A0A077ZJA4_TRITR Loading...

His Phos 1 domain containing protein

AlphaFold DB , UniProt , Accession A0A077ZJA4, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 358 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	43.7	Very low	41.5	Very low	242 Å²	242	144.4 Å²	144.4	100%	1.192	83%	0.832	S	S	*	*				0	119.7	0	-67.9	164.8	179.6	0	0	106.4
2	S	40.3	Very low	41.1	Very low	101 Å²	101	142.2 Å²	142.2	71%	0.706	83%	0.832	S	S	*	*				66.8	121.9	78.4	-178.2	0	0	0	0	111.9
3	K	40.1	Very low	41.1	Very low	197 Å²	197	138.5 Å²	138.5	86%	0.857	83%	0.828	S	S	*	*			cis	-156.1	159.1	1.3	-110.6	166.7	-170.3	174.7	0	110
4	N	44.4	Very low	40.4	Very low	146 Å²	146	139.8 Å²	139.8	78%	0.781	83%	0.828	S	S	*	*			trans	-85.7	154.8	168.8	-157.8	-15.8	0	0	0	109.5
5	P	52.1	Low	40	Very low	108 Å²	108	138.5 Å²	138.5	70%	0.701	83%	0.826	S	S	*	*				-155.5	152.8	100.3	39.4	-20.8	0	0	0	118.8
6	K	42.2	Very low	39.7	Very low	192 Å²	192	142.2 Å²	142.2	84%	0.835	83%	0.828	S	S	*	*			trans	25.8	139.3	130.6	-57.9	178.2	-178.6	179.3	0	119
7	S	43.5	Very low	39.1	Very low	108 Å²	108	141 Å²	141	76%	0.755	83%	0.829	S	S	*	*			cis	-171	-159.6	3.9	47.3	0	0	0	0	108.5
8	K	41.8	Very low	38.7	Very low	190 Å²	190	142.6 Å²	142.6	83%	0.826	83%	0.832	S	S	*	*			cis	-164.8	142.5	17.3	-162.1	-169.7	176.4	-173.4	0	112.6
9	A	38.3	Very low	38.4	Very low	99 Å²	99	140.8 Å²	140.8	82%	0.818	83%	0.829	S	S	*	*			trans	36.4	125.3	152.2	0	0	0	0	0	123.1
10	G	36.4	Very low	38	Very low	75 Å²	75	143.7 Å²	143.7	77%	0.773	83%	0.833	S	S	*	*			trans	-156.9	131.3	159.4	0	0	0	0	0	110.8
11	S	33.3	Very low	37.7	Very low	130 Å²	130	145.8 Å²	145.8	91%	0.909	83%	0.833	S	S	*	*			trans	-52.3	141.7	-169.4	-172.1	0	0	0	0	116.5
12	S	36.7	Very low	37	Very low	118 Å²	118	139.7 Å²	139.7	83%	0.825	81%	0.814	S	S	*	*			trans	-146.3	153.6	156.2	65.5	0	0	0	0	110.8
13	A	41.3	Very low	36.6	Very low	95 Å²	95	142 Å²	142	79%	0.785	82%	0.819	S	S	*	*			trans	-106.7	151.5	-172.1	0	0	0	0	0	113.2
14	N	31.3	Very low	36.3	Very low	156 Å²	156	139.2 Å²	139.2	83%	0.834	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-65.2	136.9	178.9	-76	-34.2	0	0	0	113.5
15	P	34.6	Very low	35.7	Very low	121 Å²	121	137.5 Å²	137.5	79%	0.786	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-89.6	134.7	138.1	32.7	-26.9	0	0	0	110.1
16	K	35.9	Very low	34.9	Very low	197 Å²	197	137.7 Å²	137.7	86%	0.857	82%	0.821	S	S	*	*	P	Polyproline II helix	trans	-77	156.8	173	-75	-179	177.5	176.9	0	111
17	S	29.2	Very low	34.5	Very low	122 Å²	122	133.6 Å²	133.6	85%	0.853	82%	0.823	S	S	*	*	P	Polyproline II helix	trans	-62.5	141.2	174.6	44.7	0	0	0	0	112.5
18	L	31.3	Very low	34.1	Very low	169 Å²	169	131 Å²	131	89%	0.885	81%	0.813	S	S	*	*			trans	-123.7	107.8	170	-97	162.3	0	0	0	108.5
19	S	33.2	Very low	33.7	Very low	110 Å²	110	125.3 Å²	125.3	77%	0.769	81%	0.808	S	S	*	*			trans	-76.6	122.2	174.3	41	0	0	0	0	110.1	K21	S19-K21 PolarHBondContact O-N 3.27Å
20	Q	30.3	Very low	33.5	Very low	197 Å²	197	123.1 Å²	123.1	92%	0.921	80%	0.795	S	S	*	*			trans	-70.1	99	177.5	-72.9	-179.9	-37.3	0	0	110.8
21	K	31.9	Very low	34	Very low	188 Å²	188	125.4 Å²	125.4	82%	0.817	79%	0.79	S	S	*	*			trans	-88	114.9	155.3	-78.3	-171	174.3	-175.7	0	108.8	S19 N23	S19-K21 PolarHBondContact O-N 3.27Å; K21-N23 PolarHBondContact O-N 2.9Å
22	S	29.3	Very low	34.6	Very low	114 Å²	114	122.2 Å²	122.2	80%	0.797	77%	0.771	S	S	*	*			trans	-74.4	90.5	175.5	53.8	0	0	0	0	110.8	V24	S22-V24 PolarHBondContact O-N 3.22Å
23	N	31.2	Very low	34.9	Very low	151 Å²	151	120 Å²	120	81%	0.807	76%	0.76	S	S	*	*			trans	-70.8	111.7	166.1	-83.1	0	0	0	0	109.1	K21 S25	K21-N23 PolarHBondContact O-N 2.9Å; N23-S25 PolarHBondContact O-N 3.11Å
24	V	33.3	Very low	35.4	Very low	137 Å²	137	119.2 Å²	119.2	83%	0.83	75%	0.749	S	S	*	*			trans	-73.1	104.9	167.5	179.2	0	0	0	0	107.7	S22 S26	S22-V24 PolarHBondContact O-N 3.22Å; V24-S26 PolarHBondContact O-N 2.81Å
25	S	33.5	Very low	36.6	Very low	110 Å²	110	114.7 Å²	114.7	77%	0.769	73%	0.725	S	S	*	*			trans	-69.3	116.2	173.8	53.8	0	0	0	0	110.3	N23 A27	N23-S25 PolarHBondContact O-N 3.11Å; S25-A27 PolarHBondContact O-N 2.95Å
26	S	34.8	Very low	37.6	Very low	113 Å²	113	112.3 Å²	112.3	79%	0.79	71%	0.711	S	S	*	*			trans	-67.8	124.3	171.5	39.3	0	0	0	0	110.8	V24 G28	V24-S26 PolarHBondContact O-N 2.81Å; S26-G28 PolarHBondContact O-N 3.28Å
27	A	33.9	Very low	38.6	Very low	106 Å²	106	106.3 Å²	106.3	88%	0.876	70%	0.697	S	S	*	*			trans	-70.7	107.2	164.1	0	0	0	0	0	108	S25	S25-A27 PolarHBondContact O-N 2.95Å
28	G	33.8	Very low	39.8	Very low	52 Å²	52	102.4 Å²	102.4	54%	0.536	67%	0.666	S	S	.	*			trans	-154.3	17	-174	0	0	0	0	0	115.3	S26	S26-G28 PolarHBondContact O-N 3.28Å
29	G	34.2	Very low	40.9	Very low	71 Å²	71	96.3 Å²	96.3	73%	0.732	64%	0.636	S	S	*	*	S	Bend	trans	-89.8	-35.6	-178.3	0	0	0	0	0	114.9
30	G	34.9	Very low	42.1	Very low	53 Å²	53	95.1 Å²	95.1	55%	0.546	62%	0.621	S	S	.	*	S	Bend	trans	-78.5	-49.7	-175	0	0	0	0	0	113.4	A32 A33	G30-A32 PolarHBondContact O-N 3.32Å; G30-A32 VanDerWaalsContact O-N 3.13Å; G30-A33 PolarHBondContact O-N 2.89Å
31	D	46.3	Very low	43.2	Very low	123 Å²	123	89.6 Å²	89.6	66%	0.658	60%	0.603	S	S	*	*	H	α-helix	trans	-55.4	-36.8	-171.8	-56.8	2.9	0	0	0	113.1	A33 S34 L35	D31-A33 VanDerWaalsContact C-N 3.31Å; D31-A33 PolarHBondContact O-N 3.21Å; D31-S34 PolarHBondContact O-N 3.15Å; D31-L35 VanDerWaalsContact O-CB 3.24Å; D31-L35 WeakPolarHBondContact O-CB 3.32Å; D31-L35 PolarHBondContact O-N 2.7Å
32	A	45.3	Very low	44.1	Very low	63 Å²	63	84.9 Å²	84.9	52%	0.521	60%	0.598	S	S	.	*	H	α-helix	trans	-59.8	-36.1	-174.2	0	0	0	0	0	113.6	G30 S36	G30-A32 PolarHBondContact O-N 3.32Å; G30-A32 VanDerWaalsContact O-N 3.13Å; A32-S36 VanDerWaalsContact O-CB 3.28Å; A32-S36 WeakPolarHBondContact O-CB 3.39Å; A32-S36 PolarHBondContact O-N 3.17Å
33	A	43	Very low	45	Very low	71 Å²	71	82.4 Å²	82.4	59%	0.587	59%	0.591	S	S	*	*	H	α-helix	trans	-72.3	-46.3	179.2	0	0	0	0	0	111.6	G30 D31 S36 A37	G30-A33 PolarHBondContact O-N 2.89Å; D31-A33 VanDerWaalsContact C-N 3.31Å; D31-A33 PolarHBondContact O-N 3.21Å; A33-S36 WeakPolarHBondContact O-CB 3.24Å; A33-S36 PolarHBondContact O-N 2.82Å; A33-A37 PolarHBondContact O-N 2.8Å; A33-A37 VanDerWaalsContact O-N 3.11Å
34	S	52.9	Low	45.9	Very low	79 Å²	79	83.1 Å²	83.1	55%	0.552	58%	0.583	S	S	*	*	H	α-helix	trans	-63.5	-42.1	175.9	-56.9	0	0	0	0	111.7	D31 S36 A37 M38	D31-S34 PolarHBondContact O-N 3.15Å; S34-S36 VanDerWaalsContact C-N 3.32Å; S34-S36 PolarHBondContact O-N 3.12Å; S34-A37 PolarHBondContact O-N 2.96Å; S34-M38 WeakPolarHBondContact O-CB 3.2Å; S34-M38 WeakPolarHBondContact O-CG 3.39Å; S34-M38 PolarHBondContact O-N 3.09Å
35	L	55.2	Low	46.7	Very low	62 Å²	62	81 Å²	81	33%	0.325	58%	0.575	S	S	.	*	H	α-helix	trans	-65.7	-35.6	177.1	-154.3	77.3	0	0	0	111.5	D31 M38 T39 M161	D31-L35 VanDerWaalsContact O-CB 3.24Å; D31-L35 WeakPolarHBondContact O-CB 3.32Å; D31-L35 PolarHBondContact O-N 2.7Å; L35-M38 CarbonylContact O-C 3.59Å; L35-M38 PolarHBondContact O-N 2.78Å; L35-T39 WeakPolarHBondContact O-CB 3.4Å; L35-T39 WeakPolarHBondContact O-CG2 3.46Å; L35-T39 PolarHBondContact O-N 3Å; L35-T39 PolarHBondContact O-OG1 3.4Å; L35-M161 HydrophobicContact CD1-CE 3.78Å; L35-M161 HydrophobicContact CD1-SD 4.06Å
36	S	55.5	Low	47.5	Very low	71 Å²	71	81.2 Å²	81.2	50%	0.497	57%	0.571	S	S	.	*	H	α-helix	trans	-61	-52.2	172.8	-173.1	0	0	0	0	111.6	A32 A33 S34 M38 T39 D40	A32-S36 VanDerWaalsContact O-CB 3.28Å; A32-S36 WeakPolarHBondContact O-CB 3.39Å; A32-S36 PolarHBondContact O-N 3.17Å; A33-S36 WeakPolarHBondContact O-CB 3.24Å; A33-S36 PolarHBondContact O-N 2.82Å; S34-S36 VanDerWaalsContact C-N 3.32Å; S34-S36 PolarHBondContact O-N 3.12Å; S36-M38 PolarHBondContact O-N 3.18Å; S36-T39 PolarHBondContact O-N 2.78Å; S36-T39 PolarHBondContact O-OG1 3.07Å; S36-D40 PolarHBondContact O-N 3.36Å
37	A	56.6	Low	48.3	Very low	70 Å²	70	81.2 Å²	81.2	58%	0.579	56%	0.56	S	S	*	*	H	α-helix	trans	-61.5	-30.3	175.9	0	0	0	0	0	113.3	A33 S34 T39 R165	A33-A37 PolarHBondContact O-N 2.8Å; A33-A37 VanDerWaalsContact O-N 3.11Å; S34-A37 PolarHBondContact O-N 2.96Å; A37-T39 VanDerWaalsContact C-N 3.35Å; A37-R165 PolarHBondContact O-NH1 2.93Å; A37-R165 PolarHBondContact O-NH2 3.41Å
38	M	55.5	Low	49.2	Very low	41 Å²	41	79 Å²	79	20%	0.202	53%	0.529	C	S	.	.	H	α-helix	trans	-77.9	-10.5	172.6	-72.9	-166.6	75.3	0	0	114.7	S34 L35 S36 V158 M161 M162 R165	S34-M38 WeakPolarHBondContact O-CB 3.2Å; S34-M38 WeakPolarHBondContact O-CG 3.39Å; S34-M38 PolarHBondContact O-N 3.09Å; L35-M38 CarbonylContact O-C 3.59Å; L35-M38 PolarHBondContact O-N 2.78Å; S36-M38 PolarHBondContact O-N 3.18Å; M38-V158 HydrophobicContact CE-CG1 3.87Å; M38-M161 HydrophobicContact CE-CB 3.74Å; M38-M161 HydrophobicContact CE-SD 3.97Å; M38-M161 HydrophobicContact SD-SD 3.95Å; M38-M162 HydrophobicContact CE-CG 4.05Å; M38-R165 WeakPolarHBondContact O-CD 3.43Å; M38-R165 VanDerWaalsContact O-CZ 3.25Å; M38-R165 PolarHBondContact O-NE 3.01Å; M38-R165 PolarHBondContact O-NH1 3.21Å
39	T	55.1	Low	50	Low	41 Å²	41	80 Å²	80	25%	0.252	53%	0.528	S	S	.	.	H	α-helix	trans	-119.3	-14.5	-176.1	51.4	0	0	0	0	115.4	L35 S36 A37 P41 T195	L35-T39 WeakPolarHBondContact O-CB 3.4Å; L35-T39 WeakPolarHBondContact O-CG2 3.46Å; L35-T39 PolarHBondContact O-N 3Å; L35-T39 PolarHBondContact O-OG1 3.4Å; S36-T39 PolarHBondContact O-N 2.78Å; S36-T39 PolarHBondContact O-OG1 3.07Å; A37-T39 VanDerWaalsContact C-N 3.35Å; T39-P41 WeakPolarHBondContact O-CD 3.25Å; T39-T195 HydrophobicContact CG2-CG2 3.98Å
40	D	57.3	Low	50.7	Low	85 Å²	85	80.4 Å²	80.4	46%	0.455	52%	0.524	S	S	.	.			trans	-61.7	122.1	173.2	-175.9	-4.2	0	0	0	112	S36 A42 R165	S36-D40 PolarHBondContact O-N 3.36Å; D40-A42 WeakPolarHBondContact OD1-CB 3.47Å; D40-A42 PolarHBondContact OD1-N 3.42Å; D40-R165 PolarHBondContact O-NH2 3.18Å
41	P	53.6	Low	51.4	Low	81 Å²	81	79.6 Å²	79.6	53%	0.526	51%	0.513	S	S	.	.	S	Bend	trans	-70.3	-22.7	176.2	-20.1	34.4	0	0	0	115.5	T39 G43	T39-P41 WeakPolarHBondContact O-CD 3.25Å; P41-G43 VanDerWaalsContact C-N 3.34Å; P41-G43 PolarHBondContact O-N 2.82Å
42	A	50.5	Low	51.2	Low	88 Å²	88	80 Å²	80	73%	0.727	51%	0.511	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.7	-19.1	-160.7	0	0	0	0	0	115.6	D40	D40-A42 WeakPolarHBondContact OD1-CB 3.47Å; D40-A42 PolarHBondContact OD1-N 3.42Å
43	G	48.3	Very low	51.2	Low	62 Å²	62	83 Å²	83	64%	0.639	53%	0.527	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.5	1.4	-167.7	0	0	0	0	0	117.7	P41	P41-G43 VanDerWaalsContact C-N 3.34Å; P41-G43 PolarHBondContact O-N 2.82Å
44	Y	49.7	Very low	51	Low	166 Å²	166	86.1 Å²	86.1	65%	0.651	53%	0.53	S	S	*	.			trans	-131.7	141	-167.4	-76.8	-93.1	0	0	0	114.8
45	S	50.5	Low	50.3	Low	93 Å²	93	88.5 Å²	88.5	65%	0.65	53%	0.528	S	S	*	.			trans	-79.6	147.3	171.7	-176.6	0	0	0	0	111.5	M47	S45-M47 PolarHBondContact O-N 3.43Å; S45-M47 WeakPolarHBondContact OG-CG 3.2Å; S45-M47 PolarHBondContact OG-N 2.85Å
46	V	50.5	Low	49.8	Very low	114 Å²	114	93.4 Å²	93.4	69%	0.691	54%	0.543	S	S	*	.			trans	-88.2	12.6	177.4	-152.1	0	0	0	0	112.3
47	M	51.5	Low	49.4	Very low	113 Å²	113	96.1 Å²	96.1	56%	0.557	56%	0.557	S	S	*	*	P	Polyproline II helix	trans	-74.1	129.1	176.2	-67	-68.5	-75.4	0	0	110.5	S45 M79	S45-M47 PolarHBondContact O-N 3.43Å; S45-M47 WeakPolarHBondContact OG-CG 3.2Å; S45-M47 PolarHBondContact OG-N 2.85Å; M47-M79 HydrophobicContact CB-CE 4.33Å; M47-M79 HydrophobicContact CE-CB 4.07Å; M47-M79 HydrophobicContact CE-CE 4.35Å
48	Y	52	Low	48.8	Very low	60 Å²	60	95.4 Å²	95.4	24%	0.235	56%	0.556	C	S	.	*	P	Polyproline II helix	trans	-75.5	140.1	179	-77.5	-113.4	0	0	0	110.4	M79 I84 N337 P340	Y48-M79 WeakPolarHBondContact O-CE 3.44Å; Y48-I84 HydrophobicContact CG-CD1 4.49Å; Y48-N337 HydrophobicContact CD1-CB 4.24Å; Y48-N337 HydrophobicContact CE1-CB 3.79Å; Y48-N337 PolarHBondContact OH-O 3.32Å; Y48-N337 VanDerWaalsContact OH-O 3.09Å; Y48-P340 HydrophobicContact CD1-CB 4Å; Y48-P340 HydrophobicContact CE1-CB 3.8Å
49	S	50.8	Low	48.5	Very low	73 Å²	73	99.3 Å²	99.3	51%	0.51	59%	0.587	S	S	.	*	P	Polyproline II helix	trans	-66.7	139.2	174.4	-176.9	0	0	0	0	111.1	A51	S49-A51 VanDerWaalsContact C-N 3.29Å; S49-A51 WeakPolarHBondContact OG-CB 3.31Å; S49-A51 PolarHBondContact OG-N 2.94Å
50	A	49.3	Very low	48.4	Very low	79 Å²	79	100.4 Å²	100.4	65%	0.653	59%	0.594	S	S	*	*			trans	-88.8	11.6	172.8	0	0	0	0	0	113.1	E52	A50-E52 PolarHBondContact O-N 2.93Å; A50-E52 VanDerWaalsContact O-N 3.14Å
51	A	50.2	Low	48.3	Very low	36 Å²	36	103.6 Å²	103.6	30%	0.298	61%	0.611	S	S	.	*			trans	-67.1	108.3	173.1	0	0	0	0	0	110.1	S49 T343	S49-A51 VanDerWaalsContact C-N 3.29Å; S49-A51 WeakPolarHBondContact OG-CB 3.31Å; S49-A51 PolarHBondContact OG-N 2.94Å; A51-T343 HydrophobicContact CB-CG2 4.2Å
52	E	42.7	Very low	48.9	Very low	133 Å²	133	106 Å²	106	62%	0.621	62%	0.615	S	S	*	*			trans	-62.4	159.1	178.7	-64.8	-170.3	-178.8	0	0	112.4	A50 Q54	A50-E52 PolarHBondContact O-N 2.93Å; A50-E52 VanDerWaalsContact O-N 3.14Å; E52-Q54 PolarHBondContact O-N 2.81Å; E52-Q54 PolarHBondContact OE2-NE2 2.88Å
53	S	43.5	Very low	49.7	Very low	124 Å²	124	106.1 Å²	106.1	87%	0.867	62%	0.616	S	S	*	*	S	Bend	trans	-70.7	5.8	177	53.7	0	0	0	0	114.6
54	Q	39.1	Very low	50.6	Low	137 Å²	137	106.3 Å²	106.3	64%	0.64	62%	0.618	S	S	*	*	S	Bend	trans	-79.9	119.5	175.5	-58.5	-167.3	56.1	0	0	109.5	E52 Y56	E52-Q54 PolarHBondContact O-N 2.81Å; E52-Q54 PolarHBondContact OE2-NE2 2.88Å; Q54-Y56 PolarHBondContact O-N 3Å
55	Y	39.2	Very low	51.8	Low	129 Å²	129	104.5 Å²	104.5	51%	0.506	63%	0.627	S	S	.	*			trans	-50.1	123.2	-179.6	-70.7	-94.9	0	0	0	112.2	T57 R314	Y55-T57 PolarHBondContact O-N 3.37Å; Y55-T57 PolarHBondContact O-OG1 3.07Å; Y55-R314 HydrophobicContact CE2-CB 4.5Å; Y55-R314 WeakPolarHBondContact OH-CA 3.12Å
56	Y	44.2	Very low	52.8	Low	165 Å²	165	105.4 Å²	105.4	65%	0.647	63%	0.633	S	S	*	*			trans	-72.9	70.7	169.7	-97.3	-94.2	0	0	0	110.6	Q54 V60 L345	Q54-Y56 PolarHBondContact O-N 3Å; Y56-V60 HydrophobicContact CD1-CG2 3.9Å; Y56-L345 HydrophobicContact CG-CD2 4.44Å
57	T	46.5	Very low	53.9	Low	129 Å²	129	104.3 Å²	104.3	79%	0.791	62%	0.622	S	S	*	*			trans	-91.5	-5.3	175.4	45.1	0	0	0	0	113.6	Y55	Y55-T57 PolarHBondContact O-N 3.37Å; Y55-T57 PolarHBondContact O-OG1 3.07Å
58	G	45.3	Very low	55.1	Low	54 Å²	54	101.6 Å²	101.6	56%	0.557	62%	0.618	S	S	*	*	S	Bend	trans	-71.7	151.2	169.1	0	0	0	0	0	111.7	V60	G58-V60 PolarHBondContact O-N 3.21Å
59	S	47.9	Very low	56.4	Low	123 Å²	123	104.2 Å²	104.2	86%	0.86	63%	0.633	S	S	*	*			trans	-61.6	95.4	174.8	-53.1	0	0	0	0	110.9	N61	S59-N61 PolarHBondContact O-N 2.85Å
60	V	54.2	Low	57.8	Low	64 Å²	64	105.7 Å²	105.7	39%	0.388	64%	0.635	S	S	.	*			trans	-69	116.1	176.7	-173.9	0	0	0	0	108.5	Y56 G58 Q62 L345	Y56-V60 HydrophobicContact CD1-CG2 3.9Å; G58-V60 PolarHBondContact O-N 3.21Å; V60-Q62 HydrophobicContact CB-CG 4.36Å; V60-Q62 HydrophobicContact CG1-CG 4.11Å; V60-Q62 PolarHBondContact O-N 3.45Å; V60-L345 HydrophobicContact CB-CD1 4.47Å; V60-L345 HydrophobicContact CG2-CD1 4.19Å; V60-L345 HydrophobicContact CG2-CD2 4.42Å
61	N	55	Low	59.1	Low	152 Å²	152	105.6 Å²	105.6	81%	0.813	62%	0.623	S	S	*	*			trans	-69.2	82.6	169.9	-75.5	-21.4	0	0	0	109.4	S59 A63	S59-N61 PolarHBondContact O-N 2.85Å; N61-A63 PolarHBondContact O-N 2.89Å
62	Q	66.3	Low	60.4	Low	132 Å²	132	107.9 Å²	107.9	62%	0.617	63%	0.627	S	S	*	*			trans	-69.4	-12.1	175.5	-64.5	-178.1	-0.7	0	0	112.7	V60	V60-Q62 HydrophobicContact CB-CG 4.36Å; V60-Q62 HydrophobicContact CG1-CG 4.11Å; V60-Q62 PolarHBondContact O-N 3.45Å
63	A	66	Low	62.1	Low	91 Å²	91	105.6 Å²	105.6	75%	0.752	62%	0.619	S	S	*	*	S	Bend	trans	-103.8	126.1	173.2	0	0	0	0	0	110.6	N61	N61-A63 PolarHBondContact O-N 2.89Å
64	G	68.2	Low	63.6	Low	66 Å²	66	104.5 Å²	104.5	68%	0.68	60%	0.601	S	S	*	*	S	Bend	trans	159.3	177.5	-179.3	0	0	0	0	0	110.7
65	P	74.2	Confident	65.3	Low	128 Å²	128	101.1 Å²	101.1	83%	0.831	59%	0.586	S	S	*	*	P	Polyproline II helix	trans	-65.1	164.8	161.4	32.1	-35.4	0	0	0	110.4
66	S	71.6	Confident	67	Low	111 Å²	111	99.2 Å²	99.2	78%	0.776	59%	0.588	S	S	*	*	P	Polyproline II helix	trans	-52.7	163.1	163.8	-55.5	0	0	0	0	111.6	A68	S66-A68 PolarHBondContact O-N 2.72Å
67	I	74.3	Confident	68.5	Low	91 Å²	91	93.9 Å²	93.9	47%	0.467	57%	0.574	S	S	.	*	P	Polyproline II helix	trans	-49.4	137	168.8	54.3	168.9	0	0	0	110.4	L71 E72 I75	I67-L71 HydrophobicContact CB-CD2 4.26Å; I67-L71 HydrophobicContact CG2-CD2 4.18Å; I67-E72 HydrophobicContact CD1-CB 3.86Å; I67-E72 HydrophobicContact CD1-CG 4.27Å; I67-E72 HydrophobicContact CG1-CB 4.3Å; I67-I75 HydrophobicContact CD1-CD1 3.85Å
68	A	76.7	Confident	69.8	Low	57 Å²	57	94.4 Å²	94.4	47%	0.471	57%	0.566	S	S	.	*	P	Polyproline II helix	trans	-62.4	144.6	-179.2	0	0	0	0	0	110.6	S66 N70 L71 E72	S66-A68 PolarHBondContact O-N 2.72Å; A68-N70 VanDerWaalsContact CB-OD1 3.25Å; A68-N70 WeakPolarHBondContact CB-OD1 3.29Å; A68-N70 PolarHBondContact O-N 2.67Å; A68-N70 VanDerWaalsContact O-N 3.12Å; A68-L71 WeakPolarHBondContact O-CA 3.39Å; A68-L71 WeakPolarHBondContact O-CB 3.42Å; A68-L71 PolarHBondContact O-N 3.2Å; A68-E72 PolarHBondContact O-N 2.77Å
69	Q	79.1	Confident	70.7	Confident	115 Å²	115	94.3 Å²	94.3	54%	0.537	55%	0.552	S	S	.	*	H	α-helix	trans	-50.9	-43.2	-173.7	-168.4	64.6	64.8	0	0	112.5	L71 E72 D73	Q69-L71 PolarHBondContact O-N 2.99Å; Q69-E72 PolarHBondContact NE2-OE2 3.05Å; Q69-E72 WeakPolarHBondContact O-CB 3.45Å; Q69-E72 PolarHBondContact O-N 2.79Å; Q69-E72 VanDerWaalsContact O-N 3.07Å; Q69-D73 PolarHBondContact NE2-OD1 3.07Å; Q69-D73 WeakPolarHBondContact O-CB 3.36Å; Q69-D73 PolarHBondContact O-N 2.84Å
70	N	80.4	Confident	71.6	Confident	104 Å²	104	91.2 Å²	91.2	56%	0.556	53%	0.53	S	S	*	.	H	α-helix	trans	-62.9	-22.8	178.3	67.7	-29.8	0	0	0	114.5	A68 Q74	A68-N70 VanDerWaalsContact CB-OD1 3.25Å; A68-N70 WeakPolarHBondContact CB-OD1 3.29Å; A68-N70 PolarHBondContact O-N 2.67Å; A68-N70 VanDerWaalsContact O-N 3.12Å; N70-Q74 VanDerWaalsContact O-CG 3.24Å; N70-Q74 WeakPolarHBondContact O-CG 3.48Å; N70-Q74 PolarHBondContact O-NE2 3.14Å
71	L	77.2	Confident	71.8	Confident	76 Å²	76	95.2 Å²	95.2	40%	0.398	54%	0.544	S	S	.	.	H	α-helix	trans	-86.4	-37.5	171.9	179.1	59.9	0	0	0	111.2	I67 A68 Q69 Q74 I75	I67-L71 HydrophobicContact CB-CD2 4.26Å; I67-L71 HydrophobicContact CG2-CD2 4.18Å; A68-L71 WeakPolarHBondContact O-CA 3.39Å; A68-L71 WeakPolarHBondContact O-CB 3.42Å; A68-L71 PolarHBondContact O-N 3.2Å; Q69-L71 PolarHBondContact O-N 2.99Å; L71-Q74 PolarHBondContact O-N 3.22Å; L71-I75 HydrophobicContact CD1-CD1 4.3Å; L71-I75 HydrophobicContact CD1-CG1 4.49Å; L71-I75 HydrophobicContact CG-CD1 4.06Å; L71-I75 VanDerWaalsContact O-CG1 3.29Å; L71-I75 WeakPolarHBondContact O-CG1 3.31Å; L71-I75 PolarHBondContact O-N 3.06Å
72	E	75.9	Confident	71.9	Confident	84 Å²	84	91.4 Å²	91.4	39%	0.393	53%	0.534	S	S	.	.	H	α-helix	trans	-59.4	-49.1	171.2	-173.4	176.1	-146.5	0	0	111	I67 A68 Q69 Q74 I75 V76	I67-E72 HydrophobicContact CD1-CB 3.86Å; I67-E72 HydrophobicContact CD1-CG 4.27Å; I67-E72 HydrophobicContact CG1-CB 4.3Å; A68-E72 PolarHBondContact O-N 2.77Å; Q69-E72 PolarHBondContact NE2-OE2 3.05Å; Q69-E72 WeakPolarHBondContact O-CB 3.45Å; Q69-E72 PolarHBondContact O-N 2.79Å; Q69-E72 VanDerWaalsContact O-N 3.07Å; E72-Q74 VanDerWaalsContact C-N 3.27Å; E72-Q74 PolarHBondContact O-N 2.7Å; E72-I75 CarbonylContact O-C 3.59Å; E72-I75 WeakPolarHBondContact O-CA 3.41Å; E72-I75 WeakPolarHBondContact O-CB 3.39Å; E72-I75 PolarHBondContact O-N 3.24Å; E72-V76 HydrophobicContact CG-CG2 4.42Å; E72-V76 WeakPolarHBondContact O-CG2 3.48Å; E72-V76 PolarHBondContact O-N 3.26Å
73	D	78.5	Confident	71.1	Confident	86 Å²	86	92.8 Å²	92.8	46%	0.46	54%	0.538	S	S	.	.	H	α-helix	trans	-57.9	-38.8	176.7	-58	-18.3	0	0	0	111.7	Q69 S77	Q69-D73 PolarHBondContact NE2-OD1 3.07Å; Q69-D73 WeakPolarHBondContact O-CB 3.36Å; Q69-D73 PolarHBondContact O-N 2.84Å; D73-S77 WeakPolarHBondContact O-CB 3.48Å; D73-S77 PolarHBondContact O-N 2.83Å
74	Q	76.8	Confident	70.4	Confident	101 Å²	101	93.1 Å²	93.1	47%	0.472	53%	0.526	S	S	.	.	H	α-helix	trans	-67.5	-38.6	174.1	-80.4	173.8	66	0	0	112.6	N70 L71 E72 K78	N70-Q74 VanDerWaalsContact O-CG 3.24Å; N70-Q74 WeakPolarHBondContact O-CG 3.48Å; N70-Q74 PolarHBondContact O-NE2 3.14Å; L71-Q74 PolarHBondContact O-N 3.22Å; E72-Q74 VanDerWaalsContact C-N 3.27Å; E72-Q74 PolarHBondContact O-N 2.7Å; Q74-K78 WeakPolarHBondContact O-CB 3.45Å; Q74-K78 VanDerWaalsContact O-CG 3.32Å; Q74-K78 WeakPolarHBondContact O-CG 3.39Å; Q74-K78 PolarHBondContact O-N 3.24Å
75	I	73.8	Confident	69.1	Low	65 Å²	65	97.5 Å²	97.5	33%	0.333	53%	0.529	S	S	.	.	H	α-helix	trans	-68	-48	176.2	-71.1	163.2	0	0	0	109.9	I67 L71 E72 S77 K78 M79	I67-I75 HydrophobicContact CD1-CD1 3.85Å; L71-I75 HydrophobicContact CD1-CD1 4.3Å; L71-I75 HydrophobicContact CD1-CG1 4.49Å; L71-I75 HydrophobicContact CG-CD1 4.06Å; L71-I75 VanDerWaalsContact O-CG1 3.29Å; L71-I75 WeakPolarHBondContact O-CG1 3.31Å; L71-I75 PolarHBondContact O-N 3.06Å; E72-I75 CarbonylContact O-C 3.59Å; E72-I75 WeakPolarHBondContact O-CA 3.41Å; E72-I75 WeakPolarHBondContact O-CB 3.39Å; E72-I75 PolarHBondContact O-N 3.24Å; I75-S77 VanDerWaalsContact C-N 3.32Å; I75-S77 PolarHBondContact O-N 3.09Å; I75-K78 PolarHBondContact O-N 2.81Å; I75-M79 HydrophobicContact CG2-CG 4.35Å; I75-M79 HydrophobicContact CG2-SD 3.86Å; I75-M79 WeakPolarHBondContact O-CB 3.32Å; I75-M79 VanDerWaalsContact O-CG 3.31Å; I75-M79 WeakPolarHBondContact O-CG 3.37Å; I75-M79 PolarHBondContact O-N 3.44Å
76	V	75.2	Confident	67.8	Low	89 Å²	89	96.2 Å²	96.2	54%	0.539	52%	0.521	S	S	.	.	H	α-helix	trans	-58.6	-43.8	175.6	173	0	0	0	0	110.8	E72 M79 S80	E72-V76 HydrophobicContact CG-CG2 4.42Å; E72-V76 WeakPolarHBondContact O-CG2 3.48Å; E72-V76 PolarHBondContact O-N 3.26Å; V76-M79 PolarHBondContact O-N 2.92Å; V76-S80 WeakPolarHBondContact O-CB 3.31Å; V76-S80 PolarHBondContact O-N 2.94Å
77	S	74.3	Confident	66.8	Low	53 Å²	53	95.2 Å²	95.2	37%	0.371	51%	0.51	S	S	.	.	H	α-helix	trans	-59.8	-50.2	174.4	-175.3	0	0	0	0	111.8	D73 I75 M79 S80 Q81	D73-S77 WeakPolarHBondContact O-CB 3.48Å; D73-S77 PolarHBondContact O-N 2.83Å; I75-S77 VanDerWaalsContact C-N 3.32Å; I75-S77 PolarHBondContact O-N 3.09Å; S77-M79 PolarHBondContact O-N 2.59Å; S77-S80 PolarHBondContact O-N 3.22Å; S77-S80 VanDerWaalsContact O-N 3.15Å; S77-S80 PolarHBondContact O-OG 3.23Å; S77-Q81 WeakPolarHBondContact O-CG 3.24Å; S77-Q81 PolarHBondContact O-N 2.91Å; S77-Q81 VanDerWaalsContact O-N 3.11Å; S77-Q81 PolarHBondContact OG-NE2 3.44Å
78	K	73.8	Confident	65.4	Low	141 Å²	141	98.7 Å²	98.7	61%	0.613	52%	0.524	S	S	*	.	H	α-helix	trans	-58	-44.6	175	-76.6	174.8	178.9	179.3	0	112.5	Q74 I75 S80 Q81 A82	Q74-K78 WeakPolarHBondContact O-CB 3.45Å; Q74-K78 VanDerWaalsContact O-CG 3.32Å; Q74-K78 WeakPolarHBondContact O-CG 3.39Å; Q74-K78 PolarHBondContact O-N 3.24Å; I75-K78 PolarHBondContact O-N 2.81Å; K78-S80 VanDerWaalsContact C-N 3.31Å; K78-S80 PolarHBondContact O-N 3.31Å; K78-Q81 PolarHBondContact O-N 3.21Å; K78-A82 VanDerWaalsContact O-CB 3.31Å; K78-A82 WeakPolarHBondContact O-CB 3.43Å; K78-A82 PolarHBondContact O-N 3.43Å
79	M	65.4	Low	64.3	Low	52 Å²	52	101.4 Å²	101.4	26%	0.256	53%	0.531	S	S	.	.	H	α-helix	trans	-65.2	-33.3	177.4	-69.3	178.8	78.8	0	0	112.3	M47 Y48 I75 V76 S77 Q81	M47-M79 HydrophobicContact CB-CE 4.33Å; M47-M79 HydrophobicContact CE-CB 4.07Å; M47-M79 HydrophobicContact CE-CE 4.35Å; Y48-M79 WeakPolarHBondContact O-CE 3.44Å; I75-M79 HydrophobicContact CG2-CG 4.35Å; I75-M79 HydrophobicContact CG2-SD 3.86Å; I75-M79 WeakPolarHBondContact O-CB 3.32Å; I75-M79 VanDerWaalsContact O-CG 3.31Å; I75-M79 WeakPolarHBondContact O-CG 3.37Å; I75-M79 PolarHBondContact O-N 3.44Å; V76-M79 PolarHBondContact O-N 2.92Å; S77-M79 PolarHBondContact O-N 2.59Å; M79-Q81 VanDerWaalsContact C-N 3.32Å
80	S	65.7	Low	63.1	Low	58 Å²	58	105.5 Å²	105.5	41%	0.406	55%	0.547	S	S	.	.	H	α-helix	trans	-70.3	-27.9	175.6	82.1	0	0	0	0	113.5	V76 S77 K78 K83	V76-S80 WeakPolarHBondContact O-CB 3.31Å; V76-S80 PolarHBondContact O-N 2.94Å; S77-S80 PolarHBondContact O-N 3.22Å; S77-S80 VanDerWaalsContact O-N 3.15Å; S77-S80 PolarHBondContact O-OG 3.23Å; K78-S80 VanDerWaalsContact C-N 3.31Å; K78-S80 PolarHBondContact O-N 3.31Å; S80-K83 WeakPolarHBondContact O-CD 3.22Å; S80-K83 WeakPolarHBondContact O-CG 3.45Å
81	Q	60.2	Low	62.3	Low	148 Å²	148	102.2 Å²	102.2	69%	0.692	53%	0.534	S	S	*	.	H	α-helix	trans	-83	-38.3	174.6	-65.8	170.8	30.4	0	0	111.4	S77 K78 M79 K83	S77-Q81 WeakPolarHBondContact O-CG 3.24Å; S77-Q81 PolarHBondContact O-N 2.91Å; S77-Q81 VanDerWaalsContact O-N 3.11Å; S77-Q81 PolarHBondContact OG-NE2 3.44Å; K78-Q81 PolarHBondContact O-N 3.21Å; M79-Q81 VanDerWaalsContact C-N 3.32Å; Q81-K83 PolarHBondContact O-N 2.81Å
82	A	55.5	Low	62.6	Low	72 Å²	72	104.2 Å²	104.2	60%	0.595	55%	0.545	S	S	*	.			trans	-72.6	27.8	175.8	0	0	0	0	0	113.9	K78 I84	K78-A82 VanDerWaalsContact O-CB 3.31Å; K78-A82 WeakPolarHBondContact O-CB 3.43Å; K78-A82 PolarHBondContact O-N 3.43Å; A82-I84 PolarHBondContact O-N 3.32Å
83	K	50.5	Low	63.3	Low	160 Å²	160	103.5 Å²	103.5	70%	0.696	54%	0.544	S	S	*	.			trans	-60.4	104.5	170.3	-81.8	173.7	-177.9	174.7	0	109	S80 Q81 Q85	S80-K83 WeakPolarHBondContact O-CD 3.22Å; S80-K83 WeakPolarHBondContact O-CG 3.45Å; Q81-K83 PolarHBondContact O-N 2.81Å; K83-Q85 PolarHBondContact O-N 3.16Å
84	I	50.1	Low	63.9	Low	98 Å²	98	100.6 Å²	100.6	50%	0.503	53%	0.53	S	S	.	.			trans	-51.4	113.6	170.9	-61.2	163.6	0	0	0	107.1	Y48 A82 P86 N337	Y48-I84 HydrophobicContact CG-CD1 4.49Å; A82-I84 PolarHBondContact O-N 3.32Å; I84-P86 WeakPolarHBondContact O-CD 3.43Å; I84-N337 HydrophobicContact CD1-CB 4.37Å; I84-N337 WeakPolarHBondContact CD1-ND2 3.43Å
85	Q	41.7	Very low	64.8	Low	158 Å²	158	97.4 Å²	97.4	74%	0.738	53%	0.525	S	S	*	.			trans	-62	121.8	172	-65.9	179.8	3.8	0	0	106.7	K83 T87	K83-Q85 PolarHBondContact O-N 3.16Å; Q85-T87 PolarHBondContact O-N 3.19Å
86	P	47.1	Very low	65.8	Low	102 Å²	102	95 Å²	95	66%	0.662	51%	0.511	S	S	*	.			trans	-58	127.9	173.4	25.9	-33.2	0	0	0	106.8	I84 Q88	I84-P86 WeakPolarHBondContact O-CD 3.43Å; P86-Q88 WeakPolarHBondContact O-CG 3.26Å; P86-Q88 PolarHBondContact O-N 3.2Å
87	T	50.7	Low	66.9	Low	90 Å²	90	94.7 Å²	94.7	55%	0.552	50%	0.501	S	S	*	.			trans	-54.3	100.3	-172.3	48.1	0	0	0	0	109.8	Q85 D89	Q85-T87 PolarHBondContact O-N 3.19Å; T87-D89 PolarHBondContact O-N 3.35Å; T87-D89 VanDerWaalsContact O-N 3.09Å
88	Q	45.1	Very low	68	Low	164 Å²	164	92.2 Å²	92.2	77%	0.766	48%	0.483	S	S	*	.			trans	-71.5	-10.3	-164	-68.5	-161.4	-10.4	0	0	113.6	P86 K90	P86-Q88 WeakPolarHBondContact O-CG 3.26Å; P86-Q88 PolarHBondContact O-N 3.2Å; Q88-K90 VanDerWaalsContact C-N 3.27Å; Q88-K90 PolarHBondContact O-N 2.97Å
89	D	52.9	Low	69.2	Low	113 Å²	113	85.7 Å²	85.7	60%	0.604	46%	0.455	S	S	*	.			trans	-54.3	90.3	161.5	-70.6	-9.8	0	0	0	111.1	T87 A91 R333	T87-D89 PolarHBondContact O-N 3.35Å; T87-D89 VanDerWaalsContact O-N 3.09Å; D89-A91 HydrophobicContact CB-CB 4.34Å; D89-A91 PolarHBondContact O-N 3.33Å; D89-R333 PolarHBondContact O-NH2 3.31Å; D89-R333 IonicContact OD2-NH1 3.79Å; D89-R333 PolarHBondContact OD2-NH1 2.84Å
90	K	55	Low	70.8	Confident	201 Å²	201	83.2 Å²	83.2	87%	0.874	44%	0.442	S	S	*	.			trans	-63.1	51.2	145.9	-65.9	-176	179.2	179.1	0	110.1	Q88	Q88-K90 VanDerWaalsContact C-N 3.27Å; Q88-K90 PolarHBondContact O-N 2.97Å
91	A	63	Low	72.3	Confident	35 Å²	35	80.4 Å²	80.4	29%	0.289	42%	0.423	S	S	.	.			trans	-55.3	142.8	163.4	0	0	0	0	0	107.4	D89 L93 L327	D89-A91 HydrophobicContact CB-CB 4.34Å; D89-A91 PolarHBondContact O-N 3.33Å; A91-L93 PolarHBondContact O-N 3.33Å; A91-L327 HydrophobicContact CB-CD2 3.98Å
92	N	83.4	Confident	74.1	Confident	118 Å²	118	74.5 Å²	74.5	63%	0.631	39%	0.394	S	S	*	.			trans	-64.7	99.2	177.1	-64.2	-39.4	0	0	0	108	L327 T328	N92-L327 CarbonylContact O-C 3.57Å; N92-L327 VanDerWaalsContact O-CA 3.31Å; N92-L327 WeakPolarHBondContact O-CA 3.07Å; N92-T328 HydrophobicContact CB-CG2 3.74Å; N92-T328 WeakPolarHBondContact CB-OG1 3.47Å; N92-T328 PolarHBondContact O-N 3.37Å
93	L	90.6	Very high	76.2	Confident	69 Å²	69	71.2 Å²	71.2	36%	0.361	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	143.4	174.8	-57.3	-174.2	0	0	0	109.1	A91 G95 E325 E326 L327	A91-L93 PolarHBondContact O-N 3.33Å; L93-G95 VanDerWaalsContact C-N 3.33Å; L93-E325 HydrophobicContact CD2-CG 4.01Å; L93-E326 WeakPolarHBondContact CA-O 3.46Å; L93-L327 HydrophobicContact CD2-CD2 3.55Å
94	S	92.1	Very high	78.5	Confident	25 Å²	25	63.6 Å²	63.6	18%	0.175	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	-29.1	171.9	71.5	0	0	0	0	112.4	R96 N277 E326	S94-R96 PolarHBondContact OG-N 2.83Å; S94-R96 VanDerWaalsContact OG-N 3.17Å; S94-N277 VanDerWaalsContact O-CG 3.31Å; S94-N277 PolarHBondContact O-ND2 2.92Å; S94-N277 PolarHBondContact O-OD1 3.49Å; S94-N277 VanDerWaalsContact O-OD1 3.08Å; S94-E326 WeakPolarHBondContact CB-OE2 3.33Å; S94-E326 PolarHBondContact N-O 3.12Å; S94-E326 WeakPolarHBondContact OG-CB 3.32Å; S94-E326 WeakPolarHBondContact OG-CG 3.37Å; S94-E326 PolarHBondContact OG-OE2 3.28Å
95	G	93.9	Very high	80.7	Confident	35 Å²	35	59.5 Å²	59.5	36%	0.361	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	104.7	-4.9	-170.3	0	0	0	0	0	114	L93 G278	L93-G95 VanDerWaalsContact C-N 3.33Å; G95-G278 PolarHBondContact O-N 3.11Å
96	R	96.7	Very high	83.3	Confident	15 Å²	15	53.4 Å²	53.4	6%	0.057	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	137.2	174.5	-52.8	-158.7	-62	168.7	-1.1	111.8	S94 L271 E274 E276 N277 M280 E326 W332	S94-R96 PolarHBondContact OG-N 2.83Å; S94-R96 VanDerWaalsContact OG-N 3.17Å; R96-L271 PolarHBondContact NH1-O 2.77Å; R96-L271 PolarHBondContact NH2-O 3.42Å; R96-E274 PolarHBondContact NH1-O 2.89Å; R96-E276 WeakPolarHBondContact CD-O 3.09Å; R96-E276 WeakPolarHBondContact CG-O 3.38Å; R96-N277 WeakPolarHBondContact CG-OD1 3.48Å; R96-M280 HydrophobicContact CB-CE 4.34Å; R96-E326 HydrophobicContact CB-CB 4.19Å; R96-E326 IonicContact CZ-OE1 3.75Å; R96-E326 IonicContact CZ-OE2 3.64Å; R96-E326 IonicContact NE-OE1 3.54Å; R96-E326 PolarHBondContact NE-OE1 2.71Å; R96-E326 IonicContact NE-OE2 3.76Å; R96-E326 PolarHBondContact NE-OE2 2.96Å; R96-E326 IonicContact NH2-OE1 2.9Å; R96-E326 PolarHBondContact NH2-OE1 2.89Å; R96-E326 IonicContact NH2-OE2 2.84Å; R96-E326 PolarHBondContact O-N 3.37Å; R96-W332 HydrophobicContact CB-CH2 3.96Å
97	R	97.2	Very high	85.6	Confident	82 Å²	82	48.6 Å²	48.6	31%	0.309	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	147.2	176.2	-73.7	-173	165.7	164.8	-4.7	111.6	F99 G278 M280 F324 E325	R97-F99 HydrophobicContact CB-CE2 4.02Å; R97-G278 PolarHBondContact N-O 2.86Å; R97-M280 PolarHBondContact O-N 2.79Å; R97-F324 CarbonylContact C-O 3.53Å; R97-F324 VanDerWaalsContact CA-O 3.27Å; R97-F324 WeakPolarHBondContact CA-O 3.33Å; R97-E325 HydrophobicContact CG-CB 3.78Å; R97-E325 IonicContact CZ-OE2 3.06Å; R97-E325 IonicContact NE-OE2 3.9Å; R97-E325 PolarHBondContact NE-OE2 3.2Å; R97-E325 IonicContact NH2-OE2 3.57Å; R97-E325 PolarHBondContact NH2-OE2 2.97Å
98	V	98.2	Very high	87.7	Confident	0 Å²	0	45.9 Å²	45.9	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	130	179.2	168.2	0	0	0	0	109.2	L100 M267 L271 M280 F282 L296 G323 F324 W332	V98-L100 HydrophobicContact CG1-CD2 3.66Å; V98-L100 HydrophobicContact CG1-CG 4.27Å; V98-M267 HydrophobicContact CG1-CE 3.99Å; V98-L271 HydrophobicContact CG2-CD2 3.87Å; V98-M280 CarbonylContact C-O 3.57Å; V98-M280 WeakPolarHBondContact CA-O 3.27Å; V98-M280 HydrophobicContact CG2-CB 4.44Å; V98-M280 HydrophobicContact CG2-CE 4.04Å; V98-F282 HydrophobicContact CG1-CD2 3.86Å; V98-F282 HydrophobicContact CG1-CE2 3.89Å; V98-F282 HydrophobicContact CG2-CE2 4.25Å; V98-L296 HydrophobicContact CB-CD1 4.41Å; V98-L296 HydrophobicContact CG1-CD1 3.85Å; V98-G323 CarbonylContact O-C 3.58Å; V98-F324 HydrophobicContact CB-CB 4.4Å; V98-F324 PolarHBondContact N-O 2.8Å; V98-F324 PolarHBondContact O-N 2.65Å; V98-W332 HydrophobicContact CB-CZ3 4.05Å; V98-W332 HydrophobicContact CG2-CE3 4.29Å; V98-W332 HydrophobicContact CG2-CH2 3.58Å; V98-W332 HydrophobicContact CG2-CZ2 4.37Å; V98-W332 HydrophobicContact CG2-CZ3 3.53Å
99	F	98.4	Very high	90	Very high	4 Å²	4	46.1 Å²	46.1	2%	0.018	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	119.7	174.7	-68.9	-96.5	0	0	0	108.8	R97 M167 Q172 N279 M280 L281 F282 V321 V322 A338	R97-F99 HydrophobicContact CB-CE2 4.02Å; F99-M167 HydrophobicContact CB-CE 3.93Å; F99-M167 HydrophobicContact CD1-CE 3.87Å; F99-M167 HydrophobicContact CD2-CE 4.09Å; F99-M167 HydrophobicContact CE1-CE 4.41Å; F99-M167 HydrophobicContact CG-CE 3.68Å; F99-Q172 HydrophobicContact CE1-CB 4.47Å; F99-Q172 HydrophobicContact CE2-CB 4.49Å; F99-Q172 HydrophobicContact CZ-CB 3.95Å; F99-Q172 HydrophobicContact CZ-CG 3.97Å; F99-Q172 VanDerWaalsContact CZ-OE1 3.31Å; F99-N279 HydrophobicContact CD2-CB 4.01Å; F99-N279 HydrophobicContact CE2-CB 3.78Å; F99-M280 PolarHBondContact N-O 2.96Å; F99-L281 HydrophobicContact CB-CD1 3.94Å; F99-L281 CarbonylContact O-C 3.56Å; F99-L281 WeakPolarHBondContact O-CA 3.37Å; F99-F282 PolarHBondContact O-N 2.9Å; F99-V321 HydrophobicContact CB-CG1 4.23Å; F99-V321 HydrophobicContact CD1-CG1 3.79Å; F99-V322 WeakPolarHBondContact CA-O 3.08Å; F99-A338 HydrophobicContact CE1-CB 3.96Å
100	L	98.6	Very high	91.9	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	119.7	175.9	-49.6	178.6	0	0	0	108.3	V98 M267 F282 V289 L292 S293 L296 V321 V322 F324	V98-L100 HydrophobicContact CG1-CD2 3.66Å; V98-L100 HydrophobicContact CG1-CG 4.27Å; L100-M267 HydrophobicContact CD2-CE 3.86Å; L100-F282 HydrophobicContact CD2-CB 4.08Å; L100-F282 HydrophobicContact CD2-CD2 4.3Å; L100-F282 HydrophobicContact CD2-CG 4.32Å; L100-V289 HydrophobicContact CB-CG1 4.01Å; L100-V289 HydrophobicContact CB-CG2 4.41Å; L100-V289 HydrophobicContact CD1-CG1 4.31Å; L100-L292 HydrophobicContact CD1-CB 3.78Å; L100-L292 HydrophobicContact CD2-CB 3.9Å; L100-L292 HydrophobicContact CD2-CD1 4Å; L100-S293 WeakPolarHBondContact CD1-OG 3.35Å; L100-L296 HydrophobicContact CD1-CD1 4.16Å; L100-L296 HydrophobicContact CD2-CD1 4.4Å; L100-L296 HydrophobicContact CG-CD1 4.49Å; L100-V321 CarbonylContact O-C 3.6Å; L100-V321 VanDerWaalsContact O-CA 3.29Å; L100-V321 WeakPolarHBondContact O-CA 3.37Å; L100-V322 HydrophobicContact CB-CB 4.31Å; L100-V322 PolarHBondContact N-O 3.19Å; L100-V322 PolarHBondContact O-N 3.29Å; L100-F324 HydrophobicContact CD1-CD2 4.35Å; L100-F324 HydrophobicContact CD1-CE2 3.96Å
101	M	98.3	Very high	93.7	Very high	0 Å²	0	36 Å²	36	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119	129	-177.5	-179.3	178	-171	0	0	110.8	I163 T188 L192 L281 F282 V283 V284 C319 T320 V321	M101-I163 HydrophobicContact CE-CB 3.97Å; M101-I163 HydrophobicContact CE-CG1 3.94Å; M101-I163 HydrophobicContact CE-CG2 3.87Å; M101-I163 HydrophobicContact SD-CG2 4.13Å; M101-T188 HydrophobicContact CE-CG2 3.53Å; M101-T188 HydrophobicContact SD-CG2 4.19Å; M101-L192 HydrophobicContact CE-CD1 4.38Å; M101-L192 HydrophobicContact SD-CD1 3.7Å; M101-L281 HydrophobicContact CB-CD1 3.93Å; M101-F282 PolarHBondContact N-O 3.19Å; M101-V283 HydrophobicContact CB-CG2 4.3Å; M101-V283 WeakPolarHBondContact O-CA 3.13Å; M101-V283 HydrophobicContact SD-CG2 4.23Å; M101-V284 PolarHBondContact O-N 2.89Å; M101-C319 HydrophobicContact CE-CB 4.09Å; M101-T320 VanDerWaalsContact CA-O 3.31Å; M101-T320 WeakPolarHBondContact CA-O 3.42Å; M101-V321 HydrophobicContact CB-CG2 4.22Å; M101-V321 HydrophobicContact CG-CG2 4.03Å; M101-V321 HydrophobicContact SD-CG2 4.49Å
102	R	98.4	Very high	95.1	Very high	24 Å²	24	38.8 Å²	38.8	9%	0.091	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	144	165.6	-173.7	-177.5	172.6	-160.7	-6.9	110	V284 V289 G313 Y316 P317 Y318 C319 T320	R102-V284 CarbonylContact C-O 3.56Å; R102-V284 WeakPolarHBondContact CA-O 3.38Å; R102-V289 HydrophobicContact CB-CG2 4.43Å; R102-G313 PolarHBondContact NH1-O 2.96Å; R102-Y316 WeakPolarHBondContact CD-O 3.45Å; R102-Y316 PolarHBondContact NH1-O 3.16Å; R102-P317 WeakPolarHBondContact CD-O 3.26Å; R102-Y318 VanDerWaalsContact NH2-CE1 3.28Å; R102-C319 WeakPolarHBondContact O-CA 3.3Å; R102-C319 PolarHBondContact O-N 3.18Å; R102-T320 PolarHBondContact N-O 3.16Å
103	N	98.6	Very high	95.4	Very high	3 Å²	3	38.9 Å²	38.9	2%	0.016	19%	0.192	C	C	.	.			trans	-47.1	156.4	166	70.2	-87.4	0	0	0	113.3	R184 T188 V284 Y318 C319	N103-R184 HydrophobicContact CB-CB 4.37Å; N103-R184 HydrophobicContact CB-CG 4.15Å; N103-T188 WeakPolarHBondContact CA-OG1 3.5Å; N103-V284 PolarHBondContact N-O 3.17Å; N103-Y318 WeakPolarHBondContact O-CD1 3.49Å; N103-C319 PolarHBondContact O-N 3.35Å; N103-C319 VanDerWaalsContact O-N 3.15Å
104	A	98	Very high	95.6	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	18%	0.176	C	C	.	.			trans	-76	179.8	175.1	0	0	0	0	0	112.8	R106 I152 G156 T188 Y318 C319	A104-R106 PolarHBondContact O-N 2.84Å; A104-I152 HydrophobicContact CB-CG2 4.12Å; A104-G156 VanDerWaalsContact CB-O 3.28Å; A104-G156 WeakPolarHBondContact CB-O 3.27Å; A104-T188 HydrophobicContact CB-CG2 4.08Å; A104-T188 PolarHBondContact N-OG1 3.15Å; A104-Y318 VanDerWaalsContact C-CD1 3.4Å; A104-Y318 WeakPolarHBondContact O-CD1 3.47Å; A104-Y318 WeakPolarHBondContact O-CE1 3.23Å; A104-C319 VanDerWaalsContact CA-SG 3.53Å; A104-C319 WeakPolarHBondContact CB-SG 3.26Å
105	E	96.9	Very high	95.5	Very high	12 Å²	12	34.7 Å²	34.7	6%	0.056	17%	0.168	C	C	.	.			trans	-46	130.8	177.7	-178.6	179.1	93.1	0	0	112.1	I110 N131 I152 S153 Y318	E105-I110 HydrophobicContact CG-CD1 3.9Å; E105-I110 HydrophobicContact CG-CG1 3.7Å; E105-N131 PolarHBondContact OE1-ND2 3.39Å; E105-I152 WeakPolarHBondContact O-CA 3.43Å; E105-I152 VanDerWaalsContact O-CB 3.26Å; E105-I152 WeakPolarHBondContact O-CB 3.36Å; E105-S153 WeakPolarHBondContact CB-OG 3.43Å; E105-S153 VanDerWaalsContact CD-OG 3.32Å; E105-S153 WeakPolarHBondContact CG-OG 3.41Å; E105-S153 PolarHBondContact O-N 3.08Å; E105-S153 WeakPolarHBondContact OE1-CB 3.48Å; E105-S153 PolarHBondContact OE1-OG 2.86Å; E105-Y318 HydrophobicContact CB-CD2 4.39Å
106	R	96.5	Very high	95.4	Very high	30 Å²	30	37 Å²	37	11%	0.113	17%	0.172	C	C	.	.	B	Isolated β-bridge	trans	-94.4	134.5	-178.4	-70.7	164.3	55.4	147.6	-3.3	110.1	A104 D108 R109 T150 Y318	A104-R106 PolarHBondContact O-N 2.84Å; R106-D108 VanDerWaalsContact C-N 3.27Å; R106-D108 WeakPolarHBondContact CB-OD1 3.38Å; R106-D108 IonicContact CZ-OD1 3.53Å; R106-D108 IonicContact CZ-OD2 3.46Å; R106-D108 IonicContact NE-OD1 3.55Å; R106-D108 PolarHBondContact NE-OD1 3.02Å; R106-D108 IonicContact NE-OD2 3.44Å; R106-D108 IonicContact NH2-OD1 2.78Å; R106-D108 PolarHBondContact NH2-OD1 3.38Å; R106-D108 IonicContact NH2-OD2 3.7Å; R106-D108 PolarHBondContact NH2-OD2 2.84Å; R106-D108 PolarHBondContact O-N 2.86Å; R106-R109 HydrophobicContact CB-CB 4.48Å; R106-R109 HydrophobicContact CB-CG 4.14Å; R106-R109 PolarHBondContact O-N 3.47Å; R106-R109 VanDerWaalsContact O-N 3.09Å; R106-T150 HydrophobicContact CB-CG2 4.08Å; R106-T150 HydrophobicContact CG-CG2 4.11Å; R106-Y318 HydrophobicContact CG-CE1 4.04Å
107	L	95.7	Very high	95.2	Very high	0 Å²	0	42 Å²	42	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-59.8	-39.4	-179.8	-164	68.7	0	0	0	112.1	R109 I110 F111 W114 Q132 P133 P151	L107-R109 PolarHBondContact O-N 3.01Å; L107-R109 VanDerWaalsContact O-N 3.17Å; L107-I110 PolarHBondContact O-N 3.44Å; L107-F111 HydrophobicContact CD1-CD2 3.77Å; L107-F111 HydrophobicContact CD1-CE2 4.11Å; L107-F111 HydrophobicContact CG-CD2 4.38Å; L107-F111 PolarHBondContact O-N 3.04Å; L107-W114 HydrophobicContact CD2-CD2 3.52Å; L107-W114 HydrophobicContact CD2-CE3 3.37Å; L107-W114 HydrophobicContact CD2-CG 4.1Å; L107-W114 HydrophobicContact CD2-CH2 4.08Å; L107-W114 HydrophobicContact CD2-CZ2 4.24Å; L107-W114 HydrophobicContact CD2-CZ3 3.66Å; L107-W114 HydrophobicContact CG-CD2 4.08Å; L107-W114 HydrophobicContact CG-CE3 4.37Å; L107-W114 HydrophobicContact CG-CG 4.18Å; L107-Q132 HydrophobicContact CD1-CB 4.25Å; L107-Q132 HydrophobicContact CD1-CG 4.08Å; L107-P133 HydrophobicContact CD2-CG 4.18Å; L107-P151 HydrophobicContact CB-CG 3.92Å; L107-P151 HydrophobicContact CD2-CG 3.58Å; L107-P151 HydrophobicContact CG-CG 4.41Å; L107-P151 PolarHBondContact N-O 3.06Å; L107-P151 VanDerWaalsContact N-O 3.09Å
108	D	95.4	Very high	94.9	Very high	33 Å²	33	38.2 Å²	38.2	18%	0.176	18%	0.184	C	C	.	.	H	α-helix	trans	-67	-9.1	178.2	76.9	-18.4	0	0	0	115.8	R106 T150	R106-D108 VanDerWaalsContact C-N 3.27Å; R106-D108 WeakPolarHBondContact CB-OD1 3.38Å; R106-D108 IonicContact CZ-OD1 3.53Å; R106-D108 IonicContact CZ-OD2 3.46Å; R106-D108 IonicContact NE-OD1 3.55Å; R106-D108 PolarHBondContact NE-OD1 3.02Å; R106-D108 IonicContact NE-OD2 3.44Å; R106-D108 IonicContact NH2-OD1 2.78Å; R106-D108 PolarHBondContact NH2-OD1 3.38Å; R106-D108 IonicContact NH2-OD2 3.7Å; R106-D108 PolarHBondContact NH2-OD2 2.84Å; R106-D108 PolarHBondContact O-N 2.86Å; D108-T150 HydrophobicContact CB-CG2 4.28Å; D108-T150 PolarHBondContact N-OG1 2.78Å
109	R	93.2	Very high	94.5	Very high	170 Å²	170	39.4 Å²	39.4	64%	0.642	19%	0.19	S	C	*	.	H	α-helix	trans	-100.5	-22.5	176.4	-63.2	-48.4	-173.9	142.5	0.7	113.8	R106 L107 Y318	R106-R109 HydrophobicContact CB-CB 4.48Å; R106-R109 HydrophobicContact CB-CG 4.14Å; R106-R109 PolarHBondContact O-N 3.47Å; R106-R109 VanDerWaalsContact O-N 3.09Å; L107-R109 PolarHBondContact O-N 3.01Å; L107-R109 VanDerWaalsContact O-N 3.17Å; R109-Y318 WeakPolarHBondContact CG-OH 3.48Å
110	I	92.6	Very high	93.8	Very high	70 Å²	70	40.8 Å²	40.8	36%	0.359	20%	0.197	S	C	.	.	H	α-helix	trans	-88.9	-36.7	172.9	-51.3	-54.5	0	0	0	110.4	E105 L107	E105-I110 HydrophobicContact CG-CD1 3.9Å; E105-I110 HydrophobicContact CG-CG1 3.7Å; L107-I110 PolarHBondContact O-N 3.44Å
111	F	93	Very high	92.9	Very high	30 Å²	30	49.8 Å²	49.8	13%	0.132	24%	0.239	C	C	.	.			trans	-132.8	92	-175.6	-53	-72.1	0	0	0	109.4	L107 E113 W114 Y128 D129 N131 Q132	L107-F111 HydrophobicContact CD1-CD2 3.77Å; L107-F111 HydrophobicContact CD1-CE2 4.11Å; L107-F111 HydrophobicContact CG-CD2 4.38Å; L107-F111 PolarHBondContact O-N 3.04Å; F111-E113 PolarHBondContact O-N 3.46Å; F111-W114 HydrophobicContact CB-CB 3.72Å; F111-W114 VanDerWaalsContact O-CB 3.31Å; F111-W114 WeakPolarHBondContact O-CB 3.19Å; F111-W114 PolarHBondContact O-N 3.15Å; F111-Y128 HydrophobicContact CD1-CE2 4.33Å; F111-D129 HydrophobicContact CE1-CB 3.89Å; F111-D129 HydrophobicContact CZ-CB 3.69Å; F111-D129 VanDerWaalsContact CZ-CG 3.44Å; F111-D129 WeakPolarHBondContact CZ-OD1 3.34Å; F111-N131 HydrophobicContact CE2-CB 4.26Å; F111-N131 HydrophobicContact CZ-CB 4.31Å; F111-Q132 HydrophobicContact CD2-CG 4.16Å; F111-Q132 HydrophobicContact CE2-CG 3.88Å; F111-Q132 HydrophobicContact CZ-CG 4.41Å
112	P	91.4	Very high	92.2	Very high	94 Å²	94	55.3 Å²	55.3	61%	0.61	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59	-48.9	-176.9	-28	36.7	0	0	0	113.4	W114	P112-W114 PolarHBondContact O-N 3.31Å
113	E	90	Very high	91.3	Very high	120 Å²	120	55.9 Å²	55.9	56%	0.561	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.9	14	-177.4	-51.1	-49.2	122.6	0	0	114	F111 L115 D116 M117	F111-E113 PolarHBondContact O-N 3.46Å; E113-L115 VanDerWaalsContact C-N 3.26Å; E113-L115 PolarHBondContact O-N 3.27Å; E113-L115 VanDerWaalsContact O-N 3.12Å; E113-D116 PolarHBondContact O-N 2.87Å; E113-M117 HydrophobicContact CB-CG 4.24Å; E113-M117 HydrophobicContact CB-SD 4.13Å; E113-M117 WeakPolarHBondContact O-CG 3.34Å; E113-M117 PolarHBondContact O-N 3.41Å
114	W	93.9	Very high	90.8	Very high	4 Å²	4	62.1 Å²	62.1	2%	0.015	31%	0.306	C	S	.	.	H	α-helix	trans	-56.1	-37.1	-168.5	74.6	-81.4	0	0	0	113.9	L107 F111 P112 D116 S118 F125 L136 Y146 P151	L107-W114 HydrophobicContact CD2-CD2 3.52Å; L107-W114 HydrophobicContact CD2-CE3 3.37Å; L107-W114 HydrophobicContact CD2-CG 4.1Å; L107-W114 HydrophobicContact CD2-CH2 4.08Å; L107-W114 HydrophobicContact CD2-CZ2 4.24Å; L107-W114 HydrophobicContact CD2-CZ3 3.66Å; L107-W114 HydrophobicContact CG-CD2 4.08Å; L107-W114 HydrophobicContact CG-CE3 4.37Å; L107-W114 HydrophobicContact CG-CG 4.18Å; F111-W114 HydrophobicContact CB-CB 3.72Å; F111-W114 VanDerWaalsContact O-CB 3.31Å; F111-W114 WeakPolarHBondContact O-CB 3.19Å; F111-W114 PolarHBondContact O-N 3.15Å; P112-W114 PolarHBondContact O-N 3.31Å; W114-D116 PolarHBondContact O-N 3.47Å; W114-S118 WeakPolarHBondContact O-CB 3.12Å; W114-S118 PolarHBondContact O-N 2.84Å; W114-S118 PolarHBondContact O-OG 3.33Å; W114-F125 HydrophobicContact CE3-CE2 4.08Å; W114-F125 HydrophobicContact CZ3-CD2 4.25Å; W114-F125 AromaticContact CZ3-CE2 3.8Å; W114-F125 HydrophobicContact CZ3-CE2 3.8Å; W114-L136 HydrophobicContact CH2-CD1 4.1Å; W114-L136 HydrophobicContact CZ3-CD1 3.95Å; W114-Y146 HydrophobicContact CH2-CD1 4.5Å; W114-Y146 HydrophobicContact CH2-CG 4.11Å; W114-P151 HydrophobicContact CH2-CG 3.94Å; W114-P151 HydrophobicContact CZ2-CG 4.21Å
115	L	92	Very high	90.5	Very high	2 Å²	2	63.8 Å²	63.8	1%	0.01	31%	0.313	C	S	.	.	H	α-helix	trans	-70.2	-37.8	-172.9	-171.7	62.3	0	0	0	111.5	E113 I119 Y143 R147	E113-L115 VanDerWaalsContact C-N 3.26Å; E113-L115 PolarHBondContact O-N 3.27Å; E113-L115 VanDerWaalsContact O-N 3.12Å; L115-I119 HydrophobicContact CD1-CD1 4.44Å; L115-I119 HydrophobicContact CD1-CG1 3.9Å; L115-I119 HydrophobicContact CG-CG1 4.47Å; L115-I119 VanDerWaalsContact O-CB 3.29Å; L115-I119 WeakPolarHBondContact O-CB 3.32Å; L115-I119 WeakPolarHBondContact O-CG1 3.31Å; L115-I119 PolarHBondContact O-N 3.1Å; L115-Y143 HydrophobicContact CD1-CD2 4.17Å; L115-Y143 HydrophobicContact CG-CD2 4.34Å; L115-R147 HydrophobicContact CD2-CB 3.86Å
116	D	90.6	Very high	90.3	Very high	85 Å²	85	70.7 Å²	70.7	46%	0.455	34%	0.338	S	S	.	.	H	α-helix	trans	-84.8	-24.4	-178.8	-53.2	-70.1	0	0	0	111.6	E113 W114 R147	E113-D116 PolarHBondContact O-N 2.87Å; W114-D116 PolarHBondContact O-N 3.47Å; D116-R147 IonicContact OD1-NH2 3.24Å; D116-R147 PolarHBondContact OD1-NH2 2.7Å; D116-R147 IonicContact OD2-CZ 3.76Å; D116-R147 IonicContact OD2-NH2 2.87Å; D116-R147 PolarHBondContact OD2-NH2 2.85Å
117	M	92.3	Very high	90.1	Very high	120 Å²	120	72.2 Å²	72.2	59%	0.591	35%	0.352	S	S	*	.	H	α-helix	trans	-80.5	-35.1	171.3	-70.2	-175.1	68	0	0	113.9	E113 Y128	E113-M117 HydrophobicContact CB-CG 4.24Å; E113-M117 HydrophobicContact CB-SD 4.13Å; E113-M117 WeakPolarHBondContact O-CG 3.34Å; E113-M117 PolarHBondContact O-N 3.41Å; M117-Y128 HydrophobicContact CB-CD1 3.94Å; M117-Y128 HydrophobicContact CB-CE1 3.35Å; M117-Y128 HydrophobicContact CE-CD2 4.41Å; M117-Y128 HydrophobicContact CE-CE1 4.28Å; M117-Y128 HydrophobicContact CE-CE2 4.01Å; M117-Y128 HydrophobicContact CG-CE1 4.43Å; M117-Y128 HydrophobicContact SD-CE1 4.38Å
118	S	91.7	Very high	90	Very high	2 Å²	2	76.8 Å²	76.8	1%	0.014	37%	0.37	C	S	.	.	H	α-helix	trans	-89.6	-15.6	-177.1	-60.8	0	0	0	0	114.1	W114 F125 R126 Y128 Q132	W114-S118 WeakPolarHBondContact O-CB 3.12Å; W114-S118 PolarHBondContact O-N 2.84Å; W114-S118 PolarHBondContact O-OG 3.33Å; S118-F125 CarbonylContact O-C 3.57Å; S118-F125 WeakPolarHBondContact O-CA 3.34Å; S118-R126 WeakPolarHBondContact CA-O 3.5Å; S118-R126 VanDerWaalsContact CB-O 3.26Å; S118-R126 WeakPolarHBondContact CB-O 3.5Å; S118-R126 PolarHBondContact O-N 3.16Å; S118-Y128 VanDerWaalsContact OG-CD1 3.3Å; S118-Y128 WeakPolarHBondContact OG-CD1 3.31Å; S118-Y128 VanDerWaalsContact OG-CE1 3.23Å; S118-Y128 WeakPolarHBondContact OG-CE1 3.21Å; S118-Q132 PolarHBondContact OG-OE1 3.08Å
119	I	88.5	Confident	89.9	Confident	24 Å²	24	78.1 Å²	78.1	12%	0.123	38%	0.377	C	S	.	.	B	Isolated β-bridge	trans	-96.8	118.4	179.5	-62.1	-76	0	0	0	109.9	L115 F125 Y143	L115-I119 HydrophobicContact CD1-CD1 4.44Å; L115-I119 HydrophobicContact CD1-CG1 3.9Å; L115-I119 HydrophobicContact CG-CG1 4.47Å; L115-I119 VanDerWaalsContact O-CB 3.29Å; L115-I119 WeakPolarHBondContact O-CB 3.32Å; L115-I119 WeakPolarHBondContact O-CG1 3.31Å; L115-I119 PolarHBondContact O-N 3.1Å; I119-F125 HydrophobicContact CD1-CB 3.89Å; I119-F125 HydrophobicContact CD1-CD2 4.33Å; I119-Y143 HydrophobicContact CB-CD2 4.23Å; I119-Y143 HydrophobicContact CB-CE2 4.22Å; I119-Y143 HydrophobicContact CD1-CD2 3.94Å; I119-Y143 HydrophobicContact CD1-CG 3.87Å; I119-Y143 HydrophobicContact CG1-CD2 3.65Å; I119-Y143 HydrophobicContact CG1-CE2 4.13Å; I119-Y143 HydrophobicContact CG1-CG 4.12Å; I119-Y143 HydrophobicContact CG2-CD1 4.25Å; I119-Y143 HydrophobicContact CG2-CD2 3.94Å; I119-Y143 HydrophobicContact CG2-CE1 4.09Å; I119-Y143 HydrophobicContact CG2-CE2 3.76Å; I119-Y143 HydrophobicContact CG2-CG 4.2Å
120	N	84.4	Confident	90	Very high	33 Å²	33	77.8 Å²	77.8	18%	0.176	39%	0.387	C	S	.	.			trans	-81.7	170.7	177.7	87	-10.4	0	0	0	113	Q122 G123 K124 R126	N120-Q122 PolarHBondContact ND2-OE1 3.47Å; N120-Q122 PolarHBondContact O-N 3.02Å; N120-Q122 PolarHBondContact OD1-N 3.05Å; N120-G123 WeakPolarHBondContact O-CA 3.45Å; N120-G123 PolarHBondContact O-N 3.16Å; N120-K124 PolarHBondContact N-O 2.99Å; N120-K124 WeakPolarHBondContact OD1-CB 3.15Å; N120-K124 PolarHBondContact OD1-N 3.36Å; N120-K124 PolarHBondContact OD1-O 3.28Å; N120-R126 PolarHBondContact ND2-NH2 3.11Å
121	E	80.6	Confident	90.1	Very high	190 Å²	190	75.4 Å²	75.4	89%	0.888	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.6	-25.7	179.9	-57.1	170.8	158.2	0	0	114.7	G123	E121-G123 VanDerWaalsContact C-N 3.3Å
122	Q	82.5	Confident	90.2	Very high	115 Å²	115	74.1 Å²	74.1	54%	0.537	37%	0.37	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.6	16.1	178.1	-53.8	93.9	44.4	0	0	112.8	N120 K124	N120-Q122 PolarHBondContact ND2-OE1 3.47Å; N120-Q122 PolarHBondContact O-N 3.02Å; N120-Q122 PolarHBondContact OD1-N 3.05Å; Q122-K124 PolarHBondContact O-N 2.57Å
123	G	80.1	Confident	90.4	Very high	36 Å²	36	70 Å²	70	37%	0.371	34%	0.343	S	S	.	.	S	Bend	trans	67.7	16.3	-178.8	0	0	0	0	0	114.2	N120 E121	N120-G123 WeakPolarHBondContact O-CA 3.45Å; N120-G123 PolarHBondContact O-N 3.16Å; E121-G123 VanDerWaalsContact C-N 3.3Å
124	K	86.9	Confident	90.5	Very high	135 Å²	135	69.7 Å²	69.7	59%	0.587	35%	0.349	S	S	*	.			trans	-95.7	125.3	-178.3	-63.2	-177.6	-179.9	177.7	0	110.3	N120 Q122	N120-K124 PolarHBondContact N-O 2.99Å; N120-K124 WeakPolarHBondContact OD1-CB 3.15Å; N120-K124 PolarHBondContact OD1-N 3.36Å; N120-K124 PolarHBondContact OD1-O 3.28Å; Q122-K124 PolarHBondContact O-N 2.57Å
125	F	92	Very high	90.4	Very high	35 Å²	35	73.5 Å²	73.5	15%	0.154	38%	0.376	C	S	.	.	B	Isolated β-bridge	trans	-64.5	137.3	169.4	178.7	-89.4	0	0	0	111	W114 S118 I119 P127 Q132 P133 L136	W114-F125 HydrophobicContact CE3-CE2 4.08Å; W114-F125 HydrophobicContact CZ3-CD2 4.25Å; W114-F125 AromaticContact CZ3-CE2 3.8Å; W114-F125 HydrophobicContact CZ3-CE2 3.8Å; S118-F125 CarbonylContact O-C 3.57Å; S118-F125 WeakPolarHBondContact O-CA 3.34Å; I119-F125 HydrophobicContact CD1-CB 3.89Å; I119-F125 HydrophobicContact CD1-CD2 4.33Å; F125-P127 HydrophobicContact CE1-CB 4.06Å; F125-P127 HydrophobicContact CE1-CG 4.29Å; F125-P127 HydrophobicContact CZ-CB 4.22Å; F125-Q132 HydrophobicContact CZ-CB 4.48Å; F125-P133 WeakPolarHBondContact CE1-O 3.18Å; F125-P133 HydrophobicContact CZ-CG 4.46Å; F125-L136 HydrophobicContact CB-CD1 4.15Å; F125-L136 HydrophobicContact CB-CG 4.38Å; F125-L136 HydrophobicContact CD1-CG 4.27Å; F125-L136 HydrophobicContact CD2-CD1 3.49Å; F125-L136 VanDerWaalsContact CD2-CD1 3.49Å; F125-L136 HydrophobicContact CD2-CG 3.91Å; F125-L136 HydrophobicContact CE2-CD1 4.06Å; F125-L136 HydrophobicContact CE2-CG 4.27Å; F125-L136 HydrophobicContact CG-CD1 3.84Å; F125-L136 HydrophobicContact CG-CG 3.9Å
126	R	92.6	Very high	90.4	Very high	156 Å²	156	74.6 Å²	74.6	59%	0.589	38%	0.382	S	S	*	.			trans	-139.1	123.8	171	-64.2	-177.4	178.3	-172.1	-1.6	107.9	S118 N120	S118-R126 WeakPolarHBondContact CA-O 3.5Å; S118-R126 VanDerWaalsContact CB-O 3.26Å; S118-R126 WeakPolarHBondContact CB-O 3.5Å; S118-R126 PolarHBondContact O-N 3.16Å; N120-R126 PolarHBondContact ND2-NH2 3.11Å
127	P	93.4	Very high	90.5	Very high	62 Å²	62	71.1 Å²	71.1	40%	0.403	36%	0.364	S	S	.	.			trans	-69.7	139.1	173	29.7	-32.2	0	0	0	109.8	F125 Q132	F125-P127 HydrophobicContact CE1-CB 4.06Å; F125-P127 HydrophobicContact CE1-CG 4.29Å; F125-P127 HydrophobicContact CZ-CB 4.22Å; P127-Q132 VanDerWaalsContact CA-OE1 3.28Å; P127-Q132 HydrophobicContact CB-CB 3.77Å
128	Y	92.9	Very high	90.4	Very high	97 Å²	97	73.7 Å²	73.7	38%	0.38	37%	0.372	S	S	.	.	S	Bend	trans	-110.9	-9	174.4	64.1	-101.2	0	0	0	113.4	F111 M117 S118 Q132	F111-Y128 HydrophobicContact CD1-CE2 4.33Å; M117-Y128 HydrophobicContact CB-CD1 3.94Å; M117-Y128 HydrophobicContact CB-CE1 3.35Å; M117-Y128 HydrophobicContact CE-CD2 4.41Å; M117-Y128 HydrophobicContact CE-CE1 4.28Å; M117-Y128 HydrophobicContact CE-CE2 4.01Å; M117-Y128 HydrophobicContact CG-CE1 4.43Å; M117-Y128 HydrophobicContact SD-CE1 4.38Å; S118-Y128 VanDerWaalsContact OG-CD1 3.3Å; S118-Y128 WeakPolarHBondContact OG-CD1 3.31Å; S118-Y128 VanDerWaalsContact OG-CE1 3.23Å; S118-Y128 WeakPolarHBondContact OG-CE1 3.21Å; Y128-Q132 PolarHBondContact OH-NE2 2.82Å
129	D	94.2	Very high	90.5	Very high	61 Å²	61	74.4 Å²	74.4	33%	0.326	37%	0.374	S	S	.	.	S	Bend	trans	-131.8	147.9	172.4	-177.7	-71.6	0	0	0	108.7	F111 N131 Q132	F111-D129 HydrophobicContact CE1-CB 3.89Å; F111-D129 HydrophobicContact CZ-CB 3.69Å; F111-D129 VanDerWaalsContact CZ-CG 3.44Å; F111-D129 WeakPolarHBondContact CZ-OD1 3.34Å; D129-N131 PolarHBondContact O-N 3.17Å; D129-N131 WeakPolarHBondContact OD1-CB 3.41Å; D129-N131 PolarHBondContact OD1-N 3.34Å; D129-Q132 HydrophobicContact CB-CG 4.07Å; D129-Q132 WeakPolarHBondContact O-CB 3.44Å; D129-Q132 WeakPolarHBondContact O-CG 3.29Å; D129-Q132 PolarHBondContact O-N 3.24Å; D129-Q132 VanDerWaalsContact O-N 3.08Å
130	L	94.3	Very high	90.6	Very high	162 Å²	162	77.4 Å²	77.4	85%	0.848	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.7	-14.7	-174.8	-63.8	177.3	0	0	0	113.8	Q132	L130-Q132 VanDerWaalsContact C-N 3.29Å
131	N	95.2	Very high	90.8	Very high	20 Å²	20	78.9 Å²	78.9	11%	0.107	42%	0.416	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.2	-4.1	171.7	-164.9	25.2	0	0	0	112.7	E105 F111 D129 S153 E154 L155	E105-N131 PolarHBondContact OE1-ND2 3.39Å; F111-N131 HydrophobicContact CE2-CB 4.26Å; F111-N131 HydrophobicContact CZ-CB 4.31Å; D129-N131 PolarHBondContact O-N 3.17Å; D129-N131 WeakPolarHBondContact OD1-CB 3.41Å; D129-N131 PolarHBondContact OD1-N 3.34Å; N131-S153 CarbonylContact O-C 3.54Å; N131-S153 WeakPolarHBondContact O-CA 3.17Å; N131-S153 VanDerWaalsContact O-CB 3.27Å; N131-S153 WeakPolarHBondContact O-CB 3.28Å; N131-S153 VanDerWaalsContact OD1-CB 3.32Å; N131-S153 WeakPolarHBondContact OD1-CB 2.99Å; N131-S153 PolarHBondContact OD1-OG 3.01Å; N131-E154 PolarHBondContact O-N 2.97Å; N131-E154 PolarHBondContact OD1-N 3.2Å; N131-L155 WeakPolarHBondContact OD1-CB 3.43Å; N131-L155 VanDerWaalsContact OD1-CG 3.29Å; N131-L155 WeakPolarHBondContact OD1-CG 3.31Å; N131-L155 PolarHBondContact OD1-N 2.86Å
132	Q	95.5	Very high	91.3	Very high	4 Å²	4	71.4 Å²	71.4	2%	0.019	39%	0.39	C	S	.	.	S	Bend	trans	-83.6	143	175.3	-52.9	-165	-36.3	0	0	111.3	L107 F111 S118 F125 P127 Y128 D129 L130 V134	L107-Q132 HydrophobicContact CD1-CB 4.25Å; L107-Q132 HydrophobicContact CD1-CG 4.08Å; F111-Q132 HydrophobicContact CD2-CG 4.16Å; F111-Q132 HydrophobicContact CE2-CG 3.88Å; F111-Q132 HydrophobicContact CZ-CG 4.41Å; S118-Q132 PolarHBondContact OG-OE1 3.08Å; F125-Q132 HydrophobicContact CZ-CB 4.48Å; P127-Q132 VanDerWaalsContact CA-OE1 3.28Å; P127-Q132 HydrophobicContact CB-CB 3.77Å; Y128-Q132 PolarHBondContact OH-NE2 2.82Å; D129-Q132 HydrophobicContact CB-CG 4.07Å; D129-Q132 WeakPolarHBondContact O-CB 3.44Å; D129-Q132 WeakPolarHBondContact O-CG 3.29Å; D129-Q132 PolarHBondContact O-N 3.24Å; D129-Q132 VanDerWaalsContact O-N 3.08Å; L130-Q132 VanDerWaalsContact C-N 3.29Å; Q132-V134 PolarHBondContact O-N 3.05Å
133	P	94.6	Very high	91.7	Very high	6 Å²	6	70.2 Å²	70.2	4%	0.039	38%	0.382	C	S	.	.			trans	-60.3	138.1	-178.7	25.7	-35.3	0	0	0	111.4	L107 F125 S135 L136 P151 E154	L107-P133 HydrophobicContact CD2-CG 4.18Å; F125-P133 WeakPolarHBondContact CE1-O 3.18Å; F125-P133 HydrophobicContact CZ-CG 4.46Å; P133-S135 PolarHBondContact O-N 3.19Å; P133-S135 VanDerWaalsContact O-N 3.1Å; P133-L136 HydrophobicContact CG-CD2 3.95Å; P133-P151 HydrophobicContact CG-CB 4.46Å; P133-P151 HydrophobicContact CG-CG 4.26Å; P133-E154 WeakPolarHBondContact CA-OE1 3.48Å
134	V	91.9	Very high	92.3	Very high	115 Å²	115	72.2 Å²	72.2	70%	0.697	38%	0.382	S	S	*	.	S	Bend	trans	-58.8	-29	-176.3	180	0	0	0	0	113.1	Q132 E154	Q132-V134 PolarHBondContact O-N 3.05Å; V134-E154 PolarHBondContact N-OE1 3.42Å
135	S	92	Very high	92.6	Very high	84 Å²	84	66.6 Å²	66.6	59%	0.587	36%	0.359	S	S	*	.			trans	-154.6	163.5	174.2	65.8	0	0	0	0	112.2	P133	P133-S135 PolarHBondContact O-N 3.19Å; P133-S135 VanDerWaalsContact O-N 3.1Å
136	L	92.4	Very high	92.7	Very high	24 Å²	24	65.1 Å²	65.1	13%	0.126	35%	0.352	C	S	.	.			trans	-113.9	145.2	173.8	-60.2	178.4	0	0	0	110.9	W114 F125 P133 Y146 P151	W114-L136 HydrophobicContact CH2-CD1 4.1Å; W114-L136 HydrophobicContact CZ3-CD1 3.95Å; F125-L136 HydrophobicContact CB-CD1 4.15Å; F125-L136 HydrophobicContact CB-CG 4.38Å; F125-L136 HydrophobicContact CD1-CG 4.27Å; F125-L136 HydrophobicContact CD2-CD1 3.49Å; F125-L136 VanDerWaalsContact CD2-CD1 3.49Å; F125-L136 HydrophobicContact CD2-CG 3.91Å; F125-L136 HydrophobicContact CE2-CD1 4.06Å; F125-L136 HydrophobicContact CE2-CG 4.27Å; F125-L136 HydrophobicContact CG-CD1 3.84Å; F125-L136 HydrophobicContact CG-CG 3.9Å; P133-L136 HydrophobicContact CG-CD2 3.95Å; L136-Y146 HydrophobicContact CB-CE2 3.99Å; L136-Y146 HydrophobicContact CD1-CD2 3.84Å; L136-Y146 HydrophobicContact CD1-CE2 3.84Å; L136-Y146 HydrophobicContact CD1-CG 4.36Å; L136-Y146 HydrophobicContact CG-CE2 4.43Å; L136-P151 HydrophobicContact CD2-CB 4.39Å; L136-P151 HydrophobicContact CD2-CG 4.09Å
137	P	93.1	Very high	92.8	Very high	12 Å²	12	62.7 Å²	62.7	8%	0.078	34%	0.343	C	S	.	.			trans	-52.6	153.9	164.1	-28.7	36.1	0	0	0	113.7	Y146 F183 L223 F231 Y233	P137-Y146 WeakPolarHBondContact CB-OH 3.46Å; P137-Y146 WeakPolarHBondContact CD-OH 3.43Å; P137-Y146 PolarHBondContact O-OH 2.95Å; P137-F183 HydrophobicContact CG-CE1 4.41Å; P137-F183 HydrophobicContact CG-CE2 4.1Å; P137-F183 HydrophobicContact CG-CZ 3.58Å; P137-L223 HydrophobicContact CB-CD2 4.11Å; P137-F231 HydrophobicContact CB-CB 4.48Å; P137-F231 HydrophobicContact CB-CD1 4.11Å; P137-F231 HydrophobicContact CB-CD2 3.7Å; P137-F231 HydrophobicContact CB-CE1 4.32Å; P137-F231 HydrophobicContact CB-CE2 3.93Å; P137-F231 HydrophobicContact CB-CG 3.81Å; P137-F231 HydrophobicContact CB-CZ 4.25Å; P137-F231 HydrophobicContact CG-CB 4.35Å; P137-F231 HydrophobicContact CG-CD1 4.25Å; P137-F231 HydrophobicContact CG-CD2 4.44Å; P137-F231 HydrophobicContact CG-CG 4.07Å; P137-Y233 HydrophobicContact CG-CE2 4.27Å
138	K	90.8	Very high	92.8	Very high	175 Å²	175	62.2 Å²	62.2	76%	0.761	34%	0.337	S	S	*	.			trans	-80.7	131.6	159.9	-67.3	-178.5	179.8	179.4	0	107.5	F231	K138-F231 HydrophobicContact CB-CE2 4.11Å; K138-F231 HydrophobicContact CB-CZ 4.13Å; K138-F231 HydrophobicContact CG-CZ 4.26Å
139	R	93.1	Very high	93	Very high	16 Å²	16	57.6 Å²	57.6	6%	0.06	32%	0.319	C	S	.	.			trans	-132.8	151.7	179.6	75	-165.5	-62	164.1	7.4	111.8	G142 C145 Y146 D149 V221 L223	R139-G142 WeakPolarHBondContact CG-O 3.48Å; R139-G142 WeakPolarHBondContact O-CA 3.49Å; R139-G142 PolarHBondContact O-N 2.75Å; R139-C145 HydrophobicContact CG-CB 4.39Å; R139-Y146 HydrophobicContact CG-CE2 4.28Å; R139-D149 IonicContact CZ-OD2 3.73Å; R139-D149 PolarHBondContact NH1-O 2.83Å; R139-D149 VanDerWaalsContact NH1-O 3.14Å; R139-D149 IonicContact NH1-OD2 3.96Å; R139-D149 IonicContact NH2-OD2 2.74Å; R139-D149 PolarHBondContact NH2-OD2 2.88Å; R139-V221 PolarHBondContact NH2-O 2.9Å; R139-L223 HydrophobicContact CB-CD2 3.53Å; R139-L223 HydrophobicContact CB-CG 4.31Å
140	T	90.2	Very high	93.1	Very high	88 Å²	88	54.8 Å²	54.8	54%	0.54	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.4	136.6	170.2	-63.9	0	0	0	0	109.7	G142 E227	T140-G142 PolarHBondContact O-N 3.49Å; T140-E227 VanDerWaalsContact CB-OE1 3.3Å; T140-E227 WeakPolarHBondContact CB-OE1 3.43Å; T140-E227 PolarHBondContact N-OE1 2.66Å; T140-E227 PolarHBondContact OG1-OE1 2.86Å
141	G	88.3	Confident	93.3	Very high	63 Å²	63	47 Å²	47	65%	0.649	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.2	-7.6	-168.6	0	0	0	0	0	115
142	G	91.8	Very high	93.4	Very high	33 Å²	33	46.3 Å²	46.3	34%	0.34	26%	0.26	S	S	.	.			trans	78.4	-167.4	173.6	0	0	0	0	0	114.4	R139 T140 Q144 C145	R139-G142 WeakPolarHBondContact CG-O 3.48Å; R139-G142 WeakPolarHBondContact O-CA 3.49Å; R139-G142 PolarHBondContact O-N 2.75Å; T140-G142 PolarHBondContact O-N 3.49Å; G142-Q144 VanDerWaalsContact C-N 3.28Å; G142-Q144 PolarHBondContact O-N 2.87Å; G142-C145 PolarHBondContact O-N 2.62Å
143	Y	90.6	Very high	93.5	Very high	90 Å²	90	46.2 Å²	46.2	35%	0.353	26%	0.259	S	S	.	.	G	3₁₀ helix	trans	-65.9	-29.8	-172.5	69.4	-94.4	0	0	0	113.1	L115 I119 C145 Y146	L115-Y143 HydrophobicContact CD1-CD2 4.17Å; L115-Y143 HydrophobicContact CG-CD2 4.34Å; I119-Y143 HydrophobicContact CB-CD2 4.23Å; I119-Y143 HydrophobicContact CB-CE2 4.22Å; I119-Y143 HydrophobicContact CD1-CD2 3.94Å; I119-Y143 HydrophobicContact CD1-CG 3.87Å; I119-Y143 HydrophobicContact CG1-CD2 3.65Å; I119-Y143 HydrophobicContact CG1-CE2 4.13Å; I119-Y143 HydrophobicContact CG1-CG 4.12Å; I119-Y143 HydrophobicContact CG2-CD1 4.25Å; I119-Y143 HydrophobicContact CG2-CD2 3.94Å; I119-Y143 HydrophobicContact CG2-CE1 4.09Å; I119-Y143 HydrophobicContact CG2-CE2 3.76Å; I119-Y143 HydrophobicContact CG2-CG 4.2Å; Y143-C145 PolarHBondContact O-N 2.7Å; Y143-C145 VanDerWaalsContact O-N 3.12Å; Y143-Y146 WeakPolarHBondContact O-CB 3.48Å; Y143-Y146 WeakPolarHBondContact O-CD2 3.47Å; Y143-Y146 PolarHBondContact O-N 3.46Å
144	Q	92	Very high	93.5	Very high	79 Å²	79	48.2 Å²	48.2	37%	0.369	27%	0.268	S	S	.	.	G	3₁₀ helix	trans	-58.2	-28.2	-179.4	-68.1	-69.9	-4.7	0	0	112.8	G142 Y146 R147	G142-Q144 VanDerWaalsContact C-N 3.28Å; G142-Q144 PolarHBondContact O-N 2.87Å; Q144-Y146 PolarHBondContact O-N 3.34Å; Q144-R147 PolarHBondContact O-N 2.79Å
145	C	94.3	Very high	93.7	Very high	17 Å²	17	46.9 Å²	46.9	12%	0.115	26%	0.257	C	S	.	.	G	3₁₀ helix	trans	-63.3	-20.3	175.5	-65.5	0	0	0	0	114	R139 G142 Y143 R147 N148 D149 V221	R139-C145 HydrophobicContact CG-CB 4.39Å; G142-C145 PolarHBondContact O-N 2.62Å; Y143-C145 PolarHBondContact O-N 2.7Å; Y143-C145 VanDerWaalsContact O-N 3.12Å; C145-R147 PolarHBondContact O-N 3.08Å; C145-N148 PolarHBondContact O-N 2.98Å; C145-D149 PolarHBondContact O-N 2.8Å; C145-V221 HydrophobicContact CB-CB 4.33Å
146	Y	94.8	Very high	93.9	Very high	3 Å²	3	42.9 Å²	42.9	1%	0.012	23%	0.229	C	C	.	.	G	3₁₀ helix	trans	-67.4	-17.3	175.6	-76.2	-68.1	0	0	0	114.1	W114 L136 P137 R139 Y143 Q144 N148 D149 T150 F183	W114-Y146 HydrophobicContact CH2-CD1 4.5Å; W114-Y146 HydrophobicContact CH2-CG 4.11Å; L136-Y146 HydrophobicContact CB-CE2 3.99Å; L136-Y146 HydrophobicContact CD1-CD2 3.84Å; L136-Y146 HydrophobicContact CD1-CE2 3.84Å; L136-Y146 HydrophobicContact CD1-CG 4.36Å; L136-Y146 HydrophobicContact CG-CE2 4.43Å; P137-Y146 WeakPolarHBondContact CB-OH 3.46Å; P137-Y146 WeakPolarHBondContact CD-OH 3.43Å; P137-Y146 PolarHBondContact O-OH 2.95Å; R139-Y146 HydrophobicContact CG-CE2 4.28Å; Y143-Y146 WeakPolarHBondContact O-CB 3.48Å; Y143-Y146 WeakPolarHBondContact O-CD2 3.47Å; Y143-Y146 PolarHBondContact O-N 3.46Å; Q144-Y146 PolarHBondContact O-N 3.34Å; Y146-N148 VanDerWaalsContact C-N 3.3Å; Y146-N148 PolarHBondContact O-N 2.86Å; Y146-D149 WeakPolarHBondContact CD1-O 3.31Å; Y146-D149 CarbonylContact O-C 3.48Å; Y146-T150 VanDerWaalsContact O-CA 3.31Å; Y146-T150 WeakPolarHBondContact O-CA 3.34Å; Y146-T150 PolarHBondContact O-N 3.41Å; Y146-T150 VanDerWaalsContact O-N 3.15Å; Y146-F183 HydrophobicContact CD1-CD1 4.27Å; Y146-F183 AromaticContact CE1-CD1 3.64Å; Y146-F183 HydrophobicContact CE1-CD1 3.64Å; Y146-F183 AromaticContact CE1-CE1 3.64Å; Y146-F183 HydrophobicContact CE1-CE1 3.64Å
147	R	93.2	Very high	94.1	Very high	106 Å²	106	43 Å²	43	40%	0.4	23%	0.23	S	C	.	.	G	3₁₀ helix	trans	-64.2	-35.6	175	-170.1	174.1	-73.4	100.3	-3.4	112.1	L115 D116 Q144 C145	L115-R147 HydrophobicContact CD2-CB 3.86Å; D116-R147 IonicContact OD1-NH2 3.24Å; D116-R147 PolarHBondContact OD1-NH2 2.7Å; D116-R147 IonicContact OD2-CZ 3.76Å; D116-R147 IonicContact OD2-NH2 2.87Å; D116-R147 PolarHBondContact OD2-NH2 2.85Å; Q144-R147 PolarHBondContact O-N 2.79Å; C145-R147 PolarHBondContact O-N 3.08Å
148	N	93.9	Very high	94.3	Very high	52 Å²	52	45 Å²	45	28%	0.278	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97.1	-20.1	179.6	-57.8	-29	0	0	0	113	C145 Y146 N218	C145-N148 PolarHBondContact O-N 2.98Å; Y146-N148 VanDerWaalsContact C-N 3.3Å; Y146-N148 PolarHBondContact O-N 2.86Å; N148-N218 VanDerWaalsContact ND2-CB 3.32Å; N148-N218 WeakPolarHBondContact ND2-CB 3.37Å
149	D	96.6	Very high	94.5	Very high	0 Å²	0	37 Å²	37	0%	0	21%	0.207	C	C	.	.	S	Bend	trans	-133.1	67.6	178.8	-168.4	40.1	0	0	0	111.6	R139 C145 Y146 A182 F183 R184 P220	R139-D149 IonicContact CZ-OD2 3.73Å; R139-D149 PolarHBondContact NH1-O 2.83Å; R139-D149 VanDerWaalsContact NH1-O 3.14Å; R139-D149 IonicContact NH1-OD2 3.96Å; R139-D149 IonicContact NH2-OD2 2.74Å; R139-D149 PolarHBondContact NH2-OD2 2.88Å; C145-D149 PolarHBondContact O-N 2.8Å; Y146-D149 WeakPolarHBondContact CD1-O 3.31Å; Y146-D149 CarbonylContact O-C 3.48Å; D149-A182 WeakPolarHBondContact OD1-CA 3.16Å; D149-F183 PolarHBondContact OD1-N 2.82Å; D149-F183 WeakPolarHBondContact OD2-CB 3.25Å; D149-F183 PolarHBondContact OD2-N 3.43Å; D149-R184 IonicContact OD1-NH1 3.65Å; D149-R184 PolarHBondContact OD1-NH1 2.9Å; D149-R184 VanDerWaalsContact OD1-NH1 3.11Å; D149-P220 HydrophobicContact CB-CB 3.99Å
150	T	96.9	Very high	94.7	Very high	1 Å²	1	36.3 Å²	36.3	1%	0.006	21%	0.205	C	C	.	.	P	Polyproline II helix	trans	-58.1	146.4	-178.3	-169.2	0	0	0	0	113.4	R106 D108 Y146 R184	R106-T150 HydrophobicContact CB-CG2 4.08Å; R106-T150 HydrophobicContact CG-CG2 4.11Å; D108-T150 HydrophobicContact CB-CG2 4.28Å; D108-T150 PolarHBondContact N-OG1 2.78Å; Y146-T150 VanDerWaalsContact O-CA 3.31Å; Y146-T150 WeakPolarHBondContact O-CA 3.34Å; Y146-T150 PolarHBondContact O-N 3.41Å; Y146-T150 VanDerWaalsContact O-N 3.15Å; T150-R184 PolarHBondContact O-N 2.75Å
151	P	97.6	Very high	95	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	18%	0.182	C	C	.	.	P	Polyproline II helix	trans	-71.7	173.9	166.5	33.6	-37.9	0	0	0	113	L107 W114 P133 L136 F183	L107-P151 HydrophobicContact CB-CG 3.92Å; L107-P151 HydrophobicContact CD2-CG 3.58Å; L107-P151 HydrophobicContact CG-CG 4.41Å; L107-P151 PolarHBondContact N-O 3.06Å; L107-P151 VanDerWaalsContact N-O 3.09Å; W114-P151 HydrophobicContact CH2-CG 3.94Å; W114-P151 HydrophobicContact CZ2-CG 4.21Å; P133-P151 HydrophobicContact CG-CB 4.46Å; P133-P151 HydrophobicContact CG-CG 4.26Å; L136-P151 HydrophobicContact CD2-CB 4.39Å; L136-P151 HydrophobicContact CD2-CG 4.09Å; P151-F183 HydrophobicContact CB-CD1 3.9Å; P151-F183 HydrophobicContact CB-CE1 3.77Å
152	I	98.2	Very high	95.3	Very high	5 Å²	5	33.2 Å²	33.2	3%	0.026	17%	0.168	C	C	.	.	B	Isolated β-bridge	trans	-80.2	162.9	158	66.5	-178.2	0	0	0	111.4	A104 E105 N157 R184 Q187	A104-I152 HydrophobicContact CB-CG2 4.12Å; E105-I152 WeakPolarHBondContact O-CA 3.43Å; E105-I152 VanDerWaalsContact O-CB 3.26Å; E105-I152 WeakPolarHBondContact O-CB 3.36Å; I152-N157 HydrophobicContact CD1-CB 4.36Å; I152-R184 HydrophobicContact CG2-CB 3.94Å; I152-R184 WeakPolarHBondContact CG2-O 3.4Å; I152-Q187 HydrophobicContact CD1-CB 3.59Å; I152-Q187 HydrophobicContact CG1-CB 3.72Å; I152-Q187 HydrophobicContact CG2-CB 4.47Å
153	S	96.9	Very high	95.5	Very high	1 Å²	1	32 Å²	32	1%	0.007	15%	0.154	C	C	.	.	P	Polyproline II helix	trans	-79.3	173.6	167.8	65.9	0	0	0	0	112.4	E105 N131 G156 N157	E105-S153 WeakPolarHBondContact CB-OG 3.43Å; E105-S153 VanDerWaalsContact CD-OG 3.32Å; E105-S153 WeakPolarHBondContact CG-OG 3.41Å; E105-S153 PolarHBondContact O-N 3.08Å; E105-S153 WeakPolarHBondContact OE1-CB 3.48Å; E105-S153 PolarHBondContact OE1-OG 2.86Å; N131-S153 CarbonylContact O-C 3.54Å; N131-S153 WeakPolarHBondContact O-CA 3.17Å; N131-S153 VanDerWaalsContact O-CB 3.27Å; N131-S153 WeakPolarHBondContact O-CB 3.28Å; N131-S153 VanDerWaalsContact OD1-CB 3.32Å; N131-S153 WeakPolarHBondContact OD1-CB 2.99Å; N131-S153 PolarHBondContact OD1-OG 3.01Å; S153-G156 CarbonylContact O-C 3.54Å; S153-G156 VanDerWaalsContact O-CA 3.3Å; S153-G156 WeakPolarHBondContact O-CA 3.17Å; S153-G156 PolarHBondContact O-N 3.2Å; S153-G156 VanDerWaalsContact O-N 3.08Å; S153-G156 PolarHBondContact OG-N 3.32Å; S153-N157 PolarHBondContact O-N 3.38Å
154	E	96.2	Very high	95.8	Very high	48 Å²	48	27.8 Å²	27.8	22%	0.224	14%	0.137	C	C	.	.	H	α-helix	trans	-71.3	-32.6	174	-68.9	-67.2	179	0	0	112.2	N131 P133 V134 G156 N157 V158	N131-E154 PolarHBondContact O-N 2.97Å; N131-E154 PolarHBondContact OD1-N 3.2Å; P133-E154 WeakPolarHBondContact CA-OE1 3.48Å; V134-E154 PolarHBondContact N-OE1 3.42Å; E154-G156 PolarHBondContact O-N 2.8Å; E154-N157 WeakPolarHBondContact O-CB 3.36Å; E154-N157 PolarHBondContact O-N 2.93Å; E154-N157 VanDerWaalsContact O-N 3.12Å; E154-N157 PolarHBondContact OE2-ND2 3.14Å; E154-V158 WeakPolarHBondContact O-CG2 3.36Å; E154-V158 PolarHBondContact O-N 3.35Å
155	L	95.1	Very high	95.8	Very high	87 Å²	87	25.5 Å²	25.5	46%	0.455	13%	0.125	S	C	.	.	H	α-helix	trans	-62.7	-31.7	165	-71	176.7	0	0	0	111.5	N131 T159	N131-L155 WeakPolarHBondContact OD1-CB 3.43Å; N131-L155 VanDerWaalsContact OD1-CG 3.29Å; N131-L155 WeakPolarHBondContact OD1-CG 3.31Å; N131-L155 PolarHBondContact OD1-N 2.86Å; L155-T159 WeakPolarHBondContact O-CB 3.3Å; L155-T159 VanDerWaalsContact O-CG2 3.31Å; L155-T159 WeakPolarHBondContact O-CG2 3.41Å; L155-T159 PolarHBondContact O-N 2.88Å; L155-T159 PolarHBondContact O-OG1 3.25Å
156	G	96.7	Very high	95.7	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-62.8	-41.6	169	0	0	0	0	0	113.4	A104 S153 E154 T159 G160	A104-G156 VanDerWaalsContact CB-O 3.28Å; A104-G156 WeakPolarHBondContact CB-O 3.27Å; S153-G156 CarbonylContact O-C 3.54Å; S153-G156 VanDerWaalsContact O-CA 3.3Å; S153-G156 WeakPolarHBondContact O-CA 3.17Å; S153-G156 PolarHBondContact O-N 3.2Å; S153-G156 VanDerWaalsContact O-N 3.08Å; S153-G156 PolarHBondContact OG-N 3.32Å; E154-G156 PolarHBondContact O-N 2.8Å; G156-T159 WeakPolarHBondContact CA-OG1 3.49Å; G156-T159 PolarHBondContact O-OG1 3.44Å; G156-T159 VanDerWaalsContact O-OG1 3.14Å; G156-G160 PolarHBondContact O-N 3.14Å
157	N	96.6	Very high	95.7	Very high	28 Å²	28	25 Å²	25	15%	0.15	12%	0.124	C	C	.	.	H	α-helix	trans	-64.3	-47.6	174.8	177.4	26.5	0	0	0	110.6	I152 S153 E154 G160 M161 S191 K194	I152-N157 HydrophobicContact CD1-CB 4.36Å; S153-N157 PolarHBondContact O-N 3.38Å; E154-N157 WeakPolarHBondContact O-CB 3.36Å; E154-N157 PolarHBondContact O-N 2.93Å; E154-N157 VanDerWaalsContact O-N 3.12Å; E154-N157 PolarHBondContact OE2-ND2 3.14Å; N157-G160 PolarHBondContact O-N 2.9Å; N157-M161 WeakPolarHBondContact O-CG 3.39Å; N157-M161 PolarHBondContact O-N 3.1Å; N157-S191 WeakPolarHBondContact O-CB 3.4Å; N157-S191 WeakPolarHBondContact OD1-CB 3.33Å; N157-S191 PolarHBondContact OD1-OG 3.48Å; N157-K194 PolarHBondContact OD1-NZ 2.96Å
158	V	96.1	Very high	95.7	Very high	54 Å²	54	23 Å²	23	33%	0.327	12%	0.119	S	C	.	.	H	α-helix	trans	-63.4	-44.4	177.2	175.4	0	0	0	0	112.1	M38 E154 M161 M162	M38-V158 HydrophobicContact CE-CG1 3.87Å; E154-V158 WeakPolarHBondContact O-CG2 3.36Å; E154-V158 PolarHBondContact O-N 3.35Å; V158-M161 WeakPolarHBondContact O-CB 3.47Å; V158-M161 PolarHBondContact O-N 3.47Å; V158-M162 HydrophobicContact CG1-CE 4.25Å; V158-M162 WeakPolarHBondContact O-CG 3.38Å; V158-M162 PolarHBondContact O-N 2.89Å
159	T	95.5	Very high	95.4	Very high	7 Å²	7	24.1 Å²	24.1	4%	0.043	12%	0.123	C	C	.	.	H	α-helix	trans	-66.2	-37.3	176.7	51.4	0	0	0	0	112.4	L155 G156 M161 M162 I163 V342 Y344	L155-T159 WeakPolarHBondContact O-CB 3.3Å; L155-T159 VanDerWaalsContact O-CG2 3.31Å; L155-T159 WeakPolarHBondContact O-CG2 3.41Å; L155-T159 PolarHBondContact O-N 2.88Å; L155-T159 PolarHBondContact O-OG1 3.25Å; G156-T159 WeakPolarHBondContact CA-OG1 3.49Å; G156-T159 PolarHBondContact O-OG1 3.44Å; G156-T159 VanDerWaalsContact O-OG1 3.14Å; T159-M161 PolarHBondContact O-N 3.32Å; T159-M162 HydrophobicContact CG2-CE 3.74Å; T159-M162 PolarHBondContact O-N 2.98Å; T159-I163 PolarHBondContact O-N 3.38Å; T159-I163 VanDerWaalsContact O-N 3.14Å; T159-V342 HydrophobicContact CG2-CG1 4.31Å; T159-Y344 HydrophobicContact CG2-CE1 3.99Å
160	G	97	Very high	95	Very high	0 Å²	0	26.4 Å²	26.4	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-59.7	-42.4	171.4	0	0	0	0	0	113.1	G156 N157 G164 L192	G156-G160 PolarHBondContact O-N 3.14Å; N157-G160 PolarHBondContact O-N 2.9Å; G160-G164 PolarHBondContact O-N 3.48Å; G160-L192 WeakPolarHBondContact O-CA 3.32Å
161	M	96.7	Very high	94.7	Very high	15 Å²	15	37.4 Å²	37.4	7%	0.074	18%	0.176	C	C	.	.	H	α-helix	trans	-62.6	-42.5	172.5	-69.4	174.5	179.1	0	0	112.4	L35 M38 N157 V158 T159 I163 G164 R165 S191 K194 T195	L35-M161 HydrophobicContact CD1-CE 3.78Å; L35-M161 HydrophobicContact CD1-SD 4.06Å; M38-M161 HydrophobicContact CE-CB 3.74Å; M38-M161 HydrophobicContact CE-SD 3.97Å; M38-M161 HydrophobicContact SD-SD 3.95Å; N157-M161 WeakPolarHBondContact O-CG 3.39Å; N157-M161 PolarHBondContact O-N 3.1Å; V158-M161 WeakPolarHBondContact O-CB 3.47Å; V158-M161 PolarHBondContact O-N 3.47Å; T159-M161 PolarHBondContact O-N 3.32Å; M161-I163 VanDerWaalsContact C-N 3.34Å; M161-I163 PolarHBondContact O-N 3.23Å; M161-G164 PolarHBondContact O-N 3.3Å; M161-G164 VanDerWaalsContact O-N 3.16Å; M161-R165 PolarHBondContact O-N 2.9Å; M161-S191 WeakPolarHBondContact CG-O 3.35Å; M161-K194 HydrophobicContact CE-CD 3.49Å; M161-K194 VanDerWaalsContact CE-CD 3.49Å; M161-T195 HydrophobicContact CB-CG2 3.81Å; M161-T195 HydrophobicContact CG-CG2 4.16Å; M161-T195 PolarHBondContact O-OG1 2.99Å
162	M	95.6	Very high	94.6	Very high	71 Å²	71	38.4 Å²	38.4	35%	0.35	18%	0.181	S	C	.	.	H	α-helix	trans	-62.1	-39.4	-179.8	-71.9	-169.1	-68.1	0	0	112.4	M38 V158 T159 R165 G166 V342	M38-M162 HydrophobicContact CE-CG 4.05Å; V158-M162 HydrophobicContact CG1-CE 4.25Å; V158-M162 WeakPolarHBondContact O-CG 3.38Å; V158-M162 PolarHBondContact O-N 2.89Å; T159-M162 HydrophobicContact CG2-CE 3.74Å; T159-M162 PolarHBondContact O-N 2.98Å; M162-R165 PolarHBondContact O-N 2.71Å; M162-G166 PolarHBondContact O-N 3.28Å; M162-V342 HydrophobicContact CB-CG2 4.42Å; M162-V342 HydrophobicContact CE-CG1 3.69Å
163	I	95.7	Very high	94.5	Very high	9 Å²	9	39.5 Å²	39.5	5%	0.046	19%	0.186	C	C	.	.	H	α-helix	trans	-64.1	-41.4	173.7	-63.2	-61.3	0	0	0	111.4	M101 T159 M161 G166 M167 L192 C319 V321 L339 V342	M101-I163 HydrophobicContact CE-CB 3.97Å; M101-I163 HydrophobicContact CE-CG1 3.94Å; M101-I163 HydrophobicContact CE-CG2 3.87Å; M101-I163 HydrophobicContact SD-CG2 4.13Å; T159-I163 PolarHBondContact O-N 3.38Å; T159-I163 VanDerWaalsContact O-N 3.14Å; M161-I163 VanDerWaalsContact C-N 3.34Å; M161-I163 PolarHBondContact O-N 3.23Å; I163-G166 CarbonylContact O-C 3.58Å; I163-G166 WeakPolarHBondContact O-CA 3.45Å; I163-G166 PolarHBondContact O-N 2.98Å; I163-M167 PolarHBondContact O-N 3.42Å; I163-L192 HydrophobicContact CG2-CD1 3.95Å; I163-C319 HydrophobicContact CG1-CB 4.07Å; I163-V321 HydrophobicContact CD1-CG2 4.38Å; I163-V321 HydrophobicContact CG2-CG2 3.7Å; I163-L339 HydrophobicContact CG2-CD1 4.14Å; I163-V342 HydrophobicContact CD1-CG2 3.92Å
164	G	96	Very high	94.5	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-65.8	-40.5	176.8	0	0	0	0	0	113.9	G160 M161 G166 M167 K168 T195	G160-G164 PolarHBondContact O-N 3.48Å; M161-G164 PolarHBondContact O-N 3.3Å; M161-G164 VanDerWaalsContact O-N 3.16Å; G164-G166 VanDerWaalsContact C-N 3.29Å; G164-G166 PolarHBondContact O-N 2.96Å; G164-M167 PolarHBondContact O-N 3Å; G164-K168 PolarHBondContact O-N 2.83Å; G164-T195 WeakPolarHBondContact CA-OG1 3.19Å
165	R	92.7	Very high	94.4	Very high	31 Å²	31	39.2 Å²	39.2	12%	0.117	18%	0.183	C	C	.	.	H	α-helix	trans	-57.3	-44.5	169.3	-170.2	-162	-165.9	147.6	7.6	110.4	A37 M38 D40 M161 M162 K168 M169 T195	A37-R165 PolarHBondContact O-NH1 2.93Å; A37-R165 PolarHBondContact O-NH2 3.41Å; M38-R165 WeakPolarHBondContact O-CD 3.43Å; M38-R165 VanDerWaalsContact O-CZ 3.25Å; M38-R165 PolarHBondContact O-NE 3.01Å; M38-R165 PolarHBondContact O-NH1 3.21Å; D40-R165 PolarHBondContact O-NH2 3.18Å; M161-R165 PolarHBondContact O-N 2.9Å; M162-R165 PolarHBondContact O-N 2.71Å; R165-K168 PolarHBondContact O-N 2.78Å; R165-M169 HydrophobicContact CG-CE 4.16Å; R165-M169 HydrophobicContact CG-SD 3.97Å; R165-M169 WeakPolarHBondContact O-CB 3.33Å; R165-M169 VanDerWaalsContact O-CG 3.31Å; R165-M169 WeakPolarHBondContact O-CG 3.27Å; R165-M169 PolarHBondContact O-N 3.23Å; R165-T195 PolarHBondContact N-OG1 3.33Å; R165-T195 VanDerWaalsContact N-OG1 3.14Å
166	G	91.9	Very high	94.6	Very high	10 Å²	10	36.9 Å²	36.9	10%	0.103	17%	0.169	C	C	.	.	H	α-helix	trans	-59.2	-45.6	175	0	0	0	0	0	113.2	M162 I163 G164 M169 N170	M162-G166 PolarHBondContact O-N 3.28Å; I163-G166 CarbonylContact O-C 3.58Å; I163-G166 WeakPolarHBondContact O-CA 3.45Å; I163-G166 PolarHBondContact O-N 2.98Å; G164-G166 VanDerWaalsContact C-N 3.29Å; G164-G166 PolarHBondContact O-N 2.96Å; G166-M169 PolarHBondContact O-N 3.16Å; G166-N170 WeakPolarHBondContact O-CB 3.4Å; G166-N170 PolarHBondContact O-N 3.42Å; G166-N170 PolarHBondContact O-ND2 3.36Å
167	M	94.5	Very high	94.7	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-61	-44.8	175	-71.9	-171	117.4	0	0	112.1	F99 I163 G164 N170 R171 Q172 L192 L281 L339	F99-M167 HydrophobicContact CB-CE 3.93Å; F99-M167 HydrophobicContact CD1-CE 3.87Å; F99-M167 HydrophobicContact CD2-CE 4.09Å; F99-M167 HydrophobicContact CE1-CE 4.41Å; F99-M167 HydrophobicContact CG-CE 3.68Å; I163-M167 PolarHBondContact O-N 3.42Å; G164-M167 PolarHBondContact O-N 3Å; M167-N170 PolarHBondContact O-N 2.96Å; M167-R171 PolarHBondContact O-N 3.41Å; M167-R171 VanDerWaalsContact O-N 3.15Å; M167-Q172 PolarHBondContact O-N 3.21Å; M167-L192 HydrophobicContact SD-CD1 4.17Å; M167-L281 HydrophobicContact CE-CD1 4.21Å; M167-L281 HydrophobicContact SD-CD2 4.37Å; M167-L339 HydrophobicContact CG-CD1 3.65Å; M167-L339 HydrophobicContact CG-CD2 4.29Å
168	K	92.7	Very high	94.8	Very high	65 Å²	65	35.6 Å²	35.6	28%	0.283	16%	0.162	S	C	.	.	H	α-helix	trans	-60.2	-52.4	175.8	176.7	169.3	-179.4	-175.8	0	112	G164 R165 N170 R171 E173 T195 E197	G164-K168 PolarHBondContact O-N 2.83Å; R165-K168 PolarHBondContact O-N 2.78Å; K168-N170 VanDerWaalsContact C-N 3.3Å; K168-N170 PolarHBondContact O-N 2.85Å; K168-R171 PolarHBondContact O-N 2.99Å; K168-E173 HydrophobicContact CB-CG 4.27Å; K168-E173 WeakPolarHBondContact CB-OE2 3.41Å; K168-E173 VanDerWaalsContact CG-OE2 3.25Å; K168-E173 WeakPolarHBondContact CG-OE2 3.46Å; K168-T195 WeakPolarHBondContact CD-O 3.46Å; K168-E197 HydrophobicContact CD-CB 4.43Å
169	M	88.6	Confident	94.9	Very high	75 Å²	75	33 Å²	33	37%	0.369	15%	0.147	S	C	.	.	H	α-helix	trans	-56.2	-41.6	178.7	-75.6	170.7	153.6	0	0	112.6	R165 G166 R171	R165-M169 HydrophobicContact CG-CE 4.16Å; R165-M169 HydrophobicContact CG-SD 3.97Å; R165-M169 WeakPolarHBondContact O-CB 3.33Å; R165-M169 VanDerWaalsContact O-CG 3.31Å; R165-M169 WeakPolarHBondContact O-CG 3.27Å; R165-M169 PolarHBondContact O-N 3.23Å; G166-M169 PolarHBondContact O-N 3.16Å; M169-R171 VanDerWaalsContact C-N 3.3Å; M169-R171 PolarHBondContact O-N 3.46Å
170	N	88.2	Confident	95	Very high	48 Å²	48	32.7 Å²	32.7	26%	0.257	15%	0.145	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.2	3.3	179.8	-70.8	-82.1	0	0	0	114.1	G166 M167 K168 Q172 L339	G166-N170 WeakPolarHBondContact O-CB 3.4Å; G166-N170 PolarHBondContact O-N 3.42Å; G166-N170 PolarHBondContact O-ND2 3.36Å; M167-N170 PolarHBondContact O-N 2.96Å; K168-N170 VanDerWaalsContact C-N 3.3Å; K168-N170 PolarHBondContact O-N 2.85Å; N170-Q172 VanDerWaalsContact C-N 3.26Å; N170-Q172 HydrophobicContact CB-CG 4.02Å; N170-Q172 PolarHBondContact O-N 3.49Å; N170-L339 HydrophobicContact CB-CD2 4.23Å
171	R	91	Very high	95.1	Very high	231 Å²	231	33 Å²	33	87%	0.872	15%	0.147	S	C	*	.	T	Hydrogen-bonded Turn	trans	57.9	34.5	-175	-52.4	-178.4	-178.1	-175.3	-0.3	113.7	M167 K168 M169	M167-R171 PolarHBondContact O-N 3.41Å; M167-R171 VanDerWaalsContact O-N 3.15Å; K168-R171 PolarHBondContact O-N 2.99Å; M169-R171 VanDerWaalsContact C-N 3.3Å; M169-R171 PolarHBondContact O-N 3.46Å
172	Q	93.8	Very high	95.2	Very high	21 Å²	21	32.3 Å²	32.3	10%	0.098	14%	0.144	C	C	.	.			trans	-107.2	16.4	-177.8	-66.4	176.6	9.7	0	0	113.3	F99 M167 N170 N279 A338	F99-Q172 HydrophobicContact CE1-CB 4.47Å; F99-Q172 HydrophobicContact CE2-CB 4.49Å; F99-Q172 HydrophobicContact CZ-CB 3.95Å; F99-Q172 HydrophobicContact CZ-CG 3.97Å; F99-Q172 VanDerWaalsContact CZ-OE1 3.31Å; M167-Q172 PolarHBondContact O-N 3.21Å; N170-Q172 VanDerWaalsContact C-N 3.26Å; N170-Q172 HydrophobicContact CB-CG 4.02Å; N170-Q172 PolarHBondContact O-N 3.49Å; Q172-N279 VanDerWaalsContact C-ND2 3.26Å; Q172-N279 WeakPolarHBondContact CA-ND2 3.49Å; Q172-N279 PolarHBondContact O-ND2 3.06Å; Q172-A338 PolarHBondContact NE2-O 2.63Å; Q172-A338 PolarHBondContact OE1-O 2.71Å
173	E	96	Very high	95.3	Very high	29 Å²	29	29 Å²	29	14%	0.136	13%	0.127	C	C	.	.			trans	-54.5	138.4	179.2	-62.1	-163.4	22.7	0	0	111.9	K168 L196 E197 K198 N279	K168-E173 HydrophobicContact CB-CG 4.27Å; K168-E173 WeakPolarHBondContact CB-OE2 3.41Å; K168-E173 VanDerWaalsContact CG-OE2 3.25Å; K168-E173 WeakPolarHBondContact CG-OE2 3.46Å; E173-L196 HydrophobicContact CB-CD2 4.3Å; E173-L196 HydrophobicContact CG-CD2 3.88Å; E173-L196 WeakPolarHBondContact OE1-CB 3.47Å; E173-E197 VanDerWaalsContact CD-N 3.33Å; E173-E197 PolarHBondContact OE1-N 2.87Å; E173-E197 VanDerWaalsContact OE2-CB 3.3Å; E173-E197 WeakPolarHBondContact OE2-CB 3.4Å; E173-E197 PolarHBondContact OE2-N 2.92Å; E173-K198 PolarHBondContact OE1-N 2.83Å; E173-N279 PolarHBondContact O-ND2 2.94Å
174	P	97.1	Very high	95.4	Very high	1 Å²	1	28.5 Å²	28.5	1%	0.006	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.3	145.5	178.7	27.7	-33.4	0	0	0	112.1	I177 L196 I201 N279 L281	P174-I177 HydrophobicContact CB-CG1 3.93Å; P174-I177 HydrophobicContact CG-CD1 3.88Å; P174-I177 HydrophobicContact CG-CG1 3.79Å; P174-L196 HydrophobicContact CG-CD1 4.23Å; P174-I201 WeakPolarHBondContact O-CD1 3.45Å; P174-N279 CarbonylContact C-O 3.48Å; P174-N279 WeakPolarHBondContact CA-O 3.45Å; P174-L281 HydrophobicContact CB-CB 3.79Å; P174-L281 HydrophobicContact CG-CB 4.12Å; P174-L281 HydrophobicContact CG-CD2 4.18Å
175	Y	95.9	Very high	95.6	Very high	41 Å²	41	28.5 Å²	28.5	16%	0.161	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	-30.5	160.8	79	-83.6	0	0	0	111	E276 N279 M280	Y175-E276 HydrophobicContact CD2-CG 4.4Å; Y175-E276 WeakPolarHBondContact CD2-OE2 3.4Å; Y175-E276 HydrophobicContact CE2-CB 3.77Å; Y175-E276 HydrophobicContact CE2-CG 4.14Å; Y175-E276 PolarHBondContact OH-O 3.37Å; Y175-N279 WeakPolarHBondContact CD1-O 3.49Å; Y175-N279 PolarHBondContact N-O 3.34Å; Y175-M280 HydrophobicContact CE1-CG 3.66Å
176	K	97.6	Very high	95.9	Very high	38 Å²	38	27.1 Å²	27.1	17%	0.165	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	138.7	-179.5	-162.5	68.5	170.9	174.8	0	110.8	Y178 C204 E274 M280 L281	K176-Y178 WeakPolarHBondContact CE-OH 3.48Å; K176-Y178 HydrophobicContact CG-CD2 4.35Å; K176-Y178 HydrophobicContact CG-CE2 3.53Å; K176-C204 PolarHBondContact NZ-SG 3.37Å; K176-E274 VanDerWaalsContact CE-OE2 3.28Å; K176-E274 WeakPolarHBondContact CE-OE2 3.47Å; K176-M280 HydrophobicContact CB-CG 4.22Å; K176-M280 WeakPolarHBondContact O-CA 3.3Å; K176-L281 PolarHBondContact O-N 3.46Å
177	I	98.5	Very high	96.2	Very high	0 Å²	0	27.5 Å²	27.5	0%	0	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	127.5	179.1	-60.7	-178.9	0	0	0	109.5	P174 C189 Q193 I201 M203 C204 L281	P174-I177 HydrophobicContact CB-CG1 3.93Å; P174-I177 HydrophobicContact CG-CD1 3.88Å; P174-I177 HydrophobicContact CG-CG1 3.79Å; I177-C189 WeakPolarHBondContact CG2-SG 3.31Å; I177-Q193 HydrophobicContact CD1-CG 4.28Å; I177-I201 HydrophobicContact CD1-CB 4.44Å; I177-I201 HydrophobicContact CD1-CG2 3.55Å; I177-I201 HydrophobicContact CG1-CG2 3.7Å; I177-M203 HydrophobicContact CG2-CG 4.04Å; I177-C204 WeakPolarHBondContact O-CB 3.42Å; I177-C204 PolarHBondContact O-N 3.3Å; I177-L281 CarbonylContact C-O 3.55Å; I177-L281 WeakPolarHBondContact CA-O 3.32Å; I177-L281 HydrophobicContact CG1-CB 4.35Å; I177-L281 HydrophobicContact CG1-CD2 4.49Å
178	Y	98.8	Very high	96.4	Very high	1 Å²	1	27.5 Å²	27.5	0%	0.004	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	140.9	165.8	-64.9	-85	0	0	0	109.8	K176 C204 E206 F209 Y239 I270 E274 L281 F282 V283	K176-Y178 WeakPolarHBondContact CE-OH 3.48Å; K176-Y178 HydrophobicContact CG-CD2 4.35Å; K176-Y178 HydrophobicContact CG-CE2 3.53Å; Y178-C204 WeakPolarHBondContact CA-O 3.36Å; Y178-C204 HydrophobicContact CD1-CB 3.7Å; Y178-C204 HydrophobicContact CE1-CB 3.77Å; Y178-C204 HydrophobicContact CG-CB 4.49Å; Y178-E206 HydrophobicContact CD1-CB 4.5Å; Y178-F209 HydrophobicContact CG-CE2 4.46Å; Y178-Y239 AromaticContact CE1-CE2 3.85Å; Y178-Y239 HydrophobicContact CE1-CE2 3.85Å; Y178-Y239 AromaticContact CE1-CZ 3.79Å; Y178-Y239 WeakPolarHBondContact CE1-OH 3.17Å; Y178-I270 HydrophobicContact CD1-CD1 3.7Å; Y178-I270 HydrophobicContact CD1-CG1 4.42Å; Y178-I270 HydrophobicContact CD2-CG2 4.12Å; Y178-I270 HydrophobicContact CE1-CD1 3.64Å; Y178-I270 HydrophobicContact CE1-CG1 3.86Å; Y178-I270 HydrophobicContact CE1-CG2 4.33Å; Y178-I270 HydrophobicContact CE2-CG2 3.49Å; Y178-I270 VanDerWaalsContact CE2-CG2 3.49Å; Y178-I270 HydrophobicContact CG-CD1 4.18Å; Y178-E274 HydrophobicContact CE2-CG 4.42Å; Y178-E274 WeakPolarHBondContact OH-CG 3.42Å; Y178-E274 PolarHBondContact OH-OE1 3.19Å; Y178-L281 PolarHBondContact N-O 3.21Å; Y178-F282 HydrophobicContact CD2-CD1 4.15Å; Y178-F282 AromaticContact CD2-CE1 3.57Å; Y178-F282 HydrophobicContact CD2-CE1 3.57Å; Y178-F282 HydrophobicContact CD2-CE2 4.35Å; Y178-F282 AromaticContact CD2-CZ 3.69Å; Y178-F282 HydrophobicContact CD2-CZ 3.69Å; Y178-F282 HydrophobicContact CE2-CE1 4.39Å; Y178-F282 HydrophobicContact CE2-CZ 4.24Å; Y178-F282 HydrophobicContact CG-CD1 4.18Å; Y178-F282 AromaticContact CG-CE1 3.85Å; Y178-F282 HydrophobicContact CG-CE1 3.85Å; Y178-F282 HydrophobicContact CG-CZ 4.43Å; Y178-F282 CarbonylContact O-C 3.55Å; Y178-F282 WeakPolarHBondContact O-CA 3.47Å; Y178-V283 PolarHBondContact O-N 3.06Å
179	V	98.9	Very high	96.6	Very high	0 Å²	0	24.4 Å²	24.4	0%	0	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	139.7	-178.8	69.1	0	0	0	0	111.1	C185 I186 C189 M203 C204 V205 E206 V283	V179-C185 HydrophobicContact CG2-CB 3.77Å; V179-I186 HydrophobicContact CG1-CG1 4.27Å; V179-I186 HydrophobicContact CG2-CG1 4.09Å; V179-C189 HydrophobicContact CG2-CB 4.32Å; V179-M203 HydrophobicContact CG1-CB 3.83Å; V179-M203 HydrophobicContact CG1-CG 4.24Å; V179-M203 HydrophobicContact CG1-SD 4.22Å; V179-C204 PolarHBondContact N-O 3.47Å; V179-V205 HydrophobicContact CG1-CB 4.33Å; V179-V205 HydrophobicContact CG1-CG2 3.87Å; V179-V205 WeakPolarHBondContact O-CA 3.48Å; V179-E206 PolarHBondContact O-N 2.92Å; V179-V283 WeakPolarHBondContact CA-O 3.47Å; V179-V283 HydrophobicContact CG2-CB 4.05Å; V179-V283 HydrophobicContact CG2-CG1 4.48Å
180	S	98.8	Very high	97.1	Very high	0 Å²	0	22.6 Å²	22.6	0%	0	10%	0.096	C	C	.	.			trans	-62.7	144.5	168.9	177.1	0	0	0	0	110.5	A182 F210 V283 H285	S180-A182 PolarHBondContact O-N 2.87Å; S180-F210 WeakPolarHBondContact OG-CA 3.4Å; S180-V283 PolarHBondContact N-O 2.86Å; S180-H285 WeakPolarHBondContact CB-NE2 3.47Å; S180-H285 PolarHBondContact OG-NE2 3.47Å
181	P	98.2	Very high	97.5	Very high	8 Å²	8	20.4 Å²	20.4	5%	0.052	9%	0.085	C	C	.	.	S	Bend	trans	-66.5	-6.8	178.7	30.2	-40.5	0	0	0	114.6	F183 I186 V205 E206 P207 F210 W222	P181-F183 PolarHBondContact O-N 3.22Å; P181-I186 WeakPolarHBondContact O-CD1 3.37Å; P181-V205 HydrophobicContact CB-CG1 3.81Å; P181-E206 WeakPolarHBondContact CD-O 3.39Å; P181-P207 HydrophobicContact CG-CB 4.31Å; P181-P207 HydrophobicContact CG-CG 4.44Å; P181-F210 HydrophobicContact CG-CB 4.25Å; P181-F210 HydrophobicContact CG-CD2 4.33Å; P181-W222 HydrophobicContact CB-CB 4.22Å; P181-W222 HydrophobicContact CB-CD2 3.65Å; P181-W222 HydrophobicContact CB-CE3 3.85Å; P181-W222 HydrophobicContact CB-CG 3.82Å; P181-W222 HydrophobicContact CB-CZ3 4.48Å; P181-W222 HydrophobicContact CG-CD2 3.64Å; P181-W222 HydrophobicContact CG-CE3 3.76Å; P181-W222 HydrophobicContact CG-CG 4.24Å; P181-W222 HydrophobicContact CG-CH2 4Å; P181-W222 HydrophobicContact CG-CZ2 3.89Å; P181-W222 HydrophobicContact CG-CZ3 3.93Å
182	A	98.3	Very high	97.8	Very high	0 Å²	0	9.4 Å²	9.4	0%	0	4%	0.043	C	C	.	.	S	Bend	trans	-61.4	131	174.2	0	0	0	0	0	111.6	D149 S180 R184 C185 I186 F210 H285	D149-A182 WeakPolarHBondContact OD1-CA 3.16Å; S180-A182 PolarHBondContact O-N 2.87Å; A182-R184 VanDerWaalsContact C-N 3.27Å; A182-R184 HydrophobicContact CB-CG 4.12Å; A182-R184 PolarHBondContact O-N 3.02Å; A182-C185 HydrophobicContact CB-CB 4.47Å; A182-C185 WeakPolarHBondContact O-CB 3.12Å; A182-C185 PolarHBondContact O-N 2.85Å; A182-I186 PolarHBondContact O-N 3.09Å; A182-F210 HydrophobicContact CB-CD2 4.04Å; A182-F210 HydrophobicContact CB-CE2 3.88Å; A182-H285 VanDerWaalsContact CB-CE1 3.47Å; A182-H285 WeakPolarHBondContact CB-CE1 3.41Å
183	F	98.2	Very high	97.9	Very high	0 Å²	0	8.6 Å²	8.6	0%	0	4%	0.039	C	C	.	.	H	α-helix	trans	-58.5	-39.4	-173	-174.5	-138.5	0	0	0	112.8	P137 Y146 D149 P151 P181 C185 I186 Q187 L223 Y233	P137-F183 HydrophobicContact CG-CE1 4.41Å; P137-F183 HydrophobicContact CG-CE2 4.1Å; P137-F183 HydrophobicContact CG-CZ 3.58Å; Y146-F183 HydrophobicContact CD1-CD1 4.27Å; Y146-F183 AromaticContact CE1-CD1 3.64Å; Y146-F183 HydrophobicContact CE1-CD1 3.64Å; Y146-F183 AromaticContact CE1-CE1 3.64Å; Y146-F183 HydrophobicContact CE1-CE1 3.64Å; D149-F183 PolarHBondContact OD1-N 2.82Å; D149-F183 WeakPolarHBondContact OD2-CB 3.25Å; D149-F183 PolarHBondContact OD2-N 3.43Å; P151-F183 HydrophobicContact CB-CD1 3.9Å; P151-F183 HydrophobicContact CB-CE1 3.77Å; P181-F183 PolarHBondContact O-N 3.22Å; F183-C185 VanDerWaalsContact C-N 3.31Å; F183-C185 PolarHBondContact O-N 2.82Å; F183-I186 PolarHBondContact O-N 2.84Å; F183-I186 VanDerWaalsContact O-N 3.17Å; F183-Q187 HydrophobicContact CD1-CG 4.46Å; F183-Q187 HydrophobicContact CD2-CG 3.83Å; F183-Q187 VanDerWaalsContact CE1-CD 3.45Å; F183-Q187 HydrophobicContact CE1-CG 4.15Å; F183-Q187 HydrophobicContact CE2-CG 3.45Å; F183-Q187 VanDerWaalsContact CE2-CG 3.45Å; F183-Q187 HydrophobicContact CG-CG 4.32Å; F183-Q187 HydrophobicContact CZ-CG 3.63Å; F183-Q187 WeakPolarHBondContact O-CG 3.44Å; F183-Q187 PolarHBondContact O-N 2.83Å; F183-L223 HydrophobicContact CB-CD1 4.35Å; F183-L223 HydrophobicContact CD1-CD1 4.46Å; F183-L223 HydrophobicContact CD2-CD1 3.26Å; F183-L223 HydrophobicContact CE2-CD1 3.5Å; F183-L223 HydrophobicContact CG-CD1 3.8Å; F183-L223 HydrophobicContact CZ-CD1 4.21Å; F183-Y233 HydrophobicContact CE2-CE1 4.34Å; F183-Y233 HydrophobicContact CE2-CE2 4.14Å; F183-Y233 AromaticContact CE2-CZ 3.74Å; F183-Y233 WeakPolarHBondContact CE2-OH 3.4Å
184	R	98.5	Very high	97.9	Very high	0 Å²	0	10.2 Å²	10.2	0%	0	5%	0.046	C	C	.	.	H	α-helix	trans	-52.6	-40.6	171.5	62.6	-167	156.3	-72.7	-0	114.2	N103 D149 T150 I152 A182 T188 E211 Y216	N103-R184 HydrophobicContact CB-CB 4.37Å; N103-R184 HydrophobicContact CB-CG 4.15Å; D149-R184 IonicContact OD1-NH1 3.65Å; D149-R184 PolarHBondContact OD1-NH1 2.9Å; D149-R184 VanDerWaalsContact OD1-NH1 3.11Å; T150-R184 PolarHBondContact O-N 2.75Å; I152-R184 HydrophobicContact CG2-CB 3.94Å; I152-R184 WeakPolarHBondContact CG2-O 3.4Å; A182-R184 VanDerWaalsContact C-N 3.27Å; A182-R184 HydrophobicContact CB-CG 4.12Å; A182-R184 PolarHBondContact O-N 3.02Å; R184-T188 WeakPolarHBondContact O-CB 3.47Å; R184-T188 PolarHBondContact O-N 2.77Å; R184-T188 VanDerWaalsContact O-N 3.09Å; R184-T188 PolarHBondContact O-OG1 3.4Å; R184-E211 IonicContact CZ-OE1 3.11Å; R184-E211 IonicContact NE-OE1 3.68Å; R184-E211 IonicContact NH2-OE1 3.37Å; R184-E211 PolarHBondContact NH2-OE1 2.71Å; R184-Y216 PolarHBondContact NH2-OH 3.44Å
185	C	98.8	Very high	97.7	Very high	0 Å²	0	10.3 Å²	10.3	0%	0	5%	0.046	C	C	.	.	H	α-helix	trans	-71.6	-43.1	178.7	-61.6	0	0	0	0	110.8	V179 A182 F183 T188 C189 V283 H285	V179-C185 HydrophobicContact CG2-CB 3.77Å; A182-C185 HydrophobicContact CB-CB 4.47Å; A182-C185 WeakPolarHBondContact O-CB 3.12Å; A182-C185 PolarHBondContact O-N 2.85Å; F183-C185 VanDerWaalsContact C-N 3.31Å; F183-C185 PolarHBondContact O-N 2.82Å; C185-T188 PolarHBondContact O-N 3.43Å; C185-C189 PolarHBondContact O-N 2.95Å; C185-V283 HydrophobicContact CB-CG1 4.35Å; C185-V283 WeakPolarHBondContact O-CG1 3.39Å; C185-H285 VanDerWaalsContact SG-CE1 3.55Å
186	I	98.7	Very high	97.6	Very high	1 Å²	1	8.5 Å²	8.5	1%	0.005	4%	0.039	C	C	.	.	H	α-helix	trans	-62.9	-46.2	178.5	-60.5	167.9	0	0	0	111	V179 P181 A182 F183 C189 H190 M203 L228 Y233	V179-I186 HydrophobicContact CG1-CG1 4.27Å; V179-I186 HydrophobicContact CG2-CG1 4.09Å; P181-I186 WeakPolarHBondContact O-CD1 3.37Å; A182-I186 PolarHBondContact O-N 3.09Å; F183-I186 PolarHBondContact O-N 2.84Å; F183-I186 VanDerWaalsContact O-N 3.17Å; I186-C189 PolarHBondContact O-N 2.92Å; I186-H190 VanDerWaalsContact O-CB 3.31Å; I186-H190 WeakPolarHBondContact O-CB 3.2Å; I186-H190 PolarHBondContact O-N 2.83Å; I186-M203 HydrophobicContact CG2-CE 4.12Å; I186-M203 HydrophobicContact CG2-SD 4.16Å; I186-L228 HydrophobicContact CD1-CD1 3.8Å; I186-L228 HydrophobicContact CD1-CD2 4.15Å; I186-L228 HydrophobicContact CG2-CD2 3.95Å; I186-Y233 HydrophobicContact CG2-CD1 3.74Å; I186-Y233 HydrophobicContact CG2-CE1 4.28Å; I186-Y233 HydrophobicContact CG2-CG 4.25Å
187	Q	98.3	Very high	97.3	Very high	19 Å²	19	13.6 Å²	13.6	9%	0.089	6%	0.064	C	C	.	.	H	α-helix	trans	-65.5	-39.2	176.5	-69.5	-174.6	-64.9	0	0	112.8	I152 F183 C189 H190 S191 Y233	I152-Q187 HydrophobicContact CD1-CB 3.59Å; I152-Q187 HydrophobicContact CG1-CB 3.72Å; I152-Q187 HydrophobicContact CG2-CB 4.47Å; F183-Q187 HydrophobicContact CD1-CG 4.46Å; F183-Q187 HydrophobicContact CD2-CG 3.83Å; F183-Q187 VanDerWaalsContact CE1-CD 3.45Å; F183-Q187 HydrophobicContact CE1-CG 4.15Å; F183-Q187 HydrophobicContact CE2-CG 3.45Å; F183-Q187 VanDerWaalsContact CE2-CG 3.45Å; F183-Q187 HydrophobicContact CG-CG 4.32Å; F183-Q187 HydrophobicContact CZ-CG 3.63Å; F183-Q187 WeakPolarHBondContact O-CG 3.44Å; F183-Q187 PolarHBondContact O-N 2.83Å; Q187-C189 VanDerWaalsContact C-N 3.33Å; Q187-C189 PolarHBondContact O-N 2.86Å; Q187-H190 PolarHBondContact O-N 2.81Å; Q187-S191 WeakPolarHBondContact O-CB 3.44Å; Q187-S191 PolarHBondContact O-N 3Å; Q187-S191 PolarHBondContact O-OG 3.25Å; Q187-Y233 HydrophobicContact CG-CE1 4.02Å
188	T	98.7	Very high	96.9	Very high	0 Å²	0	20 Å²	20	0%	0	9%	0.091	C	C	.	.	H	α-helix	trans	-58.3	-49.1	175.5	-57.7	0	0	0	0	110.2	M101 N103 A104 R184 C185 S191 L192 V283	M101-T188 HydrophobicContact CE-CG2 3.53Å; M101-T188 HydrophobicContact SD-CG2 4.19Å; N103-T188 WeakPolarHBondContact CA-OG1 3.5Å; A104-T188 HydrophobicContact CB-CG2 4.08Å; A104-T188 PolarHBondContact N-OG1 3.15Å; R184-T188 WeakPolarHBondContact O-CB 3.47Å; R184-T188 PolarHBondContact O-N 2.77Å; R184-T188 VanDerWaalsContact O-N 3.09Å; R184-T188 PolarHBondContact O-OG1 3.4Å; C185-T188 PolarHBondContact O-N 3.43Å; T188-S191 PolarHBondContact O-N 3.35Å; T188-L192 PolarHBondContact O-N 3.16Å; T188-L192 VanDerWaalsContact O-N 3.1Å; T188-V283 HydrophobicContact CG2-CG1 4.13Å
189	C	98.6	Very high	96.2	Very high	0 Å²	0	24 Å²	24	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-66.6	-37.9	178.6	-169.1	0	0	0	0	112.8	I177 V179 C185 I186 Q187 S191 L192 Q193 M203 V283	I177-C189 WeakPolarHBondContact CG2-SG 3.31Å; V179-C189 HydrophobicContact CG2-CB 4.32Å; C185-C189 PolarHBondContact O-N 2.95Å; I186-C189 PolarHBondContact O-N 2.92Å; Q187-C189 VanDerWaalsContact C-N 3.33Å; Q187-C189 PolarHBondContact O-N 2.86Å; C189-S191 VanDerWaalsContact C-N 3.32Å; C189-S191 PolarHBondContact O-N 3.14Å; C189-L192 WeakPolarHBondContact O-CB 3.03Å; C189-L192 PolarHBondContact O-N 3.04Å; C189-Q193 WeakPolarHBondContact O-CB 3.5Å; C189-Q193 WeakPolarHBondContact O-CG 3.44Å; C189-Q193 PolarHBondContact O-N 3.45Å; C189-M203 HydrophobicContact CB-CG 4.34Å; C189-M203 HydrophobicContact CB-SD 3.67Å; C189-V283 HydrophobicContact CB-CB 4.16Å; C189-V283 HydrophobicContact CB-CG1 4.25Å; C189-V283 HydrophobicContact CB-CG2 3.86Å
190	H	97.6	Very high	95.7	Very high	36 Å²	36	31.3 Å²	31.3	17%	0.167	15%	0.149	C	C	.	.	H	α-helix	trans	-64.6	-37	176.3	178.9	64.1	0	0	0	112.2	I186 Q187 Q193 K194 Y233	I186-H190 VanDerWaalsContact O-CB 3.31Å; I186-H190 WeakPolarHBondContact O-CB 3.2Å; I186-H190 PolarHBondContact O-N 2.83Å; Q187-H190 PolarHBondContact O-N 2.81Å; H190-Q193 PolarHBondContact O-N 3.06Å; H190-K194 WeakPolarHBondContact O-CG 3.45Å; H190-K194 PolarHBondContact O-N 3.07Å; H190-Y233 HydrophobicContact CB-CD1 3.71Å; H190-Y233 HydrophobicContact CB-CE1 3.88Å; H190-Y233 AromaticContact CD2-CE1 3.85Å; H190-Y233 AromaticContact CG-CD1 3.68Å; H190-Y233 AromaticContact CG-CE1 3.84Å
191	S	97.3	Very high	95.5	Very high	3 Å²	3	32.2 Å²	32.2	2%	0.021	15%	0.154	C	C	.	.	H	α-helix	trans	-66.9	-42.7	175.6	-52.1	0	0	0	0	111.4	N157 M161 Q187 T188 C189 K194	N157-S191 WeakPolarHBondContact O-CB 3.4Å; N157-S191 WeakPolarHBondContact OD1-CB 3.33Å; N157-S191 PolarHBondContact OD1-OG 3.48Å; M161-S191 WeakPolarHBondContact CG-O 3.35Å; Q187-S191 WeakPolarHBondContact O-CB 3.44Å; Q187-S191 PolarHBondContact O-N 3Å; Q187-S191 PolarHBondContact O-OG 3.25Å; T188-S191 PolarHBondContact O-N 3.35Å; C189-S191 VanDerWaalsContact C-N 3.32Å; C189-S191 PolarHBondContact O-N 3.14Å; S191-K194 WeakPolarHBondContact O-CB 3.48Å; S191-K194 PolarHBondContact O-N 3.23Å
192	L	97.2	Very high	95.5	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-58.7	-46.2	171.4	-179.6	152.9	0	0	0	112	M101 G160 I163 M167 T188 C189 K194 T195 L196 L281	M101-L192 HydrophobicContact CE-CD1 4.38Å; M101-L192 HydrophobicContact SD-CD1 3.7Å; G160-L192 WeakPolarHBondContact O-CA 3.32Å; I163-L192 HydrophobicContact CG2-CD1 3.95Å; M167-L192 HydrophobicContact SD-CD1 4.17Å; T188-L192 PolarHBondContact O-N 3.16Å; T188-L192 VanDerWaalsContact O-N 3.1Å; C189-L192 WeakPolarHBondContact O-CB 3.03Å; C189-L192 PolarHBondContact O-N 3.04Å; L192-K194 PolarHBondContact O-N 3.21Å; L192-K194 VanDerWaalsContact O-N 3.11Å; L192-T195 PolarHBondContact O-N 3.27Å; L192-T195 VanDerWaalsContact O-N 3.09Å; L192-T195 PolarHBondContact O-OG1 3.38Å; L192-L196 HydrophobicContact CD2-CD1 3.95Å; L192-L196 HydrophobicContact CD2-CD2 4.07Å; L192-L196 HydrophobicContact CD2-CG 4.13Å; L192-L281 HydrophobicContact CD1-CD2 3.87Å; L192-L281 HydrophobicContact CD2-CD2 3.89Å
193	Q	96.5	Very high	95.5	Very high	3 Å²	3	36.9 Å²	36.9	1%	0.014	17%	0.173	C	C	.	.	H	α-helix	trans	-59.5	-20.1	178.1	-80.4	175.1	-34.7	0	0	114.5	I177 C189 H190 T195 I201	I177-Q193 HydrophobicContact CD1-CG 4.28Å; C189-Q193 WeakPolarHBondContact O-CB 3.5Å; C189-Q193 WeakPolarHBondContact O-CG 3.44Å; C189-Q193 PolarHBondContact O-N 3.45Å; H190-Q193 PolarHBondContact O-N 3.06Å; Q193-T195 VanDerWaalsContact C-N 3.3Å; Q193-I201 PolarHBondContact NE2-O 3.2Å
194	K	94.7	Very high	95.6	Very high	64 Å²	64	36.9 Å²	36.9	28%	0.278	17%	0.174	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.9	-29.5	176.4	-65.4	166.1	-167.8	173.7	0	112	N157 M161 H190 S191 L192 Q199	N157-K194 PolarHBondContact OD1-NZ 2.96Å; M161-K194 HydrophobicContact CE-CD 3.49Å; M161-K194 VanDerWaalsContact CE-CD 3.49Å; H190-K194 WeakPolarHBondContact O-CG 3.45Å; H190-K194 PolarHBondContact O-N 3.07Å; S191-K194 WeakPolarHBondContact O-CB 3.48Å; S191-K194 PolarHBondContact O-N 3.23Å; L192-K194 PolarHBondContact O-N 3.21Å; L192-K194 VanDerWaalsContact O-N 3.11Å; K194-Q199 PolarHBondContact O-NE2 2.98Å
195	T	94.4	Very high	95.6	Very high	2 Å²	2	37.6 Å²	37.6	1%	0.012	18%	0.178	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.1	-12.9	-173.9	58.3	0	0	0	0	115.7	T39 M161 G164 R165 K168 L192 Q193	T39-T195 HydrophobicContact CG2-CG2 3.98Å; M161-T195 HydrophobicContact CB-CG2 3.81Å; M161-T195 HydrophobicContact CG-CG2 4.16Å; M161-T195 PolarHBondContact O-OG1 2.99Å; G164-T195 WeakPolarHBondContact CA-OG1 3.19Å; R165-T195 PolarHBondContact N-OG1 3.33Å; R165-T195 VanDerWaalsContact N-OG1 3.14Å; K168-T195 WeakPolarHBondContact CD-O 3.46Å; L192-T195 PolarHBondContact O-N 3.27Å; L192-T195 VanDerWaalsContact O-N 3.09Å; L192-T195 PolarHBondContact O-OG1 3.38Å; Q193-T195 VanDerWaalsContact C-N 3.3Å
196	L	93.6	Very high	95.6	Very high	4 Å²	4	37.6 Å²	37.6	2%	0.021	18%	0.178	C	C	.	.			trans	-64.9	148.9	177.5	-61.3	-177.3	0	0	0	111.4	E173 P174 L192 Q199 I201	E173-L196 HydrophobicContact CB-CD2 4.3Å; E173-L196 HydrophobicContact CG-CD2 3.88Å; E173-L196 WeakPolarHBondContact OE1-CB 3.47Å; P174-L196 HydrophobicContact CG-CD1 4.23Å; L192-L196 HydrophobicContact CD2-CD1 3.95Å; L192-L196 HydrophobicContact CD2-CD2 4.07Å; L192-L196 HydrophobicContact CD2-CG 4.13Å; L196-Q199 PolarHBondContact O-NE2 3.04Å; L196-I201 HydrophobicContact CD1-CD1 3.77Å
197	E	91.5	Very high	95.5	Very high	144 Å²	144	37.9 Å²	37.9	67%	0.673	18%	0.18	S	C	*	.	S	Bend	trans	-69.7	-42.5	170.2	-167.8	175.5	152.3	0	0	110.9	K168 E173 Q199	K168-E197 HydrophobicContact CD-CB 4.43Å; E173-E197 VanDerWaalsContact CD-N 3.33Å; E173-E197 PolarHBondContact OE1-N 2.87Å; E173-E197 VanDerWaalsContact OE2-CB 3.3Å; E173-E197 WeakPolarHBondContact OE2-CB 3.4Å; E173-E197 PolarHBondContact OE2-N 2.92Å; E197-Q199 PolarHBondContact O-N 2.84Å
198	K	88.6	Confident	95.5	Very high	134 Å²	134	37.1 Å²	37.1	58%	0.583	18%	0.176	S	C	*	.			trans	-79.9	77.5	179.7	-72.2	-178.2	-179.7	178.8	0	112.3	E173 N200 I201	E173-K198 PolarHBondContact OE1-N 2.83Å; K198-N200 PolarHBondContact O-N 3.01Å; K198-I201 HydrophobicContact CB-CD1 3.53Å; K198-I201 HydrophobicContact CB-CG1 3.87Å; K198-I201 HydrophobicContact CD-CD1 4.49Å; K198-I201 WeakPolarHBondContact O-CD1 3.39Å; K198-I201 WeakPolarHBondContact O-CG1 3.3Å; K198-I201 PolarHBondContact O-N 3.27Å
199	Q	84.2	Confident	95.5	Very high	85 Å²	85	37.1 Å²	37.1	40%	0.397	18%	0.176	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.2	-16	-176	-73.8	-66.2	-40.7	0	0	116.5	K194 L196 E197 K234	K194-Q199 PolarHBondContact O-NE2 2.98Å; L196-Q199 PolarHBondContact O-NE2 3.04Å; E197-Q199 PolarHBondContact O-N 2.84Å; Q199-K234 WeakPolarHBondContact O-CE 3.36Å; Q199-K234 PolarHBondContact O-NZ 3Å
200	N	89.6	Confident	95.5	Very high	154 Å²	154	37.1 Å²	37.1	82%	0.824	18%	0.176	S	C	*	.	T	Hydrogen-bonded Turn	trans	-95.5	1.7	-176.3	-69.6	-17	0	0	0	115.4	K198 K202	K198-N200 PolarHBondContact O-N 3.01Å; N200-K202 PolarHBondContact O-N 2.98Å
201	I	95.1	Very high	95.4	Very high	19 Å²	19	35.9 Å²	35.9	10%	0.097	17%	0.171	C	C	.	.	P	Polyproline II helix	trans	-65.4	126.7	177.4	-56.7	154	0	0	0	109.7	P174 I177 Q193 L196 K198	P174-I201 WeakPolarHBondContact O-CD1 3.45Å; I177-I201 HydrophobicContact CD1-CB 4.44Å; I177-I201 HydrophobicContact CD1-CG2 3.55Å; I177-I201 HydrophobicContact CG1-CG2 3.7Å; Q193-I201 PolarHBondContact NE2-O 3.2Å; L196-I201 HydrophobicContact CD1-CD1 3.77Å; K198-I201 HydrophobicContact CB-CD1 3.53Å; K198-I201 HydrophobicContact CB-CG1 3.87Å; K198-I201 HydrophobicContact CD-CD1 4.49Å; K198-I201 WeakPolarHBondContact O-CD1 3.39Å; K198-I201 WeakPolarHBondContact O-CG1 3.3Å; K198-I201 PolarHBondContact O-N 3.27Å
202	K	97.8	Very high	95.4	Very high	106 Å²	106	37.1 Å²	37.1	46%	0.461	18%	0.175	S	C	.	.	P	Polyproline II helix	trans	-102.5	151	-180	-63.7	-177.3	177.5	-172.4	0	112.6	N200 K234 D236	N200-K202 PolarHBondContact O-N 2.98Å; K202-K234 CarbonylContact C-O 3.42Å; K202-K234 VanDerWaalsContact CA-O 3.32Å; K202-K234 WeakPolarHBondContact CA-O 3.43Å; K202-D236 HydrophobicContact CB-CB 3.88Å; K202-D236 HydrophobicContact CD-CB 4.24Å
203	M	98.6	Very high	95.2	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	119.5	173.7	-69.6	175.8	-76.3	0	0	111.5	I177 V179 I186 C189 V205 K234 V235 D236	I177-M203 HydrophobicContact CG2-CG 4.04Å; V179-M203 HydrophobicContact CG1-CB 3.83Å; V179-M203 HydrophobicContact CG1-CG 4.24Å; V179-M203 HydrophobicContact CG1-SD 4.22Å; I186-M203 HydrophobicContact CG2-CE 4.12Å; I186-M203 HydrophobicContact CG2-SD 4.16Å; C189-M203 HydrophobicContact CB-CG 4.34Å; C189-M203 HydrophobicContact CB-SD 3.67Å; M203-V205 PolarHBondContact O-N 3.39Å; M203-K234 PolarHBondContact N-O 2.95Å; M203-V235 HydrophobicContact CB-CG1 4.35Å; M203-V235 HydrophobicContact CE-CG1 3.93Å; M203-D236 PolarHBondContact O-N 3.17Å
204	C	98.6	Very high	94.9	Very high	1 Å²	1	38.2 Å²	38.2	1%	0.007	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	106.4	164	-63	0	0	0	0	109	K176 I177 Y178 V179 E206 Y239	K176-C204 PolarHBondContact NZ-SG 3.37Å; I177-C204 WeakPolarHBondContact O-CB 3.42Å; I177-C204 PolarHBondContact O-N 3.3Å; Y178-C204 WeakPolarHBondContact CA-O 3.36Å; Y178-C204 HydrophobicContact CD1-CB 3.7Å; Y178-C204 HydrophobicContact CE1-CB 3.77Å; Y178-C204 HydrophobicContact CG-CB 4.49Å; V179-C204 PolarHBondContact N-O 3.47Å; C204-E206 PolarHBondContact O-N 3.04Å; C204-Y239 HydrophobicContact CB-CD1 3.69Å; C204-Y239 HydrophobicContact CB-CD2 3.73Å; C204-Y239 HydrophobicContact CB-CE1 3.87Å; C204-Y239 HydrophobicContact CB-CE2 3.94Å; C204-Y239 HydrophobicContact CB-CG 3.6Å
205	V	98.7	Very high	94.7	Very high	15 Å²	15	38.2 Å²	38.2	9%	0.091	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78	117	-179.6	-175.4	0	0	0	0	109.5	V179 P181 M203 I225 V235 Y239	V179-V205 HydrophobicContact CG1-CB 4.33Å; V179-V205 HydrophobicContact CG1-CG2 3.87Å; V179-V205 WeakPolarHBondContact O-CA 3.48Å; P181-V205 HydrophobicContact CB-CG1 3.81Å; M203-V205 PolarHBondContact O-N 3.39Å; V205-I225 HydrophobicContact CB-CD1 4.15Å; V205-I225 HydrophobicContact CG2-CD1 3.94Å; V205-V235 HydrophobicContact CG2-CB 4.49Å; V205-V235 HydrophobicContact CG2-CG1 3.98Å; V205-Y239 WeakPolarHBondContact O-CD1 3.28Å; V205-Y239 WeakPolarHBondContact O-CE1 3.46Å
206	E	98.5	Very high	94.6	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	19%	0.19	C	C	.	.			trans	-123.7	102.5	-172.4	176.8	49.2	-102.3	0	0	111.3	Y178 V179 P181 C204 S208 F209 Y239 P241 L242	Y178-E206 HydrophobicContact CD1-CB 4.5Å; V179-E206 PolarHBondContact O-N 2.92Å; P181-E206 WeakPolarHBondContact CD-O 3.39Å; C204-E206 PolarHBondContact O-N 3.04Å; E206-S208 PolarHBondContact O-N 3.24Å; E206-S208 WeakPolarHBondContact OE1-CB 3.33Å; E206-S208 PolarHBondContact OE1-N 3.33Å; E206-S208 PolarHBondContact OE1-OG 3.37Å; E206-F209 HydrophobicContact CB-CD2 3.83Å; E206-F209 HydrophobicContact CB-CE2 4.19Å; E206-F209 HydrophobicContact CG-CD2 3.56Å; E206-F209 HydrophobicContact CG-CE2 3.71Å; E206-F209 HydrophobicContact CG-CG 4.26Å; E206-F209 PolarHBondContact O-N 3.11Å; E206-Y239 HydrophobicContact CB-CE1 4.21Å; E206-Y239 PolarHBondContact OE2-OH 2.98Å; E206-P241 WeakPolarHBondContact OE2-CA 3.47Å; E206-L242 WeakPolarHBondContact OE2-CB 3.26Å; E206-L242 WeakPolarHBondContact OE2-CG 3.47Å; E206-L242 PolarHBondContact OE2-N 3.31Å
207	P	98.4	Very high	94.4	Very high	7 Å²	7	46.6 Å²	46.6	5%	0.045	22%	0.224	C	C	.	.	G	3₁₀ helix	trans	-56.1	-29.1	177.3	-27.3	38.1	0	0	0	114.5	P181 F209 F210 W222 P241 V248	P181-P207 HydrophobicContact CG-CB 4.31Å; P181-P207 HydrophobicContact CG-CG 4.44Å; P207-F209 PolarHBondContact O-N 3.23Å; P207-F210 VanDerWaalsContact O-CB 3.3Å; P207-F210 WeakPolarHBondContact O-CB 3.28Å; P207-F210 PolarHBondContact O-N 3.46Å; P207-W222 HydrophobicContact CB-CZ3 4.44Å; P207-P241 HydrophobicContact CG-CB 4.48Å; P207-V248 HydrophobicContact CB-CB 4.33Å; P207-V248 HydrophobicContact CB-CG2 3.72Å
208	S	98.3	Very high	94.4	Very high	2 Å²	2	44.2 Å²	44.2	1%	0.014	22%	0.216	C	C	.	.	G	3₁₀ helix	trans	-60.4	-17.9	178.7	-49.7	0	0	0	0	113.9	E206 L243 R262 A266	E206-S208 PolarHBondContact O-N 3.24Å; E206-S208 WeakPolarHBondContact OE1-CB 3.33Å; E206-S208 PolarHBondContact OE1-N 3.33Å; E206-S208 PolarHBondContact OE1-OG 3.37Å; S208-L243 WeakPolarHBondContact OG-CB 3.4Å; S208-L243 WeakPolarHBondContact OG-CG 3.41Å; S208-R262 PolarHBondContact O-NH1 2.97Å; S208-A266 VanDerWaalsContact CB-CB 3.41Å
209	F	98.6	Very high	94.5	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	20%	0.201	C	C	.	.	G	3₁₀ helix	trans	-100.6	3.9	175	-59.2	-45.3	0	0	0	114.6	Y178 E206 P207 A266 M267 I270 F282 V284 T288 L292	Y178-F209 HydrophobicContact CG-CE2 4.46Å; E206-F209 HydrophobicContact CB-CD2 3.83Å; E206-F209 HydrophobicContact CB-CE2 4.19Å; E206-F209 HydrophobicContact CG-CD2 3.56Å; E206-F209 HydrophobicContact CG-CE2 3.71Å; E206-F209 HydrophobicContact CG-CG 4.26Å; E206-F209 PolarHBondContact O-N 3.11Å; P207-F209 PolarHBondContact O-N 3.23Å; F209-A266 HydrophobicContact CD1-CB 4.4Å; F209-A266 HydrophobicContact CE1-CB 3.74Å; F209-A266 HydrophobicContact CZ-CB 4.08Å; F209-M267 HydrophobicContact CE1-CB 4.17Å; F209-M267 HydrophobicContact CZ-CB 4.25Å; F209-I270 HydrophobicContact CE2-CD1 3.59Å; F209-I270 HydrophobicContact CZ-CD1 3.66Å; F209-F282 HydrophobicContact CD2-CD1 4.23Å; F209-F282 AromaticContact CE2-CD1 3.61Å; F209-F282 HydrophobicContact CE2-CD1 3.61Å; F209-F282 AromaticContact CE2-CE1 3.68Å; F209-F282 HydrophobicContact CE2-CE1 3.68Å; F209-F282 AromaticContact CZ-CD1 3.9Å; F209-F282 HydrophobicContact CZ-CD1 3.9Å; F209-F282 AromaticContact CZ-CE1 3.76Å; F209-F282 HydrophobicContact CZ-CE1 3.76Å; F209-V284 HydrophobicContact CB-CG1 3.79Å; F209-V284 HydrophobicContact CG-CG1 4.32Å; F209-T288 HydrophobicContact CB-CG2 4.2Å; F209-T288 HydrophobicContact CD1-CG2 4.42Å; F209-T288 PolarHBondContact O-OG1 3.46Å; F209-L292 HydrophobicContact CD1-CD1 4.13Å; F209-L292 HydrophobicContact CD1-CD2 4.34Å; F209-L292 HydrophobicContact CE1-CD1 4.14Å; F209-L292 HydrophobicContact CE1-CD2 3.93Å
210	F	98.1	Very high	95	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	18%	0.182	C	C	.	.	S	Bend	trans	-59.4	146.5	164.8	-171.7	-95.7	0	0	0	110.9	S180 P181 A182 P207 M213 Y216 P220 W222 F259 R262 H285	S180-F210 WeakPolarHBondContact OG-CA 3.4Å; P181-F210 HydrophobicContact CG-CB 4.25Å; P181-F210 HydrophobicContact CG-CD2 4.33Å; A182-F210 HydrophobicContact CB-CD2 4.04Å; A182-F210 HydrophobicContact CB-CE2 3.88Å; P207-F210 VanDerWaalsContact O-CB 3.3Å; P207-F210 WeakPolarHBondContact O-CB 3.28Å; P207-F210 PolarHBondContact O-N 3.46Å; F210-M213 HydrophobicContact CD1-CE 3.58Å; F210-M213 HydrophobicContact CD1-CG 4.42Å; F210-M213 HydrophobicContact CD1-SD 3.92Å; F210-M213 HydrophobicContact CE1-CE 3.78Å; F210-M213 HydrophobicContact CE1-SD 3.67Å; F210-M213 HydrophobicContact CG-CE 4.42Å; F210-Y216 HydrophobicContact CE1-CD2 4.12Å; F210-Y216 AromaticContact CE1-CE2 3.67Å; F210-Y216 HydrophobicContact CE1-CE2 3.67Å; F210-Y216 HydrophobicContact CZ-CD2 4.31Å; F210-Y216 AromaticContact CZ-CE2 3.53Å; F210-Y216 HydrophobicContact CZ-CE2 3.53Å; F210-Y216 AromaticContact CZ-CZ 3.71Å; F210-P220 HydrophobicContact CE1-CG 4.29Å; F210-P220 HydrophobicContact CE2-CG 4.1Å; F210-P220 HydrophobicContact CZ-CG 3.68Å; F210-W222 HydrophobicContact CB-CH2 4.39Å; F210-W222 HydrophobicContact CB-CZ2 4.04Å; F210-W222 AromaticContact CD1-CZ2 3.82Å; F210-W222 HydrophobicContact CD1-CZ2 3.82Å; F210-W222 AromaticContact CD2-CE2 3.73Å; F210-W222 AromaticContact CD2-CZ2 3.43Å; F210-W222 HydrophobicContact CD2-CZ2 3.43Å; F210-W222 VanDerWaalsContact CD2-CZ2 3.43Å; F210-W222 AromaticContact CD2-NE1 3.58Å; F210-W222 HydrophobicContact CE1-CZ2 4.15Å; F210-W222 AromaticContact CE2-CE2 3.88Å; F210-W222 AromaticContact CE2-CZ2 3.79Å; F210-W222 HydrophobicContact CE2-CZ2 3.79Å; F210-W222 AromaticContact CE2-NE1 3.37Å; F210-W222 HydrophobicContact CG-CH2 4.21Å; F210-W222 AromaticContact CG-CZ2 3.45Å; F210-W222 HydrophobicContact CG-CZ2 3.45Å; F210-W222 VanDerWaalsContact CG-CZ2 3.45Å; F210-W222 HydrophobicContact CZ-CZ2 4.15Å; F210-F259 WeakPolarHBondContact O-CE2 3.47Å; F210-R262 PolarHBondContact O-NH1 3.29Å; F210-R262 PolarHBondContact O-NH2 2.99Å; F210-H285 AromaticContact CD2-NE2 3.88Å
211	E	95.6	Very high	95.1	Very high	10 Å²	10	32 Å²	32	5%	0.047	16%	0.161	C	C	.	.			trans	-61.7	-179.4	-178.3	57.4	-166	138.9	0	0	113.4	R184 M213 W215 Y216 F259 R262 H285	R184-E211 IonicContact CZ-OE1 3.11Å; R184-E211 IonicContact NE-OE1 3.68Å; R184-E211 IonicContact NH2-OE1 3.37Å; R184-E211 PolarHBondContact NH2-OE1 2.71Å; E211-M213 PolarHBondContact O-N 2.77Å; E211-W215 HydrophobicContact CB-CE3 4.2Å; E211-W215 HydrophobicContact CB-CZ3 4.06Å; E211-W215 HydrophobicContact CG-CE3 4.23Å; E211-W215 HydrophobicContact CG-CZ3 4.43Å; E211-W215 VanDerWaalsContact OE2-CZ3 3.31Å; E211-W215 WeakPolarHBondContact OE2-CZ3 3.43Å; E211-Y216 HydrophobicContact CG-CE2 4.1Å; E211-Y216 PolarHBondContact OE1-OH 2.86Å; E211-F259 VanDerWaalsContact C-CE2 3.47Å; E211-R262 PolarHBondContact O-NH2 2.83Å; E211-H285 HydrophobicContact CB-CB 3.87Å; E211-H285 VanDerWaalsContact CD-ND1 3.33Å; E211-H285 PolarHBondContact N-CD2 3.43Å; E211-H285 VanDerWaalsContact N-CD2 3.35Å; E211-H285 IonicContact OE1-CE1 3.54Å; E211-H285 PolarHBondContact OE1-CE1 3.46Å; E211-H285 VanDerWaalsContact OE1-CE1 3.24Å; E211-H285 IonicContact OE1-CG 2.7Å; E211-H285 IonicContact OE1-ND1 3.48Å; E211-H285 PolarHBondContact OE1-ND1 3.46Å; E211-H285 IonicContact OE2-ND1 2.87Å
212	W	95.8	Very high	95.2	Very high	29 Å²	29	31.9 Å²	31.9	11%	0.11	16%	0.16	C	C	.	.			trans	-67.4	120.8	-173.7	178.6	46.3	0	0	0	111.4	G214 W215 E254 P256 F259 L287 M309	W212-G214 PolarHBondContact O-N 3.05Å; W212-W215 HydrophobicContact CB-CE3 4.33Å; W212-W215 AromaticContact CE3-CD1 3.85Å; W212-W215 HydrophobicContact CE3-CD2 4.15Å; W212-W215 AromaticContact CE3-CG 3.94Å; W212-W215 HydrophobicContact CE3-CG 3.94Å; W212-W215 HydrophobicContact CZ3-CG 4.49Å; W212-W215 PolarHBondContact O-N 3.33Å; W212-W215 VanDerWaalsContact O-N 3.15Å; W212-E254 PolarHBondContact NE1-O 3.1Å; W212-P256 HydrophobicContact CZ2-CG 4.35Å; W212-F259 HydrophobicContact CB-CB 4.45Å; W212-F259 HydrophobicContact CB-CD1 4.42Å; W212-F259 HydrophobicContact CB-CD2 3.88Å; W212-F259 HydrophobicContact CB-CE2 4.31Å; W212-F259 HydrophobicContact CB-CG 3.95Å; W212-F259 HydrophobicContact CG-CB 4.33Å; W212-F259 HydrophobicContact CG-CG 4.35Å; W212-L287 HydrophobicContact CB-CD2 3.79Å; W212-M309 HydrophobicContact CB-CE 4.34Å; W212-M309 HydrophobicContact CD2-CE 3.62Å; W212-M309 HydrophobicContact CE3-CE 3.39Å; W212-M309 HydrophobicContact CE3-SD 4.16Å; W212-M309 HydrophobicContact CG-CE 4.07Å; W212-M309 HydrophobicContact CH2-CE 4.49Å; W212-M309 HydrophobicContact CH2-SD 4.49Å; W212-M309 HydrophobicContact CZ3-CE 3.86Å; W212-M309 HydrophobicContact CZ3-SD 4.01Å
213	M	93.6	Very high	95.1	Very high	0 Å²	0	27.4 Å²	27.4	0%	0	14%	0.141	C	C	.	.	G	3₁₀ helix	trans	-67.9	-18.5	-176.4	-76.2	-70	-166.9	0	0	113.4	F210 E211 W215 Y216 L219 W222 V248 R249	F210-M213 HydrophobicContact CD1-CE 3.58Å; F210-M213 HydrophobicContact CD1-CG 4.42Å; F210-M213 HydrophobicContact CD1-SD 3.92Å; F210-M213 HydrophobicContact CE1-CE 3.78Å; F210-M213 HydrophobicContact CE1-SD 3.67Å; F210-M213 HydrophobicContact CG-CE 4.42Å; E211-M213 PolarHBondContact O-N 2.77Å; M213-W215 PolarHBondContact O-N 2.92Å; M213-Y216 PolarHBondContact O-N 3.18Å; M213-L219 HydrophobicContact SD-CD2 3.88Å; M213-W222 HydrophobicContact CE-CH2 3.56Å; M213-W222 HydrophobicContact CE-CZ2 3.64Å; M213-V248 HydrophobicContact CE-CG1 3.81Å; M213-V248 HydrophobicContact CG-CG1 4.41Å; M213-R249 HydrophobicContact CE-CG 4.28Å
214	G	91.5	Very high	95	Very high	27 Å²	27	30.4 Å²	30.4	28%	0.278	16%	0.159	S	C	.	.	G	3₁₀ helix	trans	-67.1	-6.4	172.4	0	0	0	0	0	115.1	W212	W212-G214 PolarHBondContact O-N 3.05Å
215	W	90.4	Very high	95	Very high	63 Å²	63	33.1 Å²	33.1	24%	0.239	17%	0.173	C	C	.	.	G	3₁₀ helix	trans	-80.2	-14.5	167.4	-80.9	-36.4	0	0	0	114.3	E211 W212 M213 L287 R306 M309 D310	E211-W215 HydrophobicContact CB-CE3 4.2Å; E211-W215 HydrophobicContact CB-CZ3 4.06Å; E211-W215 HydrophobicContact CG-CE3 4.23Å; E211-W215 HydrophobicContact CG-CZ3 4.43Å; E211-W215 VanDerWaalsContact OE2-CZ3 3.31Å; E211-W215 WeakPolarHBondContact OE2-CZ3 3.43Å; W212-W215 HydrophobicContact CB-CE3 4.33Å; W212-W215 AromaticContact CE3-CD1 3.85Å; W212-W215 HydrophobicContact CE3-CD2 4.15Å; W212-W215 AromaticContact CE3-CG 3.94Å; W212-W215 HydrophobicContact CE3-CG 3.94Å; W212-W215 HydrophobicContact CZ3-CG 4.49Å; W212-W215 PolarHBondContact O-N 3.33Å; W212-W215 VanDerWaalsContact O-N 3.15Å; M213-W215 PolarHBondContact O-N 2.92Å; W215-L287 HydrophobicContact CH2-CB 3.85Å; W215-L287 HydrophobicContact CH2-CD2 3.84Å; W215-L287 HydrophobicContact CH2-CG 4.29Å; W215-L287 HydrophobicContact CZ2-CD2 4.37Å; W215-L287 HydrophobicContact CZ3-CB 4.13Å; W215-L287 HydrophobicContact CZ3-CD2 4.03Å; W215-R306 VanDerWaalsContact CD1-CZ 3.5Å; W215-M309 HydrophobicContact CZ2-CB 3.96Å; W215-M309 WeakPolarHBondContact CZ2-O 3.47Å; W215-D310 PolarHBondContact NE1-OD1 3Å
216	Y	91	Very high	94.9	Very high	28 Å²	28	38.2 Å²	38.2	11%	0.11	20%	0.2	C	C	.	.			trans	-104.6	117.2	-168.7	-75.8	-88.6	0	0	0	113.4	R184 F210 E211 M213 N218 R252	R184-Y216 PolarHBondContact NH2-OH 3.44Å; F210-Y216 HydrophobicContact CE1-CD2 4.12Å; F210-Y216 AromaticContact CE1-CE2 3.67Å; F210-Y216 HydrophobicContact CE1-CE2 3.67Å; F210-Y216 HydrophobicContact CZ-CD2 4.31Å; F210-Y216 AromaticContact CZ-CE2 3.53Å; F210-Y216 HydrophobicContact CZ-CE2 3.53Å; F210-Y216 AromaticContact CZ-CZ 3.71Å; E211-Y216 HydrophobicContact CG-CE2 4.1Å; E211-Y216 PolarHBondContact OE1-OH 2.86Å; M213-Y216 PolarHBondContact O-N 3.18Å; Y216-N218 WeakPolarHBondContact CD1-O 3.43Å; Y216-R252 PolarHBondContact O-NE 2.95Å; Y216-R252 PolarHBondContact O-NH2 3.39Å
217	E	89.1	Confident	94.8	Very high	154 Å²	154	39.5 Å²	39.5	72%	0.72	21%	0.206	S	C	*	.	S	Bend	trans	-72.3	-47.5	164.7	-173.9	178.7	-166.4	0	0	111.1	R252	E217-R252 VanDerWaalsContact O-CZ 3.22Å; E217-R252 PolarHBondContact O-NH1 3.08Å; E217-R252 PolarHBondContact O-NH2 2.91Å
218	N	91.8	Very high	94.8	Very high	95 Å²	95	39.2 Å²	39.2	51%	0.508	20%	0.204	S	C	.	.	S	Bend	trans	-113.8	121.1	175.9	-70.4	-75.7	0	0	0	109.1	N148 Y216	N148-N218 VanDerWaalsContact ND2-CB 3.32Å; N148-N218 WeakPolarHBondContact ND2-CB 3.37Å; Y216-N218 WeakPolarHBondContact CD1-O 3.43Å
219	L	91.8	Very high	94.7	Very high	52 Å²	52	42.6 Å²	42.6	27%	0.272	22%	0.221	S	C	.	.			trans	-71.1	146.7	-174.2	-62.4	-178.8	0	0	0	112.1	M213 R249	M213-L219 HydrophobicContact SD-CD2 3.88Å; L219-R249 HydrophobicContact CD1-CB 3.97Å; L219-R249 HydrophobicContact CD1-CG 4.19Å
220	P	93.2	Very high	94.6	Very high	1 Å²	1	46.2 Å²	46.2	1%	0.006	25%	0.251	C	S	.	.			trans	-74.3	129.6	178.2	29.3	-35.2	0	0	0	113.1	D149 F210 W222 R249	D149-P220 HydrophobicContact CB-CB 3.99Å; F210-P220 HydrophobicContact CE1-CG 4.29Å; F210-P220 HydrophobicContact CE2-CG 4.1Å; F210-P220 HydrophobicContact CZ-CG 3.68Å; P220-W222 HydrophobicContact CG-CZ2 3.9Å; P220-W222 PolarHBondContact O-N 2.87Å; P220-R249 PolarHBondContact O-NH2 3.27Å
221	V	93.7	Very high	94.4	Very high	63 Å²	63	50 Å²	50	38%	0.382	27%	0.268	S	S	.	.			trans	-90.2	78.1	169.6	-175.2	0	0	0	0	108.2	R139 C145	R139-V221 PolarHBondContact NH2-O 2.9Å; C145-V221 HydrophobicContact CB-CB 4.33Å
222	W	96.2	Very high	94.4	Very high	16 Å²	16	54.1 Å²	54.1	6%	0.061	30%	0.298	C	S	.	.	P	Polyproline II helix	trans	-53.3	150.7	177.8	-53.7	-52	0	0	0	112.4	P181 P207 F210 M213 P220 A245 V248	P181-W222 HydrophobicContact CB-CB 4.22Å; P181-W222 HydrophobicContact CB-CD2 3.65Å; P181-W222 HydrophobicContact CB-CE3 3.85Å; P181-W222 HydrophobicContact CB-CG 3.82Å; P181-W222 HydrophobicContact CB-CZ3 4.48Å; P181-W222 HydrophobicContact CG-CD2 3.64Å; P181-W222 HydrophobicContact CG-CE3 3.76Å; P181-W222 HydrophobicContact CG-CG 4.24Å; P181-W222 HydrophobicContact CG-CH2 4Å; P181-W222 HydrophobicContact CG-CZ2 3.89Å; P181-W222 HydrophobicContact CG-CZ3 3.93Å; P207-W222 HydrophobicContact CB-CZ3 4.44Å; F210-W222 HydrophobicContact CB-CH2 4.39Å; F210-W222 HydrophobicContact CB-CZ2 4.04Å; F210-W222 AromaticContact CD1-CZ2 3.82Å; F210-W222 HydrophobicContact CD1-CZ2 3.82Å; F210-W222 AromaticContact CD2-CE2 3.73Å; F210-W222 AromaticContact CD2-CZ2 3.43Å; F210-W222 HydrophobicContact CD2-CZ2 3.43Å; F210-W222 VanDerWaalsContact CD2-CZ2 3.43Å; F210-W222 AromaticContact CD2-NE1 3.58Å; F210-W222 HydrophobicContact CE1-CZ2 4.15Å; F210-W222 AromaticContact CE2-CE2 3.88Å; F210-W222 AromaticContact CE2-CZ2 3.79Å; F210-W222 HydrophobicContact CE2-CZ2 3.79Å; F210-W222 AromaticContact CE2-NE1 3.37Å; F210-W222 HydrophobicContact CG-CH2 4.21Å; F210-W222 AromaticContact CG-CZ2 3.45Å; F210-W222 HydrophobicContact CG-CZ2 3.45Å; F210-W222 VanDerWaalsContact CG-CZ2 3.45Å; F210-W222 HydrophobicContact CZ-CZ2 4.15Å; M213-W222 HydrophobicContact CE-CH2 3.56Å; M213-W222 HydrophobicContact CE-CZ2 3.64Å; P220-W222 HydrophobicContact CG-CZ2 3.9Å; P220-W222 PolarHBondContact O-N 2.87Å; W222-A245 HydrophobicContact CE3-CB 3.98Å; W222-A245 HydrophobicContact CZ3-CB 3.77Å; W222-V248 HydrophobicContact CH2-CG1 4.5Å
223	L	96.7	Very high	94.4	Very high	13 Å²	13	53.8 Å²	53.8	7%	0.068	30%	0.297	C	S	.	.	P	Polyproline II helix	trans	-59.8	142.2	171.8	-74.5	148.5	0	0	0	110.7	P137 R139 F183 E227 L228	P137-L223 HydrophobicContact CB-CD2 4.11Å; R139-L223 HydrophobicContact CB-CD2 3.53Å; R139-L223 HydrophobicContact CB-CG 4.31Å; F183-L223 HydrophobicContact CB-CD1 4.35Å; F183-L223 HydrophobicContact CD1-CD1 4.46Å; F183-L223 HydrophobicContact CD2-CD1 3.26Å; F183-L223 HydrophobicContact CE2-CD1 3.5Å; F183-L223 HydrophobicContact CG-CD1 3.8Å; F183-L223 HydrophobicContact CZ-CD1 4.21Å; L223-E227 WeakPolarHBondContact CA-OE2 3.31Å; L223-E227 HydrophobicContact CB-CB 4.43Å; L223-E227 HydrophobicContact CD2-CB 3.83Å; L223-L228 HydrophobicContact CB-CD1 4.42Å; L223-L228 HydrophobicContact CB-CD2 3.9Å; L223-L228 HydrophobicContact CB-CG 3.88Å; L223-L228 HydrophobicContact CD1-CD2 3.88Å; L223-L228 HydrophobicContact CG-CD2 4.46Å
224	T	96.3	Very high	94.6	Very high	62 Å²	62	56.7 Å²	56.7	38%	0.38	31%	0.309	S	S	.	.	P	Polyproline II helix	trans	-73.8	162.8	173.4	75.3	0	0	0	0	111.4	D226 E227 L228	T224-D226 PolarHBondContact O-N 3.45Å; T224-D226 PolarHBondContact OG1-N 3.12Å; T224-E227 PolarHBondContact N-OE2 3.34Å; T224-E227 PolarHBondContact O-N 2.75Å; T224-E227 VanDerWaalsContact OG1-CG 3.3Å; T224-E227 WeakPolarHBondContact OG1-CG 3.28Å; T224-E227 PolarHBondContact OG1-N 3.26Å; T224-L228 WeakPolarHBondContact O-CB 3.29Å; T224-L228 VanDerWaalsContact O-CG 3.26Å; T224-L228 WeakPolarHBondContact O-CG 3.45Å; T224-L228 PolarHBondContact O-N 2.81Å
225	I	97.3	Very high	94.9	Very high	59 Å²	59	55.4 Å²	55.4	30%	0.303	30%	0.296	S	S	.	.	H	α-helix	trans	-58.4	-38.3	174.3	-62	-60	0	0	0	111.2	V205 L228 L229 V235	V205-I225 HydrophobicContact CB-CD1 4.15Å; V205-I225 HydrophobicContact CG2-CD1 3.94Å; I225-L228 PolarHBondContact O-N 3.07Å; I225-L229 HydrophobicContact CG2-CD1 4.16Å; I225-L229 WeakPolarHBondContact O-CG 3.49Å; I225-L229 PolarHBondContact O-N 3.21Å; I225-V235 HydrophobicContact CG2-CG2 4.06Å
226	D	96.9	Very high	95.3	Very high	122 Å²	122	53.6 Å²	53.6	65%	0.652	29%	0.291	S	S	*	.	H	α-helix	trans	-71.3	-37.8	178.7	-58.7	-43	0	0	0	112.2	T224 L228 L229 A230	T224-D226 PolarHBondContact O-N 3.45Å; T224-D226 PolarHBondContact OG1-N 3.12Å; D226-L228 VanDerWaalsContact C-N 3.33Å; D226-L229 PolarHBondContact O-N 3.07Å; D226-A230 VanDerWaalsContact O-CB 3.27Å; D226-A230 WeakPolarHBondContact O-CB 3.37Å; D226-A230 PolarHBondContact O-N 3.24Å
227	E	97.1	Very high	95.6	Very high	27 Å²	27	55.6 Å²	55.6	13%	0.126	31%	0.309	C	S	.	.	H	α-helix	trans	-64.2	-38.9	172.2	-71.6	170.8	161.9	0	0	111.5	T140 L223 T224 A230 F231	T140-E227 VanDerWaalsContact CB-OE1 3.3Å; T140-E227 WeakPolarHBondContact CB-OE1 3.43Å; T140-E227 PolarHBondContact N-OE1 2.66Å; T140-E227 PolarHBondContact OG1-OE1 2.86Å; L223-E227 WeakPolarHBondContact CA-OE2 3.31Å; L223-E227 HydrophobicContact CB-CB 4.43Å; L223-E227 HydrophobicContact CD2-CB 3.83Å; T224-E227 PolarHBondContact N-OE2 3.34Å; T224-E227 PolarHBondContact O-N 2.75Å; T224-E227 VanDerWaalsContact OG1-CG 3.3Å; T224-E227 WeakPolarHBondContact OG1-CG 3.28Å; T224-E227 PolarHBondContact OG1-N 3.26Å; E227-A230 PolarHBondContact O-N 2.81Å; E227-F231 WeakPolarHBondContact O-CD2 3.47Å; E227-F231 PolarHBondContact O-N 3.18Å
228	L	97.6	Very high	96	Very high	1 Å²	1	53.7 Å²	53.7	1%	0.005	31%	0.308	C	S	.	.	H	α-helix	trans	-65.5	-44.1	175.1	-70.2	169.6	0	0	0	111.7	I186 L223 T224 I225 D226 F231 S232 Y233 V235	I186-L228 HydrophobicContact CD1-CD1 3.8Å; I186-L228 HydrophobicContact CD1-CD2 4.15Å; I186-L228 HydrophobicContact CG2-CD2 3.95Å; L223-L228 HydrophobicContact CB-CD1 4.42Å; L223-L228 HydrophobicContact CB-CD2 3.9Å; L223-L228 HydrophobicContact CB-CG 3.88Å; L223-L228 HydrophobicContact CD1-CD2 3.88Å; L223-L228 HydrophobicContact CG-CD2 4.46Å; T224-L228 WeakPolarHBondContact O-CB 3.29Å; T224-L228 VanDerWaalsContact O-CG 3.26Å; T224-L228 WeakPolarHBondContact O-CG 3.45Å; T224-L228 PolarHBondContact O-N 2.81Å; I225-L228 PolarHBondContact O-N 3.07Å; D226-L228 VanDerWaalsContact C-N 3.33Å; L228-F231 CarbonylContact O-C 3.46Å; L228-F231 PolarHBondContact O-N 3.06Å; L228-S232 PolarHBondContact O-N 3.42Å; L228-Y233 HydrophobicContact CD2-CD2 3.9Å; L228-Y233 HydrophobicContact CD2-CE2 4.49Å; L228-Y233 HydrophobicContact CD2-CG 4.04Å; L228-Y233 WeakPolarHBondContact O-CB 3.47Å; L228-Y233 WeakPolarHBondContact O-CD2 3.41Å; L228-Y233 PolarHBondContact O-N 2.86Å; L228-V235 HydrophobicContact CB-CG1 4.13Å; L228-V235 HydrophobicContact CB-CG2 4.16Å; L228-V235 HydrophobicContact CD1-CG1 4.07Å
229	L	97	Very high	96.2	Very high	72 Å²	72	50.7 Å²	50.7	38%	0.377	29%	0.29	S	S	.	.	H	α-helix	trans	-64.3	-39.7	174.7	-71.8	171.8	0	0	0	112.2	I225 D226 F231 S232 V235	I225-L229 HydrophobicContact CG2-CD1 4.16Å; I225-L229 WeakPolarHBondContact O-CG 3.49Å; I225-L229 PolarHBondContact O-N 3.21Å; D226-L229 PolarHBondContact O-N 3.07Å; L229-F231 PolarHBondContact O-N 3.32Å; L229-S232 PolarHBondContact O-N 3.44Å; L229-V235 HydrophobicContact CD2-CG2 3.64Å; L229-V235 HydrophobicContact CG-CG2 3.69Å
230	A	96.1	Very high	96.5	Very high	76 Å²	76	56.9 Å²	56.9	63%	0.628	32%	0.315	S	S	*	.	H	α-helix	trans	-64	-23.4	177.1	0	0	0	0	0	113.5	D226 E227	D226-A230 VanDerWaalsContact O-CB 3.27Å; D226-A230 WeakPolarHBondContact O-CB 3.37Å; D226-A230 PolarHBondContact O-N 3.24Å; E227-A230 PolarHBondContact O-N 2.81Å
231	F	94.7	Very high	96.7	Very high	80 Å²	80	59.6 Å²	59.6	35%	0.351	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.4	25	171.8	-75.6	-86.6	0	0	0	113.2	P137 K138 E227 L228 L229 Y233	P137-F231 HydrophobicContact CB-CB 4.48Å; P137-F231 HydrophobicContact CB-CD1 4.11Å; P137-F231 HydrophobicContact CB-CD2 3.7Å; P137-F231 HydrophobicContact CB-CE1 4.32Å; P137-F231 HydrophobicContact CB-CE2 3.93Å; P137-F231 HydrophobicContact CB-CG 3.81Å; P137-F231 HydrophobicContact CB-CZ 4.25Å; P137-F231 HydrophobicContact CG-CB 4.35Å; P137-F231 HydrophobicContact CG-CD1 4.25Å; P137-F231 HydrophobicContact CG-CD2 4.44Å; P137-F231 HydrophobicContact CG-CG 4.07Å; K138-F231 HydrophobicContact CB-CE2 4.11Å; K138-F231 HydrophobicContact CB-CZ 4.13Å; K138-F231 HydrophobicContact CG-CZ 4.26Å; E227-F231 WeakPolarHBondContact O-CD2 3.47Å; E227-F231 PolarHBondContact O-N 3.18Å; L228-F231 CarbonylContact O-C 3.46Å; L228-F231 PolarHBondContact O-N 3.06Å; L229-F231 PolarHBondContact O-N 3.32Å; F231-Y233 HydrophobicContact CB-CD2 3.89Å; F231-Y233 HydrophobicContact CB-CE2 3.76Å; F231-Y233 WeakPolarHBondContact O-CD2 3.42Å; F231-Y233 PolarHBondContact O-N 3.35Å; F231-Y233 VanDerWaalsContact O-N 3.16Å
232	S	94.8	Very high	97	Very high	96 Å²	96	59.5 Å²	59.5	67%	0.671	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	61	20.3	172.4	-58.6	0	0	0	0	115.9	L228 L229 K234	L228-S232 PolarHBondContact O-N 3.42Å; L229-S232 PolarHBondContact O-N 3.44Å; S232-K234 PolarHBondContact O-N 3.18Å
233	Y	96.9	Very high	97	Very high	23 Å²	23	60.5 Å²	60.5	9%	0.09	34%	0.335	C	S	.	.			trans	-70.8	128.1	170.6	-68.5	-86.5	0	0	0	109.6	P137 F183 I186 Q187 H190 L228 F231 V235	P137-Y233 HydrophobicContact CG-CE2 4.27Å; F183-Y233 HydrophobicContact CE2-CE1 4.34Å; F183-Y233 HydrophobicContact CE2-CE2 4.14Å; F183-Y233 AromaticContact CE2-CZ 3.74Å; F183-Y233 WeakPolarHBondContact CE2-OH 3.4Å; I186-Y233 HydrophobicContact CG2-CD1 3.74Å; I186-Y233 HydrophobicContact CG2-CE1 4.28Å; I186-Y233 HydrophobicContact CG2-CG 4.25Å; Q187-Y233 HydrophobicContact CG-CE1 4.02Å; H190-Y233 HydrophobicContact CB-CD1 3.71Å; H190-Y233 HydrophobicContact CB-CE1 3.88Å; H190-Y233 AromaticContact CD2-CE1 3.85Å; H190-Y233 AromaticContact CG-CD1 3.68Å; H190-Y233 AromaticContact CG-CE1 3.84Å; L228-Y233 HydrophobicContact CD2-CD2 3.9Å; L228-Y233 HydrophobicContact CD2-CE2 4.49Å; L228-Y233 HydrophobicContact CD2-CG 4.04Å; L228-Y233 WeakPolarHBondContact O-CB 3.47Å; L228-Y233 WeakPolarHBondContact O-CD2 3.41Å; L228-Y233 PolarHBondContact O-N 2.86Å; F231-Y233 HydrophobicContact CB-CD2 3.89Å; F231-Y233 HydrophobicContact CB-CE2 3.76Å; F231-Y233 WeakPolarHBondContact O-CD2 3.42Å; F231-Y233 PolarHBondContact O-N 3.35Å; F231-Y233 VanDerWaalsContact O-N 3.16Å; Y233-V235 PolarHBondContact O-N 3.05Å
234	K	96.7	Very high	97	Very high	60 Å²	60	62.5 Å²	62.5	26%	0.261	35%	0.35	S	S	.	.			trans	-75.9	68.6	-177.3	-59.8	178.6	-176.8	179.3	0	111.3	Q199 K202 M203 S232	Q199-K234 WeakPolarHBondContact O-CE 3.36Å; Q199-K234 PolarHBondContact O-NZ 3Å; K202-K234 CarbonylContact C-O 3.42Å; K202-K234 VanDerWaalsContact CA-O 3.32Å; K202-K234 WeakPolarHBondContact CA-O 3.43Å; M203-K234 PolarHBondContact N-O 2.95Å; S232-K234 PolarHBondContact O-N 3.18Å
235	V	97.8	Very high	96.8	Very high	1 Å²	1	61 Å²	61	1%	0.006	35%	0.345	C	S	.	.	B	Isolated β-bridge	trans	-93	152.8	177.7	-64.3	0	0	0	0	112.6	M203 V205 I225 L228 L229 Y233	M203-V235 HydrophobicContact CB-CG1 4.35Å; M203-V235 HydrophobicContact CE-CG1 3.93Å; V205-V235 HydrophobicContact CG2-CB 4.49Å; V205-V235 HydrophobicContact CG2-CG1 3.98Å; I225-V235 HydrophobicContact CG2-CG2 4.06Å; L228-V235 HydrophobicContact CB-CG1 4.13Å; L228-V235 HydrophobicContact CB-CG2 4.16Å; L228-V235 HydrophobicContact CD1-CG1 4.07Å; L229-V235 HydrophobicContact CD2-CG2 3.64Å; L229-V235 HydrophobicContact CG-CG2 3.69Å; Y233-V235 PolarHBondContact O-N 3.05Å
236	D	98	Very high	96.7	Very high	24 Å²	24	62.4 Å²	62.4	13%	0.128	35%	0.353	C	S	.	.			trans	-92.3	94.5	173.1	-176	6.8	0	0	0	110.8	K202 M203 T238 Y239	K202-D236 HydrophobicContact CB-CB 3.88Å; K202-D236 HydrophobicContact CD-CB 4.24Å; M203-D236 PolarHBondContact O-N 3.17Å; D236-T238 PolarHBondContact O-N 3.17Å; D236-T238 WeakPolarHBondContact OD1-CB 3.19Å; D236-T238 PolarHBondContact OD1-N 3.09Å; D236-T238 PolarHBondContact OD1-OG1 2.84Å; D236-Y239 VanDerWaalsContact O-CB 3.29Å; D236-Y239 WeakPolarHBondContact O-CB 3.32Å; D236-Y239 PolarHBondContact O-N 3.01Å; D236-Y239 VanDerWaalsContact O-N 3.14Å; D236-Y239 PolarHBondContact OD1-N 2.89Å
237	S	97.2	Very high	96.6	Very high	71 Å²	71	59.8 Å²	59.8	50%	0.497	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.9	-5.8	175	51.6	0	0	0	0	114.7
238	T	97.4	Very high	96.6	Very high	113 Å²	113	58.5 Å²	58.5	69%	0.693	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.5	-8.9	172.1	71.2	0	0	0	0	112.8	D236 K240	D236-T238 PolarHBondContact O-N 3.17Å; D236-T238 WeakPolarHBondContact OD1-CB 3.19Å; D236-T238 PolarHBondContact OD1-N 3.09Å; D236-T238 PolarHBondContact OD1-OG1 2.84Å; T238-K240 PolarHBondContact O-N 3.04Å
239	Y	97.9	Very high	96.3	Very high	33 Å²	33	61.3 Å²	61.3	13%	0.129	34%	0.343	C	S	.	.			trans	-69	128.6	178.1	-176.8	-115.6	0	0	0	111.4	Y178 C204 V205 E206 D236 P241	Y178-Y239 AromaticContact CE1-CE2 3.85Å; Y178-Y239 HydrophobicContact CE1-CE2 3.85Å; Y178-Y239 AromaticContact CE1-CZ 3.79Å; Y178-Y239 WeakPolarHBondContact CE1-OH 3.17Å; C204-Y239 HydrophobicContact CB-CD1 3.69Å; C204-Y239 HydrophobicContact CB-CD2 3.73Å; C204-Y239 HydrophobicContact CB-CE1 3.87Å; C204-Y239 HydrophobicContact CB-CE2 3.94Å; C204-Y239 HydrophobicContact CB-CG 3.6Å; V205-Y239 WeakPolarHBondContact O-CD1 3.28Å; V205-Y239 WeakPolarHBondContact O-CE1 3.46Å; E206-Y239 HydrophobicContact CB-CE1 4.21Å; E206-Y239 PolarHBondContact OE2-OH 2.98Å; D236-Y239 VanDerWaalsContact O-CB 3.29Å; D236-Y239 WeakPolarHBondContact O-CB 3.32Å; D236-Y239 PolarHBondContact O-N 3.01Å; D236-Y239 VanDerWaalsContact O-N 3.14Å; D236-Y239 PolarHBondContact OD1-N 2.89Å; Y239-P241 HydrophobicContact CD1-CG 4.12Å; Y239-P241 HydrophobicContact CE1-CB 4.08Å; Y239-P241 HydrophobicContact CE1-CG 4.08Å
240	K	97.5	Very high	96.2	Very high	182 Å²	182	65.4 Å²	65.4	79%	0.791	36%	0.36	S	S	*	.			trans	-100.6	113	169.8	-65.2	-175.4	179.8	-177.1	0	108.3	T238	T238-K240 PolarHBondContact O-N 3.04Å
241	P	98.2	Very high	96.1	Very high	58 Å²	58	66 Å²	66	38%	0.377	35%	0.347	S	S	.	.			trans	-67.6	159.9	178.3	-19.1	32.5	0	0	0	113	E206 P207 Y239 L243	E206-P241 WeakPolarHBondContact OE2-CA 3.47Å; P207-P241 HydrophobicContact CG-CB 4.48Å; Y239-P241 HydrophobicContact CD1-CG 4.12Å; Y239-P241 HydrophobicContact CE1-CB 4.08Å; Y239-P241 HydrophobicContact CE1-CG 4.08Å; P241-L243 WeakPolarHBondContact CB-O 3.45Å
242	L	98.1	Very high	95.9	Very high	60 Å²	60	68.4 Å²	68.4	31%	0.314	35%	0.353	S	S	.	.	S	Bend	trans	-77.7	-23.8	180	-63.6	179.4	0	0	0	113.6	E206 A266 K269 I270	E206-L242 WeakPolarHBondContact OE2-CB 3.26Å; E206-L242 WeakPolarHBondContact OE2-CG 3.47Å; E206-L242 PolarHBondContact OE2-N 3.31Å; L242-A266 HydrophobicContact CD1-CB 4.01Å; L242-A266 VanDerWaalsContact CD1-O 3.28Å; L242-A266 WeakPolarHBondContact CD1-O 3.46Å; L242-K269 HydrophobicContact CD1-CB 3.7Å; L242-K269 HydrophobicContact CD1-CD 4.15Å; L242-K269 HydrophobicContact CD2-CB 4.16Å; L242-K269 HydrophobicContact CD2-CD 4.25Å; L242-I270 HydrophobicContact CD1-CD1 4.08Å; L242-I270 HydrophobicContact CD1-CG1 4.05Å
243	L	97	Very high	95.8	Very high	37 Å²	37	67.4 Å²	67.4	19%	0.194	36%	0.358	C	S	.	.	S	Bend	trans	-135.3	139.7	168.1	-66.7	176.7	0	0	0	107.9	S208 P241 D247 V248 R262	S208-L243 WeakPolarHBondContact OG-CB 3.4Å; S208-L243 WeakPolarHBondContact OG-CG 3.41Å; P241-L243 WeakPolarHBondContact CB-O 3.45Å; L243-D247 HydrophobicContact CB-CB 4.12Å; L243-D247 HydrophobicContact CD2-CB 4.23Å; L243-V248 HydrophobicContact CB-CG2 3.77Å; L243-V248 HydrophobicContact CD1-CG2 3.94Å; L243-R262 HydrophobicContact CD1-CG 4.19Å
244	S	95.8	Very high	95.6	Very high	55 Å²	55	67.1 Å²	67.1	39%	0.385	36%	0.358	S	S	.	.			trans	-67.2	165.8	172.4	73.9	0	0	0	0	111	D246 D247 V248	S244-D246 PolarHBondContact O-N 3.29Å; S244-D246 PolarHBondContact OG-N 3.41Å; S244-D247 WeakPolarHBondContact CA-OD2 3.28Å; S244-D247 WeakPolarHBondContact CB-OD2 3.41Å; S244-D247 PolarHBondContact N-OD2 3.38Å; S244-D247 PolarHBondContact O-N 3.09Å; S244-D247 PolarHBondContact OG-N 3.01Å; S244-D247 VanDerWaalsContact OG-N 3.11Å; S244-D247 PolarHBondContact OG-OD2 3.47Å; S244-V248 PolarHBondContact O-N 3.35Å
245	A	93.9	Very high	95.6	Very high	31 Å²	31	68 Å²	68	26%	0.256	37%	0.368	S	S	.	.	H	α-helix	trans	-57.8	-32.9	175	0	0	0	0	0	112.3	W222 R249	W222-A245 HydrophobicContact CE3-CB 3.98Å; W222-A245 HydrophobicContact CZ3-CB 3.77Å; A245-R249 WeakPolarHBondContact O-CG 3.4Å; A245-R249 PolarHBondContact O-N 2.86Å; A245-R249 VanDerWaalsContact O-N 3.14Å
246	D	94.3	Very high	95.4	Very high	88 Å²	88	69 Å²	69	47%	0.471	38%	0.375	S	S	.	.	H	α-helix	trans	-86.6	-31.3	-175.3	-58.8	-37.2	0	0	0	112.5	S244 V248 R249 Q250	S244-D246 PolarHBondContact O-N 3.29Å; S244-D246 PolarHBondContact OG-N 3.41Å; D246-V248 PolarHBondContact O-N 3.21Å; D246-R249 PolarHBondContact O-N 2.64Å; D246-R249 VanDerWaalsContact O-N 3.16Å; D246-R249 WeakPolarHBondContact OD1-CD 3.47Å; D246-R249 IonicContact OD1-CZ 2.65Å; D246-R249 IonicContact OD1-NE 2.86Å; D246-R249 IonicContact OD1-NH1 2.8Å; D246-R249 PolarHBondContact OD1-NH1 2.86Å; D246-Q250 WeakPolarHBondContact O-CG 3.45Å; D246-Q250 PolarHBondContact O-N 2.86Å
247	D	95.6	Very high	95.3	Very high	68 Å²	68	70.5 Å²	70.5	36%	0.364	38%	0.384	S	S	.	.	H	α-helix	trans	-56.3	-35.9	167.6	-65.1	-53.2	0	0	0	111.7	L243 S244 R251	L243-D247 HydrophobicContact CB-CB 4.12Å; L243-D247 HydrophobicContact CD2-CB 4.23Å; S244-D247 WeakPolarHBondContact CA-OD2 3.28Å; S244-D247 WeakPolarHBondContact CB-OD2 3.41Å; S244-D247 PolarHBondContact N-OD2 3.38Å; S244-D247 PolarHBondContact O-N 3.09Å; S244-D247 PolarHBondContact OG-N 3.01Å; S244-D247 VanDerWaalsContact OG-N 3.11Å; S244-D247 PolarHBondContact OG-OD2 3.47Å; D247-R251 WeakPolarHBondContact O-CG 3.32Å
248	V	95.4	Very high	95.3	Very high	0 Å²	0	68.7 Å²	68.7	0%	0	37%	0.374	C	S	.	.	H	α-helix	trans	-80.8	-34.7	177.5	-172.7	0	0	0	0	111.5	P207 M213 W222 L243 S244 D246 Q250 R251	P207-V248 HydrophobicContact CB-CB 4.33Å; P207-V248 HydrophobicContact CB-CG2 3.72Å; M213-V248 HydrophobicContact CE-CG1 3.81Å; M213-V248 HydrophobicContact CG-CG1 4.41Å; W222-V248 HydrophobicContact CH2-CG1 4.5Å; L243-V248 HydrophobicContact CB-CG2 3.77Å; L243-V248 HydrophobicContact CD1-CG2 3.94Å; S244-V248 PolarHBondContact O-N 3.35Å; D246-V248 PolarHBondContact O-N 3.21Å; V248-Q250 VanDerWaalsContact C-N 3.33Å; V248-Q250 PolarHBondContact O-N 3.39Å; V248-R251 WeakPolarHBondContact O-CB 3.29Å; V248-R251 PolarHBondContact O-N 3.49Å; V248-R251 VanDerWaalsContact O-N 3.15Å
249	R	92.5	Very high	95.3	Very high	60 Å²	60	63.3 Å²	63.3	23%	0.226	34%	0.341	C	S	.	.	H	α-helix	trans	-64.4	-35.2	173.4	-74.6	166.2	178.7	140.6	1.7	113.2	M213 L219 P220 A245 D246 R251	M213-R249 HydrophobicContact CE-CG 4.28Å; L219-R249 HydrophobicContact CD1-CB 3.97Å; L219-R249 HydrophobicContact CD1-CG 4.19Å; P220-R249 PolarHBondContact O-NH2 3.27Å; A245-R249 WeakPolarHBondContact O-CG 3.4Å; A245-R249 PolarHBondContact O-N 2.86Å; A245-R249 VanDerWaalsContact O-N 3.14Å; D246-R249 PolarHBondContact O-N 2.64Å; D246-R249 VanDerWaalsContact O-N 3.16Å; D246-R249 WeakPolarHBondContact OD1-CD 3.47Å; D246-R249 IonicContact OD1-CZ 2.65Å; D246-R249 IonicContact OD1-NE 2.86Å; D246-R249 IonicContact OD1-NH1 2.8Å; D246-R249 PolarHBondContact OD1-NH1 2.86Å; R249-R251 PolarHBondContact O-N 2.8Å
250	Q	93.8	Very high	95.3	Very high	157 Å²	157	61.8 Å²	61.8	73%	0.734	34%	0.335	S	S	*	.	G	3₁₀ helix	trans	-64.5	-18.4	175	-71.1	174.4	30.5	0	0	112.9	D246 V248 R252	D246-Q250 WeakPolarHBondContact O-CG 3.45Å; D246-Q250 PolarHBondContact O-N 2.86Å; V248-Q250 VanDerWaalsContact C-N 3.33Å; V248-Q250 PolarHBondContact O-N 3.39Å; Q250-R252 PolarHBondContact O-N 2.53Å
251	R	94.1	Very high	95.3	Very high	90 Å²	90	57.1 Å²	57.1	34%	0.34	32%	0.316	S	S	.	.	G	3₁₀ helix	trans	-81.8	21	180	-69.3	169.7	166.9	-92.1	-5.8	115	D247 V248 R249 G253 E254	D247-R251 WeakPolarHBondContact O-CG 3.32Å; V248-R251 WeakPolarHBondContact O-CB 3.29Å; V248-R251 PolarHBondContact O-N 3.49Å; V248-R251 VanDerWaalsContact O-N 3.15Å; R249-R251 PolarHBondContact O-N 2.8Å; R251-G253 PolarHBondContact O-N 2.96Å; R251-G253 VanDerWaalsContact O-N 3.08Å; R251-E254 HydrophobicContact CB-CB 4.17Å; R251-E254 HydrophobicContact CB-CG 4.33Å; R251-E254 IonicContact NH1-OE2 2.69Å; R251-E254 WeakPolarHBondContact O-CB 3.19Å; R251-E254 VanDerWaalsContact O-CG 3.31Å; R251-E254 WeakPolarHBondContact O-CG 3.3Å; R251-E254 PolarHBondContact O-N 3.12Å
252	R	90.9	Very high	95.3	Very high	129 Å²	129	54.8 Å²	54.8	49%	0.487	30%	0.3	S	S	.	.	G	3₁₀ helix	trans	-54	-29	175.6	-169	175.4	179.7	-173.5	-5.1	113.7	Y216 E217 Q250	Y216-R252 PolarHBondContact O-NE 2.95Å; Y216-R252 PolarHBondContact O-NH2 3.39Å; E217-R252 VanDerWaalsContact O-CZ 3.22Å; E217-R252 PolarHBondContact O-NH1 3.08Å; E217-R252 PolarHBondContact O-NH2 2.91Å; Q250-R252 PolarHBondContact O-N 2.53Å
253	G	92	Very high	95.3	Very high	76 Å²	76	52 Å²	52	78%	0.784	29%	0.285	S	S	*	.	G	3₁₀ helix	trans	-95	13.4	174.5	0	0	0	0	0	115.8	R251	R251-G253 PolarHBondContact O-N 2.96Å; R251-G253 VanDerWaalsContact O-N 3.08Å
254	E	94.7	Very high	95.3	Very high	17 Å²	17	50.7 Å²	50.7	8%	0.079	28%	0.279	C	S	.	.			trans	-67.6	137.3	177.4	78.8	-169	163	0	0	111.1	W212 R251 A258 F259 R262	W212-E254 PolarHBondContact NE1-O 3.1Å; R251-E254 HydrophobicContact CB-CB 4.17Å; R251-E254 HydrophobicContact CB-CG 4.33Å; R251-E254 IonicContact NH1-OE2 2.69Å; R251-E254 WeakPolarHBondContact O-CB 3.19Å; R251-E254 VanDerWaalsContact O-CG 3.31Å; R251-E254 WeakPolarHBondContact O-CG 3.3Å; R251-E254 PolarHBondContact O-N 3.12Å; E254-A258 HydrophobicContact CB-CB 4.08Å; E254-F259 HydrophobicContact CG-CB 4.21Å; E254-R262 IonicContact OE1-CZ 3.53Å; E254-R262 IonicContact OE1-NE 2.68Å; E254-R262 PolarHBondContact OE1-NE 3.36Å; E254-R262 IonicContact OE1-NH2 3.54Å; E254-R262 PolarHBondContact OE1-NH2 2.77Å; E254-R262 IonicContact OE2-CZ 3.45Å; E254-R262 IonicContact OE2-NE 3.39Å; E254-R262 PolarHBondContact OE2-NE 3.01Å; E254-R262 IonicContact OE2-NH2 2.7Å
255	T	94.9	Very high	95.4	Very high	79 Å²	79	51.4 Å²	51.4	49%	0.485	28%	0.279	S	S	.	.			trans	-71.5	163.8	173.3	62.3	0	0	0	0	111	V257 A258 F259	T255-V257 VanDerWaalsContact C-N 3.28Å; T255-V257 PolarHBondContact O-N 3.48Å; T255-A258 PolarHBondContact O-N 3.29Å; T255-A258 WeakPolarHBondContact OG1-CB 3.46Å; T255-A258 PolarHBondContact OG1-N 2.85Å; T255-F259 PolarHBondContact O-N 3.33Å
256	P	94.4	Very high	95.6	Very high	21 Å²	21	50.1 Å²	50.1	14%	0.136	27%	0.269	C	S	.	.	H	α-helix	trans	-52	-46.7	171.4	-27.7	36.5	0	0	0	111.9	W212 A258 F259 Y260 M309	W212-P256 HydrophobicContact CZ2-CG 4.35Å; P256-A258 VanDerWaalsContact C-N 3.33Å; P256-A258 PolarHBondContact O-N 3.29Å; P256-F259 WeakPolarHBondContact O-CB 3.27Å; P256-F259 PolarHBondContact O-N 2.91Å; P256-F259 VanDerWaalsContact O-N 3.16Å; P256-Y260 VanDerWaalsContact O-CD2 3.3Å; P256-Y260 WeakPolarHBondContact O-CD2 3.32Å; P256-Y260 PolarHBondContact O-N 3.27Å; P256-M309 HydrophobicContact CB-CE 3.99Å; P256-M309 HydrophobicContact CB-SD 4.08Å; P256-M309 HydrophobicContact CG-CE 4.05Å; P256-M309 HydrophobicContact CG-SD 3.79Å
257	V	96.3	Very high	95.8	Very high	55 Å²	55	46 Å²	46	33%	0.333	25%	0.246	S	C	.	.	H	α-helix	trans	-55.9	-45.1	175	-174.1	0	0	0	0	112.1	T255 F259 Y260 Q261 A301 D303	T255-V257 VanDerWaalsContact C-N 3.28Å; T255-V257 PolarHBondContact O-N 3.48Å; V257-F259 PolarHBondContact O-N 3.3Å; V257-Y260 PolarHBondContact O-N 2.88Å; V257-Q261 WeakPolarHBondContact O-CB 3.36Å; V257-Q261 PolarHBondContact O-N 3.39Å; V257-A301 HydrophobicContact CG1-CB 4.09Å; V257-D303 HydrophobicContact CG2-CB 3.47Å; V257-D303 VanDerWaalsContact CG2-CB 3.47Å
258	A	96.6	Very high	95.9	Very high	33 Å²	33	48 Å²	48	27%	0.273	25%	0.252	S	S	.	.	H	α-helix	trans	-67.8	-32.8	179.9	0	0	0	0	0	113	E254 T255 P256 R262	E254-A258 HydrophobicContact CB-CB 4.08Å; T255-A258 PolarHBondContact O-N 3.29Å; T255-A258 WeakPolarHBondContact OG1-CB 3.46Å; T255-A258 PolarHBondContact OG1-N 2.85Å; P256-A258 VanDerWaalsContact C-N 3.33Å; P256-A258 PolarHBondContact O-N 3.29Å; A258-R262 WeakPolarHBondContact O-CB 3.41Å; A258-R262 PolarHBondContact O-N 3.3Å
259	F	97.3	Very high	96.1	Very high	0 Å²	0	53.4 Å²	53.4	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-64.4	-48	170	163.8	-94.8	0	0	0	111.9	F210 E211 W212 E254 T255 P256 V257 Q261 R262 C263 L287 A291	F210-F259 WeakPolarHBondContact O-CE2 3.47Å; E211-F259 VanDerWaalsContact C-CE2 3.47Å; W212-F259 HydrophobicContact CB-CB 4.45Å; W212-F259 HydrophobicContact CB-CD1 4.42Å; W212-F259 HydrophobicContact CB-CD2 3.88Å; W212-F259 HydrophobicContact CB-CE2 4.31Å; W212-F259 HydrophobicContact CB-CG 3.95Å; W212-F259 HydrophobicContact CG-CB 4.33Å; W212-F259 HydrophobicContact CG-CG 4.35Å; E254-F259 HydrophobicContact CG-CB 4.21Å; T255-F259 PolarHBondContact O-N 3.33Å; P256-F259 WeakPolarHBondContact O-CB 3.27Å; P256-F259 PolarHBondContact O-N 2.91Å; P256-F259 VanDerWaalsContact O-N 3.16Å; V257-F259 PolarHBondContact O-N 3.3Å; F259-Q261 VanDerWaalsContact C-N 3.3Å; F259-Q261 PolarHBondContact O-N 3.37Å; F259-R262 PolarHBondContact O-N 3.3Å; F259-C263 PolarHBondContact O-N 2.9Å; F259-C263 VanDerWaalsContact O-N 3.12Å; F259-C263 PolarHBondContact O-SG 2.93Å; F259-L287 HydrophobicContact CD1-CD2 3.8Å; F259-L287 HydrophobicContact CD1-CG 4.28Å; F259-L287 HydrophobicContact CE1-CB 4.3Å; F259-L287 HydrophobicContact CE1-CD2 3.48Å; F259-L287 VanDerWaalsContact CE1-CD2 3.48Å; F259-L287 HydrophobicContact CE1-CG 3.6Å; F259-L287 HydrophobicContact CZ-CB 4.46Å; F259-L287 HydrophobicContact CZ-CD2 3.99Å; F259-L287 HydrophobicContact CZ-CG 4.2Å; F259-A291 HydrophobicContact CE1-CB 4.16Å
260	Y	97.7	Very high	96.4	Very high	2 Å²	2	50.7 Å²	50.7	1%	0.008	27%	0.266	C	S	.	.	H	α-helix	trans	-60.2	-42.6	177	-87.8	-106.2	0	0	0	110.7	P256 V257 C263 A264 L287 D290 A291 V304	P256-Y260 VanDerWaalsContact O-CD2 3.3Å; P256-Y260 WeakPolarHBondContact O-CD2 3.32Å; P256-Y260 PolarHBondContact O-N 3.27Å; V257-Y260 PolarHBondContact O-N 2.88Å; Y260-C263 PolarHBondContact O-N 3.09Å; Y260-A264 WeakPolarHBondContact O-CB 3.35Å; Y260-A264 PolarHBondContact O-N 3.11Å; Y260-L287 HydrophobicContact CE2-CD1 4.17Å; Y260-L287 HydrophobicContact CE2-CG 4.28Å; Y260-L287 WeakPolarHBondContact OH-CD1 3.37Å; Y260-D290 HydrophobicContact CE1-CB 4.47Å; Y260-D290 WeakPolarHBondContact CE1-OD2 3.46Å; Y260-D290 VanDerWaalsContact CZ-OD2 3.27Å; Y260-D290 PolarHBondContact OH-OD2 3.35Å; Y260-A291 VanDerWaalsContact CD1-CA 3.46Å; Y260-A291 HydrophobicContact CD1-CB 3.5Å; Y260-A291 VanDerWaalsContact CE1-CA 3.41Å; Y260-A291 HydrophobicContact CE1-CB 3.68Å; Y260-A291 HydrophobicContact CG-CB 3.94Å; Y260-V304 HydrophobicContact CD2-CG2 4.39Å; Y260-V304 HydrophobicContact CE1-CG2 4.42Å; Y260-V304 HydrophobicContact CE2-CB 4.46Å; Y260-V304 HydrophobicContact CE2-CG2 3.59Å
261	Q	97.5	Very high	96.5	Very high	84 Å²	84	43.7 Å²	43.7	39%	0.393	23%	0.233	S	C	.	.	H	α-helix	trans	-65.8	-42.5	176.6	-166.1	62.6	43.7	0	0	112.4	V257 F259 C263 A264 D265	V257-Q261 WeakPolarHBondContact O-CB 3.36Å; V257-Q261 PolarHBondContact O-N 3.39Å; F259-Q261 VanDerWaalsContact C-N 3.3Å; F259-Q261 PolarHBondContact O-N 3.37Å; Q261-C263 VanDerWaalsContact C-N 3.3Å; Q261-C263 PolarHBondContact O-N 2.94Å; Q261-A264 PolarHBondContact O-N 2.94Å; Q261-D265 PolarHBondContact NE2-OD1 3.31Å; Q261-D265 WeakPolarHBondContact O-CB 3.38Å; Q261-D265 VanDerWaalsContact O-CG 3.3Å; Q261-D265 PolarHBondContact O-N 3.18Å
262	R	97.8	Very high	96.6	Very high	9 Å²	9	44.5 Å²	44.5	3%	0.034	24%	0.244	C	C	.	.	H	α-helix	trans	-53.5	-46.6	174.4	166.1	168.1	64.5	86.9	-21.3	111.8	S208 F210 E211 L243 E254 A258 F259 A266	S208-R262 PolarHBondContact O-NH1 2.97Å; F210-R262 PolarHBondContact O-NH1 3.29Å; F210-R262 PolarHBondContact O-NH2 2.99Å; E211-R262 PolarHBondContact O-NH2 2.83Å; L243-R262 HydrophobicContact CD1-CG 4.19Å; E254-R262 IonicContact OE1-CZ 3.53Å; E254-R262 IonicContact OE1-NE 2.68Å; E254-R262 PolarHBondContact OE1-NE 3.36Å; E254-R262 IonicContact OE1-NH2 3.54Å; E254-R262 PolarHBondContact OE1-NH2 2.77Å; E254-R262 IonicContact OE2-CZ 3.45Å; E254-R262 IonicContact OE2-NE 3.39Å; E254-R262 PolarHBondContact OE2-NE 3.01Å; E254-R262 IonicContact OE2-NH2 2.7Å; A258-R262 WeakPolarHBondContact O-CB 3.41Å; A258-R262 PolarHBondContact O-N 3.3Å; F259-R262 PolarHBondContact O-N 3.3Å; R262-A266 WeakPolarHBondContact O-CB 3.39Å; R262-A266 PolarHBondContact O-N 3.13Å
263	C	98.2	Very high	96.9	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-70.5	-40.4	-180	-62.9	0	0	0	0	111.8	F259 Y260 Q261 A266 M267 A291 L292	F259-C263 PolarHBondContact O-N 2.9Å; F259-C263 VanDerWaalsContact O-N 3.12Å; F259-C263 PolarHBondContact O-SG 2.93Å; Y260-C263 PolarHBondContact O-N 3.09Å; Q261-C263 VanDerWaalsContact C-N 3.3Å; Q261-C263 PolarHBondContact O-N 2.94Å; C263-A266 PolarHBondContact O-N 3.28Å; C263-M267 PolarHBondContact O-N 3.08Å; C263-A291 HydrophobicContact CB-CB 4.09Å; C263-L292 HydrophobicContact CB-CD2 3.92Å; C263-L292 WeakPolarHBondContact O-CD2 3.32Å
264	A	98	Very high	97	Very high	10 Å²	10	41.8 Å²	41.8	8%	0.083	22%	0.215	C	C	.	.	H	α-helix	trans	-62.1	-47.9	176.1	0	0	0	0	0	112.5	Y260 Q261 A266 M267 K268 F295	Y260-A264 WeakPolarHBondContact O-CB 3.35Å; Y260-A264 PolarHBondContact O-N 3.11Å; Q261-A264 PolarHBondContact O-N 2.94Å; A264-A266 VanDerWaalsContact C-N 3.31Å; A264-A266 PolarHBondContact O-N 2.91Å; A264-M267 PolarHBondContact O-N 3.15Å; A264-K268 WeakPolarHBondContact O-CB 3.37Å; A264-K268 PolarHBondContact O-N 3.39Å; A264-F295 HydrophobicContact CB-CB 4Å; A264-F295 HydrophobicContact CB-CD2 3.7Å; A264-F295 HydrophobicContact CB-CG 4Å
265	D	98.1	Very high	96.9	Very high	70 Å²	70	47.5 Å²	47.5	37%	0.374	24%	0.244	S	C	.	.	H	α-helix	trans	-62	-39	178.3	-71	-19.1	0	0	0	111.9	Q261 K269	Q261-D265 PolarHBondContact NE2-OD1 3.31Å; Q261-D265 WeakPolarHBondContact O-CB 3.38Å; Q261-D265 VanDerWaalsContact O-CG 3.3Å; Q261-D265 PolarHBondContact O-N 3.18Å; D265-K269 VanDerWaalsContact O-CG 3.29Å; D265-K269 WeakPolarHBondContact O-CG 3.44Å; D265-K269 PolarHBondContact O-N 3.21Å
266	A	98.5	Very high	96.9	Very high	5 Å²	5	49.4 Å²	49.4	4%	0.041	25%	0.248	C	C	.	.	H	α-helix	trans	-67.8	-46.7	177.4	0	0	0	0	0	112	S208 F209 L242 R262 C263 A264 K268 K269 I270	S208-A266 VanDerWaalsContact CB-CB 3.41Å; F209-A266 HydrophobicContact CD1-CB 4.4Å; F209-A266 HydrophobicContact CE1-CB 3.74Å; F209-A266 HydrophobicContact CZ-CB 4.08Å; L242-A266 HydrophobicContact CD1-CB 4.01Å; L242-A266 VanDerWaalsContact CD1-O 3.28Å; L242-A266 WeakPolarHBondContact CD1-O 3.46Å; R262-A266 WeakPolarHBondContact O-CB 3.39Å; R262-A266 PolarHBondContact O-N 3.13Å; C263-A266 PolarHBondContact O-N 3.28Å; A264-A266 VanDerWaalsContact C-N 3.31Å; A264-A266 PolarHBondContact O-N 2.91Å; A266-K268 VanDerWaalsContact C-N 3.35Å; A266-K268 PolarHBondContact O-N 3.26Å; A266-K269 PolarHBondContact O-N 3.05Å; A266-I270 PolarHBondContact O-N 2.9Å; A266-I270 VanDerWaalsContact O-N 3.07Å
267	M	98.3	Very high	96.9	Very high	0 Å²	0	53.2 Å²	53.2	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-63.5	-40.5	174.9	173.6	160.4	-86.9	0	0	111.8	V98 L100 F209 C263 A264 I270 L271 F282 L292 F295 L296	V98-M267 HydrophobicContact CG1-CE 3.99Å; L100-M267 HydrophobicContact CD2-CE 3.86Å; F209-M267 HydrophobicContact CE1-CB 4.17Å; F209-M267 HydrophobicContact CZ-CB 4.25Å; C263-M267 PolarHBondContact O-N 3.08Å; A264-M267 PolarHBondContact O-N 3.15Å; M267-I270 PolarHBondContact O-N 2.7Å; M267-L271 HydrophobicContact CG-CD1 3.65Å; M267-L271 HydrophobicContact CG-CG 4.02Å; M267-L271 WeakPolarHBondContact O-CG 3.38Å; M267-L271 PolarHBondContact O-N 2.94Å; M267-L271 HydrophobicContact SD-CD1 4.26Å; M267-F282 HydrophobicContact CE-CD1 3.71Å; M267-F282 HydrophobicContact CE-CD2 3.77Å; M267-F282 HydrophobicContact CE-CE1 3.53Å; M267-F282 HydrophobicContact CE-CE2 3.58Å; M267-F282 HydrophobicContact CE-CG 3.84Å; M267-F282 HydrophobicContact CE-CZ 3.46Å; M267-F282 VanDerWaalsContact CE-CZ 3.46Å; M267-L292 HydrophobicContact CB-CD2 3.63Å; M267-L292 HydrophobicContact CE-CB 4.35Å; M267-L292 HydrophobicContact CE-CD1 3.91Å; M267-L292 HydrophobicContact CE-CD2 4.26Å; M267-L292 HydrophobicContact CE-CG 4.39Å; M267-L292 HydrophobicContact CG-CD2 4.36Å; M267-L292 HydrophobicContact SD-CB 4.07Å; M267-L292 HydrophobicContact SD-CD2 3.89Å; M267-L292 HydrophobicContact SD-CG 4.36Å; M267-F295 HydrophobicContact CB-CD1 4.24Å; M267-F295 HydrophobicContact CB-CE1 4.29Å; M267-F295 HydrophobicContact CG-CD1 3.84Å; M267-F295 HydrophobicContact CG-CE1 3.75Å; M267-F295 HydrophobicContact SD-CD1 3.93Å; M267-F295 HydrophobicContact SD-CE1 4.32Å; M267-L296 HydrophobicContact SD-CD1 4Å; M267-L296 HydrophobicContact SD-CD2 3.89Å; M267-L296 HydrophobicContact SD-CG 3.88Å
268	K	97.8	Very high	96.8	Very high	110 Å²	110	51.5 Å²	51.5	48%	0.478	26%	0.261	S	S	.	.	H	α-helix	trans	-56.1	-54.4	174.8	-173.2	-178.3	173.9	-176.7	0	111.3	A264 A266 I270 L271 D272 F295	A264-K268 WeakPolarHBondContact O-CB 3.37Å; A264-K268 PolarHBondContact O-N 3.39Å; A266-K268 VanDerWaalsContact C-N 3.35Å; A266-K268 PolarHBondContact O-N 3.26Å; K268-I270 PolarHBondContact O-N 3.05Å; K268-L271 PolarHBondContact O-N 3.2Å; K268-D272 WeakPolarHBondContact O-CB 3.42Å; K268-D272 VanDerWaalsContact O-CG 3.24Å; K268-D272 PolarHBondContact O-N 2.8Å; K268-F295 HydrophobicContact CB-CE2 4.04Å; K268-F295 HydrophobicContact CB-CZ 3.65Å; K268-F295 HydrophobicContact CG-CZ 4.16Å
269	K	98.2	Very high	96.8	Very high	114 Å²	114	51 Å²	51	50%	0.496	25%	0.253	S	S	.	.	H	α-helix	trans	-58	-32.7	178.5	-72.2	169.1	-177.5	176.3	0	113.2	L242 D265 A266 K273	L242-K269 HydrophobicContact CD1-CB 3.7Å; L242-K269 HydrophobicContact CD1-CD 4.15Å; L242-K269 HydrophobicContact CD2-CB 4.16Å; L242-K269 HydrophobicContact CD2-CD 4.25Å; D265-K269 VanDerWaalsContact O-CG 3.29Å; D265-K269 WeakPolarHBondContact O-CG 3.44Å; D265-K269 PolarHBondContact O-N 3.21Å; A266-K269 PolarHBondContact O-N 3.05Å; K269-K273 WeakPolarHBondContact O-CB 3.43Å; K269-K273 PolarHBondContact O-N 2.59Å
270	I	98.2	Very high	96.9	Very high	4 Å²	4	51 Å²	51	2%	0.021	25%	0.253	C	S	.	.	H	α-helix	trans	-71.7	-47	173.2	-79.7	157.8	0	0	0	111.3	Y178 F209 L242 A266 M267 K268 D272 K273 E274 F282	Y178-I270 HydrophobicContact CD1-CD1 3.7Å; Y178-I270 HydrophobicContact CD1-CG1 4.42Å; Y178-I270 HydrophobicContact CD2-CG2 4.12Å; Y178-I270 HydrophobicContact CE1-CD1 3.64Å; Y178-I270 HydrophobicContact CE1-CG1 3.86Å; Y178-I270 HydrophobicContact CE1-CG2 4.33Å; Y178-I270 HydrophobicContact CE2-CG2 3.49Å; Y178-I270 VanDerWaalsContact CE2-CG2 3.49Å; Y178-I270 HydrophobicContact CG-CD1 4.18Å; F209-I270 HydrophobicContact CE2-CD1 3.59Å; F209-I270 HydrophobicContact CZ-CD1 3.66Å; L242-I270 HydrophobicContact CD1-CD1 4.08Å; L242-I270 HydrophobicContact CD1-CG1 4.05Å; A266-I270 PolarHBondContact O-N 2.9Å; A266-I270 VanDerWaalsContact O-N 3.07Å; M267-I270 PolarHBondContact O-N 2.7Å; K268-I270 PolarHBondContact O-N 3.05Å; I270-D272 VanDerWaalsContact C-N 3.32Å; I270-D272 PolarHBondContact O-N 3.3Å; I270-K273 PolarHBondContact O-N 3.04Å; I270-K273 VanDerWaalsContact O-N 3.09Å; I270-E274 HydrophobicContact CG2-CG 4.08Å; I270-E274 WeakPolarHBondContact O-CB 3.24Å; I270-E274 WeakPolarHBondContact O-CG 3.31Å; I270-E274 PolarHBondContact O-N 2.69Å; I270-F282 HydrophobicContact CD1-CE1 4.39Å; I270-F282 HydrophobicContact CG2-CE1 4.14Å; I270-F282 HydrophobicContact CG2-CZ 3.83Å
271	L	97.5	Very high	96.9	Very high	9 Å²	9	51 Å²	51	5%	0.047	25%	0.253	C	S	.	.	H	α-helix	trans	-71.4	-23.7	-179.7	-64.3	176.8	0	0	0	113.6	R96 V98 M267 K268 K273 M280 F295 L296 W332	R96-L271 PolarHBondContact NH1-O 2.77Å; R96-L271 PolarHBondContact NH2-O 3.42Å; V98-L271 HydrophobicContact CG2-CD2 3.87Å; M267-L271 HydrophobicContact CG-CD1 3.65Å; M267-L271 HydrophobicContact CG-CG 4.02Å; M267-L271 WeakPolarHBondContact O-CG 3.38Å; M267-L271 PolarHBondContact O-N 2.94Å; M267-L271 HydrophobicContact SD-CD1 4.26Å; K268-L271 PolarHBondContact O-N 3.2Å; L271-K273 VanDerWaalsContact C-N 3.32Å; L271-M280 HydrophobicContact CD2-CE 3.58Å; L271-M280 HydrophobicContact CD2-SD 3.83Å; L271-F295 HydrophobicContact CD1-CE1 4.1Å; L271-L296 HydrophobicContact CD1-CD2 3.89Å; L271-W332 HydrophobicContact CD1-CZ2 3.83Å; L271-W332 HydrophobicContact CD2-CH2 4.09Å; L271-W332 HydrophobicContact CD2-CZ2 3.86Å; L271-W332 HydrophobicContact CG-CZ2 4.36Å
272	D	96.6	Very high	97	Very high	108 Å²	108	47 Å²	47	58%	0.578	23%	0.234	S	C	*	.	H	α-helix	trans	-72.2	-27.2	170.3	-68.5	-20.9	0	0	0	111.4	K268 I270	K268-D272 WeakPolarHBondContact O-CB 3.42Å; K268-D272 VanDerWaalsContact O-CG 3.24Å; K268-D272 PolarHBondContact O-N 2.8Å; I270-D272 VanDerWaalsContact C-N 3.32Å; I270-D272 PolarHBondContact O-N 3.3Å
273	K	96	Very high	97	Very high	127 Å²	127	46.5 Å²	46.5	55%	0.552	23%	0.233	S	C	*	.	H	α-helix	trans	-91.6	-48.1	-179.4	177.9	-176.7	175	-115.1	0	113.6	K269 I270 L271 I275	K269-K273 WeakPolarHBondContact O-CB 3.43Å; K269-K273 PolarHBondContact O-N 2.59Å; I270-K273 PolarHBondContact O-N 3.04Å; I270-K273 VanDerWaalsContact O-N 3.09Å; L271-K273 VanDerWaalsContact C-N 3.32Å; K273-I275 VanDerWaalsContact C-N 3.31Å; K273-I275 PolarHBondContact O-N 2.91Å
274	E	95.2	Very high	97.1	Very high	21 Å²	21	46.5 Å²	46.5	10%	0.098	23%	0.233	C	C	.	.			trans	-85	75.3	-171.6	-54.6	-67.6	140.1	0	0	109.6	R96 K176 Y178 I270 E276 M280	R96-E274 PolarHBondContact NH1-O 2.89Å; K176-E274 VanDerWaalsContact CE-OE2 3.28Å; K176-E274 WeakPolarHBondContact CE-OE2 3.47Å; Y178-E274 HydrophobicContact CE2-CG 4.42Å; Y178-E274 WeakPolarHBondContact OH-CG 3.42Å; Y178-E274 PolarHBondContact OH-OE1 3.19Å; I270-E274 HydrophobicContact CG2-CG 4.08Å; I270-E274 WeakPolarHBondContact O-CB 3.24Å; I270-E274 WeakPolarHBondContact O-CG 3.31Å; I270-E274 PolarHBondContact O-N 2.69Å; E274-E276 VanDerWaalsContact C-N 3.3Å; E274-E276 PolarHBondContact O-N 2.68Å; E274-M280 HydrophobicContact CB-SD 3.94Å
275	I	92.7	Very high	97.1	Very high	137 Å²	137	46.1 Å²	46.1	70%	0.703	23%	0.229	S	C	*	.			trans	-78.9	-4	-174.9	62.2	171.2	0	0	0	114.9	K273	K273-I275 VanDerWaalsContact C-N 3.31Å; K273-I275 PolarHBondContact O-N 2.91Å
276	E	93.4	Very high	97.1	Very high	119 Å²	119	43.3 Å²	43.3	56%	0.556	22%	0.215	S	C	*	.	S	Bend	trans	-70	145.7	-178.4	-173.2	178.2	167.3	0	0	112.2	R96 Y175 E274	R96-E276 WeakPolarHBondContact CD-O 3.09Å; R96-E276 WeakPolarHBondContact CG-O 3.38Å; Y175-E276 HydrophobicContact CD2-CG 4.4Å; Y175-E276 WeakPolarHBondContact CD2-OE2 3.4Å; Y175-E276 HydrophobicContact CE2-CB 3.77Å; Y175-E276 HydrophobicContact CE2-CG 4.14Å; Y175-E276 PolarHBondContact OH-O 3.37Å; E274-E276 VanDerWaalsContact C-N 3.3Å; E274-E276 PolarHBondContact O-N 2.68Å
277	N	94.2	Very high	97	Very high	100 Å²	100	43 Å²	43	54%	0.535	21%	0.213	S	C	.	.	S	Bend	trans	-81.1	129.5	175.4	-82.8	-5.8	0	0	0	111.2	S94 R96	S94-N277 VanDerWaalsContact O-CG 3.31Å; S94-N277 PolarHBondContact O-ND2 2.92Å; S94-N277 PolarHBondContact O-OD1 3.49Å; S94-N277 VanDerWaalsContact O-OD1 3.08Å; R96-N277 WeakPolarHBondContact CG-OD1 3.48Å
278	G	95.6	Very high	97	Very high	20 Å²	20	43 Å²	43	21%	0.206	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	147.4	-170.8	-176.2	0	0	0	0	0	112.5	G95 R97	G95-G278 PolarHBondContact O-N 3.11Å; R97-G278 PolarHBondContact N-O 2.86Å
279	N	97.1	Very high	97	Very high	22 Å²	22	37.8 Å²	37.8	12%	0.118	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	127.1	-177.5	-43	-64.3	0	0	0	110.8	F99 Q172 E173 P174 Y175	F99-N279 HydrophobicContact CD2-CB 4.01Å; F99-N279 HydrophobicContact CE2-CB 3.78Å; Q172-N279 VanDerWaalsContact C-ND2 3.26Å; Q172-N279 WeakPolarHBondContact CA-ND2 3.49Å; Q172-N279 PolarHBondContact O-ND2 3.06Å; E173-N279 PolarHBondContact O-ND2 2.94Å; P174-N279 CarbonylContact C-O 3.48Å; P174-N279 WeakPolarHBondContact CA-O 3.45Å; Y175-N279 WeakPolarHBondContact CD1-O 3.49Å; Y175-N279 PolarHBondContact N-O 3.34Å
280	M	98.2	Very high	97	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	131.5	167.8	-65.6	173.7	-94.5	0	0	109.3	R96 R97 V98 F99 Y175 K176 L271 E274 F282 W332	R96-M280 HydrophobicContact CB-CE 4.34Å; R97-M280 PolarHBondContact O-N 2.79Å; V98-M280 CarbonylContact C-O 3.57Å; V98-M280 WeakPolarHBondContact CA-O 3.27Å; V98-M280 HydrophobicContact CG2-CB 4.44Å; V98-M280 HydrophobicContact CG2-CE 4.04Å; F99-M280 PolarHBondContact N-O 2.96Å; Y175-M280 HydrophobicContact CE1-CG 3.66Å; K176-M280 HydrophobicContact CB-CG 4.22Å; K176-M280 WeakPolarHBondContact O-CA 3.3Å; L271-M280 HydrophobicContact CD2-CE 3.58Å; L271-M280 HydrophobicContact CD2-SD 3.83Å; E274-M280 HydrophobicContact CB-SD 3.94Å; M280-F282 HydrophobicContact CB-CE2 3.78Å; M280-W332 HydrophobicContact CE-CH2 4.21Å
281	L	98.6	Very high	97	Very high	1 Å²	1	33.3 Å²	33.3	1%	0.005	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	134.1	178	174.5	66	0	0	0	110.9	F99 M101 M167 P174 K176 I177 Y178 L192 V283	F99-L281 HydrophobicContact CB-CD1 3.94Å; F99-L281 CarbonylContact O-C 3.56Å; F99-L281 WeakPolarHBondContact O-CA 3.37Å; M101-L281 HydrophobicContact CB-CD1 3.93Å; M167-L281 HydrophobicContact CE-CD1 4.21Å; M167-L281 HydrophobicContact SD-CD2 4.37Å; P174-L281 HydrophobicContact CB-CB 3.79Å; P174-L281 HydrophobicContact CG-CB 4.12Å; P174-L281 HydrophobicContact CG-CD2 4.18Å; K176-L281 PolarHBondContact O-N 3.46Å; I177-L281 CarbonylContact C-O 3.55Å; I177-L281 WeakPolarHBondContact CA-O 3.32Å; I177-L281 HydrophobicContact CG1-CB 4.35Å; I177-L281 HydrophobicContact CG1-CD2 4.49Å; Y178-L281 PolarHBondContact N-O 3.21Å; L192-L281 HydrophobicContact CD1-CD2 3.87Å; L192-L281 HydrophobicContact CD2-CD2 3.89Å; L281-V283 HydrophobicContact CD1-CG2 4.24Å; L281-V283 HydrophobicContact CD2-CG2 3.92Å; L281-V283 HydrophobicContact CG-CG2 3.85Å
282	F	98.8	Very high	97	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	105.1	177.7	-66.3	-102.1	0	0	0	109.3	V98 F99 L100 M101 Y178 F209 M267 I270 M280 V284	V98-F282 HydrophobicContact CG1-CD2 3.86Å; V98-F282 HydrophobicContact CG1-CE2 3.89Å; V98-F282 HydrophobicContact CG2-CE2 4.25Å; F99-F282 PolarHBondContact O-N 2.9Å; L100-F282 HydrophobicContact CD2-CB 4.08Å; L100-F282 HydrophobicContact CD2-CD2 4.3Å; L100-F282 HydrophobicContact CD2-CG 4.32Å; M101-F282 PolarHBondContact N-O 3.19Å; Y178-F282 HydrophobicContact CD2-CD1 4.15Å; Y178-F282 AromaticContact CD2-CE1 3.57Å; Y178-F282 HydrophobicContact CD2-CE1 3.57Å; Y178-F282 HydrophobicContact CD2-CE2 4.35Å; Y178-F282 AromaticContact CD2-CZ 3.69Å; Y178-F282 HydrophobicContact CD2-CZ 3.69Å; Y178-F282 HydrophobicContact CE2-CE1 4.39Å; Y178-F282 HydrophobicContact CE2-CZ 4.24Å; Y178-F282 HydrophobicContact CG-CD1 4.18Å; Y178-F282 AromaticContact CG-CE1 3.85Å; Y178-F282 HydrophobicContact CG-CE1 3.85Å; Y178-F282 HydrophobicContact CG-CZ 4.43Å; Y178-F282 CarbonylContact O-C 3.55Å; Y178-F282 WeakPolarHBondContact O-CA 3.47Å; F209-F282 HydrophobicContact CD2-CD1 4.23Å; F209-F282 AromaticContact CE2-CD1 3.61Å; F209-F282 HydrophobicContact CE2-CD1 3.61Å; F209-F282 AromaticContact CE2-CE1 3.68Å; F209-F282 HydrophobicContact CE2-CE1 3.68Å; F209-F282 AromaticContact CZ-CD1 3.9Å; F209-F282 HydrophobicContact CZ-CD1 3.9Å; F209-F282 AromaticContact CZ-CE1 3.76Å; F209-F282 HydrophobicContact CZ-CE1 3.76Å; M267-F282 HydrophobicContact CE-CD1 3.71Å; M267-F282 HydrophobicContact CE-CD2 3.77Å; M267-F282 HydrophobicContact CE-CE1 3.53Å; M267-F282 HydrophobicContact CE-CE2 3.58Å; M267-F282 HydrophobicContact CE-CG 3.84Å; M267-F282 HydrophobicContact CE-CZ 3.46Å; M267-F282 VanDerWaalsContact CE-CZ 3.46Å; I270-F282 HydrophobicContact CD1-CE1 4.39Å; I270-F282 HydrophobicContact CG2-CE1 4.14Å; I270-F282 HydrophobicContact CG2-CZ 3.83Å; M280-F282 HydrophobicContact CB-CE2 3.78Å; F282-V284 HydrophobicContact CB-CG1 4.38Å
283	V	98.8	Very high	97.1	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	107.2	-179.7	-172.7	0	0	0	0	110.2	M101 Y178 V179 S180 C185 T188 C189 L281	M101-V283 HydrophobicContact CB-CG2 4.3Å; M101-V283 WeakPolarHBondContact O-CA 3.13Å; M101-V283 HydrophobicContact SD-CG2 4.23Å; Y178-V283 PolarHBondContact O-N 3.06Å; V179-V283 WeakPolarHBondContact CA-O 3.47Å; V179-V283 HydrophobicContact CG2-CB 4.05Å; V179-V283 HydrophobicContact CG2-CG1 4.48Å; S180-V283 PolarHBondContact N-O 2.86Å; C185-V283 HydrophobicContact CB-CG1 4.35Å; C185-V283 WeakPolarHBondContact O-CG1 3.39Å; T188-V283 HydrophobicContact CG2-CG1 4.13Å; C189-V283 HydrophobicContact CB-CB 4.16Å; C189-V283 HydrophobicContact CB-CG1 4.25Å; C189-V283 HydrophobicContact CB-CG2 3.86Å; L281-V283 HydrophobicContact CD1-CG2 4.24Å; L281-V283 HydrophobicContact CD2-CG2 3.92Å; L281-V283 HydrophobicContact CG-CG2 3.85Å
284	V	98.8	Very high	97.1	Very high	0 Å²	0	24.3 Å²	24.3	0%	0	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	-158.4	-162.6	-59.8	0	0	0	0	111.7	M101 R102 N103 F209 F282 T288 V289	M101-V284 PolarHBondContact O-N 2.89Å; R102-V284 CarbonylContact C-O 3.56Å; R102-V284 WeakPolarHBondContact CA-O 3.38Å; N103-V284 PolarHBondContact N-O 3.17Å; F209-V284 HydrophobicContact CB-CG1 3.79Å; F209-V284 HydrophobicContact CG-CG1 4.32Å; F282-V284 HydrophobicContact CB-CG1 4.38Å; V284-T288 HydrophobicContact CB-CG2 3.79Å; V284-T288 HydrophobicContact CG1-CG2 4.05Å; V284-T288 HydrophobicContact CG2-CG2 3.94Å; V284-V289 HydrophobicContact CG2-CG2 3.72Å
285	H	98.3	Very high	97.2	Very high	1 Å²	1	26 Å²	26	1%	0.005	13%	0.133	C	C	.	.			trans	-109.7	162.6	-176.9	-48.4	-90.3	0	0	0	111.1	S180 A182 C185 F210 E211 L287 T288 V289	S180-H285 WeakPolarHBondContact CB-NE2 3.47Å; S180-H285 PolarHBondContact OG-NE2 3.47Å; A182-H285 VanDerWaalsContact CB-CE1 3.47Å; A182-H285 WeakPolarHBondContact CB-CE1 3.41Å; C185-H285 VanDerWaalsContact SG-CE1 3.55Å; F210-H285 AromaticContact CD2-NE2 3.88Å; E211-H285 HydrophobicContact CB-CB 3.87Å; E211-H285 VanDerWaalsContact CD-ND1 3.33Å; E211-H285 PolarHBondContact N-CD2 3.43Å; E211-H285 VanDerWaalsContact N-CD2 3.35Å; E211-H285 IonicContact OE1-CE1 3.54Å; E211-H285 PolarHBondContact OE1-CE1 3.46Å; E211-H285 VanDerWaalsContact OE1-CE1 3.24Å; E211-H285 IonicContact OE1-CG 2.7Å; E211-H285 IonicContact OE1-ND1 3.48Å; E211-H285 PolarHBondContact OE1-ND1 3.46Å; E211-H285 IonicContact OE2-ND1 2.87Å; H285-L287 PolarHBondContact O-N 3.26Å; H285-T288 CarbonylContact O-C 3.53Å; H285-T288 WeakPolarHBondContact O-CA 3.33Å; H285-T288 WeakPolarHBondContact O-CB 3.43Å; H285-T288 PolarHBondContact O-N 3.09Å; H285-V289 WeakPolarHBondContact O-CG2 3.2Å; H285-V289 PolarHBondContact O-N 2.86Å
286	S	97.5	Very high	97.5	Very high	11 Å²	11	19.8 Å²	19.8	8%	0.077	10%	0.101	C	C	.	.	H	α-helix	trans	-53.5	-47.4	-178	46.1	0	0	0	0	113.5	T288 V289 D290	S286-T288 VanDerWaalsContact C-N 3.33Å; S286-T288 PolarHBondContact O-N 3.33Å; S286-V289 PolarHBondContact O-N 2.98Å; S286-D290 PolarHBondContact O-N 3.29Å
287	L	97.1	Very high	97.6	Very high	0 Å²	0	17.7 Å²	17.7	0%	0	9%	0.092	C	C	.	.	H	α-helix	trans	-66.2	-34.2	177.7	-164.3	76.1	0	0	0	112.6	W212 W215 F259 Y260 H285 A291 M309 M312	W212-L287 HydrophobicContact CB-CD2 3.79Å; W215-L287 HydrophobicContact CH2-CB 3.85Å; W215-L287 HydrophobicContact CH2-CD2 3.84Å; W215-L287 HydrophobicContact CH2-CG 4.29Å; W215-L287 HydrophobicContact CZ2-CD2 4.37Å; W215-L287 HydrophobicContact CZ3-CB 4.13Å; W215-L287 HydrophobicContact CZ3-CD2 4.03Å; F259-L287 HydrophobicContact CD1-CD2 3.8Å; F259-L287 HydrophobicContact CD1-CG 4.28Å; F259-L287 HydrophobicContact CE1-CB 4.3Å; F259-L287 HydrophobicContact CE1-CD2 3.48Å; F259-L287 VanDerWaalsContact CE1-CD2 3.48Å; F259-L287 HydrophobicContact CE1-CG 3.6Å; F259-L287 HydrophobicContact CZ-CB 4.46Å; F259-L287 HydrophobicContact CZ-CD2 3.99Å; F259-L287 HydrophobicContact CZ-CG 4.2Å; Y260-L287 HydrophobicContact CE2-CD1 4.17Å; Y260-L287 HydrophobicContact CE2-CG 4.28Å; Y260-L287 WeakPolarHBondContact OH-CD1 3.37Å; H285-L287 PolarHBondContact O-N 3.26Å; L287-A291 WeakPolarHBondContact O-CB 3.4Å; L287-A291 PolarHBondContact O-N 2.85Å; L287-M309 HydrophobicContact CD1-CB 4.09Å; L287-M309 HydrophobicContact CD1-CE 4.32Å; L287-M309 HydrophobicContact CD1-CG 4.19Å; L287-M309 HydrophobicContact CD2-CE 3.58Å; L287-M312 HydrophobicContact CB-CG 4.46Å; L287-M312 HydrophobicContact CD1-CB 4.3Å; L287-M312 HydrophobicContact CD1-CE 4.1Å; L287-M312 HydrophobicContact CD1-CG 4.13Å
288	T	98.2	Very high	97.7	Very high	0 Å²	0	16.2 Å²	16.2	0%	0	10%	0.1	C	C	.	.	H	α-helix	trans	-68.6	-36.3	172.9	-43.4	0	0	0	0	111.3	F209 V284 H285 S286 A291 L292	F209-T288 HydrophobicContact CB-CG2 4.2Å; F209-T288 HydrophobicContact CD1-CG2 4.42Å; F209-T288 PolarHBondContact O-OG1 3.46Å; V284-T288 HydrophobicContact CB-CG2 3.79Å; V284-T288 HydrophobicContact CG1-CG2 4.05Å; V284-T288 HydrophobicContact CG2-CG2 3.94Å; H285-T288 CarbonylContact O-C 3.53Å; H285-T288 WeakPolarHBondContact O-CA 3.33Å; H285-T288 WeakPolarHBondContact O-CB 3.43Å; H285-T288 PolarHBondContact O-N 3.09Å; S286-T288 VanDerWaalsContact C-N 3.33Å; S286-T288 PolarHBondContact O-N 3.33Å; T288-A291 PolarHBondContact O-N 3.08Å; T288-L292 HydrophobicContact CG2-CD1 3.97Å; T288-L292 HydrophobicContact CG2-CG 4.17Å; T288-L292 WeakPolarHBondContact O-CB 3.37Å; T288-L292 VanDerWaalsContact O-CG 3.27Å; T288-L292 WeakPolarHBondContact O-CG 3.31Å; T288-L292 PolarHBondContact O-N 2.74Å
289	V	98.2	Very high	97.7	Very high	0 Å²	0	20 Å²	20	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-62.1	-43.9	175	179.1	0	0	0	0	110.9	L100 R102 V284 H285 S286 S293 Y316 V322	L100-V289 HydrophobicContact CB-CG1 4.01Å; L100-V289 HydrophobicContact CB-CG2 4.41Å; L100-V289 HydrophobicContact CD1-CG1 4.31Å; R102-V289 HydrophobicContact CB-CG2 4.43Å; V284-V289 HydrophobicContact CG2-CG2 3.72Å; H285-V289 WeakPolarHBondContact O-CG2 3.2Å; H285-V289 PolarHBondContact O-N 2.86Å; S286-V289 PolarHBondContact O-N 2.98Å; V289-S293 WeakPolarHBondContact O-CB 3.31Å; V289-S293 PolarHBondContact O-N 2.85Å; V289-S293 PolarHBondContact O-OG 3.17Å; V289-Y316 HydrophobicContact CB-CD1 4.09Å; V289-Y316 HydrophobicContact CB-CE1 4.36Å; V289-Y316 HydrophobicContact CB-CG 4.32Å; V289-Y316 HydrophobicContact CG1-CD1 3.47Å; V289-Y316 VanDerWaalsContact CG1-CD1 3.47Å; V289-Y316 HydrophobicContact CG1-CE1 3.53Å; V289-Y316 HydrophobicContact CG1-CG 4.2Å; V289-V322 HydrophobicContact CG1-CB 4.49Å; V289-V322 HydrophobicContact CG1-CG2 3.71Å
290	D	97.5	Very high	97.4	Very high	22 Å²	22	23.7 Å²	23.7	12%	0.118	14%	0.136	C	C	.	.	H	α-helix	trans	-62.5	-49.6	173.3	-179	46.4	0	0	0	111.5	Y260 S286 L292 S293 R294 M312 Y316	Y260-D290 HydrophobicContact CE1-CB 4.47Å; Y260-D290 WeakPolarHBondContact CE1-OD2 3.46Å; Y260-D290 VanDerWaalsContact CZ-OD2 3.27Å; Y260-D290 PolarHBondContact OH-OD2 3.35Å; S286-D290 PolarHBondContact O-N 3.29Å; D290-L292 VanDerWaalsContact C-N 3.32Å; D290-L292 PolarHBondContact O-N 2.86Å; D290-S293 WeakPolarHBondContact O-CB 3.49Å; D290-S293 PolarHBondContact O-N 2.82Å; D290-S293 VanDerWaalsContact O-N 3.11Å; D290-R294 WeakPolarHBondContact O-CG 3.48Å; D290-R294 PolarHBondContact O-N 3.37Å; D290-M312 HydrophobicContact CB-CE 4.18Å; D290-M312 HydrophobicContact CB-SD 4.02Å; D290-Y316 HydrophobicContact CB-CE2 3.78Å
291	A	97.9	Very high	97	Very high	2 Å²	2	25.1 Å²	25.1	2%	0.017	15%	0.148	C	C	.	.	H	α-helix	trans	-55.2	-45.2	-179.2	0	0	0	0	0	113.2	F259 Y260 C263 L287 T288 F295	F259-A291 HydrophobicContact CE1-CB 4.16Å; Y260-A291 VanDerWaalsContact CD1-CA 3.46Å; Y260-A291 HydrophobicContact CD1-CB 3.5Å; Y260-A291 VanDerWaalsContact CE1-CA 3.41Å; Y260-A291 HydrophobicContact CE1-CB 3.68Å; Y260-A291 HydrophobicContact CG-CB 3.94Å; C263-A291 HydrophobicContact CB-CB 4.09Å; L287-A291 WeakPolarHBondContact O-CB 3.4Å; L287-A291 PolarHBondContact O-N 2.85Å; T288-A291 PolarHBondContact O-N 3.08Å; A291-F295 PolarHBondContact O-N 3.15Å
292	L	98.5	Very high	96.5	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-72.7	-38.4	176.8	-61.9	-177.1	0	0	0	112.1	L100 F209 C263 M267 T288 D290 R294 F295 L296	L100-L292 HydrophobicContact CD1-CB 3.78Å; L100-L292 HydrophobicContact CD2-CB 3.9Å; L100-L292 HydrophobicContact CD2-CD1 4Å; F209-L292 HydrophobicContact CD1-CD1 4.13Å; F209-L292 HydrophobicContact CD1-CD2 4.34Å; F209-L292 HydrophobicContact CE1-CD1 4.14Å; F209-L292 HydrophobicContact CE1-CD2 3.93Å; C263-L292 HydrophobicContact CB-CD2 3.92Å; C263-L292 WeakPolarHBondContact O-CD2 3.32Å; M267-L292 HydrophobicContact CB-CD2 3.63Å; M267-L292 HydrophobicContact CE-CB 4.35Å; M267-L292 HydrophobicContact CE-CD1 3.91Å; M267-L292 HydrophobicContact CE-CD2 4.26Å; M267-L292 HydrophobicContact CE-CG 4.39Å; M267-L292 HydrophobicContact CG-CD2 4.36Å; M267-L292 HydrophobicContact SD-CB 4.07Å; M267-L292 HydrophobicContact SD-CD2 3.89Å; M267-L292 HydrophobicContact SD-CG 4.36Å; T288-L292 HydrophobicContact CG2-CD1 3.97Å; T288-L292 HydrophobicContact CG2-CG 4.17Å; T288-L292 WeakPolarHBondContact O-CB 3.37Å; T288-L292 VanDerWaalsContact O-CG 3.27Å; T288-L292 WeakPolarHBondContact O-CG 3.31Å; T288-L292 PolarHBondContact O-N 2.74Å; D290-L292 VanDerWaalsContact C-N 3.32Å; D290-L292 PolarHBondContact O-N 2.86Å; L292-R294 VanDerWaalsContact C-N 3.3Å; L292-R294 PolarHBondContact O-N 2.78Å; L292-F295 PolarHBondContact O-N 3.46Å; L292-L296 WeakPolarHBondContact O-CG 3.35Å; L292-L296 PolarHBondContact O-N 3.24Å
293	S	97.5	Very high	96.1	Very high	2 Å²	2	33 Å²	33	1%	0.014	19%	0.187	C	C	.	.	H	α-helix	trans	-60.5	-39.4	174.5	-64.2	0	0	0	0	111.9	L100 V289 D290 Q297	L100-S293 WeakPolarHBondContact CD1-OG 3.35Å; V289-S293 WeakPolarHBondContact O-CB 3.31Å; V289-S293 PolarHBondContact O-N 2.85Å; V289-S293 PolarHBondContact O-OG 3.17Å; D290-S293 WeakPolarHBondContact O-CB 3.49Å; D290-S293 PolarHBondContact O-N 2.82Å; D290-S293 VanDerWaalsContact O-N 3.11Å; S293-Q297 WeakPolarHBondContact O-CB 3.41Å; S293-Q297 VanDerWaalsContact O-CG 3.26Å; S293-Q297 WeakPolarHBondContact O-CG 3.33Å; S293-Q297 PolarHBondContact O-N 3.48Å; S293-Q297 PolarHBondContact O-NE2 3.14Å
294	R	97.1	Very high	95.6	Very high	52 Å²	52	33 Å²	33	20%	0.196	19%	0.187	C	C	.	.	H	α-helix	trans	-66.6	-48.1	176.7	-71.8	-176.2	68.2	84.5	3.6	111.6	D290 L292 L296 Q297 G298 K299 P300	D290-R294 WeakPolarHBondContact O-CG 3.48Å; D290-R294 PolarHBondContact O-N 3.37Å; L292-R294 VanDerWaalsContact C-N 3.3Å; L292-R294 PolarHBondContact O-N 2.78Å; R294-L296 PolarHBondContact O-N 3.38Å; R294-Q297 CarbonylContact O-C 3.59Å; R294-Q297 PolarHBondContact O-N 2.85Å; R294-Q297 VanDerWaalsContact O-N 3.16Å; R294-G298 PolarHBondContact O-N 3.18Å; R294-K299 HydrophobicContact CB-CB 4.17Å; R294-K299 WeakPolarHBondContact O-CB 3.48Å; R294-K299 PolarHBondContact O-N 3.11Å; R294-P300 PolarHBondContact NE-O 3.17Å; R294-P300 VanDerWaalsContact NE-O 3.1Å; R294-P300 PolarHBondContact NH2-O 3.22Å
295	F	97.6	Very high	95.2	Very high	57 Å²	57	35.5 Å²	35.5	25%	0.25	20%	0.204	C	C	.	.	H	α-helix	trans	-55.7	-48.6	177.1	168.7	-100.1	0	0	0	111.9	A264 M267 K268 L271 A291 L292 Q297 G298	A264-F295 HydrophobicContact CB-CB 4Å; A264-F295 HydrophobicContact CB-CD2 3.7Å; A264-F295 HydrophobicContact CB-CG 4Å; M267-F295 HydrophobicContact CB-CD1 4.24Å; M267-F295 HydrophobicContact CB-CE1 4.29Å; M267-F295 HydrophobicContact CG-CD1 3.84Å; M267-F295 HydrophobicContact CG-CE1 3.75Å; M267-F295 HydrophobicContact SD-CD1 3.93Å; M267-F295 HydrophobicContact SD-CE1 4.32Å; K268-F295 HydrophobicContact CB-CE2 4.04Å; K268-F295 HydrophobicContact CB-CZ 3.65Å; K268-F295 HydrophobicContact CG-CZ 4.16Å; L271-F295 HydrophobicContact CD1-CE1 4.1Å; A291-F295 PolarHBondContact O-N 3.15Å; L292-F295 PolarHBondContact O-N 3.46Å; F295-Q297 VanDerWaalsContact C-N 3.29Å; F295-Q297 PolarHBondContact O-N 2.94Å; F295-G298 PolarHBondContact O-N 3.36Å
296	L	97.9	Very high	94.8	Very high	6 Å²	6	41.1 Å²	41.1	3%	0.031	23%	0.225	C	C	.	.	H	α-helix	trans	-61.6	-36.6	178.3	-67.7	167.4	0	0	0	112.1	V98 L100 M267 L271 L292 R294 G298 F324 W332	V98-L296 HydrophobicContact CB-CD1 4.41Å; V98-L296 HydrophobicContact CG1-CD1 3.85Å; L100-L296 HydrophobicContact CD1-CD1 4.16Å; L100-L296 HydrophobicContact CD2-CD1 4.4Å; L100-L296 HydrophobicContact CG-CD1 4.49Å; M267-L296 HydrophobicContact SD-CD1 4Å; M267-L296 HydrophobicContact SD-CD2 3.89Å; M267-L296 HydrophobicContact SD-CG 3.88Å; L271-L296 HydrophobicContact CD1-CD2 3.89Å; L292-L296 WeakPolarHBondContact O-CG 3.35Å; L292-L296 PolarHBondContact O-N 3.24Å; R294-L296 PolarHBondContact O-N 3.38Å; L296-G298 PolarHBondContact O-N 3.41Å; L296-F324 HydrophobicContact CB-CD1 3.94Å; L296-F324 HydrophobicContact CB-CD2 4.46Å; L296-F324 HydrophobicContact CB-CE1 4Å; L296-F324 HydrophobicContact CB-CE2 4.48Å; L296-F324 HydrophobicContact CB-CG 4.19Å; L296-F324 HydrophobicContact CB-CZ 4.27Å; L296-F324 HydrophobicContact CD1-CB 4.14Å; L296-F324 HydrophobicContact CD1-CD1 4.33Å; L296-F324 HydrophobicContact CD1-CD2 3.45Å; L296-F324 VanDerWaalsContact CD1-CD2 3.45Å; L296-F324 HydrophobicContact CD1-CE2 3.85Å; L296-F324 HydrophobicContact CD1-CG 3.73Å; L296-F324 HydrophobicContact CD1-CZ 4.45Å; L296-W332 HydrophobicContact CB-CB 4.19Å; L296-W332 HydrophobicContact CB-CG 4.46Å; L296-W332 HydrophobicContact CD2-CB 4.32Å; L296-W332 HydrophobicContact CD2-CD2 3.76Å; L296-W332 HydrophobicContact CD2-CE3 4.33Å; L296-W332 HydrophobicContact CD2-CG 3.72Å
297	Q	96.8	Very high	94.5	Very high	76 Å²	76	46.4 Å²	46.4	36%	0.355	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75	6.7	174	-70.4	170.2	76.5	0	0	114.2	S293 R294 F295 K299 F324	S293-Q297 WeakPolarHBondContact O-CB 3.41Å; S293-Q297 VanDerWaalsContact O-CG 3.26Å; S293-Q297 WeakPolarHBondContact O-CG 3.33Å; S293-Q297 PolarHBondContact O-N 3.48Å; S293-Q297 PolarHBondContact O-NE2 3.14Å; R294-Q297 CarbonylContact O-C 3.59Å; R294-Q297 PolarHBondContact O-N 2.85Å; R294-Q297 VanDerWaalsContact O-N 3.16Å; F295-Q297 VanDerWaalsContact C-N 3.29Å; F295-Q297 PolarHBondContact O-N 2.94Å; Q297-K299 HydrophobicContact CB-CD 3.9Å; Q297-K299 HydrophobicContact CB-CG 4.04Å; Q297-K299 PolarHBondContact O-N 3.22Å; Q297-F324 HydrophobicContact CG-CE1 3.84Å; Q297-F324 HydrophobicContact CG-CZ 4.25Å
298	G	95.6	Very high	94.2	Very high	69 Å²	69	49.8 Å²	49.8	71%	0.711	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.9	15.2	-175.9	0	0	0	0	0	114.1	R294 F295 L296	R294-G298 PolarHBondContact O-N 3.18Å; F295-G298 PolarHBondContact O-N 3.36Å; L296-G298 PolarHBondContact O-N 3.41Å
299	K	95.2	Very high	94	Very high	98 Å²	98	49.9 Å²	49.9	43%	0.426	26%	0.264	S	S	.	.	P	Polyproline II helix	trans	-86.6	137.3	-178.9	-65.9	170.4	178.5	172.3	0	109.3	R294 Q297	R294-K299 HydrophobicContact CB-CB 4.17Å; R294-K299 WeakPolarHBondContact O-CB 3.48Å; R294-K299 PolarHBondContact O-N 3.11Å; Q297-K299 HydrophobicContact CB-CD 3.9Å; Q297-K299 HydrophobicContact CB-CG 4.04Å; Q297-K299 PolarHBondContact O-N 3.22Å
300	P	91.3	Very high	93.6	Very high	101 Å²	101	54 Å²	54	66%	0.656	29%	0.286	S	S	*	.	P	Polyproline II helix	trans	-64	159.1	178.8	27.4	-35.2	0	0	0	111.8	R294 K302	R294-P300 PolarHBondContact NE-O 3.17Å; R294-P300 VanDerWaalsContact NE-O 3.1Å; R294-P300 PolarHBondContact NH2-O 3.22Å; P300-K302 PolarHBondContact O-N 2.82Å
301	A	90.7	Very high	93.3	Very high	29 Å²	29	56.8 Å²	56.8	24%	0.24	30%	0.299	C	S	.	.	P	Polyproline II helix	trans	-47.6	129.7	165.4	0	0	0	0	0	109.6	V257	V257-A301 HydrophobicContact CG1-CB 4.09Å
302	K	86.5	Confident	93.1	Very high	58 Å²	58	57.3 Å²	57.3	25%	0.252	30%	0.301	S	S	.	.	P	Polyproline II helix	trans	-96.4	138.8	-178.5	178	177.4	166.6	-170.3	0	108.8	P300 V304 E308	P300-K302 PolarHBondContact O-N 2.82Å; K302-V304 HydrophobicContact CB-CG2 3.9Å; K302-V304 HydrophobicContact CD-CG2 3.8Å; K302-V304 HydrophobicContact CG-CG2 3.66Å; K302-V304 PolarHBondContact O-N 3.2Å; K302-E308 IonicContact NZ-OE1 3.53Å; K302-E308 PolarHBondContact NZ-OE1 2.82Å; K302-E308 IonicContact NZ-OE2 3.07Å; K302-E308 PolarHBondContact NZ-OE2 2.59Å
303	D	90.3	Very high	92.8	Very high	108 Å²	108	58.3 Å²	58.3	58%	0.578	31%	0.311	S	S	*	.			trans	-78.6	111.1	158	-161.1	19.7	0	0	0	107.8	V257	V257-D303 HydrophobicContact CG2-CB 3.47Å; V257-D303 VanDerWaalsContact CG2-CB 3.47Å
304	V	88.5	Confident	92.5	Very high	1 Å²	1	65.1 Å²	65.1	1%	0.006	34%	0.336	C	S	.	.			trans	-104.2	116.6	-172	-174.9	0	0	0	0	108.1	Y260 K302 R306 E308 M309	Y260-V304 HydrophobicContact CD2-CG2 4.39Å; Y260-V304 HydrophobicContact CE1-CG2 4.42Å; Y260-V304 HydrophobicContact CE2-CB 4.46Å; Y260-V304 HydrophobicContact CE2-CG2 3.59Å; K302-V304 HydrophobicContact CB-CG2 3.9Å; K302-V304 HydrophobicContact CD-CG2 3.8Å; K302-V304 HydrophobicContact CG-CG2 3.66Å; K302-V304 PolarHBondContact O-N 3.2Å; V304-R306 PolarHBondContact O-N 3.21Å; V304-E308 HydrophobicContact CG1-CB 3.63Å; V304-M309 HydrophobicContact CB-CG 3.81Å; V304-M309 HydrophobicContact CG1-CG 3.49Å; V304-M309 VanDerWaalsContact CG1-CG 3.49Å; V304-M309 VanDerWaalsContact O-SD 3.42Å
305	P	91.4	Very high	92.2	Very high	53 Å²	53	69.3 Å²	69.3	34%	0.344	36%	0.358	S	S	.	.			trans	-53.3	136.7	173.7	-26.9	34.9	0	0	0	111.2	H307 E308 M309	P305-H307 VanDerWaalsContact CB-CE1 3.48Å; P305-H307 WeakPolarHBondContact CB-CE1 3.19Å; P305-H307 PolarHBondContact O-N 3.14Å; P305-E308 WeakPolarHBondContact CD-OE1 3.46Å; P305-E308 WeakPolarHBondContact O-CA 3.31Å; P305-E308 WeakPolarHBondContact O-CB 3.39Å; P305-E308 PolarHBondContact O-N 3.46Å; P305-M309 PolarHBondContact O-N 3.15Å
306	R	88.7	Confident	92.1	Very high	119 Å²	119	68.6 Å²	68.6	45%	0.449	35%	0.354	S	S	.	.	H	α-helix	trans	-50.1	-37.3	-174.6	178.9	61.9	-168.8	-104.3	-11.1	113.8	W215 V304 E308 M309 D310	W215-R306 VanDerWaalsContact CD1-CZ 3.5Å; V304-R306 PolarHBondContact O-N 3.21Å; R306-E308 PolarHBondContact O-N 3.47Å; R306-M309 WeakPolarHBondContact O-CB 3.48Å; R306-M309 PolarHBondContact O-N 3.44Å; R306-D310 IonicContact CZ-OD1 2.59Å; R306-D310 IonicContact CZ-OD2 2.75Å; R306-D310 IonicContact NE-OD1 3.49Å; R306-D310 PolarHBondContact NE-OD1 3.31Å; R306-D310 IonicContact NE-OD2 3.62Å; R306-D310 PolarHBondContact NE-OD2 3.2Å; R306-D310 IonicContact NH2-OD1 2.92Å; R306-D310 PolarHBondContact NH2-OD1 2.78Å; R306-D310 IonicContact NH2-OD2 2.7Å; R306-D310 VanDerWaalsContact O-CG 3.3Å; R306-D310 PolarHBondContact O-N 3.36Å
307	H	91.7	Very high	91.9	Very high	122 Å²	122	71 Å²	71	57%	0.565	37%	0.37	S	S	*	.	H	α-helix	trans	-70	-25.1	178.4	69.6	-101.3	0	0	0	114.4	P305 Q311	P305-H307 VanDerWaalsContact CB-CE1 3.48Å; P305-H307 WeakPolarHBondContact CB-CE1 3.19Å; P305-H307 PolarHBondContact O-N 3.14Å; H307-Q311 WeakPolarHBondContact O-CG 3.29Å; H307-Q311 PolarHBondContact O-NE2 3.12Å; H307-Q311 VanDerWaalsContact O-NE2 3.16Å
308	E	92.3	Very high	91.9	Very high	71 Å²	71	70.2 Å²	70.2	33%	0.332	36%	0.364	S	S	.	.	H	α-helix	trans	-74.5	-43.2	168.1	-70.9	-171.9	-137.8	0	0	110.1	K302 V304 P305 R306 D310 Q311 M312	K302-E308 IonicContact NZ-OE1 3.53Å; K302-E308 PolarHBondContact NZ-OE1 2.82Å; K302-E308 IonicContact NZ-OE2 3.07Å; K302-E308 PolarHBondContact NZ-OE2 2.59Å; V304-E308 HydrophobicContact CG1-CB 3.63Å; P305-E308 WeakPolarHBondContact CD-OE1 3.46Å; P305-E308 WeakPolarHBondContact O-CA 3.31Å; P305-E308 WeakPolarHBondContact O-CB 3.39Å; P305-E308 PolarHBondContact O-N 3.46Å; R306-E308 PolarHBondContact O-N 3.47Å; E308-D310 PolarHBondContact O-N 3.14Å; E308-Q311 CarbonylContact O-C 3.56Å; E308-Q311 PolarHBondContact O-N 3.5Å; E308-Q311 VanDerWaalsContact O-N 3.16Å; E308-M312 PolarHBondContact O-N 3.22Å
309	M	92.7	Very high	92	Very high	2 Å²	2	67.3 Å²	67.3	1%	0.01	33%	0.333	C	S	.	.	H	α-helix	trans	-58	-50	178.7	-53.1	175.4	78.9	0	0	110.9	W212 W215 P256 L287 V304 P305 R306 Q311 M312	W212-M309 HydrophobicContact CB-CE 4.34Å; W212-M309 HydrophobicContact CD2-CE 3.62Å; W212-M309 HydrophobicContact CE3-CE 3.39Å; W212-M309 HydrophobicContact CE3-SD 4.16Å; W212-M309 HydrophobicContact CG-CE 4.07Å; W212-M309 HydrophobicContact CH2-CE 4.49Å; W212-M309 HydrophobicContact CH2-SD 4.49Å; W212-M309 HydrophobicContact CZ3-CE 3.86Å; W212-M309 HydrophobicContact CZ3-SD 4.01Å; W215-M309 HydrophobicContact CZ2-CB 3.96Å; W215-M309 WeakPolarHBondContact CZ2-O 3.47Å; P256-M309 HydrophobicContact CB-CE 3.99Å; P256-M309 HydrophobicContact CB-SD 4.08Å; P256-M309 HydrophobicContact CG-CE 4.05Å; P256-M309 HydrophobicContact CG-SD 3.79Å; L287-M309 HydrophobicContact CD1-CB 4.09Å; L287-M309 HydrophobicContact CD1-CE 4.32Å; L287-M309 HydrophobicContact CD1-CG 4.19Å; L287-M309 HydrophobicContact CD2-CE 3.58Å; V304-M309 HydrophobicContact CB-CG 3.81Å; V304-M309 HydrophobicContact CG1-CG 3.49Å; V304-M309 VanDerWaalsContact CG1-CG 3.49Å; V304-M309 VanDerWaalsContact O-SD 3.42Å; P305-M309 PolarHBondContact O-N 3.15Å; R306-M309 WeakPolarHBondContact O-CB 3.48Å; R306-M309 PolarHBondContact O-N 3.44Å; M309-Q311 PolarHBondContact O-N 3.07Å; M309-M312 WeakPolarHBondContact O-CB 3.49Å; M309-M312 PolarHBondContact O-N 2.64Å
310	D	89.2	Confident	92	Very high	85 Å²	85	64.4 Å²	64.4	46%	0.455	32%	0.323	S	S	.	.	H	α-helix	trans	-65.4	-22.9	-178.9	-66.4	-21.6	0	0	0	112.1	W215 R306 E308	W215-D310 PolarHBondContact NE1-OD1 3Å; R306-D310 IonicContact CZ-OD1 2.59Å; R306-D310 IonicContact CZ-OD2 2.75Å; R306-D310 IonicContact NE-OD1 3.49Å; R306-D310 PolarHBondContact NE-OD1 3.31Å; R306-D310 IonicContact NE-OD2 3.62Å; R306-D310 PolarHBondContact NE-OD2 3.2Å; R306-D310 IonicContact NH2-OD1 2.92Å; R306-D310 PolarHBondContact NH2-OD1 2.78Å; R306-D310 IonicContact NH2-OD2 2.7Å; R306-D310 VanDerWaalsContact O-CG 3.3Å; R306-D310 PolarHBondContact O-N 3.36Å; E308-D310 PolarHBondContact O-N 3.14Å
311	Q	92.1	Very high	92.2	Very high	82 Å²	82	61 Å²	61	38%	0.383	30%	0.301	S	S	.	.	H	α-helix	trans	-93.7	-3.3	173.6	-71.1	-174.4	72.7	0	0	114.3	H307 E308 M309 G313 R314	H307-Q311 WeakPolarHBondContact O-CG 3.29Å; H307-Q311 PolarHBondContact O-NE2 3.12Å; H307-Q311 VanDerWaalsContact O-NE2 3.16Å; E308-Q311 CarbonylContact O-C 3.56Å; E308-Q311 PolarHBondContact O-N 3.5Å; E308-Q311 VanDerWaalsContact O-N 3.16Å; M309-Q311 PolarHBondContact O-N 3.07Å; Q311-G313 PolarHBondContact O-N 3.24Å; Q311-R314 VanDerWaalsContact O-CB 3.31Å; Q311-R314 WeakPolarHBondContact O-CB 3.35Å; Q311-R314 PolarHBondContact O-N 3.03Å
312	M	94.2	Very high	92.5	Very high	12 Å²	12	60.6 Å²	60.6	6%	0.059	30%	0.296	C	S	.	.	H	α-helix	trans	-59.8	-25	-175.6	-166.4	61	72	0	0	113	L287 D290 E308 M309 R314 Q315 Y316	L287-M312 HydrophobicContact CB-CG 4.46Å; L287-M312 HydrophobicContact CD1-CB 4.3Å; L287-M312 HydrophobicContact CD1-CE 4.1Å; L287-M312 HydrophobicContact CD1-CG 4.13Å; D290-M312 HydrophobicContact CB-CE 4.18Å; D290-M312 HydrophobicContact CB-SD 4.02Å; E308-M312 PolarHBondContact O-N 3.22Å; M309-M312 WeakPolarHBondContact O-CB 3.49Å; M309-M312 PolarHBondContact O-N 2.64Å; M312-R314 PolarHBondContact O-N 3.46Å; M312-Q315 PolarHBondContact O-N 2.83Å; M312-Q315 HydrophobicContact SD-CB 4.21Å; M312-Q315 HydrophobicContact SD-CG 4.44Å; M312-Y316 HydrophobicContact CG-CD2 4.11Å; M312-Y316 PolarHBondContact O-N 2.95Å; M312-Y316 VanDerWaalsContact O-N 3.08Å; M312-Y316 HydrophobicContact SD-CD2 3.76Å; M312-Y316 HydrophobicContact SD-CE2 3.66Å
313	G	91.5	Very high	93	Very high	21 Å²	21	58 Å²	58	22%	0.216	29%	0.285	C	S	.	.	H	α-helix	trans	-65.4	-12.4	172.1	0	0	0	0	0	115.5	R102 Q311	R102-G313 PolarHBondContact NH1-O 2.96Å; Q311-G313 PolarHBondContact O-N 3.24Å
314	R	91.2	Very high	93.3	Very high	146 Å²	146	52.9 Å²	52.9	55%	0.551	26%	0.257	S	S	*	.	H	α-helix	trans	-85.2	-37.1	170.5	-61.4	177.8	166.3	168.5	-8	112.4	Y55 Q311 M312	Y55-R314 HydrophobicContact CE2-CB 4.5Å; Y55-R314 WeakPolarHBondContact OH-CA 3.12Å; Q311-R314 VanDerWaalsContact O-CB 3.31Å; Q311-R314 WeakPolarHBondContact O-CB 3.35Å; Q311-R314 PolarHBondContact O-N 3.03Å; M312-R314 PolarHBondContact O-N 3.46Å
315	Q	92.1	Very high	93.7	Very high	140 Å²	140	53.2 Å²	53.2	65%	0.654	26%	0.259	S	S	*	.	H	α-helix	trans	-74.9	-30.9	179.5	-55	-57.5	-24.7	0	0	111.9	M312	M312-Q315 PolarHBondContact O-N 2.83Å; M312-Q315 HydrophobicContact SD-CB 4.21Å; M312-Q315 HydrophobicContact SD-CG 4.44Å
316	Y	94.9	Very high	93.9	Very high	41 Å²	41	50.8 Å²	50.8	16%	0.161	24%	0.243	C	C	.	.	S	Bend	trans	-126	84	173.3	-58.5	-86.1	0	0	0	109.5	R102 V289 D290 M312 T320 V322	R102-Y316 WeakPolarHBondContact CD-O 3.45Å; R102-Y316 PolarHBondContact NH1-O 3.16Å; V289-Y316 HydrophobicContact CB-CD1 4.09Å; V289-Y316 HydrophobicContact CB-CE1 4.36Å; V289-Y316 HydrophobicContact CB-CG 4.32Å; V289-Y316 HydrophobicContact CG1-CD1 3.47Å; V289-Y316 VanDerWaalsContact CG1-CD1 3.47Å; V289-Y316 HydrophobicContact CG1-CE1 3.53Å; V289-Y316 HydrophobicContact CG1-CG 4.2Å; D290-Y316 HydrophobicContact CB-CE2 3.78Å; M312-Y316 HydrophobicContact CG-CD2 4.11Å; M312-Y316 PolarHBondContact O-N 2.95Å; M312-Y316 VanDerWaalsContact O-N 3.08Å; M312-Y316 HydrophobicContact SD-CD2 3.76Å; M312-Y316 HydrophobicContact SD-CE2 3.66Å; Y316-T320 HydrophobicContact CD1-CG2 4.1Å; Y316-V322 HydrophobicContact CD1-CG2 4.22Å; Y316-V322 HydrophobicContact CE1-CG2 3.99Å
317	P	94.4	Very high	94.2	Very high	57 Å²	57	46.7 Å²	46.7	37%	0.37	23%	0.23	S	C	.	.			trans	-53.6	164.9	174.4	-29.2	37	0	0	0	114.7	R102 T320	R102-P317 WeakPolarHBondContact CD-O 3.26Å; P317-T320 VanDerWaalsContact CD-OG1 3.31Å; P317-T320 WeakPolarHBondContact CD-OG1 3.37Å; P317-T320 WeakPolarHBondContact O-CB 3.46Å; P317-T320 PolarHBondContact O-N 3.1Å; P317-T320 VanDerWaalsContact O-N 3.08Å; P317-T320 PolarHBondContact O-OG1 2.74Å
318	Y	96.1	Very high	94.3	Very high	59 Å²	59	44.9 Å²	44.9	23%	0.231	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.3	141.8	176.9	-68.8	-62.4	0	0	0	111.4	R102 N103 A104 E105 R106 R109 T320	R102-Y318 VanDerWaalsContact NH2-CE1 3.28Å; N103-Y318 WeakPolarHBondContact O-CD1 3.49Å; A104-Y318 VanDerWaalsContact C-CD1 3.4Å; A104-Y318 WeakPolarHBondContact O-CD1 3.47Å; A104-Y318 WeakPolarHBondContact O-CE1 3.23Å; E105-Y318 HydrophobicContact CB-CD2 4.39Å; R106-Y318 HydrophobicContact CG-CE1 4.04Å; R109-Y318 WeakPolarHBondContact CG-OH 3.48Å; Y318-T320 PolarHBondContact O-N 3.27Å
319	C	96.6	Very high	94.3	Very high	9 Å²	9	46.5 Å²	46.5	6%	0.061	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	56.9	13.4	-175.3	-70.2	0	0	0	0	116.4	M101 R102 N103 A104 I163 V321	M101-C319 HydrophobicContact CE-CB 4.09Å; R102-C319 WeakPolarHBondContact O-CA 3.3Å; R102-C319 PolarHBondContact O-N 3.18Å; N103-C319 PolarHBondContact O-N 3.35Å; N103-C319 VanDerWaalsContact O-N 3.15Å; A104-C319 VanDerWaalsContact CA-SG 3.53Å; A104-C319 WeakPolarHBondContact CB-SG 3.26Å; I163-C319 HydrophobicContact CG1-CB 4.07Å; C319-V321 PolarHBondContact O-N 3.42Å
320	T	95.4	Very high	94.3	Very high	36 Å²	36	52.3 Å²	52.3	22%	0.221	26%	0.263	C	S	.	.			trans	-57.4	133	170.5	-69.6	0	0	0	0	110.5	M101 R102 Y316 P317 Y318 V322	M101-T320 VanDerWaalsContact CA-O 3.31Å; M101-T320 WeakPolarHBondContact CA-O 3.42Å; R102-T320 PolarHBondContact N-O 3.16Å; Y316-T320 HydrophobicContact CD1-CG2 4.1Å; P317-T320 VanDerWaalsContact CD-OG1 3.31Å; P317-T320 WeakPolarHBondContact CD-OG1 3.37Å; P317-T320 WeakPolarHBondContact O-CB 3.46Å; P317-T320 PolarHBondContact O-N 3.1Å; P317-T320 VanDerWaalsContact O-N 3.08Å; P317-T320 PolarHBondContact O-OG1 2.74Å; Y318-T320 PolarHBondContact O-N 3.27Å; T320-V322 HydrophobicContact CG2-CG2 4.22Å
321	V	96.6	Very high	94.6	Very high	29 Å²	29	51.5 Å²	51.5	18%	0.176	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	126.9	174.1	-176.6	0	0	0	0	110.3	F99 L100 M101 I163 C319 L339	F99-V321 HydrophobicContact CB-CG1 4.23Å; F99-V321 HydrophobicContact CD1-CG1 3.79Å; L100-V321 CarbonylContact O-C 3.6Å; L100-V321 VanDerWaalsContact O-CA 3.29Å; L100-V321 WeakPolarHBondContact O-CA 3.37Å; M101-V321 HydrophobicContact CB-CG2 4.22Å; M101-V321 HydrophobicContact CG-CG2 4.03Å; M101-V321 HydrophobicContact SD-CG2 4.49Å; I163-V321 HydrophobicContact CD1-CG2 4.38Å; I163-V321 HydrophobicContact CG2-CG2 3.7Å; C319-V321 PolarHBondContact O-N 3.42Å; V321-L339 HydrophobicContact CB-CD1 4.2Å; V321-L339 HydrophobicContact CG1-CD1 3.99Å; V321-L339 HydrophobicContact CG2-CD1 4.17Å
322	V	96.5	Very high	94.8	Very high	22 Å²	22	49.2 Å²	49.2	13%	0.133	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	120.9	174.6	-169.5	0	0	0	0	108.8	F99 L100 V289 Y316 T320 F324 L334	F99-V322 WeakPolarHBondContact CA-O 3.08Å; L100-V322 HydrophobicContact CB-CB 4.31Å; L100-V322 PolarHBondContact N-O 3.19Å; L100-V322 PolarHBondContact O-N 3.29Å; V289-V322 HydrophobicContact CG1-CB 4.49Å; V289-V322 HydrophobicContact CG1-CG2 3.71Å; Y316-V322 HydrophobicContact CD1-CG2 4.22Å; Y316-V322 HydrophobicContact CE1-CG2 3.99Å; T320-V322 HydrophobicContact CG2-CG2 4.22Å; V322-F324 HydrophobicContact CB-CE2 4.44Å; V322-F324 HydrophobicContact CG1-CD2 4.2Å; V322-F324 HydrophobicContact CG1-CE2 3.55Å; V322-F324 HydrophobicContact CG1-CZ 4.19Å; V322-L334 HydrophobicContact CG1-CD1 3.55Å
323	G	96.8	Very high	94.8	Very high	2 Å²	2	51 Å²	51	2%	0.021	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	140.8	179.4	0	0	0	0	0	113	V98 V335	V98-G323 CarbonylContact O-C 3.58Å; G323-V335 PolarHBondContact O-N 3.32Å
324	F	97.5	Very high	95	Very high	1 Å²	1	53.9 Å²	53.9	0%	0.004	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	149.5	172.5	-72.7	-90.6	0	0	0	110.6	R97 V98 L100 L296 Q297 V322 W332 R333 L334	R97-F324 CarbonylContact C-O 3.53Å; R97-F324 VanDerWaalsContact CA-O 3.27Å; R97-F324 WeakPolarHBondContact CA-O 3.33Å; V98-F324 HydrophobicContact CB-CB 4.4Å; V98-F324 PolarHBondContact N-O 2.8Å; V98-F324 PolarHBondContact O-N 2.65Å; L100-F324 HydrophobicContact CD1-CD2 4.35Å; L100-F324 HydrophobicContact CD1-CE2 3.96Å; L296-F324 HydrophobicContact CB-CD1 3.94Å; L296-F324 HydrophobicContact CB-CD2 4.46Å; L296-F324 HydrophobicContact CB-CE1 4Å; L296-F324 HydrophobicContact CB-CE2 4.48Å; L296-F324 HydrophobicContact CB-CG 4.19Å; L296-F324 HydrophobicContact CB-CZ 4.27Å; L296-F324 HydrophobicContact CD1-CB 4.14Å; L296-F324 HydrophobicContact CD1-CD1 4.33Å; L296-F324 HydrophobicContact CD1-CD2 3.45Å; L296-F324 VanDerWaalsContact CD1-CD2 3.45Å; L296-F324 HydrophobicContact CD1-CE2 3.85Å; L296-F324 HydrophobicContact CD1-CG 3.73Å; L296-F324 HydrophobicContact CD1-CZ 4.45Å; Q297-F324 HydrophobicContact CG-CE1 3.84Å; Q297-F324 HydrophobicContact CG-CZ 4.25Å; V322-F324 HydrophobicContact CB-CE2 4.44Å; V322-F324 HydrophobicContact CG1-CD2 4.2Å; V322-F324 HydrophobicContact CG1-CE2 3.55Å; V322-F324 HydrophobicContact CG1-CZ 4.19Å; F324-W332 HydrophobicContact CB-CE3 4.1Å; F324-W332 HydrophobicContact CD1-CB 4.42Å; F324-R333 CarbonylContact C-O 3.45Å; F324-R333 VanDerWaalsContact CA-O 3.27Å; F324-R333 WeakPolarHBondContact CA-O 3.37Å; F324-L334 HydrophobicContact CD1-CB 4.24Å; F324-L334 HydrophobicContact CD1-CD1 4.42Å; F324-L334 HydrophobicContact CE1-CB 3.87Å; F324-L334 HydrophobicContact CE1-CD1 3.87Å; F324-L334 HydrophobicContact CE2-CD1 4.06Å; F324-L334 HydrophobicContact CZ-CD1 3.68Å
325	E	95.9	Very high	95	Very high	8 Å²	8	48.5 Å²	48.5	4%	0.037	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	143.5	173.6	67.8	-174.4	-177.1	0	0	111.8	L93 R97 W332 R333 V335	L93-E325 HydrophobicContact CD2-CG 4.01Å; R97-E325 HydrophobicContact CG-CB 3.78Å; R97-E325 IonicContact CZ-OE2 3.06Å; R97-E325 IonicContact NE-OE2 3.9Å; R97-E325 PolarHBondContact NE-OE2 3.2Å; R97-E325 IonicContact NH2-OE2 3.57Å; R97-E325 PolarHBondContact NH2-OE2 2.97Å; E325-W332 CarbonylContact O-C 3.57Å; E325-W332 WeakPolarHBondContact O-CA 3.32Å; E325-R333 HydrophobicContact CG-CB 4.26Å; E325-R333 PolarHBondContact N-O 2.86Å; E325-R333 PolarHBondContact O-N 3.28Å; E325-R333 IonicContact OE1-CZ 3.21Å; E325-R333 VanDerWaalsContact OE1-CZ 3.31Å; E325-R333 IonicContact OE1-NE 2.72Å; E325-R333 PolarHBondContact OE1-NE 3.4Å; E325-R333 IonicContact OE1-NH2 3.31Å; E325-R333 PolarHBondContact OE1-NH2 3.43Å; E325-V335 HydrophobicContact CB-CG2 3.95Å; E325-V335 HydrophobicContact CG-CG2 3.68Å
326	E	96.6	Very high	94.5	Very high	2 Å²	2	45.7 Å²	45.7	1%	0.009	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	133.1	-179.2	176.7	-179.5	-105.9	0	0	111.5	L93 S94 R96 K330 W332	L93-E326 WeakPolarHBondContact CA-O 3.46Å; S94-E326 WeakPolarHBondContact CB-OE2 3.33Å; S94-E326 PolarHBondContact N-O 3.12Å; S94-E326 WeakPolarHBondContact OG-CB 3.32Å; S94-E326 WeakPolarHBondContact OG-CG 3.37Å; S94-E326 PolarHBondContact OG-OE2 3.28Å; R96-E326 HydrophobicContact CB-CB 4.19Å; R96-E326 IonicContact CZ-OE1 3.75Å; R96-E326 IonicContact CZ-OE2 3.64Å; R96-E326 IonicContact NE-OE1 3.54Å; R96-E326 PolarHBondContact NE-OE1 2.71Å; R96-E326 IonicContact NE-OE2 3.76Å; R96-E326 PolarHBondContact NE-OE2 2.96Å; R96-E326 IonicContact NH2-OE1 2.9Å; R96-E326 PolarHBondContact NH2-OE1 2.89Å; R96-E326 IonicContact NH2-OE2 2.84Å; R96-E326 PolarHBondContact O-N 3.37Å; E326-K330 VanDerWaalsContact CD-CD 3.44Å; E326-K330 HydrophobicContact CG-CD 4.26Å; E326-K330 WeakPolarHBondContact OE1-CD 3.45Å; E326-K330 IonicContact OE1-NZ 3.22Å; E326-K330 PolarHBondContact OE1-NZ 3.46Å; E326-K330 IonicContact OE2-NZ 3.38Å; E326-K330 PolarHBondContact OE2-NZ 2.93Å; E326-W332 HydrophobicContact CB-CD2 3.92Å; E326-W332 HydrophobicContact CB-CE3 3.81Å; E326-W332 HydrophobicContact CB-CH2 3.77Å; E326-W332 HydrophobicContact CB-CZ2 3.86Å; E326-W332 HydrophobicContact CB-CZ3 3.74Å; E326-W332 HydrophobicContact CG-CZ2 4.33Å
327	L	94.9	Very high	93.5	Very high	33 Å²	33	48.1 Å²	48.1	17%	0.173	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	156.8	170.3	-49.6	-174.8	0	0	0	110.1	A91 N92 L93 N329 K330 T331 R333	A91-L327 HydrophobicContact CB-CD2 3.98Å; N92-L327 CarbonylContact O-C 3.57Å; N92-L327 VanDerWaalsContact O-CA 3.31Å; N92-L327 WeakPolarHBondContact O-CA 3.07Å; L93-L327 HydrophobicContact CD2-CD2 3.55Å; L327-N329 WeakPolarHBondContact CB-OD1 3.29Å; L327-N329 PolarHBondContact O-N 2.94Å; L327-K330 WeakPolarHBondContact O-CA 3.34Å; L327-K330 PolarHBondContact O-N 3.06Å; L327-T331 PolarHBondContact N-O 3.2Å; L327-R333 HydrophobicContact CD2-CB 4.3Å
328	T	93	Very high	93.1	Very high	84 Å²	84	45.8 Å²	45.8	52%	0.515	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-19.2	-176.8	53.2	0	0	0	0	114.4	N92 K330	N92-T328 HydrophobicContact CB-CG2 3.74Å; N92-T328 WeakPolarHBondContact CB-OG1 3.47Å; N92-T328 PolarHBondContact O-N 3.37Å; T328-K330 PolarHBondContact O-N 3.34Å
329	N	93	Very high	92.7	Very high	106 Å²	106	43.9 Å²	43.9	57%	0.567	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	-77	5.5	170.3	74.3	-9	0	0	0	114	L327 T331	L327-N329 WeakPolarHBondContact CB-OD1 3.29Å; L327-N329 PolarHBondContact O-N 2.94Å; N329-T331 VanDerWaalsContact C-N 3.27Å; N329-T331 PolarHBondContact ND2-OG1 3.43Å; N329-T331 PolarHBondContact O-N 2.77Å; N329-T331 WeakPolarHBondContact OD1-CB 3.36Å; N329-T331 PolarHBondContact OD1-N 3.26Å; N329-T331 PolarHBondContact OD1-OG1 3.26Å
330	K	93	Very high	92	Very high	123 Å²	123	45.7 Å²	45.7	54%	0.535	25%	0.25	S	S	.	.	S	Bend	trans	65.3	18.4	-178.4	-57.9	-64	-178.8	174.4	0	116	E326 L327 T328	E326-K330 VanDerWaalsContact CD-CD 3.44Å; E326-K330 HydrophobicContact CG-CD 4.26Å; E326-K330 WeakPolarHBondContact OE1-CD 3.45Å; E326-K330 IonicContact OE1-NZ 3.22Å; E326-K330 PolarHBondContact OE1-NZ 3.46Å; E326-K330 IonicContact OE2-NZ 3.38Å; E326-K330 PolarHBondContact OE2-NZ 2.93Å; L327-K330 WeakPolarHBondContact O-CA 3.34Å; L327-K330 PolarHBondContact O-N 3.06Å; T328-K330 PolarHBondContact O-N 3.34Å
331	T	95.2	Very high	91.6	Very high	69 Å²	69	47.6 Å²	47.6	42%	0.423	26%	0.263	S	S	.	.			trans	-90.9	155	163.8	66.4	0	0	0	0	111.1	L327 N329	L327-T331 PolarHBondContact N-O 3.2Å; N329-T331 VanDerWaalsContact C-N 3.27Å; N329-T331 PolarHBondContact ND2-OG1 3.43Å; N329-T331 PolarHBondContact O-N 2.77Å; N329-T331 WeakPolarHBondContact OD1-CB 3.36Å; N329-T331 PolarHBondContact OD1-N 3.26Å; N329-T331 PolarHBondContact OD1-OG1 3.26Å
332	W	96.4	Very high	91.2	Very high	33 Å²	33	48.8 Å²	48.8	13%	0.125	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	137.3	179.4	-61.7	78.4	0	0	0	111.7	R96 V98 L271 M280 L296 F324 E325 E326	R96-W332 HydrophobicContact CB-CH2 3.96Å; V98-W332 HydrophobicContact CB-CZ3 4.05Å; V98-W332 HydrophobicContact CG2-CE3 4.29Å; V98-W332 HydrophobicContact CG2-CH2 3.58Å; V98-W332 HydrophobicContact CG2-CZ2 4.37Å; V98-W332 HydrophobicContact CG2-CZ3 3.53Å; L271-W332 HydrophobicContact CD1-CZ2 3.83Å; L271-W332 HydrophobicContact CD2-CH2 4.09Å; L271-W332 HydrophobicContact CD2-CZ2 3.86Å; L271-W332 HydrophobicContact CG-CZ2 4.36Å; M280-W332 HydrophobicContact CE-CH2 4.21Å; L296-W332 HydrophobicContact CB-CB 4.19Å; L296-W332 HydrophobicContact CB-CG 4.46Å; L296-W332 HydrophobicContact CD2-CB 4.32Å; L296-W332 HydrophobicContact CD2-CD2 3.76Å; L296-W332 HydrophobicContact CD2-CE3 4.33Å; L296-W332 HydrophobicContact CD2-CG 3.72Å; F324-W332 HydrophobicContact CB-CE3 4.1Å; F324-W332 HydrophobicContact CD1-CB 4.42Å; E325-W332 CarbonylContact O-C 3.57Å; E325-W332 WeakPolarHBondContact O-CA 3.32Å; E326-W332 HydrophobicContact CB-CD2 3.92Å; E326-W332 HydrophobicContact CB-CE3 3.81Å; E326-W332 HydrophobicContact CB-CH2 3.77Å; E326-W332 HydrophobicContact CB-CZ2 3.86Å; E326-W332 HydrophobicContact CB-CZ3 3.74Å; E326-W332 HydrophobicContact CG-CZ2 4.33Å
333	R	94	Very high	90.6	Very high	49 Å²	49	51.7 Å²	51.7	19%	0.185	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	133.7	174.1	178.6	164.8	70.5	178.4	3.5	109.7	D89 F324 E325 L327 V335	D89-R333 PolarHBondContact O-NH2 3.31Å; D89-R333 IonicContact OD2-NH1 3.79Å; D89-R333 PolarHBondContact OD2-NH1 2.84Å; F324-R333 CarbonylContact C-O 3.45Å; F324-R333 VanDerWaalsContact CA-O 3.27Å; F324-R333 WeakPolarHBondContact CA-O 3.37Å; E325-R333 HydrophobicContact CG-CB 4.26Å; E325-R333 PolarHBondContact N-O 2.86Å; E325-R333 PolarHBondContact O-N 3.28Å; E325-R333 IonicContact OE1-CZ 3.21Å; E325-R333 VanDerWaalsContact OE1-CZ 3.31Å; E325-R333 IonicContact OE1-NE 2.72Å; E325-R333 PolarHBondContact OE1-NE 3.4Å; E325-R333 IonicContact OE1-NH2 3.31Å; E325-R333 PolarHBondContact OE1-NH2 3.43Å; L327-R333 HydrophobicContact CD2-CB 4.3Å; R333-V335 PolarHBondContact O-N 3Å
334	L	95.1	Very high	90	Very high	82 Å²	82	56.5 Å²	56.5	43%	0.429	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.6	130.1	168.6	178.7	71.2	0	0	0	109.1	V322 F324 P336	V322-L334 HydrophobicContact CG1-CD1 3.55Å; F324-L334 HydrophobicContact CD1-CB 4.24Å; F324-L334 HydrophobicContact CD1-CD1 4.42Å; F324-L334 HydrophobicContact CE1-CB 3.87Å; F324-L334 HydrophobicContact CE1-CD1 3.87Å; F324-L334 HydrophobicContact CE2-CD1 4.06Å; F324-L334 HydrophobicContact CZ-CD1 3.68Å; L334-P336 VanDerWaalsContact O-CD 3.24Å; L334-P336 WeakPolarHBondContact O-CD 3.34Å
335	V	91.5	Very high	88.9	Confident	33 Å²	33	59.2 Å²	59.2	20%	0.2	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	98.5	172.5	-177.9	0	0	0	0	107.6	G323 E325 R333 A338	G323-V335 PolarHBondContact O-N 3.32Å; E325-V335 HydrophobicContact CB-CG2 3.95Å; E325-V335 HydrophobicContact CG-CG2 3.68Å; R333-V335 PolarHBondContact O-N 3Å; V335-A338 HydrophobicContact CB-CB 4.17Å; V335-A338 HydrophobicContact CG1-CB 3.91Å
336	P	80.9	Confident	87.8	Confident	82 Å²	82	67.5 Å²	67.5	53%	0.532	36%	0.359	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.8	142.8	175.5	28.4	-34.8	0	0	0	109.6	L334 A338	L334-P336 VanDerWaalsContact O-CD 3.24Å; L334-P336 WeakPolarHBondContact O-CD 3.34Å; P336-A338 PolarHBondContact O-N 2.96Å
337	N	75.2	Confident	87	Confident	91 Å²	91	74.3 Å²	74.3	49%	0.487	39%	0.389	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.8	38.1	179	-55.1	-24.9	0	0	0	113.4	Y48 I84 L339	Y48-N337 HydrophobicContact CD1-CB 4.24Å; Y48-N337 HydrophobicContact CE1-CB 3.79Å; Y48-N337 PolarHBondContact OH-O 3.32Å; Y48-N337 VanDerWaalsContact OH-O 3.09Å; I84-N337 HydrophobicContact CD1-CB 4.37Å; I84-N337 WeakPolarHBondContact CD1-ND2 3.43Å; N337-L339 PolarHBondContact O-N 3.45Å
338	A	84.4	Confident	86.5	Confident	9 Å²	9	76.4 Å²	76.4	7%	0.074	41%	0.407	C	S	.	.	S	Bend	trans	-57	-36	179	0	0	0	0	0	112.6	F99 Q172 V335 P336	F99-A338 HydrophobicContact CE1-CB 3.96Å; Q172-A338 PolarHBondContact NE2-O 2.63Å; Q172-A338 PolarHBondContact OE1-O 2.71Å; V335-A338 HydrophobicContact CB-CB 4.17Å; V335-A338 HydrophobicContact CG1-CB 3.91Å; P336-A338 PolarHBondContact O-N 2.96Å
339	L	87.4	Confident	86.1	Confident	18 Å²	18	79 Å²	79	9%	0.094	42%	0.418	C	S	.	.	S	Bend	trans	-130.3	155.5	166	-70.7	176.5	0	0	0	109.6	I163 M167 N170 V321 N337	I163-L339 HydrophobicContact CG2-CD1 4.14Å; M167-L339 HydrophobicContact CG-CD1 3.65Å; M167-L339 HydrophobicContact CG-CD2 4.29Å; N170-L339 HydrophobicContact CB-CD2 4.23Å; V321-L339 HydrophobicContact CB-CD1 4.2Å; V321-L339 HydrophobicContact CG1-CD1 3.99Å; V321-L339 HydrophobicContact CG2-CD1 4.17Å; N337-L339 PolarHBondContact O-N 3.45Å
340	P	83.4	Confident	85.9	Confident	48 Å²	48	82.9 Å²	82.9	31%	0.312	42%	0.424	S	S	.	.			trans	-67	146.4	170.1	28.8	-34.8	0	0	0	111.7	Y48	Y48-P340 HydrophobicContact CD1-CB 4Å; Y48-P340 HydrophobicContact CE1-CB 3.8Å
341	P	86.8	Confident	85.7	Confident	76 Å²	76	80.7 Å²	80.7	49%	0.494	42%	0.423	S	S	.	.			trans	-72.4	157	176	31.6	-35.7	0	0	0	111.8
342	V	87.7	Confident	85.3	Confident	53 Å²	53	82.1 Å²	82.1	32%	0.321	43%	0.428	S	S	.	.			trans	-107.9	117.2	167.3	178.9	0	0	0	0	107.7	T159 M162 I163 Y344	T159-V342 HydrophobicContact CG2-CG1 4.31Å; M162-V342 HydrophobicContact CB-CG2 4.42Å; M162-V342 HydrophobicContact CE-CG1 3.69Å; I163-V342 HydrophobicContact CD1-CG2 3.92Å; V342-Y344 HydrophobicContact CG1-CD1 4.12Å; V342-Y344 HydrophobicContact CG1-CE1 4.37Å
343	T	85	Confident	85	Confident	84 Å²	84	83.6 Å²	83.6	52%	0.515	44%	0.441	S	S	.	.			trans	-122.3	130.4	-177.7	-50.3	0	0	0	0	109.8	A51	A51-T343 HydrophobicContact CB-CG2 4.2Å
344	Y	83	Confident	84.7	Confident	102 Å²	102	87 Å²	87	40%	0.4	46%	0.463	S	S	.	.			trans	-149.3	170	179.4	56	-80.9	0	0	0	110.2	T159 V342	T159-Y344 HydrophobicContact CG2-CE1 3.99Å; V342-Y344 HydrophobicContact CG1-CD1 4.12Å; V342-Y344 HydrophobicContact CG1-CE1 4.37Å
345	L	73.9	Confident	84.5	Confident	59 Å²	59	88.5 Å²	88.5	31%	0.309	47%	0.466	S	S	.	.			trans	-99.9	147.6	178.6	-62	177.6	0	0	0	111.1	Y56 V60 F347	Y56-L345 HydrophobicContact CG-CD2 4.44Å; V60-L345 HydrophobicContact CB-CD1 4.47Å; V60-L345 HydrophobicContact CG2-CD1 4.19Å; V60-L345 HydrophobicContact CG2-CD2 4.42Å; L345-F347 HydrophobicContact CB-CD1 4.21Å; L345-F347 PolarHBondContact O-N 2.96Å
346	E	74.5	Confident	84.4	Confident	181 Å²	181	92.5 Å²	92.5	85%	0.846	49%	0.485	S	S	*	.			trans	-81.9	99.2	168.9	-66	176.1	-174.7	0	0	108.8
347	F	79.5	Confident	84.9	Confident	145 Å²	145	94.3 Å²	94.3	64%	0.636	50%	0.495	S	S	*	.			trans	-145.6	160	177.6	79.2	-78.2	0	0	0	112.2	L345	L345-F347 HydrophobicContact CB-CD1 4.21Å; L345-F347 PolarHBondContact O-N 2.96Å
348	S	83.8	Confident	85.3	Confident	78 Å²	78	101.6 Å²	101.6	55%	0.545	52%	0.516	S	S	.	.			trans	-106.1	143.4	170.3	-176.5	0	0	0	0	110.3	R350	S348-R350 WeakPolarHBondContact OG-CB 3.27Å; S348-R350 PolarHBondContact OG-N 2.83Å
349	N	85.1	Confident	85.3	Confident	139 Å²	139	106.2 Å²	106.2	74%	0.743	54%	0.538	S	S	*	.			trans	-81.5	-0.3	171.3	69	-16.6	0	0	0	113.3
350	R	88.3	Confident	85.2	Confident	186 Å²	186	110.8 Å²	110.8	70%	0.702	56%	0.561	S	S	*	*			trans	-64.6	122.1	174.5	178	174.9	174.7	162.5	-1.8	109.5	S348	S348-R350 WeakPolarHBondContact OG-CB 3.27Å; S348-R350 PolarHBondContact OG-N 2.83Å
351	P	89.5	Confident	85.3	Confident	78 Å²	78	114.3 Å²	114.3	51%	0.506	58%	0.575	S	S	.	*			trans	-66.5	146.1	175.3	29	-34.9	0	0	0	110.6	T353 L356	P351-T353 PolarHBondContact O-N 3.39Å; P351-L356 HydrophobicContact CB-CD1 3.82Å; P351-L356 HydrophobicContact CG-CD1 4.02Å
352	N	86.4	Confident	85.2	Confident	98 Å²	98	116.6 Å²	116.6	52%	0.524	58%	0.58	S	S	.	*			trans	-65.7	107.1	169.6	178.6	-19.9	0	0	0	108.6	D354 F355 L356	N352-D354 VanDerWaalsContact C-N 3.31Å; N352-D354 PolarHBondContact O-N 3.04Å; N352-D354 WeakPolarHBondContact OD1-CB 3.3Å; N352-D354 PolarHBondContact OD1-N 3.28Å; N352-F355 HydrophobicContact CB-CB 3.96Å; N352-F355 PolarHBondContact O-N 3.06Å; N352-F355 PolarHBondContact OD1-N 3.01Å; N352-L356 WeakPolarHBondContact O-CG 3.35Å; N352-L356 PolarHBondContact O-N 2.76Å; N352-L356 VanDerWaalsContact O-N 3.17Å
353	T	89.9	Confident	85.1	Confident	65 Å²	65	120.6 Å²	120.6	40%	0.399	60%	0.596	S	S	.	*	H	α-helix	trans	-61.4	-40.4	-178.3	38.7	0	0	0	0	112.1	P351 F355 L356 T357	P351-T353 PolarHBondContact O-N 3.39Å; T353-F355 VanDerWaalsContact C-N 3.26Å; T353-F355 PolarHBondContact O-N 3.44Å; T353-L356 CarbonylContact O-C 3.54Å; T353-L356 WeakPolarHBondContact O-CA 3.44Å; T353-L356 WeakPolarHBondContact O-CB 3.3Å; T353-L356 PolarHBondContact O-N 3.25Å; T353-T357 PolarHBondContact O-N 3.19Å; T353-T357 PolarHBondContact O-OG1 3.07Å
354	D	88.4	Confident	85.1	Confident	121 Å²	121	123 Å²	123	65%	0.647	60%	0.601	S	S	*	*	H	α-helix	trans	-70.1	-31.3	-173.8	-43.6	-5.4	0	0	0	110	N352	N352-D354 VanDerWaalsContact C-N 3.31Å; N352-D354 PolarHBondContact O-N 3.04Å; N352-D354 WeakPolarHBondContact OD1-CB 3.3Å; N352-D354 PolarHBondContact OD1-N 3.28Å
355	F	89.9	Confident	85.2	Confident	112 Å²	112	124.5 Å²	124.5	49%	0.491	62%	0.616	S	S	.	*	H	α-helix	trans	-74.2	-26.8	169.4	178	-90	0	0	0	113.6	N352 T353 R358	N352-F355 HydrophobicContact CB-CB 3.96Å; N352-F355 PolarHBondContact O-N 3.06Å; N352-F355 PolarHBondContact OD1-N 3.01Å; T353-F355 VanDerWaalsContact C-N 3.26Å; T353-F355 PolarHBondContact O-N 3.44Å; F355-R358 VanDerWaalsContact CE2-CZ 3.47Å; F355-R358 WeakPolarHBondContact O-CD 3.43Å; F355-R358 VanDerWaalsContact O-CG 3.28Å; F355-R358 WeakPolarHBondContact O-CG 3.48Å; F355-R358 PolarHBondContact O-NE 3Å; F355-R358 VanDerWaalsContact O-NE 3.1Å
356	L	89	Confident	86.1	Confident	117 Å²	117	129.5 Å²	129.5	61%	0.613	64%	0.639	S	S	*	*	H	α-helix	trans	-78.3	-24.3	173.9	-69.8	179.9	0	0	0	112.8	P351 N352 T353	P351-L356 HydrophobicContact CB-CD1 3.82Å; P351-L356 HydrophobicContact CG-CD1 4.02Å; N352-L356 WeakPolarHBondContact O-CG 3.35Å; N352-L356 PolarHBondContact O-N 2.76Å; N352-L356 VanDerWaalsContact O-N 3.17Å; T353-L356 CarbonylContact O-C 3.54Å; T353-L356 WeakPolarHBondContact O-CA 3.44Å; T353-L356 WeakPolarHBondContact O-CB 3.3Å; T353-L356 PolarHBondContact O-N 3.25Å
357	T	91.3	Very high	87.1	Confident	121 Å²	121	125.3 Å²	125.3	74%	0.742	62%	0.622	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107.4	28.9	-177.8	62	0	0	0	0	113.6	T353	T353-T357 PolarHBondContact O-N 3.19Å; T353-T357 PolarHBondContact O-OG1 3.07Å
358	R	83.8	Confident	87.8	Confident	243 Å²	243	123.5 Å²	123.5	92%	0.917	62%	0.621	S	S	*	*			trans	-89.8	0	-179.3	71	-173.6	167.8	129	6.6	113.6	F355	F355-R358 VanDerWaalsContact CE2-CZ 3.47Å; F355-R358 WeakPolarHBondContact O-CD 3.43Å; F355-R358 VanDerWaalsContact O-CG 3.28Å; F355-R358 WeakPolarHBondContact O-CG 3.48Å; F355-R358 PolarHBondContact O-NE 3Å; F355-R358 VanDerWaalsContact O-NE 3.1Å

Retrieved 358 of 358 residues in 632.6 ms (Link to these results)

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