59.8	87%	0.866	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	91.9	-2.6	-179.7	0	0	0	0	0	115.6	P348	P348-G350 PolarHBondContact O-N 2.93Å
351	V	84.1	Confident	88.5	Confident	56 Å²	56	63.5 Å²	63.5	34%	0.339	41%	0.408	S	S	.	.			trans	-91.5	120.7	171.4	-179.3	0	0	0	0	109.5	L347 P348 A356	L347-V351 HydrophobicContact CD2-CG1 4.27Å; P348-V351 HydrophobicContact CB-CG2 4.09Å; P348-V351 HydrophobicContact CG-CG2 4.23Å; P348-V351 PolarHBondContact O-N 2.9Å; P348-V351 VanDerWaalsContact O-N 3.12Å; V351-A356 HydrophobicContact CG1-CB 4.31Å
352	E	84.9	Confident	88.5	Confident	134 Å²	134	62.7 Å²	62.7	63%	0.626	41%	0.405	S	S	*	.			trans	-75.4	141.4	174.5	-65.3	-178.2	176.1	0	0	111.1	G354 Q355 A356	E352-G354 PolarHBondContact O-N 3.45Å; E352-G354 VanDerWaalsContact O-N 3.11Å; E352-Q355 HydrophobicContact CB-CG 4.43Å; E352-Q355 PolarHBondContact O-N 3.33Å; E352-A356 PolarHBondContact O-N 2.85Å
353	A	81.7	Confident	88.5	Confident	35 Å²	35	66.6 Å²	66.6	29%	0.289	42%	0.417	S	S	.	.	G	3₁₀ helix	trans	-55.5	-31.7	176.1	0	0	0	0	0	112.6	E344 L347 Q355 A356 L358	E344-A353 HydrophobicContact CG-CB 4.18Å; L347-A353 HydrophobicContact CD1-CB 4.14Å; A353-Q355 PolarHBondContact O-N 3.11Å; A353-A356 PolarHBondContact O-N 2.88Å; A353-L358 HydrophobicContact CB-CD1 4.29Å
354	G	82.6	Confident	88.6	Confident	57 Å²	57	67.6 Å²	67.6	59%	0.588	43%	0.434	S	S	*	.	G	3₁₀ helix	trans	-63	-21.5	175.4	0	0	0	0	0	114.5	K102 E352	K102-G354 PolarHBondContact NZ-O 2.9Å; E352-G354 PolarHBondContact O-N 3.45Å; E352-G354 VanDerWaalsContact O-N 3.11Å
355	Q	83.1	Confident	88.7	Confident	138 Å²	138	63.8 Å²	63.8	65%	0.645	43%	0.43	S	S	*	.	G	3₁₀ helix	trans	-98.9	-16.4	-180	-63	179.6	-25.4	0	0	113	E352 A353	E352-Q355 HydrophobicContact CB-CG 4.43Å; E352-Q355 PolarHBondContact O-N 3.33Å; A353-Q355 PolarHBondContact O-N 3.11Å
356	A	89.6	Confident	89	Confident	8 Å²	8	61.4 Å²	61.4	7%	0.066	40%	0.403	C	S	.	.	S	Bend	trans	-95.5	162.9	-179	0	0	0	0	0	112.7	K102 F341 L347 V351 E352 A353 L358	K102-A356 VanDerWaalsContact CE-O 3.31Å; K102-A356 WeakPolarHBondContact CE-O 3.31Å; K102-A356 PolarHBondContact NZ-O 3.16Å; F341-A356 HydrophobicContact CD2-CB 4.05Å; F341-A356 HydrophobicContact CE2-CB 4.4Å; L347-A356 HydrophobicContact CD2-CB 3.4Å; L347-A356 VanDerWaalsContact CD2-CB 3.4Å; V351-A356 HydrophobicContact CG1-CB 4.31Å; E352-A356 PolarHBondContact O-N 2.85Å; A353-A356 PolarHBondContact O-N 2.88Å; A356-L358 HydrophobicContact CB-CD2 4.27Å
357	V	92.6	Very high	89.2	Confident	9 Å²	9	61 Å²	61	6%	0.055	40%	0.399	C	S	.	.			trans	-105.4	116.1	169.6	-179.7	0	0	0	0	107.9	K102 V105 E106 V109 V340 F341 L362	K102-V357 HydrophobicContact CG-CG2 4.28Å; V105-V357 HydrophobicContact CB-CG2 4.22Å; V105-V357 HydrophobicContact CG1-CB 4.48Å; V105-V357 HydrophobicContact CG1-CG1 4.36Å; V105-V357 HydrophobicContact CG1-CG2 3.86Å; E106-V357 HydrophobicContact CG-CG1 4.24Å; E106-V357 HydrophobicContact CG-CG2 4.19Å; V109-V357 HydrophobicContact CG2-CG1 4.38Å; V340-V357 HydrophobicContact CG1-CG1 4.32Å; F341-V357 PolarHBondContact N-O 2.77Å; V357-L362 HydrophobicContact CG1-CD1 3.69Å
358	L	94.3	Very high	89.3	Confident	10 Å²	10	62.4 Å²	62.4	5%	0.052	41%	0.406	C	S	.	.	B	Isolated β-bridge	trans	-108.4	124.1	-175	-58.1	-178	0	0	0	110.9	F341 E344 L347 A353 A356 L362	F341-L358 HydrophobicContact CB-CD2 3.85Å; F341-L358 WeakPolarHBondContact O-CA 3.41Å; E344-L358 HydrophobicContact CG-CD1 3.63Å; L347-L358 HydrophobicContact CD1-CD2 4.37Å; L347-L358 HydrophobicContact CD2-CD2 4.01Å; L347-L358 HydrophobicContact CG-CD2 4.27Å; A353-L358 HydrophobicContact CB-CD1 4.29Å; A356-L358 HydrophobicContact CB-CD2 4.27Å; L358-L362 WeakPolarHBondContact O-CG 3.39Å; L358-L362 PolarHBondContact O-N 3.33Å
359	L	93.6	Very high	89.5	Confident	6 Å²	6	61 Å²	61	3%	0.031	39%	0.394	C	S	.	.	H	α-helix	trans	-65.9	-39.4	-179.1	-72	167.9	0	0	0	112.4	V109 L113 I119 V340 F341 E342 T361 L362 R363	V109-L359 HydrophobicContact CG1-CD2 3.59Å; L113-L359 HydrophobicContact CD1-CD2 4.36Å; L113-L359 HydrophobicContact CD2-CD2 4.45Å; I119-L359 HydrophobicContact CB-CD2 4.2Å; I119-L359 HydrophobicContact CG1-CD2 4.06Å; I119-L359 HydrophobicContact CG2-CD2 4.08Å; V340-L359 HydrophobicContact CG1-CD1 4.16Å; V340-L359 HydrophobicContact CG1-CD2 3.89Å; V340-L359 HydrophobicContact CG1-CG 3.74Å; F341-L359 WeakPolarHBondContact O-CG 3.37Å; F341-L359 PolarHBondContact O-N 3.27Å; E342-L359 PolarHBondContact O-N 3.15Å; E342-L359 WeakPolarHBondContact OE2-CD1 3.18Å; L359-T361 PolarHBondContact O-N 2.95Å; L359-L362 PolarHBondContact O-N 3.41Å; L359-R363 VanDerWaalsContact O-CB 3.23Å; L359-R363 WeakPolarHBondContact O-CB 3.46Å; L359-R363 PolarHBondContact O-N 3.46Å
360	C	93.1	Very high	89.8	Confident	58 Å²	58	55.9 Å²	55.9	39%	0.392	35%	0.352	S	S	.	.	H	α-helix	trans	-61	-45.3	179.8	65.5	0	0	0	0	112	E342 R363 A364	E342-C360 WeakPolarHBondContact O-CB 3.38Å; E342-C360 PolarHBondContact O-N 3.47Å; E342-C360 PolarHBondContact O-SG 3.4Å; E342-C360 VanDerWaalsContact O-SG 3.39Å; C360-R363 PolarHBondContact O-N 3.5Å; C360-A364 WeakPolarHBondContact O-CB 3.19Å; C360-A364 PolarHBondContact O-N 3.38Å
361	T	92.3	Very high	90.2	Very high	84 Å²	84	53.3 Å²	53.3	52%	0.515	32%	0.32	S	S	.	.	H	α-helix	trans	-64.2	-46.4	178.6	-50.2	0	0	0	0	111.1	L359 A364 G365	L359-T361 PolarHBondContact O-N 2.95Å; T361-A364 PolarHBondContact O-N 3.16Å; T361-G365 PolarHBondContact O-N 3.18Å
362	L	93.9	Very high	90.6	Very high	18 Å²	18	54.2 Å²	54.2	9%	0.094	33%	0.326	C	S	.	.	H	α-helix	trans	-65.2	-41.1	178.8	-67.1	-178.3	0	0	0	111.8	E106 V109 M110 L113 V357 L358 L359 G365 L366	E106-L362 HydrophobicContact CB-CD1 4.4Å; E106-L362 HydrophobicContact CB-CD2 4.11Å; E106-L362 HydrophobicContact CG-CD1 4.42Å; E106-L362 HydrophobicContact CG-CD2 4.15Å; V109-L362 HydrophobicContact CB-CD1 3.83Å; V109-L362 HydrophobicContact CG1-CD1 3.55Å; M110-L362 HydrophobicContact CG-CB 4.22Å; M110-L362 HydrophobicContact CG-CD1 4.34Å; M110-L362 HydrophobicContact CG-CD2 3.85Å; M110-L362 HydrophobicContact CG-CG 4.36Å; M110-L362 HydrophobicContact SD-CD2 4.1Å; L113-L362 HydrophobicContact CD1-CB 4.18Å; V357-L362 HydrophobicContact CG1-CD1 3.69Å; L358-L362 WeakPolarHBondContact O-CG 3.39Å; L358-L362 PolarHBondContact O-N 3.33Å; L359-L362 PolarHBondContact O-N 3.41Å; L362-G365 PolarHBondContact O-N 3.05Å; L362-L366 WeakPolarHBondContact O-CG 3.09Å; L362-L366 PolarHBondContact O-N 3.34Å
363	R	93.6	Very high	90.9	Very high	150 Å²	150	50.7 Å²	50.7	57%	0.566	31%	0.307	S	S	*	.	H	α-helix	trans	-64.5	-40.4	177.7	-173.4	176.7	-77.4	153.8	-2.5	111.9	L113 L359 C360 G365 L366	L113-R363 HydrophobicContact CD1-CB 4.35Å; L359-R363 VanDerWaalsContact O-CB 3.23Å; L359-R363 WeakPolarHBondContact O-CB 3.46Å; L359-R363 PolarHBondContact O-N 3.46Å; C360-R363 PolarHBondContact O-N 3.5Å; R363-G365 VanDerWaalsContact C-N 3.33Å; R363-L366 PolarHBondContact O-N 2.99Å
364	A	92.6	Very high	91.4	Very high	89 Å²	89	49.8 Å²	49.8	74%	0.736	30%	0.296	S	S	*	.	H	α-helix	trans	-70.2	-29.7	176.1	0	0	0	0	0	112.8	C360 T361 L366	C360-A364 WeakPolarHBondContact O-CB 3.19Å; C360-A364 PolarHBondContact O-N 3.38Å; T361-A364 PolarHBondContact O-N 3.16Å; A364-L366 VanDerWaalsContact C-N 3.35Å
365	G	91.1	Very high	91.8	Very high	50 Å²	50	50.8 Å²	50.8	52%	0.515	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.4	0.2	177.2	0	0	0	0	0	115	T361 L362 R363 P367	T361-G365 PolarHBondContact O-N 3.18Å; L362-G365 PolarHBondContact O-N 3.05Å; R363-G365 VanDerWaalsContact C-N 3.33Å; G365-P367 WeakPolarHBondContact O-CD 3.24Å
366	L	93.3	Very high	92.3	Very high	47 Å²	47	48 Å²	48	25%	0.246	27%	0.271	C	S	.	.	P	Polyproline II helix	trans	-67.5	125.4	179	-71.9	178.7	0	0	0	110.5	M110 L113 L235 L362 R363 A364	M110-L366 HydrophobicContact CB-CD2 4.11Å; M110-L366 HydrophobicContact CE-CD2 4.24Å; M110-L366 HydrophobicContact CG-CD2 4.3Å; L113-L366 HydrophobicContact CB-CD1 3.91Å; L235-L366 HydrophobicContact CD2-CD2 3.68Å; L362-L366 WeakPolarHBondContact O-CG 3.09Å; L362-L366 PolarHBondContact O-N 3.34Å; R363-L366 PolarHBondContact O-N 2.99Å; A364-L366 VanDerWaalsContact C-N 3.35Å
367	P	92.9	Very high	92.3	Very high	42 Å²	42	47.6 Å²	47.6	27%	0.273	27%	0.268	S	S	.	.	P	Polyproline II helix	trans	-70.7	164.2	173.9	27.9	-30.9	0	0	0	111.2	A234 L235 G365 L369	A234-P367 WeakPolarHBondContact O-CG 3.48Å; L235-P367 HydrophobicContact CD2-CG 4Å; G365-P367 WeakPolarHBondContact O-CD 3.24Å; P367-L369 PolarHBondContact O-N 3.24Å
368	E	91.1	Very high	92.2	Very high	60 Å²	60	49.3 Å²	49.3	28%	0.28	28%	0.278	S	S	.	.	P	Polyproline II helix	trans	-61.3	119.7	174.2	-168.6	-176.8	171.7	0	0	110.5	V372 R373 R376	E368-V372 HydrophobicContact CG-CB 3.85Å; E368-V372 HydrophobicContact CG-CG1 3.73Å; E368-R373 HydrophobicContact CB-CG 4.23Å; E368-R373 HydrophobicContact CG-CG 3.71Å; E368-R373 PolarHBondContact O-NE 3.42Å; E368-R373 PolarHBondContact O-NH2 2.97Å; E368-R373 VanDerWaalsContact O-NH2 3.07Å; E368-R373 WeakPolarHBondContact OE1-CA 3.41Å; E368-R373 PolarHBondContact OE1-N 2.85Å; E368-R376 WeakPolarHBondContact OE1-CD 3.09Å; E368-R376 IonicContact OE1-NE 2.74Å; E368-R376 IonicContact OE1-NH1 3.65Å; E368-R376 IonicContact OE2-CZ 3.7Å; E368-R376 IonicContact OE2-NH1 2.72Å; E368-R376 PolarHBondContact OE2-NH1 2.99Å
369	L	92.5	Very high	92.2	Very high	34 Å²	34	56.6 Å²	56.6	18%	0.178	31%	0.312	C	S	.	.	P	Polyproline II helix	trans	-71.3	154.3	-178.3	-60.8	-179.5	0	0	0	112.1	A114 I231 L235 P367 S371 V372 R373	A114-L369 HydrophobicContact CB-CD1 4.31Å; A114-L369 HydrophobicContact CB-CD2 3.89Å; I231-L369 HydrophobicContact CG2-CD2 4.39Å; L235-L369 HydrophobicContact CD2-CD2 4.21Å; P367-L369 PolarHBondContact O-N 3.24Å; L369-S371 VanDerWaalsContact C-N 3.28Å; L369-S371 PolarHBondContact O-N 2.95Å; L369-V372 HydrophobicContact CB-CG2 4.41Å; L369-V372 PolarHBondContact O-N 3.29Å; L369-R373 PolarHBondContact O-N 2.85Å
370	P	91.6	Very high	92	Very high	5 Å²	5	60.9 Å²	60.9	3%	0.032	34%	0.338	C	S	.	.	H	α-helix	trans	-52.9	-39.2	-179.3	-28.3	35.5	0	0	0	114.5	L230 I231 R373 R374 V392	L230-P370 HydrophobicContact CB-CB 4.3Å; L230-P370 HydrophobicContact CB-CG 3.72Å; I231-P370 HydrophobicContact CG1-CG 4.1Å; P370-R373 PolarHBondContact O-N 2.87Å; P370-R374 WeakPolarHBondContact O-CG 3.25Å; P370-R374 PolarHBondContact O-N 3.22Å; P370-V392 HydrophobicContact CB-CG1 3.81Å
371	S	90.7	Very high	91.8	Very high	30 Å²	30	60.9 Å²	60.9	21%	0.21	33%	0.331	C	S	.	.	H	α-helix	trans	-61.8	-44.6	176.3	60.3	0	0	0	0	112.6	L369 R374 D375	L369-S371 VanDerWaalsContact C-N 3.28Å; L369-S371 PolarHBondContact O-N 2.95Å; S371-R374 PolarHBondContact O-N 3.23Å; S371-D375 PolarHBondContact O-N 3.01Å; S371-D375 VanDerWaalsContact O-N 3.13Å
372	V	91.7	Very high	91.6	Very high	74 Å²	74	58.2 Å²	58.2	45%	0.448	32%	0.32	S	S	.	.	H	α-helix	trans	-66.5	-41.7	179.4	-176.7	0	0	0	0	109.9	E368 L369 R374 D375 R376	E368-V372 HydrophobicContact CG-CB 3.85Å; E368-V372 HydrophobicContact CG-CG1 3.73Å; L369-V372 HydrophobicContact CB-CG2 4.41Å; L369-V372 PolarHBondContact O-N 3.29Å; V372-R374 VanDerWaalsContact C-N 3.34Å; V372-R374 PolarHBondContact O-N 3.45Å; V372-D375 PolarHBondContact O-N 3.31Å; V372-R376 WeakPolarHBondContact O-CB 3.27Å; V372-R376 PolarHBondContact O-N 3.36Å
373	R	91	Very high	91.4	Very high	61 Å²	61	57.7 Å²	57.7	23%	0.23	32%	0.317	C	S	.	.	H	α-helix	trans	-58.8	-43.7	174.7	-66.2	-177	-165.5	-172.5	3.7	112.1	E368 L369 P370 D375 R376 L377 V392	E368-R373 HydrophobicContact CB-CG 4.23Å; E368-R373 HydrophobicContact CG-CG 3.71Å; E368-R373 PolarHBondContact O-NE 3.42Å; E368-R373 PolarHBondContact O-NH2 2.97Å; E368-R373 VanDerWaalsContact O-NH2 3.07Å; E368-R373 WeakPolarHBondContact OE1-CA 3.41Å; E368-R373 PolarHBondContact OE1-N 2.85Å; L369-R373 PolarHBondContact O-N 2.85Å; P370-R373 PolarHBondContact O-N 2.87Å; R373-D375 PolarHBondContact O-N 3.08Å; R373-R376 PolarHBondContact O-N 2.87Å; R373-L377 VanDerWaalsContact O-CG 3.31Å; R373-L377 WeakPolarHBondContact O-CG 3.32Å; R373-L377 PolarHBondContact O-N 2.99Å; R373-V392 HydrophobicContact CB-CG2 4.37Å
374	R	91.9	Very high	91.2	Very high	16 Å²	16	54.9 Å²	54.9	6%	0.06	31%	0.313	C	S	.	.	H	α-helix	trans	-61.1	-44.3	177.4	-74.4	-173.9	-67	-142.5	-2.2	111.6	E227 P370 S371 V372 L377 V378 V392	E227-R374 IonicContact OE1-CZ 3.66Å; E227-R374 IonicContact OE1-NH1 2.63Å; E227-R374 IonicContact OE1-NH2 3.71Å; E227-R374 PolarHBondContact OE1-NH2 3.4Å; E227-R374 IonicContact OE2-CZ 3.64Å; E227-R374 VanDerWaalsContact OE2-CZ 3.28Å; E227-R374 IonicContact OE2-NH1 3.27Å; E227-R374 PolarHBondContact OE2-NH1 3.5Å; E227-R374 IonicContact OE2-NH2 2.77Å; E227-R374 PolarHBondContact OE2-NH2 2.87Å; P370-R374 WeakPolarHBondContact O-CG 3.25Å; P370-R374 PolarHBondContact O-N 3.22Å; S371-R374 PolarHBondContact O-N 3.23Å; V372-R374 VanDerWaalsContact C-N 3.34Å; V372-R374 PolarHBondContact O-N 3.45Å; R374-L377 PolarHBondContact O-N 3.13Å; R374-V378 WeakPolarHBondContact O-CG2 3.2Å; R374-V378 PolarHBondContact O-N 3.35Å; R374-V392 HydrophobicContact CG-CB 3.83Å; R374-V392 HydrophobicContact CG-CG1 4.18Å; R374-V392 HydrophobicContact CG-CG2 3.62Å
375	D	91.3	Very high	90.9	Very high	77 Å²	77	54.2 Å²	54.2	41%	0.412	30%	0.301	S	S	.	.	H	α-helix	trans	-66	-41.9	178.4	-68.2	-21.9	0	0	0	111.3	S371 V372 R373 L377 V378 Q379	S371-D375 PolarHBondContact O-N 3.01Å; S371-D375 VanDerWaalsContact O-N 3.13Å; V372-D375 PolarHBondContact O-N 3.31Å; R373-D375 PolarHBondContact O-N 3.08Å; D375-L377 PolarHBondContact O-N 3.38Å; D375-V378 PolarHBondContact O-N 2.94Å; D375-Q379 WeakPolarHBondContact O-CG 3.45Å; D375-Q379 PolarHBondContact O-N 2.94Å
376	R	93.6	Very high	90.7	Very high	80 Å²	80	54.5 Å²	54.5	30%	0.302	29%	0.289	S	S	.	.	H	α-helix	trans	-58.1	-46.8	173.9	-173.3	-171.1	79	179.3	12.2	111.9	E368 V372 R373 V378 Q379 T380 E402	E368-R376 WeakPolarHBondContact OE1-CD 3.09Å; E368-R376 IonicContact OE1-NE 2.74Å; E368-R376 IonicContact OE1-NH1 3.65Å; E368-R376 IonicContact OE2-CZ 3.7Å; E368-R376 IonicContact OE2-NH1 2.72Å; E368-R376 PolarHBondContact OE2-NH1 2.99Å; V372-R376 WeakPolarHBondContact O-CB 3.27Å; V372-R376 PolarHBondContact O-N 3.36Å; R373-R376 PolarHBondContact O-N 2.87Å; R376-V378 VanDerWaalsContact C-N 3.3Å; R376-V378 PolarHBondContact O-N 3.3Å; R376-Q379 PolarHBondContact O-N 2.96Å; R376-T380 VanDerWaalsContact O-CB 3.32Å; R376-T380 WeakPolarHBondContact O-CB 2.89Å; R376-T380 PolarHBondContact O-N 3.29Å; R376-T380 PolarHBondContact O-OG1 3.18Å; R376-T380 VanDerWaalsContact O-OG1 3.08Å; R376-E402 IonicContact CZ-OE1 2.75Å; R376-E402 IonicContact NH2-OE1 3.98Å; R376-E402 PolarHBondContact NH2-OE1 3.4Å
377	L	90.3	Very high	90.5	Very high	0 Å²	0	54.4 Å²	54.4	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-60.9	-39	179.2	-74	172.1	0	0	0	112.2	R373 R374 D375 Y381 L383 L391 V392 M398	R373-L377 VanDerWaalsContact O-CG 3.31Å; R373-L377 WeakPolarHBondContact O-CG 3.32Å; R373-L377 PolarHBondContact O-N 2.99Å; R374-L377 PolarHBondContact O-N 3.13Å; D375-L377 PolarHBondContact O-N 3.38Å; L377-Y381 HydrophobicContact CD2-CD2 3.83Å; L377-Y381 HydrophobicContact CD2-CE2 3.9Å; L377-Y381 WeakPolarHBondContact O-CB 3.4Å; L377-Y381 PolarHBondContact O-N 3.28Å; L377-Y381 VanDerWaalsContact O-N 3.15Å; L377-L383 HydrophobicContact CB-CD1 4.45Å; L377-L391 HydrophobicContact CD1-CB 4.34Å; L377-L391 HydrophobicContact CD1-CD1 4.08Å; L377-V392 HydrophobicContact CD1-CG2 3.85Å; L377-M398 HydrophobicContact CD1-CG 4.42Å
378	V	91	Very high	90.4	Very high	45 Å²	45	52.6 Å²	52.6	27%	0.273	28%	0.275	S	S	.	.	H	α-helix	trans	-66.8	-44.9	176.1	171.7	0	0	0	0	110.9	R374 D375 R376 G382 S388	R374-V378 WeakPolarHBondContact O-CG2 3.2Å; R374-V378 PolarHBondContact O-N 3.35Å; D375-V378 PolarHBondContact O-N 2.94Å; R376-V378 VanDerWaalsContact C-N 3.3Å; R376-V378 PolarHBondContact O-N 3.3Å; V378-G382 WeakPolarHBondContact O-CA 3.44Å; V378-G382 PolarHBondContact O-N 3.05Å; V378-S388 WeakPolarHBondContact CG2-OG 3.43Å
379	Q	92.4	Very high	90.2	Very high	163 Å²	163	50.8 Å²	50.8	76%	0.762	27%	0.266	S	S	*	.	H	α-helix	trans	-70.4	-45.7	-177.8	-69.9	174.9	8.3	0	0	112.8	D375 R376	D375-Q379 WeakPolarHBondContact O-CG 3.45Å; D375-Q379 PolarHBondContact O-N 2.94Å; R376-Q379 PolarHBondContact O-N 2.96Å
380	T	90.5	Very high	90	Very high	95 Å²	95	50.8 Å²	50.8	58%	0.583	27%	0.268	S	S	*	.	H	α-helix	trans	-75.6	-41.9	-174.9	-58	0	0	0	0	112.5	R376	R376-T380 VanDerWaalsContact O-CB 3.32Å; R376-T380 WeakPolarHBondContact O-CB 2.89Å; R376-T380 PolarHBondContact O-N 3.29Å; R376-T380 PolarHBondContact O-OG1 3.18Å; R376-T380 VanDerWaalsContact O-OG1 3.08Å
381	Y	88.4	Confident	89.9	Confident	59 Å²	59	50.6 Å²	50.6	23%	0.231	27%	0.267	C	S	.	.	H	α-helix	trans	-107.4	-0.6	-173	-63.6	-69.5	0	0	0	113.6	L377 L383 F401 M405 P412	L377-Y381 HydrophobicContact CD2-CD2 3.83Å; L377-Y381 HydrophobicContact CD2-CE2 3.9Å; L377-Y381 WeakPolarHBondContact O-CB 3.4Å; L377-Y381 PolarHBondContact O-N 3.28Å; L377-Y381 VanDerWaalsContact O-N 3.15Å; Y381-L383 PolarHBondContact O-N 3.43Å; Y381-F401 HydrophobicContact CD2-CE1 4.09Å; Y381-F401 HydrophobicContact CE2-CE1 4.24Å; Y381-F401 HydrophobicContact CG-CE1 4.32Å; Y381-M405 HydrophobicContact CD1-CE 4.46Å; Y381-M405 HydrophobicContact CE1-CB 4.46Å; Y381-M405 HydrophobicContact CE1-CE 4.43Å; Y381-M405 HydrophobicContact CE1-CG 4.32Å; Y381-P412 HydrophobicContact CD1-CB 4.09Å; Y381-P412 HydrophobicContact CD1-CG 3.82Å; Y381-P412 HydrophobicContact CG-CB 4.35Å; Y381-P412 HydrophobicContact CG-CG 4.45Å
382	G	89.2	Confident	89.9	Confident	27 Å²	27	50 Å²	50	28%	0.278	26%	0.262	S	S	.	.			trans	62	28.1	179.9	0	0	0	0	0	113.6	V378 R413	V378-G382 WeakPolarHBondContact O-CA 3.44Å; V378-G382 PolarHBondContact O-N 3.05Å; G382-R413 PolarHBondContact O-NE 3.48Å; G382-R413 PolarHBondContact O-NH2 2.89Å
383	L	89	Confident	89.6	Confident	7 Å²	7	47.1 Å²	47.1	4%	0.037	24%	0.244	C	C	.	.			trans	-75.4	156	-178.6	-62	177.5	0	0	0	111.6	L377 Y381 L391 F401 P412 I416	L377-L383 HydrophobicContact CB-CD1 4.45Å; Y381-L383 PolarHBondContact O-N 3.43Å; L383-L391 HydrophobicContact CD1-CD1 4.08Å; L383-F401 HydrophobicContact CD1-CE1 4.15Å; L383-F401 HydrophobicContact CD1-CZ 4.02Å; L383-P412 HydrophobicContact CD2-CB 4.17Å; L383-I416 HydrophobicContact CD2-CB 3.96Å; L383-I416 HydrophobicContact CD2-CG1 4.29Å; L383-I416 HydrophobicContact CD2-CG2 3.87Å
384	L	88.6	Confident	89.3	Confident	92 Å²	92	46 Å²	46	48%	0.482	24%	0.241	S	C	.	.			trans	-72.8	146.9	170.4	-63.3	173.6	0	0	0	110.5	E386 H387 S388	L384-E386 HydrophobicContact CB-CG 3.99Å; L384-E386 WeakPolarHBondContact CD1-OE1 3.46Å; L384-E386 PolarHBondContact O-N 3.37Å; L384-H387 WeakPolarHBondContact O-CB 3.45Å; L384-H387 PolarHBondContact O-N 3.02Å; L384-S388 PolarHBondContact O-N 3.19Å
385	P	87.8	Confident	88.8	Confident	74 Å²	74	50 Å²	50	48%	0.481	26%	0.264	S	S	.	.	H	α-helix	trans	-56.5	-32.6	178.8	-27.8	35.4	0	0	0	114.6	V167 H387 S388 F389	V167-P385 HydrophobicContact CG2-CB 4.37Å; P385-H387 VanDerWaalsContact C-N 3.28Å; P385-H387 PolarHBondContact O-N 3.45Å; P385-S388 PolarHBondContact O-OG 3.3Å; P385-S388 VanDerWaalsContact O-OG 3.07Å; P385-F389 VanDerWaalsContact O-CB 3.27Å; P385-F389 WeakPolarHBondContact O-CB 3.38Å; P385-F389 PolarHBondContact O-N 2.87Å
386	E	86.9	Confident	88.5	Confident	57 Å²	57	47.5 Å²	47.5	27%	0.266	26%	0.256	S	S	.	.	H	α-helix	trans	-64.7	-33.4	176.2	63.3	-173.9	164.3	0	0	112.5	V167 L384 T390	V167-E386 HydrophobicContact CG2-CB 4.23Å; L384-E386 HydrophobicContact CB-CG 3.99Å; L384-E386 WeakPolarHBondContact CD1-OE1 3.46Å; L384-E386 PolarHBondContact O-N 3.37Å; E386-T390 PolarHBondContact O-N 2.93Å; E386-T390 VanDerWaalsContact O-N 3.14Å; E386-T390 PolarHBondContact O-OG1 3.11Å
387	H	88.6	Confident	88.3	Confident	44 Å²	44	43.7 Å²	43.7	20%	0.204	24%	0.242	C	C	.	.	H	α-helix	trans	-76.6	-43.6	178.4	-64.5	-31	0	0	0	111.5	L384 P385 F389 T390 L391 I416	L384-H387 WeakPolarHBondContact O-CB 3.45Å; L384-H387 PolarHBondContact O-N 3.02Å; P385-H387 VanDerWaalsContact C-N 3.28Å; P385-H387 PolarHBondContact O-N 3.45Å; H387-F389 VanDerWaalsContact C-N 3.28Å; H387-F389 PolarHBondContact O-N 3.37Å; H387-T390 PolarHBondContact O-N 3.15Å; H387-L391 WeakPolarHBondContact O-CG 3.3Å; H387-L391 PolarHBondContact O-N 2.89Å; H387-I416 HydrophobicContact CB-CD1 4.47Å; H387-I416 HydrophobicContact CB-CG1 3.71Å
388	S	89.4	Confident	88.3	Confident	4 Å²	4	44.3 Å²	44.3	3%	0.028	25%	0.245	C	C	.	.	H	α-helix	trans	-63.4	-37.5	175.3	66.9	0	0	0	0	111.5	V378 L384 P385 T390 L391 V392	V378-S388 WeakPolarHBondContact CG2-OG 3.43Å; L384-S388 PolarHBondContact O-N 3.19Å; P385-S388 PolarHBondContact O-OG 3.3Å; P385-S388 VanDerWaalsContact O-OG 3.07Å; S388-T390 PolarHBondContact O-N 3.41Å; S388-L391 PolarHBondContact O-N 3.42Å; S388-V392 WeakPolarHBondContact O-CG2 3.41Å; S388-V392 PolarHBondContact O-N 3.24Å; S388-V392 VanDerWaalsContact O-N 3.15Å
389	F	87.8	Confident	88.3	Confident	22 Å²	22	47 Å²	47	10%	0.096	25%	0.254	C	S	.	.	H	α-helix	trans	-57.9	-45.9	172	-179.9	-99.8	0	0	0	112.3	S157 L159 P385 H387 N393	S157-F389 WeakPolarHBondContact O-CE2 3.32Å; S157-F389 WeakPolarHBondContact O-CZ 3.25Å; L159-F389 HydrophobicContact CD1-CD1 4.4Å; L159-F389 HydrophobicContact CD1-CE1 4.17Å; L159-F389 HydrophobicContact CD2-CD1 4.47Å; L159-F389 HydrophobicContact CG-CD1 4.26Å; L159-F389 HydrophobicContact CG-CE1 3.97Å; P385-F389 VanDerWaalsContact O-CB 3.27Å; P385-F389 WeakPolarHBondContact O-CB 3.38Å; P385-F389 PolarHBondContact O-N 2.87Å; H387-F389 VanDerWaalsContact C-N 3.28Å; H387-F389 PolarHBondContact O-N 3.37Å; F389-N393 WeakPolarHBondContact CE1-ND2 3.3Å; F389-N393 WeakPolarHBondContact CE2-ND2 3.3Å; F389-N393 WeakPolarHBondContact CZ-ND2 3.5Å; F389-N393 VanDerWaalsContact O-CB 3.31Å; F389-N393 WeakPolarHBondContact O-CB 3.29Å; F389-N393 PolarHBondContact O-N 3.47Å; F389-N393 PolarHBondContact O-ND2 3.03Å
390	T	88.4	Confident	88.3	Confident	35 Å²	35	39.8 Å²	39.8	22%	0.215	22%	0.22	C	C	.	.	H	α-helix	trans	-66.4	-42.6	179.3	-55.5	0	0	0	0	111.9	E386 H387 S388 V392 N393 E394 T420 L424	E386-T390 PolarHBondContact O-N 2.93Å; E386-T390 VanDerWaalsContact O-N 3.14Å; E386-T390 PolarHBondContact O-OG1 3.11Å; H387-T390 PolarHBondContact O-N 3.15Å; S388-T390 PolarHBondContact O-N 3.41Å; T390-V392 PolarHBondContact O-N 3.43Å; T390-N393 PolarHBondContact O-N 2.95Å; T390-E394 WeakPolarHBondContact O-CG 3.46Å; T390-E394 PolarHBondContact O-N 2.97Å; T390-T420 HydrophobicContact CG2-CG2 4.21Å; T390-L424 HydrophobicContact CG2-CD2 3.77Å
391	L	90.3	Very high	88.5	Confident	0 Å²	0	35.3 Å²	35.3	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-61.1	-43	179.8	-75.2	176.7	0	0	0	113.2	L377 L383 H387 S388 L397 F401 I416 V419	L377-L391 HydrophobicContact CD1-CB 4.34Å; L377-L391 HydrophobicContact CD1-CD1 4.08Å; L383-L391 HydrophobicContact CD1-CD1 4.08Å; H387-L391 WeakPolarHBondContact O-CG 3.3Å; H387-L391 PolarHBondContact O-N 2.89Å; S388-L391 PolarHBondContact O-N 3.42Å; L391-L397 HydrophobicContact CD2-CD2 4.12Å; L391-L397 HydrophobicContact CD2-CG 3.93Å; L391-F401 HydrophobicContact CD1-CB 4.49Å; L391-F401 HydrophobicContact CD1-CD1 3.94Å; L391-F401 HydrophobicContact CD1-CE1 4.33Å; L391-F401 HydrophobicContact CD1-CG 4.07Å; L391-F401 HydrophobicContact CD2-CB 3.84Å; L391-F401 HydrophobicContact CD2-CG 4.17Å; L391-I416 HydrophobicContact CD1-CD1 3.56Å; L391-I416 HydrophobicContact CD2-CD1 3.56Å; L391-I416 HydrophobicContact CG-CD1 3.61Å; L391-V419 HydrophobicContact CD2-CG1 4.22Å
392	V	89.3	Confident	88.7	Confident	18 Å²	18	34.4 Å²	34.4	11%	0.109	19%	0.191	C	C	.	.	H	α-helix	trans	-80.4	-24.4	-174.7	174.6	0	0	0	0	112.1	P370 R373 R374 L377 S388 T390	P370-V392 HydrophobicContact CB-CG1 3.81Å; R373-V392 HydrophobicContact CB-CG2 4.37Å; R374-V392 HydrophobicContact CG-CB 3.83Å; R374-V392 HydrophobicContact CG-CG1 4.18Å; R374-V392 HydrophobicContact CG-CG2 3.62Å; L377-V392 HydrophobicContact CD1-CG2 3.85Å; S388-V392 WeakPolarHBondContact O-CG2 3.41Å; S388-V392 PolarHBondContact O-N 3.24Å; S388-V392 VanDerWaalsContact O-N 3.15Å; T390-V392 PolarHBondContact O-N 3.43Å
393	N	86.3	Confident	88.9	Confident	14 Å²	14	35 Å²	35	8%	0.075	19%	0.193	C	C	.	.	H	α-helix	trans	-85.2	-15.2	-178.5	-75	-0.3	0	0	0	114.6	L230 F389 T390	L230-N393 VanDerWaalsContact CD1-OD1 3.3Å; L230-N393 WeakPolarHBondContact CD1-OD1 3.25Å; F389-N393 WeakPolarHBondContact CE1-ND2 3.3Å; F389-N393 WeakPolarHBondContact CE2-ND2 3.3Å; F389-N393 WeakPolarHBondContact CZ-ND2 3.5Å; F389-N393 VanDerWaalsContact O-CB 3.31Å; F389-N393 WeakPolarHBondContact O-CB 3.29Å; F389-N393 PolarHBondContact O-N 3.47Å; F389-N393 PolarHBondContact O-ND2 3.03Å; T390-N393 PolarHBondContact O-N 2.95Å
394	E	84.8	Confident	89.1	Confident	36 Å²	36	34.7 Å²	34.7	17%	0.168	19%	0.191	C	C	.	.	S	Bend	trans	-104.9	122.8	179.3	-63.5	-71.9	179	0	0	108.9	T390 G396 L397 L424 K428	T390-E394 WeakPolarHBondContact O-CG 3.46Å; T390-E394 PolarHBondContact O-N 2.97Å; E394-G396 PolarHBondContact O-N 2.67Å; E394-L397 HydrophobicContact CB-CB 3.81Å; E394-L397 HydrophobicContact CB-CD2 3.76Å; E394-L397 HydrophobicContact CB-CG 4.41Å; E394-L397 HydrophobicContact CG-CD2 4.1Å; E394-L397 WeakPolarHBondContact O-CB 3.31Å; E394-L397 PolarHBondContact O-N 2.79Å; E394-L424 HydrophobicContact CG-CD1 4.1Å; E394-L424 HydrophobicContact CG-CD2 4.13Å; E394-K428 VanDerWaalsContact OE1-CE 3.29Å; E394-K428 WeakPolarHBondContact OE1-CE 3.36Å; E394-K428 IonicContact OE1-NZ 3.88Å; E394-K428 PolarHBondContact OE1-NZ 3.4Å
395	D	81.1	Confident	89.3	Confident	101 Å²	101	31.7 Å²	31.7	54%	0.54	18%	0.175	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.9	128.6	-174.2	-173.5	27.6	0	0	0	112	L397 V434	D395-L397 PolarHBondContact O-N 2.89Å; D395-V434 VanDerWaalsContact O-CG2 3.25Å; D395-V434 WeakPolarHBondContact O-CG2 3.49Å
396	G	85.1	Confident	89.4	Confident	24 Å²	24	36.9 Å²	36.9	25%	0.247	19%	0.19	C	C	.	.	T	Hydrogen-bonded Turn	trans	73.5	-5.6	-178.2	0	0	0	0	0	116.2	E394 E399 Y400	E394-G396 PolarHBondContact O-N 2.67Å; G396-E399 VanDerWaalsContact CA-OE2 3.27Å; G396-E399 WeakPolarHBondContact CA-OE2 3.36Å; G396-Y400 WeakPolarHBondContact O-CB 3.42Å; G396-Y400 PolarHBondContact O-N 2.72Å; G396-Y400 VanDerWaalsContact O-N 3.09Å
397	L	90	Very high	89.4	Confident	0 Å²	0	36.5 Å²	36.5	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-72.1	-33.2	-174.9	-166.9	64.7	0	0	0	112.3	L391 E394 D395 F401 V419 L423 L424 V434	L391-L397 HydrophobicContact CD2-CD2 4.12Å; L391-L397 HydrophobicContact CD2-CG 3.93Å; E394-L397 HydrophobicContact CB-CB 3.81Å; E394-L397 HydrophobicContact CB-CD2 3.76Å; E394-L397 HydrophobicContact CB-CG 4.41Å; E394-L397 HydrophobicContact CG-CD2 4.1Å; E394-L397 WeakPolarHBondContact O-CB 3.31Å; E394-L397 PolarHBondContact O-N 2.79Å; D395-L397 PolarHBondContact O-N 2.89Å; L397-F401 WeakPolarHBondContact O-CB 3.38Å; L397-F401 PolarHBondContact O-N 3.38Å; L397-V419 HydrophobicContact CD1-CG1 3.53Å; L397-V419 HydrophobicContact CD2-CG1 4.45Å; L397-V419 HydrophobicContact CG-CG1 3.95Å; L397-L423 HydrophobicContact CD1-CD2 4.17Å; L397-L424 HydrophobicContact CD2-CD1 4.28Å; L397-L424 HydrophobicContact CD2-CD2 4.04Å; L397-V434 HydrophobicContact CB-CG2 4.12Å; L397-V434 HydrophobicContact CD1-CG2 4Å
398	M	89.6	Confident	89.3	Confident	14 Å²	14	35.1 Å²	35.1	7%	0.069	20%	0.196	C	C	.	.	H	α-helix	trans	-66.9	-47.9	177.4	-178.8	-87.3	-153.6	0	0	111.2	L377 Y400 F401 E402	L377-M398 HydrophobicContact CD1-CG 4.42Å; M398-Y400 VanDerWaalsContact C-N 3.29Å; M398-Y400 PolarHBondContact O-N 3.19Å; M398-F401 PolarHBondContact O-N 3.22Å; M398-F401 VanDerWaalsContact O-N 3.15Å; M398-E402 WeakPolarHBondContact CE-OE1 3.49Å; M398-E402 PolarHBondContact O-N 2.71Å; M398-E402 HydrophobicContact SD-CG 4.23Å
399	E	90.9	Very high	89.1	Confident	101 Å²	101	39.5 Å²	39.5	47%	0.472	23%	0.227	S	C	.	.	H	α-helix	trans	-62.5	-39.6	176.9	-65.9	73.5	-164.7	0	0	110.8	G396 A403	G396-E399 VanDerWaalsContact CA-OE2 3.27Å; G396-E399 WeakPolarHBondContact CA-OE2 3.36Å; E399-A403 VanDerWaalsContact O-CB 3.25Å; E399-A403 WeakPolarHBondContact O-CB 3.5Å; E399-A403 PolarHBondContact O-N 3.09Å
400	Y	92.8	Very high	88.9	Confident	12 Å²	12	39.3 Å²	39.3	5%	0.047	23%	0.226	C	C	.	.	H	α-helix	trans	-60.2	-48.6	173	-170.3	-77.5	0	0	0	111.3	G396 M398 A403 V404 L423 V434 V439 P441 L444	G396-Y400 WeakPolarHBondContact O-CB 3.42Å; G396-Y400 PolarHBondContact O-N 2.72Å; G396-Y400 VanDerWaalsContact O-N 3.09Å; M398-Y400 VanDerWaalsContact C-N 3.29Å; M398-Y400 PolarHBondContact O-N 3.19Å; Y400-A403 PolarHBondContact O-N 2.97Å; Y400-V404 HydrophobicContact CD1-CG2 3.85Å; Y400-V404 HydrophobicContact CE1-CG2 3.57Å; Y400-V404 WeakPolarHBondContact O-CG2 3.49Å; Y400-V404 PolarHBondContact O-N 3.3Å; Y400-L423 HydrophobicContact CD1-CD2 3.68Å; Y400-L423 HydrophobicContact CD2-CD2 4.46Å; Y400-L423 HydrophobicContact CE1-CD1 4.47Å; Y400-L423 HydrophobicContact CE1-CD2 3.41Å; Y400-L423 VanDerWaalsContact CE1-CD2 3.41Å; Y400-L423 HydrophobicContact CE2-CD2 4.23Å; Y400-L423 HydrophobicContact CG-CD2 4.22Å; Y400-V434 HydrophobicContact CD2-CG1 3.89Å; Y400-V434 HydrophobicContact CG-CG1 4.09Å; Y400-V439 WeakPolarHBondContact CE2-O 3.43Å; Y400-V439 PolarHBondContact OH-O 2.94Å; Y400-P441 HydrophobicContact CD2-CG 3.62Å; Y400-P441 HydrophobicContact CE2-CB 4.4Å; Y400-P441 HydrophobicContact CE2-CG 3.66Å; Y400-P441 HydrophobicContact CG-CG 4.12Å; Y400-L444 HydrophobicContact CE1-CD2 3.89Å
401	F	93.7	Very high	88.9	Confident	0 Å²	0	41.1 Å²	41.1	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-60.9	-48.1	178.5	171.8	-99.8	0	0	0	112	Y381 L383 L391 L397 M398 A403 V404 M405 P412 V415 I416 V419	Y381-F401 HydrophobicContact CD2-CE1 4.09Å; Y381-F401 HydrophobicContact CE2-CE1 4.24Å; Y381-F401 HydrophobicContact CG-CE1 4.32Å; L383-F401 HydrophobicContact CD1-CE1 4.15Å; L383-F401 HydrophobicContact CD1-CZ 4.02Å; L391-F401 HydrophobicContact CD1-CB 4.49Å; L391-F401 HydrophobicContact CD1-CD1 3.94Å; L391-F401 HydrophobicContact CD1-CE1 4.33Å; L391-F401 HydrophobicContact CD1-CG 4.07Å; L391-F401 HydrophobicContact CD2-CB 3.84Å; L391-F401 HydrophobicContact CD2-CG 4.17Å; L397-F401 WeakPolarHBondContact O-CB 3.38Å; L397-F401 PolarHBondContact O-N 3.38Å; M398-F401 PolarHBondContact O-N 3.22Å; M398-F401 VanDerWaalsContact O-N 3.15Å; F401-A403 VanDerWaalsContact C-N 3.28Å; F401-A403 PolarHBondContact O-N 3.25Å; F401-V404 PolarHBondContact O-N 2.94Å; F401-M405 HydrophobicContact CD1-CG 4.24Å; F401-M405 HydrophobicContact CD2-CG 4.33Å; F401-M405 HydrophobicContact CE1-CG 3.77Å; F401-M405 HydrophobicContact CE2-CG 3.87Å; F401-M405 HydrophobicContact CE2-SD 3.95Å; F401-M405 HydrophobicContact CZ-CG 3.57Å; F401-M405 HydrophobicContact CZ-SD 3.86Å; F401-M405 WeakPolarHBondContact O-CG 3.41Å; F401-M405 PolarHBondContact O-N 3.2Å; F401-P412 HydrophobicContact CZ-CB 4.39Å; F401-V415 HydrophobicContact CD2-CG1 4.22Å; F401-V415 HydrophobicContact CE2-CB 4.24Å; F401-V415 HydrophobicContact CE2-CG1 3.99Å; F401-I416 HydrophobicContact CD2-CD1 3.99Å; F401-I416 HydrophobicContact CE2-CB 4.1Å; F401-I416 HydrophobicContact CE2-CD1 4.06Å; F401-V419 HydrophobicContact CD2-CG2 4.23Å
402	E	92.1	Very high	88.8	Confident	40 Å²	40	42.3 Å²	42.3	19%	0.187	24%	0.242	C	C	.	.	H	α-helix	trans	-62.8	-35.9	178.1	-70.5	-170.8	167.6	0	0	111.9	R376 M398 M405 K406	R376-E402 IonicContact CZ-OE1 2.75Å; R376-E402 IonicContact NH2-OE1 3.98Å; R376-E402 PolarHBondContact NH2-OE1 3.4Å; M398-E402 WeakPolarHBondContact CE-OE1 3.49Å; M398-E402 PolarHBondContact O-N 2.71Å; M398-E402 HydrophobicContact SD-CG 4.23Å; E402-M405 PolarHBondContact O-N 3.17Å; E402-K406 WeakPolarHBondContact O-CG 3.42Å; E402-K406 PolarHBondContact O-N 2.86Å; E402-K406 VanDerWaalsContact O-N 3.11Å
403	A	93.4	Very high	88.8	Confident	40 Å²	40	49.2 Å²	49.2	33%	0.331	27%	0.266	S	S	.	.	H	α-helix	trans	-66.6	-39.9	174.5	0	0	0	0	0	112.5	E399 Y400 F401 K406 P441	E399-A403 VanDerWaalsContact O-CB 3.25Å; E399-A403 WeakPolarHBondContact O-CB 3.5Å; E399-A403 PolarHBondContact O-N 3.09Å; Y400-A403 PolarHBondContact O-N 2.97Å; F401-A403 VanDerWaalsContact C-N 3.28Å; F401-A403 PolarHBondContact O-N 3.25Å; A403-K406 PolarHBondContact O-N 3.09Å; A403-P441 HydrophobicContact CB-CB 3.65Å; A403-P441 HydrophobicContact CB-CG 3.95Å
404	V	93.2	Very high	88.9	Confident	0 Å²	0	53 Å²	53	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-63.4	-46.5	173.4	175.8	0	0	0	0	110.2	Y400 F401 K406 G407 T408 V415 P441 L444 A445 L448	Y400-V404 HydrophobicContact CD1-CG2 3.85Å; Y400-V404 HydrophobicContact CE1-CG2 3.57Å; Y400-V404 WeakPolarHBondContact O-CG2 3.49Å; Y400-V404 PolarHBondContact O-N 3.3Å; F401-V404 PolarHBondContact O-N 2.94Å; V404-K406 PolarHBondContact O-N 3.29Å; V404-G407 WeakPolarHBondContact O-CA 3.45Å; V404-G407 PolarHBondContact O-N 3.11Å; V404-T408 HydrophobicContact CG1-CG2 4.33Å; V404-T408 PolarHBondContact O-N 3.09Å; V404-V415 HydrophobicContact CB-CG1 4.39Å; V404-V415 HydrophobicContact CG1-CG1 3.61Å; V404-P441 HydrophobicContact CG2-CB 3.9Å; V404-L444 HydrophobicContact CG1-CD2 4.49Å; V404-L444 HydrophobicContact CG1-CG 4.48Å; V404-L444 HydrophobicContact CG2-CB 4.36Å; V404-L444 HydrophobicContact CG2-CD2 4.06Å; V404-L444 HydrophobicContact CG2-CG 4.49Å; V404-A445 HydrophobicContact CG1-CB 4.25Å; V404-L448 HydrophobicContact CG1-CD1 4.01Å
405	M	92.9	Very high	89.2	Confident	29 Å²	29	51.3 Å²	51.3	14%	0.143	27%	0.274	C	S	.	.	H	α-helix	trans	-60.8	-29.2	180	-72	-55.4	-48.1	0	0	113.2	Y381 F401 E402 G407 P412 V415	Y381-M405 HydrophobicContact CD1-CE 4.46Å; Y381-M405 HydrophobicContact CE1-CB 4.46Å; Y381-M405 HydrophobicContact CE1-CE 4.43Å; Y381-M405 HydrophobicContact CE1-CG 4.32Å; F401-M405 HydrophobicContact CD1-CG 4.24Å; F401-M405 HydrophobicContact CD2-CG 4.33Å; F401-M405 HydrophobicContact CE1-CG 3.77Å; F401-M405 HydrophobicContact CE2-CG 3.87Å; F401-M405 HydrophobicContact CE2-SD 3.95Å; F401-M405 HydrophobicContact CZ-CG 3.57Å; F401-M405 HydrophobicContact CZ-SD 3.86Å; F401-M405 WeakPolarHBondContact O-CG 3.41Å; F401-M405 PolarHBondContact O-N 3.2Å; E402-M405 PolarHBondContact O-N 3.17Å; M405-G407 VanDerWaalsContact C-N 3.26Å; M405-G407 PolarHBondContact O-N 2.8Å; M405-P412 HydrophobicContact CE-CB 3.99Å; M405-P412 HydrophobicContact CE-CG 3.62Å; M405-P412 HydrophobicContact SD-CB 4.13Å; M405-P412 HydrophobicContact SD-CG 4.41Å; M405-V415 HydrophobicContact SD-CB 3.76Å; M405-V415 HydrophobicContact SD-CG1 3.83Å; M405-V415 HydrophobicContact SD-CG2 3.69Å
406	K	91	Very high	89.7	Confident	184 Å²	184	46.5 Å²	46.5	80%	0.8	25%	0.248	S	C	*	.	H	α-helix	trans	-69.7	-23.6	172.9	-73.5	171.5	-175.6	174	0	113.1	E402 A403 V404	E402-K406 WeakPolarHBondContact O-CG 3.42Å; E402-K406 PolarHBondContact O-N 2.86Å; E402-K406 VanDerWaalsContact O-N 3.11Å; A403-K406 PolarHBondContact O-N 3.09Å; V404-K406 PolarHBondContact O-N 3.29Å
407	G	86.4	Confident	89.9	Confident	49 Å²	49	46.4 Å²	46.4	51%	0.505	25%	0.247	S	C	.	.	H	α-helix	trans	-100.4	-5.3	-175.6	0	0	0	0	0	115.4	V404 M405	V404-G407 WeakPolarHBondContact O-CA 3.45Å; V404-G407 PolarHBondContact O-N 3.11Å; M405-G407 VanDerWaalsContact C-N 3.26Å; M405-G407 PolarHBondContact O-N 2.8Å
408	T	86.9	Confident	90	Very high	15 Å²	15	47.4 Å²	47.4	9%	0.092	25%	0.25	C	S	.	.			trans	-135.3	149.1	179.8	-176.2	0	0	0	0	111.8	V404 R410 V415 E449	V404-T408 HydrophobicContact CG1-CG2 4.33Å; V404-T408 PolarHBondContact O-N 3.09Å; T408-R410 VanDerWaalsContact C-N 3.28Å; T408-R410 HydrophobicContact CG2-CB 4.16Å; T408-R410 WeakPolarHBondContact OG1-CB 3.43Å; T408-R410 PolarHBondContact OG1-N 2.84Å; T408-V415 HydrophobicContact CG2-CG2 4.06Å; T408-E449 WeakPolarHBondContact CA-OE2 3.26Å; T408-E449 PolarHBondContact OG1-OE2 3.49Å
409	S	84.3	Confident	90.2	Very high	96 Å²	96	46.7 Å²	46.7	67%	0.671	25%	0.247	S	C	*	.			trans	-87.1	0.9	174.5	67.5	0	0	0	0	113.2	E449	S409-E449 PolarHBondContact N-OE2 3.28Å; S409-E449 VanDerWaalsContact N-OE2 3.1Å; S409-E449 PolarHBondContact OG-OE1 2.86Å; S409-E449 PolarHBondContact OG-OE2 2.88Å
410	R	84.6	Confident	90.1	Very high	18 Å²	18	42.7 Å²	42.7	7%	0.068	23%	0.23	C	C	.	.	S	Bend	trans	-71.5	148.3	-170.5	-162.6	167.7	-160.9	-169.8	-4.9	113.1	T408 K414 V415 L448 Q451 E452	T408-R410 VanDerWaalsContact C-N 3.28Å; T408-R410 HydrophobicContact CG2-CB 4.16Å; T408-R410 WeakPolarHBondContact OG1-CB 3.43Å; T408-R410 PolarHBondContact OG1-N 2.84Å; R410-K414 HydrophobicContact CG-CB 4.32Å; R410-K414 HydrophobicContact CG-CD 4.33Å; R410-V415 HydrophobicContact CB-CG2 4.05Å; R410-V415 HydrophobicContact CG-CG2 4.42Å; R410-L448 VanDerWaalsContact NH1-CD2 3.26Å; R410-Q451 VanDerWaalsContact NH1-CD 3.31Å; R410-E452 IonicContact CZ-OE2 3.73Å; R410-E452 IonicContact NE-OE2 3.85Å; R410-E452 PolarHBondContact NE-OE2 3.49Å; R410-E452 IonicContact NH2-OE2 3.94Å
411	D	87.7	Confident	89.9	Confident	72 Å²	72	47.2 Å²	47.2	39%	0.385	25%	0.254	S	S	.	.			trans	-49.6	121.6	174.2	178.2	0.9	0	0	0	111	R413 K414 V415	D411-R413 PolarHBondContact O-N 2.88Å; D411-R413 WeakPolarHBondContact OD1-CB 3.48Å; D411-R413 PolarHBondContact OD1-N 3.33Å; D411-K414 HydrophobicContact CB-CD 4.44Å; D411-K414 HydrophobicContact CB-CG 4.32Å; D411-K414 WeakPolarHBondContact O-CB 3.33Å; D411-K414 PolarHBondContact O-N 3.11Å; D411-V415 PolarHBondContact O-N 3.01Å
412	P	89.4	Confident	89.8	Confident	26 Å²	26	49 Å²	49	17%	0.169	26%	0.263	C	S	.	.	H	α-helix	trans	-50.3	-32.2	179	-23.6	26.8	0	0	0	113.9	Y381 L383 F401 M405 K414 V415 I416	Y381-P412 HydrophobicContact CD1-CB 4.09Å; Y381-P412 HydrophobicContact CD1-CG 3.82Å; Y381-P412 HydrophobicContact CG-CB 4.35Å; Y381-P412 HydrophobicContact CG-CG 4.45Å; L383-P412 HydrophobicContact CD2-CB 4.17Å; F401-P412 HydrophobicContact CZ-CB 4.39Å; M405-P412 HydrophobicContact CE-CB 3.99Å; M405-P412 HydrophobicContact CE-CG 3.62Å; M405-P412 HydrophobicContact SD-CB 4.13Å; M405-P412 HydrophobicContact SD-CG 4.41Å; P412-K414 VanDerWaalsContact C-N 3.28Å; P412-K414 PolarHBondContact O-N 3.13Å; P412-V415 PolarHBondContact O-N 3.31Å; P412-I416 WeakPolarHBondContact O-CB 3.4Å; P412-I416 WeakPolarHBondContact O-CG2 3.46Å; P412-I416 PolarHBondContact O-N 3.04Å
413	R	87.8	Confident	89.8	Confident	162 Å²	162	47.1 Å²	47.1	61%	0.611	25%	0.254	S	S	*	.	H	α-helix	trans	-66.9	-26.7	178.3	-64.7	177.8	173.5	176.4	2.4	113.6	G382 D411 I416	G382-R413 PolarHBondContact O-NE 3.48Å; G382-R413 PolarHBondContact O-NH2 2.89Å; D411-R413 PolarHBondContact O-N 2.88Å; D411-R413 WeakPolarHBondContact OD1-CB 3.48Å; D411-R413 PolarHBondContact OD1-N 3.33Å; R413-I416 VanDerWaalsContact O-CG2 3.29Å; R413-I416 WeakPolarHBondContact O-CG2 3.36Å
414	K	88.4	Confident	89.6	Confident	94 Å²	94	45.8 Å²	45.8	41%	0.409	24%	0.241	S	C	.	.	H	α-helix	trans	-82.5	-41.4	173.3	-63.6	-178.5	-172.4	169.2	0	110.4	R410 D411 P412 I416 G417 E452	R410-K414 HydrophobicContact CG-CB 4.32Å; R410-K414 HydrophobicContact CG-CD 4.33Å; D411-K414 HydrophobicContact CB-CD 4.44Å; D411-K414 HydrophobicContact CB-CG 4.32Å; D411-K414 WeakPolarHBondContact O-CB 3.33Å; D411-K414 PolarHBondContact O-N 3.11Å; P412-K414 VanDerWaalsContact C-N 3.28Å; P412-K414 PolarHBondContact O-N 3.13Å; K414-I416 PolarHBondContact O-N 3.23Å; K414-G417 PolarHBondContact O-N 3.37Å; K414-E452 IonicContact NZ-OE1 2.69Å; K414-E452 IonicContact NZ-OE2 3.71Å
415	V	91.5	Very high	89.4	Confident	0 Å²	0	47.1 Å²	47.1	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-61.1	-44.9	179.9	-178.1	0	0	0	0	110.9	F401 V404 M405 T408 R410 D411 P412 G417 W418 V419 L448	F401-V415 HydrophobicContact CD2-CG1 4.22Å; F401-V415 HydrophobicContact CE2-CB 4.24Å; F401-V415 HydrophobicContact CE2-CG1 3.99Å; V404-V415 HydrophobicContact CB-CG1 4.39Å; V404-V415 HydrophobicContact CG1-CG1 3.61Å; M405-V415 HydrophobicContact SD-CB 3.76Å; M405-V415 HydrophobicContact SD-CG1 3.83Å; M405-V415 HydrophobicContact SD-CG2 3.69Å; T408-V415 HydrophobicContact CG2-CG2 4.06Å; R410-V415 HydrophobicContact CB-CG2 4.05Å; R410-V415 HydrophobicContact CG-CG2 4.42Å; D411-V415 PolarHBondContact O-N 3.01Å; P412-V415 PolarHBondContact O-N 3.31Å; V415-G417 VanDerWaalsContact C-N 3.26Å; V415-G417 PolarHBondContact O-N 3.17Å; V415-W418 WeakPolarHBondContact O-CB 3.39Å; V415-W418 PolarHBondContact O-N 3.07Å; V415-V419 HydrophobicContact CG1-CG2 4.44Å; V415-V419 PolarHBondContact O-N 3.15Å; V415-V419 VanDerWaalsContact O-N 3.15Å; V415-L448 HydrophobicContact CB-CD1 4.39Å; V415-L448 HydrophobicContact CG1-CD1 3.99Å; V415-L448 HydrophobicContact CG2-CD1 4.1Å
416	I	91.8	Very high	89.2	Confident	1 Å²	1	47.1 Å²	47.1	1%	0.005	26%	0.255	C	S	.	.	H	α-helix	trans	-60	-37.4	-178.6	-166.8	53.1	0	0	0	112.5	L383 H387 L391 F401 P412 R413 K414 W418 V419 T420	L383-I416 HydrophobicContact CD2-CB 3.96Å; L383-I416 HydrophobicContact CD2-CG1 4.29Å; L383-I416 HydrophobicContact CD2-CG2 3.87Å; H387-I416 HydrophobicContact CB-CD1 4.47Å; H387-I416 HydrophobicContact CB-CG1 3.71Å; L391-I416 HydrophobicContact CD1-CD1 3.56Å; L391-I416 HydrophobicContact CD2-CD1 3.56Å; L391-I416 HydrophobicContact CG-CD1 3.61Å; F401-I416 HydrophobicContact CD2-CD1 3.99Å; F401-I416 HydrophobicContact CE2-CB 4.1Å; F401-I416 HydrophobicContact CE2-CD1 4.06Å; P412-I416 WeakPolarHBondContact O-CB 3.4Å; P412-I416 WeakPolarHBondContact O-CG2 3.46Å; P412-I416 PolarHBondContact O-N 3.04Å; R413-I416 VanDerWaalsContact O-CG2 3.29Å; R413-I416 WeakPolarHBondContact O-CG2 3.36Å; K414-I416 PolarHBondContact O-N 3.23Å; I416-W418 PolarHBondContact O-N 2.85Å; I416-V419 PolarHBondContact O-N 2.9Å; I416-V419 VanDerWaalsContact O-N 3.14Å; I416-T420 HydrophobicContact CD1-CG2 3.73Å; I416-T420 HydrophobicContact CG1-CG2 4Å; I416-T420 PolarHBondContact O-N 2.89Å; I416-T420 PolarHBondContact O-OG1 3.25Å; I416-T420 VanDerWaalsContact O-OG1 3.08Å
417	G	89.8	Confident	89.2	Confident	21 Å²	21	38.5 Å²	38.5	22%	0.216	22%	0.218	C	C	.	.	H	α-helix	trans	-63	-30.8	177.5	0	0	0	0	0	113	K414 V415 N421	K414-G417 PolarHBondContact O-N 3.37Å; V415-G417 VanDerWaalsContact C-N 3.26Å; V415-G417 PolarHBondContact O-N 3.17Å; G417-N421 WeakPolarHBondContact O-CB 3.46Å; G417-N421 PolarHBondContact O-N 3.16Å; G417-N421 PolarHBondContact O-ND2 3.17Å; G417-N421 VanDerWaalsContact O-ND2 3.07Å
418	W	92.3	Very high	89.2	Confident	21 Å²	21	41.9 Å²	41.9	8%	0.08	22%	0.219	C	C	.	.	I	π-helix	trans	-72.6	-44	172.4	-78.3	92.8	0	0	0	111.7	V415 I416 E422 L423 L448 A461 K462 F465	V415-W418 WeakPolarHBondContact O-CB 3.39Å; V415-W418 PolarHBondContact O-N 3.07Å; I416-W418 PolarHBondContact O-N 2.85Å; W418-E422 HydrophobicContact CD2-CG 4.36Å; W418-E422 HydrophobicContact CE3-CB 4Å; W418-E422 HydrophobicContact CE3-CG 3.7Å; W418-E422 HydrophobicContact CZ3-CB 4.47Å; W418-E422 HydrophobicContact CZ3-CG 4.03Å; W418-E422 WeakPolarHBondContact O-CB 3.08Å; W418-E422 PolarHBondContact O-N 2.75Å; W418-E422 VanDerWaalsContact O-N 3.09Å; W418-L423 PolarHBondContact O-N 2.64Å; W418-L448 HydrophobicContact CB-CD2 4.48Å; W418-L448 HydrophobicContact CD2-CD2 3.94Å; W418-L448 HydrophobicContact CG-CD2 3.7Å; W418-A461 HydrophobicContact CH2-CB 3.72Å; W418-A461 HydrophobicContact CZ2-CB 3.82Å; W418-K462 HydrophobicContact CH2-CB 4.3Å; W418-K462 HydrophobicContact CH2-CG 3.58Å; W418-K462 HydrophobicContact CZ2-CG 4.34Å; W418-K462 HydrophobicContact CZ3-CG 4.09Å; W418-F465 HydrophobicContact CZ3-CB 3.93Å; W418-F465 HydrophobicContact CZ3-CG 4.16Å
419	V	92.6	Very high	89.3	Confident	0 Å²	0	48.7 Å²	48.7	0%	0	25%	0.25	C	C	.	.	I	π-helix	trans	-66.2	-46.2	-179.2	177.2	0	0	0	0	111.3	L391 L397 F401 V415 I416 L423 L424 L444	L391-V419 HydrophobicContact CD2-CG1 4.22Å; L397-V419 HydrophobicContact CD1-CG1 3.53Å; L397-V419 HydrophobicContact CD2-CG1 4.45Å; L397-V419 HydrophobicContact CG-CG1 3.95Å; F401-V419 HydrophobicContact CD2-CG2 4.23Å; V415-V419 HydrophobicContact CG1-CG2 4.44Å; V415-V419 PolarHBondContact O-N 3.15Å; V415-V419 VanDerWaalsContact O-N 3.15Å; I416-V419 PolarHBondContact O-N 2.9Å; I416-V419 VanDerWaalsContact O-N 3.14Å; V419-L423 HydrophobicContact CG1-CD2 4.27Å; V419-L423 WeakPolarHBondContact O-CB 3.46Å; V419-L424 WeakPolarHBondContact O-CB 3.34Å; V419-L424 PolarHBondContact O-N 2.81Å; V419-L444 HydrophobicContact CG2-CD2 4.26Å
420	T	89	Confident	89.5	Confident	17 Å²	17	48.9 Å²	48.9	10%	0.104	24%	0.24	C	C	.	.	I	π-helix	trans	-80.9	-33.2	-175.7	61.9	0	0	0	0	114	T390 I416 L424	T390-T420 HydrophobicContact CG2-CG2 4.21Å; I416-T420 HydrophobicContact CD1-CG2 3.73Å; I416-T420 HydrophobicContact CG1-CG2 4Å; I416-T420 PolarHBondContact O-N 2.89Å; I416-T420 PolarHBondContact O-OG1 3.25Å; I416-T420 VanDerWaalsContact O-OG1 3.08Å; T420-L424 WeakPolarHBondContact O-CB 3.34Å
421	N	89.2	Confident	89.5	Confident	106 Å²	106	55.4 Å²	55.4	57%	0.567	28%	0.276	S	S	*	.	I	π-helix	trans	-98.4	-45.9	-174.2	-55.7	-39.1	0	0	0	112.7	G417 G425	G417-N421 WeakPolarHBondContact O-CB 3.46Å; G417-N421 PolarHBondContact O-N 3.16Å; G417-N421 PolarHBondContact O-ND2 3.17Å; G417-N421 VanDerWaalsContact O-ND2 3.07Å; N421-G425 WeakPolarHBondContact O-CA 3.32Å
422	E	90.8	Very high	89.4	Confident	39 Å²	39	55.1 Å²	55.1	18%	0.182	27%	0.274	C	S	.	.	I	π-helix	trans	-88.2	-56.5	-174.1	-54.7	-68.2	164.8	0	0	110.4	W418 L426 K462 F465	W418-E422 HydrophobicContact CD2-CG 4.36Å; W418-E422 HydrophobicContact CE3-CB 4Å; W418-E422 HydrophobicContact CE3-CG 3.7Å; W418-E422 HydrophobicContact CZ3-CB 4.47Å; W418-E422 HydrophobicContact CZ3-CG 4.03Å; W418-E422 WeakPolarHBondContact O-CB 3.08Å; W418-E422 PolarHBondContact O-N 2.75Å; W418-E422 VanDerWaalsContact O-N 3.09Å; E422-L426 WeakPolarHBondContact O-CG 3.39Å; E422-L426 PolarHBondContact O-N 2.94Å; E422-K462 VanDerWaalsContact OE1-CE 3.26Å; E422-K462 WeakPolarHBondContact OE1-CE 3.42Å; E422-K462 IonicContact OE1-NZ 3.17Å; E422-K462 PolarHBondContact OE1-NZ 2.94Å; E422-F465 HydrophobicContact CB-CD1 4.14Å; E422-F465 HydrophobicContact CB-CE1 3.8Å; E422-F465 HydrophobicContact CB-CZ 4.45Å
423	L	92.1	Very high	89.2	Confident	0 Å²	0	56.3 Å²	56.3	0%	0	28%	0.283	C	S	.	.	I	π-helix	trans	-65.5	-59.4	-178.9	-178.3	83.5	0	0	0	111.5	L397 Y400 W418 V419 G425 L426 L427 F465 W469	L397-L423 HydrophobicContact CD1-CD2 4.17Å; Y400-L423 HydrophobicContact CD1-CD2 3.68Å; Y400-L423 HydrophobicContact CD2-CD2 4.46Å; Y400-L423 HydrophobicContact CE1-CD1 4.47Å; Y400-L423 HydrophobicContact CE1-CD2 3.41Å; Y400-L423 VanDerWaalsContact CE1-CD2 3.41Å; Y400-L423 HydrophobicContact CE2-CD2 4.23Å; Y400-L423 HydrophobicContact CG-CD2 4.22Å; W418-L423 PolarHBondContact O-N 2.64Å; V419-L423 HydrophobicContact CG1-CD2 4.27Å; V419-L423 WeakPolarHBondContact O-CB 3.46Å; L423-G425 PolarHBondContact O-N 3Å; L423-L426 PolarHBondContact O-N 3.35Å; L423-L427 HydrophobicContact CD2-CD1 4.39Å; L423-L427 HydrophobicContact CG-CD1 4.01Å; L423-L427 WeakPolarHBondContact O-CG 3.42Å; L423-L427 PolarHBondContact O-N 3.39Å; L423-F465 HydrophobicContact CB-CZ 4.13Å; L423-F465 HydrophobicContact CD1-CE2 4.48Å; L423-F465 HydrophobicContact CD1-CZ 4.06Å; L423-W469 HydrophobicContact CD1-CZ3 4.02Å
424	L	89.6	Confident	89.1	Confident	11 Å²	11	49.3 Å²	49.3	6%	0.058	26%	0.259	C	S	.	.	H	α-helix	trans	-63.4	-31.7	-178.9	-174.6	66	0	0	0	112	T390 E394 L397 V419 T420 K428	T390-L424 HydrophobicContact CG2-CD2 3.77Å; E394-L424 HydrophobicContact CG-CD1 4.1Å; E394-L424 HydrophobicContact CG-CD2 4.13Å; L397-L424 HydrophobicContact CD2-CD1 4.28Å; L397-L424 HydrophobicContact CD2-CD2 4.04Å; V419-L424 WeakPolarHBondContact O-CB 3.34Å; V419-L424 PolarHBondContact O-N 2.81Å; T420-L424 WeakPolarHBondContact O-CB 3.34Å; L424-K428 HydrophobicContact CD1-CD 4.49Å; L424-K428 HydrophobicContact CG-CD 4.25Å; L424-K428 WeakPolarHBondContact O-CB 3.15Å; L424-K428 WeakPolarHBondContact O-CG 3.44Å; L424-K428 PolarHBondContact O-N 3.09Å
425	G	89.1	Confident	88.9	Confident	28 Å²	28	49.7 Å²	49.7	29%	0.289	27%	0.273	S	S	.	.	H	α-helix	trans	-61.4	-47.9	173.6	0	0	0	0	0	112.5	N421 L423 Q429	N421-G425 WeakPolarHBondContact O-CA 3.32Å; L423-G425 PolarHBondContact O-N 3Å; G425-Q429 WeakPolarHBondContact O-CG 3.49Å; G425-Q429 PolarHBondContact O-N 2.89Å; G425-Q429 VanDerWaalsContact O-N 3.09Å
426	L	89.3	Confident	88.7	Confident	29 Å²	29	56 Å²	56	15%	0.152	30%	0.302	C	S	.	.	H	α-helix	trans	-70	-40.3	177.5	-71	-179.9	0	0	0	112.7	E422 L423 K428 Q429 Q430 F465 W469	E422-L426 WeakPolarHBondContact O-CG 3.39Å; E422-L426 PolarHBondContact O-N 2.94Å; L423-L426 PolarHBondContact O-N 3.35Å; L426-K428 VanDerWaalsContact C-N 3.3Å; L426-K428 PolarHBondContact O-N 2.83Å; L426-Q429 PolarHBondContact O-N 2.94Å; L426-Q430 PolarHBondContact O-N 3.13Å; L426-F465 HydrophobicContact CD1-CD1 4.14Å; L426-F465 HydrophobicContact CD1-CE1 3.55Å; L426-F465 HydrophobicContact CD1-CZ 4.43Å; L426-W469 HydrophobicContact CB-CD2 4.15Å; L426-W469 HydrophobicContact CB-CE3 4.05Å; L426-W469 HydrophobicContact CB-CH2 3.69Å; L426-W469 HydrophobicContact CB-CZ2 3.81Å; L426-W469 HydrophobicContact CB-CZ3 3.84Å; L426-W469 HydrophobicContact CD1-CB 4.35Å; L426-W469 HydrophobicContact CD1-CD2 3.72Å; L426-W469 HydrophobicContact CD1-CE3 3.7Å; L426-W469 HydrophobicContact CD1-CG 4.01Å; L426-W469 HydrophobicContact CD1-CZ3 4.28Å
427	L	89.9	Confident	88.5	Confident	3 Å²	3	57 Å²	57	2%	0.016	31%	0.309	C	S	.	.	H	α-helix	trans	-55.3	-47.6	174.3	-75.1	171.7	0	0	0	110.8	L423 Q429 Q430 D431 L432 V434 W469	L423-L427 HydrophobicContact CD2-CD1 4.39Å; L423-L427 HydrophobicContact CG-CD1 4.01Å; L423-L427 WeakPolarHBondContact O-CG 3.42Å; L423-L427 PolarHBondContact O-N 3.39Å; L427-Q429 PolarHBondContact O-N 2.98Å; L427-Q430 CarbonylContact O-C 3.59Å; L427-Q430 PolarHBondContact O-N 3.21Å; L427-D431 WeakPolarHBondContact O-CA 3.26Å; L427-D431 PolarHBondContact O-N 3.17Å; L427-L432 HydrophobicContact CD2-CB 3.79Å; L427-L432 PolarHBondContact O-N 2.83Å; L427-V434 HydrophobicContact CD1-CB 4.45Å; L427-V434 HydrophobicContact CD1-CG2 3.91Å; L427-W469 HydrophobicContact CB-CH2 4.48Å; L427-W469 HydrophobicContact CD2-CH2 3.66Å; L427-W469 HydrophobicContact CD2-CZ3 4.47Å; L427-W469 HydrophobicContact CG-CH2 3.8Å; L427-W469 HydrophobicContact CG-CZ3 4.42Å
428	K	87.8	Confident	88.5	Confident	121 Å²	121	57.5 Å²	57.5	53%	0.526	31%	0.309	S	S	.	.	H	α-helix	trans	-67.2	-33.6	177.8	-74.4	179.5	177.5	176.8	0	113.4	E394 L424 L426 Q430	E394-K428 VanDerWaalsContact OE1-CE 3.29Å; E394-K428 WeakPolarHBondContact OE1-CE 3.36Å; E394-K428 IonicContact OE1-NZ 3.88Å; E394-K428 PolarHBondContact OE1-NZ 3.4Å; L424-K428 HydrophobicContact CD1-CD 4.49Å; L424-K428 HydrophobicContact CG-CD 4.25Å; L424-K428 WeakPolarHBondContact O-CB 3.15Å; L424-K428 WeakPolarHBondContact O-CG 3.44Å; L424-K428 PolarHBondContact O-N 3.09Å; L426-K428 VanDerWaalsContact C-N 3.3Å; L426-K428 PolarHBondContact O-N 2.83Å; K428-Q430 VanDerWaalsContact C-N 3.3Å
429	Q	88.5	Confident	88.4	Confident	157 Å²	157	56.6 Å²	56.6	73%	0.734	31%	0.305	S	S	*	.	H	α-helix	trans	-67.7	-31	175.4	-79.4	-179.2	-4.7	0	0	112.9	G425 L426 L427	G425-Q429 WeakPolarHBondContact O-CG 3.49Å; G425-Q429 PolarHBondContact O-N 2.89Å; G425-Q429 VanDerWaalsContact O-N 3.09Å; L426-Q429 PolarHBondContact O-N 2.94Å; L427-Q429 PolarHBondContact O-N 2.98Å
430	Q	87.4	Confident	88.4	Confident	101 Å²	101	59.9 Å²	59.9	47%	0.472	33%	0.327	S	S	.	.	H	α-helix	trans	-103.2	3.4	-178.7	-61.2	-169.3	2.1	0	0	113.6	L426 L427 K428 L432	L426-Q430 PolarHBondContact O-N 3.13Å; L427-Q430 CarbonylContact O-C 3.59Å; L427-Q430 PolarHBondContact O-N 3.21Å; K428-Q430 VanDerWaalsContact C-N 3.3Å; Q430-L432 VanDerWaalsContact C-N 3.25Å; Q430-L432 HydrophobicContact CB-CD1 4Å; Q430-L432 HydrophobicContact CB-CG 3.99Å; Q430-L432 PolarHBondContact O-N 3.26Å
431	D	84.7	Confident	88.6	Confident	155 Å²	155	60.8 Å²	60.8	83%	0.829	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	53	41.1	-177.1	-154.3	31.2	0	0	0	113.1	L427	L427-D431 WeakPolarHBondContact O-CA 3.26Å; L427-D431 PolarHBondContact O-N 3.17Å
432	L	86.1	Confident	88.7	Confident	65 Å²	65	59.3 Å²	59.3	34%	0.34	34%	0.336	S	S	.	.			trans	-102.5	142.5	179.7	-66.5	176.5	0	0	0	111.1	L427 Q430 W469	L427-L432 HydrophobicContact CD2-CB 3.79Å; L427-L432 PolarHBondContact O-N 2.83Å; Q430-L432 VanDerWaalsContact C-N 3.25Å; Q430-L432 HydrophobicContact CB-CD1 4Å; Q430-L432 HydrophobicContact CB-CG 3.99Å; Q430-L432 PolarHBondContact O-N 3.26Å; L432-W469 HydrophobicContact CD1-CZ2 4.15Å
433	S	85.4	Confident	88.7	Confident	52 Å²	52	58.3 Å²	58.3	36%	0.364	33%	0.334	S	S	.	.			trans	-76.7	158.8	169	63	0	0	0	0	111.3	S435 H436 S437	S433-S435 PolarHBondContact O-N 2.91Å; S433-S435 PolarHBondContact OG-OG 3.38Å; S433-H436 CarbonylContact O-C 3.6Å; S433-H436 PolarHBondContact O-N 3.47Å; S433-H436 PolarHBondContact OG-ND1 3.15Å; S433-S437 PolarHBondContact O-N 3.04Å
434	V	86.4	Confident	88.7	Confident	15 Å²	15	58.3 Å²	58.3	9%	0.091	33%	0.334	C	S	.	.	G	3₁₀ helix	trans	-58.6	-36.6	179.3	-177.4	0	0	0	0	111.8	D395 L397 Y400 L427 H436 S437	D395-V434 VanDerWaalsContact O-CG2 3.25Å; D395-V434 WeakPolarHBondContact O-CG2 3.49Å; L397-V434 HydrophobicContact CB-CG2 4.12Å; L397-V434 HydrophobicContact CD1-CG2 4Å; Y400-V434 HydrophobicContact CD2-CG1 3.89Å; Y400-V434 HydrophobicContact CG-CG1 4.09Å; L427-V434 HydrophobicContact CD1-CB 4.45Å; L427-V434 HydrophobicContact CD1-CG2 3.91Å; V434-H436 PolarHBondContact O-N 2.96Å; V434-S437 WeakPolarHBondContact O-CB 3.36Å; V434-S437 PolarHBondContact O-N 3.41Å; V434-S437 VanDerWaalsContact O-N 3.09Å
435	S	84.6	Confident	88.9	Confident	102 Å²	102	58 Å²	58	71%	0.713	33%	0.332	S	S	*	.	G	3₁₀ helix	trans	-62.2	-26.4	175.8	53.5	0	0	0	0	114.1	S433	S433-S435 PolarHBondContact O-N 2.91Å; S433-S435 PolarHBondContact OG-OG 3.38Å
436	H	86.3	Confident	89	Confident	132 Å²	132	60.3 Å²	60.3	61%	0.611	34%	0.336	S	S	*	.	G	3₁₀ helix	trans	-98.7	14	177.2	-62.4	123.9	0	0	0	112.6	S433 V434	S433-H436 CarbonylContact O-C 3.6Å; S433-H436 PolarHBondContact O-N 3.47Å; S433-H436 PolarHBondContact OG-ND1 3.15Å; V434-H436 PolarHBondContact O-N 2.96Å
437	S	88.5	Confident	89.1	Confident	22 Å²	22	58.9 Å²	58.9	15%	0.154	33%	0.329	C	S	.	.			trans	-59.4	127.9	176.6	175.7	0	0	0	0	110.8	S433 V434 V439	S433-S437 PolarHBondContact O-N 3.04Å; V434-S437 WeakPolarHBondContact O-CB 3.36Å; V434-S437 PolarHBondContact O-N 3.41Å; V434-S437 VanDerWaalsContact O-N 3.09Å; S437-V439 PolarHBondContact O-N 2.9Å; S437-V439 PolarHBondContact OG-N 2.81Å; S437-V439 PolarHBondContact OG-O 3.29Å
438	P	88.4	Confident	89.2	Confident	31 Å²	31	58.8 Å²	58.8	20%	0.201	33%	0.328	C	S	.	.	S	Bend	trans	-68.9	-18.2	174.4	27.3	-32.7	0	0	0	112.5	P440 W469 P472	P438-P440 WeakPolarHBondContact O-CD 3.4Å; P438-W469 HydrophobicContact CG-CD2 3.56Å; P438-W469 HydrophobicContact CG-CE3 3.8Å; P438-W469 HydrophobicContact CG-CG 4Å; P438-W469 HydrophobicContact CG-CH2 4.21Å; P438-W469 HydrophobicContact CG-CZ2 3.99Å; P438-W469 HydrophobicContact CG-CZ3 4.11Å; P438-P472 HydrophobicContact CB-CB 4.31Å; P438-P472 HydrophobicContact CB-CG 3.95Å
439	V	91.1	Very high	89.3	Confident	2 Å²	2	56.4 Å²	56.4	1%	0.012	32%	0.319	C	S	.	.	S	Bend	trans	-102.1	108.1	178.4	-177	0	0	0	0	109.3	Y400 S437 A443 L444 F465 M468 W469	Y400-V439 WeakPolarHBondContact CE2-O 3.43Å; Y400-V439 PolarHBondContact OH-O 2.94Å; S437-V439 PolarHBondContact O-N 2.9Å; S437-V439 PolarHBondContact OG-N 2.81Å; S437-V439 PolarHBondContact OG-O 3.29Å; V439-A443 HydrophobicContact CG1-CB 4.45Å; V439-L444 HydrophobicContact CG1-CB 4.31Å; V439-F465 HydrophobicContact CB-CE2 4.36Å; V439-F465 HydrophobicContact CG1-CE2 4.08Å; V439-F465 HydrophobicContact CG2-CE2 4.19Å; V439-M468 HydrophobicContact CG1-CE 4.04Å; V439-M468 HydrophobicContact CG2-CB 4.17Å; V439-W469 HydrophobicContact CG2-CB 4.42Å; V439-W469 HydrophobicContact CG2-CE3 4.01Å
440	P	91.8	Very high	89.3	Confident	70 Å²	70	50.7 Å²	50.7	46%	0.455	29%	0.293	S	S	.	.			trans	-72.4	155	177.5	29.2	-33.8	0	0	0	111.4	P438 A442 A443 L444	P438-P440 WeakPolarHBondContact O-CD 3.4Å; P440-A442 VanDerWaalsContact C-N 3.26Å; P440-A442 PolarHBondContact O-N 3.13Å; P440-A443 HydrophobicContact CG-CB 3.79Å; P440-A443 PolarHBondContact O-N 2.85Å; P440-L444 PolarHBondContact O-N 2.89Å
441	P	92.8	Very high	89.3	Confident	36 Å²	36	47.2 Å²	47.2	23%	0.234	28%	0.277	C	S	.	.	H	α-helix	trans	-52.1	-41.4	-179.1	-27.6	32.9	0	0	0	114	Y400 A403 V404 A443 L444 A445	Y400-P441 HydrophobicContact CD2-CG 3.62Å; Y400-P441 HydrophobicContact CE2-CB 4.4Å; Y400-P441 HydrophobicContact CE2-CG 3.66Å; Y400-P441 HydrophobicContact CG-CG 4.12Å; A403-P441 HydrophobicContact CB-CB 3.65Å; A403-P441 HydrophobicContact CB-CG 3.95Å; V404-P441 HydrophobicContact CG2-CB 3.9Å; P441-A443 VanDerWaalsContact C-N 3.33Å; P441-A443 PolarHBondContact O-N 3.42Å; P441-L444 PolarHBondContact O-N 2.73Å; P441-A445 PolarHBondContact O-N 3.32Å
442	A	91.8	Very high	89.3	Confident	75 Å²	75	44 Å²	44	62%	0.62	26%	0.257	S	S	*	.	H	α-helix	trans	-63.3	-37.2	-179.4	0	0	0	0	0	112.7	P440 A445 E446	P440-A442 VanDerWaalsContact C-N 3.26Å; P440-A442 PolarHBondContact O-N 3.13Å; A442-A445 PolarHBondContact O-N 3.22Å; A442-E446 PolarHBondContact O-N 3.01Å
443	A	91.3	Very high	89.2	Confident	17 Å²	17	44.2 Å²	44.2	14%	0.14	27%	0.268	C	S	.	.	H	α-helix	trans	-72.6	-36.7	180	0	0	0	0	0	111.4	V439 P440 P441 E446 L447 M468	V439-A443 HydrophobicContact CG1-CB 4.45Å; P440-A443 HydrophobicContact CG-CB 3.79Å; P440-A443 PolarHBondContact O-N 2.85Å; P441-A443 VanDerWaalsContact C-N 3.33Å; P441-A443 PolarHBondContact O-N 3.42Å; A443-E446 PolarHBondContact O-N 3.46Å; A443-L447 PolarHBondContact O-N 3.3Å; A443-L447 VanDerWaalsContact O-N 3.11Å; A443-M468 HydrophobicContact CB-CE 3.47Å; A443-M468 VanDerWaalsContact CB-CE 3.47Å
444	L	92.8	Very high	89	Confident	1 Å²	1	43.6 Å²	43.6	1%	0.005	27%	0.27	C	S	.	.	H	α-helix	trans	-65.4	-42.3	171.8	-177.6	60.3	0	0	0	111	Y400 V404 V419 V439 P440 P441 E446 L447 L448 F465	Y400-L444 HydrophobicContact CE1-CD2 3.89Å; V404-L444 HydrophobicContact CG1-CD2 4.49Å; V404-L444 HydrophobicContact CG1-CG 4.48Å; V404-L444 HydrophobicContact CG2-CB 4.36Å; V404-L444 HydrophobicContact CG2-CD2 4.06Å; V404-L444 HydrophobicContact CG2-CG 4.49Å; V419-L444 HydrophobicContact CG2-CD2 4.26Å; V439-L444 HydrophobicContact CG1-CB 4.31Å; P440-L444 PolarHBondContact O-N 2.89Å; P441-L444 PolarHBondContact O-N 2.73Å; L444-E446 VanDerWaalsContact C-N 3.35Å; L444-E446 PolarHBondContact O-N 2.8Å; L444-L447 HydrophobicContact CD1-CD2 4.36Å; L444-L447 WeakPolarHBondContact O-CB 3.44Å; L444-L447 PolarHBondContact O-N 2.93Å; L444-L448 HydrophobicContact CD1-CD1 4.46Å; L444-L448 HydrophobicContact CD1-CG 4.32Å; L444-L448 HydrophobicContact CG-CD1 4.14Å; L444-L448 HydrophobicContact CG-CG 4.42Å; L444-L448 VanDerWaalsContact O-CG 3.27Å; L444-L448 WeakPolarHBondContact O-CG 3.46Å; L444-L448 PolarHBondContact O-N 2.88Å; L444-F465 HydrophobicContact CD1-CD2 3.97Å; L444-F465 HydrophobicContact CD1-CE2 3.99Å
445	A	92.9	Very high	88.9	Confident	3 Å²	3	51.1 Å²	51.1	3%	0.025	30%	0.297	C	S	.	.	H	α-helix	trans	-59.3	-44.7	176.5	0	0	0	0	0	112.1	V404 P441 A442 L447 L448 E449	V404-A445 HydrophobicContact CG1-CB 4.25Å; P441-A445 PolarHBondContact O-N 3.32Å; A442-A445 PolarHBondContact O-N 3.22Å; A445-L447 PolarHBondContact O-N 2.77Å; A445-L448 PolarHBondContact O-N 3.44Å; A445-E449 PolarHBondContact O-N 3.23Å
446	E	91.8	Very high	88.9	Confident	77 Å²	77	46.5 Å²	46.5	36%	0.36	26%	0.264	S	S	.	.	H	α-helix	trans	-58	-46.7	175.1	-174.8	-175.7	-158.1	0	0	111.8	A442 A443 L444 L448 E449 L450 P477	A442-E446 PolarHBondContact O-N 3.01Å; A443-E446 PolarHBondContact O-N 3.46Å; L444-E446 VanDerWaalsContact C-N 3.35Å; L444-E446 PolarHBondContact O-N 2.8Å; E446-L448 VanDerWaalsContact C-N 3.31Å; E446-L448 PolarHBondContact O-N 3.35Å; E446-E449 PolarHBondContact O-N 3.15Å; E446-L450 HydrophobicContact CG-CD1 4.4Å; E446-L450 WeakPolarHBondContact O-CG 3.4Å; E446-L450 PolarHBondContact O-N 3.23Å; E446-P477 WeakPolarHBondContact OE1-CD 3.23Å; E446-P477 WeakPolarHBondContact OE1-CG 3.34Å
447	L	91.3	Very high	88.7	Confident	0 Å²	0	40.5 Å²	40.5	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-58.7	-42.9	177	176.5	64.6	0	0	0	112.2	A443 L444 A445 E449 L450 Q451 I456 A461 V464 F465 M468 A476	A443-L447 PolarHBondContact O-N 3.3Å; A443-L447 VanDerWaalsContact O-N 3.11Å; L444-L447 HydrophobicContact CD1-CD2 4.36Å; L444-L447 WeakPolarHBondContact O-CB 3.44Å; L444-L447 PolarHBondContact O-N 2.93Å; A445-L447 PolarHBondContact O-N 2.77Å; L447-E449 VanDerWaalsContact C-N 3.34Å; L447-L450 PolarHBondContact O-N 3.4Å; L447-Q451 PolarHBondContact O-N 2.89Å; L447-Q451 VanDerWaalsContact O-N 3.13Å; L447-I456 HydrophobicContact CD1-CD1 3.56Å; L447-A461 HydrophobicContact CD1-CB 4.36Å; L447-V464 HydrophobicContact CD1-CB 3.86Å; L447-V464 HydrophobicContact CD1-CG1 3.64Å; L447-F465 HydrophobicContact CD2-CB 3.8Å; L447-F465 HydrophobicContact CD2-CD2 4.27Å; L447-M468 HydrophobicContact CB-SD 4.45Å; L447-M468 HydrophobicContact CD2-SD 4.13Å; L447-A476 HydrophobicContact CB-CB 4.18Å; L447-A476 HydrophobicContact CD1-CB 4.2Å
448	L	91.4	Very high	88.5	Confident	0 Å²	0	42.3 Å²	42.3	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-68.4	-35.5	-179.3	-65.5	175.7	0	0	0	111.9	V404 R410 V415 W418 L444 A445 E446 Q451 E452	V404-L448 HydrophobicContact CG1-CD1 4.01Å; R410-L448 VanDerWaalsContact NH1-CD2 3.26Å; V415-L448 HydrophobicContact CB-CD1 4.39Å; V415-L448 HydrophobicContact CG1-CD1 3.99Å; V415-L448 HydrophobicContact CG2-CD1 4.1Å; W418-L448 HydrophobicContact CB-CD2 4.48Å; W418-L448 HydrophobicContact CD2-CD2 3.94Å; W418-L448 HydrophobicContact CG-CD2 3.7Å; L444-L448 HydrophobicContact CD1-CD1 4.46Å; L444-L448 HydrophobicContact CD1-CG 4.32Å; L444-L448 HydrophobicContact CG-CD1 4.14Å; L444-L448 HydrophobicContact CG-CG 4.42Å; L444-L448 VanDerWaalsContact O-CG 3.27Å; L444-L448 WeakPolarHBondContact O-CG 3.46Å; L444-L448 PolarHBondContact O-N 2.88Å; A445-L448 PolarHBondContact O-N 3.44Å; E446-L448 VanDerWaalsContact C-N 3.31Å; E446-L448 PolarHBondContact O-N 3.35Å; L448-Q451 PolarHBondContact O-N 2.77Å; L448-E452 PolarHBondContact O-N 2.89Å
449	E	90.4	Very high	88.1	Confident	71 Å²	71	42.4 Å²	42.4	33%	0.332	25%	0.251	S	S	.	.	H	α-helix	trans	-68.9	-40.4	176	-156.9	66.6	-157.6	0	0	111.4	T408 S409 A445 E446 L447 Q451 E452 A453	T408-E449 WeakPolarHBondContact CA-OE2 3.26Å; T408-E449 PolarHBondContact OG1-OE2 3.49Å; S409-E449 PolarHBondContact N-OE2 3.28Å; S409-E449 VanDerWaalsContact N-OE2 3.1Å; S409-E449 PolarHBondContact OG-OE1 2.86Å; S409-E449 PolarHBondContact OG-OE2 2.88Å; A445-E449 PolarHBondContact O-N 3.23Å; E446-E449 PolarHBondContact O-N 3.15Å; L447-E449 VanDerWaalsContact C-N 3.34Å; E449-Q451 VanDerWaalsContact C-N 3.25Å; E449-Q451 PolarHBondContact O-N 3.27Å; E449-E452 PolarHBondContact O-N 3.31Å; E449-A453 VanDerWaalsContact O-CB 3.32Å; E449-A453 WeakPolarHBondContact O-CB 3.17Å; E449-A453 PolarHBondContact O-N 3.06Å
450	L	87.6	Confident	87.8	Confident	37 Å²	37	42.3 Å²	42.3	19%	0.194	25%	0.25	C	S	.	.	H	α-helix	trans	-61.4	-36.2	174	-68.6	171.5	0	0	0	112.2	E446 L447 G454 R455 I456 A476 P477 I480	E446-L450 HydrophobicContact CG-CD1 4.4Å; E446-L450 WeakPolarHBondContact O-CG 3.4Å; E446-L450 PolarHBondContact O-N 3.23Å; L447-L450 PolarHBondContact O-N 3.4Å; L450-G454 PolarHBondContact O-N 3.03Å; L450-R455 HydrophobicContact CD2-CG 4.48Å; L450-R455 WeakPolarHBondContact O-CB 3.31Å; L450-R455 PolarHBondContact O-N 3.37Å; L450-I456 HydrophobicContact CB-CD1 4.3Å; L450-I456 HydrophobicContact CB-CG1 4.48Å; L450-A476 HydrophobicContact CD1-CB 3.95Å; L450-P477 HydrophobicContact CD1-CG 4.01Å; L450-I480 HydrophobicContact CD1-CD1 3.68Å
451	Q	87.1	Confident	87.6	Confident	29 Å²	29	39 Å²	39	14%	0.136	23%	0.229	C	C	.	.	H	α-helix	trans	-69.4	-41.7	174.6	-168.4	-171.8	-13.1	0	0	111.8	R410 L447 L448 E449 G454 I456 A461	R410-Q451 VanDerWaalsContact NH1-CD 3.31Å; L447-Q451 PolarHBondContact O-N 2.89Å; L447-Q451 VanDerWaalsContact O-N 3.13Å; L448-Q451 PolarHBondContact O-N 2.77Å; E449-Q451 VanDerWaalsContact C-N 3.25Å; E449-Q451 PolarHBondContact O-N 3.27Å; Q451-G454 PolarHBondContact O-N 2.96Å; Q451-G454 VanDerWaalsContact O-N 3.16Å; Q451-I456 HydrophobicContact CB-CD1 4.32Å; Q451-I456 HydrophobicContact CB-CG1 4.01Å; Q451-I456 HydrophobicContact CG-CG1 4.41Å; Q451-A461 HydrophobicContact CG-CB 4.42Å
452	E	85.4	Confident	87.4	Confident	87 Å²	87	41.7 Å²	41.7	41%	0.407	24%	0.236	S	C	.	.	H	α-helix	trans	-69	-35	178.5	-159.5	67.6	-160.9	0	0	111.8	R410 K414 L448 E449 G454	R410-E452 IonicContact CZ-OE2 3.73Å; R410-E452 IonicContact NE-OE2 3.85Å; R410-E452 PolarHBondContact NE-OE2 3.49Å; R410-E452 IonicContact NH2-OE2 3.94Å; K414-E452 IonicContact NZ-OE1 2.69Å; K414-E452 IonicContact NZ-OE2 3.71Å; L448-E452 PolarHBondContact O-N 2.89Å; E449-E452 PolarHBondContact O-N 3.31Å; E452-G454 PolarHBondContact O-N 3.44Å; E452-G454 VanDerWaalsContact O-N 3.1Å
453	A	84.9	Confident	87.2	Confident	69 Å²	69	42 Å²	42	57%	0.57	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	-69.9	1.6	171.7	0	0	0	0	0	113.9	E449 R455	E449-A453 VanDerWaalsContact O-CB 3.32Å; E449-A453 WeakPolarHBondContact O-CB 3.17Å; E449-A453 PolarHBondContact O-N 3.06Å; A453-R455 HydrophobicContact CB-CG 4.26Å; A453-R455 PolarHBondContact O-N 3.13Å
454	G	81.3	Confident	87.1	Confident	39 Å²	39	41.2 Å²	41.2	40%	0.402	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	70	14.9	177.8	0	0	0	0	0	114.7	L450 Q451 E452 I456	L450-G454 PolarHBondContact O-N 3.03Å; Q451-G454 PolarHBondContact O-N 2.96Å; Q451-G454 VanDerWaalsContact O-N 3.16Å; E452-G454 PolarHBondContact O-N 3.44Å; E452-G454 VanDerWaalsContact O-N 3.1Å; G454-I456 VanDerWaalsContact C-N 3.33Å
455	R	82.5	Confident	87.1	Confident	174 Å²	174	41.2 Å²	41.2	66%	0.657	22%	0.218	S	C	*	.	S	Bend	trans	-74.3	-26.2	179.9	-63.6	-65.5	-172.7	159.7	0.3	112.7	L450 A453 L487	L450-R455 HydrophobicContact CD2-CG 4.48Å; L450-R455 WeakPolarHBondContact O-CB 3.31Å; L450-R455 PolarHBondContact O-N 3.37Å; A453-R455 HydrophobicContact CB-CG 4.26Å; A453-R455 PolarHBondContact O-N 3.13Å; R455-L487 PolarHBondContact O-N 2.93Å
456	I	85.2	Confident	86.9	Confident	4 Å²	4	45.3 Å²	45.3	2%	0.021	24%	0.237	C	C	.	.	S	Bend	trans	-138.5	149.8	179.6	59.3	178.1	0	0	0	110.7	L447 L450 Q451 G454 A460 A461 I480	L447-I456 HydrophobicContact CD1-CD1 3.56Å; L450-I456 HydrophobicContact CB-CD1 4.3Å; L450-I456 HydrophobicContact CB-CG1 4.48Å; Q451-I456 HydrophobicContact CB-CD1 4.32Å; Q451-I456 HydrophobicContact CB-CG1 4.01Å; Q451-I456 HydrophobicContact CG-CG1 4.41Å; G454-I456 VanDerWaalsContact C-N 3.33Å; I456-A460 HydrophobicContact CB-CB 4.2Å; I456-A461 HydrophobicContact CD1-CB 3.75Å; I456-A461 HydrophobicContact CG1-CB 4.37Å; I456-I480 HydrophobicContact CD1-CD1 4.22Å; I456-I480 HydrophobicContact CG2-CD1 3.59Å; I456-I480 HydrophobicContact CG2-CG1 3.87Å; I456-I480 HydrophobicContact CG2-CG2 4.06Å
457	S	83.3	Confident	86.8	Confident	7 Å²	7	42.8 Å²	42.8	5%	0.049	23%	0.226	C	C	.	.			trans	-75.8	167.8	172.3	74.7	0	0	0	0	111.4	S459 A460 A461 G533	S457-S459 VanDerWaalsContact C-N 3.31Å; S457-S459 PolarHBondContact O-N 3.42Å; S457-S459 PolarHBondContact OG-N 2.99Å; S457-S459 PolarHBondContact OG-OG 3.44Å; S457-A460 PolarHBondContact O-N 2.74Å; S457-A460 WeakPolarHBondContact OG-CB 3.38Å; S457-A460 PolarHBondContact OG-N 2.83Å; S457-A461 WeakPolarHBondContact O-CB 3.36Å; S457-A461 PolarHBondContact O-N 3.48Å; S457-G533 WeakPolarHBondContact CB-O 3.37Å; S457-G533 PolarHBondContact OG-O 3.43Å
458	S	82.6	Confident	86.7	Confident	60 Å²	60	43.1 Å²	43.1	42%	0.42	23%	0.227	S	C	.	.	H	α-helix	trans	-61.8	-36	173.7	57.5	0	0	0	0	113.3	K462	S458-K462 PolarHBondContact O-N 2.75Å
459	S	81.6	Confident	86.7	Confident	33 Å²	33	43.9 Å²	43.9	23%	0.231	23%	0.23	C	C	.	.	H	α-helix	trans	-71	-39.2	176	45	0	0	0	0	112.2	S457 K462 Q463 G533	S457-S459 VanDerWaalsContact C-N 3.31Å; S457-S459 PolarHBondContact O-N 3.42Å; S457-S459 PolarHBondContact OG-N 2.99Å; S457-S459 PolarHBondContact OG-OG 3.44Å; S459-K462 PolarHBondContact O-N 3.33Å; S459-Q463 PolarHBondContact O-N 3.24Å; S459-G533 PolarHBondContact OG-O 3.16Å
460	A	84.9	Confident	86.6	Confident	0 Å²	0	48.9 Å²	48.9	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-66.1	-41.2	176	0	0	0	0	0	111	I456 S457 K462 Q463 V464 L485	I456-A460 HydrophobicContact CB-CB 4.2Å; S457-A460 PolarHBondContact O-N 2.74Å; S457-A460 WeakPolarHBondContact OG-CB 3.38Å; S457-A460 PolarHBondContact OG-N 2.83Å; A460-K462 VanDerWaalsContact C-N 3.26Å; A460-K462 PolarHBondContact O-N 2.77Å; A460-Q463 WeakPolarHBondContact O-CB 3.37Å; A460-Q463 PolarHBondContact O-N 2.83Å; A460-V464 WeakPolarHBondContact O-CG2 3.36Å; A460-V464 PolarHBondContact O-N 2.79Å; A460-L485 HydrophobicContact CB-CB 4.46Å
461	A	87.7	Confident	86.5	Confident	0 Å²	0	48.8 Å²	48.8	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-56.3	-39.6	175.7	0	0	0	0	0	112.5	W418 L447 Q451 I456 S457 Q463 V464 F465	W418-A461 HydrophobicContact CH2-CB 3.72Å; W418-A461 HydrophobicContact CZ2-CB 3.82Å; L447-A461 HydrophobicContact CD1-CB 4.36Å; Q451-A461 HydrophobicContact CG-CB 4.42Å; I456-A461 HydrophobicContact CD1-CB 3.75Å; I456-A461 HydrophobicContact CG1-CB 4.37Å; S457-A461 WeakPolarHBondContact O-CB 3.36Å; S457-A461 PolarHBondContact O-N 3.48Å; A461-Q463 PolarHBondContact O-N 3.44Å; A461-V464 PolarHBondContact O-N 2.87Å; A461-F465 WeakPolarHBondContact O-CB 3.48Å; A461-F465 PolarHBondContact O-N 3.15Å
462	K	88.7	Confident	86.2	Confident	92 Å²	92	51.6 Å²	51.6	40%	0.4	27%	0.269	S	S	.	.	H	α-helix	trans	-66.6	-38.2	177.6	-69.1	-173.2	-176.8	-143.6	0	112.1	W418 E422 S458 S459 A460 F465 Q466	W418-K462 HydrophobicContact CH2-CB 4.3Å; W418-K462 HydrophobicContact CH2-CG 3.58Å; W418-K462 HydrophobicContact CZ2-CG 4.34Å; W418-K462 HydrophobicContact CZ3-CG 4.09Å; E422-K462 VanDerWaalsContact OE1-CE 3.26Å; E422-K462 WeakPolarHBondContact OE1-CE 3.42Å; E422-K462 IonicContact OE1-NZ 3.17Å; E422-K462 PolarHBondContact OE1-NZ 2.94Å; S458-K462 PolarHBondContact O-N 2.75Å; S459-K462 PolarHBondContact O-N 3.33Å; A460-K462 VanDerWaalsContact C-N 3.26Å; A460-K462 PolarHBondContact O-N 2.77Å; K462-F465 PolarHBondContact O-N 3.4Å; K462-Q466 WeakPolarHBondContact O-CG 3.5Å; K462-Q466 PolarHBondContact O-N 2.83Å
463	Q	86.9	Confident	85.8	Confident	82 Å²	82	51.2 Å²	51.2	38%	0.383	29%	0.289	S	S	.	.	H	α-helix	trans	-66	-42.9	175.4	-65.4	177.3	23.9	0	0	111.2	S459 A460 A461 Q466 E467 L485	S459-Q463 PolarHBondContact O-N 3.24Å; A460-Q463 WeakPolarHBondContact O-CB 3.37Å; A460-Q463 PolarHBondContact O-N 2.83Å; A461-Q463 PolarHBondContact O-N 3.44Å; Q463-Q466 PolarHBondContact O-N 2.84Å; Q463-E467 PolarHBondContact O-N 3.38Å; Q463-L485 HydrophobicContact CB-CD1 4.36Å
464	V	89.6	Confident	85.7	Confident	0 Å²	0	51.3 Å²	51.3	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-60.9	-46.5	175.8	177.5	0	0	0	0	110.3	L447 A460 A461 Q466 E467 M468 A476 I479 I480 L485	L447-V464 HydrophobicContact CD1-CB 3.86Å; L447-V464 HydrophobicContact CD1-CG1 3.64Å; A460-V464 WeakPolarHBondContact O-CG2 3.36Å; A460-V464 PolarHBondContact O-N 2.79Å; A461-V464 PolarHBondContact O-N 2.87Å; V464-Q466 PolarHBondContact O-N 3.31Å; V464-E467 PolarHBondContact O-N 2.7Å; V464-E467 VanDerWaalsContact O-N 3.1Å; V464-M468 HydrophobicContact CG1-CG 4.24Å; V464-M468 HydrophobicContact CG1-SD 3.94Å; V464-M468 VanDerWaalsContact O-CG 3.28Å; V464-M468 WeakPolarHBondContact O-CG 3.44Å; V464-M468 PolarHBondContact O-N 3.48Å; V464-A476 HydrophobicContact CG1-CB 4.06Å; V464-I479 HydrophobicContact CB-CG2 4.41Å; V464-I479 HydrophobicContact CG1-CB 4.2Å; V464-I479 HydrophobicContact CG1-CD1 4.43Å; V464-I479 HydrophobicContact CG1-CG2 4.04Å; V464-I479 HydrophobicContact CG2-CG2 4.27Å; V464-I480 HydrophobicContact CG1-CG1 4.5Å; V464-I480 HydrophobicContact CG2-CG1 3.7Å; V464-L485 HydrophobicContact CG2-CD1 3.71Å
465	F	91.5	Very high	85.9	Confident	1 Å²	1	50.9 Å²	50.9	0%	0.004	27%	0.269	C	S	.	.	H	α-helix	trans	-58.1	-44.6	177	-178.1	-105	0	0	0	112.8	W418 E422 L423 L426 V439 L444 L447 A461 K462 E467 M468 W469	W418-F465 HydrophobicContact CZ3-CB 3.93Å; W418-F465 HydrophobicContact CZ3-CG 4.16Å; E422-F465 HydrophobicContact CB-CD1 4.14Å; E422-F465 HydrophobicContact CB-CE1 3.8Å; E422-F465 HydrophobicContact CB-CZ 4.45Å; L423-F465 HydrophobicContact CB-CZ 4.13Å; L423-F465 HydrophobicContact CD1-CE2 4.48Å; L423-F465 HydrophobicContact CD1-CZ 4.06Å; L426-F465 HydrophobicContact CD1-CD1 4.14Å; L426-F465 HydrophobicContact CD1-CE1 3.55Å; L426-F465 HydrophobicContact CD1-CZ 4.43Å; V439-F465 HydrophobicContact CB-CE2 4.36Å; V439-F465 HydrophobicContact CG1-CE2 4.08Å; V439-F465 HydrophobicContact CG2-CE2 4.19Å; L444-F465 HydrophobicContact CD1-CD2 3.97Å; L444-F465 HydrophobicContact CD1-CE2 3.99Å; L447-F465 HydrophobicContact CD2-CB 3.8Å; L447-F465 HydrophobicContact CD2-CD2 4.27Å; A461-F465 WeakPolarHBondContact O-CB 3.48Å; A461-F465 PolarHBondContact O-N 3.15Å; K462-F465 PolarHBondContact O-N 3.4Å; F465-E467 VanDerWaalsContact C-N 3.28Å; F465-E467 PolarHBondContact O-N 2.84Å; F465-M468 PolarHBondContact O-N 2.9Å; F465-W469 HydrophobicContact CZ-CE3 4.33Å; F465-W469 PolarHBondContact O-N 2.93Å
466	Q	90.1	Very high	86.1	Confident	89 Å²	89	42.6 Å²	42.6	42%	0.416	24%	0.238	S	C	.	.	H	α-helix	trans	-62.4	-35.8	175.9	-73.9	180	2.2	0	0	112.6	K462 Q463 V464 W469 R470	K462-Q466 WeakPolarHBondContact O-CG 3.5Å; K462-Q466 PolarHBondContact O-N 2.83Å; Q463-Q466 PolarHBondContact O-N 2.84Å; V464-Q466 PolarHBondContact O-N 3.31Å; Q466-W469 WeakPolarHBondContact O-CB 3.41Å; Q466-W469 PolarHBondContact O-N 2.79Å; Q466-R470 WeakPolarHBondContact O-CG 3.44Å; Q466-R470 PolarHBondContact O-N 2.9Å; Q466-R470 VanDerWaalsContact O-N 3.14Å
467	E	89	Confident	86.1	Confident	25 Å²	25	44.6 Å²	44.6	12%	0.117	25%	0.251	C	S	.	.	H	α-helix	trans	-74	-38.6	177.1	-166.9	69.5	174.9	0	0	111.9	Q463 V464 F465 W469 R470 S471 I479 R483	Q463-E467 PolarHBondContact O-N 3.38Å; V464-E467 PolarHBondContact O-N 2.7Å; V464-E467 VanDerWaalsContact O-N 3.1Å; F465-E467 VanDerWaalsContact C-N 3.28Å; F465-E467 PolarHBondContact O-N 2.84Å; E467-W469 PolarHBondContact O-N 3.4Å; E467-R470 PolarHBondContact O-N 2.96Å; E467-R470 VanDerWaalsContact O-N 3.12Å; E467-S471 PolarHBondContact O-N 3.47Å; E467-I479 HydrophobicContact CB-CD1 4.3Å; E467-I479 HydrophobicContact CB-CG2 3.92Å; E467-I479 HydrophobicContact CG-CD1 4.31Å; E467-I479 HydrophobicContact CG-CG1 4.41Å; E467-I479 HydrophobicContact CG-CG2 3.93Å; E467-R483 IonicContact OE1-CZ 3.75Å; E467-R483 IonicContact OE1-NE 3.69Å; E467-R483 IonicContact OE1-NH2 3.6Å; E467-R483 PolarHBondContact OE1-NH2 2.76Å; E467-R483 IonicContact OE2-NH2 3.55Å
468	M	89.8	Confident	86.2	Confident	7 Å²	7	49.1 Å²	49.1	3%	0.034	27%	0.271	C	S	.	.	H	α-helix	trans	-58.3	-37.8	171.7	-68.2	169.2	70.3	0	0	111.2	V439 A443 L447 V464 F465 S471 A476 I479	V439-M468 HydrophobicContact CG1-CE 4.04Å; V439-M468 HydrophobicContact CG2-CB 4.17Å; A443-M468 HydrophobicContact CB-CE 3.47Å; A443-M468 VanDerWaalsContact CB-CE 3.47Å; L447-M468 HydrophobicContact CB-SD 4.45Å; L447-M468 HydrophobicContact CD2-SD 4.13Å; V464-M468 HydrophobicContact CG1-CG 4.24Å; V464-M468 HydrophobicContact CG1-SD 3.94Å; V464-M468 VanDerWaalsContact O-CG 3.28Å; V464-M468 WeakPolarHBondContact O-CG 3.44Å; V464-M468 PolarHBondContact O-N 3.48Å; F465-M468 PolarHBondContact O-N 2.9Å; M468-S471 CarbonylContact O-C 3.55Å; M468-A476 HydrophobicContact SD-CB 4.07Å; M468-I479 HydrophobicContact CB-CD1 4.24Å; M468-I479 HydrophobicContact CG-CD1 3.36Å
469	W	90.4	Very high	86.4	Confident	15 Å²	15	46.3 Å²	46.3	6%	0.057	25%	0.252	C	S	.	.	H	α-helix	trans	-65	-43.4	174.6	-169.8	-75.4	0	0	0	112.5	L423 L426 L427 L432 P438 V439 F465 Q466 E467	L423-W469 HydrophobicContact CD1-CZ3 4.02Å; L426-W469 HydrophobicContact CB-CD2 4.15Å; L426-W469 HydrophobicContact CB-CE3 4.05Å; L426-W469 HydrophobicContact CB-CH2 3.69Å; L426-W469 HydrophobicContact CB-CZ2 3.81Å; L426-W469 HydrophobicContact CB-CZ3 3.84Å; L426-W469 HydrophobicContact CD1-CB 4.35Å; L426-W469 HydrophobicContact CD1-CD2 3.72Å; L426-W469 HydrophobicContact CD1-CE3 3.7Å; L426-W469 HydrophobicContact CD1-CG 4.01Å; L426-W469 HydrophobicContact CD1-CZ3 4.28Å; L427-W469 HydrophobicContact CB-CH2 4.48Å; L427-W469 HydrophobicContact CD2-CH2 3.66Å; L427-W469 HydrophobicContact CD2-CZ3 4.47Å; L427-W469 HydrophobicContact CG-CH2 3.8Å; L427-W469 HydrophobicContact CG-CZ3 4.42Å; L432-W469 HydrophobicContact CD1-CZ2 4.15Å; P438-W469 HydrophobicContact CG-CD2 3.56Å; P438-W469 HydrophobicContact CG-CE3 3.8Å; P438-W469 HydrophobicContact CG-CG 4Å; P438-W469 HydrophobicContact CG-CH2 4.21Å; P438-W469 HydrophobicContact CG-CZ2 3.99Å; P438-W469 HydrophobicContact CG-CZ3 4.11Å; V439-W469 HydrophobicContact CG2-CB 4.42Å; V439-W469 HydrophobicContact CG2-CE3 4.01Å; F465-W469 HydrophobicContact CZ-CE3 4.33Å; F465-W469 PolarHBondContact O-N 2.93Å; Q466-W469 WeakPolarHBondContact O-CB 3.41Å; Q466-W469 PolarHBondContact O-N 2.79Å; E467-W469 PolarHBondContact O-N 3.4Å
470	R	88.6	Confident	86.6	Confident	176 Å²	176	45.8 Å²	45.8	66%	0.664	25%	0.246	S	C	*	.	H	α-helix	trans	-73.5	-31.9	-179	-72.7	174.1	179.5	173	0.7	113.4	Q466 E467 P472	Q466-R470 WeakPolarHBondContact O-CG 3.44Å; Q466-R470 PolarHBondContact O-N 2.9Å; Q466-R470 VanDerWaalsContact O-N 3.14Å; E467-R470 PolarHBondContact O-N 2.96Å; E467-R470 VanDerWaalsContact O-N 3.12Å; R470-P472 WeakPolarHBondContact O-CD 3.24Å
471	S	85.9	Confident	86.5	Confident	35 Å²	35	53.5 Å²	53.5	25%	0.245	28%	0.282	C	S	.	.	S	Bend	trans	-122.7	80.1	-177.8	-59.9	0	0	0	0	109.8	E467 M468 G473 K474	E467-S471 PolarHBondContact O-N 3.47Å; M468-S471 CarbonylContact O-C 3.55Å; S471-G473 PolarHBondContact O-N 2.86Å; S471-K474 PolarHBondContact O-N 3.41Å
472	P	80.3	Confident	86.4	Confident	88 Å²	88	59.1 Å²	59.1	57%	0.571	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.2	138.2	180	-21.4	31.4	0	0	0	111.4	P438 R470	P438-P472 HydrophobicContact CB-CB 4.31Å; P438-P472 HydrophobicContact CB-CG 3.95Å; R470-P472 WeakPolarHBondContact O-CD 3.24Å
473	G	76.1	Confident	85.9	Confident	80 Å²	80	61.5 Å²	61.5	83%	0.825	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	88.5	-7.8	177.3	0	0	0	0	0	115.8	S471	S471-G473 PolarHBondContact O-N 2.86Å
474	K	83.6	Confident	85.5	Confident	71 Å²	71	62.2 Å²	62.2	31%	0.309	32%	0.321	S	S	.	.			trans	-76.3	129.8	169.2	-73.9	-165.2	171.4	-164	0	110.8	S471 I479 E482	S471-K474 PolarHBondContact O-N 3.41Å; K474-I479 HydrophobicContact CB-CD1 3.93Å; K474-I479 HydrophobicContact CB-CG1 4Å; K474-I479 HydrophobicContact CD-CG1 4.36Å; K474-E482 IonicContact NZ-OE1 2.88Å; K474-E482 PolarHBondContact NZ-OE1 2.97Å; K474-E482 IonicContact NZ-OE2 3.34Å; K474-E482 PolarHBondContact NZ-OE2 2.82Å
475	A	85.7	Confident	85	Confident	30 Å²	30	62.7 Å²	62.7	25%	0.248	32%	0.324	C	S	.	.			trans	-74.7	148.1	178.6	0	0	0	0	0	111.3	P477 Q478 I479	A475-P477 VanDerWaalsContact C-CD 3.49Å; A475-Q478 HydrophobicContact CB-CG 4.26Å; A475-Q478 WeakPolarHBondContact O-CB 3.35Å; A475-Q478 PolarHBondContact O-N 2.99Å; A475-Q478 VanDerWaalsContact O-N 3.11Å; A475-I479 PolarHBondContact O-N 3.46Å
476	A	86.4	Confident	84.3	Confident	0 Å²	0	63.6 Å²	63.6	0%	0	33%	0.333	C	S	.	.	H	α-helix	trans	-56.2	-42.6	-179.4	0	0	0	0	0	113.1	L447 L450 V464 M468 Q478 I479 I480	L447-A476 HydrophobicContact CB-CB 4.18Å; L447-A476 HydrophobicContact CD1-CB 4.2Å; L450-A476 HydrophobicContact CD1-CB 3.95Å; V464-A476 HydrophobicContact CG1-CB 4.06Å; M468-A476 HydrophobicContact SD-CB 4.07Å; A476-Q478 VanDerWaalsContact C-N 3.31Å; A476-Q478 PolarHBondContact O-N 2.93Å; A476-I479 PolarHBondContact O-N 3.34Å; A476-I480 WeakPolarHBondContact O-CD1 3.48Å; A476-I480 VanDerWaalsContact O-CG1 3.22Å; A476-I480 WeakPolarHBondContact O-CG1 3.37Å; A476-I480 PolarHBondContact O-N 3.49Å
477	P	85.8	Confident	83.6	Confident	46 Å²	46	61.6 Å²	61.6	30%	0.299	33%	0.325	S	S	.	.	H	α-helix	trans	-60.1	-37.3	176.2	-23.8	32.9	0	0	0	114.1	E446 L450 A475 I480 Q481	E446-P477 WeakPolarHBondContact OE1-CD 3.23Å; E446-P477 WeakPolarHBondContact OE1-CG 3.34Å; L450-P477 HydrophobicContact CD1-CG 4.01Å; A475-P477 VanDerWaalsContact C-CD 3.49Å; P477-I480 PolarHBondContact O-N 3.22Å; P477-Q481 PolarHBondContact O-N 2.69Å; P477-Q481 VanDerWaalsContact O-N 3.1Å
478	Q	86.1	Confident	82.7	Confident	102 Å²	102	61.9 Å²	61.9	48%	0.477	33%	0.329	S	S	.	.	H	α-helix	trans	-66.2	-45.6	179.9	-67.1	174.1	-22.4	0	0	110.5	A475 A476 I480 Q481 E482	A475-Q478 HydrophobicContact CB-CG 4.26Å; A475-Q478 WeakPolarHBondContact O-CB 3.35Å; A475-Q478 PolarHBondContact O-N 2.99Å; A475-Q478 VanDerWaalsContact O-N 3.11Å; A476-Q478 VanDerWaalsContact C-N 3.31Å; A476-Q478 PolarHBondContact O-N 2.93Å; Q478-I480 VanDerWaalsContact C-N 3.29Å; Q478-I480 PolarHBondContact O-N 3.27Å; Q478-Q481 PolarHBondContact O-N 3.5Å; Q478-E482 WeakPolarHBondContact O-CB 3.31Å; Q478-E482 WeakPolarHBondContact O-CG 3.49Å; Q478-E482 PolarHBondContact O-N 2.8Å
479	I	85.6	Confident	81.4	Confident	1 Å²	1	67 Å²	67	1%	0.005	37%	0.365	C	S	.	.	H	α-helix	trans	-62	-40.3	177.5	-64.4	167.2	0	0	0	110.7	V464 E467 M468 K474 A475 A476 Q481 E482 R483	V464-I479 HydrophobicContact CB-CG2 4.41Å; V464-I479 HydrophobicContact CG1-CB 4.2Å; V464-I479 HydrophobicContact CG1-CD1 4.43Å; V464-I479 HydrophobicContact CG1-CG2 4.04Å; V464-I479 HydrophobicContact CG2-CG2 4.27Å; E467-I479 HydrophobicContact CB-CD1 4.3Å; E467-I479 HydrophobicContact CB-CG2 3.92Å; E467-I479 HydrophobicContact CG-CD1 4.31Å; E467-I479 HydrophobicContact CG-CG1 4.41Å; E467-I479 HydrophobicContact CG-CG2 3.93Å; M468-I479 HydrophobicContact CB-CD1 4.24Å; M468-I479 HydrophobicContact CG-CD1 3.36Å; K474-I479 HydrophobicContact CB-CD1 3.93Å; K474-I479 HydrophobicContact CB-CG1 4Å; K474-I479 HydrophobicContact CD-CG1 4.36Å; A475-I479 PolarHBondContact O-N 3.46Å; A476-I479 PolarHBondContact O-N 3.34Å; I479-Q481 VanDerWaalsContact C-N 3.32Å; I479-Q481 PolarHBondContact O-N 3.35Å; I479-E482 PolarHBondContact O-N 2.81Å; I479-R483 HydrophobicContact CG2-CG 4.27Å; I479-R483 VanDerWaalsContact O-CB 3.29Å; I479-R483 WeakPolarHBondContact O-CB 3.36Å; I479-R483 WeakPolarHBondContact O-CG 3.4Å; I479-R483 PolarHBondContact O-N 3.28Å
480	I	85.4	Confident	80.6	Confident	21 Å²	21	70.7 Å²	70.7	11%	0.108	39%	0.386	C	S	.	.	H	α-helix	trans	-61.7	-41.2	178.3	-68.2	160.6	0	0	0	111.3	L450 I456 V464 A476 P477 Q478 D484 L485	L450-I480 HydrophobicContact CD1-CD1 3.68Å; I456-I480 HydrophobicContact CD1-CD1 4.22Å; I456-I480 HydrophobicContact CG2-CD1 3.59Å; I456-I480 HydrophobicContact CG2-CG1 3.87Å; I456-I480 HydrophobicContact CG2-CG2 4.06Å; V464-I480 HydrophobicContact CG1-CG1 4.5Å; V464-I480 HydrophobicContact CG2-CG1 3.7Å; A476-I480 WeakPolarHBondContact O-CD1 3.48Å; A476-I480 VanDerWaalsContact O-CG1 3.22Å; A476-I480 WeakPolarHBondContact O-CG1 3.37Å; A476-I480 PolarHBondContact O-N 3.49Å; P477-I480 PolarHBondContact O-N 3.22Å; Q478-I480 VanDerWaalsContact C-N 3.29Å; Q478-I480 PolarHBondContact O-N 3.27Å; I480-D484 WeakPolarHBondContact O-CA 3.49Å; I480-D484 PolarHBondContact O-N 3.38Å; I480-D484 VanDerWaalsContact O-N 3.11Å; I480-L485 HydrophobicContact CG2-CB 4.49Å; I480-L485 PolarHBondContact O-N 3.2Å
481	Q	83.9	Confident	79.8	Confident	163 Å²	163	66.1 Å²	66.1	76%	0.762	38%	0.375	S	S	*	.	H	α-helix	trans	-70.8	-49.2	176.7	-73.5	-179.5	-0.5	0	0	112.2	P477 Q478 I479 R483 D484	P477-Q481 PolarHBondContact O-N 2.69Å; P477-Q481 VanDerWaalsContact O-N 3.1Å; Q478-Q481 PolarHBondContact O-N 3.5Å; I479-Q481 VanDerWaalsContact C-N 3.32Å; I479-Q481 PolarHBondContact O-N 3.35Å; Q481-R483 VanDerWaalsContact C-N 3.27Å; Q481-R483 PolarHBondContact O-N 3.37Å; Q481-D484 PolarHBondContact O-N 3.11Å
482	E	84.6	Confident	79.4	Confident	118 Å²	118	67.7 Å²	67.7	55%	0.551	39%	0.389	S	S	*	.	H	α-helix	trans	-59.7	-36.7	-178.9	-74.5	179.5	-178.9	0	0	112.6	K474 Q478 I479	K474-E482 IonicContact NZ-OE1 2.88Å; K474-E482 PolarHBondContact NZ-OE1 2.97Å; K474-E482 IonicContact NZ-OE2 3.34Å; K474-E482 PolarHBondContact NZ-OE2 2.82Å; Q478-E482 WeakPolarHBondContact O-CB 3.31Å; Q478-E482 WeakPolarHBondContact O-CG 3.49Å; Q478-E482 PolarHBondContact O-N 2.8Å; I479-E482 PolarHBondContact O-N 2.81Å
483	R	78.4	Confident	79.3	Confident	142 Å²	142	66.4 Å²	66.4	54%	0.536	38%	0.378	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.9	0.4	-177.2	-62.9	-73.2	-169.9	175.8	0.1	113.5	E467 I479 Q481 L485	E467-R483 IonicContact OE1-CZ 3.75Å; E467-R483 IonicContact OE1-NE 3.69Å; E467-R483 IonicContact OE1-NH2 3.6Å; E467-R483 PolarHBondContact OE1-NH2 2.76Å; E467-R483 IonicContact OE2-NH2 3.55Å; I479-R483 HydrophobicContact CG2-CG 4.27Å; I479-R483 VanDerWaalsContact O-CB 3.29Å; I479-R483 WeakPolarHBondContact O-CB 3.36Å; I479-R483 WeakPolarHBondContact O-CG 3.4Å; I479-R483 PolarHBondContact O-N 3.28Å; Q481-R483 VanDerWaalsContact C-N 3.27Å; Q481-R483 PolarHBondContact O-N 3.37Å; R483-L485 VanDerWaalsContact C-N 3.34Å; R483-L485 HydrophobicContact CB-CD1 3.62Å; R483-L485 HydrophobicContact CB-CD2 4.47Å; R483-L485 HydrophobicContact CB-CG 3.61Å; R483-L485 HydrophobicContact CG-CD1 4.36Å; R483-L485 PolarHBondContact O-N 3.41Å
484	D	78.6	Confident	79.6	Confident	97 Å²	97	62.6 Å²	62.6	52%	0.519	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	49	52.8	-175.8	-172.3	26.7	0	0	0	112	I480 Q481 R534	I480-D484 WeakPolarHBondContact O-CA 3.49Å; I480-D484 PolarHBondContact O-N 3.38Å; I480-D484 VanDerWaalsContact O-N 3.11Å; Q481-D484 PolarHBondContact O-N 3.11Å; D484-R534 WeakPolarHBondContact O-CD 3.3Å; D484-R534 PolarHBondContact O-NE 3.41Å; D484-R534 VanDerWaalsContact O-NE 3.1Å; D484-R534 PolarHBondContact O-NH1 2.72Å; D484-R534 VanDerWaalsContact O-NH1 3.13Å; D484-R534 IonicContact OD1-CZ 2.68Å; D484-R534 VanDerWaalsContact OD1-CZ 3.31Å; D484-R534 IonicContact OD1-NH1 3.7Å; D484-R534 PolarHBondContact OD1-NH1 3.11Å; D484-R534 IonicContact OD1-NH2 3.26Å; D484-R534 PolarHBondContact OD1-NH2 2.75Å; D484-R534 IonicContact OD2-CZ 3.07Å; D484-R534 IonicContact OD2-NH1 3.61Å; D484-R534 PolarHBondContact OD2-NH1 3.33Å; D484-R534 IonicContact OD2-NH2 3.34Å
485	L	78.3	Confident	79.5	Confident	10 Å²	10	61.8 Å²	61.8	5%	0.052	34%	0.336	C	S	.	.			trans	-98.7	6	-175.5	-66.8	173.9	0	0	0	113.8	A460 Q463 V464 I480 R483	A460-L485 HydrophobicContact CB-CB 4.46Å; Q463-L485 HydrophobicContact CB-CD1 4.36Å; V464-L485 HydrophobicContact CG2-CD1 3.71Å; I480-L485 HydrophobicContact CG2-CB 4.49Å; I480-L485 PolarHBondContact O-N 3.2Å; R483-L485 VanDerWaalsContact C-N 3.34Å; R483-L485 HydrophobicContact CB-CD1 3.62Å; R483-L485 HydrophobicContact CB-CD2 4.47Å; R483-L485 HydrophobicContact CB-CG 3.61Å; R483-L485 HydrophobicContact CG-CD1 4.36Å; R483-L485 PolarHBondContact O-N 3.41Å
486	G	77.3	Confident	79.4	Confident	20 Å²	20	68.3 Å²	68.3	21%	0.206	35%	0.354	C	S	.	.	S	Bend	trans	-61	146.2	176.1	0	0	0	0	0	111.8	V488 R534	G486-V488 PolarHBondContact O-N 3.34Å; G486-R534 PolarHBondContact O-NE 2.91Å; G486-R534 PolarHBondContact O-NH2 2.71Å
487	L	75.3	Confident	79.3	Confident	47 Å²	47	69.8 Å²	69.8	25%	0.246	36%	0.362	C	S	.	.			trans	-58.3	133.3	177.2	-154.9	92.1	0	0	0	109.9	R455 S489 R534	R455-L487 PolarHBondContact O-N 2.93Å; L487-S489 PolarHBondContact O-N 3.28Å; L487-S489 VanDerWaalsContact O-N 3.13Å; L487-R534 WeakPolarHBondContact CA-O 3.47Å; L487-R534 WeakPolarHBondContact CD1-O 3.19Å; L487-R534 WeakPolarHBondContact CG-O 3.19Å
488	V	70.1	Confident	79.3	Confident	31 Å²	31	67.6 Å²	67.6	19%	0.188	35%	0.348	C	S	.	.			trans	-74.6	105	171	-179.6	0	0	0	0	107.4	G486 L494 R534	G486-V488 PolarHBondContact O-N 3.34Å; V488-L494 HydrophobicContact CB-CD1 4.02Å; V488-L494 HydrophobicContact CG1-CD1 3.94Å; V488-R534 HydrophobicContact CG2-CB 3.98Å; V488-R534 PolarHBondContact N-O 3.5Å
489	S	63	Low	79.2	Confident	115 Å²	115	66.9 Å²	66.9	80%	0.804	34%	0.344	S	S	*	.			trans	-94.8	-4	179.7	47.7	0	0	0	0	113.8	L487 D491	L487-S489 PolarHBondContact O-N 3.28Å; L487-S489 VanDerWaalsContact O-N 3.13Å; S489-D491 PolarHBondContact O-N 2.83Å
490	D	72.8	Confident	79.3	Confident	92 Å²	92	72.1 Å²	72.1	49%	0.492	37%	0.367	S	S	.	.			trans	-85	105.6	176.4	-163.4	-17.1	0	0	0	110.3	A492 D493 L494	D490-A492 PolarHBondContact O-N 3.08Å; D490-A492 PolarHBondContact OD1-N 2.96Å; D490-D493 HydrophobicContact CB-CB 4.39Å; D490-D493 PolarHBondContact O-N 2.84Å; D490-L494 PolarHBondContact O-N 3.5Å
491	D	72.1	Confident	79.4	Confident	80 Å²	80	71.3 Å²	71.3	43%	0.428	36%	0.363	S	S	.	.	H	α-helix	trans	-59.3	-35.1	-177.7	-162.9	47.5	0	0	0	111.4	S489 D493 L494 H495	S489-D491 PolarHBondContact O-N 2.83Å; D491-D493 PolarHBondContact O-N 3.45Å; D491-L494 PolarHBondContact O-N 2.86Å; D491-H495 WeakPolarHBondContact O-CB 3.47Å; D491-H495 PolarHBondContact O-CD2 2.94Å; D491-H495 PolarHBondContact O-N 2.85Å; D491-H495 IonicContact OD1-CD2 3.4Å; D491-H495 IonicContact OD1-NE2 2.75Å; D491-H495 IonicContact OD2-CD2 3.05Å; D491-H495 IonicContact OD2-NE2 3.97Å
492	A	76.9	Confident	79.5	Confident	67 Å²	67	64.7 Å²	64.7	55%	0.554	33%	0.333	S	S	*	.	H	α-helix	trans	-64.9	-40.8	-179.6	0	0	0	0	0	112.2	D490 H495 R496	D490-A492 PolarHBondContact O-N 3.08Å; D490-A492 PolarHBondContact OD1-N 2.96Å; A492-H495 PolarHBondContact O-N 3.26Å; A492-R496 WeakPolarHBondContact O-CB 3.27Å; A492-R496 PolarHBondContact O-N 2.87Å
493	D	79	Confident	79.6	Confident	61 Å²	61	65.2 Å²	65.2	33%	0.326	34%	0.336	S	S	.	.	H	α-helix	trans	-70.3	-39	177.4	-101	-22.4	0	0	0	111.8	D490 D491 H495 R496 I497	D490-D493 HydrophobicContact CB-CB 4.39Å; D490-D493 PolarHBondContact O-N 2.84Å; D491-D493 PolarHBondContact O-N 3.45Å; D493-H495 VanDerWaalsContact C-N 3.35Å; D493-H495 PolarHBondContact O-N 3.26Å; D493-R496 PolarHBondContact O-N 3.12Å; D493-R496 IonicContact OD1-CZ 3.68Å; D493-R496 IonicContact OD1-NE 3.91Å; D493-R496 PolarHBondContact OD1-NE 3.11Å; D493-R496 IonicContact OD1-NH2 3.27Å; D493-R496 PolarHBondContact OD1-NH2 3.23Å; D493-I497 WeakPolarHBondContact O-CG1 3.34Å; D493-I497 PolarHBondContact O-N 3.09Å
494	L	81.6	Confident	80	Confident	1 Å²	1	61.8 Å²	61.8	1%	0.005	33%	0.334	C	S	.	.	H	α-helix	trans	-62.8	-43.3	175	-133.7	92.6	0	0	0	111.4	V488 D490 D491 R496 I497 C498 A535 L539 V540 I543	V488-L494 HydrophobicContact CB-CD1 4.02Å; V488-L494 HydrophobicContact CG1-CD1 3.94Å; D490-L494 PolarHBondContact O-N 3.5Å; D491-L494 PolarHBondContact O-N 2.86Å; L494-R496 VanDerWaalsContact C-N 3.33Å; L494-R496 PolarHBondContact O-N 2.85Å; L494-I497 PolarHBondContact O-N 3.17Å; L494-C498 WeakPolarHBondContact O-CB 2.93Å; L494-C498 PolarHBondContact O-N 3.09Å; L494-C498 PolarHBondContact O-SG 2.85Å; L494-A535 HydrophobicContact CD1-CB 3.87Å; L494-L539 HydrophobicContact CD2-CB 4.41Å; L494-L539 HydrophobicContact CD2-CD2 3.87Å; L494-L539 HydrophobicContact CD2-CG 4Å; L494-V540 HydrophobicContact CD2-CG2 3.64Å; L494-V540 HydrophobicContact CG-CG2 4.38Å; L494-I543 HydrophobicContact CB-CD1 4.3Å; L494-I543 HydrophobicContact CD2-CD1 3.8Å
495	H	82.7	Confident	80.5	Confident	54 Å²	54	59.8 Å²	59.8	25%	0.25	32%	0.321	C	S	.	.	H	α-helix	trans	-60.7	-41.1	175.7	-91.9	-83.4	0	0	0	112	D491 A492 D493 Q499 K547	D491-H495 WeakPolarHBondContact O-CB 3.47Å; D491-H495 PolarHBondContact O-CD2 2.94Å; D491-H495 PolarHBondContact O-N 2.85Å; D491-H495 IonicContact OD1-CD2 3.4Å; D491-H495 IonicContact OD1-NE2 2.75Å; D491-H495 IonicContact OD2-CD2 3.05Å; D491-H495 IonicContact OD2-NE2 3.97Å; A492-H495 PolarHBondContact O-N 3.26Å; D493-H495 VanDerWaalsContact C-N 3.35Å; D493-H495 PolarHBondContact O-N 3.26Å; H495-Q499 VanDerWaalsContact O-CB 3.29Å; H495-Q499 WeakPolarHBondContact O-CB 3.39Å; H495-Q499 PolarHBondContact O-N 3.24Å; H495-K547 WeakPolarHBondContact O-CE 3.39Å
496	R	84.4	Confident	80.9	Confident	166 Å²	166	62.6 Å²	62.6	63%	0.626	34%	0.34	S	S	*	.	H	α-helix	trans	-65.3	-44.8	177.4	-174.3	175.2	63	131	-3	112.2	A492 D493 L494 Q499 K500	A492-R496 WeakPolarHBondContact O-CB 3.27Å; A492-R496 PolarHBondContact O-N 2.87Å; D493-R496 PolarHBondContact O-N 3.12Å; D493-R496 IonicContact OD1-CZ 3.68Å; D493-R496 IonicContact OD1-NE 3.91Å; D493-R496 PolarHBondContact OD1-NE 3.11Å; D493-R496 IonicContact OD1-NH2 3.27Å; D493-R496 PolarHBondContact OD1-NH2 3.23Å; L494-R496 VanDerWaalsContact C-N 3.33Å; L494-R496 PolarHBondContact O-N 2.85Å; R496-Q499 PolarHBondContact O-N 3.01Å; R496-K500 WeakPolarHBondContact O-CB 3.36Å; R496-K500 PolarHBondContact O-N 2.85Å
497	I	84.1	Confident	81.2	Confident	32 Å²	32	66.4 Å²	66.4	16%	0.164	36%	0.356	C	S	.	.	H	α-helix	trans	-65.3	-45	177.6	-64.9	167.5	0	0	0	110.4	D493 L494 Q499 K500 V501 V527 E530 T531	D493-I497 WeakPolarHBondContact O-CG1 3.34Å; D493-I497 PolarHBondContact O-N 3.09Å; L494-I497 PolarHBondContact O-N 3.17Å; I497-Q499 VanDerWaalsContact C-N 3.3Å; I497-Q499 PolarHBondContact O-N 3.1Å; I497-K500 PolarHBondContact O-N 3.18Å; I497-V501 WeakPolarHBondContact O-CG2 3.32Å; I497-V501 PolarHBondContact O-N 3.02Å; I497-V527 HydrophobicContact CG2-CG1 4.37Å; I497-E530 HydrophobicContact CG2-CB 3.95Å; I497-T531 HydrophobicContact CD1-CG2 3.85Å; I497-T531 HydrophobicContact CG2-CG2 4.14Å
498	C	84.1	Confident	81.7	Confident	0 Å²	0	65.8 Å²	65.8	0%	0	35%	0.351	C	S	.	.	H	α-helix	trans	-60.8	-41	176.4	-68.4	0	0	0	0	111.5	L494 V501 V502 I543 L544 K547	L494-C498 WeakPolarHBondContact O-CB 2.93Å; L494-C498 PolarHBondContact O-N 3.09Å; L494-C498 PolarHBondContact O-SG 2.85Å; C498-V501 PolarHBondContact O-N 3.16Å; C498-V502 VanDerWaalsContact O-CG2 3.26Å; C498-V502 WeakPolarHBondContact O-CG2 3.47Å; C498-V502 PolarHBondContact O-N 2.81Å; C498-I543 HydrophobicContact CB-CG2 3.72Å; C498-L544 HydrophobicContact CB-CD2 4.13Å; C498-K547 HydrophobicContact CB-CD 4.35Å
499	Q	85.3	Confident	82.4	Confident	86 Å²	86	64.9 Å²	64.9	40%	0.402	35%	0.346	S	S	.	.	H	α-helix	trans	-61.5	-47.8	176	-175.9	122	5.9	0	0	111.8	H495 R496 I497 V501 V502 E503 K547	H495-Q499 VanDerWaalsContact O-CB 3.29Å; H495-Q499 WeakPolarHBondContact O-CB 3.39Å; H495-Q499 PolarHBondContact O-N 3.24Å; R496-Q499 PolarHBondContact O-N 3.01Å; I497-Q499 VanDerWaalsContact C-N 3.3Å; I497-Q499 PolarHBondContact O-N 3.1Å; Q499-V501 VanDerWaalsContact C-N 3.28Å; Q499-V501 PolarHBondContact O-N 3.11Å; Q499-V502 PolarHBondContact O-N 2.92Å; Q499-V502 VanDerWaalsContact O-N 3.16Å; Q499-E503 HydrophobicContact CG-CG 4.42Å; Q499-E503 WeakPolarHBondContact CG-OE1 3.39Å; Q499-E503 PolarHBondContact NE2-OE1 2.63Å; Q499-E503 WeakPolarHBondContact O-CG 3.38Å; Q499-E503 PolarHBondContact O-N 3.41Å; Q499-K547 HydrophobicContact CB-CD 4.43Å
500	K	87.4	Confident	83.3	Confident	111 Å²	111	67.1 Å²	67.1	48%	0.483	34%	0.337	S	S	.	.	H	α-helix	trans	-58	-40	176.4	-175.3	-170.8	172.9	-153.5	0	112.2	R496 I497 S504 E530	R496-K500 WeakPolarHBondContact O-CB 3.36Å; R496-K500 PolarHBondContact O-N 2.85Å; I497-K500 PolarHBondContact O-N 3.18Å; K500-S504 WeakPolarHBondContact O-CB 3.38Å; K500-S504 PolarHBondContact O-N 3.2Å; K500-S504 PolarHBondContact O-OG 2.71Å; K500-E530 IonicContact NZ-OE1 3.52Å; K500-E530 PolarHBondContact NZ-OE1 3.49Å; K500-E530 IonicContact NZ-OE2 3.74Å; K500-E530 PolarHBondContact NZ-OE2 3.39Å
501	V	86.8	Confident	83.8	Confident	5 Å²	5	64 Å²	64	3%	0.03	32%	0.324	C	S	.	.	H	α-helix	trans	-67.8	-41	177.3	172.6	0	0	0	0	111.5	I497 C498 Q499 S504 H505 L523 L526 V527	I497-V501 WeakPolarHBondContact O-CG2 3.32Å; I497-V501 PolarHBondContact O-N 3.02Å; C498-V501 PolarHBondContact O-N 3.16Å; Q499-V501 VanDerWaalsContact C-N 3.28Å; Q499-V501 PolarHBondContact O-N 3.11Å; V501-S504 WeakPolarHBondContact CA-OG 3.01Å; V501-S504 PolarHBondContact O-N 3.22Å; V501-S504 PolarHBondContact O-OG 3.02Å; V501-S504 VanDerWaalsContact O-OG 3.08Å; V501-H505 PolarHBondContact O-N 2.84Å; V501-H505 PolarHBondContact O-ND1 3.33Å; V501-L523 HydrophobicContact CG1-CD2 4.09Å; V501-L526 HydrophobicContact CG1-CB 3.88Å; V501-L526 HydrophobicContact CG1-CD1 4.32Å; V501-V527 HydrophobicContact CB-CG2 4.01Å; V501-V527 HydrophobicContact CG1-CG2 4.03Å; V501-V527 HydrophobicContact CG2-CG2 3.88Å
502	V	86.5	Confident	84.5	Confident	23 Å²	23	61 Å²	61	14%	0.139	31%	0.309	C	S	.	.	H	α-helix	trans	-64.1	-43.8	176.4	168.7	0	0	0	0	111.4	C498 Q499 H505 V509 L544 K547 T548	C498-V502 VanDerWaalsContact O-CG2 3.26Å; C498-V502 WeakPolarHBondContact O-CG2 3.47Å; C498-V502 PolarHBondContact O-N 2.81Å; Q499-V502 PolarHBondContact O-N 2.92Å; Q499-V502 VanDerWaalsContact O-N 3.16Å; V502-H505 PolarHBondContact O-N 2.83Å; V502-V509 HydrophobicContact CB-CG2 4.35Å; V502-V509 HydrophobicContact CG1-CG2 3.77Å; V502-L544 HydrophobicContact CG2-CD2 3.9Å; V502-K547 HydrophobicContact CG2-CB 4.28Å; V502-T548 HydrophobicContact CG2-CG2 4Å
503	E	87.1	Confident	84.8	Confident	130 Å²	130	65.3 Å²	65.3	61%	0.607	31%	0.31	S	S	*	.	H	α-helix	trans	-68.7	-33.9	179.8	-72.9	170.3	-171.8	0	0	112.8	Q499 H505	Q499-E503 HydrophobicContact CG-CG 4.42Å; Q499-E503 WeakPolarHBondContact CG-OE1 3.39Å; Q499-E503 PolarHBondContact NE2-OE1 2.63Å; Q499-E503 WeakPolarHBondContact O-CG 3.38Å; Q499-E503 PolarHBondContact O-N 3.41Å; E503-H505 VanDerWaalsContact C-N 3.34Å
504	S	87.7	Confident	84.9	Confident	69 Å²	69	67 Å²	67	48%	0.483	33%	0.327	S	S	.	.	H	α-helix	trans	-79.5	-12.5	179.1	50.2	0	0	0	0	114.4	K500 V501 P506	K500-S504 WeakPolarHBondContact O-CB 3.38Å; K500-S504 PolarHBondContact O-N 3.2Å; K500-S504 PolarHBondContact O-OG 2.71Å; V501-S504 WeakPolarHBondContact CA-OG 3.01Å; V501-S504 PolarHBondContact O-N 3.22Å; V501-S504 PolarHBondContact O-OG 3.02Å; V501-S504 VanDerWaalsContact O-OG 3.08Å; S504-P506 VanDerWaalsContact C-CD 3.5Å
505	H	88.5	Confident	84.9	Confident	56 Å²	56	69.7 Å²	69.7	26%	0.259	36%	0.355	S	S	.	.			trans	-132.5	61	-174.7	-64	80.8	0	0	0	112.3	V501 V502 E503 D507 E508 V509 L523	V501-H505 PolarHBondContact O-N 2.84Å; V501-H505 PolarHBondContact O-ND1 3.33Å; V502-H505 PolarHBondContact O-N 2.83Å; E503-H505 VanDerWaalsContact C-N 3.34Å; H505-D507 VanDerWaalsContact C-N 3.28Å; H505-D507 PolarHBondContact O-N 3.48Å; H505-E508 HydrophobicContact CB-CB 4.32Å; H505-E508 WeakPolarHBondContact CB-OE2 3.39Å; H505-E508 IonicContact CD2-OE2 3.71Å; H505-E508 PolarHBondContact O-N 2.97Å; H505-V509 WeakPolarHBondContact O-CG2 3.49Å; H505-V509 PolarHBondContact O-N 2.62Å; H505-L523 HydrophobicContact CB-CD2 4.05Å
506	P	85.8	Confident	84.8	Confident	69 Å²	69	70.8 Å²	70.8	45%	0.448	36%	0.363	S	S	.	.	H	α-helix	trans	-66.7	-25.9	-173	27	-35.4	0	0	0	113.9	S504 V509 R510	S504-P506 VanDerWaalsContact C-CD 3.5Å; P506-V509 PolarHBondContact O-N 3.12Å; P506-R510 WeakPolarHBondContact O-CG 3.45Å; P506-R510 PolarHBondContact O-N 3.42Å; P506-R510 VanDerWaalsContact O-N 3.07Å
507	D	84.6	Confident	84.5	Confident	100 Å²	100	68.6 Å²	68.6	54%	0.535	36%	0.36	S	S	.	.	H	α-helix	trans	-70.2	-42.8	178.6	-67.7	-25.1	0	0	0	111.4	H505 V509 R510 A511	H505-D507 VanDerWaalsContact C-N 3.28Å; H505-D507 PolarHBondContact O-N 3.48Å; D507-V509 VanDerWaalsContact C-N 3.32Å; D507-V509 PolarHBondContact O-N 2.86Å; D507-R510 PolarHBondContact O-N 3.18Å; D507-R510 IonicContact OD1-CZ 3.6Å; D507-R510 IonicContact OD1-NE 3.77Å; D507-R510 IonicContact OD1-NH2 2.66Å; D507-R510 PolarHBondContact OD1-NH2 2.83Å; D507-A511 PolarHBondContact O-N 3.41Å
508	E	85.1	Confident	84.3	Confident	33 Å²	33	75.1 Å²	75.1	15%	0.154	39%	0.387	C	S	.	.	H	α-helix	trans	-62.2	-39.5	173.6	-75	79.8	179.5	0	0	112	H505 A511 V512 V519 K522 L523	H505-E508 HydrophobicContact CB-CB 4.32Å; H505-E508 WeakPolarHBondContact CB-OE2 3.39Å; H505-E508 IonicContact CD2-OE2 3.71Å; H505-E508 PolarHBondContact O-N 2.97Å; E508-A511 WeakPolarHBondContact O-CB 3.47Å; E508-A511 PolarHBondContact O-N 2.74Å; E508-V512 WeakPolarHBondContact O-CG2 3.47Å; E508-V512 PolarHBondContact O-N 2.93Å; E508-V519 HydrophobicContact CB-CG1 3.61Å; E508-V519 HydrophobicContact CG-CG1 3.75Å; E508-V519 WeakPolarHBondContact O-CG1 3.28Å; E508-K522 HydrophobicContact CG-CD 4.26Å; E508-K522 IonicContact OE1-NZ 3.81Å; E508-K522 PolarHBondContact OE1-NZ 2.69Å; E508-L523 HydrophobicContact CB-CD1 4.41Å; E508-L523 HydrophobicContact CB-CD2 3.92Å; E508-L523 HydrophobicContact CB-CG 4.21Å; E508-L523 HydrophobicContact CG-CD2 4.5Å
509	V	84.7	Confident	84.4	Confident	12 Å²	12	76.4 Å²	76.4	7%	0.073	39%	0.394	C	S	.	.	H	α-helix	trans	-65.7	-42.2	177.8	177.7	0	0	0	0	111.1	V502 H505 P506 D507 A511 V512 R513 T548	V502-V509 HydrophobicContact CB-CG2 4.35Å; V502-V509 HydrophobicContact CG1-CG2 3.77Å; H505-V509 WeakPolarHBondContact O-CG2 3.49Å; H505-V509 PolarHBondContact O-N 2.62Å; P506-V509 PolarHBondContact O-N 3.12Å; D507-V509 VanDerWaalsContact C-N 3.32Å; D507-V509 PolarHBondContact O-N 2.86Å; V509-A511 VanDerWaalsContact C-N 3.3Å; V509-A511 PolarHBondContact O-N 3.23Å; V509-V512 PolarHBondContact O-N 2.84Å; V509-R513 PolarHBondContact O-N 2.94Å; V509-T548 HydrophobicContact CG1-CG2 4.17Å; V509-T548 HydrophobicContact CG2-CG2 4.16Å
510	R	83	Confident	84.3	Confident	163 Å²	163	72.4 Å²	72.4	62%	0.615	38%	0.376	S	S	*	.	H	α-helix	trans	-62.1	-37.5	173.2	-76.3	-171.1	-75.6	-165.6	-2	112.4	P506 D507 R513 S514	P506-R510 WeakPolarHBondContact O-CG 3.45Å; P506-R510 PolarHBondContact O-N 3.42Å; P506-R510 VanDerWaalsContact O-N 3.07Å; D507-R510 PolarHBondContact O-N 3.18Å; D507-R510 IonicContact OD1-CZ 3.6Å; D507-R510 IonicContact OD1-NE 3.77Å; D507-R510 IonicContact OD1-NH2 2.66Å; D507-R510 PolarHBondContact OD1-NH2 2.83Å; R510-R513 PolarHBondContact O-N 2.89Å; R510-S514 PolarHBondContact O-N 3.11Å; R510-S514 PolarHBondContact O-OG 3.3Å
511	A	83.3	Confident	84.1	Confident	27 Å²	27	71.2 Å²	71.2	22%	0.223	38%	0.375	C	S	.	.	H	α-helix	trans	-67.5	-36.4	176.1	0	0	0	0	0	112.5	D507 E508 V509 S514 N516 V519	D507-A511 PolarHBondContact O-N 3.41Å; E508-A511 WeakPolarHBondContact O-CB 3.47Å; E508-A511 PolarHBondContact O-N 2.74Å; V509-A511 VanDerWaalsContact C-N 3.3Å; V509-A511 PolarHBondContact O-N 3.23Å; A511-S514 VanDerWaalsContact CA-OG 3.32Å; A511-S514 WeakPolarHBondContact CA-OG 3.41Å; A511-S514 PolarHBondContact O-OG 3.19Å; A511-N516 VanDerWaalsContact O-CB 3.31Å; A511-N516 WeakPolarHBondContact O-CB 3.35Å; A511-N516 PolarHBondContact O-N 2.86Å; A511-N516 VanDerWaalsContact O-N 3.08Å; A511-V519 HydrophobicContact CB-CB 4.37Å; A511-V519 HydrophobicContact CB-CG1 4.27Å; A511-V519 HydrophobicContact CB-CG2 3.93Å
512	V	85.6	Confident	84	Confident	17 Å²	17	76.8 Å²	76.8	10%	0.103	40%	0.398	C	S	.	.	H	α-helix	trans	-66.6	-45.7	173.3	174.7	0	0	0	0	110.9	E508 V509 S514 G515 V519 L520 L523	E508-V512 WeakPolarHBondContact O-CG2 3.47Å; E508-V512 PolarHBondContact O-N 2.93Å; V509-V512 PolarHBondContact O-N 2.84Å; V512-S514 VanDerWaalsContact C-N 3.27Å; V512-S514 PolarHBondContact O-N 3.33Å; V512-G515 PolarHBondContact O-N 3.38Å; V512-V519 HydrophobicContact CG2-CB 3.88Å; V512-V519 HydrophobicContact CG2-CG1 4.11Å; V512-L520 HydrophobicContact CG2-CB 4.34Å; V512-L523 HydrophobicContact CG2-CD1 4.31Å
513	R	82.9	Confident	83.9	Confident	156 Å²	156	75.7 Å²	75.7	59%	0.589	39%	0.392	S	S	*	.	H	α-helix	trans	-61.9	-30.6	177.6	-75.6	-176.5	169.6	169.1	-0.1	114.2	V509 R510 G515 T548 S549	V509-R513 PolarHBondContact O-N 2.94Å; R510-R513 PolarHBondContact O-N 2.89Å; R513-G515 PolarHBondContact O-N 3.45Å; R513-T548 WeakPolarHBondContact CG-O 3.34Å; R513-S549 PolarHBondContact NE-OXT 3.12Å; R513-S549 PolarHBondContact NH2-OXT 3.25Å
514	S	82.4	Confident	83.8	Confident	98 Å²	98	70.3 Å²	70.3	69%	0.685	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80	6.9	174.9	48.2	0	0	0	0	113.8	R510 A511 V512	R510-S514 PolarHBondContact O-N 3.11Å; R510-S514 PolarHBondContact O-OG 3.3Å; A511-S514 VanDerWaalsContact CA-OG 3.32Å; A511-S514 WeakPolarHBondContact CA-OG 3.41Å; A511-S514 PolarHBondContact O-OG 3.19Å; V512-S514 VanDerWaalsContact C-N 3.27Å; V512-S514 PolarHBondContact O-N 3.33Å
515	G	80.1	Confident	83.6	Confident	57 Å²	57	68.7 Å²	68.7	59%	0.588	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	99.4	0.3	172.3	0	0	0	0	0	114.9	V512 R513 Q517	V512-G515 PolarHBondContact O-N 3.38Å; R513-G515 PolarHBondContact O-N 3.45Å; G515-Q517 VanDerWaalsContact C-N 3.35Å; G515-Q517 PolarHBondContact O-N 2.96Å
516	N	81	Confident	83.4	Confident	77 Å²	77	68.3 Å²	68.3	41%	0.412	36%	0.361	S	S	.	.			trans	-84.3	76.8	178.8	-166.3	-7.5	0	0	0	112	A511 K518 V519	A511-N516 VanDerWaalsContact O-CB 3.31Å; A511-N516 WeakPolarHBondContact O-CB 3.35Å; A511-N516 PolarHBondContact O-N 2.86Å; A511-N516 VanDerWaalsContact O-N 3.08Å; N516-K518 PolarHBondContact O-N 3Å; N516-K518 WeakPolarHBondContact OD1-CB 3.46Å; N516-K518 PolarHBondContact OD1-N 2.88Å; N516-V519 HydrophobicContact CB-CG2 4.27Å; N516-V519 PolarHBondContact O-N 3.01Å; N516-V519 VanDerWaalsContact O-N 3.07Å
517	Q	78	Confident	83.3	Confident	120 Å²	120	65 Å²	65	56%	0.561	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.7	-19.5	178.3	-72.2	-101.4	-11.4	0	0	114.3	G515 V519 L520	G515-Q517 VanDerWaalsContact C-N 3.35Å; G515-Q517 PolarHBondContact O-N 2.96Å; Q517-V519 PolarHBondContact O-N 3.47Å; Q517-L520 VanDerWaalsContact O-CB 3.3Å; Q517-L520 WeakPolarHBondContact O-CB 3.45Å; Q517-L520 PolarHBondContact O-N 2.95Å
518	K	80.3	Confident	83.2	Confident	169 Å²	169	63.4 Å²	63.4	74%	0.735	33%	0.329	S	S	*	.	H	α-helix	trans	-65.6	-27.1	176.7	-68.4	-178.2	177.8	177.1	0	112.5	N516 L520 N521	N516-K518 PolarHBondContact O-N 3Å; N516-K518 WeakPolarHBondContact OD1-CB 3.46Å; N516-K518 PolarHBondContact OD1-N 2.88Å; K518-L520 VanDerWaalsContact C-N 3.28Å; K518-L520 PolarHBondContact O-N 2.99Å; K518-N521 PolarHBondContact O-N 3.5Å
519	V	85.4	Confident	83	Confident	26 Å²	26	70 Å²	70	16%	0.158	36%	0.357	C	S	.	.	H	α-helix	trans	-71.7	-24.8	179.9	-177.4	0	0	0	0	111.8	E508 A511 V512 N516 Q517 N521 K522 L523	E508-V519 HydrophobicContact CB-CG1 3.61Å; E508-V519 HydrophobicContact CG-CG1 3.75Å; E508-V519 WeakPolarHBondContact O-CG1 3.28Å; A511-V519 HydrophobicContact CB-CB 4.37Å; A511-V519 HydrophobicContact CB-CG1 4.27Å; A511-V519 HydrophobicContact CB-CG2 3.93Å; V512-V519 HydrophobicContact CG2-CB 3.88Å; V512-V519 HydrophobicContact CG2-CG1 4.11Å; N516-V519 HydrophobicContact CB-CG2 4.27Å; N516-V519 PolarHBondContact O-N 3.01Å; N516-V519 VanDerWaalsContact O-N 3.07Å; Q517-V519 PolarHBondContact O-N 3.47Å; V519-N521 PolarHBondContact O-N 2.68Å; V519-K522 VanDerWaalsContact O-CB 3.28Å; V519-K522 WeakPolarHBondContact O-CB 3.39Å; V519-K522 PolarHBondContact O-N 3.38Å; V519-L523 PolarHBondContact O-N 3.02Å
520	L	83.1	Confident	82.9	Confident	2 Å²	2	74.1 Å²	74.1	1%	0.01	38%	0.375	C	S	.	.	H	α-helix	trans	-59.3	-36.2	173.2	-170.2	71.3	0	0	0	111.8	V512 Q517 K518 K522 L523 M524 R541 L544 Q545	V512-L520 HydrophobicContact CG2-CB 4.34Å; Q517-L520 VanDerWaalsContact O-CB 3.3Å; Q517-L520 WeakPolarHBondContact O-CB 3.45Å; Q517-L520 PolarHBondContact O-N 2.95Å; K518-L520 VanDerWaalsContact C-N 3.28Å; K518-L520 PolarHBondContact O-N 2.99Å; L520-K522 VanDerWaalsContact C-N 3.26Å; L520-K522 PolarHBondContact O-N 2.95Å; L520-L523 PolarHBondContact O-N 2.9Å; L520-M524 WeakPolarHBondContact O-CG 3.17Å; L520-M524 PolarHBondContact O-N 3.24Å; L520-R541 HydrophobicContact CD2-CG 4.35Å; L520-L544 HydrophobicContact CD1-CB 3.89Å; L520-Q545 HydrophobicContact CD2-CG 3.67Å
521	N	84.2	Confident	82.8	Confident	87 Å²	87	66.7 Å²	66.7	47%	0.465	35%	0.348	S	S	.	.	H	α-helix	trans	-65.5	-29.7	176	-66	-32.6	0	0	0	112.3	K518 V519 G525 R541	K518-N521 PolarHBondContact O-N 3.5Å; V519-N521 PolarHBondContact O-N 2.68Å; N521-G525 PolarHBondContact O-N 3.43Å; N521-G525 VanDerWaalsContact O-N 3.1Å; N521-R541 PolarHBondContact OD1-NH2 2.85Å
522	K	84.9	Confident	82.3	Confident	121 Å²	121	72.7 Å²	72.7	53%	0.526	37%	0.369	S	S	.	.	H	α-helix	trans	-69.5	-43.8	175.2	-165.9	-173.9	176.7	-161.1	0	110.7	E508 V519 L520 G525 L526	E508-K522 HydrophobicContact CG-CD 4.26Å; E508-K522 IonicContact OE1-NZ 3.81Å; E508-K522 PolarHBondContact OE1-NZ 2.69Å; V519-K522 VanDerWaalsContact O-CB 3.28Å; V519-K522 WeakPolarHBondContact O-CB 3.39Å; V519-K522 PolarHBondContact O-N 3.38Å; L520-K522 VanDerWaalsContact C-N 3.26Å; L520-K522 PolarHBondContact O-N 2.95Å; K522-G525 PolarHBondContact O-N 3.42Å; K522-L526 PolarHBondContact O-N 3.11Å; K522-L526 VanDerWaalsContact O-N 3.16Å
523	L	84.8	Confident	81.7	Confident	0 Å²	0	72.2 Å²	72.2	0%	0	37%	0.367	C	S	.	.	H	α-helix	trans	-63.5	-40.7	174.3	-67	172.5	0	0	0	111.8	V501 H505 E508 V512 V519 L520 G525 L526 V527 L544 T548	V501-L523 HydrophobicContact CG1-CD2 4.09Å; H505-L523 HydrophobicContact CB-CD2 4.05Å; E508-L523 HydrophobicContact CB-CD1 4.41Å; E508-L523 HydrophobicContact CB-CD2 3.92Å; E508-L523 HydrophobicContact CB-CG 4.21Å; E508-L523 HydrophobicContact CG-CD2 4.5Å; V512-L523 HydrophobicContact CG2-CD1 4.31Å; V519-L523 PolarHBondContact O-N 3.02Å; L520-L523 PolarHBondContact O-N 2.9Å; L523-G525 VanDerWaalsContact C-N 3.3Å; L523-G525 PolarHBondContact O-N 2.59Å; L523-L526 HydrophobicContact CD2-CD1 4.37Å; L523-L526 WeakPolarHBondContact O-CB 3.38Å; L523-L526 PolarHBondContact O-N 3.43Å; L523-L526 VanDerWaalsContact O-N 3.14Å; L523-V527 PolarHBondContact O-N 2.61Å; L523-L544 HydrophobicContact CB-CD1 4.17Å; L523-T548 HydrophobicContact CD1-CG2 4.19Å
524	M	84.2	Confident	81.2	Confident	18 Å²	18	67 Å²	67	9%	0.089	35%	0.348	C	S	.	.	H	α-helix	trans	-57.7	-42.4	172.4	-75.5	-176.2	64.6	0	0	112.1	L520 L526 V527 Q528 P537 R541 L544	L520-M524 WeakPolarHBondContact O-CG 3.17Å; L520-M524 PolarHBondContact O-N 3.24Å; M524-L526 VanDerWaalsContact C-N 3.31Å; M524-L526 PolarHBondContact O-N 2.85Å; M524-V527 PolarHBondContact O-N 3.17Å; M524-Q528 WeakPolarHBondContact O-CB 3.09Å; M524-Q528 PolarHBondContact O-N 2.9Å; M524-P537 HydrophobicContact CE-CB 4.12Å; M524-R541 HydrophobicContact CE-CB 4.27Å; M524-R541 HydrophobicContact SD-CB 4.02Å; M524-R541 HydrophobicContact SD-CG 4.3Å; M524-R541 PolarHBondContact SD-NH2 3.34Å; M524-R541 VanDerWaalsContact SD-NH2 3.38Å; M524-L544 HydrophobicContact CG-CD1 3.91Å
525	G	83.4	Confident	80.9	Confident	35 Å²	35	62.4 Å²	62.4	36%	0.361	32%	0.315	S	S	.	.	H	α-helix	trans	-62.3	-35.7	176	0	0	0	0	0	113.3	N521 K522 L523 K529	N521-G525 PolarHBondContact O-N 3.43Å; N521-G525 VanDerWaalsContact O-N 3.1Å; K522-G525 PolarHBondContact O-N 3.42Å; L523-G525 VanDerWaalsContact C-N 3.3Å; L523-G525 PolarHBondContact O-N 2.59Å; G525-K529 WeakPolarHBondContact O-CB 3.45Å; G525-K529 PolarHBondContact O-N 2.77Å
526	L	85.1	Confident	80.7	Confident	47 Å²	47	62.5 Å²	62.5	25%	0.246	30%	0.303	C	S	.	.	H	α-helix	trans	-70	-43.7	176.1	-68.6	169.4	0	0	0	112.1	V501 K522 L523 M524 Q528 K529 E530	V501-L526 HydrophobicContact CG1-CB 3.88Å; V501-L526 HydrophobicContact CG1-CD1 4.32Å; K522-L526 PolarHBondContact O-N 3.11Å; K522-L526 VanDerWaalsContact O-N 3.16Å; L523-L526 HydrophobicContact CD2-CD1 4.37Å; L523-L526 WeakPolarHBondContact O-CB 3.38Å; L523-L526 PolarHBondContact O-N 3.43Å; L523-L526 VanDerWaalsContact O-N 3.14Å; M524-L526 VanDerWaalsContact C-N 3.31Å; M524-L526 PolarHBondContact O-N 2.85Å; L526-Q528 VanDerWaalsContact C-N 3.33Å; L526-Q528 PolarHBondContact O-N 2.83Å; L526-K529 WeakPolarHBondContact O-CB 3.39Å; L526-K529 PolarHBondContact O-N 2.92Å; L526-K529 VanDerWaalsContact O-N 3.14Å; L526-E530 PolarHBondContact O-N 3.31Å
527	V	84	Confident	80.5	Confident	0 Å²	0	60.6 Å²	60.6	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-63	-41.5	174.1	177	0	0	0	0	110.7	I497 V501 L523 M524 K529 E530 T531 V540 L544	I497-V527 HydrophobicContact CG2-CG1 4.37Å; V501-V527 HydrophobicContact CB-CG2 4.01Å; V501-V527 HydrophobicContact CG1-CG2 4.03Å; V501-V527 HydrophobicContact CG2-CG2 3.88Å; L523-V527 PolarHBondContact O-N 2.61Å; M524-V527 PolarHBondContact O-N 3.17Å; V527-K529 VanDerWaalsContact C-N 3.28Å; V527-K529 PolarHBondContact O-N 3.26Å; V527-E530 PolarHBondContact O-N 2.7Å; V527-T531 HydrophobicContact CG1-CG2 4.26Å; V527-T531 WeakPolarHBondContact O-CB 3.41Å; V527-T531 WeakPolarHBondContact O-CG2 3.2Å; V527-T531 PolarHBondContact O-N 3.27Å; V527-T531 PolarHBondContact O-OG1 2.88Å; V527-V540 HydrophobicContact CB-CG1 3.91Å; V527-V540 HydrophobicContact CG1-CG1 3.65Å; V527-V540 HydrophobicContact CG1-CG2 3.95Å; V527-V540 HydrophobicContact CG2-CG1 4.29Å; V527-L544 HydrophobicContact CG2-CD1 4.08Å; V527-L544 HydrophobicContact CG2-CD2 4.24Å
528	Q	80.8	Confident	80.7	Confident	67 Å²	67	60.1 Å²	60.1	31%	0.313	30%	0.299	S	S	.	.	H	α-helix	trans	-61.4	-36.2	173.3	-88.6	-179.9	-15.4	0	0	112.5	M524 L526 T531 K532 G533	M524-Q528 WeakPolarHBondContact O-CB 3.09Å; M524-Q528 PolarHBondContact O-N 2.9Å; L526-Q528 VanDerWaalsContact C-N 3.33Å; L526-Q528 PolarHBondContact O-N 2.83Å; Q528-T531 WeakPolarHBondContact CA-OG1 3.34Å; Q528-T531 PolarHBondContact O-OG1 3.04Å; Q528-K532 CarbonylContact O-C 3.51Å; Q528-K532 WeakPolarHBondContact O-CA 3.49Å; Q528-K532 PolarHBondContact O-N 2.97Å; Q528-G533 PolarHBondContact O-N 3.23Å
529	K	82.5	Confident	80.7	Confident	170 Å²	170	55 Å²	55	74%	0.739	28%	0.279	S	S	*	.	H	α-helix	trans	-68.3	-45.4	177.2	-166.6	179.3	-178.9	-176.4	0	112.1	G525 L526 V527 K532	G525-K529 WeakPolarHBondContact O-CB 3.45Å; G525-K529 PolarHBondContact O-N 2.77Å; L526-K529 WeakPolarHBondContact O-CB 3.39Å; L526-K529 PolarHBondContact O-N 2.92Å; L526-K529 VanDerWaalsContact O-N 3.14Å; V527-K529 VanDerWaalsContact C-N 3.28Å; V527-K529 PolarHBondContact O-N 3.26Å; K529-K532 PolarHBondContact O-N 3.34Å
530	E	82.5	Confident	80.7	Confident	99 Å²	99	53.9 Å²	53.9	46%	0.463	27%	0.273	S	S	.	.	H	α-helix	trans	-63.6	-41.1	175.9	-83.1	-109.2	156.6	0	0	111.6	I497 K500 L526 V527 K532	I497-E530 HydrophobicContact CG2-CB 3.95Å; K500-E530 IonicContact NZ-OE1 3.52Å; K500-E530 PolarHBondContact NZ-OE1 3.49Å; K500-E530 IonicContact NZ-OE2 3.74Å; K500-E530 PolarHBondContact NZ-OE2 3.39Å; L526-E530 PolarHBondContact O-N 3.31Å; V527-E530 PolarHBondContact O-N 2.7Å; E530-K532 PolarHBondContact O-N 2.99Å
531	T	79.3	Confident	80.8	Confident	8 Å²	8	58.5 Å²	58.5	5%	0.049	29%	0.29	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83	4	179	59.1	0	0	0	0	113.4	I497 V527 Q528 G533 R534 A535	I497-T531 HydrophobicContact CD1-CG2 3.85Å; I497-T531 HydrophobicContact CG2-CG2 4.14Å; V527-T531 HydrophobicContact CG1-CG2 4.26Å; V527-T531 WeakPolarHBondContact O-CB 3.41Å; V527-T531 WeakPolarHBondContact O-CG2 3.2Å; V527-T531 PolarHBondContact O-N 3.27Å; V527-T531 PolarHBondContact O-OG1 2.88Å; Q528-T531 WeakPolarHBondContact CA-OG1 3.34Å; Q528-T531 PolarHBondContact O-OG1 3.04Å; T531-G533 PolarHBondContact O-N 3.35Å; T531-G533 VanDerWaalsContact O-N 3.09Å; T531-R534 WeakPolarHBondContact O-CB 3.35Å; T531-R534 WeakPolarHBondContact O-CD 3.31Å; T531-R534 WeakPolarHBondContact O-CG 3.34Å; T531-R534 PolarHBondContact O-N 2.8Å; T531-A535 HydrophobicContact CG2-CB 4Å
532	K	73.7	Confident	80.9	Confident	153 Å²	153	60 Å²	60	67%	0.665	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.3	29	-174.5	-58	179.1	-177.6	174.1	0	113.9	Q528 K529 E530	Q528-K532 CarbonylContact O-C 3.51Å; Q528-K532 WeakPolarHBondContact O-CA 3.49Å; Q528-K532 PolarHBondContact O-N 2.97Å; K529-K532 PolarHBondContact O-N 3.34Å; E530-K532 PolarHBondContact O-N 2.99Å
533	G	72.8	Confident	80.9	Confident	6 Å²	6	54.4 Å²	54.4	6%	0.062	27%	0.268	C	S	.	.	T	Hydrogen-bonded Turn	trans	78	15.5	-177.6	0	0	0	0	0	114.4	S457 S459 Q528 T531	S457-G533 WeakPolarHBondContact CB-O 3.37Å; S457-G533 PolarHBondContact OG-O 3.43Å; S459-G533 PolarHBondContact OG-O 3.16Å; Q528-G533 PolarHBondContact O-N 3.23Å; T531-G533 PolarHBondContact O-N 3.35Å; T531-G533 VanDerWaalsContact O-N 3.09Å
534	R	72.3	Confident	80.9	Confident	48 Å²	48	54.4 Å²	54.4	18%	0.181	27%	0.268	C	S	.	.			trans	-87.1	-5.7	-179.3	-61.3	168	61.4	171.9	9	114.6	D484 G486 L487 V488 T531	D484-R534 WeakPolarHBondContact O-CD 3.3Å; D484-R534 PolarHBondContact O-NE 3.41Å; D484-R534 VanDerWaalsContact O-NE 3.1Å; D484-R534 PolarHBondContact O-NH1 2.72Å; D484-R534 VanDerWaalsContact O-NH1 3.13Å; D484-R534 IonicContact OD1-CZ 2.68Å; D484-R534 VanDerWaalsContact OD1-CZ 3.31Å; D484-R534 IonicContact OD1-NH1 3.7Å; D484-R534 PolarHBondContact OD1-NH1 3.11Å; D484-R534 IonicContact OD1-NH2 3.26Å; D484-R534 PolarHBondContact OD1-NH2 2.75Å; D484-R534 IonicContact OD2-CZ 3.07Å; D484-R534 IonicContact OD2-NH1 3.61Å; D484-R534 PolarHBondContact OD2-NH1 3.33Å; D484-R534 IonicContact OD2-NH2 3.34Å; G486-R534 PolarHBondContact O-NE 2.91Å; G486-R534 PolarHBondContact O-NH2 2.71Å; L487-R534 WeakPolarHBondContact CA-O 3.47Å; L487-R534 WeakPolarHBondContact CD1-O 3.19Å; L487-R534 WeakPolarHBondContact CG-O 3.19Å; V488-R534 HydrophobicContact CG2-CB 3.98Å; V488-R534 PolarHBondContact N-O 3.5Å; T531-R534 WeakPolarHBondContact O-CB 3.35Å; T531-R534 WeakPolarHBondContact O-CD 3.31Å; T531-R534 WeakPolarHBondContact O-CG 3.34Å; T531-R534 PolarHBondContact O-N 2.8Å
535	A	76.4	Confident	80.9	Confident	0 Å²	0	57.1 Å²	57.1	0%	0	28%	0.281	C	S	.	.	S	Bend	trans	-90.1	144.9	-179.9	0	0	0	0	0	112	L494 T531 P537 V540	L494-A535 HydrophobicContact CD1-CB 3.87Å; T531-A535 HydrophobicContact CG2-CB 4Å; A535-P537 VanDerWaalsContact O-CD 3.32Å; A535-P537 WeakPolarHBondContact O-CD 3.46Å; A535-V540 HydrophobicContact CB-CG2 3.53Å
536	D	76	Confident	81	Confident	60 Å²	60	60.6 Å²	60.6	32%	0.321	29%	0.288	S	S	.	.			trans	-67.6	117.8	170.1	-179.5	-4	0	0	0	109.9	V538 L539 V540	D536-V538 PolarHBondContact O-N 3.39Å; D536-V538 WeakPolarHBondContact OD1-CB 3.44Å; D536-V538 PolarHBondContact OD1-N 3.49Å; D536-L539 HydrophobicContact CB-CB 4.05Å; D536-L539 PolarHBondContact O-N 3.49Å; D536-V540 WeakPolarHBondContact O-CG2 3.37Å; D536-V540 PolarHBondContact O-N 2.96Å
537	P	76.7	Confident	80.8	Confident	36 Å²	36	60.8 Å²	60.8	23%	0.234	29%	0.287	C	S	.	.	H	α-helix	trans	-58.1	-29.3	179.2	-22.2	32.9	0	0	0	114.1	M524 A535 R541	M524-P537 HydrophobicContact CE-CB 4.12Å; A535-P537 VanDerWaalsContact O-CD 3.32Å; A535-P537 WeakPolarHBondContact O-CD 3.46Å; P537-R541 VanDerWaalsContact O-CB 3.26Å; P537-R541 WeakPolarHBondContact O-CB 3.49Å; P537-R541 PolarHBondContact O-N 3.34Å; P537-R541 VanDerWaalsContact O-N 3.07Å
538	V	81.7	Confident	80.5	Confident	110 Å²	110	61 Å²	61	67%	0.667	29%	0.287	S	S	*	.	H	α-helix	trans	-71.3	-48.1	179.9	-178.1	0	0	0	0	109.9	D536 R541 K542	D536-V538 PolarHBondContact O-N 3.39Å; D536-V538 WeakPolarHBondContact OD1-CB 3.44Å; D536-V538 PolarHBondContact OD1-N 3.49Å; V538-R541 PolarHBondContact O-N 2.96Å; V538-K542 PolarHBondContact O-N 3.01Å; V538-K542 VanDerWaalsContact O-N 3.11Å
539	L	81.3	Confident	79.9	Confident	61 Å²	61	63.3 Å²	63.3	32%	0.319	31%	0.312	S	S	.	.	H	α-helix	trans	-65	-45.4	178.3	-170.8	63.9	0	0	0	111.5	L494 D536 R541 K542 I543	L494-L539 HydrophobicContact CD2-CB 4.41Å; L494-L539 HydrophobicContact CD2-CD2 3.87Å; L494-L539 HydrophobicContact CD2-CG 4Å; D536-L539 HydrophobicContact CB-CB 4.05Å; D536-L539 PolarHBondContact O-N 3.49Å; L539-R541 VanDerWaalsContact C-N 3.32Å; L539-R541 PolarHBondContact O-N 2.91Å; L539-K542 WeakPolarHBondContact O-CB 3.31Å; L539-K542 PolarHBondContact O-N 3.09Å; L539-I543 HydrophobicContact CD1-CD1 4.39Å; L539-I543 HydrophobicContact CG-CD1 3.99Å; L539-I543 WeakPolarHBondContact O-CG1 3.4Å; L539-I543 PolarHBondContact O-N 3.33Å
540	V	84.4	Confident	79.7	Confident	3 Å²	3	58 Å²	58	2%	0.018	29%	0.29	C	S	.	.	H	α-helix	trans	-58.7	-43.4	176.1	170.8	0	0	0	0	111.5	L494 V527 A535 D536 K542 I543 L544	L494-V540 HydrophobicContact CD2-CG2 3.64Å; L494-V540 HydrophobicContact CG-CG2 4.38Å; V527-V540 HydrophobicContact CB-CG1 3.91Å; V527-V540 HydrophobicContact CG1-CG1 3.65Å; V527-V540 HydrophobicContact CG1-CG2 3.95Å; V527-V540 HydrophobicContact CG2-CG1 4.29Å; A535-V540 HydrophobicContact CB-CG2 3.53Å; D536-V540 WeakPolarHBondContact O-CG2 3.37Å; D536-V540 PolarHBondContact O-N 2.96Å; V540-K542 VanDerWaalsContact C-N 3.34Å; V540-K542 PolarHBondContact O-N 3.31Å; V540-I543 PolarHBondContact O-N 3.5Å; V540-L544 HydrophobicContact CG1-CD1 3.72Å; V540-L544 HydrophobicContact CG1-CG 4.23Å; V540-L544 WeakPolarHBondContact O-CB 3.21Å; V540-L544 VanDerWaalsContact O-CG 3.32Å; V540-L544 WeakPolarHBondContact O-CG 3.3Å; V540-L544 PolarHBondContact O-N 3.41Å
541	R	86.3	Confident	79.6	Confident	99 Å²	99	55.8 Å²	55.8	37%	0.374	28%	0.281	S	S	.	.	H	α-helix	trans	-61	-44.5	177.8	177.5	177.4	-70.4	-125	-9.3	111.2	L520 N521 M524 P537 V538 L539 L544 Q545	L520-R541 HydrophobicContact CD2-CG 4.35Å; N521-R541 PolarHBondContact OD1-NH2 2.85Å; M524-R541 HydrophobicContact CE-CB 4.27Å; M524-R541 HydrophobicContact SD-CB 4.02Å; M524-R541 HydrophobicContact SD-CG 4.3Å; M524-R541 PolarHBondContact SD-NH2 3.34Å; M524-R541 VanDerWaalsContact SD-NH2 3.38Å; P537-R541 VanDerWaalsContact O-CB 3.26Å; P537-R541 WeakPolarHBondContact O-CB 3.49Å; P537-R541 PolarHBondContact O-N 3.34Å; P537-R541 VanDerWaalsContact O-N 3.07Å; V538-R541 PolarHBondContact O-N 2.96Å; L539-R541 VanDerWaalsContact C-N 3.32Å; L539-R541 PolarHBondContact O-N 2.91Å; R541-L544 PolarHBondContact O-N 3.23Å; R541-Q545 HydrophobicContact CG-CG 4.48Å; R541-Q545 WeakPolarHBondContact O-CB 3.26Å; R541-Q545 VanDerWaalsContact O-CG 3.29Å; R541-Q545 WeakPolarHBondContact O-CG 3.44Å; R541-Q545 PolarHBondContact O-N 3.25Å
542	K	85.8	Confident	79.6	Confident	120 Å²	120	58.5 Å²	58.5	52%	0.522	29%	0.294	S	S	.	.	H	α-helix	trans	-61.2	-49.7	178.6	-171.9	-176	174.2	-167.7	0	111.3	V538 L539 V540 L544 Q545 E546	V538-K542 PolarHBondContact O-N 3.01Å; V538-K542 VanDerWaalsContact O-N 3.11Å; L539-K542 WeakPolarHBondContact O-CB 3.31Å; L539-K542 PolarHBondContact O-N 3.09Å; V540-K542 VanDerWaalsContact C-N 3.34Å; V540-K542 PolarHBondContact O-N 3.31Å; K542-L544 PolarHBondContact O-N 3.24Å; K542-Q545 PolarHBondContact O-N 3.43Å; K542-E546 VanDerWaalsContact CE-OE1 3.28Å; K542-E546 WeakPolarHBondContact CE-OE1 3.37Å; K542-E546 WeakPolarHBondContact O-CG 3.16Å; K542-E546 PolarHBondContact O-N 3.29Å
543	I	84.8	Confident	80	Confident	3 Å²	3	52.9 Å²	52.9	2%	0.015	27%	0.272	C	S	.	.	H	α-helix	trans	-63	-42.6	179.7	-65.4	168.9	0	0	0	111.5	L494 C498 L539 V540 E546 K547	L494-I543 HydrophobicContact CB-CD1 4.3Å; L494-I543 HydrophobicContact CD2-CD1 3.8Å; C498-I543 HydrophobicContact CB-CG2 3.72Å; L539-I543 HydrophobicContact CD1-CD1 4.39Å; L539-I543 HydrophobicContact CG-CD1 3.99Å; L539-I543 WeakPolarHBondContact O-CG1 3.4Å; L539-I543 PolarHBondContact O-N 3.33Å; V540-I543 PolarHBondContact O-N 3.5Å; I543-E546 PolarHBondContact O-N 3.44Å; I543-K547 HydrophobicContact CG2-CD 4.2Å; I543-K547 WeakPolarHBondContact O-CB 3.08Å; I543-K547 WeakPolarHBondContact O-CG 2.8Å; I543-K547 PolarHBondContact O-N 3.24Å
544	L	85.2	Confident	80.4	Confident	0 Å²	0	55.9 Å²	55.9	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-65.7	-40.4	176.6	-74.8	174.2	0	0	0	111.5	C498 V502 L520 L523 M524 V527 V540 R541 K542 K547 T548	C498-L544 HydrophobicContact CB-CD2 4.13Å; V502-L544 HydrophobicContact CG2-CD2 3.9Å; L520-L544 HydrophobicContact CD1-CB 3.89Å; L523-L544 HydrophobicContact CB-CD1 4.17Å; M524-L544 HydrophobicContact CG-CD1 3.91Å; V527-L544 HydrophobicContact CG2-CD1 4.08Å; V527-L544 HydrophobicContact CG2-CD2 4.24Å; V540-L544 HydrophobicContact CG1-CD1 3.72Å; V540-L544 HydrophobicContact CG1-CG 4.23Å; V540-L544 WeakPolarHBondContact O-CB 3.21Å; V540-L544 VanDerWaalsContact O-CG 3.32Å; V540-L544 WeakPolarHBondContact O-CG 3.3Å; V540-L544 PolarHBondContact O-N 3.41Å; R541-L544 PolarHBondContact O-N 3.23Å; K542-L544 PolarHBondContact O-N 3.24Å; L544-K547 PolarHBondContact O-N 3.01Å; L544-T548 VanDerWaalsContact O-CB 3.29Å; L544-T548 WeakPolarHBondContact O-CB 3.49Å; L544-T548 VanDerWaalsContact O-CG2 3.31Å; L544-T548 WeakPolarHBondContact O-CG2 3.17Å; L544-T548 PolarHBondContact O-N 3.49Å; L544-T548 PolarHBondContact O-OG1 2.79Å
545	Q	84.9	Confident	80.9	Confident	74 Å²	74	56.4 Å²	56.4	35%	0.346	29%	0.292	S	S	.	.	H	α-helix	trans	-60.7	-45.9	174.6	-78.7	175.5	-24.6	0	0	111.1	L520 R541 K542 K547 T548 S549	L520-Q545 HydrophobicContact CD2-CG 3.67Å; R541-Q545 HydrophobicContact CG-CG 4.48Å; R541-Q545 WeakPolarHBondContact O-CB 3.26Å; R541-Q545 VanDerWaalsContact O-CG 3.29Å; R541-Q545 WeakPolarHBondContact O-CG 3.44Å; R541-Q545 PolarHBondContact O-N 3.25Å; K542-Q545 PolarHBondContact O-N 3.43Å; Q545-K547 VanDerWaalsContact C-N 3.33Å; Q545-K547 PolarHBondContact O-N 2.91Å; Q545-T548 PolarHBondContact O-N 3.11Å; Q545-S549 WeakPolarHBondContact O-CB 3.36Å; Q545-S549 PolarHBondContact O-N 3.32Å; Q545-S549 PolarHBondContact O-OG 3.4Å
546	E	84.9	Confident	81.3	Confident	109 Å²	109	60.4 Å²	60.4	51%	0.509	31%	0.313	S	S	.	.	H	α-helix	trans	-60.6	-39.6	176.6	-72.2	171	-173.8	0	0	112.5	K542 I543	K542-E546 VanDerWaalsContact CE-OE1 3.28Å; K542-E546 WeakPolarHBondContact CE-OE1 3.37Å; K542-E546 WeakPolarHBondContact O-CG 3.16Å; K542-E546 PolarHBondContact O-N 3.29Å; I543-E546 PolarHBondContact O-N 3.44Å
547	K	81	Confident	81.7	Confident	51 Å²	51	60.5 Å²	60.5	22%	0.222	31%	0.312	C	S	.	.	H	α-helix	trans	-80.7	-20.3	-179.7	-70.8	-175.8	-178	-68.3	0	114.8	H495 C498 Q499 V502 I543 L544 Q545	H495-K547 WeakPolarHBondContact O-CE 3.39Å; C498-K547 HydrophobicContact CB-CD 4.35Å; Q499-K547 HydrophobicContact CB-CD 4.43Å; V502-K547 HydrophobicContact CG2-CB 4.28Å; I543-K547 HydrophobicContact CG2-CD 4.2Å; I543-K547 WeakPolarHBondContact O-CB 3.08Å; I543-K547 WeakPolarHBondContact O-CG 2.8Å; I543-K547 PolarHBondContact O-N 3.24Å; L544-K547 PolarHBondContact O-N 3.01Å; Q545-K547 VanDerWaalsContact C-N 3.33Å; Q545-K547 PolarHBondContact O-N 2.91Å
548	T	77.8	Confident	82.1	Confident	3 Å²	3	62.5 Å²	62.5	2%	0.018	32%	0.319	C	S	.	.	H	α-helix	trans	-110.1	-5.3	-176.8	60.9	0	0	0	0	113.9	V502 V509 R513 L523 L544 Q545	V502-T548 HydrophobicContact CG2-CG2 4Å; V509-T548 HydrophobicContact CG1-CG2 4.17Å; V509-T548 HydrophobicContact CG2-CG2 4.16Å; R513-T548 WeakPolarHBondContact CG-O 3.34Å; L523-T548 HydrophobicContact CD1-CG2 4.19Å; L544-T548 VanDerWaalsContact O-CB 3.29Å; L544-T548 WeakPolarHBondContact O-CB 3.49Å; L544-T548 VanDerWaalsContact O-CG2 3.31Å; L544-T548 WeakPolarHBondContact O-CG2 3.17Å; L544-T548 PolarHBondContact O-N 3.49Å; L544-T548 PolarHBondContact O-OG1 2.79Å; Q545-T548 PolarHBondContact O-N 3.11Å
549	S	67.1	Low	82.1	Confident	117 Å²	117	58.2 Å²	58.2	82%	0.818	29%	0.287	S	S	*	.			trans	-57.7	0	156.6	-56.9	0	0	0	0	109.8	R513 Q545	R513-S549 PolarHBondContact NE-OXT 3.12Å; R513-S549 PolarHBondContact NH2-OXT 3.25Å; Q545-S549 WeakPolarHBondContact O-CB 3.36Å; Q545-S549 PolarHBondContact O-N 3.32Å; Q545-S549 PolarHBondContact O-OG 3.4Å

Retrieved 549 of 549 residues in 455.2 ms (Link to these results)

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