A0A096MXQ3_PAPAN Loading...

Caspase-8

AlphaFold DB , UniProt , Accession A0A096MXQ3, Species PAPAN (Papio anubis, Olive baboon), Gene CASP8, Length 538 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	V	32.8	Very low	29.4	Very low	184 Å²	184	161.6 Å²	161.6	100%	1.115	87%	0.874	S	S	*	*				0	118.7	0	176.8	0	0	0	0	106.7
2	E	33.2	Very low	29	Very low	189 Å²	189	159.3 Å²	159.3	88%	0.883	85%	0.853	S	S	*	*			trans	47.6	120.2	162.6	-60.6	-178.5	154	0	0	117.7
3	G	32.1	Very low	28.6	Very low	84 Å²	84	156.8 Å²	156.8	87%	0.866	86%	0.856	S	S	*	*				110.4	96.1	54.4	0	0	0	0	0	108
4	G	30.5	Very low	28.5	Very low	83 Å²	83	157.9 Å²	157.9	86%	0.856	85%	0.848	S	S	*	*			trans	-137.8	97.2	-178.2	0	0	0	0	0	111.5
5	R	34.3	Very low	28.3	Very low	249 Å²	249	162.1 Å²	162.1	94%	0.94	85%	0.847	S	S	*	*			trans	-63.3	143.4	176.1	-61.1	170.4	-172.4	168.4	2.2	111.2
6	R	30.2	Very low	28.3	Very low	258 Å²	258	159.2 Å²	159.2	97%	0.974	83%	0.833	S	S	*	*				-156.9	143.6	129.6	-112.5	173.9	-174.4	-173.4	1.5	111.8
7	A	29.8	Very low	28.4	Very low	101 Å²	101	159.7 Å²	159.7	84%	0.835	83%	0.827	S	S	*	*			trans	-87.1	156.5	-155.5	0	0	0	0	0	114.4
8	R	24.9	Very low	28.3	Very low	227 Å²	227	160.8 Å²	160.8	86%	0.857	83%	0.825	S	S	*	*			trans	-64.2	144.2	163.2	-81.5	172.6	160.7	167.8	-6	112.7	V10	R8-V10 HydrophobicContact CB-CG2 4.33Å
9	V	25	Very low	28.4	Very low	142 Å²	142	160.2 Å²	160.2	86%	0.861	82%	0.822	S	S	*	*			trans	-153	96.5	133.7	179.6	0	0	0	0	104.3
10	V	25.8	Very low	28.1	Very low	96 Å²	96	155.4 Å²	155.4	58%	0.582	81%	0.814	S	S	*	*				49.2	98.8	78.4	-169.5	0	0	0	0	115	R8 E12	R8-V10 HydrophobicContact CB-CG2 4.33Å; V10-E12 HydrophobicContact CG1-CG 4.49Å
11	I	24.6	Very low	28.2	Very low	165 Å²	165	152.5 Å²	152.5	85%	0.846	81%	0.813	S	S	*	*			trans	-147	90.2	131.9	-55	-174	0	0	0	105.7
12	E	24.9	Very low	27.9	Very low	134 Å²	134	149.4 Å²	149.4	63%	0.626	80%	0.798	S	S	*	*				46.5	97	104.3	-83.7	-163.4	143.5	0	0	115.6	V10 K14	V10-E12 HydrophobicContact CG1-CG 4.49Å; E12-K14 IonicContact OE1-NZ 2.82Å; E12-K14 PolarHBondContact OE1-NZ 3.24Å
13	S	23.6	Very low	28.2	Very low	127 Å²	127	145.7 Å²	145.7	89%	0.888	79%	0.791	S	S	*	*			trans	-116.4	106.6	145.2	179.3	0	0	0	0	106.9
14	K	27.1	Very low	27.8	Very low	172 Å²	172	147.3 Å²	147.3	75%	0.748	78%	0.784	S	S	*	*			trans	-95.9	129.9	174.9	-99.4	177.9	-178.4	140.3	0	109.9	E12	E12-K14 IonicContact OE1-NZ 2.82Å; E12-K14 PolarHBondContact OE1-NZ 3.24Å
15	R	26	Very low	28.1	Very low	221 Å²	221	148.5 Å²	148.5	83%	0.834	78%	0.776	S	S	*	*			trans	-66.3	145.3	171.5	-83.6	173.8	168.5	168.5	-4.7	113.7
16	N	28.8	Very low	27.8	Very low	115 Å²	115	145.4 Å²	145.4	62%	0.615	77%	0.77	S	S	*	*				61.2	149.1	122.9	-56.4	-5.7	0	0	0	124.7
17	F	29.1	Very low	28	Very low	168 Å²	168	137.4 Å²	137.4	74%	0.737	75%	0.752	S	S	*	*				103.7	129.5	126.5	-90.4	-59.6	0	0	0	119
18	F	27.4	Very low	27.7	Very low	179 Å²	179	138 Å²	138	79%	0.785	75%	0.745	S	S	*	*				174.8	151.2	108.6	-89.4	-48.1	0	0	0	109.7
19	L	30.3	Very low	27.8	Very low	149 Å²	149	135.8 Å²	135.8	78%	0.78	74%	0.744	S	S	*	*			cis	-165.5	159.5	-0.8	-95.4	153.9	0	0	0	107.3
20	G	22.8	Very low	27.8	Very low	64 Å²	64	137.8 Å²	137.8	66%	0.66	74%	0.744	S	S	*	*			cis	175.3	179.8	7.9	0	0	0	0	0	116.1
21	A	28.8	Very low	27.8	Very low	96 Å²	96	139.5 Å²	139.5	79%	0.793	75%	0.754	S	S	*	*			trans	50.2	139	157.7	0	0	0	0	0	120.2
22	C	27.7	Very low	27.7	Very low	119 Å²	119	139.6 Å²	139.6	80%	0.804	75%	0.751	S	S	*	*			cis	173.1	177.3	-0.7	-105.5	0	0	0	0	105
23	P	38.1	Very low	27.7	Very low	111 Å²	111	141.1 Å²	141.1	72%	0.721	76%	0.763	S	S	*	*			cis	-133.3	167.9	-43.3	36.5	-17.8	0	0	0	114.7
24	T	24.7	Very low	27.7	Very low	117 Å²	117	138.8 Å²	138.8	72%	0.718	76%	0.759	S	S	*	*			trans	-27.8	168.4	163	51.4	0	0	0	0	120.1
25	P	37.3	Very low	27.7	Very low	108 Å²	108	141.8 Å²	141.8	70%	0.701	77%	0.765	S	S	*	*			cis	-154	149.4	41.3	35.7	-10.4	0	0	0	123.3
26	F	26.8	Very low	27.7	Very low	184 Å²	184	139.2 Å²	139.2	81%	0.807	77%	0.767	S	S	*	*			trans	55.2	163	135.5	-76	-97	0	0	0	122.3
27	P	34.8	Very low	27.7	Very low	91 Å²	91	137.7 Å²	137.7	59%	0.591	78%	0.779	S	S	*	*			cis	-144.4	177.5	-49.9	38.3	-18.9	0	0	0	116.5
28	T	24.3	Very low	27.5	Very low	114 Å²	114	133.4 Å²	133.4	70%	0.699	78%	0.781	S	S	*	*			trans	64.9	140.8	147	37.7	0	0	0	0	118.2
29	E	26.1	Very low	27.6	Very low	179 Å²	179	130.2 Å²	130.2	84%	0.836	78%	0.781	S	S	*	*			cis	-166.1	173.8	37.5	-136.6	163.6	-146.1	0	0	111.8
30	H	24.1	Very low	27.4	Very low	184 Å²	184	131.7 Å²	131.7	85%	0.852	79%	0.785	S	S	*	*			trans	-71	153.1	-164.2	-86.1	-101.5	0	0	0	117.5
31	V	26	Very low	27.7	Very low	132 Å²	132	134.6 Å²	134.6	80%	0.8	79%	0.79	S	S	*	*			trans	-63	136.7	158.6	173	0	0	0	0	111
32	E	23.8	Very low	27.5	Very low	167 Å²	167	135 Å²	135	78%	0.78	79%	0.792	S	S	*	*				-175.2	150	127.1	-112.6	-179	-177.1	0	0	116
33	L	23.6	Very low	27.4	Very low	167 Å²	167	138 Å²	138	87%	0.874	80%	0.797	S	S	*	*			trans	88.3	124.8	154.6	-68.6	152.8	0	0	0	120.4
34	G	24.3	Very low	27	Very low	77 Å²	77	139.1 Å²	139.1	79%	0.794	80%	0.802	S	S	*	*			trans	137.5	84.4	143.7	0	0	0	0	0	115.6
35	R	26.5	Very low	27.3	Very low	236 Å²	236	139.7 Å²	139.7	89%	0.891	81%	0.807	S	S	*	*			trans	-72.9	149	164	-105.9	-172.8	-169.4	-164.6	3.3	110.7
36	L	26.8	Very low	26.8	Very low	167 Å²	167	138.3 Å²	138.3	87%	0.874	81%	0.813	S	S	*	*			trans	94.9	104.1	152.7	-67.5	150.6	0	0	0	118.8
37	G	27.6	Very low	27	Very low	83 Å²	83	139.9 Å²	139.9	86%	0.856	82%	0.819	S	S	*	*				98.8	119.9	118.7	0	0	0	0	0	116.9
38	G	25.5	Very low	26.7	Very low	77 Å²	77	139.5 Å²	139.5	79%	0.794	83%	0.832	S	S	*	*			trans	131.7	115.6	158.6	0	0	0	0	0	114
39	S	30	Very low	26.9	Very low	112 Å²	112	138 Å²	138	78%	0.783	84%	0.839	S	S	*	*			trans	-47.1	133.7	164.3	50.3	0	0	0	0	112.9
40	E	26.3	Very low	27.4	Very low	181 Å²	181	133.8 Å²	133.8	85%	0.846	84%	0.835	S	S	*	*				175.3	147.7	115.5	-96.8	178.2	164.5	0	0	111.9
41	T	28.5	Very low	27.7	Very low	125 Å²	125	132 Å²	132	77%	0.767	83%	0.832	S	S	*	*			trans	-35.7	146	170.8	42.5	0	0	0	0	117.2
42	A	25.1	Very low	27.8	Very low	103 Å²	103	136.9 Å²	136.9	85%	0.851	84%	0.837	S	S	*	*			trans	-127	110.5	151.9	0	0	0	0	0	110
43	M	24.6	Very low	28.2	Very low	182 Å²	182	135.7 Å²	135.7	90%	0.897	84%	0.835	S	S	*	*			trans	-78.9	146.4	165.1	-68.9	-171.8	-171.2	0	0	110.3
44	V	30.4	Very low	28.5	Very low	136 Å²	136	135.4 Å²	135.4	82%	0.824	83%	0.833	S	S	*	*			trans	-132.4	127.6	155.9	-177.4	0	0	0	0	108.1
45	P	30.6	Very low	28.5	Very low	128 Å²	128	139.1 Å²	139.1	83%	0.831	83%	0.834	S	S	*	*			trans	-94.1	133.8	-177.9	34.4	-29	0	0	0	111.9
46	G	27.3	Very low	29.3	Very low	80 Å²	80	132.7 Å²	132.7	83%	0.825	82%	0.823	S	S	*	*			trans	-144.6	121.7	170.3	0	0	0	0	0	109.9
47	K	30.1	Very low	29.7	Very low	217 Å²	217	134.1 Å²	134.1	94%	0.943	82%	0.823	S	S	*	*			trans	-71	134.2	-162.5	-67	170.4	172.5	175.9	0	114.2
48	G	29.2	Very low	30.5	Very low	82 Å²	82	139.3 Å²	139.3	85%	0.845	82%	0.824	S	S	*	*			trans	97	117.9	134.8	0	0	0	0	0	117.5
49	G	29.2	Very low	31.4	Very low	82 Å²	82	144.5 Å²	144.5	85%	0.845	83%	0.828	S	S	*	*			trans	110.5	101.2	151.5	0	0	0	0	0	115.4
50	A	35.7	Very low	32.6	Very low	91 Å²	91	143 Å²	143	75%	0.752	81%	0.81	S	S	*	*			trans	-12.7	121.9	163.2	0	0	0	0	0	118.3
51	D	30.8	Very low	34.7	Very low	148 Å²	148	138.8 Å²	138.8	79%	0.791	79%	0.793	S	S	*	*				177	98.9	112.2	-88.6	-17.4	0	0	0	108.8	I53	D51-I53 PolarHBondContact O-N 3.5Å
52	Y	27.7	Very low	37.1	Very low	234 Å²	234	134.1 Å²	134.1	92%	0.918	76%	0.762	S	S	*	*			trans	-91.4	100	169.2	-74.3	-79.8	0	0	0	108.6	L54	Y52-L54 PolarHBondContact O-N 2.86Å
53	I	32.1	Very low	39.8	Very low	141 Å²	141	134 Å²	134	72%	0.723	75%	0.747	S	S	*	*			trans	-64.5	108.1	158.9	-60.6	175.4	0	0	0	106.3	D51 L55	D51-I53 PolarHBondContact O-N 3.5Å; I53-L55 HydrophobicContact CG2-CD2 4.04Å; I53-L55 HydrophobicContact CG2-CG 3.99Å; I53-L55 PolarHBondContact O-N 3.1Å; I53-L55 VanDerWaalsContact O-N 3.08Å
54	L	29.6	Very low	42.6	Very low	162 Å²	162	133.1 Å²	133.1	85%	0.848	73%	0.734	S	S	*	*			trans	-64.7	102.3	162.2	-84.9	157.1	0	0	0	107.5	Y52 P56	Y52-L54 PolarHBondContact O-N 2.86Å; L54-P56 WeakPolarHBondContact O-CD 3.39Å
55	L	25.9	Very low	45.1	Very low	154 Å²	154	128 Å²	128	81%	0.806	70%	0.701	S	S	*	*			trans	-94.9	111.9	158.9	-68.4	176.7	0	0	0	107.7	I53	I53-L55 HydrophobicContact CG2-CD2 4.04Å; I53-L55 HydrophobicContact CG2-CG 3.99Å; I53-L55 PolarHBondContact O-N 3.1Å; I53-L55 VanDerWaalsContact O-N 3.08Å
56	P	43	Very low	47.7	Very low	102 Å²	102	122.3 Å²	122.3	66%	0.662	66%	0.664	S	S	*	*			trans	-107.4	92.6	164.8	33.7	-20.1	0	0	0	108.3	L54	L54-P56 WeakPolarHBondContact O-CD 3.39Å
57	F	35	Very low	50.5	Low	197 Å²	197	124 Å²	124	86%	0.864	65%	0.647	S	S	*	*			trans	-148.4	90.4	159.8	-90.8	-81.2	0	0	0	107	E59	F57-E59 PolarHBondContact O-N 2.86Å; F57-E59 VanDerWaalsContact O-N 3.14Å
58	E	45.1	Very low	53.1	Low	191 Å²	191	115.8 Å²	115.8	89%	0.893	61%	0.613	S	S	*	*			trans	-61.9	108.3	151.7	-76.1	-175.9	157.4	0	0	105.5	M60	E58-M60 PolarHBondContact O-N 2.87Å; E58-M60 VanDerWaalsContact O-N 3.09Å
59	E	43.9	Very low	55.9	Low	186 Å²	186	111.9 Å²	111.9	87%	0.869	57%	0.573	S	S	*	*			trans	-52.6	116.8	168.7	-82.5	174.9	151.5	0	0	107.8	F57 D61	F57-E59 PolarHBondContact O-N 2.86Å; F57-E59 VanDerWaalsContact O-N 3.14Å; E59-D61 PolarHBondContact O-N 3.2Å
60	M	55.5	Low	58.5	Low	81 Å²	81	108.3 Å²	108.3	40%	0.399	54%	0.536	S	S	.	.			trans	-59.2	108.5	170	-83.1	175.5	55.1	0	0	107.8	E58 F62 N65 Y137	E58-M60 PolarHBondContact O-N 2.87Å; E58-M60 VanDerWaalsContact O-N 3.09Å; M60-F62 VanDerWaalsContact C-N 3.32Å; M60-F62 PolarHBondContact O-N 2.86Å; M60-N65 WeakPolarHBondContact CE-ND2 3.48Å; M60-Y137 WeakPolarHBondContact CE-O 3.49Å
61	D	70.1	Confident	61	Low	93 Å²	93	110 Å²	110	50%	0.497	53%	0.528	S	S	.	.			trans	-66.8	95.5	172.1	-174.7	-12.1	0	0	0	108.6	E59 N63 R64 N65	E59-D61 PolarHBondContact O-N 3.2Å; D61-N63 VanDerWaalsContact C-N 3.25Å; D61-N63 PolarHBondContact O-N 2.57Å; D61-N63 PolarHBondContact OD1-N 2.75Å; D61-R64 HydrophobicContact CB-CB 3.79Å; D61-R64 WeakPolarHBondContact O-CB 3.42Å; D61-R64 PolarHBondContact O-N 3.04Å; D61-R64 PolarHBondContact OD1-N 3.26Å; D61-N65 PolarHBondContact O-N 3.2Å
62	F	78.5	Confident	63.7	Low	26 Å²	26	106.9 Å²	106.9	11%	0.114	51%	0.509	C	S	.	.	H	α-helix	trans	-51.9	-42.2	-174.6	166.5	-110.6	0	0	0	112.4	M60 N65 L66 L113 E115 L118	M60-F62 VanDerWaalsContact C-N 3.32Å; M60-F62 PolarHBondContact O-N 2.86Å; F62-N65 PolarHBondContact O-N 3.07Å; F62-L66 HydrophobicContact CD2-CD1 4.48Å; F62-L66 HydrophobicContact CE1-CD1 4.02Å; F62-L66 HydrophobicContact CE2-CD1 3.96Å; F62-L66 HydrophobicContact CE2-CG 4.38Å; F62-L66 HydrophobicContact CZ-CD1 3.71Å; F62-L66 WeakPolarHBondContact O-CG 3.42Å; F62-L66 PolarHBondContact O-N 3.25Å; F62-L66 VanDerWaalsContact O-N 3.13Å; F62-L113 HydrophobicContact CE2-CD1 4.41Å; F62-L113 HydrophobicContact CE2-CG 4.45Å; F62-L113 HydrophobicContact CZ-CG 4.23Å; F62-E115 HydrophobicContact CB-CB 4.33Å; F62-E115 HydrophobicContact CB-CG 3.99Å; F62-E115 HydrophobicContact CD1-CB 4.16Å; F62-E115 HydrophobicContact CD2-CB 4.22Å; F62-E115 HydrophobicContact CE1-CB 4.47Å; F62-E115 HydrophobicContact CG-CB 4Å; F62-E115 HydrophobicContact CG-CG 4.21Å; F62-L118 HydrophobicContact CD2-CD2 3.98Å; F62-L118 HydrophobicContact CE2-CD2 3.59Å
63	N	81.9	Confident	66.6	Low	101 Å²	101	96.6 Å²	96.6	54%	0.54	47%	0.47	S	S	.	.	H	α-helix	trans	-73.3	-34.6	-179.8	-68.8	-50.9	0	0	0	112.1	D61 L66 Y67	D61-N63 VanDerWaalsContact C-N 3.25Å; D61-N63 PolarHBondContact O-N 2.57Å; D61-N63 PolarHBondContact OD1-N 2.75Å; N63-L66 PolarHBondContact O-N 3.07Å; N63-Y67 WeakPolarHBondContact O-CB 3.31Å; N63-Y67 PolarHBondContact O-N 3.3Å
64	R	82.2	Confident	69.2	Low	164 Å²	164	93.8 Å²	93.8	62%	0.619	46%	0.456	S	S	*	.	H	α-helix	trans	-65.3	-41.7	174.6	-173.2	176	177.3	-176.8	-2.2	111.6	D61 L66 Y67 D68	D61-R64 HydrophobicContact CB-CB 3.79Å; D61-R64 WeakPolarHBondContact O-CB 3.42Å; D61-R64 PolarHBondContact O-N 3.04Å; D61-R64 PolarHBondContact OD1-N 3.26Å; R64-L66 PolarHBondContact O-N 2.78Å; R64-Y67 WeakPolarHBondContact O-CB 3.43Å; R64-Y67 PolarHBondContact O-N 3.11Å; R64-D68 PolarHBondContact O-N 3.48Å
65	N	83.8	Confident	71.7	Confident	27 Å²	27	90.7 Å²	90.7	14%	0.144	45%	0.448	C	S	.	.	H	α-helix	trans	-63.3	-41.4	175.4	-71.8	-27.1	0	0	0	112.1	M60 D61 F62 Y67 D68 I69	M60-N65 WeakPolarHBondContact CE-ND2 3.48Å; D61-N65 PolarHBondContact O-N 3.2Å; F62-N65 PolarHBondContact O-N 3.07Å; N65-Y67 VanDerWaalsContact C-N 3.31Å; N65-Y67 PolarHBondContact O-N 2.64Å; N65-D68 PolarHBondContact O-N 3.35Å; N65-I69 WeakPolarHBondContact O-CB 3.5Å; N65-I69 WeakPolarHBondContact O-CD1 3.3Å; N65-I69 WeakPolarHBondContact O-CG1 3.41Å; N65-I69 PolarHBondContact O-N 3.13Å
66	L	85.2	Confident	74.5	Confident	10 Å²	10	90.4 Å²	90.4	5%	0.052	44%	0.443	C	S	.	.	H	α-helix	trans	-64.7	-36.7	174.9	-68.3	-178.8	0	0	0	112.4	F62 N63 R64 G70 F104 L113 L121	F62-L66 HydrophobicContact CD2-CD1 4.48Å; F62-L66 HydrophobicContact CE1-CD1 4.02Å; F62-L66 HydrophobicContact CE2-CD1 3.96Å; F62-L66 HydrophobicContact CE2-CG 4.38Å; F62-L66 HydrophobicContact CZ-CD1 3.71Å; F62-L66 WeakPolarHBondContact O-CG 3.42Å; F62-L66 PolarHBondContact O-N 3.25Å; F62-L66 VanDerWaalsContact O-N 3.13Å; N63-L66 PolarHBondContact O-N 3.07Å; R64-L66 PolarHBondContact O-N 2.78Å; L66-G70 PolarHBondContact O-N 2.88Å; L66-F104 HydrophobicContact CB-CD2 4.12Å; L66-F104 HydrophobicContact CD1-CB 4.49Å; L66-F104 HydrophobicContact CD2-CD2 4.19Å; L66-F104 HydrophobicContact CD2-CG 4.36Å; L66-F104 WeakPolarHBondContact O-CE2 3.4Å; L66-L113 HydrophobicContact CD1-CD2 3.9Å; L66-L113 HydrophobicContact CD1-CG 4.48Å; L66-L113 HydrophobicContact CD2-CD1 4.49Å; L66-L113 HydrophobicContact CD2-CD2 3.82Å; L66-L121 HydrophobicContact CD2-CD2 3.42Å; L66-L121 VanDerWaalsContact CD2-CD2 3.42Å
67	Y	86	Confident	76.6	Confident	116 Å²	116	87.2 Å²	87.2	46%	0.455	42%	0.419	S	S	.	.	H	α-helix	trans	-62.4	-51.9	174.2	-177.8	-90.1	0	0	0	111.4	N63 R64 N65 I69 G70 E71 L101	N63-Y67 WeakPolarHBondContact O-CB 3.31Å; N63-Y67 PolarHBondContact O-N 3.3Å; R64-Y67 WeakPolarHBondContact O-CB 3.43Å; R64-Y67 PolarHBondContact O-N 3.11Å; N65-Y67 VanDerWaalsContact C-N 3.31Å; N65-Y67 PolarHBondContact O-N 2.64Å; Y67-I69 VanDerWaalsContact C-N 3.35Å; Y67-I69 PolarHBondContact O-N 2.7Å; Y67-G70 PolarHBondContact O-N 2.75Å; Y67-G70 VanDerWaalsContact O-N 3.08Å; Y67-E71 HydrophobicContact CD1-CG 4.16Å; Y67-E71 HydrophobicContact CE1-CG 3.65Å; Y67-E71 HydrophobicContact CE2-CG 4.49Å; Y67-E71 PolarHBondContact O-N 3.36Å; Y67-L101 HydrophobicContact CD2-CD1 3.87Å; Y67-L101 HydrophobicContact CD2-CD2 4.36Å; Y67-L101 HydrophobicContact CE2-CD1 4.08Å
68	D	84.4	Confident	79	Confident	43 Å²	43	78.4 Å²	78.4	23%	0.23	38%	0.381	C	S	.	.	H	α-helix	trans	-65.9	-36.5	-177.3	-68.1	-22.7	0	0	0	112.2	R64 N65 Q72 Y137	R64-D68 PolarHBondContact O-N 3.48Å; N65-D68 PolarHBondContact O-N 3.35Å; D68-Q72 WeakPolarHBondContact O-CG 3.32Å; D68-Q72 PolarHBondContact O-N 3.37Å; D68-Y137 HydrophobicContact CB-CD1 4.01Å; D68-Y137 HydrophobicContact CB-CE1 3.31Å; D68-Y137 HydrophobicContact CB-CE2 4.49Å
69	I	87.4	Confident	80.9	Confident	0 Å²	0	71 Å²	71	0%	0	35%	0.353	C	S	.	.	H	α-helix	trans	-63.3	-45.3	170.9	-69.8	166.7	0	0	0	110.1	N65 Y67 E71 Q72 L73 F104 L121 L125 L133 Y137 L138	N65-I69 WeakPolarHBondContact O-CB 3.5Å; N65-I69 WeakPolarHBondContact O-CD1 3.3Å; N65-I69 WeakPolarHBondContact O-CG1 3.41Å; N65-I69 PolarHBondContact O-N 3.13Å; Y67-I69 VanDerWaalsContact C-N 3.35Å; Y67-I69 PolarHBondContact O-N 2.7Å; I69-E71 VanDerWaalsContact C-N 3.35Å; I69-E71 PolarHBondContact O-N 3.3Å; I69-Q72 PolarHBondContact O-N 2.73Å; I69-L73 HydrophobicContact CG2-CD1 4.07Å; I69-L73 WeakPolarHBondContact O-CG 3.27Å; I69-L73 PolarHBondContact O-N 2.6Å; I69-F104 HydrophobicContact CB-CE2 4.38Å; I69-F104 HydrophobicContact CG2-CE2 3.98Å; I69-F104 HydrophobicContact CG2-CZ 3.76Å; I69-L121 HydrophobicContact CD1-CD2 4.25Å; I69-L125 HydrophobicContact CD1-CD1 4.36Å; I69-L125 HydrophobicContact CG2-CD1 4.18Å; I69-L125 HydrophobicContact CG2-CD2 4.27Å; I69-L133 HydrophobicContact CG2-CD1 4.27Å; I69-Y137 HydrophobicContact CD1-CG 4.41Å; I69-Y137 HydrophobicContact CG1-CD2 3.81Å; I69-Y137 HydrophobicContact CG1-CG 3.83Å; I69-L138 HydrophobicContact CD1-CD1 4.42Å; I69-L138 HydrophobicContact CD1-CD2 3.91Å; I69-L138 HydrophobicContact CD1-CG 4.12Å
70	G	85.6	Confident	83	Confident	8 Å²	8	62.7 Å²	62.7	8%	0.082	32%	0.315	C	S	.	.	H	α-helix	trans	-62.7	-38.5	-177.7	0	0	0	0	0	113.5	L66 Y67 Q72 L73	L66-G70 PolarHBondContact O-N 2.88Å; Y67-G70 PolarHBondContact O-N 2.75Å; Y67-G70 VanDerWaalsContact O-N 3.08Å; G70-Q72 VanDerWaalsContact C-N 3.26Å; G70-Q72 PolarHBondContact O-N 2.84Å; G70-L73 PolarHBondContact O-N 2.72Å
71	E	87.8	Confident	84.5	Confident	126 Å²	126	58.9 Å²	58.9	59%	0.589	30%	0.296	S	S	*	.	H	α-helix	trans	-68.8	-23.9	177.3	-74	-69.9	110.9	0	0	113.3	Y67 I69	Y67-E71 HydrophobicContact CD1-CG 4.16Å; Y67-E71 HydrophobicContact CE1-CG 3.65Å; Y67-E71 HydrophobicContact CE2-CG 4.49Å; Y67-E71 PolarHBondContact O-N 3.36Å; I69-E71 VanDerWaalsContact C-N 3.35Å; I69-E71 PolarHBondContact O-N 3.3Å
72	Q	86.9	Confident	85.3	Confident	82 Å²	82	56.6 Å²	56.6	38%	0.383	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.8	-0.3	179.2	-68.9	-162.1	42	0	0	113.9	D68 I69 G70 R130 L133 Y137	D68-Q72 WeakPolarHBondContact O-CG 3.32Å; D68-Q72 PolarHBondContact O-N 3.37Å; I69-Q72 PolarHBondContact O-N 2.73Å; G70-Q72 VanDerWaalsContact C-N 3.26Å; G70-Q72 PolarHBondContact O-N 2.84Å; Q72-R130 PolarHBondContact O-NH1 3.48Å; Q72-R130 PolarHBondContact O-NH2 3.36Å; Q72-L133 HydrophobicContact CB-CD1 4.33Å; Q72-L133 HydrophobicContact CB-CD2 3.75Å; Q72-L133 HydrophobicContact CG-CD2 4.2Å; Q72-L133 VanDerWaalsContact OE1-CD2 3.25Å; Q72-Y137 PolarHBondContact NE2-OH 3.17Å
73	L	88.9	Confident	85.7	Confident	19 Å²	19	55.5 Å²	55.5	10%	0.099	28%	0.277	C	S	.	.			trans	-98	125.5	177.6	-70.4	166.3	0	0	0	110.5	I69 G70 E77 L81 A100 F104 L125 I128 L133	I69-L73 HydrophobicContact CG2-CD1 4.07Å; I69-L73 WeakPolarHBondContact O-CG 3.27Å; I69-L73 PolarHBondContact O-N 2.6Å; G70-L73 PolarHBondContact O-N 2.72Å; L73-E77 VanDerWaalsContact CA-OE2 3.28Å; L73-E77 WeakPolarHBondContact CA-OE2 3.41Å; L73-E77 HydrophobicContact CD2-CB 4.04Å; L73-L81 HydrophobicContact CD1-CD1 3.6Å; L73-L81 HydrophobicContact CD2-CD1 4.13Å; L73-L81 HydrophobicContact CG-CD1 4.46Å; L73-A100 HydrophobicContact CB-CB 4.23Å; L73-A100 HydrophobicContact CD1-CB 3.89Å; L73-F104 HydrophobicContact CD1-CZ 3.8Å; L73-L125 HydrophobicContact CD2-CD2 4.3Å; L73-I128 HydrophobicContact CD2-CD1 3.73Å; L73-L133 HydrophobicContact CD2-CD1 4.08Å; L73-L133 HydrophobicContact CG-CD1 4.3Å
74	D	86	Confident	85.9	Confident	81 Å²	81	50.8 Å²	50.8	43%	0.433	25%	0.252	S	S	.	.			trans	-84	-179.9	176.2	74.3	30.6	0	0	0	112.8	E76 E77 L78	D74-E76 VanDerWaalsContact C-N 3.35Å; D74-E76 WeakPolarHBondContact OD1-CA 3.19Å; D74-E76 WeakPolarHBondContact OD1-CB 3.38Å; D74-E76 PolarHBondContact OD1-N 3.34Å; D74-E77 PolarHBondContact N-OE2 3.03Å; D74-E77 WeakPolarHBondContact OD1-CG 3.47Å; D74-E77 PolarHBondContact OD1-N 3.39Å; D74-L78 VanDerWaalsContact O-CB 3.27Å; D74-L78 WeakPolarHBondContact O-CB 3.47Å; D74-L78 PolarHBondContact O-N 3.31Å
75	S	83.7	Confident	86	Confident	98 Å²	98	43 Å²	43	69%	0.685	22%	0.222	S	C	*	.	H	α-helix	trans	-69.1	-29.8	-178.6	54.3	0	0	0	0	114	A79	S75-A79 PolarHBondContact O-N 2.65Å
76	E	82.9	Confident	86	Confident	147 Å²	147	42.6 Å²	42.6	69%	0.687	22%	0.22	S	C	*	.	H	α-helix	trans	-74.7	-45.8	178.3	-65.8	-173.8	176.9	0	0	109.3	D74 L78 A79 S80	D74-E76 VanDerWaalsContact C-N 3.35Å; D74-E76 WeakPolarHBondContact OD1-CA 3.19Å; D74-E76 WeakPolarHBondContact OD1-CB 3.38Å; D74-E76 PolarHBondContact OD1-N 3.34Å; E76-L78 VanDerWaalsContact C-N 3.32Å; E76-L78 PolarHBondContact O-N 3.02Å; E76-A79 WeakPolarHBondContact O-CB 3.39Å; E76-A79 PolarHBondContact O-N 2.91Å; E76-S80 PolarHBondContact O-N 3.34Å; E76-S80 PolarHBondContact O-OG 3.32Å
77	E	87	Confident	85.7	Confident	35 Å²	35	46.1 Å²	46.1	16%	0.164	24%	0.239	C	C	.	.	H	α-helix	trans	-61.2	-39.8	174.1	-66.4	175.1	137.8	0	0	111.7	L73 D74 A79 S80 L81 I128 R130	L73-E77 VanDerWaalsContact CA-OE2 3.28Å; L73-E77 WeakPolarHBondContact CA-OE2 3.41Å; L73-E77 HydrophobicContact CD2-CB 4.04Å; D74-E77 PolarHBondContact N-OE2 3.03Å; D74-E77 WeakPolarHBondContact OD1-CG 3.47Å; D74-E77 PolarHBondContact OD1-N 3.39Å; E77-A79 VanDerWaalsContact C-N 3.31Å; E77-A79 PolarHBondContact O-N 3.27Å; E77-S80 WeakPolarHBondContact O-CB 3.33Å; E77-S80 PolarHBondContact O-N 3.41Å; E77-L81 VanDerWaalsContact O-CG 3.29Å; E77-L81 WeakPolarHBondContact O-CG 3.41Å; E77-L81 PolarHBondContact O-N 2.86Å; E77-I128 HydrophobicContact CB-CD1 4.47Å; E77-R130 VanDerWaalsContact CD-NH1 3.25Å; E77-R130 WeakPolarHBondContact OE1-CD 3.32Å; E77-R130 WeakPolarHBondContact OE1-CG 3.17Å; E77-R130 IonicContact OE1-CZ 3.42Å; E77-R130 IonicContact OE1-NE 3.13Å; E77-R130 IonicContact OE1-NH1 2.82Å; E77-R130 PolarHBondContact OE1-NH1 3.19Å; E77-R130 IonicContact OE2-NH1 2.98Å; E77-R130 PolarHBondContact OE2-NH1 3.44Å
78	L	86.9	Confident	85.2	Confident	13 Å²	13	42.3 Å²	42.3	7%	0.068	23%	0.229	C	C	.	.	H	α-helix	trans	-61.8	-38.8	173.5	179.9	61.1	0	0	0	112.1	D74 E76 L81 K82 A100 L103	D74-L78 VanDerWaalsContact O-CB 3.27Å; D74-L78 WeakPolarHBondContact O-CB 3.47Å; D74-L78 PolarHBondContact O-N 3.31Å; E76-L78 VanDerWaalsContact C-N 3.32Å; E76-L78 PolarHBondContact O-N 3.02Å; L78-L81 PolarHBondContact O-N 2.88Å; L78-K82 HydrophobicContact CG-CD 4.37Å; L78-K82 WeakPolarHBondContact O-CB 3.2Å; L78-K82 VanDerWaalsContact O-CG 3.28Å; L78-K82 WeakPolarHBondContact O-CG 3.46Å; L78-K82 PolarHBondContact O-N 2.87Å; L78-A100 HydrophobicContact CD1-CB 4.24Å; L78-L103 HydrophobicContact CD1-CB 4.33Å; L78-L103 HydrophobicContact CD1-CD2 4.05Å
79	A	85.1	Confident	84.8	Confident	36 Å²	36	40.4 Å²	40.4	30%	0.298	22%	0.219	S	C	.	.	H	α-helix	trans	-65.3	-41.6	175.8	0	0	0	0	0	111.1	S75 E76 E77 K82 F83	S75-A79 PolarHBondContact O-N 2.65Å; E76-A79 WeakPolarHBondContact O-CB 3.39Å; E76-A79 PolarHBondContact O-N 2.91Å; E77-A79 VanDerWaalsContact C-N 3.31Å; E77-A79 PolarHBondContact O-N 3.27Å; A79-K82 WeakPolarHBondContact O-CB 3.49Å; A79-K82 PolarHBondContact O-N 3.32Å; A79-F83 PolarHBondContact O-N 2.77Å
80	S	87.6	Confident	84.1	Confident	11 Å²	11	43.8 Å²	43.8	8%	0.077	24%	0.241	C	C	.	.	H	α-helix	trans	-60.1	-45.5	173.4	-58.1	0	0	0	0	112.2	E76 E77 K82 F83 L84 Y165	E76-S80 PolarHBondContact O-N 3.34Å; E76-S80 PolarHBondContact O-OG 3.32Å; E77-S80 WeakPolarHBondContact O-CB 3.33Å; E77-S80 PolarHBondContact O-N 3.41Å; S80-K82 PolarHBondContact O-N 2.88Å; S80-F83 PolarHBondContact O-N 2.9Å; S80-L84 WeakPolarHBondContact O-CG 3.43Å; S80-L84 PolarHBondContact O-N 3.18Å; S80-Y165 VanDerWaalsContact CB-CE2 3.46Å; S80-Y165 WeakPolarHBondContact OG-CE2 3.4Å
81	L	86.9	Confident	83.4	Confident	0 Å²	0	46.3 Å²	46.3	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-63.9	-40.1	176.6	-70.3	178.2	0	0	0	112.6	L73 E77 L78 S85 L103 L124 I128	L73-L81 HydrophobicContact CD1-CD1 3.6Å; L73-L81 HydrophobicContact CD2-CD1 4.13Å; L73-L81 HydrophobicContact CG-CD1 4.46Å; E77-L81 VanDerWaalsContact O-CG 3.29Å; E77-L81 WeakPolarHBondContact O-CG 3.41Å; E77-L81 PolarHBondContact O-N 2.86Å; L78-L81 PolarHBondContact O-N 2.88Å; L81-S85 VanDerWaalsContact O-CB 3.32Å; L81-S85 WeakPolarHBondContact O-CB 3.45Å; L81-S85 PolarHBondContact O-N 2.73Å; L81-S85 PolarHBondContact O-OG 2.95Å; L81-L103 HydrophobicContact CB-CD2 3.71Å; L81-L103 HydrophobicContact CD1-CD2 4.45Å; L81-L124 HydrophobicContact CD2-CB 3.68Å; L81-L124 HydrophobicContact CD2-CD1 4.36Å; L81-L124 HydrophobicContact CD2-CD2 3.95Å; L81-L124 HydrophobicContact CD2-CG 4.21Å; L81-I128 HydrophobicContact CD1-CD1 4.4Å; L81-I128 HydrophobicContact CD2-CD1 4Å; L81-I128 HydrophobicContact CD2-CG1 4.46Å; L81-I128 HydrophobicContact CD2-CG2 3.95Å; L81-I128 HydrophobicContact CG-CD1 4.19Å; L81-I128 HydrophobicContact CG-CG2 4.37Å
82	K	86.3	Confident	82.5	Confident	46 Å²	46	50.9 Å²	50.9	20%	0.2	26%	0.262	C	S	.	.	H	α-helix	trans	-60.9	-47.3	173.2	-78.1	170.7	177.8	177.3	0	111.1	L78 A79 S80 S85 L86 Q94 I97	L78-K82 HydrophobicContact CG-CD 4.37Å; L78-K82 WeakPolarHBondContact O-CB 3.2Å; L78-K82 VanDerWaalsContact O-CG 3.28Å; L78-K82 WeakPolarHBondContact O-CG 3.46Å; L78-K82 PolarHBondContact O-N 2.87Å; A79-K82 WeakPolarHBondContact O-CB 3.49Å; A79-K82 PolarHBondContact O-N 3.32Å; S80-K82 PolarHBondContact O-N 2.88Å; K82-S85 CarbonylContact O-C 3.59Å; K82-S85 PolarHBondContact O-N 2.81Å; K82-S85 PolarHBondContact O-OG 3.03Å; K82-S85 VanDerWaalsContact O-OG 3.07Å; K82-L86 PolarHBondContact O-N 3.25Å; K82-Q94 PolarHBondContact O-NE2 3.29Å; K82-Q94 PolarHBondContact O-OE1 3.36Å; K82-I97 WeakPolarHBondContact CE-O 3.36Å; K82-I97 PolarHBondContact NZ-O 3.21Å
83	F	87.4	Confident	81.8	Confident	3 Å²	3	52.5 Å²	52.5	1%	0.013	27%	0.268	C	S	.	.	H	α-helix	trans	-59.7	-49.9	178.3	179.9	-94.7	0	0	0	112.2	A79 S80 S85 L86 L164 L199 F202 I203	A79-F83 PolarHBondContact O-N 2.77Å; S80-F83 PolarHBondContact O-N 2.9Å; F83-S85 PolarHBondContact O-N 2.73Å; F83-L86 HydrophobicContact CD2-CD1 3.78Å; F83-L86 HydrophobicContact CE2-CD1 4.28Å; F83-L86 HydrophobicContact CG-CD1 4.37Å; F83-L86 WeakPolarHBondContact O-CB 3.4Å; F83-L86 WeakPolarHBondContact O-CG 3.14Å; F83-L86 PolarHBondContact O-N 3.13Å; F83-L86 VanDerWaalsContact O-N 3.16Å; F83-L164 HydrophobicContact CE1-CB 3.94Å; F83-L164 HydrophobicContact CZ-CB 3.69Å; F83-L164 HydrophobicContact CZ-CD1 3.87Å; F83-L164 HydrophobicContact CZ-CG 4.47Å; F83-L199 HydrophobicContact CB-CD1 4.01Å; F83-L199 HydrophobicContact CB-CD2 4.49Å; F83-L199 HydrophobicContact CD1-CD2 3.68Å; F83-L199 HydrophobicContact CD2-CB 3.91Å; F83-L199 HydrophobicContact CD2-CD2 3.9Å; F83-L199 HydrophobicContact CD2-CG 4.37Å; F83-L199 HydrophobicContact CE1-CD2 3.76Å; F83-L199 HydrophobicContact CE2-CB 4.36Å; F83-L199 HydrophobicContact CE2-CD2 3.98Å; F83-L199 HydrophobicContact CG-CB 4.25Å; F83-L199 HydrophobicContact CG-CD1 4.17Å; F83-L199 HydrophobicContact CG-CD2 3.75Å; F83-L199 HydrophobicContact CG-CG 4.28Å; F83-L199 HydrophobicContact CZ-CD2 3.91Å; F83-F202 HydrophobicContact CE2-CB 4.22Å; F83-F202 HydrophobicContact CZ-CB 4.46Å; F83-F202 HydrophobicContact CZ-CD2 4.45Å; F83-I203 HydrophobicContact CD2-CD1 4.03Å; F83-I203 HydrophobicContact CD2-CG1 3.96Å; F83-I203 HydrophobicContact CE2-CG1 4.04Å
84	L	85.4	Confident	81	Confident	2 Å²	2	52.2 Å²	52.2	1%	0.01	27%	0.266	C	S	.	.	H	α-helix	trans	-64.4	-25.3	179.3	-69.4	172.8	0	0	0	112.9	S80 L124 R127 I128 I157 R161 Y165	S80-L84 WeakPolarHBondContact O-CG 3.43Å; S80-L84 PolarHBondContact O-N 3.18Å; L84-L124 HydrophobicContact CB-CD2 3.69Å; L84-L124 HydrophobicContact CD1-CD2 4.34Å; L84-R127 HydrophobicContact CD1-CB 3.75Å; L84-I128 HydrophobicContact CD1-CG2 3.93Å; L84-I157 HydrophobicContact CB-CD1 4.37Å; L84-I157 HydrophobicContact CD2-CG2 4.26Å; L84-R161 HydrophobicContact CD2-CB 4.47Å; L84-Y165 HydrophobicContact CD2-CG 4.08Å; L84-Y165 HydrophobicContact CG-CG 4.48Å
85	S	84.8	Confident	80.3	Confident	0 Å²	0	55.1 Å²	55.1	0%	0	28%	0.277	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.3	6.8	178	62.1	0	0	0	0	114.5	L81 K82 F83 D87 C88 I89 Q94	L81-S85 VanDerWaalsContact O-CB 3.32Å; L81-S85 WeakPolarHBondContact O-CB 3.45Å; L81-S85 PolarHBondContact O-N 2.73Å; L81-S85 PolarHBondContact O-OG 2.95Å; K82-S85 CarbonylContact O-C 3.59Å; K82-S85 PolarHBondContact O-N 2.81Å; K82-S85 PolarHBondContact O-OG 3.03Å; K82-S85 VanDerWaalsContact O-OG 3.07Å; F83-S85 PolarHBondContact O-N 2.73Å; S85-D87 VanDerWaalsContact C-N 3.26Å; S85-D87 PolarHBondContact O-N 3.02Å; S85-C88 PolarHBondContact O-N 3.4Å; S85-I89 PolarHBondContact O-N 3.37Å; S85-Q94 PolarHBondContact O-NE2 3.06Å; S85-Q94 PolarHBondContact OG-NE2 2.99Å
86	L	83.1	Confident	80	Confident	19 Å²	19	53.5 Å²	53.5	10%	0.099	26%	0.264	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59	-35	-179.3	-81.1	169.9	0	0	0	113.7	K82 F83 C88 I89 Q91 I203	K82-L86 PolarHBondContact O-N 3.25Å; F83-L86 HydrophobicContact CD2-CD1 3.78Å; F83-L86 HydrophobicContact CE2-CD1 4.28Å; F83-L86 HydrophobicContact CG-CD1 4.37Å; F83-L86 WeakPolarHBondContact O-CB 3.4Å; F83-L86 WeakPolarHBondContact O-CG 3.14Å; F83-L86 PolarHBondContact O-N 3.13Å; F83-L86 VanDerWaalsContact O-N 3.16Å; L86-C88 PolarHBondContact O-N 3.21Å; L86-I89 CarbonylContact O-C 3.52Å; L86-Q91 HydrophobicContact CD2-CB 4.15Å; L86-I203 HydrophobicContact CD1-CD1 3.86Å; L86-I203 HydrophobicContact CD1-CG1 3.72Å
87	D	79.6	Confident	79.9	Confident	83 Å²	83	46.7 Å²	46.7	44%	0.444	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.8	-24.4	178.6	-61.6	-14.6	0	0	0	111.6	S85 S158 R161	S85-D87 VanDerWaalsContact C-N 3.26Å; S85-D87 PolarHBondContact O-N 3.02Å; D87-S158 VanDerWaalsContact OD2-CB 3.31Å; D87-S158 WeakPolarHBondContact OD2-CB 3.35Å; D87-S158 PolarHBondContact OD2-OG 3.48Å; D87-R161 IonicContact OD1-CZ 3.61Å; D87-R161 IonicContact OD1-NE 3.81Å; D87-R161 PolarHBondContact OD1-NE 3.24Å; D87-R161 IonicContact OD1-NH2 3.54Å; D87-R161 PolarHBondContact OD1-NH2 3.4Å; D87-R161 WeakPolarHBondContact OD2-CG 3.37Å; D87-R161 IonicContact OD2-NE 3.47Å
88	C	74.6	Confident	79.5	Confident	36 Å²	36	53.5 Å²	53.5	24%	0.243	26%	0.262	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.3	-37.8	-179.5	-54.9	0	0	0	0	112.8	S85 L86 F120	S85-C88 PolarHBondContact O-N 3.4Å; L86-C88 PolarHBondContact O-N 3.21Å; C88-F120 HydrophobicContact CB-CZ 4.34Å
89	I	75.9	Confident	79.4	Confident	3 Å²	3	56.2 Å²	56.2	2%	0.015	28%	0.276	C	S	.	.	S	Bend	trans	-122.4	106.2	-180	-54.9	175	0	0	0	108	S85 L86 K93 Q94 L103 R106 L107	S85-I89 PolarHBondContact O-N 3.37Å; L86-I89 CarbonylContact O-C 3.52Å; I89-K93 HydrophobicContact CG2-CB 3.92Å; I89-Q94 HydrophobicContact CB-CG 4.01Å; I89-Q94 HydrophobicContact CG2-CG 3.55Å; I89-Q94 WeakPolarHBondContact O-CG 3.22Å; I89-Q94 PolarHBondContact O-NE2 2.9Å; I89-L103 HydrophobicContact CD1-CD1 4.04Å; I89-R106 HydrophobicContact CD1-CB 3.98Å; I89-L107 HydrophobicContact CD1-CD2 3.59Å; I89-L107 HydrophobicContact CD1-CG 3.96Å; I89-L107 HydrophobicContact CG1-CD2 4.22Å
90	P	73.9	Confident	79.4	Confident	72 Å²	72	54.8 Å²	54.8	47%	0.468	26%	0.264	S	S	.	.			trans	-58.2	145.1	179.4	-25.2	33.6	0	0	0	112.5	R92 K93 Q94	P90-R92 VanDerWaalsContact C-N 3.25Å; P90-R92 PolarHBondContact O-N 2.8Å; P90-K93 PolarHBondContact O-N 2.8Å; P90-Q94 PolarHBondContact O-N 3.04Å
91	Q	70.2	Confident	79.3	Confident	61 Å²	61	57 Å²	57	29%	0.285	28%	0.275	S	S	.	.	H	α-helix	trans	-46.2	-41.9	-175.4	-173.1	174	19.4	0	0	114.5	L86 K93 Q94 E95 K207	L86-Q91 HydrophobicContact CD2-CB 4.15Å; Q91-K93 PolarHBondContact O-N 3.42Å; Q91-K93 VanDerWaalsContact O-N 3.1Å; Q91-Q94 PolarHBondContact O-N 3.21Å; Q91-E95 PolarHBondContact O-N 3.42Å; Q91-E95 VanDerWaalsContact O-N 3.08Å; Q91-K207 VanDerWaalsContact NE2-NZ 3.15Å
92	R	69.1	Low	79.2	Confident	221 Å²	221	59.4 Å²	59.4	83%	0.834	29%	0.287	S	S	*	.	H	α-helix	trans	-58.5	-25.9	178.6	-65.2	-175.4	-176.9	170	3.1	114.1	P90	P90-R92 VanDerWaalsContact C-N 3.25Å; P90-R92 PolarHBondContact O-N 2.8Å
93	K	71.9	Confident	79.1	Confident	116 Å²	116	57.2 Å²	57.2	50%	0.504	28%	0.278	S	S	.	.	H	α-helix	trans	-95.1	-12.6	177.3	-65.4	-171	175.5	-170.6	0	112.6	I89 P90 Q91 P96	I89-K93 HydrophobicContact CG2-CB 3.92Å; P90-K93 PolarHBondContact O-N 2.8Å; Q91-K93 PolarHBondContact O-N 3.42Å; Q91-K93 VanDerWaalsContact O-N 3.1Å; K93-P96 WeakPolarHBondContact O-CD 3.31Å
94	Q	72.2	Confident	79.1	Confident	14 Å²	14	57.2 Å²	57.2	7%	0.065	28%	0.278	C	S	.	.	H	α-helix	trans	-88.5	-27.3	174.5	-61.4	-168	-3	0	0	113.2	K82 S85 I89 P90 Q91 P96 I97	K82-Q94 PolarHBondContact O-NE2 3.29Å; K82-Q94 PolarHBondContact O-OE1 3.36Å; S85-Q94 PolarHBondContact O-NE2 3.06Å; S85-Q94 PolarHBondContact OG-NE2 2.99Å; I89-Q94 HydrophobicContact CB-CG 4.01Å; I89-Q94 HydrophobicContact CG2-CG 3.55Å; I89-Q94 WeakPolarHBondContact O-CG 3.22Å; I89-Q94 PolarHBondContact O-NE2 2.9Å; P90-Q94 PolarHBondContact O-N 3.04Å; Q91-Q94 PolarHBondContact O-N 3.21Å; Q94-P96 VanDerWaalsContact C-CD 3.44Å; Q94-P96 VanDerWaalsContact C-N 3.35Å; Q94-I97 HydrophobicContact CB-CD1 4.27Å; Q94-I97 HydrophobicContact CG-CD1 4.36Å; Q94-I97 VanDerWaalsContact O-CB 3.27Å; Q94-I97 WeakPolarHBondContact O-CB 3.32Å; Q94-I97 PolarHBondContact O-N 3.03Å
95	E	71.4	Confident	79	Confident	142 Å²	142	61.7 Å²	61.7	66%	0.664	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-48.6	-41.6	174.5	-75.1	173.3	-165.4	0	0	115.1	Q91 I97	Q91-E95 PolarHBondContact O-N 3.42Å; Q91-E95 VanDerWaalsContact O-N 3.08Å; E95-I97 VanDerWaalsContact C-N 3.3Å; E95-I97 PolarHBondContact O-N 3.03Å
96	P	76.5	Confident	78.8	Confident	64 Å²	64	64.4 Å²	64.4	42%	0.416	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.1	-5.7	177.9	31.2	-36.6	0	0	0	114.6	K93 Q94 K98 M102	K93-P96 WeakPolarHBondContact O-CD 3.31Å; Q94-P96 VanDerWaalsContact C-CD 3.44Å; Q94-P96 VanDerWaalsContact C-N 3.35Å; P96-K98 PolarHBondContact O-N 3.21Å; P96-M102 WeakPolarHBondContact O-CE 3.45Å
97	I	81.1	Confident	78.9	Confident	3 Å²	3	63.5 Å²	63.5	2%	0.015	30%	0.304	C	S	.	.			trans	-78.6	112.1	-177.1	-59	177.8	0	0	0	108.5	K82 Q94 E95 D99 M102 L103 R106	K82-I97 WeakPolarHBondContact CE-O 3.36Å; K82-I97 PolarHBondContact NZ-O 3.21Å; Q94-I97 HydrophobicContact CB-CD1 4.27Å; Q94-I97 HydrophobicContact CG-CD1 4.36Å; Q94-I97 VanDerWaalsContact O-CB 3.27Å; Q94-I97 WeakPolarHBondContact O-CB 3.32Å; Q94-I97 PolarHBondContact O-N 3.03Å; E95-I97 VanDerWaalsContact C-N 3.3Å; E95-I97 PolarHBondContact O-N 3.03Å; I97-D99 WeakPolarHBondContact CG2-O 3.26Å; I97-M102 HydrophobicContact CB-CB 4.49Å; I97-M102 HydrophobicContact CG2-CB 3.91Å; I97-L103 HydrophobicContact CD1-CD1 3.74Å; I97-L103 HydrophobicContact CG2-CB 3.87Å; I97-R106 HydrophobicContact CD1-CB 4.36Å; I97-R106 HydrophobicContact CD1-CG 4.03Å; I97-R106 HydrophobicContact CG1-CG 4.31Å
98	K	79.7	Confident	78.9	Confident	178 Å²	178	62.5 Å²	62.5	77%	0.774	30%	0.297	S	S	*	.			trans	-100.5	-22.7	-176.9	-65.4	-175.7	179.8	-177.8	0	114.1	P96 M102	P96-K98 PolarHBondContact O-N 3.21Å; K98-M102 HydrophobicContact CB-SD 4.09Å; K98-M102 PolarHBondContact N-SD 2.9Å
99	D	84.8	Confident	79.3	Confident	70 Å²	70	66.4 Å²	66.4	37%	0.374	31%	0.311	S	S	.	.	S	Bend	trans	-140.3	171.1	-178.4	57.9	53.4	0	0	0	111	I97 L101 M102 L103	I97-D99 WeakPolarHBondContact CG2-O 3.26Å; D99-L101 VanDerWaalsContact C-N 3.3Å; D99-L101 PolarHBondContact O-N 2.81Å; D99-L101 WeakPolarHBondContact OD1-CB 3.49Å; D99-L101 PolarHBondContact OD1-N 3.23Å; D99-L101 VanDerWaalsContact OD1-N 3.09Å; D99-M102 PolarHBondContact O-N 3.19Å; D99-M102 WeakPolarHBondContact OD1-CB 3.11Å; D99-M102 VanDerWaalsContact OD1-CG 3.28Å; D99-M102 WeakPolarHBondContact OD1-CG 3.26Å; D99-M102 PolarHBondContact OD1-N 3.4Å; D99-L103 PolarHBondContact O-N 3Å
100	A	85.6	Confident	79.5	Confident	6 Å²	6	71.2 Å²	71.2	5%	0.05	33%	0.332	C	S	.	.	H	α-helix	trans	-65.7	-31	179.9	0	0	0	0	0	112.9	L73 L78 L103 F104	L73-A100 HydrophobicContact CB-CB 4.23Å; L73-A100 HydrophobicContact CD1-CB 3.89Å; L78-A100 HydrophobicContact CD1-CB 4.24Å; A100-L103 WeakPolarHBondContact O-CB 3.15Å; A100-L103 PolarHBondContact O-N 3.47Å; A100-L103 VanDerWaalsContact O-N 3.14Å; A100-F104 HydrophobicContact CB-CE2 4.28Å; A100-F104 HydrophobicContact CB-CZ 4.32Å; A100-F104 WeakPolarHBondContact O-CD2 2.99Å; A100-F104 VanDerWaalsContact O-CG 3.27Å; A100-F104 WeakPolarHBondContact O-CG 3.5Å; A100-F104 PolarHBondContact O-N 3.26Å
101	L	84.3	Confident	79.7	Confident	58 Å²	58	76.7 Å²	76.7	30%	0.304	34%	0.343	S	S	.	.	H	α-helix	trans	-67.1	-42	179.1	-56.7	179.6	0	0	0	111.4	Y67 D99 L103 F104 Q105	Y67-L101 HydrophobicContact CD2-CD1 3.87Å; Y67-L101 HydrophobicContact CD2-CD2 4.36Å; Y67-L101 HydrophobicContact CE2-CD1 4.08Å; D99-L101 VanDerWaalsContact C-N 3.3Å; D99-L101 PolarHBondContact O-N 2.81Å; D99-L101 WeakPolarHBondContact OD1-CB 3.49Å; D99-L101 PolarHBondContact OD1-N 3.23Å; D99-L101 VanDerWaalsContact OD1-N 3.09Å; L101-L103 PolarHBondContact O-N 3.26Å; L101-F104 HydrophobicContact CD2-CD2 4.44Å; L101-F104 PolarHBondContact O-N 2.91Å; L101-Q105 WeakPolarHBondContact O-CB 3.29Å; L101-Q105 PolarHBondContact O-N 3.13Å
102	M	84.4	Confident	80	Confident	51 Å²	51	76.5 Å²	76.5	25%	0.251	34%	0.343	S	S	.	.	H	α-helix	trans	-61.4	-34.5	172.7	-71.1	-174.1	78.7	0	0	111.5	P96 I97 K98 D99 R106	P96-M102 WeakPolarHBondContact O-CE 3.45Å; I97-M102 HydrophobicContact CB-CB 4.49Å; I97-M102 HydrophobicContact CG2-CB 3.91Å; K98-M102 HydrophobicContact CB-SD 4.09Å; K98-M102 PolarHBondContact N-SD 2.9Å; D99-M102 PolarHBondContact O-N 3.19Å; D99-M102 WeakPolarHBondContact OD1-CB 3.11Å; D99-M102 VanDerWaalsContact OD1-CG 3.28Å; D99-M102 WeakPolarHBondContact OD1-CG 3.26Å; D99-M102 PolarHBondContact OD1-N 3.4Å; M102-R106 VanDerWaalsContact O-CG 3.27Å; M102-R106 WeakPolarHBondContact O-CG 3.45Å; M102-R106 PolarHBondContact O-N 2.88Å; M102-R106 VanDerWaalsContact O-N 3.13Å
103	L	85.9	Confident	80.6	Confident	0 Å²	0	66.1 Å²	66.1	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-67	-47.4	174.4	-175.7	63.5	0	0	0	110.9	L78 L81 I89 I97 D99 A100 L101 Q105 R106 L107	L78-L103 HydrophobicContact CD1-CB 4.33Å; L78-L103 HydrophobicContact CD1-CD2 4.05Å; L81-L103 HydrophobicContact CB-CD2 3.71Å; L81-L103 HydrophobicContact CD1-CD2 4.45Å; I89-L103 HydrophobicContact CD1-CD1 4.04Å; I97-L103 HydrophobicContact CD1-CD1 3.74Å; I97-L103 HydrophobicContact CG2-CB 3.87Å; D99-L103 PolarHBondContact O-N 3Å; A100-L103 WeakPolarHBondContact O-CB 3.15Å; A100-L103 PolarHBondContact O-N 3.47Å; A100-L103 VanDerWaalsContact O-N 3.14Å; L101-L103 PolarHBondContact O-N 3.26Å; L103-Q105 VanDerWaalsContact C-N 3.33Å; L103-Q105 PolarHBondContact O-N 2.83Å; L103-R106 PolarHBondContact O-N 3.3Å; L103-R106 VanDerWaalsContact O-N 3.15Å; L103-L107 HydrophobicContact CG-CD1 4.28Å; L103-L107 WeakPolarHBondContact O-CG 3.25Å; L103-L107 PolarHBondContact O-N 3.05Å
104	F	86.5	Confident	80.9	Confident	3 Å²	3	64.6 Å²	64.6	1%	0.013	30%	0.299	C	S	.	.	H	α-helix	trans	-62.1	-40.5	177.8	-59.2	-26.3	0	0	0	112.1	L66 I69 L73 A100 L101 R106 L107 Q108 L113 L121	L66-F104 HydrophobicContact CB-CD2 4.12Å; L66-F104 HydrophobicContact CD1-CB 4.49Å; L66-F104 HydrophobicContact CD2-CD2 4.19Å; L66-F104 HydrophobicContact CD2-CG 4.36Å; L66-F104 WeakPolarHBondContact O-CE2 3.4Å; I69-F104 HydrophobicContact CB-CE2 4.38Å; I69-F104 HydrophobicContact CG2-CE2 3.98Å; I69-F104 HydrophobicContact CG2-CZ 3.76Å; L73-F104 HydrophobicContact CD1-CZ 3.8Å; A100-F104 HydrophobicContact CB-CE2 4.28Å; A100-F104 HydrophobicContact CB-CZ 4.32Å; A100-F104 WeakPolarHBondContact O-CD2 2.99Å; A100-F104 VanDerWaalsContact O-CG 3.27Å; A100-F104 WeakPolarHBondContact O-CG 3.5Å; A100-F104 PolarHBondContact O-N 3.26Å; L101-F104 HydrophobicContact CD2-CD2 4.44Å; L101-F104 PolarHBondContact O-N 2.91Å; F104-R106 VanDerWaalsContact C-N 3.32Å; F104-R106 PolarHBondContact O-N 2.9Å; F104-L107 HydrophobicContact CD1-CD1 4.39Å; F104-L107 PolarHBondContact O-N 2.83Å; F104-L107 VanDerWaalsContact O-N 3.16Å; F104-Q108 WeakPolarHBondContact O-CG 3.47Å; F104-Q108 PolarHBondContact O-N 3.47Å; F104-L113 HydrophobicContact CB-CD2 3.93Å; F104-L113 HydrophobicContact CD1-CD2 4.31Å; F104-L113 HydrophobicContact CG-CD2 4.31Å; F104-L121 HydrophobicContact CD1-CD1 4.22Å; F104-L121 HydrophobicContact CE1-CD1 3.56Å; F104-L121 HydrophobicContact CZ-CD1 4.04Å
105	Q	83.2	Confident	81	Confident	96 Å²	96	69.9 Å²	69.9	45%	0.449	32%	0.324	S	S	.	.	H	α-helix	trans	-60.1	-41.6	174	-169.6	-179.8	20.7	0	0	111.8	L101 L103 L107 Q108 E109	L101-Q105 WeakPolarHBondContact O-CB 3.29Å; L101-Q105 PolarHBondContact O-N 3.13Å; L103-Q105 VanDerWaalsContact C-N 3.33Å; L103-Q105 PolarHBondContact O-N 2.83Å; Q105-L107 VanDerWaalsContact C-N 3.35Å; Q105-Q108 WeakPolarHBondContact O-CB 3.46Å; Q105-Q108 PolarHBondContact O-N 3.14Å; Q105-E109 WeakPolarHBondContact O-CG 3.1Å; Q105-E109 PolarHBondContact O-N 2.85Å
106	R	81.6	Confident	81.2	Confident	57 Å²	57	70.7 Å²	70.7	22%	0.215	33%	0.332	C	S	.	.	H	α-helix	trans	-67.8	-34.4	176.2	-71.9	-68.4	122.4	65.3	7.6	112.7	I89 I97 M102 L103 F104 E109 K110	I89-R106 HydrophobicContact CD1-CB 3.98Å; I97-R106 HydrophobicContact CD1-CB 4.36Å; I97-R106 HydrophobicContact CD1-CG 4.03Å; I97-R106 HydrophobicContact CG1-CG 4.31Å; M102-R106 VanDerWaalsContact O-CG 3.27Å; M102-R106 WeakPolarHBondContact O-CG 3.45Å; M102-R106 PolarHBondContact O-N 2.88Å; M102-R106 VanDerWaalsContact O-N 3.13Å; L103-R106 PolarHBondContact O-N 3.3Å; L103-R106 VanDerWaalsContact O-N 3.15Å; F104-R106 VanDerWaalsContact C-N 3.32Å; F104-R106 PolarHBondContact O-N 2.9Å; R106-E109 WeakPolarHBondContact CD-OE2 3.49Å; R106-E109 IonicContact CZ-OE1 3.81Å; R106-E109 IonicContact CZ-OE2 2.94Å; R106-E109 IonicContact NE-OE1 2.84Å; R106-E109 PolarHBondContact NE-OE1 3.41Å; R106-E109 IonicContact NE-OE2 3.67Å; R106-E109 PolarHBondContact NE-OE2 2.54Å; R106-E109 IonicContact NH2-OE1 3.07Å; R106-E109 PolarHBondContact NH2-OE1 2.86Å; R106-K110 WeakPolarHBondContact O-CG 3.4Å; R106-K110 PolarHBondContact O-N 2.92Å
107	L	83.7	Confident	81.3	Confident	0 Å²	0	70 Å²	70	0%	0	33%	0.325	C	S	.	.	H	α-helix	trans	-69.3	-36.1	173.9	-69.5	171.5	0	0	0	111.9	I89 L103 F104 Q105 K110 R111 M112 L113 F120 L124	I89-L107 HydrophobicContact CD1-CD2 3.59Å; I89-L107 HydrophobicContact CD1-CG 3.96Å; I89-L107 HydrophobicContact CG1-CD2 4.22Å; L103-L107 HydrophobicContact CG-CD1 4.28Å; L103-L107 WeakPolarHBondContact O-CG 3.25Å; L103-L107 PolarHBondContact O-N 3.05Å; F104-L107 HydrophobicContact CD1-CD1 4.39Å; F104-L107 PolarHBondContact O-N 2.83Å; F104-L107 VanDerWaalsContact O-N 3.16Å; Q105-L107 VanDerWaalsContact C-N 3.35Å; L107-K110 PolarHBondContact O-N 3.13Å; L107-R111 PolarHBondContact O-N 3.43Å; L107-M112 HydrophobicContact CD2-CB 4.42Å; L107-M112 PolarHBondContact O-N 2.73Å; L107-L113 HydrophobicContact CB-CB 3.84Å; L107-L113 HydrophobicContact CB-CD2 4.36Å; L107-L113 PolarHBondContact O-N 3.4Å; L107-F120 HydrophobicContact CD1-CD1 4.26Å; L107-F120 HydrophobicContact CD1-CE1 4.16Å; L107-F120 HydrophobicContact CD2-CD1 3.92Å; L107-F120 HydrophobicContact CD2-CE1 3.49Å; L107-F120 VanDerWaalsContact CD2-CE1 3.49Å; L107-F120 HydrophobicContact CG-CE1 4.49Å; L107-L124 HydrophobicContact CD1-CD1 4.14Å
108	Q	80.8	Confident	81.4	Confident	62 Å²	62	71.2 Å²	71.2	29%	0.29	33%	0.331	S	S	.	.	H	α-helix	trans	-64.2	-46.6	171.7	-72.1	174.8	-40.8	0	0	111.8	F104 Q105 K110 R111 L113	F104-Q108 WeakPolarHBondContact O-CG 3.47Å; F104-Q108 PolarHBondContact O-N 3.47Å; Q105-Q108 WeakPolarHBondContact O-CB 3.46Å; Q105-Q108 PolarHBondContact O-N 3.14Å; Q108-K110 PolarHBondContact O-N 2.75Å; Q108-K110 VanDerWaalsContact O-N 3.13Å; Q108-R111 PolarHBondContact O-N 2.98Å; Q108-L113 WeakPolarHBondContact CA-O 3.43Å; Q108-L113 HydrophobicContact CG-CB 4.23Å; Q108-L113 HydrophobicContact CG-CD2 4.3Å; Q108-L113 HydrophobicContact CG-CG 4.27Å; Q108-L113 WeakPolarHBondContact CG-O 3.27Å
109	E	82.3	Confident	81.6	Confident	117 Å²	117	64.8 Å²	64.8	55%	0.547	31%	0.309	S	S	.	.	H	α-helix	trans	-56.9	-29.5	175.4	-74.1	171.5	-160.7	0	0	112.5	Q105 R106	Q105-E109 WeakPolarHBondContact O-CG 3.1Å; Q105-E109 PolarHBondContact O-N 2.85Å; R106-E109 WeakPolarHBondContact CD-OE2 3.49Å; R106-E109 IonicContact CZ-OE1 3.81Å; R106-E109 IonicContact CZ-OE2 2.94Å; R106-E109 IonicContact NE-OE1 2.84Å; R106-E109 PolarHBondContact NE-OE1 3.41Å; R106-E109 IonicContact NE-OE2 3.67Å; R106-E109 PolarHBondContact NE-OE2 2.54Å; R106-E109 IonicContact NH2-OE1 3.07Å; R106-E109 PolarHBondContact NH2-OE1 2.86Å
110	K	79.6	Confident	81.6	Confident	105 Å²	105	61.4 Å²	61.4	46%	0.457	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.4	0.6	177.3	-73.8	-64.6	-165.1	166.7	0	114.5	R106 L107 Q108 M112	R106-K110 WeakPolarHBondContact O-CG 3.4Å; R106-K110 PolarHBondContact O-N 2.92Å; L107-K110 PolarHBondContact O-N 3.13Å; Q108-K110 PolarHBondContact O-N 2.75Å; Q108-K110 VanDerWaalsContact O-N 3.13Å; K110-M112 HydrophobicContact CB-CG 4.17Å; K110-M112 PolarHBondContact O-N 2.93Å
111	R	79	Confident	81.6	Confident	187 Å²	187	61.2 Å²	61.2	71%	0.706	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.1	26.7	-174.8	-56.7	-173.2	-178.6	178.3	-2.8	113.8	L107 Q108 E114	L107-R111 PolarHBondContact O-N 3.43Å; Q108-R111 PolarHBondContact O-N 2.98Å; R111-E114 WeakPolarHBondContact CB-OE1 3.18Å; R111-E114 WeakPolarHBondContact CG-OE1 3.38Å
112	M	76.1	Confident	81.7	Confident	56 Å²	56	60.2 Å²	60.2	28%	0.276	28%	0.282	S	S	.	.	S	Bend	trans	-95.1	-13.4	174.8	-62.9	-85	58.2	0	0	112.4	L107 K110 F120	L107-M112 HydrophobicContact CD2-CB 4.42Å; L107-M112 PolarHBondContact O-N 2.73Å; K110-M112 HydrophobicContact CB-CG 4.17Å; K110-M112 PolarHBondContact O-N 2.93Å; M112-F120 HydrophobicContact CB-CD1 4.36Å; M112-F120 WeakPolarHBondContact O-CB 3.38Å
113	L	81.2	Confident	81.8	Confident	3 Å²	3	57.9 Å²	57.9	2%	0.016	27%	0.271	C	S	.	.	S	Bend	trans	-132.7	110.9	173.9	-176.3	60.7	0	0	0	108.4	F62 L66 F104 L107 Q108 L118 L121	F62-L113 HydrophobicContact CE2-CD1 4.41Å; F62-L113 HydrophobicContact CE2-CG 4.45Å; F62-L113 HydrophobicContact CZ-CG 4.23Å; L66-L113 HydrophobicContact CD1-CD2 3.9Å; L66-L113 HydrophobicContact CD1-CG 4.48Å; L66-L113 HydrophobicContact CD2-CD1 4.49Å; L66-L113 HydrophobicContact CD2-CD2 3.82Å; F104-L113 HydrophobicContact CB-CD2 3.93Å; F104-L113 HydrophobicContact CD1-CD2 4.31Å; F104-L113 HydrophobicContact CG-CD2 4.31Å; L107-L113 HydrophobicContact CB-CB 3.84Å; L107-L113 HydrophobicContact CB-CD2 4.36Å; L107-L113 PolarHBondContact O-N 3.4Å; Q108-L113 WeakPolarHBondContact CA-O 3.43Å; Q108-L113 HydrophobicContact CG-CB 4.23Å; Q108-L113 HydrophobicContact CG-CD2 4.3Å; Q108-L113 HydrophobicContact CG-CG 4.27Å; Q108-L113 WeakPolarHBondContact CG-O 3.27Å; L113-L118 HydrophobicContact CD1-CD2 3.79Å; L113-L121 HydrophobicContact CD1-CB 3.73Å; L113-L121 HydrophobicContact CD1-CD2 3.91Å; L113-L121 HydrophobicContact CD1-CG 4.46Å; L113-L121 HydrophobicContact CD2-CD2 4.47Å
114	E	80.1	Confident	81.9	Confident	84 Å²	84	57.9 Å²	57.9	39%	0.393	27%	0.271	S	S	.	.	B	Isolated β-bridge	trans	-135.8	161.3	176.4	-62.6	-178.6	163.9	0	0	108.4	R111 N116 N117	R111-E114 WeakPolarHBondContact CB-OE1 3.18Å; R111-E114 WeakPolarHBondContact CG-OE1 3.38Å; E114-N116 PolarHBondContact O-N 3Å; E114-N116 VanDerWaalsContact O-N 3.16Å; E114-N117 HydrophobicContact CB-CB 4.29Å; E114-N117 PolarHBondContact N-O 2.74Å; E114-N117 VanDerWaalsContact N-O 3.13Å; E114-N117 CarbonylContact O-C 3.31Å; E114-N117 PolarHBondContact O-N 3.28Å; E114-N117 VanDerWaalsContact O-O 3.1Å
115	E	74.2	Confident	81.9	Confident	126 Å²	126	57.8 Å²	57.8	59%	0.589	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54	-37.3	179.3	-176.7	170.3	-163.8	0	0	112.4	F62	F62-E115 HydrophobicContact CB-CB 4.33Å; F62-E115 HydrophobicContact CB-CG 3.99Å; F62-E115 HydrophobicContact CD1-CB 4.16Å; F62-E115 HydrophobicContact CD2-CB 4.22Å; F62-E115 HydrophobicContact CE1-CB 4.47Å; F62-E115 HydrophobicContact CG-CB 4Å; F62-E115 HydrophobicContact CG-CG 4.21Å
116	N	74.2	Confident	82	Confident	159 Å²	159	54.8 Å²	54.8	85%	0.85	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.9	-2	178.1	-60.6	-33.7	0	0	0	113.7	E114	E114-N116 PolarHBondContact O-N 3Å; E114-N116 VanDerWaalsContact O-N 3.16Å
117	N	79.9	Confident	82.2	Confident	49 Å²	49	55.2 Å²	55.2	26%	0.262	26%	0.257	S	S	.	.	B	Isolated β-bridge	trans	-139.8	86.8	-178	-174.1	14.6	0	0	0	111.6	E114 S119	E114-N117 HydrophobicContact CB-CB 4.29Å; E114-N117 PolarHBondContact N-O 2.74Å; E114-N117 VanDerWaalsContact N-O 3.13Å; E114-N117 CarbonylContact O-C 3.31Å; E114-N117 PolarHBondContact O-N 3.28Å; E114-N117 VanDerWaalsContact O-O 3.1Å; N117-S119 PolarHBondContact OD1-N 3.2Å; N117-S119 PolarHBondContact OD1-OG 3.4Å
118	L	82.2	Confident	82.3	Confident	28 Å²	28	55.9 Å²	55.9	15%	0.147	26%	0.261	C	S	.	.			trans	-98.2	2.3	177.6	-63.2	170.4	0	0	0	112.9	F62 L113 F120 L121 K122 L138	F62-L118 HydrophobicContact CD2-CD2 3.98Å; F62-L118 HydrophobicContact CE2-CD2 3.59Å; L113-L118 HydrophobicContact CD1-CD2 3.79Å; L118-F120 VanDerWaalsContact C-N 3.31Å; L118-F120 PolarHBondContact O-N 3.38Å; L118-L121 PolarHBondContact O-N 2.77Å; L118-K122 HydrophobicContact CB-CG 4.42Å; L118-K122 VanDerWaalsContact O-CG 3.3Å; L118-K122 WeakPolarHBondContact O-CG 3.47Å; L118-K122 PolarHBondContact O-N 3.47Å; L118-L138 HydrophobicContact CD1-CD2 4.16Å
119	S	83.9	Confident	82.5	Confident	43 Å²	43	58.3 Å²	58.3	30%	0.301	28%	0.276	S	S	.	.	H	α-helix	trans	-58.6	-39.7	-170	58.8	0	0	0	0	113.2	N117 E123 Q156	N117-S119 PolarHBondContact OD1-N 3.2Å; N117-S119 PolarHBondContact OD1-OG 3.4Å; S119-E123 PolarHBondContact O-N 3Å; S119-Q156 PolarHBondContact OG-NE2 2.83Å
120	F	85.6	Confident	82.6	Confident	0 Å²	0	54.3 Å²	54.3	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-69.1	-43.6	178.7	-171.8	-111.4	0	0	0	112.4	C88 L107 M112 L118 K122 E123 L124 Q156 I157	C88-F120 HydrophobicContact CB-CZ 4.34Å; L107-F120 HydrophobicContact CD1-CD1 4.26Å; L107-F120 HydrophobicContact CD1-CE1 4.16Å; L107-F120 HydrophobicContact CD2-CD1 3.92Å; L107-F120 HydrophobicContact CD2-CE1 3.49Å; L107-F120 VanDerWaalsContact CD2-CE1 3.49Å; L107-F120 HydrophobicContact CG-CE1 4.49Å; M112-F120 HydrophobicContact CB-CD1 4.36Å; M112-F120 WeakPolarHBondContact O-CB 3.38Å; L118-F120 VanDerWaalsContact C-N 3.31Å; L118-F120 PolarHBondContact O-N 3.38Å; F120-K122 VanDerWaalsContact C-N 3.35Å; F120-E123 PolarHBondContact O-N 3.36Å; F120-L124 HydrophobicContact CD1-CD1 3.79Å; F120-L124 HydrophobicContact CD1-CG 4.37Å; F120-L124 HydrophobicContact CE1-CD1 3.48Å; F120-L124 VanDerWaalsContact CE1-CD1 3.48Å; F120-L124 HydrophobicContact CE1-CG 4.06Å; F120-L124 HydrophobicContact CZ-CD1 4.15Å; F120-L124 HydrophobicContact CZ-CD2 4.45Å; F120-L124 HydrophobicContact CZ-CG 4.28Å; F120-L124 WeakPolarHBondContact O-CG 3.37Å; F120-L124 PolarHBondContact O-N 3.03Å; F120-Q156 HydrophobicContact CD2-CB 3.66Å; F120-Q156 HydrophobicContact CE2-CB 4.19Å; F120-I157 HydrophobicContact CD2-CG1 4.45Å; F120-I157 HydrophobicContact CE2-CG1 3.8Å; F120-I157 HydrophobicContact CZ-CG1 4.47Å
121	L	85.9	Confident	82.8	Confident	1 Å²	1	51.3 Å²	51.3	1%	0.005	24%	0.244	C	C	.	.	H	α-helix	trans	-65.7	-39.6	176.7	178.1	63.2	0	0	0	111.5	L66 I69 F104 L113 L118 E123 L124 L125 L138	L66-L121 HydrophobicContact CD2-CD2 3.42Å; L66-L121 VanDerWaalsContact CD2-CD2 3.42Å; I69-L121 HydrophobicContact CD1-CD2 4.25Å; F104-L121 HydrophobicContact CD1-CD1 4.22Å; F104-L121 HydrophobicContact CE1-CD1 3.56Å; F104-L121 HydrophobicContact CZ-CD1 4.04Å; L113-L121 HydrophobicContact CD1-CB 3.73Å; L113-L121 HydrophobicContact CD1-CD2 3.91Å; L113-L121 HydrophobicContact CD1-CG 4.46Å; L113-L121 HydrophobicContact CD2-CD2 4.47Å; L118-L121 PolarHBondContact O-N 2.77Å; L121-E123 VanDerWaalsContact C-N 3.34Å; L121-L124 PolarHBondContact O-N 2.63Å; L121-L125 HydrophobicContact CD1-CD1 4.31Å; L121-L125 HydrophobicContact CD1-CG 4.2Å; L121-L125 HydrophobicContact CG-CD1 4.26Å; L121-L125 WeakPolarHBondContact O-CG 3.43Å; L121-L125 PolarHBondContact O-N 3.3Å; L121-L138 HydrophobicContact CD2-CD1 4.26Å; L121-L138 HydrophobicContact CG-CD1 4.19Å
122	K	85.4	Confident	83	Confident	38 Å²	38	45.7 Å²	45.7	17%	0.165	23%	0.228	C	C	.	.	H	α-helix	trans	-60.5	-44.2	173.6	-70.5	178.5	-176.9	-160.8	0	111.3	L118 F120 F126 L134 L138 T140 M145	L118-K122 HydrophobicContact CB-CG 4.42Å; L118-K122 VanDerWaalsContact O-CG 3.3Å; L118-K122 WeakPolarHBondContact O-CG 3.47Å; L118-K122 PolarHBondContact O-N 3.47Å; F120-K122 VanDerWaalsContact C-N 3.35Å; K122-F126 VanDerWaalsContact O-CB 3.26Å; K122-F126 WeakPolarHBondContact O-CB 3.1Å; K122-F126 PolarHBondContact O-N 3.19Å; K122-L134 HydrophobicContact CB-CD2 4.14Å; K122-L134 HydrophobicContact CG-CD2 4.32Å; K122-L134 WeakPolarHBondContact O-CD2 3.3Å; K122-L138 HydrophobicContact CG-CB 4.32Å; K122-L138 HydrophobicContact CG-CD1 3.67Å; K122-T140 HydrophobicContact CD-CG2 4.28Å; K122-T140 WeakPolarHBondContact CD-OG1 3.48Å; K122-T140 WeakPolarHBondContact CE-OG1 3.25Å; K122-T140 PolarHBondContact NZ-OG1 3.41Å; K122-M145 HydrophobicContact CB-CE 4.09Å; K122-M145 HydrophobicContact CB-SD 3.74Å; K122-M145 HydrophobicContact CD-SD 4.34Å
123	E	87.3	Confident	83.5	Confident	2 Å²	2	43 Å²	43	1%	0.009	22%	0.215	C	C	.	.	H	α-helix	trans	-64.1	-45.4	175.9	-169.7	176.1	-175.7	0	0	111.7	S119 F120 L121 L125 F126 R127 M145 L149 A155 Q156 I157	S119-E123 PolarHBondContact O-N 3Å; F120-E123 PolarHBondContact O-N 3.36Å; L121-E123 VanDerWaalsContact C-N 3.34Å; E123-L125 PolarHBondContact O-N 3.39Å; E123-F126 WeakPolarHBondContact O-CB 3.3Å; E123-F126 PolarHBondContact O-N 3.11Å; E123-R127 HydrophobicContact CG-CG 4.23Å; E123-R127 VanDerWaalsContact O-CG 3.31Å; E123-R127 WeakPolarHBondContact O-CG 3.48Å; E123-R127 PolarHBondContact O-N 3.42Å; E123-R127 IonicContact OE1-CZ 3.74Å; E123-R127 IonicContact OE1-NE 2.76Å; E123-R127 PolarHBondContact OE1-NE 3.02Å; E123-R127 IonicContact OE1-NH2 3.13Å; E123-R127 PolarHBondContact OE1-NH2 3.16Å; E123-R127 VanDerWaalsContact OE1-NH2 3.07Å; E123-M145 HydrophobicContact CB-CE 4.34Å; E123-L149 HydrophobicContact CB-CD2 4.43Å; E123-L149 HydrophobicContact CG-CD1 4.25Å; E123-L149 HydrophobicContact CG-CD2 3.81Å; E123-A155 WeakPolarHBondContact OE2-CA 3.33Å; E123-Q156 PolarHBondContact OE2-N 2.86Å; E123-I157 HydrophobicContact CB-CD1 4.31Å; E123-I157 HydrophobicContact CG-CD1 3.83Å; E123-I157 HydrophobicContact CG-CG1 4.17Å; E123-I157 PolarHBondContact OE2-N 2.93Å
124	L	87	Confident	83.6	Confident	0 Å²	0	43 Å²	43	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-55	-52.4	177.5	-82.3	174.8	0	0	0	112.4	L81 L84 L107 F120 L121 F126 R127 I128 I157	L81-L124 HydrophobicContact CD2-CB 3.68Å; L81-L124 HydrophobicContact CD2-CD1 4.36Å; L81-L124 HydrophobicContact CD2-CD2 3.95Å; L81-L124 HydrophobicContact CD2-CG 4.21Å; L84-L124 HydrophobicContact CB-CD2 3.69Å; L84-L124 HydrophobicContact CD1-CD2 4.34Å; L107-L124 HydrophobicContact CD1-CD1 4.14Å; F120-L124 HydrophobicContact CD1-CD1 3.79Å; F120-L124 HydrophobicContact CD1-CG 4.37Å; F120-L124 HydrophobicContact CE1-CD1 3.48Å; F120-L124 VanDerWaalsContact CE1-CD1 3.48Å; F120-L124 HydrophobicContact CE1-CG 4.06Å; F120-L124 HydrophobicContact CZ-CD1 4.15Å; F120-L124 HydrophobicContact CZ-CD2 4.45Å; F120-L124 HydrophobicContact CZ-CG 4.28Å; F120-L124 WeakPolarHBondContact O-CG 3.37Å; F120-L124 PolarHBondContact O-N 3.03Å; L121-L124 PolarHBondContact O-N 2.63Å; L124-F126 VanDerWaalsContact C-N 3.29Å; L124-F126 PolarHBondContact O-N 3.31Å; L124-R127 PolarHBondContact O-N 2.75Å; L124-I128 WeakPolarHBondContact O-CG1 3.47Å; L124-I128 PolarHBondContact O-N 3.32Å; L124-I128 VanDerWaalsContact O-N 3.11Å; L124-I157 HydrophobicContact CD2-CD1 3.65Å; L124-I157 HydrophobicContact CG-CD1 4.03Å
125	L	86.5	Confident	83.7	Confident	0 Å²	0	42.4 Å²	42.4	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-63.8	-34.4	178.6	-68.3	178.6	0	0	0	112.3	I69 L73 L121 E123 I128 N129 R130 L133 L134 L138	I69-L125 HydrophobicContact CD1-CD1 4.36Å; I69-L125 HydrophobicContact CG2-CD1 4.18Å; I69-L125 HydrophobicContact CG2-CD2 4.27Å; L73-L125 HydrophobicContact CD2-CD2 4.3Å; L121-L125 HydrophobicContact CD1-CD1 4.31Å; L121-L125 HydrophobicContact CD1-CG 4.2Å; L121-L125 HydrophobicContact CG-CD1 4.26Å; L121-L125 WeakPolarHBondContact O-CG 3.43Å; L121-L125 PolarHBondContact O-N 3.3Å; E123-L125 PolarHBondContact O-N 3.39Å; L125-I128 HydrophobicContact CD2-CD1 4.04Å; L125-I128 WeakPolarHBondContact O-CG1 3.44Å; L125-N129 PolarHBondContact O-N 3.19Å; L125-R130 HydrophobicContact CD2-CB 4.48Å; L125-R130 PolarHBondContact O-N 3.23Å; L125-L133 HydrophobicContact CD1-CB 4.11Å; L125-L133 HydrophobicContact CD2-CD1 4.08Å; L125-L134 HydrophobicContact CB-CD2 3.63Å; L125-L134 HydrophobicContact CB-CG 3.85Å; L125-L134 HydrophobicContact CD1-CD2 4.1Å; L125-L134 HydrophobicContact CG-CD2 4.5Å; L125-L138 HydrophobicContact CD1-CD1 3.81Å
126	F	86.4	Confident	84	Confident	33 Å²	33	40.8 Å²	40.8	15%	0.145	22%	0.216	C	C	.	.	H	α-helix	trans	-65.5	-43.4	174.1	-179.1	-95.8	0	0	0	111.8	K122 E123 L124 N129 L131 L134 K142 M145 E146 L149	K122-F126 VanDerWaalsContact O-CB 3.26Å; K122-F126 WeakPolarHBondContact O-CB 3.1Å; K122-F126 PolarHBondContact O-N 3.19Å; E123-F126 WeakPolarHBondContact O-CB 3.3Å; E123-F126 PolarHBondContact O-N 3.11Å; L124-F126 VanDerWaalsContact C-N 3.29Å; L124-F126 PolarHBondContact O-N 3.31Å; F126-N129 PolarHBondContact O-N 2.95Å; F126-N129 VanDerWaalsContact O-N 3.08Å; F126-L131 HydrophobicContact CD2-CD2 3.87Å; F126-L131 HydrophobicContact CE2-CD2 4.32Å; F126-L134 HydrophobicContact CB-CD1 3.84Å; F126-L134 HydrophobicContact CD2-CD1 4.2Å; F126-K142 HydrophobicContact CE2-CG 3.96Å; F126-M145 HydrophobicContact CB-CE 4.24Å; F126-M145 HydrophobicContact CD2-CB 3.65Å; F126-M145 HydrophobicContact CD2-CG 4.15Å; F126-M145 HydrophobicContact CE2-CB 3.89Å; F126-M145 HydrophobicContact CG-CB 4.18Å; F126-E146 HydrophobicContact CE2-CG 4.05Å; F126-E146 HydrophobicContact CZ-CG 3.7Å; F126-L149 HydrophobicContact CD1-CD1 3.57Å; F126-L149 HydrophobicContact CE1-CD1 3.73Å; F126-L149 HydrophobicContact CG-CD1 4.32Å
127	R	84.9	Confident	84.3	Confident	66 Å²	66	35.1 Å²	35.1	25%	0.249	18%	0.183	C	C	.	.	H	α-helix	trans	-68.2	-36.4	-179	-66.2	-55.6	-180	178.3	0.1	113.1	L84 E123 L124 N129 I157 V162 Y165	L84-R127 HydrophobicContact CD1-CB 3.75Å; E123-R127 HydrophobicContact CG-CG 4.23Å; E123-R127 VanDerWaalsContact O-CG 3.31Å; E123-R127 WeakPolarHBondContact O-CG 3.48Å; E123-R127 PolarHBondContact O-N 3.42Å; E123-R127 IonicContact OE1-CZ 3.74Å; E123-R127 IonicContact OE1-NE 2.76Å; E123-R127 PolarHBondContact OE1-NE 3.02Å; E123-R127 IonicContact OE1-NH2 3.13Å; E123-R127 PolarHBondContact OE1-NH2 3.16Å; E123-R127 VanDerWaalsContact OE1-NH2 3.07Å; L124-R127 PolarHBondContact O-N 2.75Å; R127-N129 PolarHBondContact O-N 2.76Å; R127-I157 HydrophobicContact CG-CD1 4.04Å; R127-V162 HydrophobicContact CG-CG2 4.41Å; R127-Y165 WeakPolarHBondContact O-CE1 3.34Å
128	I	86.5	Confident	84.3	Confident	14 Å²	14	33.2 Å²	33.2	7%	0.072	17%	0.173	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.7	6	172.6	68	165.9	0	0	0	113	L73 E77 L81 L84 L124 L125 R130	L73-I128 HydrophobicContact CD2-CD1 3.73Å; E77-I128 HydrophobicContact CB-CD1 4.47Å; L81-I128 HydrophobicContact CD1-CD1 4.4Å; L81-I128 HydrophobicContact CD2-CD1 4Å; L81-I128 HydrophobicContact CD2-CG1 4.46Å; L81-I128 HydrophobicContact CD2-CG2 3.95Å; L81-I128 HydrophobicContact CG-CD1 4.19Å; L81-I128 HydrophobicContact CG-CG2 4.37Å; L84-I128 HydrophobicContact CD1-CG2 3.93Å; L124-I128 WeakPolarHBondContact O-CG1 3.47Å; L124-I128 PolarHBondContact O-N 3.32Å; L124-I128 VanDerWaalsContact O-N 3.11Å; L125-I128 HydrophobicContact CD2-CD1 4.04Å; L125-I128 WeakPolarHBondContact O-CG1 3.44Å; I128-R130 VanDerWaalsContact C-N 3.27Å; I128-R130 HydrophobicContact CD1-CB 4.04Å; I128-R130 HydrophobicContact CD1-CG 3.68Å; I128-R130 HydrophobicContact CG1-CB 4.04Å; I128-R130 HydrophobicContact CG1-CG 3.93Å; I128-R130 PolarHBondContact O-N 3.28Å
129	N	84.6	Confident	84.2	Confident	113 Å²	113	37.4 Å²	37.4	60%	0.604	20%	0.196	S	C	*	.	T	Hydrogen-bonded Turn	trans	60.7	26.8	178.8	-164.9	42.9	0	0	0	115.1	L125 F126 R127 L131	L125-N129 PolarHBondContact O-N 3.19Å; F126-N129 PolarHBondContact O-N 2.95Å; F126-N129 VanDerWaalsContact O-N 3.08Å; R127-N129 PolarHBondContact O-N 2.76Å; N129-L131 VanDerWaalsContact C-N 3.28Å; N129-L131 PolarHBondContact O-N 3.05Å; N129-L131 VanDerWaalsContact O-N 3.13Å
130	R	84.4	Confident	84	Confident	34 Å²	34	35.4 Å²	35.4	13%	0.128	18%	0.182	C	C	.	.			trans	-88.8	62.9	173.7	-71.9	-61.5	-61.1	-80.8	2.7	112.2	Q72 E77 L125 I128 D132 L133 L134	Q72-R130 PolarHBondContact O-NH1 3.48Å; Q72-R130 PolarHBondContact O-NH2 3.36Å; E77-R130 VanDerWaalsContact CD-NH1 3.25Å; E77-R130 WeakPolarHBondContact OE1-CD 3.32Å; E77-R130 WeakPolarHBondContact OE1-CG 3.17Å; E77-R130 IonicContact OE1-CZ 3.42Å; E77-R130 IonicContact OE1-NE 3.13Å; E77-R130 IonicContact OE1-NH1 2.82Å; E77-R130 PolarHBondContact OE1-NH1 3.19Å; E77-R130 IonicContact OE2-NH1 2.98Å; E77-R130 PolarHBondContact OE2-NH1 3.44Å; L125-R130 HydrophobicContact CD2-CB 4.48Å; L125-R130 PolarHBondContact O-N 3.23Å; I128-R130 VanDerWaalsContact C-N 3.27Å; I128-R130 HydrophobicContact CD1-CB 4.04Å; I128-R130 HydrophobicContact CD1-CG 3.68Å; I128-R130 HydrophobicContact CG1-CB 4.04Å; I128-R130 HydrophobicContact CG1-CG 3.93Å; I128-R130 PolarHBondContact O-N 3.28Å; R130-D132 VanDerWaalsContact CA-OD1 3.29Å; R130-D132 WeakPolarHBondContact CA-OD1 3.32Å; R130-D132 IonicContact CZ-OD1 2.79Å; R130-D132 IonicContact CZ-OD2 3.19Å; R130-D132 IonicContact NE-OD1 3.45Å; R130-D132 PolarHBondContact NE-OD1 3.01Å; R130-D132 IonicContact NE-OD2 2.75Å; R130-D132 PolarHBondContact NE-OD2 3.44Å; R130-D132 VanDerWaalsContact NE-OD2 3.13Å; R130-D132 IonicContact NH2-OD1 3.8Å; R130-D132 IonicContact NH2-OD2 3.31Å; R130-D132 PolarHBondContact NH2-OD2 2.92Å; R130-D132 PolarHBondContact O-N 3.23Å; R130-L133 HydrophobicContact CB-CB 4.48Å; R130-L133 HydrophobicContact CB-CD1 4.1Å; R130-L133 HydrophobicContact CB-CG 4.26Å; R130-L133 HydrophobicContact CG-CD1 4.48Å; R130-L133 PolarHBondContact O-N 3.07Å; R130-L134 PolarHBondContact O-N 2.95Å
131	L	84.3	Confident	83.8	Confident	41 Å²	41	43.8 Å²	43.8	22%	0.215	21%	0.213	C	C	.	.	H	α-helix	trans	-67.4	-24.3	-178.3	-55	-179.4	0	0	0	113.1	F126 N129 L134 T135 K142	F126-L131 HydrophobicContact CD2-CD2 3.87Å; F126-L131 HydrophobicContact CE2-CD2 4.32Å; N129-L131 VanDerWaalsContact C-N 3.28Å; N129-L131 PolarHBondContact O-N 3.05Å; N129-L131 VanDerWaalsContact O-N 3.13Å; L131-L134 HydrophobicContact CD2-CD1 3.88Å; L131-T135 WeakPolarHBondContact O-CB 3.42Å; L131-T135 PolarHBondContact O-N 3.02Å; L131-T135 PolarHBondContact O-OG1 3.19Å; L131-K142 HydrophobicContact CD1-CB 4.33Å; L131-K142 HydrophobicContact CD1-CD 3.75Å; L131-K142 HydrophobicContact CD1-CG 4.1Å; L131-K142 HydrophobicContact CD2-CB 4.46Å; L131-K142 HydrophobicContact CD2-CG 4.32Å
132	D	82.5	Confident	83.5	Confident	69 Å²	69	48.5 Å²	48.5	37%	0.369	23%	0.234	S	C	.	.	H	α-helix	trans	-59.3	-47.3	171.1	59.5	-44.1	0	0	0	111.1	R130 T135 T136	R130-D132 VanDerWaalsContact CA-OD1 3.29Å; R130-D132 WeakPolarHBondContact CA-OD1 3.32Å; R130-D132 IonicContact CZ-OD1 2.79Å; R130-D132 IonicContact CZ-OD2 3.19Å; R130-D132 IonicContact NE-OD1 3.45Å; R130-D132 PolarHBondContact NE-OD1 3.01Å; R130-D132 IonicContact NE-OD2 2.75Å; R130-D132 PolarHBondContact NE-OD2 3.44Å; R130-D132 VanDerWaalsContact NE-OD2 3.13Å; R130-D132 IonicContact NH2-OD1 3.8Å; R130-D132 IonicContact NH2-OD2 3.31Å; R130-D132 PolarHBondContact NH2-OD2 2.92Å; R130-D132 PolarHBondContact O-N 3.23Å; D132-T135 PolarHBondContact O-N 3.14Å; D132-T136 WeakPolarHBondContact O-CB 3.49Å; D132-T136 PolarHBondContact O-N 2.89Å; D132-T136 PolarHBondContact O-OG1 3.5Å
133	L	85.9	Confident	83.3	Confident	1 Å²	1	52.4 Å²	52.4	1%	0.005	25%	0.252	C	S	.	.	H	α-helix	trans	-70	-39.1	179.5	-60.7	-176.7	0	0	0	111.9	I69 Q72 L73 L125 R130 T135 Y137	I69-L133 HydrophobicContact CG2-CD1 4.27Å; Q72-L133 HydrophobicContact CB-CD1 4.33Å; Q72-L133 HydrophobicContact CB-CD2 3.75Å; Q72-L133 HydrophobicContact CG-CD2 4.2Å; Q72-L133 VanDerWaalsContact OE1-CD2 3.25Å; L73-L133 HydrophobicContact CD2-CD1 4.08Å; L73-L133 HydrophobicContact CG-CD1 4.3Å; L125-L133 HydrophobicContact CD1-CB 4.11Å; L125-L133 HydrophobicContact CD2-CD1 4.08Å; R130-L133 HydrophobicContact CB-CB 4.48Å; R130-L133 HydrophobicContact CB-CD1 4.1Å; R130-L133 HydrophobicContact CB-CG 4.26Å; R130-L133 HydrophobicContact CG-CD1 4.48Å; R130-L133 PolarHBondContact O-N 3.07Å; L133-T135 PolarHBondContact O-N 3.18Å; L133-Y137 HydrophobicContact CB-CD2 4.49Å; L133-Y137 HydrophobicContact CD2-CD2 3.95Å; L133-Y137 HydrophobicContact CD2-CE2 3.79Å; L133-Y137 PolarHBondContact O-N 3.39Å
134	L	83.1	Confident	83	Confident	1 Å²	1	55.6 Å²	55.6	1%	0.005	27%	0.267	C	S	.	.	H	α-helix	trans	-58.6	-46.6	175.1	-73.7	179.8	0	0	0	112.5	K122 L125 F126 R130 L131 L138 N139 T140 M145	K122-L134 HydrophobicContact CB-CD2 4.14Å; K122-L134 HydrophobicContact CG-CD2 4.32Å; K122-L134 WeakPolarHBondContact O-CD2 3.3Å; L125-L134 HydrophobicContact CB-CD2 3.63Å; L125-L134 HydrophobicContact CB-CG 3.85Å; L125-L134 HydrophobicContact CD1-CD2 4.1Å; L125-L134 HydrophobicContact CG-CD2 4.5Å; F126-L134 HydrophobicContact CB-CD1 3.84Å; F126-L134 HydrophobicContact CD2-CD1 4.2Å; R130-L134 PolarHBondContact O-N 2.95Å; L131-L134 HydrophobicContact CD2-CD1 3.88Å; L134-L138 HydrophobicContact CD2-CD1 4.02Å; L134-L138 CarbonylContact O-C 3.54Å; L134-L138 VanDerWaalsContact O-C 3.31Å; L134-L138 WeakPolarHBondContact O-CA 3.4Å; L134-L138 WeakPolarHBondContact O-CB 3.11Å; L134-L138 PolarHBondContact O-N 3.46Å; L134-N139 PolarHBondContact O-N 3.44Å; L134-N139 VanDerWaalsContact O-N 3.14Å; L134-T140 CarbonylContact C-O 3.56Å; L134-T140 PolarHBondContact O-N 2.92Å; L134-T140 VanDerWaalsContact O-N 3.12Å; L134-M145 HydrophobicContact CD1-CG 4.42Å
135	T	82.4	Confident	82.9	Confident	73 Å²	73	55.7 Å²	55.7	45%	0.448	27%	0.268	S	S	.	.	H	α-helix	trans	-74	-40.2	-176.4	-51.8	0	0	0	0	110.7	L131 D132 L133	L131-T135 WeakPolarHBondContact O-CB 3.42Å; L131-T135 PolarHBondContact O-N 3.02Å; L131-T135 PolarHBondContact O-OG1 3.19Å; D132-T135 PolarHBondContact O-N 3.14Å; L133-T135 PolarHBondContact O-N 3.18Å
136	T	80.9	Confident	82.6	Confident	92 Å²	92	59.2 Å²	59.2	56%	0.564	28%	0.284	S	S	*	.	H	α-helix	trans	-76.9	-43.8	-173.2	-54.4	0	0	0	0	112.8	D132	D132-T136 WeakPolarHBondContact O-CB 3.49Å; D132-T136 PolarHBondContact O-N 2.89Å; D132-T136 PolarHBondContact O-OG1 3.5Å
137	Y	81.1	Confident	82.1	Confident	40 Å²	40	65 Å²	65	16%	0.157	31%	0.305	C	S	.	.	H	α-helix	trans	-108.5	-24.6	-170.9	-64.4	-73.7	0	0	0	114	M60 D68 I69 Q72 L133	M60-Y137 WeakPolarHBondContact CE-O 3.49Å; D68-Y137 HydrophobicContact CB-CD1 4.01Å; D68-Y137 HydrophobicContact CB-CE1 3.31Å; D68-Y137 HydrophobicContact CB-CE2 4.49Å; I69-Y137 HydrophobicContact CD1-CG 4.41Å; I69-Y137 HydrophobicContact CG1-CD2 3.81Å; I69-Y137 HydrophobicContact CG1-CG 3.83Å; Q72-Y137 PolarHBondContact NE2-OH 3.17Å; L133-Y137 HydrophobicContact CB-CD2 4.49Å; L133-Y137 HydrophobicContact CD2-CD2 3.95Å; L133-Y137 HydrophobicContact CD2-CE2 3.79Å; L133-Y137 PolarHBondContact O-N 3.39Å
138	L	80	Confident	81.8	Confident	9 Å²	9	65.1 Å²	65.1	5%	0.047	31%	0.309	C	S	.	.	S	Bend	trans	-114	5.5	-176.2	-53.2	-177.5	0	0	0	113	I69 L118 L121 K122 L125 L134 T140	I69-L138 HydrophobicContact CD1-CD1 4.42Å; I69-L138 HydrophobicContact CD1-CD2 3.91Å; I69-L138 HydrophobicContact CD1-CG 4.12Å; L118-L138 HydrophobicContact CD1-CD2 4.16Å; L121-L138 HydrophobicContact CD2-CD1 4.26Å; L121-L138 HydrophobicContact CG-CD1 4.19Å; K122-L138 HydrophobicContact CG-CB 4.32Å; K122-L138 HydrophobicContact CG-CD1 3.67Å; L125-L138 HydrophobicContact CD1-CD1 3.81Å; L134-L138 HydrophobicContact CD2-CD1 4.02Å; L134-L138 CarbonylContact O-C 3.54Å; L134-L138 VanDerWaalsContact O-C 3.31Å; L134-L138 WeakPolarHBondContact O-CA 3.4Å; L134-L138 WeakPolarHBondContact O-CB 3.11Å; L134-L138 PolarHBondContact O-N 3.46Å; L138-T140 PolarHBondContact O-N 3.4Å; L138-T140 PolarHBondContact O-OG1 3.14Å
139	N	78.9	Confident	81.5	Confident	116 Å²	116	65.7 Å²	65.7	62%	0.62	31%	0.312	S	S	*	.			trans	48	29.8	179.5	-72	-44	0	0	0	114.2	L134	L134-N139 PolarHBondContact O-N 3.44Å; L134-N139 VanDerWaalsContact O-N 3.14Å
140	T	79.9	Confident	80.9	Confident	1 Å²	1	67.8 Å²	67.8	1%	0.006	32%	0.318	C	S	.	.			trans	-112.9	127.1	-173.9	-51.2	0	0	0	0	109.8	K122 L134 L138 E144 M145	K122-T140 HydrophobicContact CD-CG2 4.28Å; K122-T140 WeakPolarHBondContact CD-OG1 3.48Å; K122-T140 WeakPolarHBondContact CE-OG1 3.25Å; K122-T140 PolarHBondContact NZ-OG1 3.41Å; L134-T140 CarbonylContact C-O 3.56Å; L134-T140 PolarHBondContact O-N 2.92Å; L134-T140 VanDerWaalsContact O-N 3.12Å; L138-T140 PolarHBondContact O-N 3.4Å; L138-T140 PolarHBondContact O-OG1 3.14Å; T140-E144 HydrophobicContact CG2-CB 4.35Å; T140-E144 HydrophobicContact CG2-CG 4.38Å; T140-M145 HydrophobicContact CG2-CG 3.65Å; T140-M145 HydrophobicContact CG2-SD 3.84Å
141	R	80.9	Confident	80.3	Confident	175 Å²	175	68 Å²	68	66%	0.66	33%	0.327	S	S	*	.			trans	-86	153.6	178.6	-64.5	-176.6	-178.1	-179.8	1.6	111.2	E143 E144 M145	R141-E143 VanDerWaalsContact C-N 3.3Å; R141-E143 PolarHBondContact O-N 2.73Å; R141-E144 WeakPolarHBondContact O-CB 3.25Å; R141-E144 PolarHBondContact O-N 2.87Å; R141-M145 PolarHBondContact O-N 2.69Å; R141-M145 VanDerWaalsContact O-N 3.16Å
142	K	80.9	Confident	79.2	Confident	100 Å²	100	71.8 Å²	71.8	44%	0.435	35%	0.354	S	S	.	.	H	α-helix	trans	-50.5	-48.4	175.3	-175.3	-173.4	172.9	165.7	0	112.5	F126 L131 E144 M145 E146	F126-K142 HydrophobicContact CE2-CG 3.96Å; L131-K142 HydrophobicContact CD1-CB 4.33Å; L131-K142 HydrophobicContact CD1-CD 3.75Å; L131-K142 HydrophobicContact CD1-CG 4.1Å; L131-K142 HydrophobicContact CD2-CB 4.46Å; L131-K142 HydrophobicContact CD2-CG 4.32Å; K142-E144 VanDerWaalsContact C-N 3.25Å; K142-E144 PolarHBondContact O-N 3.4Å; K142-M145 PolarHBondContact O-N 2.92Å; K142-E146 WeakPolarHBondContact CE-OE1 3.45Å; K142-E146 IonicContact NZ-OE1 3.16Å; K142-E146 WeakPolarHBondContact O-CG 3.44Å; K142-E146 PolarHBondContact O-N 3.11Å
143	E	80.5	Confident	78.3	Confident	120 Å²	120	72 Å²	72	56%	0.561	37%	0.373	S	S	*	.	H	α-helix	trans	-62.7	-31.5	-178.9	-62.1	167.5	-171.9	0	0	112.9	R141 R147	R141-E143 VanDerWaalsContact C-N 3.3Å; R141-E143 PolarHBondContact O-N 2.73Å; E143-R147 WeakPolarHBondContact O-CG 3.13Å; E143-R147 PolarHBondContact O-N 2.96Å; E143-R147 VanDerWaalsContact O-N 3.16Å
144	E	81.8	Confident	77.8	Confident	69 Å²	69	80 Å²	80	32%	0.322	40%	0.403	S	S	.	.	H	α-helix	trans	-71.5	-46.3	177.4	-173	179.7	178.6	0	0	110.4	T140 R141 K142 E146 R147 E148	T140-E144 HydrophobicContact CG2-CB 4.35Å; T140-E144 HydrophobicContact CG2-CG 4.38Å; R141-E144 WeakPolarHBondContact O-CB 3.25Å; R141-E144 PolarHBondContact O-N 2.87Å; K142-E144 VanDerWaalsContact C-N 3.25Å; K142-E144 PolarHBondContact O-N 3.4Å; E144-E146 PolarHBondContact O-N 2.86Å; E144-R147 PolarHBondContact O-N 2.59Å; E144-E148 WeakPolarHBondContact O-CG 3.35Å; E144-E148 PolarHBondContact O-N 3.23Å
145	M	83.9	Confident	77.6	Confident	3 Å²	3	81.3 Å²	81.3	2%	0.015	41%	0.414	C	S	.	.	H	α-helix	trans	-60.4	-42.4	173.6	-76.3	-56.9	-57.4	0	0	112.6	K122 E123 F126 L134 T140 R141 K142 R147 E148 L149	K122-M145 HydrophobicContact CB-CE 4.09Å; K122-M145 HydrophobicContact CB-SD 3.74Å; K122-M145 HydrophobicContact CD-SD 4.34Å; E123-M145 HydrophobicContact CB-CE 4.34Å; F126-M145 HydrophobicContact CB-CE 4.24Å; F126-M145 HydrophobicContact CD2-CB 3.65Å; F126-M145 HydrophobicContact CD2-CG 4.15Å; F126-M145 HydrophobicContact CE2-CB 3.89Å; F126-M145 HydrophobicContact CG-CB 4.18Å; L134-M145 HydrophobicContact CD1-CG 4.42Å; T140-M145 HydrophobicContact CG2-CG 3.65Å; T140-M145 HydrophobicContact CG2-SD 3.84Å; R141-M145 PolarHBondContact O-N 2.69Å; R141-M145 VanDerWaalsContact O-N 3.16Å; K142-M145 PolarHBondContact O-N 2.92Å; M145-R147 VanDerWaalsContact C-N 3.32Å; M145-R147 PolarHBondContact O-N 2.64Å; M145-E148 PolarHBondContact O-N 2.98Å; M145-L149 HydrophobicContact CE-CD1 3.91Å; M145-L149 HydrophobicContact CE-CD2 4.34Å; M145-L149 HydrophobicContact CE-CG 4.05Å; M145-L149 WeakPolarHBondContact O-CB 3.41Å; M145-L149 VanDerWaalsContact O-CG 3.26Å; M145-L149 WeakPolarHBondContact O-CG 3.45Å; M145-L149 PolarHBondContact O-N 3.5Å
146	E	79.6	Confident	77.5	Confident	74 Å²	74	81 Å²	81	35%	0.346	41%	0.407	S	S	.	.	H	α-helix	trans	-60.8	-42.1	177.1	-75.2	175.9	169.8	0	0	111.6	F126 K142 E144 Q150	F126-E146 HydrophobicContact CE2-CG 4.05Å; F126-E146 HydrophobicContact CZ-CG 3.7Å; K142-E146 WeakPolarHBondContact CE-OE1 3.45Å; K142-E146 IonicContact NZ-OE1 3.16Å; K142-E146 WeakPolarHBondContact O-CG 3.44Å; K142-E146 PolarHBondContact O-N 3.11Å; E144-E146 PolarHBondContact O-N 2.86Å; E146-Q150 WeakPolarHBondContact O-CB 3.37Å; E146-Q150 WeakPolarHBondContact O-CG 3.48Å; E146-Q150 PolarHBondContact O-N 2.95Å; E146-Q150 VanDerWaalsContact O-N 3.07Å
147	R	77.8	Confident	77.6	Confident	153 Å²	153	77 Å²	77	58%	0.577	38%	0.382	S	S	*	.	H	α-helix	trans	-65.4	-42.7	174.3	-73.9	-172	-59.9	-109.3	1.2	112.4	E143 E144 M145 Q150	E143-R147 WeakPolarHBondContact O-CG 3.13Å; E143-R147 PolarHBondContact O-N 2.96Å; E143-R147 VanDerWaalsContact O-N 3.16Å; E144-R147 PolarHBondContact O-N 2.59Å; M145-R147 VanDerWaalsContact C-N 3.32Å; M145-R147 PolarHBondContact O-N 2.64Å; R147-Q150 PolarHBondContact O-N 3.24Å
148	E	78.3	Confident	77.8	Confident	69 Å²	69	76.6 Å²	76.6	32%	0.322	39%	0.385	S	S	.	.	H	α-helix	trans	-65.3	-42.4	179.4	-74.1	-169.8	162.6	0	0	111.9	E144 M145 A151 R154	E144-E148 WeakPolarHBondContact O-CG 3.35Å; E144-E148 PolarHBondContact O-N 3.23Å; M145-E148 PolarHBondContact O-N 2.98Å; E148-A151 WeakPolarHBondContact O-CB 3.23Å; E148-A151 PolarHBondContact O-N 2.88Å; E148-R154 WeakPolarHBondContact O-CB 3.21Å
149	L	79.5	Confident	78	Confident	26 Å²	26	77.6 Å²	77.6	14%	0.136	40%	0.395	C	S	.	.	H	α-helix	trans	-76.7	-20.6	-178.9	-65.1	174.9	0	0	0	113.4	E123 F126 M145 A151 A155	E123-L149 HydrophobicContact CB-CD2 4.43Å; E123-L149 HydrophobicContact CG-CD1 4.25Å; E123-L149 HydrophobicContact CG-CD2 3.81Å; F126-L149 HydrophobicContact CD1-CD1 3.57Å; F126-L149 HydrophobicContact CE1-CD1 3.73Å; F126-L149 HydrophobicContact CG-CD1 4.32Å; M145-L149 HydrophobicContact CE-CD1 3.91Å; M145-L149 HydrophobicContact CE-CD2 4.34Å; M145-L149 HydrophobicContact CE-CG 4.05Å; M145-L149 WeakPolarHBondContact O-CB 3.41Å; M145-L149 VanDerWaalsContact O-CG 3.26Å; M145-L149 WeakPolarHBondContact O-CG 3.45Å; M145-L149 PolarHBondContact O-N 3.5Å; L149-A151 VanDerWaalsContact C-N 3.27Å; L149-A155 HydrophobicContact CD2-CB 3.93Å
150	Q	72.1	Confident	78.3	Confident	157 Å²	157	72.7 Å²	72.7	73%	0.734	37%	0.368	S	S	*	.	H	α-helix	trans	-70	-24.1	169.8	-80	174	9.2	0	0	112.5	E146 R147	E146-Q150 WeakPolarHBondContact O-CB 3.37Å; E146-Q150 WeakPolarHBondContact O-CG 3.48Å; E146-Q150 PolarHBondContact O-N 2.95Å; E146-Q150 VanDerWaalsContact O-N 3.07Å; R147-Q150 PolarHBondContact O-N 3.24Å
151	A	71.3	Confident	78.7	Confident	39 Å²	39	73.5 Å²	73.5	32%	0.322	37%	0.371	S	S	.	.	S	Bend	trans	-74	129.6	178.1	0	0	0	0	0	111.3	E148 L149 G153 R154	E148-A151 WeakPolarHBondContact O-CB 3.23Å; E148-A151 PolarHBondContact O-N 2.88Å; L149-A151 VanDerWaalsContact C-N 3.27Å; A151-G153 PolarHBondContact O-N 2.75Å; A151-R154 HydrophobicContact CB-CB 4.38Å; A151-R154 HydrophobicContact CB-CG 3.78Å; A151-R154 PolarHBondContact O-N 2.87Å
152	P	61.4	Low	79	Confident	120 Å²	120	65.7 Å²	65.7	78%	0.779	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.8	131.8	-179	22.3	-30.3	0	0	0	111.3
153	G	64.3	Low	79.4	Confident	74 Å²	74	61 Å²	61	76%	0.763	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	83.3	2.1	178.6	0	0	0	0	0	116	A151	A151-G153 PolarHBondContact O-N 2.75Å
154	R	74.5	Confident	79.7	Confident	168 Å²	168	55.3 Å²	55.3	63%	0.634	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90	-29.9	176	-69.3	-62.1	-170.6	128.8	-0.6	114.3	E148 A151 Q156	E148-R154 WeakPolarHBondContact O-CB 3.21Å; A151-R154 HydrophobicContact CB-CB 4.38Å; A151-R154 HydrophobicContact CB-CG 3.78Å; A151-R154 PolarHBondContact O-N 2.87Å; R154-Q156 PolarHBondContact O-N 2.92Å
155	A	78.6	Confident	80.1	Confident	29 Å²	29	52.8 Å²	52.8	24%	0.24	28%	0.283	C	S	.	.			trans	-70.1	125.1	171.6	0	0	0	0	0	110.1	E123 L149	E123-A155 WeakPolarHBondContact OE2-CA 3.33Å; L149-A155 HydrophobicContact CD2-CB 3.93Å
156	Q	80.3	Confident	80.2	Confident	67 Å²	67	57 Å²	57	31%	0.313	30%	0.303	S	S	.	.			trans	-96.8	-26.6	179.6	-75.5	169.3	90.6	0	0	112.2	S119 F120 E123 R154	S119-Q156 PolarHBondContact OG-NE2 2.83Å; F120-Q156 HydrophobicContact CD2-CB 3.66Å; F120-Q156 HydrophobicContact CE2-CB 4.19Å; E123-Q156 PolarHBondContact OE2-N 2.86Å; R154-Q156 PolarHBondContact O-N 2.92Å
157	I	84.9	Confident	80.5	Confident	8 Å²	8	53.5 Å²	53.5	4%	0.041	29%	0.287	C	S	.	.	S	Bend	trans	-80.7	134.3	173.5	-55.3	175.4	0	0	0	108.8	L84 F120 E123 L124 R127 R161 V162	L84-I157 HydrophobicContact CB-CD1 4.37Å; L84-I157 HydrophobicContact CD2-CG2 4.26Å; F120-I157 HydrophobicContact CD2-CG1 4.45Å; F120-I157 HydrophobicContact CE2-CG1 3.8Å; F120-I157 HydrophobicContact CZ-CG1 4.47Å; E123-I157 HydrophobicContact CB-CD1 4.31Å; E123-I157 HydrophobicContact CG-CD1 3.83Å; E123-I157 HydrophobicContact CG-CG1 4.17Å; E123-I157 PolarHBondContact OE2-N 2.93Å; L124-I157 HydrophobicContact CD2-CD1 3.65Å; L124-I157 HydrophobicContact CG-CD1 4.03Å; R127-I157 HydrophobicContact CG-CD1 4.04Å; I157-R161 HydrophobicContact CG2-CB 4.1Å; I157-V162 HydrophobicContact CB-CG2 4.48Å; I157-V162 HydrophobicContact CG2-CG2 3.92Å
158	S	84.9	Confident	81	Confident	31 Å²	31	47.1 Å²	47.1	22%	0.217	27%	0.265	C	S	.	.			trans	-63.9	139.5	-180	68.9	0	0	0	0	111.2	D87 Y160 R161 V162	D87-S158 VanDerWaalsContact OD2-CB 3.31Å; D87-S158 WeakPolarHBondContact OD2-CB 3.35Å; D87-S158 PolarHBondContact OD2-OG 3.48Å; S158-Y160 PolarHBondContact O-N 3.06Å; S158-Y160 VanDerWaalsContact O-N 3.14Å; S158-R161 PolarHBondContact O-N 2.83Å; S158-R161 VanDerWaalsContact O-N 3.09Å; S158-R161 WeakPolarHBondContact OG-CB 3.36Å; S158-R161 WeakPolarHBondContact OG-CG 3.42Å; S158-R161 PolarHBondContact OG-N 2.89Å; S158-V162 PolarHBondContact O-N 2.94Å; S158-V162 VanDerWaalsContact O-N 3.15Å
159	A	83.4	Confident	81.4	Confident	31 Å²	31	50 Å²	50	26%	0.256	28%	0.279	S	S	.	.	H	α-helix	trans	-59.2	-28.4	178	0	0	0	0	0	111.8	M163 Y237 F240	A159-M163 WeakPolarHBondContact O-CB 3.42Å; A159-M163 PolarHBondContact O-N 2.83Å; A159-Y237 HydrophobicContact CB-CD2 4.17Å; A159-Y237 HydrophobicContact CB-CE2 3.89Å; A159-F240 HydrophobicContact CB-CD1 4.44Å; A159-F240 HydrophobicContact CB-CE1 4.35Å
160	Y	85.6	Confident	81.6	Confident	12 Å²	12	53.3 Å²	53.3	5%	0.047	29%	0.294	C	S	.	.	H	α-helix	trans	-63.5	-49.1	173.4	170.9	-107.9	0	0	0	112.9	S158 V162 M163 L164 E206 L211 G212 E213 L216	S158-Y160 PolarHBondContact O-N 3.06Å; S158-Y160 VanDerWaalsContact O-N 3.14Å; Y160-V162 VanDerWaalsContact C-N 3.29Å; Y160-V162 PolarHBondContact O-N 2.75Å; Y160-M163 HydrophobicContact CD2-CE 3.5Å; Y160-M163 VanDerWaalsContact CD2-CE 3.5Å; Y160-M163 HydrophobicContact CE2-CE 3.92Å; Y160-M163 HydrophobicContact CG-CE 4.49Å; Y160-M163 PolarHBondContact O-N 2.95Å; Y160-L164 HydrophobicContact CD1-CD1 4.45Å; Y160-L164 HydrophobicContact CE1-CD1 3.77Å; Y160-L164 HydrophobicContact CE2-CD1 3.98Å; Y160-L164 HydrophobicContact CE2-CD2 4.44Å; Y160-L164 HydrophobicContact CE2-CG 4.16Å; Y160-L164 VanDerWaalsContact CZ-CD1 3.5Å; Y160-L164 PolarHBondContact O-N 3.05Å; Y160-E206 VanDerWaalsContact CE1-OE1 3.26Å; Y160-E206 WeakPolarHBondContact CE1-OE1 3.33Å; Y160-E206 PolarHBondContact OH-OE1 3.32Å; Y160-L211 WeakPolarHBondContact OH-CG 3.41Å; Y160-G212 VanDerWaalsContact CE2-C 3.43Å; Y160-G212 WeakPolarHBondContact CE2-O 3.34Å; Y160-G212 VanDerWaalsContact OH-CA 3.26Å; Y160-G212 WeakPolarHBondContact OH-CA 3.31Å; Y160-G212 PolarHBondContact OH-N 3.5Å; Y160-E213 HydrophobicContact CD2-CB 4.31Å; Y160-E213 HydrophobicContact CG-CB 4.25Å; Y160-E213 HydrophobicContact CG-CG 4.34Å; Y160-L216 HydrophobicContact CD2-CD2 4.47Å; Y160-L216 HydrophobicContact CE2-CD2 3.93Å
161	R	88.6	Confident	82.1	Confident	19 Å²	19	46.6 Å²	46.6	7%	0.072	26%	0.264	C	S	.	.	H	α-helix	trans	-61.7	-39.5	175.9	-71.1	-72	177.7	-159.4	-8	112	L84 D87 I157 S158 L164 Y165 E206	L84-R161 HydrophobicContact CD2-CB 4.47Å; D87-R161 IonicContact OD1-CZ 3.61Å; D87-R161 IonicContact OD1-NE 3.81Å; D87-R161 PolarHBondContact OD1-NE 3.24Å; D87-R161 IonicContact OD1-NH2 3.54Å; D87-R161 PolarHBondContact OD1-NH2 3.4Å; D87-R161 WeakPolarHBondContact OD2-CG 3.37Å; D87-R161 IonicContact OD2-NE 3.47Å; I157-R161 HydrophobicContact CG2-CB 4.1Å; S158-R161 PolarHBondContact O-N 2.83Å; S158-R161 VanDerWaalsContact O-N 3.09Å; S158-R161 WeakPolarHBondContact OG-CB 3.36Å; S158-R161 WeakPolarHBondContact OG-CG 3.42Å; S158-R161 PolarHBondContact OG-N 2.89Å; R161-L164 PolarHBondContact O-N 3.29Å; R161-Y165 WeakPolarHBondContact O-CB 3.42Å; R161-Y165 PolarHBondContact O-N 2.8Å; R161-E206 IonicContact CZ-OE1 3.07Å; R161-E206 VanDerWaalsContact CZ-OE1 3.22Å; R161-E206 IonicContact CZ-OE2 2.75Å; R161-E206 VanDerWaalsContact CZ-OE2 3.29Å; R161-E206 IonicContact NH1-OE1 3.81Å; R161-E206 PolarHBondContact NH1-OE1 2.94Å; R161-E206 IonicContact NH1-OE2 3.43Å; R161-E206 PolarHBondContact NH1-OE2 2.92Å; R161-E206 IonicContact NH2-OE1 2.77Å; R161-E206 PolarHBondContact NH2-OE1 2.79Å; R161-E206 IonicContact NH2-OE2 2.75Å; R161-E206 PolarHBondContact NH2-OE2 3.11Å
162	V	86.1	Confident	82.6	Confident	11 Å²	11	46.3 Å²	46.3	7%	0.067	26%	0.264	C	S	.	.	H	α-helix	trans	-61.5	-44.7	175.7	176.9	0	0	0	0	110.9	R127 I157 S158 Y160 Y165 Q166	R127-V162 HydrophobicContact CG-CG2 4.41Å; I157-V162 HydrophobicContact CB-CG2 4.48Å; I157-V162 HydrophobicContact CG2-CG2 3.92Å; S158-V162 PolarHBondContact O-N 2.94Å; S158-V162 VanDerWaalsContact O-N 3.15Å; Y160-V162 VanDerWaalsContact C-N 3.29Å; Y160-V162 PolarHBondContact O-N 2.75Å; V162-Y165 PolarHBondContact O-N 3.33Å; V162-Q166 HydrophobicContact CG1-CG 4.45Å; V162-Q166 VanDerWaalsContact O-CG 3.31Å; V162-Q166 WeakPolarHBondContact O-CG 3.4Å; V162-Q166 PolarHBondContact O-N 2.87Å
163	M	89.1	Confident	83.4	Confident	2 Å²	2	51.5 Å²	51.5	1%	0.01	27%	0.268	C	S	.	.	H	α-helix	trans	-62.6	-44.5	178	170.2	-91.4	-57.6	0	0	112.2	A159 Y160 Y165 Q166 I167 L216 L219 I233 I234 Y237	A159-M163 WeakPolarHBondContact O-CB 3.42Å; A159-M163 PolarHBondContact O-N 2.83Å; Y160-M163 HydrophobicContact CD2-CE 3.5Å; Y160-M163 VanDerWaalsContact CD2-CE 3.5Å; Y160-M163 HydrophobicContact CE2-CE 3.92Å; Y160-M163 HydrophobicContact CG-CE 4.49Å; Y160-M163 PolarHBondContact O-N 2.95Å; M163-Y165 VanDerWaalsContact C-N 3.34Å; M163-Y165 PolarHBondContact O-N 2.8Å; M163-Q166 PolarHBondContact O-N 3.37Å; M163-I167 HydrophobicContact CG-CD1 4.32Å; M163-I167 WeakPolarHBondContact O-CG1 3.32Å; M163-I167 PolarHBondContact O-N 2.87Å; M163-I167 HydrophobicContact SD-CD1 3.6Å; M163-I167 VanDerWaalsContact SD-CD1 3.6Å; M163-L216 HydrophobicContact CE-CD1 4.02Å; M163-L216 HydrophobicContact CE-CD2 3.87Å; M163-L219 HydrophobicContact SD-CD2 4.39Å; M163-I233 HydrophobicContact CG-CG2 4.08Å; M163-I234 HydrophobicContact SD-CG1 4.24Å; M163-Y237 HydrophobicContact CB-CD2 4.07Å; M163-Y237 HydrophobicContact CB-CG 4.09Å; M163-Y237 HydrophobicContact CE-CD1 3.89Å; M163-Y237 HydrophobicContact CE-CD2 4.5Å; M163-Y237 HydrophobicContact CE-CE1 4.14Å; M163-Y237 HydrophobicContact CE-CG 4.1Å; M163-Y237 HydrophobicContact CG-CG 4.03Å
164	L	88.5	Confident	83.9	Confident	0 Å²	0	52.4 Å²	52.4	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-62.9	-41.4	175.9	-68.2	-177	0	0	0	112.3	F83 Y160 R161 I167 S168 F202 L211 L219	F83-L164 HydrophobicContact CE1-CB 3.94Å; F83-L164 HydrophobicContact CZ-CB 3.69Å; F83-L164 HydrophobicContact CZ-CD1 3.87Å; F83-L164 HydrophobicContact CZ-CG 4.47Å; Y160-L164 HydrophobicContact CD1-CD1 4.45Å; Y160-L164 HydrophobicContact CE1-CD1 3.77Å; Y160-L164 HydrophobicContact CE2-CD1 3.98Å; Y160-L164 HydrophobicContact CE2-CD2 4.44Å; Y160-L164 HydrophobicContact CE2-CG 4.16Å; Y160-L164 VanDerWaalsContact CZ-CD1 3.5Å; Y160-L164 PolarHBondContact O-N 3.05Å; R161-L164 PolarHBondContact O-N 3.29Å; L164-I167 PolarHBondContact O-N 3.12Å; L164-S168 PolarHBondContact O-N 3.02Å; L164-F202 HydrophobicContact CB-CD2 3.96Å; L164-F202 HydrophobicContact CB-CE2 4.22Å; L164-F202 HydrophobicContact CD1-CB 4.32Å; L164-F202 HydrophobicContact CD2-CD1 4.45Å; L164-F202 HydrophobicContact CD2-CD2 4.23Å; L164-F202 HydrophobicContact CD2-CE2 4.33Å; L164-F202 HydrophobicContact CD2-CG 4.29Å; L164-F202 HydrophobicContact CD2-CZ 4.49Å; L164-F202 HydrophobicContact CG-CD2 4.49Å; L164-F202 VanDerWaalsContact O-CE2 3.3Å; L164-F202 WeakPolarHBondContact O-CE2 3.03Å; L164-L211 HydrophobicContact CD1-CD2 4.16Å; L164-L211 HydrophobicContact CD2-CD2 3.96Å; L164-L219 HydrophobicContact CD2-CD2 3.57Å
165	Y	88.8	Confident	84.3	Confident	16 Å²	16	46.3 Å²	46.3	6%	0.063	24%	0.241	C	C	.	.	H	α-helix	trans	-63.7	-41.2	176.1	-179.6	-104	0	0	0	112.3	S80 L84 R127 R161 V162 M163 I167 S168 E169 L199	S80-Y165 VanDerWaalsContact CB-CE2 3.46Å; S80-Y165 WeakPolarHBondContact OG-CE2 3.4Å; L84-Y165 HydrophobicContact CD2-CG 4.08Å; L84-Y165 HydrophobicContact CG-CG 4.48Å; R127-Y165 WeakPolarHBondContact O-CE1 3.34Å; R161-Y165 WeakPolarHBondContact O-CB 3.42Å; R161-Y165 PolarHBondContact O-N 2.8Å; V162-Y165 PolarHBondContact O-N 3.33Å; M163-Y165 VanDerWaalsContact C-N 3.34Å; M163-Y165 PolarHBondContact O-N 2.8Å; Y165-I167 VanDerWaalsContact C-N 3.3Å; Y165-I167 PolarHBondContact O-N 3.46Å; Y165-S168 WeakPolarHBondContact CA-OG 3.5Å; Y165-S168 PolarHBondContact O-N 2.9Å; Y165-S168 VanDerWaalsContact O-N 3.11Å; Y165-S168 PolarHBondContact O-OG 2.82Å; Y165-E169 HydrophobicContact CD1-CG 4.35Å; Y165-E169 HydrophobicContact CE1-CG 3.8Å; Y165-E169 HydrophobicContact CE2-CG 4.27Å; Y165-E169 PolarHBondContact O-N 3.03Å; Y165-L199 HydrophobicContact CD2-CD1 4.35Å; Y165-L199 HydrophobicContact CD2-CD2 4.35Å
166	Q	86.2	Confident	84.5	Confident	91 Å²	91	46.6 Å²	46.6	43%	0.425	24%	0.239	S	C	.	.	H	α-helix	trans	-61.4	-39.6	174.9	-74.8	174.2	-32.6	0	0	112	V162 M163 S168 E169 E170 I233	V162-Q166 HydrophobicContact CG1-CG 4.45Å; V162-Q166 VanDerWaalsContact O-CG 3.31Å; V162-Q166 WeakPolarHBondContact O-CG 3.4Å; V162-Q166 PolarHBondContact O-N 2.87Å; M163-Q166 PolarHBondContact O-N 3.37Å; Q166-S168 VanDerWaalsContact C-N 3.33Å; Q166-S168 PolarHBondContact O-N 2.93Å; Q166-E169 PolarHBondContact O-N 3.17Å; Q166-E170 PolarHBondContact O-N 3.42Å; Q166-E170 VanDerWaalsContact O-N 3.11Å; Q166-I233 HydrophobicContact CB-CD1 4.34Å; Q166-I233 HydrophobicContact CB-CG2 3.87Å
167	I	86.2	Confident	84.5	Confident	0 Å²	0	53.2 Å²	53.2	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-63.1	-40.5	174.1	-65.3	166.7	0	0	0	110.6	M163 L164 Y165 E169 E170 V171 F179 L198 F202 L219 L230 I233 I234	M163-I167 HydrophobicContact CG-CD1 4.32Å; M163-I167 WeakPolarHBondContact O-CG1 3.32Å; M163-I167 PolarHBondContact O-N 2.87Å; M163-I167 HydrophobicContact SD-CD1 3.6Å; M163-I167 VanDerWaalsContact SD-CD1 3.6Å; L164-I167 PolarHBondContact O-N 3.12Å; Y165-I167 VanDerWaalsContact C-N 3.3Å; Y165-I167 PolarHBondContact O-N 3.46Å; I167-E169 VanDerWaalsContact C-N 3.31Å; I167-E169 PolarHBondContact O-N 3.24Å; I167-E170 PolarHBondContact O-N 3.06Å; I167-V171 HydrophobicContact CG2-CG2 4.1Å; I167-V171 WeakPolarHBondContact O-CB 3.29Å; I167-V171 WeakPolarHBondContact O-CG2 3.34Å; I167-V171 PolarHBondContact O-N 2.69Å; I167-V171 VanDerWaalsContact O-N 3.1Å; I167-F179 HydrophobicContact CG2-CZ 4.5Å; I167-L198 HydrophobicContact CG2-CD2 4.13Å; I167-F202 HydrophobicContact CB-CE2 4.43Å; I167-F202 HydrophobicContact CB-CZ 4.25Å; I167-F202 HydrophobicContact CG2-CE2 4.37Å; I167-F202 HydrophobicContact CG2-CZ 3.77Å; I167-L219 HydrophobicContact CD1-CD2 3.87Å; I167-L230 HydrophobicContact CG2-CD2 4.34Å; I167-I233 HydrophobicContact CG1-CB 4.27Å; I167-I233 HydrophobicContact CG1-CD1 3.94Å; I167-I233 HydrophobicContact CG1-CG2 4.16Å; I167-I234 HydrophobicContact CD1-CD1 4.11Å; I167-I234 HydrophobicContact CD1-CG1 3.74Å
168	S	88.1	Confident	84.4	Confident	19 Å²	19	55.4 Å²	55.4	13%	0.133	28%	0.277	C	S	.	.	H	α-helix	trans	-66.2	-31.5	177.8	61.2	0	0	0	0	114.2	L164 Y165 Q166 L199	L164-S168 PolarHBondContact O-N 3.02Å; Y165-S168 WeakPolarHBondContact CA-OG 3.5Å; Y165-S168 PolarHBondContact O-N 2.9Å; Y165-S168 VanDerWaalsContact O-N 3.11Å; Y165-S168 PolarHBondContact O-OG 2.82Å; Q166-S168 VanDerWaalsContact C-N 3.33Å; Q166-S168 PolarHBondContact O-N 2.93Å; S168-L199 WeakPolarHBondContact OG-CD2 3.21Å
169	E	86.6	Confident	84.3	Confident	129 Å²	129	53.9 Å²	53.9	60%	0.603	27%	0.267	S	S	*	.	H	α-helix	trans	-73.9	-33.6	176.2	-71.2	-67.8	97.7	0	0	112.5	Y165 Q166 I167	Y165-E169 HydrophobicContact CD1-CG 4.35Å; Y165-E169 HydrophobicContact CE1-CG 3.8Å; Y165-E169 HydrophobicContact CE2-CG 4.27Å; Y165-E169 PolarHBondContact O-N 3.03Å; Q166-E169 PolarHBondContact O-N 3.17Å; I167-E169 VanDerWaalsContact C-N 3.31Å; I167-E169 PolarHBondContact O-N 3.24Å
170	E	83.5	Confident	84.3	Confident	97 Å²	97	53.8 Å²	53.8	45%	0.453	26%	0.26	S	S	.	.	H	α-helix	trans	-79.8	-19.3	177.8	-73.3	-163.6	-161.5	0	0	113.5	Q166 I167 L230 I233	Q166-E170 PolarHBondContact O-N 3.42Å; Q166-E170 VanDerWaalsContact O-N 3.11Å; I167-E170 PolarHBondContact O-N 3.06Å; E170-L230 HydrophobicContact CB-CD2 3.58Å; E170-I233 HydrophobicContact CB-CD1 4.36Å; E170-I233 HydrophobicContact CG-CD1 4.04Å; E170-I233 WeakPolarHBondContact OE1-CD1 3.33Å
171	V	83.9	Confident	84.1	Confident	16 Å²	16	60 Å²	60	10%	0.097	29%	0.288	C	S	.	.			trans	-87.5	112.7	-177.5	169.7	0	0	0	0	111.4	I167 E175 L176 F179 L198 L230	I167-V171 HydrophobicContact CG2-CG2 4.1Å; I167-V171 WeakPolarHBondContact O-CB 3.29Å; I167-V171 WeakPolarHBondContact O-CG2 3.34Å; I167-V171 PolarHBondContact O-N 2.69Å; I167-V171 VanDerWaalsContact O-N 3.1Å; V171-E175 WeakPolarHBondContact CA-OE2 3.22Å; V171-E175 HydrophobicContact CG1-CB 3.84Å; V171-L176 HydrophobicContact CG1-CB 4.28Å; V171-F179 HydrophobicContact CG1-CD2 4.01Å; V171-F179 HydrophobicContact CG1-CE2 4.13Å; V171-F179 HydrophobicContact CG2-CD2 4.32Å; V171-F179 HydrophobicContact CG2-CE2 3.6Å; V171-F179 HydrophobicContact CG2-CZ 4.15Å; V171-L198 HydrophobicContact CB-CD2 3.76Å; V171-L198 HydrophobicContact CG1-CD2 3.94Å; V171-L198 HydrophobicContact CG2-CD2 3.8Å; V171-L230 HydrophobicContact CG2-CD1 3.56Å; V171-L230 HydrophobicContact CG2-CD2 3.97Å; V171-L230 HydrophobicContact CG2-CG 4.42Å
172	G	80.9	Confident	83.8	Confident	32 Å²	32	61.2 Å²	61.2	33%	0.33	30%	0.295	S	S	.	.			trans	-77.6	173.2	175.6	0	0	0	0	0	114.1	S174 E175 L176	G172-S174 VanDerWaalsContact C-N 3.32Å; G172-S174 PolarHBondContact O-N 3.29Å; G172-E175 PolarHBondContact N-OE2 2.99Å; G172-E175 PolarHBondContact O-N 3.48Å; G172-E175 VanDerWaalsContact O-N 3.13Å; G172-L176 PolarHBondContact O-N 3.29Å
173	R	78.2	Confident	83.5	Confident	229 Å²	229	60.7 Å²	60.7	86%	0.864	29%	0.292	S	S	*	.	H	α-helix	trans	-58.2	-37.6	-179.4	-66.9	-176.5	178.8	-176.2	-1.2	114.2	R177	R173-R177 PolarHBondContact O-N 3.36Å
174	S	75.3	Confident	83	Confident	94 Å²	94	63.7 Å²	63.7	66%	0.657	31%	0.306	S	S	*	.	H	α-helix	trans	-69.7	-38	177.9	48.1	0	0	0	0	112.1	G172 R177 S178	G172-S174 VanDerWaalsContact C-N 3.32Å; G172-S174 PolarHBondContact O-N 3.29Å; S174-R177 PolarHBondContact O-N 2.77Å; S174-S178 PolarHBondContact O-N 3.49Å; S174-S178 PolarHBondContact O-OG 3.44Å
175	E	81.8	Confident	82	Confident	39 Å²	39	72.3 Å²	72.3	18%	0.182	35%	0.347	C	S	.	.	H	α-helix	trans	-72.2	-37.7	178.2	-70.3	172.1	146.6	0	0	110.8	V171 G172 R177 S178 F179 V226 N227	V171-E175 WeakPolarHBondContact CA-OE2 3.22Å; V171-E175 HydrophobicContact CG1-CB 3.84Å; G172-E175 PolarHBondContact N-OE2 2.99Å; G172-E175 PolarHBondContact O-N 3.48Å; G172-E175 VanDerWaalsContact O-N 3.13Å; E175-R177 VanDerWaalsContact C-N 3.25Å; E175-R177 PolarHBondContact O-N 2.99Å; E175-S178 CarbonylContact O-C 3.05Å; E175-S178 WeakPolarHBondContact O-CA 3.45Å; E175-S178 WeakPolarHBondContact O-CB 3.4Å; E175-S178 PolarHBondContact O-N 3.07Å; E175-F179 WeakPolarHBondContact O-CD2 3.23Å; E175-F179 PolarHBondContact O-N 3.14Å; E175-V226 HydrophobicContact CB-CG1 3.49Å; E175-V226 VanDerWaalsContact CB-CG1 3.49Å; E175-V226 HydrophobicContact CG-CG1 3.73Å; E175-N227 WeakPolarHBondContact OE1-CB 3.37Å; E175-N227 PolarHBondContact OE1-ND2 2.83Å
176	L	83.3	Confident	81.2	Confident	36 Å²	36	75.9 Å²	75.9	19%	0.188	36%	0.364	C	S	.	.	H	α-helix	trans	-56.3	-39	173.1	-179.3	61.3	0	0	0	112.2	V171 G172 S178 F179 K180 L198 I201	V171-L176 HydrophobicContact CG1-CB 4.28Å; G172-L176 PolarHBondContact O-N 3.29Å; L176-S178 VanDerWaalsContact C-N 3.34Å; L176-F179 WeakPolarHBondContact O-CB 3.24Å; L176-F179 PolarHBondContact O-N 3.41Å; L176-K180 WeakPolarHBondContact O-CG 3.47Å; L176-K180 PolarHBondContact O-N 3.31Å; L176-L198 HydrophobicContact CD1-CB 3.95Å; L176-L198 HydrophobicContact CD1-CD1 3.7Å; L176-L198 HydrophobicContact CD1-CG 4.42Å; L176-I201 HydrophobicContact CD1-CD1 3.75Å
177	R	81.4	Confident	80.6	Confident	205 Å²	205	71.6 Å²	71.6	77%	0.774	34%	0.344	S	S	*	.	H	α-helix	trans	-64.6	-40.9	175.3	-169.8	178	-176.5	178.8	2.2	111.6	R173 S174 E175 K180 F181	R173-R177 PolarHBondContact O-N 3.36Å; S174-R177 PolarHBondContact O-N 2.77Å; E175-R177 VanDerWaalsContact C-N 3.25Å; E175-R177 PolarHBondContact O-N 2.99Å; R177-K180 PolarHBondContact O-N 3.26Å; R177-F181 WeakPolarHBondContact O-CB 3.33Å; R177-F181 PolarHBondContact O-N 3.39Å
178	S	81.4	Confident	79.6	Confident	54 Å²	54	74.2 Å²	74.2	38%	0.378	36%	0.362	S	S	.	.	H	α-helix	trans	-64.7	-40.6	173.7	-57.6	0	0	0	0	111.4	S174 E175 L176 F181 L182	S174-S178 PolarHBondContact O-N 3.49Å; S174-S178 PolarHBondContact O-OG 3.44Å; E175-S178 CarbonylContact O-C 3.05Å; E175-S178 WeakPolarHBondContact O-CA 3.45Å; E175-S178 WeakPolarHBondContact O-CB 3.4Å; E175-S178 PolarHBondContact O-N 3.07Å; L176-S178 VanDerWaalsContact C-N 3.34Å; S178-F181 PolarHBondContact O-N 3.03Å; S178-L182 WeakPolarHBondContact O-CB 3.28Å; S178-L182 VanDerWaalsContact O-CG 3.28Å; S178-L182 WeakPolarHBondContact O-CG 3.36Å; S178-L182 PolarHBondContact O-N 3.1Å
179	F	83.8	Confident	78.2	Confident	0 Å²	0	80.1 Å²	80.1	0%	0	39%	0.386	C	S	.	.	H	α-helix	trans	-56.6	-51.1	172.3	-97.5	-91.5	0	0	0	111.7	I167 V171 E175 L176 F181 L182 L183 L198 L219 V222 V226 L230	I167-F179 HydrophobicContact CG2-CZ 4.5Å; V171-F179 HydrophobicContact CG1-CD2 4.01Å; V171-F179 HydrophobicContact CG1-CE2 4.13Å; V171-F179 HydrophobicContact CG2-CD2 4.32Å; V171-F179 HydrophobicContact CG2-CE2 3.6Å; V171-F179 HydrophobicContact CG2-CZ 4.15Å; E175-F179 WeakPolarHBondContact O-CD2 3.23Å; E175-F179 PolarHBondContact O-N 3.14Å; L176-F179 WeakPolarHBondContact O-CB 3.24Å; L176-F179 PolarHBondContact O-N 3.41Å; F179-F181 VanDerWaalsContact C-N 3.29Å; F179-F181 PolarHBondContact O-N 2.78Å; F179-L182 PolarHBondContact O-N 2.95Å; F179-L183 HydrophobicContact CD1-CD1 4.3Å; F179-L183 VanDerWaalsContact O-CB 3.3Å; F179-L183 WeakPolarHBondContact O-CB 3.31Å; F179-L183 WeakPolarHBondContact O-CG 3.42Å; F179-L183 PolarHBondContact O-N 2.85Å; F179-L198 HydrophobicContact CB-CD1 4.1Å; F179-L198 HydrophobicContact CD1-CD1 3.73Å; F179-L198 HydrophobicContact CD2-CD1 4.33Å; F179-L198 HydrophobicContact CE1-CD1 4.21Å; F179-L198 HydrophobicContact CG-CD1 3.81Å; F179-L219 HydrophobicContact CE1-CD1 4.13Å; F179-V222 HydrophobicContact CD1-CG1 3.35Å; F179-V222 HydrophobicContact CE1-CB 4.32Å; F179-V222 HydrophobicContact CE1-CG1 3.48Å; F179-V222 VanDerWaalsContact CE1-CG1 3.48Å; F179-V222 HydrophobicContact CG-CG1 3.92Å; F179-V222 HydrophobicContact CZ-CG1 4.13Å; F179-V226 HydrophobicContact CD2-CB 4.1Å; F179-V226 HydrophobicContact CD2-CG1 3.82Å; F179-V226 HydrophobicContact CD2-CG2 3.73Å; F179-V226 HydrophobicContact CE2-CB 3.85Å; F179-V226 HydrophobicContact CE2-CG1 3.73Å; F179-V226 HydrophobicContact CE2-CG2 3.89Å; F179-V226 HydrophobicContact CG-CG2 4.32Å; F179-L230 HydrophobicContact CE2-CD1 3.86Å; F179-L230 HydrophobicContact CZ-CD1 4.01Å
180	K	83.4	Confident	76.6	Confident	28 Å²	28	80.2 Å²	80.2	12%	0.122	40%	0.399	C	S	.	.	H	α-helix	trans	-59.8	-39.7	177.5	-71.3	-175.4	-176	-168.1	0	112	L176 R177 Q184 D193 D194 M196 I201	L176-K180 WeakPolarHBondContact O-CG 3.47Å; L176-K180 PolarHBondContact O-N 3.31Å; R177-K180 PolarHBondContact O-N 3.26Å; K180-Q184 PolarHBondContact O-N 3.4Å; K180-D193 PolarHBondContact NZ-O 3.48Å; K180-D194 VanDerWaalsContact NZ-C 3.32Å; K180-D194 PolarHBondContact NZ-O 3.27Å; K180-M196 WeakPolarHBondContact CE-O 3.47Å; K180-M196 PolarHBondContact NZ-O 2.98Å; K180-I201 HydrophobicContact CD-CD1 4.48Å; K180-I201 HydrophobicContact CG-CD1 3.7Å
181	F	81.9	Confident	75.7	Confident	144 Å²	144	80.8 Å²	80.8	63%	0.632	40%	0.4	S	S	*	.	H	α-helix	trans	-66.9	-47.9	178.6	-178.4	-97.3	0	0	0	112.2	R177 S178 F179 L183 Q184	R177-F181 WeakPolarHBondContact O-CB 3.33Å; R177-F181 PolarHBondContact O-N 3.39Å; S178-F181 PolarHBondContact O-N 3.03Å; F179-F181 VanDerWaalsContact C-N 3.29Å; F179-F181 PolarHBondContact O-N 2.78Å; F181-L183 VanDerWaalsContact C-N 3.34Å; F181-L183 PolarHBondContact O-N 3.43Å; F181-Q184 WeakPolarHBondContact O-CB 3.39Å; F181-Q184 PolarHBondContact O-N 3.03Å; F181-Q184 VanDerWaalsContact O-N 3.15Å
182	L	80.6	Confident	74.9	Confident	43 Å²	43	81.1 Å²	81.1	23%	0.225	40%	0.401	C	S	.	.	H	α-helix	trans	-69.2	-33.6	-178.7	-67.8	175.9	0	0	0	112.6	S178 F179 Q184 V222 Q225 V226	S178-L182 WeakPolarHBondContact O-CB 3.28Å; S178-L182 VanDerWaalsContact O-CG 3.28Å; S178-L182 WeakPolarHBondContact O-CG 3.36Å; S178-L182 PolarHBondContact O-N 3.1Å; F179-L182 PolarHBondContact O-N 2.95Å; L182-Q184 PolarHBondContact O-N 3.45Å; L182-V222 HydrophobicContact CB-CG1 4.2Å; L182-V222 HydrophobicContact CB-CG2 4.27Å; L182-V222 HydrophobicContact CD1-CG1 4.15Å; L182-Q225 HydrophobicContact CD1-CB 3.6Å; L182-V226 HydrophobicContact CD1-CG2 3.74Å
183	L	80.7	Confident	74.2	Confident	1 Å²	1	84.2 Å²	84.2	1%	0.005	41%	0.41	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.4	-4.1	174.9	-70.2	170.3	0	0	0	113	F179 F181 E185 E186 I187 L192 I201 M205 I218 V222	F179-L183 HydrophobicContact CD1-CD1 4.3Å; F179-L183 VanDerWaalsContact O-CB 3.3Å; F179-L183 WeakPolarHBondContact O-CB 3.31Å; F179-L183 WeakPolarHBondContact O-CG 3.42Å; F179-L183 PolarHBondContact O-N 2.85Å; F181-L183 VanDerWaalsContact C-N 3.34Å; F181-L183 PolarHBondContact O-N 3.43Å; L183-E185 PolarHBondContact O-N 3.48Å; L183-E186 PolarHBondContact O-N 3.36Å; L183-I187 HydrophobicContact CB-CD1 4.03Å; L183-I187 HydrophobicContact CB-CG1 4.36Å; L183-I187 HydrophobicContact CD1-CD1 4.33Å; L183-I187 HydrophobicContact CD2-CD1 4.41Å; L183-I187 WeakPolarHBondContact O-CA 3.37Å; L183-I187 VanDerWaalsContact O-CB 3.29Å; L183-I187 WeakPolarHBondContact O-CB 3.29Å; L183-I187 PolarHBondContact O-N 2.81Å; L183-L192 HydrophobicContact CB-CD1 4.47Å; L183-I201 HydrophobicContact CD1-CG2 3.44Å; L183-I201 VanDerWaalsContact CD1-CG2 3.44Å; L183-M205 HydrophobicContact CD1-CE 4.48Å; L183-M205 HydrophobicContact CD1-SD 3.76Å; L183-M205 HydrophobicContact CD2-CE 3.69Å; L183-M205 HydrophobicContact CD2-SD 4.02Å; L183-I218 HydrophobicContact CD2-CG2 4.14Å; L183-V222 HydrophobicContact CD2-CG2 3.83Å; L183-V222 HydrophobicContact CG-CG2 4.16Å
184	Q	77.5	Confident	73.6	Confident	64 Å²	64	80.2 Å²	80.2	30%	0.299	41%	0.406	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.1	-26.9	-179.6	-168.1	171.8	68	0	0	113	K180 F181 L182 I187 K189	K180-Q184 PolarHBondContact O-N 3.4Å; F181-Q184 WeakPolarHBondContact O-CB 3.39Å; F181-Q184 PolarHBondContact O-N 3.03Å; F181-Q184 VanDerWaalsContact O-N 3.15Å; L182-Q184 PolarHBondContact O-N 3.45Å; Q184-I187 CarbonylContact C-O 3.38Å; Q184-I187 VanDerWaalsContact O-O 3.07Å; Q184-K189 HydrophobicContact CG-CB 4.43Å; Q184-K189 HydrophobicContact CG-CD 3.97Å; Q184-K189 HydrophobicContact CG-CG 3.56Å; Q184-K189 VanDerWaalsContact OE1-CE 3.26Å
185	E	69.1	Low	73.3	Confident	182 Å²	182	82.8 Å²	82.8	85%	0.85	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.8	-33.4	176.3	-64.2	-174.4	167.5	0	0	111.6	L183	L183-E185 PolarHBondContact O-N 3.48Å
186	E	72.3	Confident	73.2	Confident	91 Å²	91	83 Å²	83	43%	0.425	41%	0.414	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.4	-28.4	-178.2	-59.2	-64	161.1	0	0	112.7	L183 I210 I218	L183-E186 PolarHBondContact O-N 3.36Å; E186-I210 HydrophobicContact CB-CD1 4.42Å; E186-I218 HydrophobicContact CG-CG2 4.29Å
187	I	73	Confident	73.2	Confident	0 Å²	0	84.2 Å²	84.2	0%	0	42%	0.42	C	S	.	.	S	Bend	trans	-121.8	112.6	-177.1	-52.1	179.5	0	0	0	108	L183 Q184 K189 L192 E204 M205 I210	L183-I187 HydrophobicContact CB-CD1 4.03Å; L183-I187 HydrophobicContact CB-CG1 4.36Å; L183-I187 HydrophobicContact CD1-CD1 4.33Å; L183-I187 HydrophobicContact CD2-CD1 4.41Å; L183-I187 WeakPolarHBondContact O-CA 3.37Å; L183-I187 VanDerWaalsContact O-CB 3.29Å; L183-I187 WeakPolarHBondContact O-CB 3.29Å; L183-I187 PolarHBondContact O-N 2.81Å; Q184-I187 CarbonylContact C-O 3.38Å; Q184-I187 VanDerWaalsContact O-O 3.07Å; I187-K189 PolarHBondContact O-N 3.22Å; I187-L192 HydrophobicContact CB-CD1 4.13Å; I187-L192 HydrophobicContact CB-CG 4.3Å; I187-L192 HydrophobicContact CD1-CD2 4.26Å; I187-L192 HydrophobicContact CG2-CD1 4.25Å; I187-L192 HydrophobicContact CG2-CD2 4.01Å; I187-L192 HydrophobicContact CG2-CG 3.86Å; I187-E204 HydrophobicContact CG2-CG 4.45Å; I187-M205 HydrophobicContact CD1-CG 3.69Å; I187-I210 HydrophobicContact CD1-CD1 4.14Å; I187-I210 HydrophobicContact CG1-CD1 3.87Å
188	S	65.2	Low	73.4	Confident	56 Å²	56	74.9 Å²	74.9	39%	0.392	39%	0.386	S	S	.	.			trans	-39.3	127.8	177.9	60.1	0	0	0	0	113.5	C190 K191 R208	S188-C190 PolarHBondContact O-N 3.38Å; S188-K191 PolarHBondContact O-N 2.95Å; S188-R208 PolarHBondContact OG-NH2 2.76Å
189	K	57.7	Low	73.7	Confident	143 Å²	143	72.9 Å²	72.9	62%	0.622	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-46.8	-33.5	-176.7	-54.1	-157	173.7	-157.7	0	115	Q184 I187 K191	Q184-K189 HydrophobicContact CG-CB 4.43Å; Q184-K189 HydrophobicContact CG-CD 3.97Å; Q184-K189 HydrophobicContact CG-CG 3.56Å; Q184-K189 VanDerWaalsContact OE1-CE 3.26Å; I187-K189 PolarHBondContact O-N 3.22Å; K189-K191 VanDerWaalsContact C-N 3.26Å; K189-K191 PolarHBondContact O-N 2.85Å
190	C	53.4	Low	73.7	Confident	130 Å²	130	75.8 Å²	75.8	88%	0.878	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74	-5.7	-175.4	-57.1	0	0	0	0	115.3	S188	S188-C190 PolarHBondContact O-N 3.38Å
191	K	64.5	Low	73.8	Confident	109 Å²	109	74.5 Å²	74.5	47%	0.474	38%	0.381	S	S	.	.	T	Hydrogen-bonded Turn	trans	-114.1	-16	-176.6	-69.7	-146.4	-158.3	171.9	0	115.5	S188 K189 D193 M196 E204	S188-K191 PolarHBondContact O-N 2.95Å; K189-K191 VanDerWaalsContact C-N 3.26Å; K189-K191 PolarHBondContact O-N 2.85Å; K191-D193 PolarHBondContact O-N 3.18Å; K191-D193 VanDerWaalsContact O-N 3.16Å; K191-M196 VanDerWaalsContact O-SD 3.36Å; K191-E204 WeakPolarHBondContact CD-OE1 3.47Å; K191-E204 IonicContact NZ-OE1 3.94Å; K191-E204 PolarHBondContact NZ-OE1 3.08Å; K191-E204 VanDerWaalsContact NZ-OE1 3.09Å
192	L	67.9	Low	74.1	Confident	24 Å²	24	67.6 Å²	67.6	13%	0.126	35%	0.351	C	S	.	.			trans	-83.9	88.3	174.1	-68.8	172.7	0	0	0	107.2	L183 I187 I201	L183-L192 HydrophobicContact CB-CD1 4.47Å; I187-L192 HydrophobicContact CB-CD1 4.13Å; I187-L192 HydrophobicContact CB-CG 4.3Å; I187-L192 HydrophobicContact CD1-CD2 4.26Å; I187-L192 HydrophobicContact CG2-CD1 4.25Å; I187-L192 HydrophobicContact CG2-CD2 4.01Å; I187-L192 HydrophobicContact CG2-CG 3.86Å; L192-I201 HydrophobicContact CD2-CG1 4.22Å
193	D	66.3	Low	74.3	Confident	96 Å²	96	66.5 Å²	66.5	51%	0.513	35%	0.345	S	S	.	.			trans	-69.6	151.2	176	-155.2	-19.3	0	0	0	110.3	K180 K191 D195 M196	K180-D193 PolarHBondContact NZ-O 3.48Å; K191-D193 PolarHBondContact O-N 3.18Å; K191-D193 VanDerWaalsContact O-N 3.16Å; D193-D195 PolarHBondContact O-N 2.77Å; D193-M196 HydrophobicContact CB-CG 4.13Å; D193-M196 PolarHBondContact O-N 2.83Å
194	D	65.5	Low	74.3	Confident	146 Å²	146	67.2 Å²	67.2	78%	0.781	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.3	-27.4	176.9	-81.1	-27.9	0	0	0	111.2	K180	K180-D194 VanDerWaalsContact NZ-C 3.32Å; K180-D194 PolarHBondContact NZ-O 3.27Å
195	D	68.8	Low	74.6	Confident	147 Å²	147	64.2 Å²	64.2	79%	0.786	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.2	-9.4	-179.8	-66.2	-25.7	0	0	0	114.5	D193 N197	D193-D195 PolarHBondContact O-N 2.77Å; D195-N197 PolarHBondContact O-N 3.12Å
196	M	79	Confident	75.4	Confident	44 Å²	44	57.5 Å²	57.5	22%	0.217	30%	0.302	C	S	.	.			trans	-69.2	130.9	179.5	-76.7	-176.6	151.5	0	0	112.4	K180 K191 D193 D200 I201	K180-M196 WeakPolarHBondContact CE-O 3.47Å; K180-M196 PolarHBondContact NZ-O 2.98Å; K191-M196 VanDerWaalsContact O-SD 3.36Å; D193-M196 HydrophobicContact CB-CG 4.13Å; D193-M196 PolarHBondContact O-N 2.83Å; M196-D200 HydrophobicContact CB-CB 4.22Å; M196-D200 HydrophobicContact CG-CB 4.22Å; M196-I201 HydrophobicContact CB-CG1 4.37Å
197	N	83.8	Confident	75.9	Confident	61 Å²	61	58.6 Å²	58.6	33%	0.326	31%	0.306	S	S	.	.			trans	-84.2	173.9	169	67.1	43.4	0	0	0	111	D195 L199 D200 I201	D195-N197 PolarHBondContact O-N 3.12Å; N197-L199 VanDerWaalsContact C-N 3.31Å; N197-L199 PolarHBondContact O-N 3.18Å; N197-L199 WeakPolarHBondContact OD1-CA 3.34Å; N197-L199 WeakPolarHBondContact OD1-CB 3.39Å; N197-L199 PolarHBondContact OD1-N 3.37Å; N197-D200 PolarHBondContact N-OD2 2.95Å; N197-D200 PolarHBondContact ND2-OD2 3.38Å; N197-D200 PolarHBondContact O-N 3.24Å; N197-D200 PolarHBondContact OD1-N 3.39Å; N197-D200 PolarHBondContact OD1-OD2 2.88Å; N197-D200 VanDerWaalsContact OD1-OD2 3.09Å; N197-I201 WeakPolarHBondContact O-CG1 3.45Å; N197-I201 PolarHBondContact O-N 2.95Å
198	L	85.8	Confident	76.1	Confident	9 Å²	9	62 Å²	62	5%	0.047	32%	0.319	C	S	.	.	H	α-helix	trans	-66.6	-32.9	-177.1	-163.2	68.9	0	0	0	112.8	I167 V171 L176 F179 I201 F202	I167-L198 HydrophobicContact CG2-CD2 4.13Å; V171-L198 HydrophobicContact CB-CD2 3.76Å; V171-L198 HydrophobicContact CG1-CD2 3.94Å; V171-L198 HydrophobicContact CG2-CD2 3.8Å; L176-L198 HydrophobicContact CD1-CB 3.95Å; L176-L198 HydrophobicContact CD1-CD1 3.7Å; L176-L198 HydrophobicContact CD1-CG 4.42Å; F179-L198 HydrophobicContact CB-CD1 4.1Å; F179-L198 HydrophobicContact CD1-CD1 3.73Å; F179-L198 HydrophobicContact CD2-CD1 4.33Å; F179-L198 HydrophobicContact CE1-CD1 4.21Å; F179-L198 HydrophobicContact CG-CD1 3.81Å; L198-I201 HydrophobicContact CD1-CD1 4.29Å; L198-I201 WeakPolarHBondContact O-CB 3.44Å; L198-I201 PolarHBondContact O-N 3.34Å; L198-F202 HydrophobicContact CD1-CE1 4.28Å; L198-F202 HydrophobicContact CD1-CZ 4.18Å; L198-F202 HydrophobicContact CD2-CE1 4.3Å; L198-F202 HydrophobicContact CD2-CE2 3.7Å; L198-F202 HydrophobicContact CD2-CZ 3.42Å; L198-F202 VanDerWaalsContact CD2-CZ 3.42Å; L198-F202 HydrophobicContact CG-CD2 4.38Å; L198-F202 HydrophobicContact CG-CE1 4.04Å; L198-F202 HydrophobicContact CG-CE2 3.72Å; L198-F202 HydrophobicContact CG-CZ 3.53Å; L198-F202 WeakPolarHBondContact O-CD2 3.2Å; L198-F202 WeakPolarHBondContact O-CG 3.38Å; L198-F202 PolarHBondContact O-N 2.94Å
199	L	87.3	Confident	76.8	Confident	13 Å²	13	64.1 Å²	64.1	7%	0.068	33%	0.329	C	S	.	.	H	α-helix	trans	-64.5	-41.3	176.7	-63	178.9	0	0	0	111.3	F83 Y165 S168 N197 I201 F202 I203	F83-L199 HydrophobicContact CB-CD1 4.01Å; F83-L199 HydrophobicContact CB-CD2 4.49Å; F83-L199 HydrophobicContact CD1-CD2 3.68Å; F83-L199 HydrophobicContact CD2-CB 3.91Å; F83-L199 HydrophobicContact CD2-CD2 3.9Å; F83-L199 HydrophobicContact CD2-CG 4.37Å; F83-L199 HydrophobicContact CE1-CD2 3.76Å; F83-L199 HydrophobicContact CE2-CB 4.36Å; F83-L199 HydrophobicContact CE2-CD2 3.98Å; F83-L199 HydrophobicContact CG-CB 4.25Å; F83-L199 HydrophobicContact CG-CD1 4.17Å; F83-L199 HydrophobicContact CG-CD2 3.75Å; F83-L199 HydrophobicContact CG-CG 4.28Å; F83-L199 HydrophobicContact CZ-CD2 3.91Å; Y165-L199 HydrophobicContact CD2-CD1 4.35Å; Y165-L199 HydrophobicContact CD2-CD2 4.35Å; S168-L199 WeakPolarHBondContact OG-CD2 3.21Å; N197-L199 VanDerWaalsContact C-N 3.31Å; N197-L199 PolarHBondContact O-N 3.18Å; N197-L199 WeakPolarHBondContact OD1-CA 3.34Å; N197-L199 WeakPolarHBondContact OD1-CB 3.39Å; N197-L199 PolarHBondContact OD1-N 3.37Å; L199-I201 VanDerWaalsContact C-N 3.29Å; L199-I201 PolarHBondContact O-N 2.86Å; L199-F202 HydrophobicContact CD2-CD2 4.33Å; L199-F202 PolarHBondContact O-N 2.78Å; L199-I203 VanDerWaalsContact O-CG1 3.29Å; L199-I203 WeakPolarHBondContact O-CG1 3.18Å; L199-I203 PolarHBondContact O-N 3.34Å
200	D	84.8	Confident	78.1	Confident	61 Å²	61	58.8 Å²	58.8	33%	0.326	31%	0.307	S	S	.	.	H	α-helix	trans	-61.9	-39.3	174.6	-63.5	-41.5	0	0	0	111.5	M196 N197 I203 E204	M196-D200 HydrophobicContact CB-CB 4.22Å; M196-D200 HydrophobicContact CG-CB 4.22Å; N197-D200 PolarHBondContact N-OD2 2.95Å; N197-D200 PolarHBondContact ND2-OD2 3.38Å; N197-D200 PolarHBondContact O-N 3.24Å; N197-D200 PolarHBondContact OD1-N 3.39Å; N197-D200 PolarHBondContact OD1-OD2 2.88Å; N197-D200 VanDerWaalsContact OD1-OD2 3.09Å; D200-I203 PolarHBondContact O-N 3.34Å; D200-E204 PolarHBondContact O-N 2.86Å
201	I	84.6	Confident	79.7	Confident	0 Å²	0	53 Å²	53	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-63.5	-46.5	175.1	-65.9	169.9	0	0	0	110	L176 K180 L183 L192 M196 N197 L198 L199 I203 E204 M205	L176-I201 HydrophobicContact CD1-CD1 3.75Å; K180-I201 HydrophobicContact CD-CD1 4.48Å; K180-I201 HydrophobicContact CG-CD1 3.7Å; L183-I201 HydrophobicContact CD1-CG2 3.44Å; L183-I201 VanDerWaalsContact CD1-CG2 3.44Å; L192-I201 HydrophobicContact CD2-CG1 4.22Å; M196-I201 HydrophobicContact CB-CG1 4.37Å; N197-I201 WeakPolarHBondContact O-CG1 3.45Å; N197-I201 PolarHBondContact O-N 2.95Å; L198-I201 HydrophobicContact CD1-CD1 4.29Å; L198-I201 WeakPolarHBondContact O-CB 3.44Å; L198-I201 PolarHBondContact O-N 3.34Å; L199-I201 VanDerWaalsContact C-N 3.29Å; L199-I201 PolarHBondContact O-N 2.86Å; I201-I203 VanDerWaalsContact C-N 3.3Å; I201-I203 PolarHBondContact O-N 3.06Å; I201-E204 PolarHBondContact O-N 2.88Å; I201-E204 VanDerWaalsContact O-N 3.14Å; I201-M205 HydrophobicContact CG2-CG 4.26Å; I201-M205 HydrophobicContact CG2-SD 4.07Å; I201-M205 WeakPolarHBondContact O-CB 3.49Å; I201-M205 VanDerWaalsContact O-CG 3.24Å; I201-M205 WeakPolarHBondContact O-CG 3.31Å; I201-M205 PolarHBondContact O-N 3.3Å
202	F	88.3	Confident	80.6	Confident	0 Å²	0	48.7 Å²	48.7	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-60.6	-39.9	176.5	-64.9	-30.7	0	0	0	112.3	F83 L164 I167 L198 L199 E204 M205 E206 L211 L219	F83-F202 HydrophobicContact CE2-CB 4.22Å; F83-F202 HydrophobicContact CZ-CB 4.46Å; F83-F202 HydrophobicContact CZ-CD2 4.45Å; L164-F202 HydrophobicContact CB-CD2 3.96Å; L164-F202 HydrophobicContact CB-CE2 4.22Å; L164-F202 HydrophobicContact CD1-CB 4.32Å; L164-F202 HydrophobicContact CD2-CD1 4.45Å; L164-F202 HydrophobicContact CD2-CD2 4.23Å; L164-F202 HydrophobicContact CD2-CE2 4.33Å; L164-F202 HydrophobicContact CD2-CG 4.29Å; L164-F202 HydrophobicContact CD2-CZ 4.49Å; L164-F202 HydrophobicContact CG-CD2 4.49Å; L164-F202 VanDerWaalsContact O-CE2 3.3Å; L164-F202 WeakPolarHBondContact O-CE2 3.03Å; I167-F202 HydrophobicContact CB-CE2 4.43Å; I167-F202 HydrophobicContact CB-CZ 4.25Å; I167-F202 HydrophobicContact CG2-CE2 4.37Å; I167-F202 HydrophobicContact CG2-CZ 3.77Å; L198-F202 HydrophobicContact CD1-CE1 4.28Å; L198-F202 HydrophobicContact CD1-CZ 4.18Å; L198-F202 HydrophobicContact CD2-CE1 4.3Å; L198-F202 HydrophobicContact CD2-CE2 3.7Å; L198-F202 HydrophobicContact CD2-CZ 3.42Å; L198-F202 VanDerWaalsContact CD2-CZ 3.42Å; L198-F202 HydrophobicContact CG-CD2 4.38Å; L198-F202 HydrophobicContact CG-CE1 4.04Å; L198-F202 HydrophobicContact CG-CE2 3.72Å; L198-F202 HydrophobicContact CG-CZ 3.53Å; L198-F202 WeakPolarHBondContact O-CD2 3.2Å; L198-F202 WeakPolarHBondContact O-CG 3.38Å; L198-F202 PolarHBondContact O-N 2.94Å; L199-F202 HydrophobicContact CD2-CD2 4.33Å; L199-F202 PolarHBondContact O-N 2.78Å; F202-E204 PolarHBondContact O-N 2.78Å; F202-M205 HydrophobicContact CD1-SD 4.02Å; F202-M205 WeakPolarHBondContact O-CB 3.31Å; F202-M205 PolarHBondContact O-N 3.25Å; F202-E206 WeakPolarHBondContact O-CG 3.36Å; F202-E206 PolarHBondContact O-N 3.14Å; F202-L211 HydrophobicContact CB-CD2 4.07Å; F202-L211 HydrophobicContact CD1-CD2 3.83Å; F202-L211 HydrophobicContact CG-CD2 4.2Å; F202-L219 HydrophobicContact CD1-CD1 4.46Å; F202-L219 HydrophobicContact CE1-CD1 3.59Å; F202-L219 HydrophobicContact CZ-CD1 4.18Å
203	I	84.1	Confident	81.1	Confident	20 Å²	20	53.3 Å²	53.3	10%	0.103	28%	0.275	C	S	.	.	H	α-helix	trans	-62.9	-42.4	174.3	-64.1	163.8	0	0	0	111.2	F83 L86 L199 D200 I201 M205 E206 K207	F83-I203 HydrophobicContact CD2-CD1 4.03Å; F83-I203 HydrophobicContact CD2-CG1 3.96Å; F83-I203 HydrophobicContact CE2-CG1 4.04Å; L86-I203 HydrophobicContact CD1-CD1 3.86Å; L86-I203 HydrophobicContact CD1-CG1 3.72Å; L199-I203 VanDerWaalsContact O-CG1 3.29Å; L199-I203 WeakPolarHBondContact O-CG1 3.18Å; L199-I203 PolarHBondContact O-N 3.34Å; D200-I203 PolarHBondContact O-N 3.34Å; I201-I203 VanDerWaalsContact C-N 3.3Å; I201-I203 PolarHBondContact O-N 3.06Å; I203-M205 VanDerWaalsContact C-N 3.34Å; I203-E206 PolarHBondContact O-N 2.99Å; I203-K207 WeakPolarHBondContact O-CG 3.26Å; I203-K207 PolarHBondContact O-N 3.31Å
204	E	82.3	Confident	81.5	Confident	16 Å²	16	52.4 Å²	52.4	8%	0.075	29%	0.288	C	S	.	.	H	α-helix	trans	-68.7	-33.8	177.3	-170.7	64.6	-163.6	0	0	112	I187 K191 D200 I201 F202 K207 R208	I187-E204 HydrophobicContact CG2-CG 4.45Å; K191-E204 WeakPolarHBondContact CD-OE1 3.47Å; K191-E204 IonicContact NZ-OE1 3.94Å; K191-E204 PolarHBondContact NZ-OE1 3.08Å; K191-E204 VanDerWaalsContact NZ-OE1 3.09Å; D200-E204 PolarHBondContact O-N 2.86Å; I201-E204 PolarHBondContact O-N 2.88Å; I201-E204 VanDerWaalsContact O-N 3.14Å; F202-E204 PolarHBondContact O-N 2.78Å; E204-K207 PolarHBondContact O-N 3.44Å; E204-K207 WeakPolarHBondContact OE2-CD 3.32Å; E204-K207 IonicContact OE2-NZ 2.69Å; E204-R208 WeakPolarHBondContact O-CG 3.45Å; E204-R208 PolarHBondContact O-N 3.41Å; E204-R208 IonicContact OE1-CZ 3.23Å; E204-R208 IonicContact OE1-NE 2.59Å; E204-R208 PolarHBondContact OE1-NE 3.34Å; E204-R208 IonicContact OE1-NH2 3.07Å
205	M	83	Confident	82.3	Confident	1 Å²	1	51 Å²	51	1%	0.005	28%	0.275	C	S	.	.	H	α-helix	trans	-63.6	-42.5	171.4	-71	179.6	77.6	0	0	111.6	L183 I187 I201 F202 I203 R208 V209 I210 L211 I218	L183-M205 HydrophobicContact CD1-CE 4.48Å; L183-M205 HydrophobicContact CD1-SD 3.76Å; L183-M205 HydrophobicContact CD2-CE 3.69Å; L183-M205 HydrophobicContact CD2-SD 4.02Å; I187-M205 HydrophobicContact CD1-CG 3.69Å; I201-M205 HydrophobicContact CG2-CG 4.26Å; I201-M205 HydrophobicContact CG2-SD 4.07Å; I201-M205 WeakPolarHBondContact O-CB 3.49Å; I201-M205 VanDerWaalsContact O-CG 3.24Å; I201-M205 WeakPolarHBondContact O-CG 3.31Å; I201-M205 PolarHBondContact O-N 3.3Å; F202-M205 HydrophobicContact CD1-SD 4.02Å; F202-M205 WeakPolarHBondContact O-CB 3.31Å; F202-M205 PolarHBondContact O-N 3.25Å; I203-M205 VanDerWaalsContact C-N 3.34Å; M205-R208 PolarHBondContact O-N 3.05Å; M205-V209 PolarHBondContact O-N 2.83Å; M205-I210 HydrophobicContact CB-CD1 3.94Å; M205-I210 HydrophobicContact CB-CG1 3.75Å; M205-I210 HydrophobicContact CE-CD1 4.15Å; M205-I210 HydrophobicContact CE-CG1 4.44Å; M205-I210 HydrophobicContact CG-CD1 3.73Å; M205-I210 HydrophobicContact CG-CG1 4.12Å; M205-I210 WeakPolarHBondContact O-CG1 3.27Å; M205-I210 PolarHBondContact O-N 3.25Å; M205-I210 VanDerWaalsContact O-N 3.13Å; M205-L211 HydrophobicContact CB-CB 3.64Å; M205-L211 HydrophobicContact CB-CD2 4.01Å; M205-L211 HydrophobicContact CB-CG 4.47Å; M205-L211 HydrophobicContact CE-CB 4.24Å; M205-L211 HydrophobicContact CE-CD1 4.45Å; M205-L211 HydrophobicContact CE-CD2 4.41Å; M205-L211 PolarHBondContact O-N 3.07Å; M205-L211 HydrophobicContact SD-CD2 4.2Å; M205-I218 HydrophobicContact CE-CG2 4.01Å
206	E	86.1	Confident	83	Confident	40 Å²	40	44.3 Å²	44.3	19%	0.187	24%	0.239	C	C	.	.	H	α-helix	trans	-64.2	-43	175.1	-75.4	177.3	177.3	0	0	112.1	Y160 R161 F202 I203 R208 V209 L211	Y160-E206 VanDerWaalsContact CE1-OE1 3.26Å; Y160-E206 WeakPolarHBondContact CE1-OE1 3.33Å; Y160-E206 PolarHBondContact OH-OE1 3.32Å; R161-E206 IonicContact CZ-OE1 3.07Å; R161-E206 VanDerWaalsContact CZ-OE1 3.22Å; R161-E206 IonicContact CZ-OE2 2.75Å; R161-E206 VanDerWaalsContact CZ-OE2 3.29Å; R161-E206 IonicContact NH1-OE1 3.81Å; R161-E206 PolarHBondContact NH1-OE1 2.94Å; R161-E206 IonicContact NH1-OE2 3.43Å; R161-E206 PolarHBondContact NH1-OE2 2.92Å; R161-E206 IonicContact NH2-OE1 2.77Å; R161-E206 PolarHBondContact NH2-OE1 2.79Å; R161-E206 IonicContact NH2-OE2 2.75Å; R161-E206 PolarHBondContact NH2-OE2 3.11Å; F202-E206 WeakPolarHBondContact O-CG 3.36Å; F202-E206 PolarHBondContact O-N 3.14Å; I203-E206 PolarHBondContact O-N 2.99Å; E206-R208 PolarHBondContact O-N 3.18Å; E206-V209 PolarHBondContact O-N 2.92Å; E206-L211 HydrophobicContact CG-CB 4.47Å
207	K	82.6	Confident	83.2	Confident	114 Å²	114	47.5 Å²	47.5	50%	0.496	26%	0.257	S	S	.	.	H	α-helix	trans	-58.1	-31.6	175.9	-76.1	174.6	-175.6	170.1	0	113.1	Q91 I203 E204 V209	Q91-K207 VanDerWaalsContact NE2-NZ 3.15Å; I203-K207 WeakPolarHBondContact O-CG 3.26Å; I203-K207 PolarHBondContact O-N 3.31Å; E204-K207 PolarHBondContact O-N 3.44Å; E204-K207 WeakPolarHBondContact OE2-CD 3.32Å; E204-K207 IonicContact OE2-NZ 2.69Å; K207-V209 VanDerWaalsContact C-N 3.33Å
208	R	77.6	Confident	83.2	Confident	72 Å²	72	46.2 Å²	46.2	27%	0.272	25%	0.25	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.3	-0	178.2	-68.2	176.3	-176.6	-122.5	4.5	113.1	S188 E204 M205 E206 I210	S188-R208 PolarHBondContact OG-NH2 2.76Å; E204-R208 WeakPolarHBondContact O-CG 3.45Å; E204-R208 PolarHBondContact O-N 3.41Å; E204-R208 IonicContact OE1-CZ 3.23Å; E204-R208 IonicContact OE1-NE 2.59Å; E204-R208 PolarHBondContact OE1-NE 3.34Å; E204-R208 IonicContact OE1-NH2 3.07Å; M205-R208 PolarHBondContact O-N 3.05Å; E206-R208 PolarHBondContact O-N 3.18Å; R208-I210 HydrophobicContact CB-CG1 4.11Å; R208-I210 HydrophobicContact CB-CG2 4.34Å; R208-I210 PolarHBondContact O-N 2.79Å
209	V	80.6	Confident	83.2	Confident	100 Å²	100	45.8 Å²	45.8	61%	0.606	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	61.6	22.3	179.6	-159.5	0	0	0	0	112.5	M205 E206 K207	M205-V209 PolarHBondContact O-N 2.83Å; E206-V209 PolarHBondContact O-N 2.92Å; K207-V209 VanDerWaalsContact C-N 3.33Å
210	I	84	Confident	83.1	Confident	32 Å²	32	47.4 Å²	47.4	16%	0.164	25%	0.254	C	S	.	.	S	Bend	trans	-90.3	-14.3	175.4	58.6	169.1	0	0	0	112.3	E186 I187 M205 R208 I218	E186-I210 HydrophobicContact CB-CD1 4.42Å; I187-I210 HydrophobicContact CD1-CD1 4.14Å; I187-I210 HydrophobicContact CG1-CD1 3.87Å; M205-I210 HydrophobicContact CB-CD1 3.94Å; M205-I210 HydrophobicContact CB-CG1 3.75Å; M205-I210 HydrophobicContact CE-CD1 4.15Å; M205-I210 HydrophobicContact CE-CG1 4.44Å; M205-I210 HydrophobicContact CG-CD1 3.73Å; M205-I210 HydrophobicContact CG-CG1 4.12Å; M205-I210 WeakPolarHBondContact O-CG1 3.27Å; M205-I210 PolarHBondContact O-N 3.25Å; M205-I210 VanDerWaalsContact O-N 3.13Å; R208-I210 HydrophobicContact CB-CG1 4.11Å; R208-I210 HydrophobicContact CB-CG2 4.34Å; R208-I210 PolarHBondContact O-N 2.79Å; I210-I218 HydrophobicContact CB-CD1 3.74Å; I210-I218 HydrophobicContact CG2-CD1 4.08Å
211	L	86.7	Confident	83.1	Confident	7 Å²	7	51.9 Å²	51.9	4%	0.037	27%	0.267	C	S	.	.	S	Bend	trans	-132.2	136.4	177.2	-170.5	64.9	0	0	0	110.2	Y160 L164 F202 M205 E206 L216 L219	Y160-L211 WeakPolarHBondContact OH-CG 3.41Å; L164-L211 HydrophobicContact CD1-CD2 4.16Å; L164-L211 HydrophobicContact CD2-CD2 3.96Å; F202-L211 HydrophobicContact CB-CD2 4.07Å; F202-L211 HydrophobicContact CD1-CD2 3.83Å; F202-L211 HydrophobicContact CG-CD2 4.2Å; M205-L211 HydrophobicContact CB-CB 3.64Å; M205-L211 HydrophobicContact CB-CD2 4.01Å; M205-L211 HydrophobicContact CB-CG 4.47Å; M205-L211 HydrophobicContact CE-CB 4.24Å; M205-L211 HydrophobicContact CE-CD1 4.45Å; M205-L211 HydrophobicContact CE-CD2 4.41Å; M205-L211 PolarHBondContact O-N 3.07Å; M205-L211 HydrophobicContact SD-CD2 4.2Å; E206-L211 HydrophobicContact CG-CB 4.47Å; L211-L216 HydrophobicContact CD1-CD2 4.02Å; L211-L219 HydrophobicContact CD1-CB 3.62Å; L211-L219 HydrophobicContact CD1-CD2 3.79Å; L211-L219 HydrophobicContact CD1-CG 4.26Å
212	G	83.1	Confident	83.1	Confident	19 Å²	19	52.2 Å²	52.2	20%	0.196	27%	0.269	C	S	.	.	B	Isolated β-bridge	trans	-171.7	174	177.1	0	0	0	0	0	111.9	Y160 G214 K215 L216	Y160-G212 VanDerWaalsContact CE2-C 3.43Å; Y160-G212 WeakPolarHBondContact CE2-O 3.34Å; Y160-G212 VanDerWaalsContact OH-CA 3.26Å; Y160-G212 WeakPolarHBondContact OH-CA 3.31Å; Y160-G212 PolarHBondContact OH-N 3.5Å; G212-G214 VanDerWaalsContact C-N 3.27Å; G212-G214 PolarHBondContact O-N 2.99Å; G212-K215 PolarHBondContact N-O 2.74Å; G212-K215 VanDerWaalsContact N-O 3.12Å; G212-K215 CarbonylContact O-C 3.43Å; G212-K215 PolarHBondContact O-N 2.83Å; G212-L216 WeakPolarHBondContact O-CD2 3.26Å
213	E	78.9	Confident	83	Confident	121 Å²	121	52.2 Å²	52.2	57%	0.565	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.1	-40.4	-175.3	-166.2	170.3	-167.9	0	0	113.7	Y160 Y237	Y160-E213 HydrophobicContact CD2-CB 4.31Å; Y160-E213 HydrophobicContact CG-CB 4.25Å; Y160-E213 HydrophobicContact CG-CG 4.34Å; E213-Y237 WeakPolarHBondContact CG-OH 3.37Å; E213-Y237 PolarHBondContact OE1-OH 2.94Å
214	G	74.4	Confident	83	Confident	77 Å²	77	53.3 Å²	53.3	79%	0.794	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103	6.6	175.5	0	0	0	0	0	115	G212	G212-G214 VanDerWaalsContact C-N 3.27Å; G212-G214 PolarHBondContact O-N 2.99Å
215	K	81.8	Confident	82.9	Confident	117 Å²	117	58.3 Å²	58.3	51%	0.509	30%	0.304	S	S	.	.	B	Isolated β-bridge	trans	-128	84.4	-176.3	-70.9	-173.8	-180	-177.3	0	109.7	G212	G212-K215 PolarHBondContact N-O 2.74Å; G212-K215 VanDerWaalsContact N-O 3.12Å; G212-K215 CarbonylContact O-C 3.43Å; G212-K215 PolarHBondContact O-N 2.83Å
216	L	85.4	Confident	82.8	Confident	6 Å²	6	59.6 Å²	59.6	3%	0.031	31%	0.312	C	S	.	.			trans	-113.9	3.1	-177	-58.2	178.9	0	0	0	112.9	Y160 M163 L211 G212 I218 L219 K220 I234 Y237	Y160-L216 HydrophobicContact CD2-CD2 4.47Å; Y160-L216 HydrophobicContact CE2-CD2 3.93Å; M163-L216 HydrophobicContact CE-CD1 4.02Å; M163-L216 HydrophobicContact CE-CD2 3.87Å; L211-L216 HydrophobicContact CD1-CD2 4.02Å; G212-L216 WeakPolarHBondContact O-CD2 3.26Å; L216-I218 PolarHBondContact O-N 2.91Å; L216-L219 HydrophobicContact CD2-CD2 4.39Å; L216-L219 PolarHBondContact O-N 3.46Å; L216-K220 HydrophobicContact CB-CD 4.5Å; L216-K220 HydrophobicContact CB-CG 4.46Å; L216-K220 WeakPolarHBondContact O-CB 3.4Å; L216-K220 VanDerWaalsContact O-CG 3.29Å; L216-K220 WeakPolarHBondContact O-CG 3.17Å; L216-K220 PolarHBondContact O-N 2.87Å; L216-I234 HydrophobicContact CB-CG2 4.46Å; L216-I234 HydrophobicContact CD1-CG2 3.92Å; L216-Y237 HydrophobicContact CD1-CD1 3.82Å; L216-Y237 HydrophobicContact CD1-CE1 3.81Å
217	D	82.6	Confident	82.4	Confident	111 Å²	111	59.9 Å²	59.9	59%	0.594	32%	0.315	S	S	*	.	H	α-helix	trans	-62.6	-41.8	-171.6	-56.9	-62.6	0	0	0	113.3	R221	D217-R221 WeakPolarHBondContact O-CB 3.45Å; D217-R221 PolarHBondContact O-N 3.25Å
218	I	82.8	Confident	82.2	Confident	34 Å²	34	62.6 Å²	62.6	17%	0.174	33%	0.326	C	S	.	.	H	α-helix	trans	-68.4	-45.2	177.2	-64.9	168.5	0	0	0	109.6	L183 E186 M205 I210 L216 K220 R221 V222	L183-I218 HydrophobicContact CD2-CG2 4.14Å; E186-I218 HydrophobicContact CG-CG2 4.29Å; M205-I218 HydrophobicContact CE-CG2 4.01Å; I210-I218 HydrophobicContact CB-CD1 3.74Å; I210-I218 HydrophobicContact CG2-CD1 4.08Å; L216-I218 PolarHBondContact O-N 2.91Å; I218-K220 PolarHBondContact O-N 3.46Å; I218-R221 WeakPolarHBondContact O-CB 3.13Å; I218-R221 PolarHBondContact O-N 2.87Å; I218-V222 HydrophobicContact CG2-CG2 4.49Å; I218-V222 WeakPolarHBondContact O-CG2 3.37Å; I218-V222 PolarHBondContact O-N 3.46Å
219	L	86.3	Confident	82.3	Confident	1 Å²	1	61.7 Å²	61.7	1%	0.005	33%	0.331	C	S	.	.	H	α-helix	trans	-61.3	-44.8	176.7	-177	61.5	0	0	0	111.6	M163 L164 I167 F179 F202 L211 L216 R221 V222 C223 I234	M163-L219 HydrophobicContact SD-CD2 4.39Å; L164-L219 HydrophobicContact CD2-CD2 3.57Å; I167-L219 HydrophobicContact CD1-CD2 3.87Å; F179-L219 HydrophobicContact CE1-CD1 4.13Å; F202-L219 HydrophobicContact CD1-CD1 4.46Å; F202-L219 HydrophobicContact CE1-CD1 3.59Å; F202-L219 HydrophobicContact CZ-CD1 4.18Å; L211-L219 HydrophobicContact CD1-CB 3.62Å; L211-L219 HydrophobicContact CD1-CD2 3.79Å; L211-L219 HydrophobicContact CD1-CG 4.26Å; L216-L219 HydrophobicContact CD2-CD2 4.39Å; L216-L219 PolarHBondContact O-N 3.46Å; L219-R221 VanDerWaalsContact C-N 3.34Å; L219-R221 PolarHBondContact O-N 3.39Å; L219-V222 PolarHBondContact O-N 3.39Å; L219-C223 VanDerWaalsContact O-CB 3.22Å; L219-C223 WeakPolarHBondContact O-CB 3.29Å; L219-C223 PolarHBondContact O-N 3.44Å; L219-C223 PolarHBondContact O-SG 3.25Å; L219-I234 HydrophobicContact CD2-CD1 4.19Å; L219-I234 HydrophobicContact CG-CD1 3.95Å
220	K	85.3	Confident	82.5	Confident	47 Å²	47	57 Å²	57	20%	0.204	30%	0.302	C	S	.	.	H	α-helix	trans	-58.1	-45.4	174.6	-79.2	175.8	164.7	-176.5	0	111.9	L216 I218 A224 L231 I234 E238	L216-K220 HydrophobicContact CB-CD 4.5Å; L216-K220 HydrophobicContact CB-CG 4.46Å; L216-K220 WeakPolarHBondContact O-CB 3.4Å; L216-K220 VanDerWaalsContact O-CG 3.29Å; L216-K220 WeakPolarHBondContact O-CG 3.17Å; L216-K220 PolarHBondContact O-N 2.87Å; I218-K220 PolarHBondContact O-N 3.46Å; K220-A224 WeakPolarHBondContact O-CB 3.34Å; K220-A224 PolarHBondContact O-N 3.27Å; K220-L231 HydrophobicContact CB-CD2 4.33Å; K220-L231 HydrophobicContact CG-CD2 4.46Å; K220-L231 WeakPolarHBondContact O-CD2 3.2Å; K220-I234 HydrophobicContact CD-CG2 4.22Å; K220-I234 VanDerWaalsContact CE-CG2 3.42Å; K220-I234 HydrophobicContact CG-CD1 4Å; K220-I234 HydrophobicContact CG-CG2 3.77Å; K220-E238 VanDerWaalsContact CE-OE1 3.23Å; K220-E238 WeakPolarHBondContact CE-OE1 3.5Å; K220-E238 IonicContact NZ-OE1 2.8Å; K220-E238 PolarHBondContact NZ-OE1 3.16Å; K220-E238 IonicContact NZ-OE2 3.35Å; K220-E238 PolarHBondContact NZ-OE2 2.93Å
221	R	85	Confident	82.4	Confident	155 Å²	155	57.5 Å²	57.5	59%	0.585	31%	0.306	S	S	*	.	H	α-helix	trans	-60.8	-47.1	177.7	-174.8	-169	-51	-123	-0.2	111.2	D217 I218 L219 A224 Q225	D217-R221 WeakPolarHBondContact O-CB 3.45Å; D217-R221 PolarHBondContact O-N 3.25Å; I218-R221 WeakPolarHBondContact O-CB 3.13Å; I218-R221 PolarHBondContact O-N 2.87Å; L219-R221 VanDerWaalsContact C-N 3.34Å; L219-R221 PolarHBondContact O-N 3.39Å; R221-A224 PolarHBondContact O-N 3.25Å; R221-Q225 WeakPolarHBondContact O-CG 3.17Å; R221-Q225 PolarHBondContact O-N 3.07Å
222	V	84.7	Confident	82.2	Confident	7 Å²	7	63.7 Å²	63.7	4%	0.042	33%	0.332	C	S	.	.	H	α-helix	trans	-66.5	-48.9	179.7	177.2	0	0	0	0	110.2	F179 L182 L183 I218 L219 A224 Q225 V226	F179-V222 HydrophobicContact CD1-CG1 3.35Å; F179-V222 HydrophobicContact CE1-CB 4.32Å; F179-V222 HydrophobicContact CE1-CG1 3.48Å; F179-V222 VanDerWaalsContact CE1-CG1 3.48Å; F179-V222 HydrophobicContact CG-CG1 3.92Å; F179-V222 HydrophobicContact CZ-CG1 4.13Å; L182-V222 HydrophobicContact CB-CG1 4.2Å; L182-V222 HydrophobicContact CB-CG2 4.27Å; L182-V222 HydrophobicContact CD1-CG1 4.15Å; L183-V222 HydrophobicContact CD2-CG2 3.83Å; L183-V222 HydrophobicContact CG-CG2 4.16Å; I218-V222 HydrophobicContact CG2-CG2 4.49Å; I218-V222 WeakPolarHBondContact O-CG2 3.37Å; I218-V222 PolarHBondContact O-N 3.46Å; L219-V222 PolarHBondContact O-N 3.39Å; V222-A224 VanDerWaalsContact C-N 3.32Å; V222-A224 PolarHBondContact O-N 2.88Å; V222-Q225 PolarHBondContact O-N 3.17Å; V222-Q225 VanDerWaalsContact O-N 3.1Å; V222-V226 HydrophobicContact CG1-CG2 4.2Å; V222-V226 WeakPolarHBondContact O-CG2 3.32Å; V222-V226 PolarHBondContact O-N 3.47Å
223	C	85.4	Confident	82.2	Confident	0 Å²	0	63.4 Å²	63.4	0%	0	33%	0.326	C	S	.	.	H	α-helix	trans	-55.9	-43.7	174.8	-73.3	0	0	0	0	112.1	L219 Q225 V226 N227 L230 L231 I234	L219-C223 VanDerWaalsContact O-CB 3.22Å; L219-C223 WeakPolarHBondContact O-CB 3.29Å; L219-C223 PolarHBondContact O-N 3.44Å; L219-C223 PolarHBondContact O-SG 3.25Å; C223-Q225 PolarHBondContact O-N 3.44Å; C223-V226 PolarHBondContact O-N 3.36Å; C223-N227 CarbonylContact O-C 3.55Å; C223-N227 PolarHBondContact O-N 2.69Å; C223-L230 HydrophobicContact CB-CB 3.9Å; C223-L230 HydrophobicContact CB-CD1 4.45Å; C223-L231 HydrophobicContact CB-CD2 4.22Å; C223-I234 HydrophobicContact CB-CD1 4.13Å
224	A	83.9	Confident	82.5	Confident	43 Å²	43	57.6 Å²	57.6	36%	0.355	30%	0.299	S	S	.	.	H	α-helix	trans	-60.4	-32.9	178.4	0	0	0	0	0	113.3	K220 R221 V222 L231	K220-A224 WeakPolarHBondContact O-CB 3.34Å; K220-A224 PolarHBondContact O-N 3.27Å; R221-A224 PolarHBondContact O-N 3.25Å; V222-A224 VanDerWaalsContact C-N 3.32Å; V222-A224 PolarHBondContact O-N 2.88Å; A224-L231 HydrophobicContact CB-CD1 3.87Å; A224-L231 HydrophobicContact CB-CD2 4.18Å; A224-L231 HydrophobicContact CB-CG 4.34Å
225	Q	80.1	Confident	83	Confident	121 Å²	121	57.2 Å²	57.2	57%	0.565	28%	0.279	S	S	*	.	H	α-helix	trans	-85.1	-31.5	-180	-69	-177.1	33.8	0	0	112.7	L182 R221 V222 C223	L182-Q225 HydrophobicContact CD1-CB 3.6Å; R221-Q225 WeakPolarHBondContact O-CG 3.17Å; R221-Q225 PolarHBondContact O-N 3.07Å; V222-Q225 PolarHBondContact O-N 3.17Å; V222-Q225 VanDerWaalsContact O-N 3.1Å; C223-Q225 PolarHBondContact O-N 3.44Å
226	V	81.6	Confident	83	Confident	27 Å²	27	55.6 Å²	55.6	16%	0.164	28%	0.275	C	S	.	.	H	α-helix	trans	-83.5	-57.4	-179.8	178.8	0	0	0	0	111.2	E175 F179 L182 V222 C223	E175-V226 HydrophobicContact CB-CG1 3.49Å; E175-V226 VanDerWaalsContact CB-CG1 3.49Å; E175-V226 HydrophobicContact CG-CG1 3.73Å; F179-V226 HydrophobicContact CD2-CB 4.1Å; F179-V226 HydrophobicContact CD2-CG1 3.82Å; F179-V226 HydrophobicContact CD2-CG2 3.73Å; F179-V226 HydrophobicContact CE2-CB 3.85Å; F179-V226 HydrophobicContact CE2-CG1 3.73Å; F179-V226 HydrophobicContact CE2-CG2 3.89Å; F179-V226 HydrophobicContact CG-CG2 4.32Å; L182-V226 HydrophobicContact CD1-CG2 3.74Å; V222-V226 HydrophobicContact CG1-CG2 4.2Å; V222-V226 WeakPolarHBondContact O-CG2 3.32Å; V222-V226 PolarHBondContact O-N 3.47Å; C223-V226 PolarHBondContact O-N 3.36Å
227	N	78.5	Confident	82.9	Confident	46 Å²	46	56.2 Å²	56.2	25%	0.246	28%	0.277	C	S	.	.			trans	-155.9	118.8	-177.8	-176.1	-12.3	0	0	0	111.4	E175 C223 S229 L230	E175-N227 WeakPolarHBondContact OE1-CB 3.37Å; E175-N227 PolarHBondContact OE1-ND2 2.83Å; C223-N227 CarbonylContact O-C 3.55Å; C223-N227 PolarHBondContact O-N 2.69Å; N227-S229 VanDerWaalsContact CG-OG 3.25Å; N227-S229 PolarHBondContact ND2-OG 3.26Å; N227-S229 PolarHBondContact O-N 2.9Å; N227-S229 WeakPolarHBondContact OD1-CB 3.28Å; N227-S229 PolarHBondContact OD1-N 3.27Å; N227-S229 PolarHBondContact OD1-OG 2.95Å; N227-L230 HydrophobicContact CB-CD1 3.91Å; N227-L230 HydrophobicContact CB-CG 3.98Å; N227-L230 WeakPolarHBondContact O-CB 3.49Å; N227-L230 PolarHBondContact O-N 2.96Å; N227-L230 VanDerWaalsContact O-N 3.11Å
228	K	78.3	Confident	82.8	Confident	171 Å²	171	52.6 Å²	52.6	74%	0.743	26%	0.257	S	S	*	.	H	α-helix	trans	-63	-22.1	-179	-66.5	-176.4	-179.9	-179.7	0	113.6	L230 L231	K228-L230 VanDerWaalsContact C-N 3.26Å; K228-L230 PolarHBondContact O-N 3.26Å; K228-L231 WeakPolarHBondContact O-CB 3.32Å; K228-L231 PolarHBondContact O-N 3.1Å
229	S	79.6	Confident	82.6	Confident	54 Å²	54	57.2 Å²	57.2	38%	0.378	28%	0.278	S	S	.	.	H	α-helix	trans	-64.8	-32.9	175.3	68.7	0	0	0	0	111.9	N227 L231 K232	N227-S229 VanDerWaalsContact CG-OG 3.25Å; N227-S229 PolarHBondContact ND2-OG 3.26Å; N227-S229 PolarHBondContact O-N 2.9Å; N227-S229 WeakPolarHBondContact OD1-CB 3.28Å; N227-S229 PolarHBondContact OD1-N 3.27Å; N227-S229 PolarHBondContact OD1-OG 2.95Å; S229-L231 PolarHBondContact O-N 2.91Å; S229-K232 WeakPolarHBondContact O-CB 3.29Å; S229-K232 PolarHBondContact O-N 3.26Å
230	L	83.6	Confident	82	Confident	0 Å²	0	62.2 Å²	62.2	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-64.8	-27.9	179.3	-55.7	174.9	0	0	0	112.4	I167 E170 V171 F179 C223 N227 K228 K232 I233 I234	I167-L230 HydrophobicContact CG2-CD2 4.34Å; E170-L230 HydrophobicContact CB-CD2 3.58Å; V171-L230 HydrophobicContact CG2-CD1 3.56Å; V171-L230 HydrophobicContact CG2-CD2 3.97Å; V171-L230 HydrophobicContact CG2-CG 4.42Å; F179-L230 HydrophobicContact CE2-CD1 3.86Å; F179-L230 HydrophobicContact CZ-CD1 4.01Å; C223-L230 HydrophobicContact CB-CB 3.9Å; C223-L230 HydrophobicContact CB-CD1 4.45Å; N227-L230 HydrophobicContact CB-CD1 3.91Å; N227-L230 HydrophobicContact CB-CG 3.98Å; N227-L230 WeakPolarHBondContact O-CB 3.49Å; N227-L230 PolarHBondContact O-N 2.96Å; N227-L230 VanDerWaalsContact O-N 3.11Å; K228-L230 VanDerWaalsContact C-N 3.26Å; K228-L230 PolarHBondContact O-N 3.26Å; L230-K232 PolarHBondContact O-N 3.18Å; L230-I233 HydrophobicContact CD2-CD1 4.23Å; L230-I233 PolarHBondContact O-N 3.45Å; L230-I234 PolarHBondContact O-N 3.39Å
231	L	82.4	Confident	81.2	Confident	44 Å²	44	61.9 Å²	61.9	23%	0.23	30%	0.303	C	S	.	.	H	α-helix	trans	-63.3	-29.8	173.3	-69.5	176	0	0	0	111.9	K220 C223 A224 K228 S229 I234 N235	K220-L231 HydrophobicContact CB-CD2 4.33Å; K220-L231 HydrophobicContact CG-CD2 4.46Å; K220-L231 WeakPolarHBondContact O-CD2 3.2Å; C223-L231 HydrophobicContact CB-CD2 4.22Å; A224-L231 HydrophobicContact CB-CD1 3.87Å; A224-L231 HydrophobicContact CB-CD2 4.18Å; A224-L231 HydrophobicContact CB-CG 4.34Å; K228-L231 WeakPolarHBondContact O-CB 3.32Å; K228-L231 PolarHBondContact O-N 3.1Å; S229-L231 PolarHBondContact O-N 2.91Å; L231-I234 PolarHBondContact O-N 3.44Å; L231-N235 WeakPolarHBondContact O-CB 3.46Å; L231-N235 PolarHBondContact O-N 3.42Å; L231-N235 PolarHBondContact O-ND2 3.09Å
232	K	83.2	Confident	80.2	Confident	137 Å²	137	62.1 Å²	62.1	60%	0.596	30%	0.304	S	S	*	.	H	α-helix	trans	-63.6	-43.9	177.3	-166.9	-175.9	173.8	-170.7	0	110.6	S229 L230 I234 N235 D236	S229-K232 WeakPolarHBondContact O-CB 3.29Å; S229-K232 PolarHBondContact O-N 3.26Å; L230-K232 PolarHBondContact O-N 3.18Å; K232-I234 VanDerWaalsContact C-N 3.32Å; K232-I234 PolarHBondContact O-N 2.61Å; K232-N235 PolarHBondContact O-N 3.24Å; K232-D236 WeakPolarHBondContact O-CB 3.44Å; K232-D236 PolarHBondContact O-N 2.84Å
233	I	83.3	Confident	78.8	Confident	12 Å²	12	63.3 Å²	63.3	6%	0.062	32%	0.318	C	S	.	.	H	α-helix	trans	-59.4	-44.4	177.5	-48.3	176.2	0	0	0	110.9	M163 Q166 I167 E170 L230 Y237	M163-I233 HydrophobicContact CG-CG2 4.08Å; Q166-I233 HydrophobicContact CB-CD1 4.34Å; Q166-I233 HydrophobicContact CB-CG2 3.87Å; I167-I233 HydrophobicContact CG1-CB 4.27Å; I167-I233 HydrophobicContact CG1-CD1 3.94Å; I167-I233 HydrophobicContact CG1-CG2 4.16Å; E170-I233 HydrophobicContact CB-CD1 4.36Å; E170-I233 HydrophobicContact CG-CD1 4.04Å; E170-I233 WeakPolarHBondContact OE1-CD1 3.33Å; L230-I233 HydrophobicContact CD2-CD1 4.23Å; L230-I233 PolarHBondContact O-N 3.45Å; I233-Y237 WeakPolarHBondContact O-CB 3.43Å; I233-Y237 PolarHBondContact O-N 3.24Å
234	I	84.9	Confident	77.2	Confident	0 Å²	0	69.1 Å²	69.1	0%	0	34%	0.34	C	S	.	.	H	α-helix	trans	-67.2	-42.7	179.1	-61.5	171.7	0	0	0	111	M163 I167 L216 L219 K220 C223 L230 L231 K232 Y237 E238	M163-I234 HydrophobicContact SD-CG1 4.24Å; I167-I234 HydrophobicContact CD1-CD1 4.11Å; I167-I234 HydrophobicContact CD1-CG1 3.74Å; L216-I234 HydrophobicContact CB-CG2 4.46Å; L216-I234 HydrophobicContact CD1-CG2 3.92Å; L219-I234 HydrophobicContact CD2-CD1 4.19Å; L219-I234 HydrophobicContact CG-CD1 3.95Å; K220-I234 HydrophobicContact CD-CG2 4.22Å; K220-I234 VanDerWaalsContact CE-CG2 3.42Å; K220-I234 HydrophobicContact CG-CD1 4Å; K220-I234 HydrophobicContact CG-CG2 3.77Å; C223-I234 HydrophobicContact CB-CD1 4.13Å; L230-I234 PolarHBondContact O-N 3.39Å; L231-I234 PolarHBondContact O-N 3.44Å; K232-I234 VanDerWaalsContact C-N 3.32Å; K232-I234 PolarHBondContact O-N 2.61Å; I234-Y237 WeakPolarHBondContact O-CB 3.25Å; I234-Y237 PolarHBondContact O-N 3.2Å; I234-E238 WeakPolarHBondContact O-CG 3.31Å; I234-E238 PolarHBondContact O-N 3.44Å
235	N	83.9	Confident	75.3	Confident	69 Å²	69	72.3 Å²	72.3	37%	0.369	36%	0.355	S	S	.	.	H	α-helix	trans	-66.6	-42.2	178.5	-69	-19.2	0	0	0	111.5	L231 K232 Y237 E238 E239	L231-N235 WeakPolarHBondContact O-CB 3.46Å; L231-N235 PolarHBondContact O-N 3.42Å; L231-N235 PolarHBondContact O-ND2 3.09Å; K232-N235 PolarHBondContact O-N 3.24Å; N235-Y237 VanDerWaalsContact C-N 3.25Å; N235-Y237 PolarHBondContact O-N 2.82Å; N235-E238 CarbonylContact O-C 3.57Å; N235-E238 PolarHBondContact O-N 3.24Å; N235-E238 VanDerWaalsContact O-N 3.11Å; N235-E239 WeakPolarHBondContact O-CB 3.37Å; N235-E239 WeakPolarHBondContact O-CG 3.15Å; N235-E239 PolarHBondContact O-N 3.23Å
236	D	81.5	Confident	73.3	Confident	82 Å²	82	76.4 Å²	76.4	44%	0.439	37%	0.366	S	S	.	.	H	α-helix	trans	-60.3	-39	175.9	-68.9	-9.7	0	0	0	110.2	K232 F240	K232-D236 WeakPolarHBondContact O-CB 3.44Å; K232-D236 PolarHBondContact O-N 2.84Å; D236-F240 WeakPolarHBondContact O-CB 3.31Å; D236-F240 PolarHBondContact O-N 2.95Å
237	Y	83.4	Confident	71.3	Confident	19 Å²	19	79.8 Å²	79.8	8%	0.075	39%	0.39	C	S	.	.	H	α-helix	trans	-64.8	-43.6	172	167.4	-95.6	0	0	0	112.9	A159 M163 E213 L216 I233 I234 N235 F240 S241	A159-Y237 HydrophobicContact CB-CD2 4.17Å; A159-Y237 HydrophobicContact CB-CE2 3.89Å; M163-Y237 HydrophobicContact CB-CD2 4.07Å; M163-Y237 HydrophobicContact CB-CG 4.09Å; M163-Y237 HydrophobicContact CE-CD1 3.89Å; M163-Y237 HydrophobicContact CE-CD2 4.5Å; M163-Y237 HydrophobicContact CE-CE1 4.14Å; M163-Y237 HydrophobicContact CE-CG 4.1Å; M163-Y237 HydrophobicContact CG-CG 4.03Å; E213-Y237 WeakPolarHBondContact CG-OH 3.37Å; E213-Y237 PolarHBondContact OE1-OH 2.94Å; L216-Y237 HydrophobicContact CD1-CD1 3.82Å; L216-Y237 HydrophobicContact CD1-CE1 3.81Å; I233-Y237 WeakPolarHBondContact O-CB 3.43Å; I233-Y237 PolarHBondContact O-N 3.24Å; I234-Y237 WeakPolarHBondContact O-CB 3.25Å; I234-Y237 PolarHBondContact O-N 3.2Å; N235-Y237 VanDerWaalsContact C-N 3.25Å; N235-Y237 PolarHBondContact O-N 2.82Å; Y237-F240 PolarHBondContact O-N 3.13Å; Y237-S241 WeakPolarHBondContact O-CB 3.36Å; Y237-S241 PolarHBondContact O-N 3.22Å; Y237-S241 PolarHBondContact O-OG 2.81Å
238	E	81.6	Confident	69.5	Low	36 Å²	36	85.3 Å²	85.3	17%	0.168	42%	0.419	C	S	.	.	H	α-helix	trans	-66.5	-37.4	176.6	-74.4	-170.1	157.6	0	0	112.6	K220 I234 N235 S241 R242	K220-E238 VanDerWaalsContact CE-OE1 3.23Å; K220-E238 WeakPolarHBondContact CE-OE1 3.5Å; K220-E238 IonicContact NZ-OE1 2.8Å; K220-E238 PolarHBondContact NZ-OE1 3.16Å; K220-E238 IonicContact NZ-OE2 3.35Å; K220-E238 PolarHBondContact NZ-OE2 2.93Å; I234-E238 WeakPolarHBondContact O-CG 3.31Å; I234-E238 PolarHBondContact O-N 3.44Å; N235-E238 CarbonylContact O-C 3.57Å; N235-E238 PolarHBondContact O-N 3.24Å; N235-E238 VanDerWaalsContact O-N 3.11Å; E238-S241 VanDerWaalsContact CA-OG 3.29Å; E238-S241 WeakPolarHBondContact CA-OG 3.27Å; E238-S241 PolarHBondContact O-OG 3.46Å; E238-R242 VanDerWaalsContact O-CB 3.25Å; E238-R242 WeakPolarHBondContact O-CB 3.46Å; E238-R242 WeakPolarHBondContact O-CD 3.45Å; E238-R242 WeakPolarHBondContact O-CG 2.96Å; E238-R242 PolarHBondContact O-N 3.34Å
239	E	78.5	Confident	67.5	Low	130 Å²	130	85.4 Å²	85.4	61%	0.607	42%	0.422	S	S	*	.	H	α-helix	trans	-69.5	-40.3	174.4	-73.9	-172	178.2	0	0	111.4	N235 R242 G243	N235-E239 WeakPolarHBondContact O-CB 3.37Å; N235-E239 WeakPolarHBondContact O-CG 3.15Å; N235-E239 PolarHBondContact O-N 3.23Å; E239-R242 PolarHBondContact O-N 3.45Å; E239-G243 WeakPolarHBondContact O-CA 3.26Å; E239-G243 PolarHBondContact O-N 2.77Å
240	F	73	Confident	65.1	Low	107 Å²	107	86.6 Å²	86.6	47%	0.469	44%	0.443	S	S	.	.	H	α-helix	trans	-65.4	-41.7	175.8	-176.5	-100.7	0	0	0	112.4	A159 D236 Y237 G243 R244	A159-F240 HydrophobicContact CB-CD1 4.44Å; A159-F240 HydrophobicContact CB-CE1 4.35Å; D236-F240 WeakPolarHBondContact O-CB 3.31Å; D236-F240 PolarHBondContact O-N 2.95Å; Y237-F240 PolarHBondContact O-N 3.13Å; F240-G243 PolarHBondContact O-N 3.34Å; F240-R244 PolarHBondContact O-N 3.19Å
241	S	68.3	Low	62.5	Low	40 Å²	40	92.2 Å²	92.2	28%	0.28	48%	0.482	S	S	.	.	H	α-helix	trans	-68.8	-37.7	175.4	54.2	0	0	0	0	112.4	Y237 E238 T245	Y237-S241 WeakPolarHBondContact O-CB 3.36Å; Y237-S241 PolarHBondContact O-N 3.22Å; Y237-S241 PolarHBondContact O-OG 2.81Å; E238-S241 VanDerWaalsContact CA-OG 3.29Å; E238-S241 WeakPolarHBondContact CA-OG 3.27Å; E238-S241 PolarHBondContact O-OG 3.46Å; S241-T245 PolarHBondContact O-N 2.85Å; S241-T245 PolarHBondContact O-OG1 2.71Å
242	R	64.4	Low	60.2	Low	159 Å²	159	96.1 Å²	96.1	60%	0.6	51%	0.51	S	S	*	.	H	α-helix	trans	-67.6	-34.5	169.6	-72.8	170.5	-176	168.3	6	112.5	E238 E239 T245 R246	E238-R242 VanDerWaalsContact O-CB 3.25Å; E238-R242 WeakPolarHBondContact O-CB 3.46Å; E238-R242 WeakPolarHBondContact O-CD 3.45Å; E238-R242 WeakPolarHBondContact O-CG 2.96Å; E238-R242 PolarHBondContact O-N 3.34Å; E239-R242 PolarHBondContact O-N 3.45Å; R242-T245 WeakPolarHBondContact O-CA 3.37Å; R242-T245 VanDerWaalsContact O-CB 3.29Å; R242-T245 WeakPolarHBondContact O-CB 3.31Å; R242-T245 PolarHBondContact O-N 2.94Å; R242-T245 VanDerWaalsContact O-N 3.11Å; R242-R246 PolarHBondContact O-N 2.63Å
243	G	55.8	Low	57.6	Low	32 Å²	32	98.9 Å²	98.9	33%	0.33	53%	0.525	S	S	.	.	H	α-helix	trans	-66.5	-40.4	178.2	0	0	0	0	0	112.8	E239 F240 T245 R246 S247	E239-G243 WeakPolarHBondContact O-CA 3.26Å; E239-G243 PolarHBondContact O-N 2.77Å; F240-G243 PolarHBondContact O-N 3.34Å; G243-T245 PolarHBondContact O-N 2.92Å; G243-R246 PolarHBondContact O-N 3.19Å; G243-S247 WeakPolarHBondContact O-CB 3.48Å; G243-S247 PolarHBondContact O-N 2.9Å; G243-S247 PolarHBondContact O-OG 3.11Å
244	R	51.6	Low	55	Low	122 Å²	122	107.7 Å²	107.7	46%	0.46	57%	0.566	S	S	.	*	H	α-helix	trans	-63.3	-26.5	169	-81.8	-173.9	-178.1	-179.5	0.7	113.2	F240 S247	F240-R244 PolarHBondContact O-N 3.19Å; R244-S247 WeakPolarHBondContact CA-OG 3.34Å
245	T	43	Very low	52.2	Low	111 Å²	111	111.2 Å²	111.2	68%	0.681	60%	0.603	S	S	*	*	H	α-helix	trans	-77.1	-32.8	175.3	-50.5	0	0	0	0	111.7	S241 R242 G243	S241-T245 PolarHBondContact O-N 2.85Å; S241-T245 PolarHBondContact O-OG1 2.71Å; R242-T245 WeakPolarHBondContact O-CA 3.37Å; R242-T245 VanDerWaalsContact O-CB 3.29Å; R242-T245 WeakPolarHBondContact O-CB 3.31Å; R242-T245 PolarHBondContact O-N 2.94Å; R242-T245 VanDerWaalsContact O-N 3.11Å; G243-T245 PolarHBondContact O-N 2.92Å
246	R	38.4	Very low	49.4	Very low	207 Å²	207	113.2 Å²	113.2	78%	0.781	62%	0.622	S	S	*	*	H	α-helix	trans	-83	-26.6	176.1	-80.8	-179.4	170.1	168.7	-3.3	114.6	R242 G243 L248 E249	R242-R246 PolarHBondContact O-N 2.63Å; G243-R246 PolarHBondContact O-N 3.19Å; R246-L248 VanDerWaalsContact C-N 3.25Å; R246-L248 PolarHBondContact O-N 3.44Å; R246-E249 PolarHBondContact O-N 3.03Å; R246-E249 VanDerWaalsContact O-N 3.13Å
247	S	41	Very low	46.7	Very low	97 Å²	97	117 Å²	117	68%	0.678	64%	0.642	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.5	7.8	-174.5	38.5	0	0	0	0	115.5	G243 R244	G243-S247 WeakPolarHBondContact O-CB 3.48Å; G243-S247 PolarHBondContact O-N 2.9Å; G243-S247 PolarHBondContact O-OG 3.11Å; R244-S247 WeakPolarHBondContact CA-OG 3.34Å
248	L	39.7	Very low	44	Very low	163 Å²	163	119.9 Å²	119.9	85%	0.853	68%	0.678	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.3	-1.9	163.2	-79.4	159.6	0	0	0	112.9	R246	R246-L248 VanDerWaalsContact C-N 3.25Å; R246-L248 PolarHBondContact O-N 3.44Å
249	E	35.9	Very low	41.3	Very low	172 Å²	172	127.3 Å²	127.3	80%	0.804	71%	0.712	S	S	*	*	S	Bend	trans	-121.5	110.7	170.7	-75.7	-175.5	161.6	0	0	110.8	R246	R246-E249 PolarHBondContact O-N 3.03Å; R246-E249 VanDerWaalsContact O-N 3.13Å
250	G	30.3	Very low	38.8	Very low	79 Å²	79	129.5 Å²	129.5	81%	0.814	72%	0.722	S	S	*	*			trans	101.6	100.7	154	0	0	0	0	0	117
251	S	28.1	Very low	36.4	Very low	118 Å²	118	131.6 Å²	131.6	83%	0.825	74%	0.738	S	S	*	*			trans	-66.5	158.6	150.8	-55.1	0	0	0	0	110.5
252	P	34.9	Very low	34.3	Very low	127 Å²	127	135.9 Å²	135.9	83%	0.825	77%	0.766	S	S	*	*			trans	-83.8	134.9	-168.5	32.6	-30.9	0	0	0	111.9
253	E	28.8	Very low	32.4	Very low	194 Å²	194	131.9 Å²	131.9	91%	0.907	78%	0.775	S	S	*	*			trans	-105.6	126.8	157	-74.6	-161.6	166.4	0	0	109.7
254	E	28.6	Very low	30.8	Very low	198 Å²	198	138 Å²	138	93%	0.925	80%	0.799	S	S	*	*			trans	-66.7	145.9	168.8	-61.8	-179	147	0	0	110.8
255	G	25.1	Very low	29.5	Very low	74 Å²	74	141 Å²	141	76%	0.763	82%	0.821	S	S	*	*			trans	155.7	86.9	158.9	0	0	0	0	0	117.8
256	S	25.1	Very low	28.6	Very low	110 Å²	110	141.2 Å²	141.2	77%	0.769	82%	0.822	S	S	*	*			trans	68.1	110.8	137	-167.7	0	0	0	0	121.3
257	N	25.7	Very low	28	Very low	162 Å²	162	138.5 Å²	138.5	87%	0.866	82%	0.821	S	S	*	*			trans	30.4	124.2	130.6	-63.9	-10.2	0	0	0	120.2
258	G	25.8	Very low	27.2	Very low	80 Å²	80	138.7 Å²	138.7	83%	0.825	82%	0.823	S	S	*	*			trans	175.7	102	155.3	0	0	0	0	0	112
259	E	25.6	Very low	26.5	Very low	191 Å²	191	138.7 Å²	138.7	89%	0.893	82%	0.823	S	S	*	*			trans	-68.1	171.4	170.5	-64.9	173.7	136	0	0	112.2
260	E	25.1	Very low	26.2	Very low	176 Å²	176	135.9 Å²	135.9	82%	0.822	82%	0.823	S	S	*	*			trans	94.1	108.7	156.8	-76.2	-170.7	142.6	0	0	121.3
261	L	24	Very low	26.5	Very low	152 Å²	152	137.6 Å²	137.6	80%	0.796	82%	0.82	S	S	*	*				77.3	111.2	110.9	-152.2	74.3	0	0	0	119.8
262	C	23.2	Very low	26.6	Very low	130 Å²	130	143.7 Å²	143.7	88%	0.878	83%	0.825	S	S	*	*			trans	-14.6	122.4	146.5	-149.7	0	0	0	0	116
263	G	24.5	Very low	26.4	Very low	75 Å²	75	146.3 Å²	146.3	77%	0.773	83%	0.826	S	S	*	*			trans	-153.4	94.3	174.5	0	0	0	0	0	112.2
264	L	22.9	Very low	26.5	Very low	160 Å²	160	145.5 Å²	145.5	84%	0.838	82%	0.822	S	S	*	*			trans	-55.4	128.3	167.7	-179.2	81.3	0	0	0	111.7
265	M	23	Very low	26.6	Very low	186 Å²	186	143.5 Å²	143.5	92%	0.916	82%	0.817	S	S	*	*			trans	-152.2	126.9	141.9	-79.4	-152.5	172.5	0	0	111.7
266	T	23.9	Very low	27	Very low	114 Å²	114	144.7 Å²	144.7	70%	0.699	81%	0.814	S	S	*	*			trans	-66.7	156.5	165.8	40.7	0	0	0	0	110.3
267	I	27	Very low	27.5	Very low	150 Å²	150	146.7 Å²	146.7	77%	0.769	81%	0.811	S	S	*	*				-179.4	143.1	88.1	-81.6	165.4	0	0	0	110.8
268	S	24.1	Very low	28	Very low	102 Å²	102	144.1 Å²	144.1	71%	0.713	81%	0.806	S	S	*	*			trans	75.2	104	148.6	65.1	0	0	0	0	124.6
269	D	25.5	Very low	28.6	Very low	163 Å²	163	146.7 Å²	146.7	87%	0.872	80%	0.797	S	S	*	*				30.2	121.5	118.1	-75.2	-28.3	0	0	0	122.3
270	S	28.2	Very low	29.3	Very low	113 Å²	113	140.5 Å²	140.5	79%	0.79	77%	0.772	S	S	*	*				-169.7	152.8	100.3	52.7	0	0	0	0	112.2
271	P	37.1	Very low	30.6	Very low	115 Å²	115	139 Å²	139	75%	0.747	77%	0.769	S	S	*	*			trans	-100.3	137	-162.7	36.1	-28.9	0	0	0	113
272	R	30.3	Very low	32.9	Very low	246 Å²	246	134.1 Å²	134.1	93%	0.928	74%	0.744	S	S	*	*			trans	-138.9	104.9	152.7	-78.8	-169.3	177.2	175.5	-0.8	108.7	Q274	R272-Q274 PolarHBondContact O-N 3.03Å
273	E	30.3	Very low	35.9	Very low	182 Å²	182	132.7 Å²	132.7	85%	0.85	72%	0.723	S	S	*	*			trans	-55	114.4	170.9	-67	167	161.6	0	0	109.3
274	Q	32.1	Very low	39.2	Very low	177 Å²	177	132.2 Å²	132.2	83%	0.827	70%	0.704	S	S	*	*			trans	-99.7	100.9	151.8	-81.4	-173.3	-25.9	0	0	105.6	R272 S276	R272-Q274 PolarHBondContact O-N 3.03Å; Q274-S276 PolarHBondContact O-N 3.26Å
275	D	31	Very low	42.6	Very low	155 Å²	155	125 Å²	125	83%	0.829	67%	0.666	S	S	*	*			trans	-59.5	95.3	161.2	-84.1	-28.1	0	0	0	107.9	E277	D275-E277 PolarHBondContact O-N 3.34Å
276	S	33.6	Very low	45.9	Very low	99 Å²	99	121 Å²	121	69%	0.692	65%	0.645	S	S	*	*			trans	-90.4	87.8	161.1	-62.2	0	0	0	0	106.3	Q274 S278	Q274-S276 PolarHBondContact O-N 3.26Å; S276-S278 PolarHBondContact O-N 2.88Å
277	E	34.3	Very low	49.2	Very low	152 Å²	152	116.2 Å²	116.2	71%	0.71	62%	0.615	S	S	*	*			trans	-60.9	93.9	160.1	-78.3	-169.6	172	0	0	107.9	D275 Q279	D275-E277 PolarHBondContact O-N 3.34Å; E277-Q279 PolarHBondContact O-N 3.35Å; E277-Q279 PolarHBondContact OE2-NE2 3.48Å; E277-Q279 VanDerWaalsContact OE2-NE2 3.1Å
278	S	36.6	Very low	52.4	Low	109 Å²	109	116 Å²	116	76%	0.762	61%	0.608	S	S	*	*			trans	-69.6	75.6	164.6	163.5	0	0	0	0	108.4	S276 T280	S276-S278 PolarHBondContact O-N 2.88Å; S278-T280 PolarHBondContact O-N 3.2Å
279	Q	38.3	Very low	55.6	Low	134 Å²	134	112 Å²	112	63%	0.626	58%	0.58	S	S	*	*			trans	-68.1	108.7	162.1	-67.6	179	12.1	0	0	107.1	E277 L281	E277-Q279 PolarHBondContact O-N 3.35Å; E277-Q279 PolarHBondContact OE2-NE2 3.48Å; E277-Q279 VanDerWaalsContact OE2-NE2 3.1Å; Q279-L281 PolarHBondContact O-N 3.28Å
280	T	40.5	Very low	58.7	Low	61 Å²	61	110.3 Å²	110.3	37%	0.374	57%	0.565	S	S	.	*			trans	-60.6	92.5	161.3	47.9	0	0	0	0	107	S278 D282	S278-T280 PolarHBondContact O-N 3.2Å; T280-D282 PolarHBondContact O-N 3.25Å
281	L	52.9	Low	61.8	Low	143 Å²	143	107.3 Å²	107.3	75%	0.749	54%	0.543	S	S	*	.			trans	-68	103.1	176.3	-88.9	154.3	0	0	0	107.9	Q279 K283	Q279-L281 PolarHBondContact O-N 3.28Å; L281-K283 PolarHBondContact O-N 3.27Å
282	D	71.1	Confident	64.6	Low	51 Å²	51	102.4 Å²	102.4	27%	0.273	51%	0.51	S	S	.	.			trans	-42.4	130.3	168.6	-70.3	-23.4	0	0	0	109.2	T280 V284 E441 K532	T280-D282 PolarHBondContact O-N 3.25Å; D282-V284 WeakPolarHBondContact O-CG2 3.4Å; D282-V284 PolarHBondContact O-N 2.92Å; D282-E441 VanDerWaalsContact OD1-CD 3.28Å; D282-K532 HydrophobicContact CB-CD 4.07Å; D282-K532 WeakPolarHBondContact OD2-CE 3.24Å; D282-K532 IonicContact OD2-NZ 3.07Å; D282-K532 PolarHBondContact OD2-NZ 3.49Å
283	K	87.3	Confident	67.8	Low	100 Å²	100	90.7 Å²	90.7	44%	0.435	47%	0.465	S	S	.	.			trans	-69.1	112.5	-179.6	-69.4	171	-176.4	152.3	0	109.2	L281 D443 K531 K532	L281-K283 PolarHBondContact O-N 3.27Å; K283-D443 VanDerWaalsContact CE-OD1 3.31Å; K283-D443 WeakPolarHBondContact CE-OD1 3.09Å; K283-D443 IonicContact NZ-OD1 3.44Å; K283-D443 PolarHBondContact NZ-OD1 3.09Å; K283-K531 HydrophobicContact CB-CD 4.29Å; K283-K531 HydrophobicContact CB-CG 3.97Å; K283-K531 CarbonylContact O-C 3.59Å; K283-K531 WeakPolarHBondContact O-CA 3.42Å; K283-K531 WeakPolarHBondContact O-CB 3.42Å; K283-K532 PolarHBondContact O-N 2.95Å
284	V	93.7	Very high	71	Confident	64 Å²	64	83.7 Å²	83.7	39%	0.388	43%	0.431	S	S	.	.	B	Isolated β-bridge	trans	-104.4	144.6	178.1	-173.3	0	0	0	0	110.8	D282 K532 V534	D282-V284 WeakPolarHBondContact O-CG2 3.4Å; D282-V284 PolarHBondContact O-N 2.92Å; V284-K532 CarbonylContact C-O 3.44Å; V284-K532 WeakPolarHBondContact CA-O 3.15Å; V284-K532 WeakPolarHBondContact CG1-O 3.36Å; V284-K532 HydrophobicContact CG2-CB 4.22Å; V284-V534 HydrophobicContact CG1-CG2 3.51Å
285	Y	93.4	Very high	74.1	Confident	9 Å²	9	75.2 Å²	75.2	4%	0.035	39%	0.392	C	S	.	.			trans	-65.1	139.2	169.2	-74.9	-73.9	0	0	0	110.7	M287 P411 D457 L529 R530 K531 K532 L533	Y285-M287 PolarHBondContact O-N 2.9Å; Y285-P411 HydrophobicContact CD1-CG 4.42Å; Y285-P411 HydrophobicContact CG-CG 4.24Å; Y285-D457 HydrophobicContact CE1-CB 4.34Å; Y285-D457 WeakPolarHBondContact CE1-OD1 3.36Å; Y285-D457 PolarHBondContact OH-OD1 2.92Å; Y285-L529 HydrophobicContact CE2-CB 4.21Å; Y285-L529 HydrophobicContact CE2-CD2 3.88Å; Y285-L529 HydrophobicContact CE2-CG 4.5Å; Y285-L529 WeakPolarHBondContact OH-CA 3.36Å; Y285-R530 PolarHBondContact OH-N 3.44Å; Y285-K531 HydrophobicContact CD1-CB 4.18Å; Y285-K531 HydrophobicContact CD1-CD 4.15Å; Y285-K531 HydrophobicContact CD2-CB 3.63Å; Y285-K531 WeakPolarHBondContact CD2-O 3.46Å; Y285-K531 HydrophobicContact CE1-CB 4.15Å; Y285-K531 HydrophobicContact CE1-CD 4.33Å; Y285-K531 HydrophobicContact CE1-CG 4.39Å; Y285-K531 HydrophobicContact CE2-CB 3.6Å; Y285-K531 WeakPolarHBondContact CE2-O 3.42Å; Y285-K531 HydrophobicContact CG-CB 3.93Å; Y285-K531 HydrophobicContact CG-CD 4.46Å; Y285-K532 WeakPolarHBondContact CD2-O 3.47Å; Y285-K532 PolarHBondContact N-O 3.16Å; Y285-L533 HydrophobicContact CD2-CB 3.94Å; Y285-L533 HydrophobicContact CD2-CD1 4.25Å; Y285-L533 HydrophobicContact CE2-CB 4.45Å
286	Q	92.9	Very high	77.3	Confident	103 Å²	103	67.9 Å²	67.9	48%	0.481	35%	0.353	S	S	.	.			trans	-61.2	131.5	170.5	-175.8	179.7	-77.1	0	0	109.1	K288 D367	Q286-K288 HydrophobicContact CG-CD 3.86Å; Q286-K288 HydrophobicContact CG-CG 3.83Å; Q286-D367 PolarHBondContact NE2-OD1 3.33Å; Q286-D367 WeakPolarHBondContact O-CB 3.4Å
287	M	94.2	Very high	80.4	Confident	13 Å²	13	63.1 Å²	63.1	6%	0.064	32%	0.32	C	S	.	.			trans	-145.8	59.7	-178.6	-159.5	61.1	60.4	0	0	109.9	Y285 R292 D367 C368 P411 L533 V534 F535	Y285-M287 PolarHBondContact O-N 2.9Å; M287-R292 PolarHBondContact O-NE 3.03Å; M287-R292 VanDerWaalsContact O-NE 3.11Å; M287-R292 PolarHBondContact O-NH1 3.43Å; M287-R292 PolarHBondContact O-NH2 3.04Å; M287-R292 HydrophobicContact SD-CB 4.42Å; M287-D367 HydrophobicContact SD-CB 4.11Å; M287-C368 HydrophobicContact CE-CB 3.84Å; M287-C368 HydrophobicContact SD-CB 3.81Å; M287-P411 HydrophobicContact CE-CG 3.92Å; M287-L533 HydrophobicContact CE-CD1 3.34Å; M287-V534 WeakPolarHBondContact CG-O 3.43Å; M287-F535 HydrophobicContact CE-CD1 4.08Å; M287-F535 HydrophobicContact CE-CE1 3.82Å; M287-F535 HydrophobicContact CG-CD1 4.03Å; M287-F535 HydrophobicContact SD-CD1 3.96Å; M287-F535 HydrophobicContact SD-CE1 4.06Å
288	K	93.1	Very high	83.5	Confident	144 Å²	144	55.9 Å²	55.9	63%	0.626	29%	0.286	S	S	*	.			trans	-123	-15.6	-169.7	74.7	-173.4	-174	-161.8	0	114.9	Q286 R292 D367	Q286-K288 HydrophobicContact CG-CD 3.86Å; Q286-K288 HydrophobicContact CG-CG 3.83Å; K288-R292 PolarHBondContact O-NH1 3.21Å; K288-D367 PolarHBondContact N-OD2 3.08Å
289	S	92	Very high	86.4	Confident	18 Å²	18	51.3 Å²	51.3	13%	0.126	25%	0.253	C	S	.	.			trans	-62.8	148.1	176.1	50.7	0	0	0	0	112.4	P291 R292 N365 D367	S289-P291 CarbonylContact C-O 3.52Å; S289-P291 CarbonylContact O-C 3.48Å; S289-P291 PolarHBondContact OG-O 3.19Å; S289-R292 WeakPolarHBondContact O-CA 3.08Å; S289-R292 WeakPolarHBondContact O-CD 3.45Å; S289-R292 WeakPolarHBondContact O-CG 3.45Å; S289-R292 PolarHBondContact O-N 3.08Å; S289-R292 PolarHBondContact O-NH1 3.41Å; S289-R292 WeakPolarHBondContact OG-CA 3.19Å; S289-R292 PolarHBondContact OG-O 3.08Å; S289-N365 VanDerWaalsContact CB-O 3.3Å; S289-N365 WeakPolarHBondContact CB-O 3.34Å; S289-D367 VanDerWaalsContact CB-OD2 3.27Å; S289-D367 WeakPolarHBondContact CB-OD2 3.23Å; S289-D367 PolarHBondContact N-OD2 3.34Å; S289-D367 WeakPolarHBondContact OG-CB 3.5Å; S289-D367 PolarHBondContact OG-N 2.83Å; S289-D367 VanDerWaalsContact OG-N 3.13Å; S289-D367 PolarHBondContact OG-OD2 2.84Å
290	K	90.4	Very high	89.1	Confident	129 Å²	129	45 Å²	45	56%	0.561	22%	0.223	S	C	*	.	S	Bend	trans	-132.1	112.5	173.1	-69.6	-169.6	-178.7	-178.9	0	108.4	D538	K290-D538 WeakPolarHBondContact CE-OD1 3.46Å; K290-D538 IonicContact NZ-OD1 3.73Å; K290-D538 PolarHBondContact NZ-OD1 3.49Å; K290-D538 IonicContact NZ-OD2 2.84Å; K290-D538 PolarHBondContact NZ-OD2 3.41Å
291	P	93.7	Very high	91.8	Very high	49 Å²	49	46.3 Å²	46.3	32%	0.318	22%	0.222	S	C	.	.	S	Bend	cis	-66.3	152.1	-4	30.3	-36.7	0	0	0	112.5	S289 G293 H337 E339 K366	S289-P291 CarbonylContact C-O 3.52Å; S289-P291 CarbonylContact O-C 3.48Å; S289-P291 PolarHBondContact OG-O 3.19Å; P291-G293 PolarHBondContact O-N 3.31Å; P291-H337 WeakPolarHBondContact CA-O 3.26Å; P291-E339 HydrophobicContact CB-CB 4.02Å; P291-E339 HydrophobicContact CG-CB 4.33Å; P291-K366 HydrophobicContact CG-CD 4.08Å; P291-K366 WeakPolarHBondContact O-CD 3.36Å
292	R	94.9	Very high	93.8	Very high	12 Å²	12	42.5 Å²	42.5	5%	0.045	20%	0.202	C	C	.	.			trans	-63	-32.2	179.6	-67.7	-76.1	-169.1	-116.5	7.2	112.8	M287 K288 S289 L336 H337 F338 D367 C368	M287-R292 PolarHBondContact O-NE 3.03Å; M287-R292 VanDerWaalsContact O-NE 3.11Å; M287-R292 PolarHBondContact O-NH1 3.43Å; M287-R292 PolarHBondContact O-NH2 3.04Å; M287-R292 HydrophobicContact SD-CB 4.42Å; K288-R292 PolarHBondContact O-NH1 3.21Å; S289-R292 WeakPolarHBondContact O-CA 3.08Å; S289-R292 WeakPolarHBondContact O-CD 3.45Å; S289-R292 WeakPolarHBondContact O-CG 3.45Å; S289-R292 PolarHBondContact O-N 3.08Å; S289-R292 PolarHBondContact O-NH1 3.41Å; S289-R292 WeakPolarHBondContact OG-CA 3.19Å; S289-R292 PolarHBondContact OG-O 3.08Å; R292-L336 WeakPolarHBondContact CG-O 3.5Å; R292-H337 HydrophobicContact CG-CB 4Å; R292-H337 PolarHBondContact N-O 2.94Å; R292-F338 HydrophobicContact CB-CD1 4.24Å; R292-F338 HydrophobicContact CB-CD2 4.17Å; R292-F338 HydrophobicContact CB-CE1 4.03Å; R292-F338 HydrophobicContact CB-CE2 3.96Å; R292-F338 HydrophobicContact CB-CG 4.3Å; R292-F338 HydrophobicContact CB-CZ 3.88Å; R292-F338 HydrophobicContact CG-CE2 4.4Å; R292-D367 PolarHBondContact O-N 3.17Å; R292-C368 PolarHBondContact O-N 2.75Å
293	G	96.8	Very high	94.9	Very high	0 Å²	0	40 Å²	40	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	175	171.3	-166.3	0	0	0	0	0	112.1	P291 E339 C368	P291-G293 PolarHBondContact O-N 3.31Å; G293-E339 PolarHBondContact O-N 3.14Å; G293-C368 WeakPolarHBondContact CA-O 3.14Å
294	Y	98.1	Very high	95.1	Very high	35 Å²	35	37.5 Å²	37.5	14%	0.137	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	141.1	162.4	-64.2	-75.5	0	0	0	109.5	E339 Q341 Y358 M361 H363 K366 I370	Y294-E339 WeakPolarHBondContact CA-O 3.26Å; Y294-E339 HydrophobicContact CD1-CB 4.22Å; Y294-E339 HydrophobicContact CD1-CG 4.23Å; Y294-E339 HydrophobicContact CE1-CG 4.35Å; Y294-E339 WeakPolarHBondContact CE1-OE1 3.48Å; Y294-E339 VanDerWaalsContact CE1-OE2 3.26Å; Y294-E339 WeakPolarHBondContact CE1-OE2 3.42Å; Y294-Q341 HydrophobicContact CD1-CG 4.21Å; Y294-Y358 AromaticContact CD1-CE1 3.94Å; Y294-Y358 HydrophobicContact CD1-CE1 3.94Å; Y294-Y358 HydrophobicContact CD2-CD1 4.24Å; Y294-Y358 HydrophobicContact CD2-CE1 4.44Å; Y294-Y358 HydrophobicContact CE1-CE1 4.25Å; Y294-Y358 HydrophobicContact CG-CD1 4.17Å; Y294-Y358 HydrophobicContact CG-CE1 4.02Å; Y294-M361 HydrophobicContact CE2-SD 4.31Å; Y294-H363 AromaticContact CD2-CE1 3.62Å; Y294-H363 AromaticContact CD2-ND1 3.63Å; Y294-H363 AromaticContact CE2-CE1 3.97Å; Y294-H363 AromaticContact CE2-ND1 3.92Å; Y294-K366 HydrophobicContact CE2-CG 4.5Å; Y294-I370 PolarHBondContact O-N 3.11Å
295	C	98.1	Very high	95.1	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	104.3	167.1	-179	0	0	0	0	108.6	F333 F338 E339 I340 Q341 I370	C295-F333 HydrophobicContact CB-CB 4.4Å; C295-F338 HydrophobicContact CB-CB 4.01Å; C295-F338 HydrophobicContact CB-CD1 4.44Å; C295-F338 HydrophobicContact CB-CG 4.49Å; C295-E339 PolarHBondContact N-O 3.1Å; C295-I340 HydrophobicContact CB-CD1 3.6Å; C295-I340 WeakPolarHBondContact O-CA 3.31Å; C295-Q341 PolarHBondContact O-N 3.3Å; C295-I370 CarbonylContact C-O 3.41Å; C295-I370 VanDerWaalsContact CA-O 3.32Å; C295-I370 WeakPolarHBondContact CA-O 3.42Å; C295-I370 HydrophobicContact CB-CB 4.17Å
296	L	98.4	Very high	95	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82	131.4	176.7	-49.5	-171.5	0	0	0	109.2	Q341 I354 L355 Y358 F369 I370 C371 C372	L296-Q341 HydrophobicContact CD2-CB 3.69Å; L296-Q341 HydrophobicContact CD2-CG 4.19Å; L296-I354 HydrophobicContact CD1-CG2 4.33Å; L296-L355 HydrophobicContact CD1-CD2 4.01Å; L296-Y358 HydrophobicContact CD1-CD2 3.5Å; L296-Y358 VanDerWaalsContact CD1-CD2 3.5Å; L296-Y358 HydrophobicContact CD1-CE2 4Å; L296-Y358 HydrophobicContact CD1-CG 3.85Å; L296-Y358 HydrophobicContact CD2-CD1 3.88Å; L296-Y358 HydrophobicContact CD2-CD2 3.65Å; L296-Y358 HydrophobicContact CD2-CE1 3.63Å; L296-Y358 HydrophobicContact CD2-CE2 3.39Å; L296-Y358 HydrophobicContact CD2-CG 3.9Å; L296-Y358 HydrophobicContact CG-CD2 4.24Å; L296-Y358 HydrophobicContact CG-CE2 4.36Å; L296-Y358 HydrophobicContact CG-CG 4.46Å; L296-F369 HydrophobicContact CD1-CE2 3.94Å; L296-F369 HydrophobicContact CD1-CZ 3.72Å; L296-F369 HydrophobicContact CG-CE2 3.95Å; L296-F369 HydrophobicContact CG-CZ 4.02Å; L296-I370 PolarHBondContact N-O 3.46Å; L296-C371 HydrophobicContact CB-CB 4.46Å; L296-C372 PolarHBondContact O-N 3.39Å
297	I	98.3	Very high	95	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	101.1	173.7	-56.7	178.1	0	0	0	108.2	N299 A326 L329 T330 I340 Q341 H343 C372 L374	I297-N299 HydrophobicContact CG2-CB 4.49Å; I297-A326 HydrophobicContact CG2-CB 4.1Å; I297-L329 HydrophobicContact CD1-CB 3.81Å; I297-T330 WeakPolarHBondContact CD1-OG1 3.26Å; I297-I340 HydrophobicContact CD1-CG2 3.55Å; I297-I340 HydrophobicContact CG1-CG2 4.13Å; I297-Q341 PolarHBondContact N-O 2.8Å; I297-H343 PolarHBondContact O-N 2.94Å; I297-C372 HydrophobicContact CG1-CB 4.43Å; I297-L374 HydrophobicContact CG2-CD1 4.5Å
298	I	98.1	Very high	94.9	Very high	0 Å²	0	44 Å²	44	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	107.1	174.1	-56.3	-178.9	0	0	0	108	H343 C346 I351 L355 C372 I373 L374	I298-H343 CarbonylContact C-O 3.48Å; I298-H343 WeakPolarHBondContact CA-O 3.48Å; I298-H343 HydrophobicContact CG1-CB 4.33Å; I298-C346 HydrophobicContact CG2-CB 4.18Å; I298-I351 HydrophobicContact CD1-CG1 4.33Å; I298-I351 HydrophobicContact CD1-CG2 3.96Å; I298-I351 HydrophobicContact CG2-CD1 4.27Å; I298-I351 HydrophobicContact CG2-CG1 4.12Å; I298-L355 HydrophobicContact CD1-CD2 4.48Å; I298-C372 PolarHBondContact N-O 3.2Å; I298-I373 HydrophobicContact CD1-CG1 4.36Å; I298-L374 PolarHBondContact O-N 3.4Å
299	N	97.6	Very high	94.8	Very high	13 Å²	13	43.9 Å²	43.9	7%	0.07	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	99.1	-172.3	-175.2	29.6	0	0	0	111.1	I297 T322 A326 H343 N344 D345 L374	I297-N299 HydrophobicContact CG2-CB 4.49Å; N299-T322 WeakPolarHBondContact OD1-CB 3.22Å; N299-T322 WeakPolarHBondContact OD1-CG2 3.35Å; N299-T322 PolarHBondContact OD1-O 3.19Å; N299-T322 PolarHBondContact OD1-OG1 3.43Å; N299-A326 HydrophobicContact CB-CB 4.36Å; N299-H343 PolarHBondContact N-O 3.43Å; N299-N344 WeakPolarHBondContact O-CA 3.35Å; N299-D345 PolarHBondContact O-N 3.47Å; N299-L374 HydrophobicContact CB-CD1 4.46Å
300	N	96.8	Very high	94.7	Very high	0 Å²	0	43.9 Å²	43.9	0%	0	20%	0.202	C	C	.	.			trans	-96	114.3	-179.3	-72.3	-8.6	0	0	0	110.7	F303 R319 C346 L374 S375 Y383 T385	N300-F303 HydrophobicContact CB-CE2 4.01Å; N300-F303 HydrophobicContact CB-CZ 3.72Å; N300-R319 VanDerWaalsContact O-CD 3.31Å; N300-R319 WeakPolarHBondContact O-CD 3.48Å; N300-R319 PolarHBondContact O-NH1 3.25Å; N300-C346 PolarHBondContact ND2-O 3.35Å; N300-C346 PolarHBondContact OD1-N 2.85Å; N300-C346 PolarHBondContact OD1-O 2.98Å; N300-L374 PolarHBondContact N-O 3.12Å; N300-S375 PolarHBondContact ND2-OG 3.18Å; N300-Y383 PolarHBondContact ND2-O 3.01Å; N300-T385 HydrophobicContact CB-CG2 3.98Å
301	Y	95.3	Very high	94.6	Very high	89 Å²	89	43.1 Å²	43.1	35%	0.349	21%	0.21	S	C	.	.			trans	-105.5	-53	178.9	169.3	-96.6	0	0	0	112.1	F303 D318 R319 N320 T322 D345	Y301-F303 WeakPolarHBondContact O-CD2 3.19Å; Y301-D318 HydrophobicContact CE1-CB 4.4Å; Y301-D318 HydrophobicContact CE2-CB 4.38Å; Y301-D318 WeakPolarHBondContact O-CA 3.18Å; Y301-D318 WeakPolarHBondContact O-CB 3.22Å; Y301-R319 PolarHBondContact O-N 3.47Å; Y301-N320 WeakPolarHBondContact CE2-OD1 3.37Å; Y301-N320 PolarHBondContact OH-OD1 3.06Å; Y301-N320 VanDerWaalsContact OH-OD1 3.09Å; Y301-T322 HydrophobicContact CD2-CG2 4.11Å; Y301-D345 WeakPolarHBondContact CA-OD1 3.26Å; Y301-D345 PolarHBondContact N-OD1 3.21Å
302	D	94.9	Very high	94.3	Very high	63 Å²	63	47.2 Å²	47.2	34%	0.337	22%	0.223	S	C	.	.			trans	-92.5	116.5	-170.9	179.8	10.5	0	0	0	111.9	T304 D345 T385	D302-T304 WeakPolarHBondContact OD1-CB 3.36Å; D302-T304 PolarHBondContact OD1-N 3.15Å; D302-T304 PolarHBondContact OD1-OG1 3Å; D302-D345 PolarHBondContact N-OD1 2.84Å; D302-T385 VanDerWaalsContact O-CB 3.25Å; D302-T385 WeakPolarHBondContact O-CB 3.38Å; D302-T385 WeakPolarHBondContact O-CG2 3.41Å
303	F	94.3	Very high	93.9	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	23%	0.225	C	C	.	.			trans	-111.4	24	177.4	-70.5	-96.8	0	0	0	112.5	N300 Y301 K305 A306 R307 I316 D318 R319 S375 H376 G384	N300-F303 HydrophobicContact CB-CE2 4.01Å; N300-F303 HydrophobicContact CB-CZ 3.72Å; Y301-F303 WeakPolarHBondContact O-CD2 3.19Å; F303-K305 VanDerWaalsContact C-N 3.28Å; F303-K305 PolarHBondContact O-N 3.27Å; F303-A306 HydrophobicContact CB-CB 4.13Å; F303-A306 HydrophobicContact CD1-CB 4.2Å; F303-A306 WeakPolarHBondContact O-CB 3.25Å; F303-A306 PolarHBondContact O-N 3.09Å; F303-A306 VanDerWaalsContact O-N 3.09Å; F303-R307 PolarHBondContact O-N 2.63Å; F303-I316 HydrophobicContact CB-CG2 3.73Å; F303-I316 HydrophobicContact CD1-CD1 4.13Å; F303-I316 HydrophobicContact CG-CD1 4.46Å; F303-D318 PolarHBondContact N-OD1 3Å; F303-R319 HydrophobicContact CD2-CG 4.43Å; F303-R319 HydrophobicContact CE2-CG 3.84Å; F303-S375 WeakPolarHBondContact CZ-OG 3.48Å; F303-H376 AromaticContact CD2-CD2 3.65Å; F303-H376 HydrophobicContact CE1-CB 4.32Å; F303-H376 AromaticContact CE1-CD2 3.92Å; F303-H376 AromaticContact CE2-CD2 3.49Å; F303-H376 VanDerWaalsContact CE2-CD2 3.49Å; F303-H376 WeakPolarHBondContact CE2-CD2 3.36Å; F303-H376 AromaticContact CG-CD2 3.96Å; F303-H376 HydrophobicContact CZ-CB 4.28Å; F303-H376 AromaticContact CZ-CD2 3.62Å; F303-G384 WeakPolarHBondContact CE1-O 3.41Å
304	T	93.3	Very high	93.4	Very high	47 Å²	47	53.5 Å²	53.5	29%	0.288	25%	0.253	S	S	.	.	H	α-helix	trans	-55.5	-43.9	177.1	-59.6	0	0	0	0	111.8	D302 A306 R307 E308	D302-T304 WeakPolarHBondContact OD1-CB 3.36Å; D302-T304 PolarHBondContact OD1-N 3.15Å; D302-T304 PolarHBondContact OD1-OG1 3Å; T304-A306 VanDerWaalsContact C-N 3.32Å; T304-A306 PolarHBondContact O-N 2.9Å; T304-R307 WeakPolarHBondContact O-CB 3.37Å; T304-R307 PolarHBondContact O-N 3.4Å; T304-R307 PolarHBondContact OG1-NH2 3.16Å; T304-E308 WeakPolarHBondContact O-CG 3.18Å; T304-E308 PolarHBondContact O-N 3.45Å
305	K	92.6	Very high	92.7	Very high	109 Å²	109	56 Å²	56	47%	0.474	28%	0.276	S	S	.	.	H	α-helix	trans	-63	-37.9	177.1	-67.7	176.1	-177.1	170.2	0	112.3	F303 E308 K309	F303-K305 VanDerWaalsContact C-N 3.28Å; F303-K305 PolarHBondContact O-N 3.27Å; K305-E308 PolarHBondContact O-N 2.92Å; K305-K309 VanDerWaalsContact O-CB 3.28Å; K305-K309 WeakPolarHBondContact O-CB 3.43Å; K305-K309 WeakPolarHBondContact O-CG 3.48Å; K305-K309 PolarHBondContact O-N 3.31Å
306	A	91.9	Very high	92.2	Very high	0 Å²	0	57.1 Å²	57.1	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-63.3	-44.5	174.9	0	0	0	0	0	111.3	F303 T304 E308 K309 V310 L313 I316 T385 G387	F303-A306 HydrophobicContact CB-CB 4.13Å; F303-A306 HydrophobicContact CD1-CB 4.2Å; F303-A306 WeakPolarHBondContact O-CB 3.25Å; F303-A306 PolarHBondContact O-N 3.09Å; F303-A306 VanDerWaalsContact O-N 3.09Å; T304-A306 VanDerWaalsContact C-N 3.32Å; T304-A306 PolarHBondContact O-N 2.9Å; A306-E308 VanDerWaalsContact C-N 3.29Å; A306-E308 PolarHBondContact O-N 3.34Å; A306-K309 PolarHBondContact O-N 3.06Å; A306-V310 WeakPolarHBondContact O-CB 3.36Å; A306-V310 PolarHBondContact O-N 3.31Å; A306-L313 HydrophobicContact CB-CD1 4.25Å; A306-I316 HydrophobicContact CB-CG2 4.19Å; A306-T385 PolarHBondContact N-O 2.76Å; A306-G387 VanDerWaalsContact CB-CA 3.41Å
307	R	92.9	Very high	91.7	Very high	71 Å²	71	66.7 Å²	66.7	27%	0.268	32%	0.318	S	S	.	.	H	α-helix	trans	-59.9	-38.8	177	-70.7	-171	-74.3	-88.5	6.2	112.6	F303 T304 I316 D318	F303-R307 PolarHBondContact O-N 2.63Å; T304-R307 WeakPolarHBondContact O-CB 3.37Å; T304-R307 PolarHBondContact O-N 3.4Å; T304-R307 PolarHBondContact OG1-NH2 3.16Å; R307-I316 VanDerWaalsContact CD-O 3.31Å; R307-I316 WeakPolarHBondContact CD-O 3.21Å; R307-I316 HydrophobicContact CG-CG2 3.75Å; R307-I316 WeakPolarHBondContact CG-O 3.5Å; R307-I316 PolarHBondContact NH1-O 3.42Å; R307-D318 IonicContact CZ-OD1 2.62Å; R307-D318 IonicContact CZ-OD2 3.84Å; R307-D318 IonicContact NH1-OD1 2.87Å; R307-D318 PolarHBondContact NH1-OD1 2.78Å; R307-D318 IonicContact NH1-OD2 2.88Å; R307-D318 IonicContact NH2-OD1 3.93Å; R307-D318 PolarHBondContact NH2-OD1 3.27Å; R307-D318 VanDerWaalsContact NH2-OD1 3.16Å; R307-D318 IonicContact NH2-OD2 3.91Å; R307-D318 PolarHBondContact NH2-OD2 2.65Å; R307-D318 VanDerWaalsContact NH2-OD2 3.07Å
308	E	92.6	Very high	91.3	Very high	144 Å²	144	68.3 Å²	68.3	67%	0.673	33%	0.327	S	S	*	.	H	α-helix	trans	-76.5	-43.4	-179.6	-70.9	174.8	179.4	0	0	113	T304 K305 A306	T304-E308 WeakPolarHBondContact O-CG 3.18Å; T304-E308 PolarHBondContact O-N 3.45Å; K305-E308 PolarHBondContact O-N 2.92Å; A306-E308 VanDerWaalsContact C-N 3.29Å; A306-E308 PolarHBondContact O-N 3.34Å
309	K	90.5	Very high	90.9	Very high	143 Å²	143	68.5 Å²	68.5	62%	0.622	33%	0.327	S	S	*	.	H	α-helix	trans	-94.5	-24.9	-167.9	-66.3	-175.1	177	-172.2	0	114.5	K305 A306	K305-K309 VanDerWaalsContact O-CB 3.28Å; K305-K309 WeakPolarHBondContact O-CB 3.43Å; K305-K309 WeakPolarHBondContact O-CG 3.48Å; K305-K309 PolarHBondContact O-N 3.31Å; A306-K309 PolarHBondContact O-N 3.06Å
310	V	90.5	Very high	90.4	Very high	18 Å²	18	71.5 Å²	71.5	11%	0.109	34%	0.343	C	S	.	.			trans	-117.4	103.2	-172.5	-177.3	0	0	0	0	108.9	A306 K312 L313 H314	A306-V310 WeakPolarHBondContact O-CB 3.36Å; A306-V310 PolarHBondContact O-N 3.31Å; V310-K312 HydrophobicContact CG1-CD 4.44Å; V310-K312 HydrophobicContact CG1-CG 3.58Å; V310-K312 PolarHBondContact O-N 3.48Å; V310-K312 VanDerWaalsContact O-N 3.13Å; V310-L313 HydrophobicContact CB-CB 4.18Å; V310-L313 HydrophobicContact CB-CD1 4.17Å; V310-L313 HydrophobicContact CB-CG 4.2Å; V310-L313 HydrophobicContact CG1-CB 4.16Å; V310-L313 HydrophobicContact CG1-CD1 3.93Å; V310-L313 HydrophobicContact CG1-CG 3.74Å; V310-L313 PolarHBondContact O-N 2.94Å; V310-H314 PolarHBondContact O-N 2.59Å
311	P	87.3	Confident	90	Very high	112 Å²	112	71.7 Å²	71.7	73%	0.727	35%	0.345	S	S	*	.	G	3₁₀ helix	trans	-54.7	-37.6	-174.5	-29.3	35.4	0	0	0	113.9	L313 H314	P311-L313 PolarHBondContact O-N 2.95Å; P311-H314 PolarHBondContact O-CD2 3.17Å; P311-H314 PolarHBondContact O-N 3.01Å
312	K	87.3	Confident	89.7	Confident	135 Å²	135	67.5 Å²	67.5	59%	0.587	33%	0.328	S	S	*	.	G	3₁₀ helix	trans	-67.6	-19.2	177.8	65.3	172.2	-173.3	176.3	0	114.1	V310 E389	V310-K312 HydrophobicContact CG1-CD 4.44Å; V310-K312 HydrophobicContact CG1-CG 3.58Å; V310-K312 PolarHBondContact O-N 3.48Å; V310-K312 VanDerWaalsContact O-N 3.13Å; K312-E389 IonicContact NZ-OE1 3Å; K312-E389 PolarHBondContact NZ-OE1 3.2Å
313	L	86.5	Confident	89.6	Confident	18 Å²	18	68.8 Å²	68.8	9%	0.094	33%	0.332	C	S	.	.	G	3₁₀ helix	trans	-105.8	13.5	-178.4	-57.8	-177.7	0	0	0	112.8	A306 V310 P311 S315 I316 Y383 G387	A306-L313 HydrophobicContact CB-CD1 4.25Å; V310-L313 HydrophobicContact CB-CB 4.18Å; V310-L313 HydrophobicContact CB-CD1 4.17Å; V310-L313 HydrophobicContact CB-CG 4.2Å; V310-L313 HydrophobicContact CG1-CB 4.16Å; V310-L313 HydrophobicContact CG1-CD1 3.93Å; V310-L313 HydrophobicContact CG1-CG 3.74Å; V310-L313 PolarHBondContact O-N 2.94Å; P311-L313 PolarHBondContact O-N 2.95Å; L313-S315 PolarHBondContact O-N 3.44Å; L313-I316 HydrophobicContact CB-CB 4.29Å; L313-I316 HydrophobicContact CB-CG2 4.19Å; L313-I316 HydrophobicContact CD2-CD1 4.42Å; L313-I316 WeakPolarHBondContact O-CB 3.05Å; L313-I316 WeakPolarHBondContact O-CG2 3.4Å; L313-I316 PolarHBondContact O-N 3.35Å; L313-Y383 HydrophobicContact CD1-CD1 3.89Å; L313-Y383 HydrophobicContact CD1-CE1 3.78Å; L313-Y383 HydrophobicContact CD1-CG 4.44Å; L313-Y383 HydrophobicContact CD2-CE1 4.45Å; L313-Y383 HydrophobicContact CD2-CE2 4.38Å; L313-G387 WeakPolarHBondContact CD1-O 3.3Å
314	H	85.6	Confident	89.6	Confident	126 Å²	126	70.9 Å²	70.9	58%	0.583	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.9	-26.3	-177.5	76.8	92.8	0	0	0	114.1	V310 P311	V310-H314 PolarHBondContact O-N 2.59Å; P311-H314 PolarHBondContact O-CD2 3.17Å; P311-H314 PolarHBondContact O-N 3.01Å
315	S	84.6	Confident	89.6	Confident	87 Å²	87	68.6 Å²	68.6	61%	0.608	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.5	6	179.4	-61.8	0	0	0	0	114.1	L313 R317	L313-S315 PolarHBondContact O-N 3.44Å; S315-R317 PolarHBondContact O-N 3.28Å
316	I	87.3	Confident	89.7	Confident	24 Å²	24	63.7 Å²	63.7	12%	0.123	31%	0.309	C	S	.	.	P	Polyproline II helix	trans	-66.7	128.9	-179.9	-157.2	173.2	0	0	0	110	F303 A306 R307 L313 H376	F303-I316 HydrophobicContact CB-CG2 3.73Å; F303-I316 HydrophobicContact CD1-CD1 4.13Å; F303-I316 HydrophobicContact CG-CD1 4.46Å; A306-I316 HydrophobicContact CB-CG2 4.19Å; R307-I316 VanDerWaalsContact CD-O 3.31Å; R307-I316 WeakPolarHBondContact CD-O 3.21Å; R307-I316 HydrophobicContact CG-CG2 3.75Å; R307-I316 WeakPolarHBondContact CG-O 3.5Å; R307-I316 PolarHBondContact NH1-O 3.42Å; L313-I316 HydrophobicContact CB-CB 4.29Å; L313-I316 HydrophobicContact CB-CG2 4.19Å; L313-I316 HydrophobicContact CD2-CD1 4.42Å; L313-I316 WeakPolarHBondContact O-CB 3.05Å; L313-I316 WeakPolarHBondContact O-CG2 3.4Å; L313-I316 PolarHBondContact O-N 3.35Å; I316-H376 HydrophobicContact CD1-CB 3.84Å; I316-H376 VanDerWaalsContact CD1-CD2 3.42Å; I316-H376 WeakPolarHBondContact CD1-CD2 3.4Å
317	R	87.3	Confident	90	Very high	202 Å²	202	69.3 Å²	69.3	76%	0.762	34%	0.335	S	S	*	.	P	Polyproline II helix	trans	-90.3	152.6	-177.6	-62.7	-176.8	-178.6	-174.5	-0.1	111	S315 H376	S315-R317 PolarHBondContact O-N 3.28Å; R317-H376 PolarHBondContact O-NE2 2.95Å
318	D	90.7	Very high	90.1	Very high	34 Å²	34	66.8 Å²	66.8	18%	0.182	33%	0.33	C	S	.	.	P	Polyproline II helix	trans	-66.6	151.5	171.1	-58.9	-30.6	0	0	0	111.2	Y301 F303 R307 N320	Y301-D318 HydrophobicContact CE1-CB 4.4Å; Y301-D318 HydrophobicContact CE2-CB 4.38Å; Y301-D318 WeakPolarHBondContact O-CA 3.18Å; Y301-D318 WeakPolarHBondContact O-CB 3.22Å; F303-D318 PolarHBondContact N-OD1 3Å; R307-D318 IonicContact CZ-OD1 2.62Å; R307-D318 IonicContact CZ-OD2 3.84Å; R307-D318 IonicContact NH1-OD1 2.87Å; R307-D318 PolarHBondContact NH1-OD1 2.78Å; R307-D318 IonicContact NH1-OD2 2.88Å; R307-D318 IonicContact NH2-OD1 3.93Å; R307-D318 PolarHBondContact NH2-OD1 3.27Å; R307-D318 VanDerWaalsContact NH2-OD1 3.16Å; R307-D318 IonicContact NH2-OD2 3.91Å; R307-D318 PolarHBondContact NH2-OD2 2.65Å; R307-D318 VanDerWaalsContact NH2-OD2 3.07Å; D318-N320 VanDerWaalsContact C-N 3.25Å; D318-N320 PolarHBondContact O-N 3.16Å
319	R	90.6	Very high	90.4	Very high	3 Å²	3	60 Å²	60	1%	0.011	30%	0.298	C	S	.	.			trans	-86.6	56.4	-171.6	-65.9	-176.3	57.5	-88.3	-7.5	113.1	N300 Y301 F303 G321 T322 L374 S375 H376 R472	N300-R319 VanDerWaalsContact O-CD 3.31Å; N300-R319 WeakPolarHBondContact O-CD 3.48Å; N300-R319 PolarHBondContact O-NH1 3.25Å; Y301-R319 PolarHBondContact O-N 3.47Å; F303-R319 HydrophobicContact CD2-CG 4.43Å; F303-R319 HydrophobicContact CE2-CG 3.84Å; R319-G321 PolarHBondContact O-N 3.29Å; R319-T322 HydrophobicContact CB-CG2 4.22Å; R319-T322 PolarHBondContact NH1-OG1 2.65Å; R319-T322 PolarHBondContact NH2-OG1 3.36Å; R319-T322 VanDerWaalsContact O-CB 3.24Å; R319-T322 WeakPolarHBondContact O-CB 3.34Å; R319-T322 WeakPolarHBondContact O-CG2 3.48Å; R319-T322 PolarHBondContact O-N 2.82Å; R319-L374 VanDerWaalsContact CZ-C 3.49Å; R319-L374 PolarHBondContact NH1-O 2.91Å; R319-L374 VanDerWaalsContact NH1-O 3.08Å; R319-S375 VanDerWaalsContact NE-C 3.28Å; R319-S375 PolarHBondContact NE-O 2.89Å; R319-H376 WeakPolarHBondContact CG-NE2 3.38Å; R319-R472 VanDerWaalsContact CA-CZ 3.49Å
320	N	86.7	Confident	90.7	Very high	77 Å²	77	54 Å²	54	41%	0.412	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	-45.9	130.5	174.4	-69.2	-53.6	0	0	0	113	Y301 D318 R472 P474	Y301-N320 WeakPolarHBondContact CE2-OD1 3.37Å; Y301-N320 PolarHBondContact OH-OD1 3.06Å; Y301-N320 VanDerWaalsContact OH-OD1 3.09Å; D318-N320 VanDerWaalsContact C-N 3.25Å; D318-N320 PolarHBondContact O-N 3.16Å; N320-R472 VanDerWaalsContact N-NH1 3.2Å; N320-R472 WeakPolarHBondContact O-CD 3.47Å; N320-R472 PolarHBondContact O-NH1 3.31Å; N320-P474 HydrophobicContact CB-CB 4.22Å
321	G	87	Confident	91	Very high	3 Å²	3	55 Å²	55	3%	0.031	28%	0.284	C	S	.	.	T	Hydrogen-bonded Turn	trans	89.5	-6.7	-175.6	0	0	0	0	0	115.3	R319 H323 L324 P474	R319-G321 PolarHBondContact O-N 3.29Å; G321-H323 PolarHBondContact O-N 2.89Å; G321-L324 WeakPolarHBondContact O-CB 3.18Å; G321-L324 PolarHBondContact O-N 2.82Å; G321-P474 WeakPolarHBondContact CA-O 3.12Å
322	T	90.1	Very high	91.4	Very high	1 Å²	1	49.8 Å²	49.8	1%	0.006	25%	0.25	C	S	.	.	H	α-helix	trans	-68	-19.1	179.1	-163.5	0	0	0	0	114.7	N299 Y301 R319 L324 D325 A326	N299-T322 WeakPolarHBondContact OD1-CB 3.22Å; N299-T322 WeakPolarHBondContact OD1-CG2 3.35Å; N299-T322 PolarHBondContact OD1-O 3.19Å; N299-T322 PolarHBondContact OD1-OG1 3.43Å; Y301-T322 HydrophobicContact CD2-CG2 4.11Å; R319-T322 HydrophobicContact CB-CG2 4.22Å; R319-T322 PolarHBondContact NH1-OG1 2.65Å; R319-T322 PolarHBondContact NH2-OG1 3.36Å; R319-T322 VanDerWaalsContact O-CB 3.24Å; R319-T322 WeakPolarHBondContact O-CB 3.34Å; R319-T322 WeakPolarHBondContact O-CG2 3.48Å; R319-T322 PolarHBondContact O-N 2.82Å; T322-L324 VanDerWaalsContact C-N 3.32Å; T322-D325 PolarHBondContact O-N 3.32Å; T322-A326 PolarHBondContact O-N 3.05Å; T322-A326 VanDerWaalsContact O-N 3.08Å
323	H	92.6	Very high	91.9	Very high	90 Å²	90	43.4 Å²	43.4	42%	0.417	22%	0.222	S	C	.	.	H	α-helix	trans	-66.7	-36.6	173.4	64.6	-80.3	0	0	0	111.1	G321 D325 A326 E327	G321-H323 PolarHBondContact O-N 2.89Å; H323-D325 VanDerWaalsContact C-N 3.29Å; H323-D325 PolarHBondContact O-N 3.13Å; H323-A326 PolarHBondContact O-N 2.74Å; H323-E327 IonicContact CD2-OE1 3.36Å; H323-E327 WeakPolarHBondContact O-CB 3.24Å; H323-E327 VanDerWaalsContact O-CG 3.31Å; H323-E327 WeakPolarHBondContact O-CG 3.38Å; H323-E327 PolarHBondContact O-N 3.22Å
324	L	93.8	Very high	92.3	Very high	44 Å²	44	47.9 Å²	47.9	23%	0.23	24%	0.242	C	C	.	.	H	α-helix	trans	-61.7	-39.4	175.8	-56.1	172.2	0	0	0	111.4	G321 T322 A328 A475	G321-L324 WeakPolarHBondContact O-CB 3.18Å; G321-L324 PolarHBondContact O-N 2.82Å; T322-L324 VanDerWaalsContact C-N 3.32Å; L324-A328 VanDerWaalsContact O-CB 3.28Å; L324-A328 WeakPolarHBondContact O-CB 3.43Å; L324-A328 PolarHBondContact O-N 2.94Å; L324-A475 VanDerWaalsContact CD1-O 3.26Å; L324-A475 WeakPolarHBondContact CD1-O 3.39Å
325	D	93.6	Very high	92.7	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-66.8	-43.8	174.4	-73.6	-14.1	0	0	0	111.9	T322 H323 E327 A328 L329 L374 G477 T478 I481 Q482	T322-D325 PolarHBondContact O-N 3.32Å; H323-D325 VanDerWaalsContact C-N 3.29Å; H323-D325 PolarHBondContact O-N 3.13Å; D325-E327 VanDerWaalsContact C-N 3.35Å; D325-A328 PolarHBondContact O-N 3.4Å; D325-L329 WeakPolarHBondContact O-CB 3.37Å; D325-L329 VanDerWaalsContact O-CG 3.25Å; D325-L329 WeakPolarHBondContact O-CG 3.1Å; D325-L329 PolarHBondContact O-N 3.28Å; D325-L374 HydrophobicContact CB-CD1 3.83Å; D325-G477 VanDerWaalsContact OD1-CA 3.25Å; D325-G477 WeakPolarHBondContact OD1-CA 3.16Å; D325-T478 VanDerWaalsContact CG-N 3.34Å; D325-T478 VanDerWaalsContact CG-OG1 3.27Å; D325-T478 PolarHBondContact OD1-N 3.37Å; D325-T478 PolarHBondContact OD1-OG1 3.32Å; D325-T478 WeakPolarHBondContact OD2-CB 3.36Å; D325-T478 WeakPolarHBondContact OD2-CG2 3.47Å; D325-T478 PolarHBondContact OD2-N 2.87Å; D325-T478 VanDerWaalsContact OD2-N 3.09Å; D325-T478 PolarHBondContact OD2-OG1 2.87Å; D325-I481 HydrophobicContact CB-CB 4.15Å; D325-I481 HydrophobicContact CB-CG1 4.48Å; D325-I481 HydrophobicContact CB-CG2 3.76Å; D325-Q482 PolarHBondContact OD1-NE2 3.13Å
326	A	95.7	Very high	93.2	Very high	5 Å²	5	42.6 Å²	42.6	4%	0.041	21%	0.209	C	C	.	.	H	α-helix	trans	-63.2	-42	177.5	0	0	0	0	0	111.6	I297 N299 T322 H323 T330 L374	I297-A326 HydrophobicContact CG2-CB 4.1Å; N299-A326 HydrophobicContact CB-CB 4.36Å; T322-A326 PolarHBondContact O-N 3.05Å; T322-A326 VanDerWaalsContact O-N 3.08Å; H323-A326 PolarHBondContact O-N 2.74Å; A326-T330 WeakPolarHBondContact O-CB 3.4Å; A326-T330 PolarHBondContact O-N 2.95Å; A326-T330 PolarHBondContact O-OG1 3.4Å; A326-L374 HydrophobicContact CB-CD1 4.26Å
327	E	96.5	Very high	93.6	Very high	118 Å²	118	43.8 Å²	43.8	55%	0.551	21%	0.214	S	C	*	.	H	α-helix	trans	-64.7	-44.4	175.6	-73.3	168.8	-161.9	0	0	111.7	H323 D325 L329 T330 A331	H323-E327 IonicContact CD2-OE1 3.36Å; H323-E327 WeakPolarHBondContact O-CB 3.24Å; H323-E327 VanDerWaalsContact O-CG 3.31Å; H323-E327 WeakPolarHBondContact O-CG 3.38Å; H323-E327 PolarHBondContact O-N 3.22Å; D325-E327 VanDerWaalsContact C-N 3.35Å; E327-L329 PolarHBondContact O-N 3.49Å; E327-T330 WeakPolarHBondContact O-CB 3.35Å; E327-T330 PolarHBondContact O-N 2.7Å; E327-A331 PolarHBondContact O-N 3.09Å
328	A	96.6	Very high	94.1	Very high	19 Å²	19	34.6 Å²	34.6	16%	0.157	18%	0.179	C	C	.	.	H	α-helix	trans	-61.9	-43.9	177	0	0	0	0	0	112.3	L324 D325 T330 T332 C485	L324-A328 VanDerWaalsContact O-CB 3.28Å; L324-A328 WeakPolarHBondContact O-CB 3.43Å; L324-A328 PolarHBondContact O-N 2.94Å; D325-A328 PolarHBondContact O-N 3.4Å; A328-T330 VanDerWaalsContact C-N 3.33Å; A328-T332 WeakPolarHBondContact O-CB 3.46Å; A328-T332 PolarHBondContact O-N 2.87Å; A328-T332 PolarHBondContact O-OG1 3.33Å; A328-C485 HydrophobicContact CB-CB 4.22Å
329	L	97.4	Very high	94.4	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-62.6	-41.2	175	-73.3	166.5	0	0	0	111.5	I297 D325 E327 T332 F333 C372 L374 I481	I297-L329 HydrophobicContact CD1-CB 3.81Å; D325-L329 WeakPolarHBondContact O-CB 3.37Å; D325-L329 VanDerWaalsContact O-CG 3.25Å; D325-L329 WeakPolarHBondContact O-CG 3.1Å; D325-L329 PolarHBondContact O-N 3.28Å; E327-L329 PolarHBondContact O-N 3.49Å; L329-T332 PolarHBondContact O-N 3.29Å; L329-F333 HydrophobicContact CB-CD2 4.43Å; L329-F333 HydrophobicContact CD2-CD2 4.24Å; L329-F333 HydrophobicContact CD2-CE2 3.69Å; L329-F333 WeakPolarHBondContact O-CB 3.45Å; L329-F333 VanDerWaalsContact O-CD2 3.24Å; L329-F333 WeakPolarHBondContact O-CD2 3.11Å; L329-F333 PolarHBondContact O-N 2.89Å; L329-C372 HydrophobicContact CD1-CB 3.91Å; L329-L374 HydrophobicContact CD1-CD1 4.17Å; L329-L374 HydrophobicContact CD1-CD2 4.08Å; L329-L374 HydrophobicContact CD1-CG 4.47Å; L329-I481 HydrophobicContact CD1-CD1 4.32Å; L329-I481 HydrophobicContact CD1-CG2 3.9Å; L329-I481 HydrophobicContact CD2-CD1 4.42Å; L329-I481 HydrophobicContact CD2-CG2 3.97Å; L329-I481 HydrophobicContact CG-CG2 3.63Å
330	T	97.6	Very high	94.7	Very high	18 Å²	18	37.2 Å²	37.2	11%	0.11	19%	0.191	C	C	.	.	H	α-helix	trans	-61.4	-55.8	178.2	-56.4	0	0	0	0	110.3	I297 A326 E327 A328 T332 F333 E334 I340 H342	I297-T330 WeakPolarHBondContact CD1-OG1 3.26Å; A326-T330 WeakPolarHBondContact O-CB 3.4Å; A326-T330 PolarHBondContact O-N 2.95Å; A326-T330 PolarHBondContact O-OG1 3.4Å; E327-T330 WeakPolarHBondContact O-CB 3.35Å; E327-T330 PolarHBondContact O-N 2.7Å; A328-T330 VanDerWaalsContact C-N 3.33Å; T330-T332 VanDerWaalsContact C-N 3.27Å; T330-T332 PolarHBondContact O-N 3.22Å; T330-F333 PolarHBondContact O-N 2.81Å; T330-E334 HydrophobicContact CG2-CG 4.23Å; T330-E334 WeakPolarHBondContact CG2-OE1 3.39Å; T330-E334 VanDerWaalsContact O-CB 3.3Å; T330-E334 WeakPolarHBondContact O-CB 3.17Å; T330-E334 VanDerWaalsContact O-CG 3.25Å; T330-E334 WeakPolarHBondContact O-CG 3.46Å; T330-E334 PolarHBondContact O-N 2.89Å; T330-I340 HydrophobicContact CG2-CG1 4.26Å; T330-I340 HydrophobicContact CG2-CG2 4.23Å; T330-H342 PolarHBondContact OG1-CE1 2.87Å; T330-H342 PolarHBondContact OG1-NE2 3.36Å; T330-H342 VanDerWaalsContact OG1-NE2 3.11Å
331	A	96.6	Very high	95.3	Very high	40 Å²	40	36.1 Å²	36.1	33%	0.331	18%	0.184	S	C	.	.	H	α-helix	trans	-56.8	-42.3	179.6	0	0	0	0	0	112.1	E327 E335	E327-A331 PolarHBondContact O-N 3.09Å; A331-E335 WeakPolarHBondContact O-CB 3.31Å; A331-E335 PolarHBondContact O-N 3.01Å
332	T	96.4	Very high	95.7	Very high	2 Å²	2	40.1 Å²	40.1	1%	0.012	20%	0.201	C	C	.	.	H	α-helix	trans	-66.1	-50.5	179.8	-57.1	0	0	0	0	111.9	A328 L329 T330 E335 L336 C485 L488 R489	A328-T332 WeakPolarHBondContact O-CB 3.46Å; A328-T332 PolarHBondContact O-N 2.87Å; A328-T332 PolarHBondContact O-OG1 3.33Å; L329-T332 PolarHBondContact O-N 3.29Å; T330-T332 VanDerWaalsContact C-N 3.27Å; T330-T332 PolarHBondContact O-N 3.22Å; T332-E335 PolarHBondContact O-N 3.45Å; T332-L336 HydrophobicContact CG2-CD1 4.38Å; T332-L336 WeakPolarHBondContact O-CG 3.36Å; T332-L336 PolarHBondContact O-N 2.98Å; T332-C485 WeakPolarHBondContact OG1-CB 3.42Å; T332-L488 HydrophobicContact CG2-CB 3.77Å; T332-L488 HydrophobicContact CG2-CD1 4Å; T332-R489 HydrophobicContact CG2-CG 3.81Å
333	F	96.6	Very high	96.1	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-78.9	-24.3	-174.7	-73.9	-61	0	0	0	113.2	C295 L329 T330 L336 H337 F338 I340 I370 F415 L488	C295-F333 HydrophobicContact CB-CB 4.4Å; L329-F333 HydrophobicContact CB-CD2 4.43Å; L329-F333 HydrophobicContact CD2-CD2 4.24Å; L329-F333 HydrophobicContact CD2-CE2 3.69Å; L329-F333 WeakPolarHBondContact O-CB 3.45Å; L329-F333 VanDerWaalsContact O-CD2 3.24Å; L329-F333 WeakPolarHBondContact O-CD2 3.11Å; L329-F333 PolarHBondContact O-N 2.89Å; T330-F333 PolarHBondContact O-N 2.81Å; F333-L336 HydrophobicContact CD1-CD1 4.08Å; F333-L336 HydrophobicContact CE1-CD1 4.26Å; F333-L336 CarbonylContact O-C 3.51Å; F333-L336 PolarHBondContact O-N 3.39Å; F333-H337 PolarHBondContact O-N 3.49Å; F333-F338 HydrophobicContact CB-CB 4.16Å; F333-F338 HydrophobicContact CD1-CD2 4.1Å; F333-F338 HydrophobicContact CD1-CE2 4.43Å; F333-F338 WeakPolarHBondContact O-CB 3.49Å; F333-F338 PolarHBondContact O-N 3.29Å; F333-I340 HydrophobicContact CB-CD1 3.54Å; F333-I370 HydrophobicContact CD1-CD1 3.69Å; F333-I370 HydrophobicContact CE1-CD1 3.42Å; F333-I370 VanDerWaalsContact CE1-CD1 3.42Å; F333-I370 HydrophobicContact CE2-CG2 4.45Å; F333-I370 HydrophobicContact CZ-CD1 4.09Å; F333-I370 HydrophobicContact CZ-CG2 4.31Å; F333-F415 HydrophobicContact CE2-CD2 4.5Å; F333-F415 HydrophobicContact CE2-CE2 4.41Å; F333-F415 HydrophobicContact CZ-CD2 4.19Å; F333-F415 AromaticContact CZ-CE2 3.68Å; F333-F415 HydrophobicContact CZ-CE2 3.68Å; F333-L488 HydrophobicContact CE1-CD1 4.2Å; F333-L488 HydrophobicContact CZ-CD1 3.87Å
334	E	95.4	Very high	96.3	Very high	112 Å²	112	41.6 Å²	41.6	52%	0.523	21%	0.211	S	C	.	.	H	α-helix	trans	-64.3	-43.4	167.7	-75.3	-179.3	164.6	0	0	111.5	T330 L336 H337 I340	T330-E334 HydrophobicContact CG2-CG 4.23Å; T330-E334 WeakPolarHBondContact CG2-OE1 3.39Å; T330-E334 VanDerWaalsContact O-CB 3.3Å; T330-E334 WeakPolarHBondContact O-CB 3.17Å; T330-E334 VanDerWaalsContact O-CG 3.25Å; T330-E334 WeakPolarHBondContact O-CG 3.46Å; T330-E334 PolarHBondContact O-N 2.89Å; E334-L336 PolarHBondContact O-N 3.36Å; E334-H337 WeakPolarHBondContact O-CA 3.44Å; E334-H337 PolarHBondContact O-N 3.22Å; E334-I340 HydrophobicContact CG-CD1 4.27Å; E334-I340 HydrophobicContact CG-CG1 3.51Å
335	E	94.2	Very high	96.4	Very high	94 Å²	94	42.4 Å²	42.4	44%	0.439	22%	0.216	S	C	.	.	H	α-helix	trans	-62.3	-30.1	175.2	-171.4	165.3	-159.6	0	0	111.7	A331 T332 H337 R489	A331-E335 WeakPolarHBondContact O-CB 3.31Å; A331-E335 PolarHBondContact O-N 3.01Å; T332-E335 PolarHBondContact O-N 3.45Å; E335-H337 VanDerWaalsContact C-N 3.27Å; E335-H337 PolarHBondContact O-N 2.82Å; E335-R489 IonicContact OE2-CZ 2.57Å; E335-R489 VanDerWaalsContact OE2-CZ 3.24Å; E335-R489 IonicContact OE2-NE 2.75Å; E335-R489 PolarHBondContact OE2-NE 2.81Å; E335-R489 IonicContact OE2-NH2 3.69Å; E335-R489 PolarHBondContact OE2-NH2 2.81Å
336	L	94.9	Very high	96.5	Very high	8 Å²	8	42.4 Å²	42.4	4%	0.042	22%	0.216	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.5	13.1	172.1	-59.7	175.8	0	0	0	113.8	R292 T332 F333 E334 F338 C492 F535	R292-L336 WeakPolarHBondContact CG-O 3.5Å; T332-L336 HydrophobicContact CG2-CD1 4.38Å; T332-L336 WeakPolarHBondContact O-CG 3.36Å; T332-L336 PolarHBondContact O-N 2.98Å; F333-L336 HydrophobicContact CD1-CD1 4.08Å; F333-L336 HydrophobicContact CE1-CD1 4.26Å; F333-L336 CarbonylContact O-C 3.51Å; F333-L336 PolarHBondContact O-N 3.39Å; E334-L336 PolarHBondContact O-N 3.36Å; L336-F338 HydrophobicContact CB-CD2 3.96Å; L336-F338 HydrophobicContact CB-CE2 4.15Å; L336-F338 WeakPolarHBondContact O-CD2 3.36Å; L336-F338 PolarHBondContact O-N 2.96Å; L336-C492 HydrophobicContact CD2-CB 3.8Å; L336-F535 HydrophobicContact CD1-CB 4.14Å; L336-F535 HydrophobicContact CD1-CD2 4.42Å; L336-F535 HydrophobicContact CD1-CG 4.44Å; L336-F535 HydrophobicContact CD2-CB 4.03Å
337	H	95.8	Very high	96.6	Very high	49 Å²	49	43.7 Å²	43.7	23%	0.227	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	62.8	30.9	176	-45.5	-60.1	0	0	0	115.9	P291 R292 F333 E334 E335 D538	P291-H337 WeakPolarHBondContact CA-O 3.26Å; R292-H337 HydrophobicContact CG-CB 4Å; R292-H337 PolarHBondContact N-O 2.94Å; F333-H337 PolarHBondContact O-N 3.49Å; E334-H337 WeakPolarHBondContact O-CA 3.44Å; E334-H337 PolarHBondContact O-N 3.22Å; E335-H337 VanDerWaalsContact C-N 3.27Å; E335-H337 PolarHBondContact O-N 2.82Å; H337-D538 IonicContact CE1-OD2 3.44Å; H337-D538 PolarHBondContact CE1-OD2 2.98Å; H337-D538 VanDerWaalsContact CE1-OD2 3.25Å; H337-D538 IonicContact NE2-OD1 3.71Å; H337-D538 IonicContact NE2-OD2 3.22Å; H337-D538 PolarHBondContact NE2-OD2 2.82Å; H337-D538 VanDerWaalsContact NE2-OD2 3.07Å
338	F	96.9	Very high	96.5	Very high	10 Å²	10	38.8 Å²	38.8	4%	0.044	20%	0.201	C	C	.	.			trans	-85.9	153.1	169.2	-73.9	-97.8	0	0	0	111.8	R292 C295 F333 L336 I340 C368 I370 F535	R292-F338 HydrophobicContact CB-CD1 4.24Å; R292-F338 HydrophobicContact CB-CD2 4.17Å; R292-F338 HydrophobicContact CB-CE1 4.03Å; R292-F338 HydrophobicContact CB-CE2 3.96Å; R292-F338 HydrophobicContact CB-CG 4.3Å; R292-F338 HydrophobicContact CB-CZ 3.88Å; R292-F338 HydrophobicContact CG-CE2 4.4Å; C295-F338 HydrophobicContact CB-CB 4.01Å; C295-F338 HydrophobicContact CB-CD1 4.44Å; C295-F338 HydrophobicContact CB-CG 4.49Å; F333-F338 HydrophobicContact CB-CB 4.16Å; F333-F338 HydrophobicContact CD1-CD2 4.1Å; F333-F338 HydrophobicContact CD1-CE2 4.43Å; F333-F338 WeakPolarHBondContact O-CB 3.49Å; F333-F338 PolarHBondContact O-N 3.29Å; L336-F338 HydrophobicContact CB-CD2 3.96Å; L336-F338 HydrophobicContact CB-CE2 4.15Å; L336-F338 WeakPolarHBondContact O-CD2 3.36Å; L336-F338 PolarHBondContact O-N 2.96Å; F338-I340 HydrophobicContact CB-CD1 4.07Å; F338-C368 HydrophobicContact CE1-CB 3.78Å; F338-C368 HydrophobicContact CZ-CB 3.9Å; F338-I370 HydrophobicContact CD1-CD1 3.93Å; F338-I370 HydrophobicContact CD1-CG1 4.14Å; F338-I370 HydrophobicContact CD2-CD1 4.34Å; F338-I370 HydrophobicContact CE1-CD1 3.47Å; F338-I370 VanDerWaalsContact CE1-CD1 3.47Å; F338-I370 HydrophobicContact CE1-CG1 3.65Å; F338-I370 HydrophobicContact CE2-CD1 3.92Å; F338-I370 HydrophobicContact CG-CD1 4.35Å; F338-I370 HydrophobicContact CZ-CD1 3.48Å; F338-I370 VanDerWaalsContact CZ-CD1 3.48Å; F338-I370 HydrophobicContact CZ-CG1 4.1Å; F338-F535 HydrophobicContact CE2-CD1 4.03Å; F338-F535 HydrophobicContact CE2-CE1 4.13Å; F338-F535 HydrophobicContact CZ-CD1 4.05Å; F338-F535 AromaticContact CZ-CE1 3.74Å; F338-F535 HydrophobicContact CZ-CE1 3.74Å
339	E	97.4	Very high	96.5	Very high	68 Å²	68	45.2 Å²	45.2	32%	0.318	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	109.5	172.7	-172	-175.8	157.9	0	0	109.4	P291 G293 Y294 C295 Q341 K366	P291-E339 HydrophobicContact CB-CB 4.02Å; P291-E339 HydrophobicContact CG-CB 4.33Å; G293-E339 PolarHBondContact O-N 3.14Å; Y294-E339 WeakPolarHBondContact CA-O 3.26Å; Y294-E339 HydrophobicContact CD1-CB 4.22Å; Y294-E339 HydrophobicContact CD1-CG 4.23Å; Y294-E339 HydrophobicContact CE1-CG 4.35Å; Y294-E339 WeakPolarHBondContact CE1-OE1 3.48Å; Y294-E339 VanDerWaalsContact CE1-OE2 3.26Å; Y294-E339 WeakPolarHBondContact CE1-OE2 3.42Å; C295-E339 PolarHBondContact N-O 3.1Å; E339-Q341 PolarHBondContact OE1-NE2 2.9Å; E339-K366 IonicContact OE2-NZ 3.25Å; E339-K366 PolarHBondContact OE2-NZ 3.07Å
340	I	97.9	Very high	96.5	Very high	24 Å²	24	49.7 Å²	49.7	12%	0.123	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	136.4	-172.7	-46.7	-51.7	0	0	0	111.5	C295 I297 T330 F333 E334 F338	C295-I340 HydrophobicContact CB-CD1 3.6Å; C295-I340 WeakPolarHBondContact O-CA 3.31Å; I297-I340 HydrophobicContact CD1-CG2 3.55Å; I297-I340 HydrophobicContact CG1-CG2 4.13Å; T330-I340 HydrophobicContact CG2-CG1 4.26Å; T330-I340 HydrophobicContact CG2-CG2 4.23Å; F333-I340 HydrophobicContact CB-CD1 3.54Å; E334-I340 HydrophobicContact CG-CD1 4.27Å; E334-I340 HydrophobicContact CG-CG1 3.51Å; F338-I340 HydrophobicContact CB-CD1 4.07Å
341	Q	97.9	Very high	96.4	Very high	54 Å²	54	48.8 Å²	48.8	25%	0.252	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131	106.2	-178.8	-62.9	-67.4	-21.7	0	0	110.3	Y294 C295 L296 I297 E339 Y358	Y294-Q341 HydrophobicContact CD1-CG 4.21Å; C295-Q341 PolarHBondContact O-N 3.3Å; L296-Q341 HydrophobicContact CD2-CB 3.69Å; L296-Q341 HydrophobicContact CD2-CG 4.19Å; I297-Q341 PolarHBondContact N-O 2.8Å; E339-Q341 PolarHBondContact OE1-NE2 2.9Å; Q341-Y358 WeakPolarHBondContact CB-OH 2.91Å; Q341-Y358 HydrophobicContact CG-CE1 4.28Å; Q341-Y358 WeakPolarHBondContact CG-OH 3.36Å; Q341-Y358 PolarHBondContact OE1-OH 2.73Å
342	H	96.2	Very high	96.3	Very high	87 Å²	87	49.5 Å²	49.5	40%	0.403	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	133.3	-176	-73.8	-89.2	0	0	0	113	T330	T330-H342 PolarHBondContact OG1-CE1 2.87Å; T330-H342 PolarHBondContact OG1-NE2 3.36Å; T330-H342 VanDerWaalsContact OG1-NE2 3.11Å
343	H	97.6	Very high	96.4	Very high	36 Å²	36	56.6 Å²	56.6	17%	0.167	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	97.8	176.1	-63.9	-61.6	0	0	0	110.5	I297 I298 N299 I354 Y358	I297-H343 PolarHBondContact O-N 2.94Å; I298-H343 CarbonylContact C-O 3.48Å; I298-H343 WeakPolarHBondContact CA-O 3.48Å; I298-H343 HydrophobicContact CG1-CB 4.33Å; N299-H343 PolarHBondContact N-O 3.43Å; H343-I354 HydrophobicContact CB-CD1 3.77Å; H343-I354 WeakPolarHBondContact NE2-CG2 3.37Å; H343-Y358 AromaticContact NE2-CE2 3.77Å
344	N	96.6	Very high	96.4	Very high	85 Å²	85	57.3 Å²	57.3	46%	0.455	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	145.3	-179.4	-61.1	-33.7	0	0	0	112.1	N299 C346 K350	N299-N344 WeakPolarHBondContact O-CA 3.35Å; N344-C346 PolarHBondContact O-N 3.05Å; N344-K350 PolarHBondContact O-NZ 2.72Å
345	D	96.3	Very high	96.3	Very high	62 Å²	62	52 Å²	52	33%	0.332	25%	0.246	S	C	.	.	S	Bend	trans	47.4	58.7	170.3	-63.8	-44.9	0	0	0	114.1	N299 Y301 D302 T385	N299-D345 PolarHBondContact O-N 3.47Å; Y301-D345 WeakPolarHBondContact CA-OD1 3.26Å; Y301-D345 PolarHBondContact N-OD1 3.21Å; D302-D345 PolarHBondContact N-OD1 2.84Å; D345-T385 HydrophobicContact CB-CG2 3.95Å; D345-T385 PolarHBondContact O-OG1 3.19Å
346	C	96.9	Very high	96.3	Very high	0 Å²	0	51.7 Å²	51.7	0%	0	24%	0.243	C	C	.	.			trans	-90.4	130.5	-177	-61.4	0	0	0	0	112.4	I298 N300 N344 K350 I351 G384 T385	I298-C346 HydrophobicContact CG2-CB 4.18Å; N300-C346 PolarHBondContact ND2-O 3.35Å; N300-C346 PolarHBondContact OD1-N 2.85Å; N300-C346 PolarHBondContact OD1-O 2.98Å; N344-C346 PolarHBondContact O-N 3.05Å; C346-K350 HydrophobicContact CB-CB 4.26Å; C346-K350 HydrophobicContact CB-CD 4.15Å; C346-K350 HydrophobicContact CB-CG 4.27Å; C346-I351 HydrophobicContact CB-CD1 4.32Å; C346-I351 HydrophobicContact CB-CG1 3.59Å; C346-G384 WeakPolarHBondContact O-CA 3.47Å; C346-T385 PolarHBondContact O-N 3.16Å; C346-T385 PolarHBondContact O-OG1 2.98Å
347	T	96.7	Very high	96.4	Very high	31 Å²	31	54.7 Å²	54.7	19%	0.19	26%	0.261	C	S	.	.			trans	-69.9	162.4	164	61.3	0	0	0	0	110.1	E349 K350 I351 T385 D386	T347-E349 VanDerWaalsContact C-N 3.28Å; T347-E349 PolarHBondContact O-N 2.88Å; T347-K350 PolarHBondContact O-N 2.98Å; T347-K350 WeakPolarHBondContact OG1-CB 3.15Å; T347-K350 PolarHBondContact OG1-N 3.03Å; T347-I351 WeakPolarHBondContact O-CG1 3.29Å; T347-I351 PolarHBondContact O-N 3.33Å; T347-T385 PolarHBondContact N-OG1 3.42Å; T347-D386 HydrophobicContact CG2-CB 3.87Å
348	V	95.2	Very high	96.4	Very high	16 Å²	16	53.2 Å²	53.2	10%	0.097	25%	0.254	C	S	.	.	H	α-helix	trans	-54.8	-45.6	177.5	169.9	0	0	0	0	111.9	K350 I351 Y352 D386 Q388 A390	V348-K350 VanDerWaalsContact C-N 3.31Å; V348-K350 PolarHBondContact O-N 3.33Å; V348-I351 WeakPolarHBondContact O-CB 3.46Å; V348-I351 PolarHBondContact O-N 3.05Å; V348-I351 VanDerWaalsContact O-N 3.16Å; V348-Y352 HydrophobicContact CG1-CD2 3.62Å; V348-Y352 HydrophobicContact CG1-CE2 3.39Å; V348-Y352 VanDerWaalsContact O-CD2 3.26Å; V348-Y352 WeakPolarHBondContact O-CD2 3.46Å; V348-Y352 PolarHBondContact O-N 3.35Å; V348-D386 PolarHBondContact N-OD1 3.14Å; V348-Q388 HydrophobicContact CB-CB 4.06Å; V348-Q388 VanDerWaalsContact CG2-C 3.48Å; V348-Q388 HydrophobicContact CG2-CB 3.66Å; V348-Q388 WeakPolarHBondContact CG2-O 2.96Å; V348-A390 HydrophobicContact CG1-CB 3.98Å; V348-A390 HydrophobicContact CG2-CB 4.09Å
349	E	95.9	Very high	96.3	Very high	153 Å²	153	53.4 Å²	53.4	72%	0.715	26%	0.255	S	S	*	.	H	α-helix	trans	-57.1	-44.1	176.7	-173.3	-170.7	166.4	0	0	112.2	T347 Y352 K353	T347-E349 VanDerWaalsContact C-N 3.28Å; T347-E349 PolarHBondContact O-N 2.88Å; E349-Y352 PolarHBondContact O-N 3.4Å; E349-K353 WeakPolarHBondContact O-CB 3.42Å; E349-K353 PolarHBondContact O-N 3.02Å
350	K	96.9	Very high	96	Very high	94 Å²	94	56.2 Å²	56.2	41%	0.409	27%	0.272	S	S	.	.	H	α-helix	trans	-66.6	-39.2	178.8	-172.3	177.6	171.7	-162.8	0	111.2	N344 C346 T347 V348 K353 I354	N344-K350 PolarHBondContact O-NZ 2.72Å; C346-K350 HydrophobicContact CB-CB 4.26Å; C346-K350 HydrophobicContact CB-CD 4.15Å; C346-K350 HydrophobicContact CB-CG 4.27Å; T347-K350 PolarHBondContact O-N 2.98Å; T347-K350 WeakPolarHBondContact OG1-CB 3.15Å; T347-K350 PolarHBondContact OG1-N 3.03Å; V348-K350 VanDerWaalsContact C-N 3.31Å; V348-K350 PolarHBondContact O-N 3.33Å; K350-K353 PolarHBondContact O-N 3.28Å; K350-I354 HydrophobicContact CG-CD1 3.94Å; K350-I354 WeakPolarHBondContact O-CD1 3.46Å; K350-I354 VanDerWaalsContact O-CG1 3.24Å; K350-I354 WeakPolarHBondContact O-CG1 3.32Å; K350-I354 PolarHBondContact O-N 3.43Å
351	I	96.3	Very high	95.9	Very high	0 Å²	0	58.3 Å²	58.3	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-58.4	-53.1	174.7	-66.8	172	0	0	0	109.9	I298 C346 T347 V348 K353 I354 L355 I382 L395	I298-I351 HydrophobicContact CD1-CG1 4.33Å; I298-I351 HydrophobicContact CD1-CG2 3.96Å; I298-I351 HydrophobicContact CG2-CD1 4.27Å; I298-I351 HydrophobicContact CG2-CG1 4.12Å; C346-I351 HydrophobicContact CB-CD1 4.32Å; C346-I351 HydrophobicContact CB-CG1 3.59Å; T347-I351 WeakPolarHBondContact O-CG1 3.29Å; T347-I351 PolarHBondContact O-N 3.33Å; V348-I351 WeakPolarHBondContact O-CB 3.46Å; V348-I351 PolarHBondContact O-N 3.05Å; V348-I351 VanDerWaalsContact O-N 3.16Å; I351-K353 VanDerWaalsContact C-N 3.29Å; I351-K353 PolarHBondContact O-N 2.73Å; I351-I354 PolarHBondContact O-N 3.49Å; I351-L355 HydrophobicContact CG2-CD1 4.24Å; I351-L355 HydrophobicContact CG2-CG 4.42Å; I351-L355 WeakPolarHBondContact O-CG 3.5Å; I351-L355 PolarHBondContact O-N 3.11Å; I351-I382 HydrophobicContact CD1-CD1 3.77Å; I351-L395 HydrophobicContact CG2-CD2 3.84Å
352	Y	95.1	Very high	95.6	Very high	55 Å²	55	60.6 Å²	60.6	22%	0.216	30%	0.296	C	S	.	.	H	α-helix	trans	-59.2	-40.1	178.2	-79.3	-71.7	0	0	0	112.3	V348 E349 L355 K356 A390 E394 L395	V348-Y352 HydrophobicContact CG1-CD2 3.62Å; V348-Y352 HydrophobicContact CG1-CE2 3.39Å; V348-Y352 VanDerWaalsContact O-CD2 3.26Å; V348-Y352 WeakPolarHBondContact O-CD2 3.46Å; V348-Y352 PolarHBondContact O-N 3.35Å; E349-Y352 PolarHBondContact O-N 3.4Å; Y352-L355 PolarHBondContact O-N 3.4Å; Y352-K356 WeakPolarHBondContact O-CB 3.33Å; Y352-K356 PolarHBondContact O-N 2.9Å; Y352-A390 HydrophobicContact CE2-CB 4.24Å; Y352-E394 HydrophobicContact CE1-CB 4.1Å; Y352-E394 WeakPolarHBondContact OH-CB 3.19Å; Y352-E394 PolarHBondContact OH-OE2 3.11Å; Y352-L395 HydrophobicContact CD1-CD2 4.17Å; Y352-L395 HydrophobicContact CE1-CD2 3.79Å; Y352-L395 HydrophobicContact CE2-CD2 4.49Å
353	K	96.9	Very high	95.5	Very high	150 Å²	150	56.5 Å²	56.5	65%	0.652	28%	0.277	S	S	*	.	H	α-helix	trans	-64.3	-41.2	177.6	-171.7	174.8	-178.5	175.7	0	112.5	E349 K350 I351 K356 T357	E349-K353 WeakPolarHBondContact O-CB 3.42Å; E349-K353 PolarHBondContact O-N 3.02Å; K350-K353 PolarHBondContact O-N 3.28Å; I351-K353 VanDerWaalsContact C-N 3.29Å; I351-K353 PolarHBondContact O-N 2.73Å; K353-K356 PolarHBondContact O-N 2.89Å; K353-T357 PolarHBondContact O-N 3.39Å; K353-T357 PolarHBondContact O-OG1 2.97Å
354	I	96.6	Very high	95.1	Very high	15 Å²	15	58.4 Å²	58.4	8%	0.077	29%	0.294	C	S	.	.	H	α-helix	trans	-61.6	-54.4	174.9	-71.6	160.1	0	0	0	109.5	L296 H343 K350 I351 K356 T357 Y358	L296-I354 HydrophobicContact CD1-CG2 4.33Å; H343-I354 HydrophobicContact CB-CD1 3.77Å; H343-I354 WeakPolarHBondContact NE2-CG2 3.37Å; K350-I354 HydrophobicContact CG-CD1 3.94Å; K350-I354 WeakPolarHBondContact O-CD1 3.46Å; K350-I354 VanDerWaalsContact O-CG1 3.24Å; K350-I354 WeakPolarHBondContact O-CG1 3.32Å; K350-I354 PolarHBondContact O-N 3.43Å; I351-I354 PolarHBondContact O-N 3.49Å; I354-K356 VanDerWaalsContact C-N 3.26Å; I354-K356 PolarHBondContact O-N 3.14Å; I354-T357 VanDerWaalsContact O-CB 3.31Å; I354-T357 WeakPolarHBondContact O-CB 3.3Å; I354-T357 PolarHBondContact O-N 2.97Å; I354-Y358 HydrophobicContact CG2-CD2 4.01Å; I354-Y358 HydrophobicContact CG2-CE2 4Å; I354-Y358 VanDerWaalsContact O-CD2 3.31Å; I354-Y358 WeakPolarHBondContact O-CD2 3.49Å; I354-Y358 PolarHBondContact O-N 2.6Å; I354-Y358 VanDerWaalsContact O-N 3.12Å
355	L	95.2	Very high	94.9	Very high	0 Å²	0	59.8 Å²	59.8	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-59.7	-39.3	-179.6	-63	-173.9	0	0	0	111.7	L296 I298 I351 Y352 T357 Y358 Q359 L395 F399	L296-L355 HydrophobicContact CD1-CD2 4.01Å; I298-L355 HydrophobicContact CD1-CD2 4.48Å; I351-L355 HydrophobicContact CG2-CD1 4.24Å; I351-L355 HydrophobicContact CG2-CG 4.42Å; I351-L355 WeakPolarHBondContact O-CG 3.5Å; I351-L355 PolarHBondContact O-N 3.11Å; Y352-L355 PolarHBondContact O-N 3.4Å; L355-T357 VanDerWaalsContact C-N 3.3Å; L355-T357 PolarHBondContact O-N 3.22Å; L355-Y358 PolarHBondContact O-N 3.24Å; L355-Q359 WeakPolarHBondContact O-CB 3.28Å; L355-Q359 PolarHBondContact O-N 2.83Å; L355-L395 HydrophobicContact CD1-CB 3.77Å; L355-L395 HydrophobicContact CD1-CD2 3.62Å; L355-L395 HydrophobicContact CD1-CG 4.24Å; L355-F399 HydrophobicContact CB-CE2 4.07Å; L355-F399 HydrophobicContact CB-CZ 4.21Å; L355-F399 HydrophobicContact CD1-CE2 4.47Å; L355-F399 HydrophobicContact CD2-CE2 3.98Å; L355-F399 HydrophobicContact CD2-CZ 4.13Å; L355-F399 HydrophobicContact CG-CE2 4.39Å
356	K	93.9	Very high	94.9	Very high	89 Å²	89	57 Å²	57	39%	0.387	29%	0.287	S	S	.	.	H	α-helix	trans	-63.2	-37.1	175.9	-171.8	56.7	171.3	-175.3	0	112.5	Y352 K353 I354 Q359 L360	Y352-K356 WeakPolarHBondContact O-CB 3.33Å; Y352-K356 PolarHBondContact O-N 2.9Å; K353-K356 PolarHBondContact O-N 2.89Å; I354-K356 VanDerWaalsContact C-N 3.26Å; I354-K356 PolarHBondContact O-N 3.14Å; K356-Q359 PolarHBondContact O-N 3.36Å; K356-L360 HydrophobicContact CD-CD1 4.43Å; K356-L360 HydrophobicContact CD-CG 4.49Å; K356-L360 HydrophobicContact CG-CD1 4.3Å; K356-L360 VanDerWaalsContact O-CG 3.31Å; K356-L360 WeakPolarHBondContact O-CG 3.25Å; K356-L360 PolarHBondContact O-N 3.17Å
357	T	96.6	Very high	94.8	Very high	70 Å²	70	57.5 Å²	57.5	43%	0.429	29%	0.289	S	S	.	.	H	α-helix	trans	-62.9	-49.5	176.5	-58.2	0	0	0	0	110.3	K353 I354 L355 L360 M361	K353-T357 PolarHBondContact O-N 3.39Å; K353-T357 PolarHBondContact O-OG1 2.97Å; I354-T357 VanDerWaalsContact O-CB 3.31Å; I354-T357 WeakPolarHBondContact O-CB 3.3Å; I354-T357 PolarHBondContact O-N 2.97Å; L355-T357 VanDerWaalsContact C-N 3.3Å; L355-T357 PolarHBondContact O-N 3.22Å; T357-L360 PolarHBondContact O-N 3.16Å; T357-M361 HydrophobicContact CG2-CE 4.1Å; T357-M361 WeakPolarHBondContact O-CG 3.46Å; T357-M361 PolarHBondContact O-N 2.92Å
358	Y	96.1	Very high	94.7	Very high	18 Å²	18	56 Å²	56	7%	0.071	28%	0.28	C	S	.	.	H	α-helix	trans	-71.1	-30.7	178.4	-73.4	-80.3	0	0	0	113.2	Y294 L296 Q341 H343 I354 L355 L360 M361 H363	Y294-Y358 AromaticContact CD1-CE1 3.94Å; Y294-Y358 HydrophobicContact CD1-CE1 3.94Å; Y294-Y358 HydrophobicContact CD2-CD1 4.24Å; Y294-Y358 HydrophobicContact CD2-CE1 4.44Å; Y294-Y358 HydrophobicContact CE1-CE1 4.25Å; Y294-Y358 HydrophobicContact CG-CD1 4.17Å; Y294-Y358 HydrophobicContact CG-CE1 4.02Å; L296-Y358 HydrophobicContact CD1-CD2 3.5Å; L296-Y358 VanDerWaalsContact CD1-CD2 3.5Å; L296-Y358 HydrophobicContact CD1-CE2 4Å; L296-Y358 HydrophobicContact CD1-CG 3.85Å; L296-Y358 HydrophobicContact CD2-CD1 3.88Å; L296-Y358 HydrophobicContact CD2-CD2 3.65Å; L296-Y358 HydrophobicContact CD2-CE1 3.63Å; L296-Y358 HydrophobicContact CD2-CE2 3.39Å; L296-Y358 HydrophobicContact CD2-CG 3.9Å; L296-Y358 HydrophobicContact CG-CD2 4.24Å; L296-Y358 HydrophobicContact CG-CE2 4.36Å; L296-Y358 HydrophobicContact CG-CG 4.46Å; Q341-Y358 WeakPolarHBondContact CB-OH 2.91Å; Q341-Y358 HydrophobicContact CG-CE1 4.28Å; Q341-Y358 WeakPolarHBondContact CG-OH 3.36Å; Q341-Y358 PolarHBondContact OE1-OH 2.73Å; H343-Y358 AromaticContact NE2-CE2 3.77Å; I354-Y358 HydrophobicContact CG2-CD2 4.01Å; I354-Y358 HydrophobicContact CG2-CE2 4Å; I354-Y358 VanDerWaalsContact O-CD2 3.31Å; I354-Y358 WeakPolarHBondContact O-CD2 3.49Å; I354-Y358 PolarHBondContact O-N 2.6Å; I354-Y358 VanDerWaalsContact O-N 3.12Å; L355-Y358 PolarHBondContact O-N 3.24Å; Y358-L360 VanDerWaalsContact C-N 3.26Å; Y358-L360 PolarHBondContact O-N 3.42Å; Y358-M361 HydrophobicContact CD1-SD 3.65Å; Y358-M361 HydrophobicContact CE1-CE 4.41Å; Y358-M361 HydrophobicContact CE1-SD 3.86Å; Y358-M361 HydrophobicContact CG-SD 4.45Å; Y358-M361 PolarHBondContact O-N 3.28Å; Y358-H363 PolarHBondContact O-NE2 3.44Å
359	Q	93.4	Very high	94.9	Very high	14 Å²	14	55.2 Å²	55.2	7%	0.065	28%	0.275	C	S	.	.	H	α-helix	trans	-57.3	-42.2	171.4	177	-163.5	-9.2	0	0	111.3	L355 K356 M361 Q398 F399 K403 C404	L355-Q359 WeakPolarHBondContact O-CB 3.28Å; L355-Q359 PolarHBondContact O-N 2.83Å; K356-Q359 PolarHBondContact O-N 3.36Å; Q359-M361 VanDerWaalsContact C-N 3.32Å; Q359-Q398 VanDerWaalsContact CG-O 3.26Å; Q359-Q398 WeakPolarHBondContact CG-O 3.38Å; Q359-F399 HydrophobicContact CB-CE1 4.41Å; Q359-K403 WeakPolarHBondContact CG-O 3.46Å; Q359-K403 PolarHBondContact NE2-O 3.29Å; Q359-C404 HydrophobicContact CG-CB 4.23Å; Q359-C404 PolarHBondContact O-SG 3.45Å
360	L	92.6	Very high	95	Very high	127 Å²	127	48 Å²	48	67%	0.665	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	-82	-8.9	-176.1	-67.1	173	0	0	0	113.6	K356 T357 Y358	K356-L360 HydrophobicContact CD-CD1 4.43Å; K356-L360 HydrophobicContact CD-CG 4.49Å; K356-L360 HydrophobicContact CG-CD1 4.3Å; K356-L360 VanDerWaalsContact O-CG 3.31Å; K356-L360 WeakPolarHBondContact O-CG 3.25Å; K356-L360 PolarHBondContact O-N 3.17Å; T357-L360 PolarHBondContact O-N 3.16Å; Y358-L360 VanDerWaalsContact C-N 3.26Å; Y358-L360 PolarHBondContact O-N 3.42Å
361	M	94.1	Very high	95	Very high	69 Å²	69	43.5 Å²	43.5	34%	0.34	22%	0.222	S	C	.	.	S	Bend	trans	-73	154.2	175.6	-75.7	-177.8	173.4	0	0	111.7	Y294 T357 Y358 Q359 H363 S406	Y294-M361 HydrophobicContact CE2-SD 4.31Å; T357-M361 HydrophobicContact CG2-CE 4.1Å; T357-M361 WeakPolarHBondContact O-CG 3.46Å; T357-M361 PolarHBondContact O-N 2.92Å; Y358-M361 HydrophobicContact CD1-SD 3.65Å; Y358-M361 HydrophobicContact CE1-CE 4.41Å; Y358-M361 HydrophobicContact CE1-SD 3.86Å; Y358-M361 HydrophobicContact CG-SD 4.45Å; Y358-M361 PolarHBondContact O-N 3.28Å; Q359-M361 VanDerWaalsContact C-N 3.32Å; M361-H363 PolarHBondContact O-CD2 3.24Å; M361-S406 PolarHBondContact O-OG 3.44Å
362	D	92.2	Very high	95.1	Very high	102 Å²	102	43.5 Å²	43.5	55%	0.545	22%	0.222	S	C	.	.			trans	-82.3	119.7	170.3	-176.2	21.8	0	0	0	110.4	S364 S406	D362-S364 WeakPolarHBondContact OD1-CB 3.4Å; D362-S364 PolarHBondContact OD1-N 3.21Å; D362-S364 PolarHBondContact OD1-OG 2.9Å; D362-S406 WeakPolarHBondContact OD1-CB 3.47Å
363	H	94.2	Very high	95.2	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	21%	0.212	C	C	.	.			trans	-104.7	11.6	176.1	-59.1	-87.6	0	0	0	112.1	Y294 Y358 M361 N365 K366 S406 L407 K410	Y294-H363 AromaticContact CD2-CE1 3.62Å; Y294-H363 AromaticContact CD2-ND1 3.63Å; Y294-H363 AromaticContact CE2-CE1 3.97Å; Y294-H363 AromaticContact CE2-ND1 3.92Å; Y358-H363 PolarHBondContact O-NE2 3.44Å; M361-H363 PolarHBondContact O-CD2 3.24Å; H363-N365 PolarHBondContact O-N 2.81Å; H363-K366 HydrophobicContact CB-CB 4.35Å; H363-K366 WeakPolarHBondContact O-CA 3.24Å; H363-K366 WeakPolarHBondContact O-CB 3.43Å; H363-K366 PolarHBondContact O-N 3.47Å; H363-S406 PolarHBondContact CD2-OG 2.94Å; H363-S406 PolarHBondContact N-OG 2.83Å; H363-L407 HydrophobicContact CB-CD2 3.46Å; H363-L407 VanDerWaalsContact CB-CD2 3.46Å; H363-L407 HydrophobicContact CB-CG 3.75Å; H363-K410 PolarHBondContact O-NZ 3.34Å
364	S	90.1	Very high	95.1	Very high	77 Å²	77	33.7 Å²	33.7	54%	0.538	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.6	-36.6	-175.5	-64.8	0	0	0	0	112.9	D362 K410	D362-S364 WeakPolarHBondContact OD1-CB 3.4Å; D362-S364 PolarHBondContact OD1-N 3.21Å; D362-S364 PolarHBondContact OD1-OG 2.9Å; S364-K410 PolarHBondContact O-NZ 2.86Å
365	N	92.3	Very high	94.9	Very high	113 Å²	113	33.1 Å²	33.1	60%	0.604	18%	0.178	S	C	*	.	T	Hydrogen-bonded Turn	trans	-85.4	-1.6	176.8	67.4	-12.7	0	0	0	114.9	S289 H363	S289-N365 VanDerWaalsContact CB-O 3.3Å; S289-N365 WeakPolarHBondContact CB-O 3.34Å; H363-N365 PolarHBondContact O-N 2.81Å
366	K	94.9	Very high	94.6	Very high	4 Å²	4	34.6 Å²	34.6	2%	0.017	18%	0.184	C	C	.	.			trans	-103.3	150.4	175.4	-55.6	-55.6	-178.5	98.2	0	109.4	P291 Y294 E339 H363 K410	P291-K366 HydrophobicContact CG-CD 4.08Å; P291-K366 WeakPolarHBondContact O-CD 3.36Å; Y294-K366 HydrophobicContact CE2-CG 4.5Å; E339-K366 IonicContact OE2-NZ 3.25Å; E339-K366 PolarHBondContact OE2-NZ 3.07Å; H363-K366 HydrophobicContact CB-CB 4.35Å; H363-K366 WeakPolarHBondContact O-CA 3.24Å; H363-K366 WeakPolarHBondContact O-CB 3.43Å; H363-K366 PolarHBondContact O-N 3.47Å; K366-K410 VanDerWaalsContact O-CD 3.26Å; K366-K410 WeakPolarHBondContact O-CD 3.26Å; K366-K410 WeakPolarHBondContact O-CE 3.47Å; K366-K410 PolarHBondContact O-NZ 3.07Å
367	D	94.6	Very high	94.2	Very high	10 Å²	10	30.8 Å²	30.8	5%	0.053	17%	0.171	C	C	.	.	S	Bend	trans	-100.2	-22.1	177.3	-74.2	-36.7	0	0	0	113.2	Q286 M287 K288 S289 R292 K410 P411	Q286-D367 PolarHBondContact NE2-OD1 3.33Å; Q286-D367 WeakPolarHBondContact O-CB 3.4Å; M287-D367 HydrophobicContact SD-CB 4.11Å; K288-D367 PolarHBondContact N-OD2 3.08Å; S289-D367 VanDerWaalsContact CB-OD2 3.27Å; S289-D367 WeakPolarHBondContact CB-OD2 3.23Å; S289-D367 PolarHBondContact N-OD2 3.34Å; S289-D367 WeakPolarHBondContact OG-CB 3.5Å; S289-D367 PolarHBondContact OG-N 2.83Å; S289-D367 VanDerWaalsContact OG-N 3.13Å; S289-D367 PolarHBondContact OG-OD2 2.84Å; R292-D367 PolarHBondContact O-N 3.17Å; D367-K410 WeakPolarHBondContact O-CB 3.37Å; D367-P411 VanDerWaalsContact O-CD 3.31Å; D367-P411 WeakPolarHBondContact O-CD 3.26Å
368	C	96.5	Very high	93.2	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	156.2	-175.2	-172.8	0	0	0	0	111.4	M287 R292 G293 F338 P411	M287-C368 HydrophobicContact CE-CB 3.84Å; M287-C368 HydrophobicContact SD-CB 3.81Å; R292-C368 PolarHBondContact O-N 2.75Å; G293-C368 WeakPolarHBondContact CA-O 3.14Å; F338-C368 HydrophobicContact CE1-CB 3.78Å; F338-C368 HydrophobicContact CZ-CB 3.9Å; C368-P411 HydrophobicContact CB-CG 3.96Å
369	F	97.9	Very high	92.2	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	133.2	168.2	173.7	-99.7	0	0	0	109.7	L296 C371 F399 L407 P411 V413 F414	L296-F369 HydrophobicContact CD1-CE2 3.94Å; L296-F369 HydrophobicContact CD1-CZ 3.72Å; L296-F369 HydrophobicContact CG-CE2 3.95Å; L296-F369 HydrophobicContact CG-CZ 4.02Å; F369-C371 HydrophobicContact CE1-CB 3.79Å; F369-C371 HydrophobicContact CZ-CB 3.98Å; F369-F399 HydrophobicContact CD1-CD1 4.19Å; F369-F399 HydrophobicContact CD1-CE1 4.31Å; F369-F399 HydrophobicContact CD1-CG 4.5Å; F369-F399 AromaticContact CE1-CD1 3.91Å; F369-F399 HydrophobicContact CE1-CD1 3.91Å; F369-F399 HydrophobicContact CE1-CD2 4.19Å; F369-F399 AromaticContact CE1-CE1 3.7Å; F369-F399 HydrophobicContact CE1-CE1 3.7Å; F369-F399 AromaticContact CE1-CE2 3.99Å; F369-F399 HydrophobicContact CE1-CE2 3.99Å; F369-F399 HydrophobicContact CE1-CG 4.15Å; F369-F399 AromaticContact CE1-CZ 3.73Å; F369-F399 HydrophobicContact CE1-CZ 3.73Å; F369-F399 AromaticContact CE2-CE1 3.96Å; F369-F399 HydrophobicContact CE2-CE1 3.96Å; F369-F399 HydrophobicContact CE2-CZ 4.26Å; F369-F399 HydrophobicContact CZ-CD1 4.18Å; F369-F399 AromaticContact CZ-CE1 3.5Å; F369-F399 HydrophobicContact CZ-CE1 3.5Å; F369-F399 VanDerWaalsContact CZ-CE1 3.5Å; F369-F399 HydrophobicContact CZ-CE2 4.1Å; F369-F399 AromaticContact CZ-CZ 3.44Å; F369-F399 HydrophobicContact CZ-CZ 3.44Å; F369-F399 VanDerWaalsContact CZ-CZ 3.44Å; F369-L407 HydrophobicContact CB-CD1 3.78Å; F369-L407 HydrophobicContact CB-CD2 3.92Å; F369-L407 HydrophobicContact CG-CD1 4.04Å; F369-P411 PolarHBondContact N-O 2.75Å; F369-V413 PolarHBondContact O-N 3.3Å; F369-F414 HydrophobicContact CD1-CZ 4.46Å; F369-F414 HydrophobicContact CE1-CE1 4.35Å; F369-F414 AromaticContact CE1-CZ 3.91Å; F369-F414 HydrophobicContact CE1-CZ 3.91Å
370	I	98.1	Very high	91.3	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	136.8	177.9	-54.3	-173.3	0	0	0	109.7	Y294 C295 L296 F333 F338 V413 F415 F535	Y294-I370 PolarHBondContact O-N 3.11Å; C295-I370 CarbonylContact C-O 3.41Å; C295-I370 VanDerWaalsContact CA-O 3.32Å; C295-I370 WeakPolarHBondContact CA-O 3.42Å; C295-I370 HydrophobicContact CB-CB 4.17Å; L296-I370 PolarHBondContact N-O 3.46Å; F333-I370 HydrophobicContact CD1-CD1 3.69Å; F333-I370 HydrophobicContact CE1-CD1 3.42Å; F333-I370 VanDerWaalsContact CE1-CD1 3.42Å; F333-I370 HydrophobicContact CE2-CG2 4.45Å; F333-I370 HydrophobicContact CZ-CD1 4.09Å; F333-I370 HydrophobicContact CZ-CG2 4.31Å; F338-I370 HydrophobicContact CD1-CD1 3.93Å; F338-I370 HydrophobicContact CD1-CG1 4.14Å; F338-I370 HydrophobicContact CD2-CD1 4.34Å; F338-I370 HydrophobicContact CE1-CD1 3.47Å; F338-I370 VanDerWaalsContact CE1-CD1 3.47Å; F338-I370 HydrophobicContact CE1-CG1 3.65Å; F338-I370 HydrophobicContact CE2-CD1 3.92Å; F338-I370 HydrophobicContact CG-CD1 4.35Å; F338-I370 HydrophobicContact CZ-CD1 3.48Å; F338-I370 VanDerWaalsContact CZ-CD1 3.48Å; F338-I370 HydrophobicContact CZ-CG1 4.1Å; I370-V413 CarbonylContact C-O 3.59Å; I370-V413 VanDerWaalsContact CA-O 3.28Å; I370-V413 WeakPolarHBondContact CA-O 3.4Å; I370-V413 HydrophobicContact CG1-CB 4.19Å; I370-F415 HydrophobicContact CG2-CD2 4.13Å; I370-F415 HydrophobicContact CG2-CE2 4.21Å; I370-F535 HydrophobicContact CD1-CZ 4.35Å
371	C	97.9	Very high	90.9	Very high	0 Å²	0	31 Å²	31	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	114.1	173.4	-175.9	0	0	0	0	110.7	L296 F369 V413 F414 F415	L296-C371 HydrophobicContact CB-CB 4.46Å; F369-C371 HydrophobicContact CE1-CB 3.79Å; F369-C371 HydrophobicContact CZ-CB 3.98Å; C371-V413 PolarHBondContact N-O 3.45Å; C371-F414 HydrophobicContact CB-CD1 3.64Å; C371-F414 HydrophobicContact CB-CE1 3.63Å; C371-F414 HydrophobicContact CB-CG 4.43Å; C371-F414 HydrophobicContact CB-CZ 4.41Å; C371-F414 CarbonylContact O-C 3.57Å; C371-F414 VanDerWaalsContact O-CA 3.27Å; C371-F414 WeakPolarHBondContact O-CA 3.44Å; C371-F415 PolarHBondContact O-N 2.98Å
372	C	97.8	Very high	90.8	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	126	176.6	-56.6	0	0	0	0	109.5	L296 I297 I298 L329 F415	L296-C372 PolarHBondContact O-N 3.39Å; I297-C372 HydrophobicContact CG1-CB 4.43Å; I298-C372 PolarHBondContact N-O 3.2Å; L329-C372 HydrophobicContact CD1-CB 3.91Å; C372-F415 CarbonylContact C-O 3.58Å; C372-F415 WeakPolarHBondContact CA-O 3.44Å
373	I	96.9	Very high	90.7	Very high	0 Å²	0	23.4 Å²	23.4	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	115	178.1	-54.3	-175.4	0	0	0	109	I298 I382 L395 F415 I416 Q417	I298-I373 HydrophobicContact CD1-CG1 4.36Å; I373-I382 HydrophobicContact CG2-CD1 4.14Å; I373-I382 HydrophobicContact CG2-CG1 4.37Å; I373-L395 HydrophobicContact CD1-CD1 3.73Å; I373-F415 PolarHBondContact N-O 3.41Å; I373-I416 HydrophobicContact CB-CD1 3.88Å; I373-I416 HydrophobicContact CD1-CD1 3.82Å; I373-I416 HydrophobicContact CG1-CD1 3.9Å; I373-Q417 PolarHBondContact O-N 2.93Å
374	L	95.6	Very high	90.8	Very high	0 Å²	0	23.4 Å²	23.4	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	99.2	178.6	-47.1	-179	0	0	0	108.4	I297 I298 N299 N300 R319 D325 A326 L329 Q417 I481	I297-L374 HydrophobicContact CG2-CD1 4.5Å; I298-L374 PolarHBondContact O-N 3.4Å; N299-L374 HydrophobicContact CB-CD1 4.46Å; N300-L374 PolarHBondContact N-O 3.12Å; R319-L374 VanDerWaalsContact CZ-C 3.49Å; R319-L374 PolarHBondContact NH1-O 2.91Å; R319-L374 VanDerWaalsContact NH1-O 3.08Å; D325-L374 HydrophobicContact CB-CD1 3.83Å; A326-L374 HydrophobicContact CB-CD1 4.26Å; L329-L374 HydrophobicContact CD1-CD1 4.17Å; L329-L374 HydrophobicContact CD1-CD2 4.08Å; L329-L374 HydrophobicContact CD1-CG 4.47Å; L374-Q417 HydrophobicContact CD2-CB 3.66Å; L374-Q417 HydrophobicContact CD2-CG 4.15Å; L374-I481 HydrophobicContact CD2-CD1 3.95Å; L374-I481 HydrophobicContact CD2-CG1 3.87Å
375	S	92.9	Very high	91	Very high	2 Å²	2	20 Å²	20	1%	0.014	11%	0.11	C	C	.	.	S	Bend	trans	-149.8	-179.1	-176.7	-157.4	0	0	0	0	112.4	N300 F303 R319 Y383 Q417 A418	N300-S375 PolarHBondContact ND2-OG 3.18Å; F303-S375 WeakPolarHBondContact CZ-OG 3.48Å; R319-S375 VanDerWaalsContact NE-C 3.28Å; R319-S375 PolarHBondContact NE-O 2.89Å; S375-Y383 PolarHBondContact OG-O 3.21Å; S375-Q417 PolarHBondContact N-O 3.34Å; S375-Q417 VanDerWaalsContact N-O 3.08Å; S375-Q417 VanDerWaalsContact O-O 3.04Å; S375-A418 WeakPolarHBondContact O-CA 3.47Å
376	H	88.4	Confident	91	Very high	31 Å²	31	15.8 Å²	15.8	14%	0.144	9%	0.087	C	C	.	.			trans	-78.7	162	158	-71.9	-67.1	0	0	0	109.2	F303 I316 R317 R319 Y383	F303-H376 AromaticContact CD2-CD2 3.65Å; F303-H376 HydrophobicContact CE1-CB 4.32Å; F303-H376 AromaticContact CE1-CD2 3.92Å; F303-H376 AromaticContact CE2-CD2 3.49Å; F303-H376 VanDerWaalsContact CE2-CD2 3.49Å; F303-H376 WeakPolarHBondContact CE2-CD2 3.36Å; F303-H376 AromaticContact CG-CD2 3.96Å; F303-H376 HydrophobicContact CZ-CB 4.28Å; F303-H376 AromaticContact CZ-CD2 3.62Å; I316-H376 HydrophobicContact CD1-CB 3.84Å; I316-H376 VanDerWaalsContact CD1-CD2 3.42Å; I316-H376 WeakPolarHBondContact CD1-CD2 3.4Å; R317-H376 PolarHBondContact O-NE2 2.95Å; R319-H376 WeakPolarHBondContact CG-NE2 3.38Å; H376-Y383 HydrophobicContact CB-CD2 4.02Å; H376-Y383 PolarHBondContact O-N 3Å
377	G	84.8	Confident	90.8	Very high	10 Å²	10	15.7 Å²	15.7	10%	0.103	9%	0.087	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-163.3	177.4	176.4	0	0	0	0	0	111.4	I381 C419	G377-I381 WeakPolarHBondContact CA-O 3.3Å; G377-C419 CarbonylContact C-O 3.56Å; G377-C419 WeakPolarHBondContact CA-O 3.3Å
378	D	75.9	Confident	90.7	Very high	56 Å²	56	20.2 Å²	20.2	30%	0.299	11%	0.108	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	-177.4	173.3	-163.1	-5.6	0	0	0	107	G380 I381 Y383 C419 Q420 G421	D378-G380 PolarHBondContact O-N 3.27Å; D378-I381 HydrophobicContact CB-CD1 3.79Å; D378-I381 HydrophobicContact CB-CG1 3.91Å; D378-I381 VanDerWaalsContact N-CD1 3.32Å; D378-I381 PolarHBondContact N-O 2.92Å; D378-I381 PolarHBondContact O-N 3.29Å; D378-Y383 HydrophobicContact CB-CE2 4.27Å; D378-C419 PolarHBondContact N-O 2.81Å; D378-Q420 PolarHBondContact O-NE2 3.09Å; D378-G421 WeakPolarHBondContact OD1-CA 3.46Å
379	K	75.6	Confident	90.4	Very high	124 Å²	124	24 Å²	24	54%	0.539	13%	0.126	S	C	.	.	T	Hydrogen-bonded Turn	trans	-49	107.3	-174.4	-172.4	177.3	-175.4	160.6	0	112.9	I381 Q420 N467	K379-I381 VanDerWaalsContact C-N 3.28Å; K379-I381 PolarHBondContact O-N 3.13Å; K379-Q420 WeakPolarHBondContact CA-O 3.31Å; K379-Q420 PolarHBondContact N-O 3.04Å; K379-N467 WeakPolarHBondContact CD-OD1 3.39Å; K379-N467 WeakPolarHBondContact CE-OD1 3.15Å; K379-N467 PolarHBondContact NZ-OD1 3.27Å
380	G	73.3	Confident	89.9	Confident	34 Å²	34	24 Å²	24	35%	0.351	13%	0.126	S	C	.	.	T	Hydrogen-bonded Turn	trans	76.2	4.3	177.3	0	0	0	0	0	115.6	D378 I392	D378-G380 PolarHBondContact O-N 3.27Å; G380-I392 PolarHBondContact O-N 3.18Å
381	I	85.5	Confident	89.4	Confident	20 Å²	20	26.2 Å²	26.2	10%	0.103	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	159.5	-175.4	68.5	82.2	0	0	0	112	G377 D378 K379 Y383 E389 A390 Q420	G377-I381 WeakPolarHBondContact CA-O 3.3Å; D378-I381 HydrophobicContact CB-CD1 3.79Å; D378-I381 HydrophobicContact CB-CG1 3.91Å; D378-I381 VanDerWaalsContact N-CD1 3.32Å; D378-I381 PolarHBondContact N-O 2.92Å; D378-I381 PolarHBondContact O-N 3.29Å; K379-I381 VanDerWaalsContact C-N 3.28Å; K379-I381 PolarHBondContact O-N 3.13Å; I381-Y383 HydrophobicContact CD1-CD1 4.33Å; I381-Y383 HydrophobicContact CD1-CD2 4.05Å; I381-Y383 HydrophobicContact CD1-CE1 4.07Å; I381-Y383 HydrophobicContact CD1-CE2 3.76Å; I381-Y383 HydrophobicContact CD1-CG 4.31Å; I381-E389 HydrophobicContact CB-CB 4.39Å; I381-E389 HydrophobicContact CD1-CB 4.3Å; I381-E389 HydrophobicContact CD1-CG 3.89Å; I381-E389 HydrophobicContact CG1-CB 4.42Å; I381-E389 HydrophobicContact CG1-CG 4.28Å; I381-A390 WeakPolarHBondContact CA-O 3.19Å; I381-Q420 PolarHBondContact O-NE2 2.6Å
382	I	90.4	Very high	88.8	Confident	0 Å²	0	26.7 Å²	26.7	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	148.3	164.2	60.3	99	0	0	0	109.6	I351 I373 A390 I392 L395 I416 A418	I351-I382 HydrophobicContact CD1-CD1 3.77Å; I373-I382 HydrophobicContact CG2-CD1 4.14Å; I373-I382 HydrophobicContact CG2-CG1 4.37Å; I382-A390 HydrophobicContact CD1-CB 3.91Å; I382-A390 HydrophobicContact CG1-CB 4.08Å; I382-A390 PolarHBondContact N-O 3.31Å; I382-A390 PolarHBondContact O-N 3.35Å; I382-I392 HydrophobicContact CG2-CD1 4.3Å; I382-I392 HydrophobicContact CG2-CG1 4.05Å; I382-L395 HydrophobicContact CD1-CD1 3.94Å; I382-L395 HydrophobicContact CG1-CD1 3.65Å; I382-I416 HydrophobicContact CG2-CG2 3.85Å; I382-A418 HydrophobicContact CG2-CB 3.84Å
383	Y	91.6	Very high	88	Confident	11 Å²	11	33.5 Å²	33.5	4%	0.043	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	138.2	175.8	-73.8	-67.1	0	0	0	111.1	N300 L313 S375 H376 D378 I381 G387 Q388 E389	N300-Y383 PolarHBondContact ND2-O 3.01Å; L313-Y383 HydrophobicContact CD1-CD1 3.89Å; L313-Y383 HydrophobicContact CD1-CE1 3.78Å; L313-Y383 HydrophobicContact CD1-CG 4.44Å; L313-Y383 HydrophobicContact CD2-CE1 4.45Å; L313-Y383 HydrophobicContact CD2-CE2 4.38Å; S375-Y383 PolarHBondContact OG-O 3.21Å; H376-Y383 HydrophobicContact CB-CD2 4.02Å; H376-Y383 PolarHBondContact O-N 3Å; D378-Y383 HydrophobicContact CB-CE2 4.27Å; I381-Y383 HydrophobicContact CD1-CD1 4.33Å; I381-Y383 HydrophobicContact CD1-CD2 4.05Å; I381-Y383 HydrophobicContact CD1-CE1 4.07Å; I381-Y383 HydrophobicContact CD1-CE2 3.76Å; I381-Y383 HydrophobicContact CD1-CG 4.31Å; Y383-G387 WeakPolarHBondContact CD1-O 3.49Å; Y383-Q388 WeakPolarHBondContact CA-O 3.39Å; Y383-E389 HydrophobicContact CD1-CG 3.84Å; Y383-E389 HydrophobicContact CE1-CG 3.26Å; Y383-E389 WeakPolarHBondContact CE1-OE1 3.33Å; Y383-E389 PolarHBondContact OH-OE1 3.08Å
384	G	94.9	Very high	87.3	Confident	0 Å²	0	37.9 Å²	37.9	0%	0	19%	0.19	C	C	.	.			trans	-76.5	167.9	158.8	0	0	0	0	0	111.3	F303 C346 D386 G387 Q388	F303-G384 WeakPolarHBondContact CE1-O 3.41Å; C346-G384 WeakPolarHBondContact O-CA 3.47Å; G384-D386 WeakPolarHBondContact CA-OD1 3.31Å; G384-D386 PolarHBondContact O-N 2.83Å; G384-D386 VanDerWaalsContact O-N 3.14Å; G384-G387 PolarHBondContact O-N 3.13Å; G384-Q388 PolarHBondContact N-O 2.9Å
385	T	94.9	Very high	87	Confident	5 Å²	5	37.9 Å²	37.9	3%	0.031	19%	0.19	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-18.1	175.6	53.6	0	0	0	0	113.6	N300 D302 A306 D345 C346 T347 G387	N300-T385 HydrophobicContact CB-CG2 3.98Å; D302-T385 VanDerWaalsContact O-CB 3.25Å; D302-T385 WeakPolarHBondContact O-CB 3.38Å; D302-T385 WeakPolarHBondContact O-CG2 3.41Å; A306-T385 PolarHBondContact N-O 2.76Å; D345-T385 HydrophobicContact CB-CG2 3.95Å; D345-T385 PolarHBondContact O-OG1 3.19Å; C346-T385 PolarHBondContact O-N 3.16Å; C346-T385 PolarHBondContact O-OG1 2.98Å; T347-T385 PolarHBondContact N-OG1 3.42Å; T385-G387 VanDerWaalsContact C-N 3.28Å
386	D	93.3	Very high	86.8	Confident	25 Å²	25	38.8 Å²	38.8	13%	0.134	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.9	-5.3	171.1	56.7	-19.6	0	0	0	114.1	T347 V348 G384 Q388	T347-D386 HydrophobicContact CG2-CB 3.87Å; V348-D386 PolarHBondContact N-OD1 3.14Å; G384-D386 WeakPolarHBondContact CA-OD1 3.31Å; G384-D386 PolarHBondContact O-N 2.83Å; G384-D386 VanDerWaalsContact O-N 3.14Å; D386-Q388 HydrophobicContact CB-CG 4.43Å; D386-Q388 PolarHBondContact O-N 3.12Å; D386-Q388 WeakPolarHBondContact OD2-CG 3.49Å
387	G	89.8	Confident	86.7	Confident	2 Å²	2	37.9 Å²	37.9	2%	0.021	19%	0.192	C	C	.	.	S	Bend	trans	77.6	5.1	-178.8	0	0	0	0	0	114	A306 L313 Y383 G384 T385	A306-G387 VanDerWaalsContact CB-CA 3.41Å; L313-G387 WeakPolarHBondContact CD1-O 3.3Å; Y383-G387 WeakPolarHBondContact CD1-O 3.49Å; G384-G387 PolarHBondContact O-N 3.13Å; T385-G387 VanDerWaalsContact C-N 3.28Å
388	Q	93.4	Very high	86.8	Confident	105 Å²	105	38.9 Å²	38.9	49%	0.491	19%	0.194	S	C	.	.			trans	-75.8	154.3	172.3	-62.6	-60.2	-24.9	0	0	110.2	V348 Y383 G384 D386	V348-Q388 HydrophobicContact CB-CB 4.06Å; V348-Q388 VanDerWaalsContact CG2-C 3.48Å; V348-Q388 HydrophobicContact CG2-CB 3.66Å; V348-Q388 WeakPolarHBondContact CG2-O 2.96Å; Y383-Q388 WeakPolarHBondContact CA-O 3.39Å; G384-Q388 PolarHBondContact N-O 2.9Å; D386-Q388 HydrophobicContact CB-CG 4.43Å; D386-Q388 PolarHBondContact O-N 3.12Å; D386-Q388 WeakPolarHBondContact OD2-CG 3.49Å
389	E	90.4	Very high	87.5	Confident	80 Å²	80	36.2 Å²	36.2	37%	0.374	18%	0.18	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-97	135.3	-176.4	-65.4	176.7	-179.4	0	0	110.5	K312 I381 Y383	K312-E389 IonicContact NZ-OE1 3Å; K312-E389 PolarHBondContact NZ-OE1 3.2Å; I381-E389 HydrophobicContact CB-CB 4.39Å; I381-E389 HydrophobicContact CD1-CB 4.3Å; I381-E389 HydrophobicContact CD1-CG 3.89Å; I381-E389 HydrophobicContact CG1-CB 4.42Å; I381-E389 HydrophobicContact CG1-CG 4.28Å; Y383-E389 HydrophobicContact CD1-CG 3.84Å; Y383-E389 HydrophobicContact CE1-CG 3.26Å; Y383-E389 WeakPolarHBondContact CE1-OE1 3.33Å; Y383-E389 PolarHBondContact OH-OE1 3.08Å
390	A	87.2	Confident	87.9	Confident	0 Å²	0	30.6 Å²	30.6	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	113.1	171	0	0	0	0	0	108.8	V348 Y352 I381 I382 I392 L395	V348-A390 HydrophobicContact CG1-CB 3.98Å; V348-A390 HydrophobicContact CG2-CB 4.09Å; Y352-A390 HydrophobicContact CE2-CB 4.24Å; I381-A390 WeakPolarHBondContact CA-O 3.19Å; I382-A390 HydrophobicContact CD1-CB 3.91Å; I382-A390 HydrophobicContact CG1-CB 4.08Å; I382-A390 PolarHBondContact N-O 3.31Å; I382-A390 PolarHBondContact O-N 3.35Å; A390-I392 PolarHBondContact O-N 3.48Å; A390-L395 HydrophobicContact CB-CD1 4.28Å; A390-L395 HydrophobicContact CB-CD2 4.25Å; A390-L395 HydrophobicContact CB-CG 4.48Å
391	P	86.6	Confident	88	Confident	45 Å²	45	29.8 Å²	29.8	29%	0.292	15%	0.147	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.7	130.5	175	-21.8	33.1	0	0	0	111.3	Y393 E394 L395	P391-Y393 PolarHBondContact O-N 2.88Å; P391-E394 HydrophobicContact CB-CB 4.34Å; P391-E394 HydrophobicContact CB-CG 4.09Å; P391-E394 HydrophobicContact CG-CG 4.25Å; P391-E394 WeakPolarHBondContact O-CB 3.25Å; P391-E394 PolarHBondContact O-N 3.06Å; P391-L395 PolarHBondContact O-N 3.15Å
392	I	85.9	Confident	87.6	Confident	11 Å²	11	35.4 Å²	35.4	6%	0.056	18%	0.177	C	C	.	.	H	α-helix	trans	-58.1	-39.1	-178.3	-65.3	168.3	0	0	0	110.6	G380 I382 A390 E394 L395 T396 I416 L460 M462	G380-I392 PolarHBondContact O-N 3.18Å; I382-I392 HydrophobicContact CG2-CD1 4.3Å; I382-I392 HydrophobicContact CG2-CG1 4.05Å; A390-I392 PolarHBondContact O-N 3.48Å; I392-E394 VanDerWaalsContact C-N 3.29Å; I392-E394 PolarHBondContact O-N 2.91Å; I392-L395 WeakPolarHBondContact O-CB 3.46Å; I392-L395 PolarHBondContact O-N 3.14Å; I392-L395 VanDerWaalsContact O-N 3.12Å; I392-T396 HydrophobicContact CG2-CG2 4.25Å; I392-T396 PolarHBondContact O-N 3.33Å; I392-T396 PolarHBondContact O-OG1 3.37Å; I392-I416 HydrophobicContact CD1-CG2 4.07Å; I392-I416 HydrophobicContact CG2-CG1 4.44Å; I392-L460 HydrophobicContact CG2-CD1 4.27Å; I392-L460 HydrophobicContact CG2-CD2 4.32Å; I392-M462 HydrophobicContact CD1-CE 3.6Å; I392-M462 HydrophobicContact CD1-SD 4.15Å
393	Y	81.5	Confident	87.1	Confident	143 Å²	143	39.6 Å²	39.6	56%	0.561	20%	0.195	S	C	*	.	H	α-helix	trans	-57.7	-38.4	175.2	178.6	-101.5	0	0	0	113	P391 L395 T396 S397 E455	P391-Y393 PolarHBondContact O-N 2.88Å; Y393-L395 VanDerWaalsContact C-N 3.31Å; Y393-L395 PolarHBondContact O-N 3.24Å; Y393-T396 PolarHBondContact O-OG1 2.9Å; Y393-S397 WeakPolarHBondContact O-CB 3.38Å; Y393-S397 PolarHBondContact O-N 3.37Å; Y393-S397 PolarHBondContact O-OG 2.99Å; Y393-E455 PolarHBondContact OH-OE1 3.42Å
394	E	82	Confident	87	Confident	91 Å²	91	39.1 Å²	39.1	43%	0.425	19%	0.194	S	C	.	.	H	α-helix	trans	-70.9	-29.7	178.3	-72.3	-169.9	-176.9	0	0	112.6	Y352 P391 I392 S397 Q398	Y352-E394 HydrophobicContact CE1-CB 4.1Å; Y352-E394 WeakPolarHBondContact OH-CB 3.19Å; Y352-E394 PolarHBondContact OH-OE2 3.11Å; P391-E394 HydrophobicContact CB-CB 4.34Å; P391-E394 HydrophobicContact CB-CG 4.09Å; P391-E394 HydrophobicContact CG-CG 4.25Å; P391-E394 WeakPolarHBondContact O-CB 3.25Å; P391-E394 PolarHBondContact O-N 3.06Å; I392-E394 VanDerWaalsContact C-N 3.29Å; I392-E394 PolarHBondContact O-N 2.91Å; E394-S397 PolarHBondContact O-OG 3.02Å; E394-Q398 WeakPolarHBondContact O-CG 3.35Å; E394-Q398 PolarHBondContact O-NE2 2.93Å
395	L	89.2	Confident	86.5	Confident	1 Å²	1	43.5 Å²	43.5	1%	0.005	22%	0.222	C	C	.	.	H	α-helix	trans	-73.9	-48.4	176.4	-56.2	178.6	0	0	0	111.1	I351 Y352 L355 I373 I382 A390 P391 I392 Y393 Q398	I351-L395 HydrophobicContact CG2-CD2 3.84Å; Y352-L395 HydrophobicContact CD1-CD2 4.17Å; Y352-L395 HydrophobicContact CE1-CD2 3.79Å; Y352-L395 HydrophobicContact CE2-CD2 4.49Å; L355-L395 HydrophobicContact CD1-CB 3.77Å; L355-L395 HydrophobicContact CD1-CD2 3.62Å; L355-L395 HydrophobicContact CD1-CG 4.24Å; I373-L395 HydrophobicContact CD1-CD1 3.73Å; I382-L395 HydrophobicContact CD1-CD1 3.94Å; I382-L395 HydrophobicContact CG1-CD1 3.65Å; A390-L395 HydrophobicContact CB-CD1 4.28Å; A390-L395 HydrophobicContact CB-CD2 4.25Å; A390-L395 HydrophobicContact CB-CG 4.48Å; P391-L395 PolarHBondContact O-N 3.15Å; I392-L395 WeakPolarHBondContact O-CB 3.46Å; I392-L395 PolarHBondContact O-N 3.14Å; I392-L395 VanDerWaalsContact O-N 3.12Å; Y393-L395 VanDerWaalsContact C-N 3.31Å; Y393-L395 PolarHBondContact O-N 3.24Å; L395-Q398 PolarHBondContact O-N 3.43Å
396	T	87.8	Confident	86.3	Confident	21 Å²	21	44.5 Å²	44.5	13%	0.129	23%	0.229	C	C	.	.	H	α-helix	trans	-68.9	-39.9	179.9	56.6	0	0	0	0	111.7	I392 Y393 Q398 F399 F414 F458 L460	I392-T396 HydrophobicContact CG2-CG2 4.25Å; I392-T396 PolarHBondContact O-N 3.33Å; I392-T396 PolarHBondContact O-OG1 3.37Å; Y393-T396 PolarHBondContact O-OG1 2.9Å; T396-Q398 PolarHBondContact O-N 3.42Å; T396-F399 PolarHBondContact O-N 3.5Å; T396-F414 HydrophobicContact CG2-CB 4.39Å; T396-F414 HydrophobicContact CG2-CD1 3.92Å; T396-F414 HydrophobicContact CG2-CD2 4Å; T396-F414 HydrophobicContact CG2-CE1 4.16Å; T396-F414 HydrophobicContact CG2-CE2 4.25Å; T396-F414 HydrophobicContact CG2-CG 3.84Å; T396-F414 HydrophobicContact CG2-CZ 4.33Å; T396-F458 WeakPolarHBondContact O-CE1 3.45Å; T396-L460 HydrophobicContact CG2-CD1 4.39Å
397	S	86.4	Confident	86.2	Confident	11 Å²	11	43.3 Å²	43.3	8%	0.077	22%	0.223	C	C	.	.	G	3₁₀ helix	trans	-67.2	-4.7	179.1	69	0	0	0	0	114.1	Y393 E394 F399 K403	Y393-S397 WeakPolarHBondContact O-CB 3.38Å; Y393-S397 PolarHBondContact O-N 3.37Å; Y393-S397 PolarHBondContact O-OG 2.99Å; E394-S397 PolarHBondContact O-OG 3.02Å; S397-F399 PolarHBondContact O-N 3.09Å; S397-K403 VanDerWaalsContact O-CD 3.23Å; S397-K403 WeakPolarHBondContact O-CD 3.42Å; S397-K403 WeakPolarHBondContact O-CE 3.36Å; S397-K403 PolarHBondContact O-NZ 3.26Å
398	Q	87.7	Confident	86	Confident	32 Å²	32	45.4 Å²	45.4	15%	0.15	24%	0.24	C	C	.	.	G	3₁₀ helix	trans	-68.4	-21.9	168.7	-60.5	-53.1	-42.3	0	0	112.3	Q359 E394 L395 T396 K403	Q359-Q398 VanDerWaalsContact CG-O 3.26Å; Q359-Q398 WeakPolarHBondContact CG-O 3.38Å; E394-Q398 WeakPolarHBondContact O-CG 3.35Å; E394-Q398 PolarHBondContact O-NE2 2.93Å; L395-Q398 PolarHBondContact O-N 3.43Å; T396-Q398 PolarHBondContact O-N 3.42Å; Q398-K403 VanDerWaalsContact O-CB 3.29Å; Q398-K403 WeakPolarHBondContact O-CB 3.37Å
399	F	90.8	Very high	85.6	Confident	0 Å²	0	41.8 Å²	41.8	0%	0	23%	0.231	C	C	.	.	G	3₁₀ helix	trans	-109.8	20.4	-172.5	-61.4	-89.8	0	0	0	113.4	L355 Q359 F369 T396 S397 L407 K412 F414 F458	L355-F399 HydrophobicContact CB-CE2 4.07Å; L355-F399 HydrophobicContact CB-CZ 4.21Å; L355-F399 HydrophobicContact CD1-CE2 4.47Å; L355-F399 HydrophobicContact CD2-CE2 3.98Å; L355-F399 HydrophobicContact CD2-CZ 4.13Å; L355-F399 HydrophobicContact CG-CE2 4.39Å; Q359-F399 HydrophobicContact CB-CE1 4.41Å; F369-F399 HydrophobicContact CD1-CD1 4.19Å; F369-F399 HydrophobicContact CD1-CE1 4.31Å; F369-F399 HydrophobicContact CD1-CG 4.5Å; F369-F399 AromaticContact CE1-CD1 3.91Å; F369-F399 HydrophobicContact CE1-CD1 3.91Å; F369-F399 HydrophobicContact CE1-CD2 4.19Å; F369-F399 AromaticContact CE1-CE1 3.7Å; F369-F399 HydrophobicContact CE1-CE1 3.7Å; F369-F399 AromaticContact CE1-CE2 3.99Å; F369-F399 HydrophobicContact CE1-CE2 3.99Å; F369-F399 HydrophobicContact CE1-CG 4.15Å; F369-F399 AromaticContact CE1-CZ 3.73Å; F369-F399 HydrophobicContact CE1-CZ 3.73Å; F369-F399 AromaticContact CE2-CE1 3.96Å; F369-F399 HydrophobicContact CE2-CE1 3.96Å; F369-F399 HydrophobicContact CE2-CZ 4.26Å; F369-F399 HydrophobicContact CZ-CD1 4.18Å; F369-F399 AromaticContact CZ-CE1 3.5Å; F369-F399 HydrophobicContact CZ-CE1 3.5Å; F369-F399 VanDerWaalsContact CZ-CE1 3.5Å; F369-F399 HydrophobicContact CZ-CE2 4.1Å; F369-F399 AromaticContact CZ-CZ 3.44Å; F369-F399 HydrophobicContact CZ-CZ 3.44Å; F369-F399 VanDerWaalsContact CZ-CZ 3.44Å; T396-F399 PolarHBondContact O-N 3.5Å; S397-F399 PolarHBondContact O-N 3.09Å; F399-L407 HydrophobicContact CD1-CD1 3.94Å; F399-K412 HydrophobicContact CB-CD 4.11Å; F399-K412 WeakPolarHBondContact O-CD 3.3Å; F399-F414 HydrophobicContact CD2-CE1 4.31Å; F399-F414 AromaticContact CD2-CZ 3.61Å; F399-F414 HydrophobicContact CD2-CZ 3.61Å; F399-F414 HydrophobicContact CE2-CE1 4.42Å; F399-F414 HydrophobicContact CE2-CZ 4.11Å; F399-F414 HydrophobicContact CG-CZ 4.24Å; F399-F458 HydrophobicContact CB-CE1 4.34Å; F399-F458 HydrophobicContact CB-CZ 4.25Å; F399-F458 WeakPolarHBondContact O-CZ 3.39Å
400	T	82.5	Confident	85.7	Confident	5 Å²	5	39.7 Å²	39.7	3%	0.031	22%	0.22	C	C	.	.	S	Bend	trans	-63.1	160	173.3	71.5	0	0	0	0	111	L402 K403 C404 D454 E455	T400-L402 PolarHBondContact O-N 3.09Å; T400-L402 VanDerWaalsContact O-N 3.17Å; T400-K403 PolarHBondContact O-N 3.36Å; T400-C404 PolarHBondContact O-N 2.91Å; T400-D454 VanDerWaalsContact CB-CG 3.48Å; T400-D454 WeakPolarHBondContact CB-O 3.36Å; T400-D454 VanDerWaalsContact CB-OD1 3.32Å; T400-D454 WeakPolarHBondContact CB-OD1 3.48Å; T400-D454 VanDerWaalsContact CB-OD2 3.26Å; T400-D454 WeakPolarHBondContact CB-OD2 3.38Å; T400-D454 PolarHBondContact OG1-OD1 3.03Å; T400-D454 PolarHBondContact OG1-OD2 3.27Å; T400-E455 HydrophobicContact CG2-CG 4.1Å
401	G	75.9	Confident	86.2	Confident	17 Å²	17	39.8 Å²	39.8	18%	0.175	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.4	-33.2	-178.1	0	0	0	0	0	114.1	P405 D454	G401-P405 VanDerWaalsContact O-CA 3.23Å; G401-P405 WeakPolarHBondContact O-CA 3.32Å; G401-D454 WeakPolarHBondContact CA-OD1 3.11Å; G401-D454 PolarHBondContact N-O 2.81Å; G401-D454 PolarHBondContact N-OD1 2.87Å
402	L	76.6	Confident	86.7	Confident	139 Å²	139	37.7 Å²	37.7	73%	0.728	21%	0.207	S	C	*	.	T	Hydrogen-bonded Turn	trans	-73.3	-39.7	176.2	-70.2	176.3	0	0	0	112	T400 D454	T400-L402 PolarHBondContact O-N 3.09Å; T400-L402 VanDerWaalsContact O-N 3.17Å; L402-D454 WeakPolarHBondContact CB-OD1 3.34Å; L402-D454 HydrophobicContact CD1-CB 4.39Å; L402-D454 HydrophobicContact CG-CB 4.42Å; L402-D454 VanDerWaalsContact CG-OD1 3.27Å; L402-D454 WeakPolarHBondContact CG-OD1 3.34Å; L402-D454 PolarHBondContact N-OD1 3.08Å
403	K	81.8	Confident	87.2	Confident	88 Å²	88	37.2 Å²	37.2	38%	0.383	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.8	-27.6	-176.4	-73.6	-163.4	-155.2	158.3	0	113.2	Q359 S397 Q398 T400	Q359-K403 WeakPolarHBondContact CG-O 3.46Å; Q359-K403 PolarHBondContact NE2-O 3.29Å; S397-K403 VanDerWaalsContact O-CD 3.23Å; S397-K403 WeakPolarHBondContact O-CD 3.42Å; S397-K403 WeakPolarHBondContact O-CE 3.36Å; S397-K403 PolarHBondContact O-NZ 3.26Å; Q398-K403 VanDerWaalsContact O-CB 3.29Å; Q398-K403 WeakPolarHBondContact O-CB 3.37Å; T400-K403 PolarHBondContact O-N 3.36Å
404	C	87.9	Confident	88	Confident	1 Å²	1	30.4 Å²	30.4	1%	0.007	18%	0.178	C	C	.	.			trans	-136.6	76.8	175.7	-165.5	0	0	0	0	110.5	Q359 T400 S406 L407	Q359-C404 HydrophobicContact CG-CB 4.23Å; Q359-C404 PolarHBondContact O-SG 3.45Å; T400-C404 PolarHBondContact O-N 2.91Å; C404-S406 PolarHBondContact O-N 3.13Å; C404-S406 VanDerWaalsContact O-N 3.16Å; C404-L407 PolarHBondContact O-N 3.43Å
405	P	85.4	Confident	88.6	Confident	91 Å²	91	26.1 Å²	26.1	59%	0.591	16%	0.158	S	C	*	.	G	3₁₀ helix	trans	-59.3	-29.2	-175.6	-26.3	35.6	0	0	0	114.6	G401 L407 A408	G401-P405 VanDerWaalsContact O-CA 3.23Å; G401-P405 WeakPolarHBondContact O-CA 3.32Å; P405-L407 PolarHBondContact O-N 3.02Å; P405-A408 VanDerWaalsContact O-CB 3.25Å; P405-A408 WeakPolarHBondContact O-CB 3.35Å; P405-A408 PolarHBondContact O-N 3.36Å
406	S	89.9	Confident	88.7	Confident	26 Å²	26	26.1 Å²	26.1	18%	0.182	16%	0.158	C	C	.	.	G	3₁₀ helix	trans	-67.2	-14.6	177.8	58.8	0	0	0	0	113.7	M361 D362 H363 C404 K410	M361-S406 PolarHBondContact O-OG 3.44Å; D362-S406 WeakPolarHBondContact OD1-CB 3.47Å; H363-S406 PolarHBondContact CD2-OG 2.94Å; H363-S406 PolarHBondContact N-OG 2.83Å; C404-S406 PolarHBondContact O-N 3.13Å; C404-S406 VanDerWaalsContact O-N 3.16Å; S406-K410 PolarHBondContact O-NZ 3.16Å
407	L	91	Very high	88.8	Confident	0 Å²	0	25.4 Å²	25.4	0%	0	15%	0.153	C	C	.	.	G	3₁₀ helix	trans	-105	5	172.1	-70	176.2	0	0	0	113.7	H363 F369 F399 C404 P405 G409 K410 K412	H363-L407 HydrophobicContact CB-CD2 3.46Å; H363-L407 VanDerWaalsContact CB-CD2 3.46Å; H363-L407 HydrophobicContact CB-CG 3.75Å; F369-L407 HydrophobicContact CB-CD1 3.78Å; F369-L407 HydrophobicContact CB-CD2 3.92Å; F369-L407 HydrophobicContact CG-CD1 4.04Å; F399-L407 HydrophobicContact CD1-CD1 3.94Å; C404-L407 PolarHBondContact O-N 3.43Å; P405-L407 PolarHBondContact O-N 3.02Å; L407-G409 PolarHBondContact O-N 3.25Å; L407-K410 HydrophobicContact CD2-CB 4.46Å; L407-K410 HydrophobicContact CD2-CD 4.35Å; L407-K410 PolarHBondContact O-N 3.18Å; L407-K412 HydrophobicContact CB-CD 4.26Å; L407-K412 HydrophobicContact CB-CG 4.42Å; L407-K412 HydrophobicContact CD1-CG 4.41Å; L407-K412 PolarHBondContact O-NZ 2.92Å
408	A	86.8	Confident	88.6	Confident	47 Å²	47	24.9 Å²	24.9	39%	0.388	15%	0.149	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.9	129.7	173.9	0	0	0	0	0	110.1	P405 K410	P405-A408 VanDerWaalsContact O-CB 3.25Å; P405-A408 WeakPolarHBondContact O-CB 3.35Å; P405-A408 PolarHBondContact O-N 3.36Å; A408-K410 VanDerWaalsContact C-N 3.26Å; A408-K410 PolarHBondContact O-N 3.41Å
409	G	83.6	Confident	88.1	Confident	28 Å²	28	24.6 Å²	24.6	29%	0.289	15%	0.151	S	C	.	.	T	Hydrogen-bonded Turn	trans	81.6	-2.5	-177.4	0	0	0	0	0	115.5	L407 I452 D457	L407-G409 PolarHBondContact O-N 3.25Å; G409-I452 VanDerWaalsContact N-CD1 3.31Å; G409-D457 WeakPolarHBondContact CA-OD2 3.45Å; G409-D457 PolarHBondContact N-OD2 3.22Å
410	K	94.3	Very high	86.9	Confident	37 Å²	37	24.7 Å²	24.7	16%	0.161	15%	0.151	C	C	.	.	S	Bend	trans	-109.2	144.5	-179	-65	176.5	-177.1	172.5	0	111.1	H363 S364 K366 D367 S406 L407 A408 K412 D457	H363-K410 PolarHBondContact O-NZ 3.34Å; S364-K410 PolarHBondContact O-NZ 2.86Å; K366-K410 VanDerWaalsContact O-CD 3.26Å; K366-K410 WeakPolarHBondContact O-CD 3.26Å; K366-K410 WeakPolarHBondContact O-CE 3.47Å; K366-K410 PolarHBondContact O-NZ 3.07Å; D367-K410 WeakPolarHBondContact O-CB 3.37Å; S406-K410 PolarHBondContact O-NZ 3.16Å; L407-K410 HydrophobicContact CD2-CB 4.46Å; L407-K410 HydrophobicContact CD2-CD 4.35Å; L407-K410 PolarHBondContact O-N 3.18Å; A408-K410 VanDerWaalsContact C-N 3.26Å; A408-K410 PolarHBondContact O-N 3.41Å; K410-K412 PolarHBondContact O-N 2.96Å; K410-K412 PolarHBondContact O-NZ 2.74Å; K410-D457 WeakPolarHBondContact O-CB 3.42Å
411	P	96.6	Very high	85.7	Confident	1 Å²	1	24.7 Å²	24.7	1%	0.006	15%	0.152	C	C	.	.			trans	-62.2	131.9	178	25.6	-35.9	0	0	0	112.2	Y285 M287 D367 C368 F369 D457 L529 L533	Y285-P411 HydrophobicContact CD1-CG 4.42Å; Y285-P411 HydrophobicContact CG-CG 4.24Å; M287-P411 HydrophobicContact CE-CG 3.92Å; D367-P411 VanDerWaalsContact O-CD 3.31Å; D367-P411 WeakPolarHBondContact O-CD 3.26Å; C368-P411 HydrophobicContact CB-CG 3.96Å; F369-P411 PolarHBondContact N-O 2.75Å; P411-D457 CarbonylContact C-O 3.56Å; P411-D457 WeakPolarHBondContact CA-O 3.44Å; P411-L529 HydrophobicContact CB-CD2 4.31Å; P411-L533 HydrophobicContact CB-CD1 3.94Å; P411-L533 HydrophobicContact CB-CD2 3.69Å; P411-L533 HydrophobicContact CB-CG 4.44Å; P411-L533 HydrophobicContact CG-CD1 3.73Å; P411-L533 HydrophobicContact CG-CD2 4.37Å
412	K	96.9	Very high	84.8	Confident	2 Å²	2	30.4 Å²	30.4	1%	0.009	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	102	177	-67.9	163.1	-73.3	-71.1	0	108.6	F399 L407 K410 F414 A456 D457 F458 L459	F399-K412 HydrophobicContact CB-CD 4.11Å; F399-K412 WeakPolarHBondContact O-CD 3.3Å; L407-K412 HydrophobicContact CB-CD 4.26Å; L407-K412 HydrophobicContact CB-CG 4.42Å; L407-K412 HydrophobicContact CD1-CG 4.41Å; L407-K412 PolarHBondContact O-NZ 2.92Å; K410-K412 PolarHBondContact O-N 2.96Å; K410-K412 PolarHBondContact O-NZ 2.74Å; K412-F414 HydrophobicContact CB-CE2 4.3Å; K412-A456 WeakPolarHBondContact CE-O 3.1Å; K412-A456 PolarHBondContact NZ-O 3.26Å; K412-D457 PolarHBondContact N-O 2.84Å; K412-F458 HydrophobicContact CB-CD1 3.87Å; K412-F458 HydrophobicContact CB-CE1 3.96Å; K412-F458 HydrophobicContact CB-CG 4.24Å; K412-F458 HydrophobicContact CB-CZ 4.4Å; K412-F458 HydrophobicContact CD-CD2 4.38Å; K412-F458 HydrophobicContact CD-CE1 4.05Å; K412-F458 HydrophobicContact CD-CE2 3.82Å; K412-F458 HydrophobicContact CD-CZ 3.65Å; K412-F458 WeakPolarHBondContact O-CA 3.36Å; K412-L459 PolarHBondContact O-N 3.48Å
413	V	97.4	Very high	83.1	Confident	0 Å²	0	28.7 Å²	28.7	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	128.3	-170.5	-172.5	0	0	0	0	110.4	F369 I370 C371 F415 L459 L533	F369-V413 PolarHBondContact O-N 3.3Å; I370-V413 CarbonylContact C-O 3.59Å; I370-V413 VanDerWaalsContact CA-O 3.28Å; I370-V413 WeakPolarHBondContact CA-O 3.4Å; I370-V413 HydrophobicContact CG1-CB 4.19Å; C371-V413 PolarHBondContact N-O 3.45Å; V413-F415 HydrophobicContact CG1-CD2 4.11Å; V413-F415 HydrophobicContact CG1-CE1 4.07Å; V413-F415 HydrophobicContact CG1-CE2 3.46Å; V413-F415 VanDerWaalsContact CG1-CE2 3.46Å; V413-F415 HydrophobicContact CG1-CZ 3.45Å; V413-F415 VanDerWaalsContact CG1-CZ 3.45Å; V413-L459 CarbonylContact C-O 3.58Å; V413-L459 WeakPolarHBondContact CA-O 3.46Å; V413-L459 HydrophobicContact CG1-CB 4.28Å; V413-L459 HydrophobicContact CG1-CD2 3.87Å; V413-L459 HydrophobicContact CG1-CG 4.14Å; V413-L459 HydrophobicContact CG2-CB 4.26Å; V413-L459 HydrophobicContact CG2-CD2 4.3Å; V413-L533 HydrophobicContact CG2-CD2 3.75Å
414	F	96.6	Very high	81.5	Confident	1 Å²	1	30.4 Å²	30.4	0%	0.004	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	123.9	177.3	-70.5	-98.6	0	0	0	109.6	F369 C371 T396 F399 K412 I416 F458 L459 L460 G461	F369-F414 HydrophobicContact CD1-CZ 4.46Å; F369-F414 HydrophobicContact CE1-CE1 4.35Å; F369-F414 AromaticContact CE1-CZ 3.91Å; F369-F414 HydrophobicContact CE1-CZ 3.91Å; C371-F414 HydrophobicContact CB-CD1 3.64Å; C371-F414 HydrophobicContact CB-CE1 3.63Å; C371-F414 HydrophobicContact CB-CG 4.43Å; C371-F414 HydrophobicContact CB-CZ 4.41Å; C371-F414 CarbonylContact O-C 3.57Å; C371-F414 VanDerWaalsContact O-CA 3.27Å; C371-F414 WeakPolarHBondContact O-CA 3.44Å; T396-F414 HydrophobicContact CG2-CB 4.39Å; T396-F414 HydrophobicContact CG2-CD1 3.92Å; T396-F414 HydrophobicContact CG2-CD2 4Å; T396-F414 HydrophobicContact CG2-CE1 4.16Å; T396-F414 HydrophobicContact CG2-CE2 4.25Å; T396-F414 HydrophobicContact CG2-CG 3.84Å; T396-F414 HydrophobicContact CG2-CZ 4.33Å; F399-F414 HydrophobicContact CD2-CE1 4.31Å; F399-F414 AromaticContact CD2-CZ 3.61Å; F399-F414 HydrophobicContact CD2-CZ 3.61Å; F399-F414 HydrophobicContact CE2-CE1 4.42Å; F399-F414 HydrophobicContact CE2-CZ 4.11Å; F399-F414 HydrophobicContact CG-CZ 4.24Å; K412-F414 HydrophobicContact CB-CE2 4.3Å; F414-I416 HydrophobicContact CB-CD1 4.41Å; F414-F458 HydrophobicContact CD2-CD1 4.19Å; F414-F458 HydrophobicContact CD2-CE1 4.48Å; F414-F458 AromaticContact CE2-CD1 3.89Å; F414-F458 HydrophobicContact CE2-CD1 3.89Å; F414-F458 AromaticContact CE2-CE1 3.75Å; F414-F458 HydrophobicContact CE2-CE1 3.75Å; F414-L459 PolarHBondContact N-O 3Å; F414-L460 HydrophobicContact CB-CD1 3.69Å; F414-L460 CarbonylContact O-C 3.19Å; F414-L460 WeakPolarHBondContact O-CA 3.43Å; F414-G461 PolarHBondContact O-N 3.25Å
415	F	96.3	Very high	79.1	Confident	0 Å²	0	33.7 Å²	33.7	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	114.1	172.5	-65	-63.1	0	0	0	109.3	F333 I370 C371 C372 I373 V413 L484 L502	F333-F415 HydrophobicContact CE2-CD2 4.5Å; F333-F415 HydrophobicContact CE2-CE2 4.41Å; F333-F415 HydrophobicContact CZ-CD2 4.19Å; F333-F415 AromaticContact CZ-CE2 3.68Å; F333-F415 HydrophobicContact CZ-CE2 3.68Å; I370-F415 HydrophobicContact CG2-CD2 4.13Å; I370-F415 HydrophobicContact CG2-CE2 4.21Å; C371-F415 PolarHBondContact O-N 2.98Å; C372-F415 CarbonylContact C-O 3.58Å; C372-F415 WeakPolarHBondContact CA-O 3.44Å; I373-F415 PolarHBondContact N-O 3.41Å; V413-F415 HydrophobicContact CG1-CD2 4.11Å; V413-F415 HydrophobicContact CG1-CE1 4.07Å; V413-F415 HydrophobicContact CG1-CE2 3.46Å; V413-F415 VanDerWaalsContact CG1-CE2 3.46Å; V413-F415 HydrophobicContact CG1-CZ 3.45Å; V413-F415 VanDerWaalsContact CG1-CZ 3.45Å; F415-L484 HydrophobicContact CB-CD2 4.39Å; F415-L484 HydrophobicContact CD1-CD2 3.56Å; F415-L484 HydrophobicContact CD2-CD2 4.1Å; F415-L484 HydrophobicContact CE1-CD1 4.02Å; F415-L484 HydrophobicContact CE1-CD2 3.74Å; F415-L484 HydrophobicContact CE2-CD2 4.26Å; F415-L484 HydrophobicContact CG-CD2 3.75Å; F415-L484 HydrophobicContact CZ-CD1 4.24Å; F415-L484 HydrophobicContact CZ-CD2 4.08Å; F415-L502 HydrophobicContact CE1-CD2 4.17Å
416	I	90.8	Very high	76.7	Confident	2 Å²	2	38.2 Å²	38.2	1%	0.01	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	106.1	-174.5	-49.6	-60.1	0	0	0	109.4	I373 I382 I392 F414 A418 L460 G461 M462 A463	I373-I416 HydrophobicContact CB-CD1 3.88Å; I373-I416 HydrophobicContact CD1-CD1 3.82Å; I373-I416 HydrophobicContact CG1-CD1 3.9Å; I382-I416 HydrophobicContact CG2-CG2 3.85Å; I392-I416 HydrophobicContact CD1-CG2 4.07Å; I392-I416 HydrophobicContact CG2-CG1 4.44Å; F414-I416 HydrophobicContact CB-CD1 4.41Å; I416-A418 HydrophobicContact CG2-CB 4.2Å; I416-L460 HydrophobicContact CD1-CD1 4.48Å; I416-L460 HydrophobicContact CG1-CD1 3.62Å; I416-G461 PolarHBondContact N-O 3.4Å; I416-M462 HydrophobicContact CB-CE 4.39Å; I416-M462 HydrophobicContact CB-SD 3.71Å; I416-M462 HydrophobicContact CG1-SD 3.95Å; I416-M462 HydrophobicContact CG2-CE 4.29Å; I416-M462 HydrophobicContact CG2-SD 4.21Å; I416-A463 WeakPolarHBondContact O-CB 3.46Å; I416-A463 PolarHBondContact O-N 2.93Å
417	Q	90.3	Very high	73.8	Confident	5 Å²	5	39.4 Å²	39.4	2%	0.023	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	87.4	171.9	173.6	47.7	64.8	0	0	109.1	I373 L374 S375 A463 S470 T478 I481	I373-Q417 PolarHBondContact O-N 2.93Å; L374-Q417 HydrophobicContact CD2-CB 3.66Å; L374-Q417 HydrophobicContact CD2-CG 4.15Å; S375-Q417 PolarHBondContact N-O 3.34Å; S375-Q417 VanDerWaalsContact N-O 3.08Å; S375-Q417 VanDerWaalsContact O-O 3.04Å; Q417-A463 HydrophobicContact CB-CB 4.5Å; Q417-S470 PolarHBondContact NE2-OG 3.15Å; Q417-T478 HydrophobicContact CG-CG2 3.82Å; Q417-I481 HydrophobicContact CB-CD1 4.04Å; Q417-I481 HydrophobicContact CB-CG1 3.89Å; Q417-I481 HydrophobicContact CG-CG1 3.97Å
418	A	81.1	Confident	71.1	Confident	0 Å²	0	46.3 Å²	46.3	0%	0	25%	0.253	C	S	.	.	S	Bend	trans	-150	153.3	175.3	0	0	0	0	0	110.1	S375 I382 I416	S375-A418 WeakPolarHBondContact O-CA 3.47Å; I382-A418 HydrophobicContact CG2-CB 3.84Å; I416-A418 HydrophobicContact CG2-CB 4.2Å
419	C	76.9	Confident	68.1	Low	27 Å²	27	50.4 Å²	50.4	18%	0.182	28%	0.275	C	S	.	.			trans	-63.4	152	169.4	-61.5	0	0	0	0	110.2	G377 D378	G377-C419 CarbonylContact C-O 3.56Å; G377-C419 WeakPolarHBondContact CA-O 3.3Å; D378-C419 PolarHBondContact N-O 2.81Å
420	Q	66	Low	65.6	Low	2 Å²	2	54.7 Å²	54.7	1%	0.009	30%	0.296	C	S	.	.			trans	-121.2	19.7	175.7	-68.7	-64	-71.6	0	0	112	D378 K379 I381 M462 T464 N467 C468	D378-Q420 PolarHBondContact O-NE2 3.09Å; K379-Q420 WeakPolarHBondContact CA-O 3.31Å; K379-Q420 PolarHBondContact N-O 3.04Å; I381-Q420 PolarHBondContact O-NE2 2.6Å; Q420-M462 VanDerWaalsContact CD-CE 3.43Å; Q420-M462 HydrophobicContact CG-CE 3.62Å; Q420-T464 HydrophobicContact CB-CG2 4.22Å; Q420-T464 HydrophobicContact CG-CG2 4.21Å; Q420-N467 WeakPolarHBondContact O-CA 3.42Å; Q420-N467 PolarHBondContact O-N 2.95Å; Q420-C468 PolarHBondContact N-O 2.94Å
421	G	57.4	Low	62.4	Low	5 Å²	5	62.2 Å²	62.2	5%	0.052	33%	0.332	C	S	.	.			trans	149.8	-179.4	178.8	0	0	0	0	0	111.4	D378 C468 V469	D378-G421 WeakPolarHBondContact OD1-CA 3.46Å; G421-C468 CarbonylContact O-C 3.54Å; G421-V469 WeakPolarHBondContact O-CG1 3.5Å
422	D	56.6	Low	59.3	Low	136 Å²	136	68 Å²	68	73%	0.727	37%	0.367	S	S	*	.	S	Bend	trans	-100.8	0.2	-172.3	-63.6	-29.1	0	0	0	114.4
423	N	42.2	Very low	56	Low	103 Å²	103	75.1 Å²	75.1	55%	0.551	41%	0.405	S	S	*	.	B	Isolated β-bridge	trans	-79.6	144.4	-179	-55	-63.2	0	0	0	111.4	N467 C468 V469	N423-N467 WeakPolarHBondContact CB-O 3.43Å; N423-N467 PolarHBondContact N-O 2.88Å; N423-N467 VanDerWaalsContact N-O 3.14Å; N423-N467 PolarHBondContact ND2-O 3.44Å; N423-C468 VanDerWaalsContact O-CA 3.25Å; N423-C468 WeakPolarHBondContact O-CA 3.41Å; N423-V469 PolarHBondContact O-N 2.82Å; N423-V469 VanDerWaalsContact O-N 3.12Å
424	Y	46.8	Very low	52.6	Low	124 Å²	124	80.9 Å²	80.9	49%	0.486	45%	0.446	S	S	.	.	P	Polyproline II helix	trans	-84.7	128.3	168.1	-58.9	-79	0	0	0	109.3	K426 V469 Y471 N517	Y424-K426 PolarHBondContact O-N 3Å; Y424-V469 HydrophobicContact CD1-CG2 3.85Å; Y424-V469 HydrophobicContact CE1-CG2 4.17Å; Y424-Y471 WeakPolarHBondContact CD1-OH 3.36Å; Y424-N517 HydrophobicContact CD1-CB 4.39Å; Y424-N517 HydrophobicContact CE1-CB 4.27Å
425	Q	37.4	Very low	49.9	Very low	71 Å²	71	90 Å²	90	33%	0.332	49%	0.488	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.3	121.7	174.4	-171.7	69.5	2.2	0	0	108.9	C468 K520	Q425-C468 PolarHBondContact OE1-SG 3.16Å; Q425-K520 HydrophobicContact CB-CB 4.41Å; Q425-K520 WeakPolarHBondContact CB-O 3.28Å; Q425-K520 HydrophobicContact CG-CB 4.5Å; Q425-K520 PolarHBondContact O-N 2.97Å; Q425-K520 VanDerWaalsContact O-N 3.14Å
426	K	35.1	Very low	46.6	Very low	186 Å²	186	99.3 Å²	99.3	81%	0.809	53%	0.531	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77.3	128	177.2	-65.2	-179.3	-178.7	178.2	0	109.6	Y424	Y424-K426 PolarHBondContact O-N 3Å
427	G	30.6	Very low	43.9	Very low	51 Å²	51	106.5 Å²	106.5	53%	0.526	57%	0.565	S	S	.	*	P	Polyproline II helix	trans	-73.5	136.5	170.5	0	0	0	0	0	111.1
428	I	33.7	Very low	40.9	Very low	144 Å²	144	111.8 Å²	111.8	74%	0.738	60%	0.6	S	S	*	*			trans	-105.7	137.5	165.1	48.9	169.4	0	0	0	108.3	V430	I428-V430 HydrophobicContact CG1-CG2 4.39Å
429	P	24.6	Very low	38.1	Very low	134 Å²	134	121.2 Å²	121.2	87%	0.87	64%	0.637	S	S	*	*			trans	-68.9	132.5	173.6	28	-31.2	0	0	0	109.3
430	V	29.9	Very low	35.6	Very low	118 Å²	118	126.9 Å²	126.9	72%	0.715	67%	0.665	S	S	*	*			trans	-124.5	126.5	176.6	-166.9	0	0	0	0	107.7	I428	I428-V430 HydrophobicContact CG1-CG2 4.39Å
431	E	28.1	Very low	33.8	Very low	195 Å²	195	131.7 Å²	131.7	91%	0.911	69%	0.687	S	S	*	*			trans	-81.3	137.1	166.9	-68	-177	170.1	0	0	108.7
432	T	29.9	Very low	32.3	Very low	122 Å²	122	140.4 Å²	140.4	75%	0.748	73%	0.729	S	S	*	*			trans	-94.5	136.7	-174.5	21.4	0	0	0	0	110.8
433	D	27.6	Very low	30.8	Very low	151 Å²	151	137.2 Å²	137.2	81%	0.807	71%	0.712	S	S	*	*				165.6	148.9	123.2	-82.7	-16.3	0	0	0	112.8
434	S	27.6	Very low	30.2	Very low	122 Å²	122	140.1 Å²	140.1	85%	0.853	73%	0.726	S	S	*	*			trans	122.1	126.4	144.4	-48.9	0	0	0	0	116.5
435	E	39.3	Very low	29.4	Very low	192 Å²	192	138.7 Å²	138.7	90%	0.897	73%	0.734	S	S	*	*			trans	-69.5	140	-177.9	-55.7	179.9	157.3	0	0	113.1
436	E	25.7	Very low	28.8	Very low	195 Å²	195	139.3 Å²	139.3	91%	0.911	75%	0.747	S	S	*	*			trans	-144.7	137.3	155	-72.9	-166.4	161.5	0	0	111.5
437	Q	34.3	Very low	28.9	Very low	153 Å²	153	136.4 Å²	136.4	72%	0.715	75%	0.747	S	S	*	*			trans	-77.5	164.3	177.1	-59.5	-155.4	-21.4	0	0	112.6
438	P	29	Very low	28.7	Very low	116 Å²	116	141.7 Å²	141.7	75%	0.753	76%	0.758	S	S	*	*				-148.8	177.3	123.2	29.7	-7.8	0	0	0	118.3
439	Y	22.2	Very low	28.7	Very low	198 Å²	198	141.2 Å²	141.2	78%	0.776	76%	0.762	S	S	*	*			trans	-99.2	173.9	-151.7	-37.7	-92.8	0	0	0	114.1
440	L	23.8	Very low	29.2	Very low	147 Å²	147	142.9 Å²	142.9	77%	0.77	75%	0.751	S	S	*	*			trans	-72.3	165.7	-160.9	-81.1	148.5	0	0	0	120.1
441	E	28.5	Very low	29.5	Very low	103 Å²	103	147.9 Å²	147.9	48%	0.481	76%	0.758	S	S	.	*			trans	-71.3	177.9	-174.4	-52.7	-169.6	139.2	0	0	118	D282	D282-E441 VanDerWaalsContact OD1-CD 3.28Å
442	M	25.1	Very low	30.3	Very low	187 Å²	187	141.3 Å²	141.3	92%	0.921	73%	0.729	S	S	*	*			trans	-144.7	138.3	151.7	-160.3	177.2	-69.4	0	0	112.4
443	D	26.1	Very low	31.2	Very low	69 Å²	69	140 Å²	140	37%	0.369	72%	0.722	S	S	.	*			trans	-116.1	152.8	-171.5	-171.5	22.7	0	0	0	112.9	K283	K283-D443 VanDerWaalsContact CE-OD1 3.31Å; K283-D443 WeakPolarHBondContact CE-OD1 3.09Å; K283-D443 IonicContact NZ-OD1 3.44Å; K283-D443 PolarHBondContact NZ-OD1 3.09Å
444	L	29.3	Very low	32.4	Very low	164 Å²	164	135.3 Å²	135.3	86%	0.859	70%	0.697	S	S	*	*			trans	-151.8	137.2	155.1	-77.6	-176.6	0	0	0	112
445	S	29.9	Very low	34.5	Very low	94 Å²	94	134 Å²	134	66%	0.657	68%	0.678	S	S	*	*			trans	-130.3	138.8	-176.9	54.9	0	0	0	0	113.3
446	S	24.8	Very low	35.8	Very low	85 Å²	85	125.2 Å²	125.2	59%	0.594	64%	0.638	S	S	*	*			trans	-157	146.2	154.3	176.6	0	0	0	0	109.4	Q448	S446-Q448 PolarHBondContact O-N 3.33Å
447	P	36.3	Very low	38.9	Very low	124 Å²	124	116 Å²	116	81%	0.805	60%	0.595	S	S	*	*			trans	-89.8	104.4	-161.3	33.5	-28.6	0	0	0	111.7
448	Q	27.7	Very low	41.6	Very low	163 Å²	163	109.8 Å²	109.8	76%	0.762	57%	0.566	S	S	*	*			trans	-112	145.4	159.8	-66.9	167.4	-4.5	0	0	106.1	S446 R450	S446-Q448 PolarHBondContact O-N 3.33Å; Q448-R450 VanDerWaalsContact C-N 3.28Å; Q448-R450 WeakPolarHBondContact O-CG 3.46Å; Q448-R450 PolarHBondContact O-N 3.1Å
449	T	32.9	Very low	44.7	Very low	134 Å²	134	104.3 Å²	104.3	82%	0.822	53%	0.53	S	S	*	.			trans	-56.5	94.3	172.6	26.2	0	0	0	0	109.2	Y451	T449-Y451 PolarHBondContact O-N 2.84Å
450	R	34.4	Very low	47.9	Very low	169 Å²	169	96.8 Å²	96.8	64%	0.638	50%	0.503	S	S	*	.			trans	-80.6	111.5	-172.8	-82.6	170	-179.9	174.9	-3.9	108.7	Q448	Q448-R450 VanDerWaalsContact C-N 3.28Å; Q448-R450 WeakPolarHBondContact O-CG 3.46Å; Q448-R450 PolarHBondContact O-N 3.1Å
451	Y	37.5	Very low	51	Low	223 Å²	223	89.8 Å²	89.8	88%	0.875	47%	0.466	S	S	*	.			trans	-69.9	134.8	162.9	-62.2	-87.3	0	0	0	108.4	T449	T449-Y451 PolarHBondContact O-N 2.84Å
452	I	43.3	Very low	53.8	Low	56 Å²	56	85.7 Å²	85.7	29%	0.287	45%	0.447	S	S	.	.			trans	-110.3	152.2	179.2	65.5	171.9	0	0	0	108.5	G409	G409-I452 VanDerWaalsContact N-CD1 3.31Å
453	P	48.9	Very low	55.7	Low	94 Å²	94	76.8 Å²	76.8	61%	0.61	40%	0.403	S	S	*	.			trans	-56.4	143.3	175.1	-23.8	33.2	0	0	0	111.8	E455 A456	P453-E455 PolarHBondContact O-N 2.92Å; P453-A456 HydrophobicContact CB-CB 4.21Å; P453-A456 WeakPolarHBondContact O-CB 3.43Å; P453-A456 PolarHBondContact O-N 3.16Å
454	D	53.7	Low	57.5	Low	53 Å²	53	73.6 Å²	73.6	28%	0.283	39%	0.386	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.4	-34.7	-175.3	-172.8	35.4	0	0	0	113.2	T400 G401 L402	T400-D454 VanDerWaalsContact CB-CG 3.48Å; T400-D454 WeakPolarHBondContact CB-O 3.36Å; T400-D454 VanDerWaalsContact CB-OD1 3.32Å; T400-D454 WeakPolarHBondContact CB-OD1 3.48Å; T400-D454 VanDerWaalsContact CB-OD2 3.26Å; T400-D454 WeakPolarHBondContact CB-OD2 3.38Å; T400-D454 PolarHBondContact OG1-OD1 3.03Å; T400-D454 PolarHBondContact OG1-OD2 3.27Å; G401-D454 WeakPolarHBondContact CA-OD1 3.11Å; G401-D454 PolarHBondContact N-O 2.81Å; G401-D454 PolarHBondContact N-OD1 2.87Å; L402-D454 WeakPolarHBondContact CB-OD1 3.34Å; L402-D454 HydrophobicContact CD1-CB 4.39Å; L402-D454 HydrophobicContact CG-CB 4.42Å; L402-D454 VanDerWaalsContact CG-OD1 3.27Å; L402-D454 WeakPolarHBondContact CG-OD1 3.34Å; L402-D454 PolarHBondContact N-OD1 3.08Å
455	E	71.3	Confident	58.7	Low	95 Å²	95	67 Å²	67	44%	0.444	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.3	19.2	179.5	-58.1	-172.1	179.5	0	0	113	Y393 T400 P453 F458 T528	Y393-E455 PolarHBondContact OH-OE1 3.42Å; T400-E455 HydrophobicContact CG2-CG 4.1Å; P453-E455 PolarHBondContact O-N 2.92Å; E455-F458 WeakPolarHBondContact O-CD2 3.41Å; E455-T528 PolarHBondContact O-OG1 3.05Å
456	A	67.5	Low	60.1	Low	7 Å²	7	66.7 Å²	66.7	6%	0.058	34%	0.344	C	S	.	.			trans	-76.1	158.2	176.2	0	0	0	0	0	112.9	K412 P453 F458	K412-A456 WeakPolarHBondContact CE-O 3.1Å; K412-A456 PolarHBondContact NZ-O 3.26Å; P453-A456 HydrophobicContact CB-CB 4.21Å; P453-A456 WeakPolarHBondContact O-CB 3.43Å; P453-A456 PolarHBondContact O-N 3.16Å; A456-F458 WeakPolarHBondContact O-CD2 3.09Å
457	D	89.4	Confident	61.5	Low	1 Å²	1	65.6 Å²	65.6	1%	0.005	33%	0.331	C	S	.	.	S	Bend	trans	67.5	32.5	176.1	-43.7	-58.6	0	0	0	114.1	Y285 G409 K410 P411 K412 T528 R530	Y285-D457 HydrophobicContact CE1-CB 4.34Å; Y285-D457 WeakPolarHBondContact CE1-OD1 3.36Å; Y285-D457 PolarHBondContact OH-OD1 2.92Å; G409-D457 WeakPolarHBondContact CA-OD2 3.45Å; G409-D457 PolarHBondContact N-OD2 3.22Å; K410-D457 WeakPolarHBondContact O-CB 3.42Å; P411-D457 CarbonylContact C-O 3.56Å; P411-D457 WeakPolarHBondContact CA-O 3.44Å; K412-D457 PolarHBondContact N-O 2.84Å; D457-T528 PolarHBondContact N-O 3.45Å; D457-R530 IonicContact OD1-CZ 3.88Å; D457-R530 IonicContact OD1-NE 2.88Å; D457-R530 PolarHBondContact OD1-NE 3.27Å; D457-R530 IonicContact OD1-NH2 3.29Å; D457-R530 PolarHBondContact OD1-NH2 3.07Å; D457-R530 VanDerWaalsContact OD1-NH2 3.13Å; D457-R530 IonicContact OD2-CZ 2.64Å; D457-R530 IonicContact OD2-NE 2.77Å; D457-R530 PolarHBondContact OD2-NE 3.23Å; D457-R530 IonicContact OD2-NH2 2.65Å; D457-R530 PolarHBondContact OD2-NH2 3Å
458	F	91.4	Very high	62	Low	24 Å²	24	60 Å²	60	11%	0.105	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	146.5	171.8	-77.5	-100.6	0	0	0	112.2	T396 F399 K412 F414 E455 A456 F527 T528 L529	T396-F458 WeakPolarHBondContact O-CE1 3.45Å; F399-F458 HydrophobicContact CB-CE1 4.34Å; F399-F458 HydrophobicContact CB-CZ 4.25Å; F399-F458 WeakPolarHBondContact O-CZ 3.39Å; K412-F458 HydrophobicContact CB-CD1 3.87Å; K412-F458 HydrophobicContact CB-CE1 3.96Å; K412-F458 HydrophobicContact CB-CG 4.24Å; K412-F458 HydrophobicContact CB-CZ 4.4Å; K412-F458 HydrophobicContact CD-CD2 4.38Å; K412-F458 HydrophobicContact CD-CE1 4.05Å; K412-F458 HydrophobicContact CD-CE2 3.82Å; K412-F458 HydrophobicContact CD-CZ 3.65Å; K412-F458 WeakPolarHBondContact O-CA 3.36Å; F414-F458 HydrophobicContact CD2-CD1 4.19Å; F414-F458 HydrophobicContact CD2-CE1 4.48Å; F414-F458 AromaticContact CE2-CD1 3.89Å; F414-F458 HydrophobicContact CE2-CD1 3.89Å; F414-F458 AromaticContact CE2-CE1 3.75Å; F414-F458 HydrophobicContact CE2-CE1 3.75Å; E455-F458 WeakPolarHBondContact O-CD2 3.41Å; A456-F458 WeakPolarHBondContact O-CD2 3.09Å; F458-F527 CarbonylContact O-C 3.58Å; F458-F527 VanDerWaalsContact O-CA 3.31Å; F458-F527 WeakPolarHBondContact O-CA 3.46Å; F458-T528 PolarHBondContact N-OG1 2.92Å; F458-T528 PolarHBondContact O-N 3.32Å; F458-L529 PolarHBondContact O-N 3.18Å
459	L	93.7	Very high	63.6	Low	0 Å²	0	53.3 Å²	53.3	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	122.2	165.9	173.2	63.2	0	0	0	108.2	K412 V413 F414 I498 L499 L502 F527 L529	K412-L459 PolarHBondContact O-N 3.48Å; V413-L459 CarbonylContact C-O 3.58Å; V413-L459 WeakPolarHBondContact CA-O 3.46Å; V413-L459 HydrophobicContact CG1-CB 4.28Å; V413-L459 HydrophobicContact CG1-CD2 3.87Å; V413-L459 HydrophobicContact CG1-CG 4.14Å; V413-L459 HydrophobicContact CG2-CB 4.26Å; V413-L459 HydrophobicContact CG2-CD2 4.3Å; F414-L459 PolarHBondContact N-O 3Å; L459-I498 HydrophobicContact CD2-CB 4.28Å; L459-I498 HydrophobicContact CD2-CG1 3.58Å; L459-I498 HydrophobicContact CD2-CG2 3.64Å; L459-L499 HydrophobicContact CD1-CD2 3.96Å; L459-L502 HydrophobicContact CD1-CD1 3.9Å; L459-L502 HydrophobicContact CD2-CD1 3.93Å; L459-L502 HydrophobicContact CG-CD1 4.32Å; L459-F527 HydrophobicContact CD1-CB 3.81Å; L459-L529 HydrophobicContact CB-CD1 4.16Å; L459-L529 HydrophobicContact CB-CD2 4.31Å; L459-L529 HydrophobicContact CB-CG 4.26Å; L459-L529 HydrophobicContact CD2-CD1 4.35Å
460	L	91	Very high	65.1	Low	40 Å²	40	47.7 Å²	47.7	21%	0.209	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	104.1	176.9	180	64	0	0	0	109	I392 T396 F414 I416 M462 P525 T526	I392-L460 HydrophobicContact CG2-CD1 4.27Å; I392-L460 HydrophobicContact CG2-CD2 4.32Å; T396-L460 HydrophobicContact CG2-CD1 4.39Å; F414-L460 HydrophobicContact CB-CD1 3.69Å; F414-L460 CarbonylContact O-C 3.19Å; F414-L460 WeakPolarHBondContact O-CA 3.43Å; I416-L460 HydrophobicContact CD1-CD1 4.48Å; I416-L460 HydrophobicContact CG1-CD1 3.62Å; L460-M462 HydrophobicContact CD1-SD 4.03Å; L460-M462 HydrophobicContact CD2-CG 4.31Å; L460-M462 HydrophobicContact CD2-SD 4.07Å; L460-M462 HydrophobicContact CG-CG 4.1Å; L460-M462 HydrophobicContact CG-SD 3.97Å; L460-P525 CarbonylContact O-C 3.2Å; L460-P525 VanDerWaalsContact O-CA 3.31Å; L460-P525 WeakPolarHBondContact O-CA 3.27Å; L460-T526 PolarHBondContact N-O 2.97Å; L460-T526 PolarHBondContact O-N 3.48Å
461	G	89.1	Confident	66.8	Low	0 Å²	0	41 Å²	41	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89	103.4	172.6	0	0	0	0	0	111	F414 I416 Y480	F414-G461 PolarHBondContact O-N 3.25Å; I416-G461 PolarHBondContact N-O 3.4Å; G461-Y480 WeakPolarHBondContact CA-OH 3.37Å; G461-Y480 PolarHBondContact O-OH 3.48Å
462	M	85.4	Confident	68.8	Low	17 Å²	17	33.7 Å²	33.7	8%	0.084	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	132.7	175.2	-62	-65.2	-66.7	0	0	110.6	I392 I416 Q420 L460 T464 P523 Q524	I392-M462 HydrophobicContact CD1-CE 3.6Å; I392-M462 HydrophobicContact CD1-SD 4.15Å; I416-M462 HydrophobicContact CB-CE 4.39Å; I416-M462 HydrophobicContact CB-SD 3.71Å; I416-M462 HydrophobicContact CG1-SD 3.95Å; I416-M462 HydrophobicContact CG2-CE 4.29Å; I416-M462 HydrophobicContact CG2-SD 4.21Å; Q420-M462 VanDerWaalsContact CD-CE 3.43Å; Q420-M462 HydrophobicContact CG-CE 3.62Å; L460-M462 HydrophobicContact CD1-SD 4.03Å; L460-M462 HydrophobicContact CD2-CG 4.31Å; L460-M462 HydrophobicContact CD2-SD 4.07Å; L460-M462 HydrophobicContact CG-CG 4.1Å; L460-M462 HydrophobicContact CG-SD 3.97Å; M462-T464 PolarHBondContact O-N 3.4Å; M462-P523 WeakPolarHBondContact O-CA 3.39Å; M462-P523 WeakPolarHBondContact O-CB 3.35Å; M462-Q524 WeakPolarHBondContact CB-O 3.44Å; M462-Q524 PolarHBondContact N-O 3.19Å; M462-Q524 PolarHBondContact O-N 2.91Å
463	A	66.9	Low	70.3	Confident	0 Å²	0	33.2 Å²	33.2	0%	0	18%	0.176	C	C	.	.	S	Bend	trans	-65.3	-22.4	178.8	0	0	0	0	0	114.5	I416 Q417 Y480 Q521 P523	I416-A463 WeakPolarHBondContact O-CB 3.46Å; I416-A463 PolarHBondContact O-N 2.93Å; Q417-A463 HydrophobicContact CB-CB 4.5Å; A463-Y480 HydrophobicContact CB-CD1 3.47Å; A463-Y480 VanDerWaalsContact CB-CD1 3.47Å; A463-Y480 HydrophobicContact CB-CE1 4.18Å; A463-Y480 HydrophobicContact CB-CG 3.68Å; A463-Q521 PolarHBondContact O-NE2 3.22Å; A463-P523 WeakPolarHBondContact O-CA 3.45Å
464	T	63.1	Low	71.4	Confident	2 Å²	2	32.6 Å²	32.6	1%	0.012	17%	0.172	C	C	.	.	S	Bend	trans	-150.1	150.6	178.5	-176.6	0	0	0	0	111.4	Q420 M462 C468 V469 M522	Q420-T464 HydrophobicContact CB-CG2 4.22Å; Q420-T464 HydrophobicContact CG-CG2 4.21Å; M462-T464 PolarHBondContact O-N 3.4Å; T464-C468 VanDerWaalsContact CG2-O 3.26Å; T464-C468 WeakPolarHBondContact CG2-O 3.43Å; T464-C468 WeakPolarHBondContact OG1-CB 3.44Å; T464-V469 PolarHBondContact OG1-O 2.72Å; T464-M522 CarbonylContact C-O 3.51Å; T464-M522 VanDerWaalsContact CA-O 3.25Å; T464-M522 WeakPolarHBondContact CA-O 3.13Å
465	V	54	Low	72.4	Confident	26 Å²	26	33.8 Å²	33.8	16%	0.158	19%	0.188	C	C	.	.			trans	-56.7	155.8	166.6	-63.4	0	0	0	0	111.8	C468 M522 Q524	V465-C468 HydrophobicContact CG2-CB 4.04Å; V465-C468 PolarHBondContact O-N 2.88Å; V465-M522 HydrophobicContact CG1-CB 4.22Å; V465-M522 HydrophobicContact CG1-CG 4.26Å; V465-M522 WeakPolarHBondContact CG1-O 3.35Å; V465-M522 PolarHBondContact N-O 3.41Å; V465-Q524 HydrophobicContact CG1-CB 4.07Å
466	N	60.3	Low	72.7	Confident	87 Å²	87	35.3 Å²	35.3	47%	0.465	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.9	145.7	177.9	-80.7	-16	0	0	0	112.9	C468	N466-C468 PolarHBondContact O-N 3.25Å
467	N	53	Low	73.6	Confident	63 Å²	63	35 Å²	35	34%	0.337	19%	0.193	S	C	.	.	T	Hydrogen-bonded Turn	trans	71	5.4	-178.1	-36.6	-73.3	0	0	0	115.4	K379 Q420 N423	K379-N467 WeakPolarHBondContact CD-OD1 3.39Å; K379-N467 WeakPolarHBondContact CE-OD1 3.15Å; K379-N467 PolarHBondContact NZ-OD1 3.27Å; Q420-N467 WeakPolarHBondContact O-CA 3.42Å; Q420-N467 PolarHBondContact O-N 2.95Å; N423-N467 WeakPolarHBondContact CB-O 3.43Å; N423-N467 PolarHBondContact N-O 2.88Å; N423-N467 VanDerWaalsContact N-O 3.14Å; N423-N467 PolarHBondContact ND2-O 3.44Å
468	C	47.4	Very low	73.4	Confident	7 Å²	7	35 Å²	35	5%	0.047	19%	0.193	C	C	.	.	B	Isolated β-bridge	trans	-117.2	157	-176.4	-62.3	0	0	0	0	114.2	Q420 G421 N423 Q425 T464 V465 N466	Q420-C468 PolarHBondContact N-O 2.94Å; G421-C468 CarbonylContact O-C 3.54Å; N423-C468 VanDerWaalsContact O-CA 3.25Å; N423-C468 WeakPolarHBondContact O-CA 3.41Å; Q425-C468 PolarHBondContact OE1-SG 3.16Å; T464-C468 VanDerWaalsContact CG2-O 3.26Å; T464-C468 WeakPolarHBondContact CG2-O 3.43Å; T464-C468 WeakPolarHBondContact OG1-CB 3.44Å; V465-C468 HydrophobicContact CG2-CB 4.04Å; V465-C468 PolarHBondContact O-N 2.88Å; N466-C468 PolarHBondContact O-N 3.25Å
469	V	61.3	Low	73.3	Confident	21 Å²	21	35.7 Å²	35.7	13%	0.127	20%	0.195	C	C	.	.			trans	-78.3	153.9	176.4	-60.8	0	0	0	0	112.2	G421 N423 Y424 T464 Y471	G421-V469 WeakPolarHBondContact O-CG1 3.5Å; N423-V469 PolarHBondContact O-N 2.82Å; N423-V469 VanDerWaalsContact O-N 3.12Å; Y424-V469 HydrophobicContact CD1-CG2 3.85Å; Y424-V469 HydrophobicContact CE1-CG2 4.17Å; T464-V469 PolarHBondContact OG1-O 2.72Å; V469-Y471 HydrophobicContact CG2-CE2 4.02Å
470	S	64	Low	73.2	Confident	17 Å²	17	35.8 Å²	35.8	12%	0.119	20%	0.195	C	C	.	.			trans	-115.3	140.3	168.9	63	0	0	0	0	110.1	Q417	Q417-S470 PolarHBondContact NE2-OG 3.15Å
471	Y	71.3	Confident	73.4	Confident	28 Å²	28	33.9 Å²	33.9	11%	0.11	19%	0.186	C	C	.	.			trans	-94.4	143.2	-171.7	-65.5	-92.2	0	0	0	112.7	Y424 V469 T478 W479 D514 G519 K520 Q521	Y424-Y471 WeakPolarHBondContact CD1-OH 3.36Å; V469-Y471 HydrophobicContact CG2-CE2 4.02Å; Y471-T478 WeakPolarHBondContact O-CB 3.44Å; Y471-W479 HydrophobicContact CD1-CH2 4.2Å; Y471-W479 HydrophobicContact CD1-CZ3 4.49Å; Y471-W479 AromaticContact CD2-CE3 3.86Å; Y471-W479 HydrophobicContact CD2-CE3 3.86Å; Y471-W479 AromaticContact CD2-CH2 3.94Å; Y471-W479 HydrophobicContact CD2-CH2 3.94Å; Y471-W479 AromaticContact CD2-CZ3 3.43Å; Y471-W479 HydrophobicContact CD2-CZ3 3.43Å; Y471-W479 VanDerWaalsContact CD2-CZ3 3.43Å; Y471-W479 HydrophobicContact CE2-CH2 4.49Å; Y471-W479 HydrophobicContact CE2-CZ3 4.06Å; Y471-W479 HydrophobicContact CG-CD2 4.47Å; Y471-W479 HydrophobicContact CG-CE3 4.05Å; Y471-W479 AromaticContact CG-CH2 3.78Å; Y471-W479 HydrophobicContact CG-CH2 3.78Å; Y471-W479 HydrophobicContact CG-CZ2 4.26Å; Y471-W479 AromaticContact CG-CZ3 3.69Å; Y471-W479 HydrophobicContact CG-CZ3 3.69Å; Y471-W479 PolarHBondContact O-N 2.97Å; Y471-D514 HydrophobicContact CD1-CB 4.05Å; Y471-D514 HydrophobicContact CE1-CB 3.5Å; Y471-D514 VanDerWaalsContact CE1-CB 3.5Å; Y471-D514 WeakPolarHBondContact CE1-OD2 3.43Å; Y471-G519 VanDerWaalsContact OH-CA 3.31Å; Y471-G519 WeakPolarHBondContact OH-CA 3.36Å; Y471-K520 WeakPolarHBondContact CE2-O 3.4Å; Y471-Q521 HydrophobicContact CD2-CB 3.92Å; Y471-Q521 HydrophobicContact CE2-CB 4.21Å
472	R	78.9	Confident	73.6	Confident	69 Å²	69	36.4 Å²	36.4	26%	0.26	20%	0.197	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	124.4	177.6	-178.6	162.3	44.1	72.1	3.5	109.9	R319 N320 T478	R319-R472 VanDerWaalsContact CA-CZ 3.49Å; N320-R472 VanDerWaalsContact N-NH1 3.2Å; N320-R472 WeakPolarHBondContact O-CD 3.47Å; N320-R472 PolarHBondContact O-NH1 3.31Å; R472-T478 HydrophobicContact CB-CG2 3.71Å; R472-T478 HydrophobicContact CG-CG2 3.74Å
473	N	73.9	Confident	74	Confident	47 Å²	47	35.7 Å²	35.7	25%	0.251	19%	0.194	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	120.3	168.3	-173.2	-15.6	0	0	0	109	A475 E476 G477	N473-A475 PolarHBondContact O-N 3.13Å; N473-A475 VanDerWaalsContact O-N 3.13Å; N473-A475 PolarHBondContact OD1-N 3.4Å; N473-E476 HydrophobicContact CB-CB 4.1Å; N473-E476 VanDerWaalsContact ND2-CD 3.26Å; N473-E476 PolarHBondContact ND2-OE2 3.44Å; N473-E476 PolarHBondContact O-N 3.24Å; N473-G477 WeakPolarHBondContact CA-O 3.42Å; N473-G477 WeakPolarHBondContact CB-O 3.29Å; N473-G477 PolarHBondContact N-O 3.23Å; N473-G477 WeakPolarHBondContact O-CA 3.36Å; N473-G477 PolarHBondContact O-N 3.31Å
474	P	73.6	Confident	75.3	Confident	81 Å²	81	35.7 Å²	35.7	53%	0.526	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.7	-24.3	177.5	-25.8	35.3	0	0	0	115.1	N320 G321	N320-P474 HydrophobicContact CB-CB 4.22Å; G321-P474 WeakPolarHBondContact CA-O 3.12Å
475	A	73.8	Confident	76.9	Confident	77 Å²	77	35.8 Å²	35.8	64%	0.636	20%	0.195	S	C	*	.	T	Hydrogen-bonded Turn	trans	-98.2	-19.6	-176.8	0	0	0	0	0	114.3	L324 N473	L324-A475 VanDerWaalsContact CD1-O 3.26Å; L324-A475 WeakPolarHBondContact CD1-O 3.39Å; N473-A475 PolarHBondContact O-N 3.13Å; N473-A475 VanDerWaalsContact O-N 3.13Å; N473-A475 PolarHBondContact OD1-N 3.4Å
476	E	78.2	Confident	78.8	Confident	128 Å²	128	39.5 Å²	39.5	60%	0.598	21%	0.21	S	C	*	.	T	Hydrogen-bonded Turn	trans	-125.6	-11.2	-172.1	-64.1	171.9	172.9	0	0	113.3	N473 Q482	N473-E476 HydrophobicContact CB-CB 4.1Å; N473-E476 VanDerWaalsContact ND2-CD 3.26Å; N473-E476 PolarHBondContact ND2-OE2 3.44Å; N473-E476 PolarHBondContact O-N 3.24Å; E476-Q482 WeakPolarHBondContact O-CG 3.47Å; E476-Q482 PolarHBondContact O-NE2 2.94Å
477	G	84.8	Confident	80.4	Confident	1 Å²	1	35.6 Å²	35.6	1%	0.01	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	94.4	-166.6	-173.1	0	0	0	0	0	113.2	D325 N473	D325-G477 VanDerWaalsContact OD1-CA 3.25Å; D325-G477 WeakPolarHBondContact OD1-CA 3.16Å; N473-G477 WeakPolarHBondContact CA-O 3.42Å; N473-G477 WeakPolarHBondContact CB-O 3.29Å; N473-G477 PolarHBondContact N-O 3.23Å; N473-G477 WeakPolarHBondContact O-CA 3.36Å; N473-G477 PolarHBondContact O-N 3.31Å
478	T	87.1	Confident	82.4	Confident	1 Å²	1	32.6 Å²	32.6	1%	0.006	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	144.7	179.7	58	0	0	0	0	112	D325 Q417 Y471 R472 Y480 I481 Q482	D325-T478 VanDerWaalsContact CG-N 3.34Å; D325-T478 VanDerWaalsContact CG-OG1 3.27Å; D325-T478 PolarHBondContact OD1-N 3.37Å; D325-T478 PolarHBondContact OD1-OG1 3.32Å; D325-T478 WeakPolarHBondContact OD2-CB 3.36Å; D325-T478 WeakPolarHBondContact OD2-CG2 3.47Å; D325-T478 PolarHBondContact OD2-N 2.87Å; D325-T478 VanDerWaalsContact OD2-N 3.09Å; D325-T478 PolarHBondContact OD2-OG1 2.87Å; Q417-T478 HydrophobicContact CG-CG2 3.82Å; Y471-T478 WeakPolarHBondContact O-CB 3.44Å; R472-T478 HydrophobicContact CB-CG2 3.71Å; R472-T478 HydrophobicContact CG-CG2 3.74Å; T478-Y480 VanDerWaalsContact C-N 3.25Å; T478-Y480 PolarHBondContact O-N 3.13Å; T478-I481 PolarHBondContact O-N 2.95Å; T478-I481 WeakPolarHBondContact OG1-CB 3.34Å; T478-I481 VanDerWaalsContact OG1-CG1 3.3Å; T478-I481 WeakPolarHBondContact OG1-CG1 3.45Å; T478-Q482 WeakPolarHBondContact O-CB 3.4Å; T478-Q482 WeakPolarHBondContact O-CG 3.44Å; T478-Q482 PolarHBondContact O-N 3.06Å
479	W	88.9	Confident	84.6	Confident	37 Å²	37	38.1 Å²	38.1	14%	0.14	19%	0.194	C	C	.	.	H	α-helix	trans	-57.9	-40.2	-177.3	-70.2	-7.7	0	0	0	113.1	Y471 S483 V509 K512 D513 D514 Q521	Y471-W479 HydrophobicContact CD1-CH2 4.2Å; Y471-W479 HydrophobicContact CD1-CZ3 4.49Å; Y471-W479 AromaticContact CD2-CE3 3.86Å; Y471-W479 HydrophobicContact CD2-CE3 3.86Å; Y471-W479 AromaticContact CD2-CH2 3.94Å; Y471-W479 HydrophobicContact CD2-CH2 3.94Å; Y471-W479 AromaticContact CD2-CZ3 3.43Å; Y471-W479 HydrophobicContact CD2-CZ3 3.43Å; Y471-W479 VanDerWaalsContact CD2-CZ3 3.43Å; Y471-W479 HydrophobicContact CE2-CH2 4.49Å; Y471-W479 HydrophobicContact CE2-CZ3 4.06Å; Y471-W479 HydrophobicContact CG-CD2 4.47Å; Y471-W479 HydrophobicContact CG-CE3 4.05Å; Y471-W479 AromaticContact CG-CH2 3.78Å; Y471-W479 HydrophobicContact CG-CH2 3.78Å; Y471-W479 HydrophobicContact CG-CZ2 4.26Å; Y471-W479 AromaticContact CG-CZ3 3.69Å; Y471-W479 HydrophobicContact CG-CZ3 3.69Å; Y471-W479 PolarHBondContact O-N 2.97Å; W479-S483 WeakPolarHBondContact O-CB 3.28Å; W479-S483 PolarHBondContact O-N 3.49Å; W479-S483 VanDerWaalsContact O-N 3.14Å; W479-V509 HydrophobicContact CB-CG1 4.47Å; W479-K512 HydrophobicContact CB-CD 3.81Å; W479-K512 HydrophobicContact CD2-CB 3.83Å; W479-K512 HydrophobicContact CD2-CD 3.84Å; W479-K512 HydrophobicContact CD2-CG 4.43Å; W479-K512 HydrophobicContact CE3-CB 3.67Å; W479-K512 HydrophobicContact CE3-CD 4.38Å; W479-K512 HydrophobicContact CG-CB 4.47Å; W479-K512 HydrophobicContact CG-CD 3.56Å; W479-K512 HydrophobicContact CH2-CB 4.24Å; W479-K512 HydrophobicContact CZ2-CB 4.35Å; W479-K512 HydrophobicContact CZ3-CB 3.89Å; W479-D513 VanDerWaalsContact CH2-C 3.4Å; W479-D514 HydrophobicContact CH2-CB 4.15Å; W479-Q521 HydrophobicContact CE3-CB 3.98Å; W479-Q521 HydrophobicContact CZ3-CB 4.15Å
480	Y	91.6	Very high	86.1	Confident	2 Å²	2	42.4 Å²	42.4	1%	0.008	21%	0.212	C	C	.	.	H	α-helix	trans	-69.9	-51.8	-179.3	177	-114.2	0	0	0	112.3	G461 A463 T478 Q482 S483 L484 V505 P523	G461-Y480 WeakPolarHBondContact CA-OH 3.37Å; G461-Y480 PolarHBondContact O-OH 3.48Å; A463-Y480 HydrophobicContact CB-CD1 3.47Å; A463-Y480 VanDerWaalsContact CB-CD1 3.47Å; A463-Y480 HydrophobicContact CB-CE1 4.18Å; A463-Y480 HydrophobicContact CB-CG 3.68Å; T478-Y480 VanDerWaalsContact C-N 3.25Å; T478-Y480 PolarHBondContact O-N 3.13Å; Y480-Q482 PolarHBondContact O-N 2.67Å; Y480-S483 PolarHBondContact O-N 2.85Å; Y480-L484 HydrophobicContact CE1-CD2 4.38Å; Y480-L484 WeakPolarHBondContact O-CB 3.29Å; Y480-L484 PolarHBondContact O-N 3Å; Y480-V505 HydrophobicContact CD2-CG1 3.68Å; Y480-V505 HydrophobicContact CE2-CG1 3.69Å; Y480-P523 HydrophobicContact CD2-CB 3.64Å; Y480-P523 HydrophobicContact CD2-CG 3.69Å; Y480-P523 HydrophobicContact CE2-CB 3.69Å; Y480-P523 HydrophobicContact CE2-CG 4.2Å
481	I	94	Very high	87.5	Confident	0 Å²	0	43.4 Å²	43.4	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-67	-40.6	-176.8	-62.7	-61.9	0	0	0	111.3	D325 L329 L374 Q417 T478 L484 C485	D325-I481 HydrophobicContact CB-CB 4.15Å; D325-I481 HydrophobicContact CB-CG1 4.48Å; D325-I481 HydrophobicContact CB-CG2 3.76Å; L329-I481 HydrophobicContact CD1-CD1 4.32Å; L329-I481 HydrophobicContact CD1-CG2 3.9Å; L329-I481 HydrophobicContact CD2-CD1 4.42Å; L329-I481 HydrophobicContact CD2-CG2 3.97Å; L329-I481 HydrophobicContact CG-CG2 3.63Å; L374-I481 HydrophobicContact CD2-CD1 3.95Å; L374-I481 HydrophobicContact CD2-CG1 3.87Å; Q417-I481 HydrophobicContact CB-CD1 4.04Å; Q417-I481 HydrophobicContact CB-CG1 3.89Å; Q417-I481 HydrophobicContact CG-CG1 3.97Å; T478-I481 PolarHBondContact O-N 2.95Å; T478-I481 WeakPolarHBondContact OG1-CB 3.34Å; T478-I481 VanDerWaalsContact OG1-CG1 3.3Å; T478-I481 WeakPolarHBondContact OG1-CG1 3.45Å; I481-L484 HydrophobicContact CD1-CD2 4.49Å; I481-L484 PolarHBondContact O-N 3.48Å; I481-C485 WeakPolarHBondContact O-CB 3.5Å; I481-C485 PolarHBondContact O-N 3.09Å; I481-C485 PolarHBondContact O-SG 3Å
482	Q	93.7	Very high	88.5	Confident	53 Å²	53	42.1 Å²	42.1	25%	0.248	21%	0.209	C	C	.	.	H	α-helix	trans	-64.4	-45.1	177.8	-63.3	-60.1	-41.7	0	0	111.5	D325 E476 T478 Y480 C485 Q486	D325-Q482 PolarHBondContact OD1-NE2 3.13Å; E476-Q482 WeakPolarHBondContact O-CG 3.47Å; E476-Q482 PolarHBondContact O-NE2 2.94Å; T478-Q482 WeakPolarHBondContact O-CB 3.4Å; T478-Q482 WeakPolarHBondContact O-CG 3.44Å; T478-Q482 PolarHBondContact O-N 3.06Å; Y480-Q482 PolarHBondContact O-N 2.67Å; Q482-C485 PolarHBondContact O-N 2.98Å; Q482-Q486 WeakPolarHBondContact O-CB 3.36Å; Q482-Q486 PolarHBondContact O-N 3.03Å
483	S	94.3	Very high	89.1	Confident	2 Å²	2	42.5 Å²	42.5	1%	0.014	22%	0.22	C	C	.	.	H	α-helix	trans	-64.5	-41.1	175.6	178.1	0	0	0	0	111.8	W479 Y480 Q486 S487 E508	W479-S483 WeakPolarHBondContact O-CB 3.28Å; W479-S483 PolarHBondContact O-N 3.49Å; W479-S483 VanDerWaalsContact O-N 3.14Å; Y480-S483 PolarHBondContact O-N 2.85Å; S483-Q486 PolarHBondContact O-N 2.84Å; S483-S487 WeakPolarHBondContact O-CB 3.41Å; S483-S487 PolarHBondContact O-N 3.24Å; S483-S487 PolarHBondContact O-OG 3.19Å; S483-S487 VanDerWaalsContact O-OG 3.05Å; S483-E508 WeakPolarHBondContact OG-CB 3.37Å
484	L	94.7	Very high	89.9	Confident	0 Å²	0	48.3 Å²	48.3	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-59.3	-50.2	175.3	176.3	65	0	0	0	111.8	F415 Y480 I481 S487 L488 L502 V505	F415-L484 HydrophobicContact CB-CD2 4.39Å; F415-L484 HydrophobicContact CD1-CD2 3.56Å; F415-L484 HydrophobicContact CD2-CD2 4.1Å; F415-L484 HydrophobicContact CE1-CD1 4.02Å; F415-L484 HydrophobicContact CE1-CD2 3.74Å; F415-L484 HydrophobicContact CE2-CD2 4.26Å; F415-L484 HydrophobicContact CG-CD2 3.75Å; F415-L484 HydrophobicContact CZ-CD1 4.24Å; F415-L484 HydrophobicContact CZ-CD2 4.08Å; Y480-L484 HydrophobicContact CE1-CD2 4.38Å; Y480-L484 WeakPolarHBondContact O-CB 3.29Å; Y480-L484 PolarHBondContact O-N 3Å; I481-L484 HydrophobicContact CD1-CD2 4.49Å; I481-L484 PolarHBondContact O-N 3.48Å; L484-S487 PolarHBondContact O-N 2.76Å; L484-L488 HydrophobicContact CD1-CD1 3.82Å; L484-L488 HydrophobicContact CD1-CG 4.12Å; L484-L488 HydrophobicContact CG-CD1 3.83Å; L484-L488 VanDerWaalsContact O-CB 3.29Å; L484-L488 WeakPolarHBondContact O-CB 3.41Å; L484-L488 WeakPolarHBondContact O-CD1 3.47Å; L484-L488 WeakPolarHBondContact O-CG 3.42Å; L484-L488 PolarHBondContact O-N 3.28Å; L484-L502 HydrophobicContact CD1-CD2 3.86Å; L484-V505 HydrophobicContact CB-CG2 4.35Å; L484-V505 HydrophobicContact CD1-CG2 4.26Å
485	C	95.5	Very high	90.7	Very high	5 Å²	5	46.7 Å²	46.7	3%	0.034	24%	0.237	C	C	.	.	H	α-helix	trans	-63.3	-44.4	-180	-66.7	0	0	0	0	111.1	A328 T332 I481 Q482 L488 R489	A328-C485 HydrophobicContact CB-CB 4.22Å; T332-C485 WeakPolarHBondContact OG1-CB 3.42Å; I481-C485 WeakPolarHBondContact O-CB 3.5Å; I481-C485 PolarHBondContact O-N 3.09Å; I481-C485 PolarHBondContact O-SG 3Å; Q482-C485 PolarHBondContact O-N 2.98Å; C485-L488 PolarHBondContact O-N 3.14Å; C485-R489 VanDerWaalsContact O-CG 3.27Å; C485-R489 WeakPolarHBondContact O-CG 3.35Å; C485-R489 PolarHBondContact O-N 3.24Å
486	Q	94.4	Very high	91.6	Very high	103 Å²	103	44.6 Å²	44.6	48%	0.481	22%	0.215	S	C	.	.	H	α-helix	trans	-59.7	-54	176.9	-176.6	-179.5	-3	0	0	111.4	Q482 S483 L488 R489 E490	Q482-Q486 WeakPolarHBondContact O-CB 3.36Å; Q482-Q486 PolarHBondContact O-N 3.03Å; S483-Q486 PolarHBondContact O-N 2.84Å; Q486-L488 VanDerWaalsContact C-N 3.32Å; Q486-L488 PolarHBondContact O-N 3.28Å; Q486-R489 PolarHBondContact O-N 3.27Å; Q486-E490 WeakPolarHBondContact CG-OE1 3.27Å; Q486-E490 PolarHBondContact NE2-OE1 3.31Å; Q486-E490 WeakPolarHBondContact O-CG 3.42Å; Q486-E490 PolarHBondContact O-N 2.86Å
487	S	94.1	Very high	92.4	Very high	5 Å²	5	39.6 Å²	39.6	4%	0.035	19%	0.192	C	C	.	.	H	α-helix	trans	-62.7	-37.7	-178.5	-61	0	0	0	0	112.2	S483 L484 R491	S483-S487 WeakPolarHBondContact O-CB 3.41Å; S483-S487 PolarHBondContact O-N 3.24Å; S483-S487 PolarHBondContact O-OG 3.19Å; S483-S487 VanDerWaalsContact O-OG 3.05Å; L484-S487 PolarHBondContact O-N 2.76Å; S487-R491 WeakPolarHBondContact O-CB 3.42Å; S487-R491 WeakPolarHBondContact O-CG 3.19Å; S487-R491 PolarHBondContact O-N 3.26Å
488	L	94.1	Very high	92.9	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-60.8	-51.1	173.9	-79.1	168.3	0	0	0	111.3	T332 F333 L484 C485 Q486 E490 R491 C492 I498 I501 F535	T332-L488 HydrophobicContact CG2-CB 3.77Å; T332-L488 HydrophobicContact CG2-CD1 4Å; F333-L488 HydrophobicContact CE1-CD1 4.2Å; F333-L488 HydrophobicContact CZ-CD1 3.87Å; L484-L488 HydrophobicContact CD1-CD1 3.82Å; L484-L488 HydrophobicContact CD1-CG 4.12Å; L484-L488 HydrophobicContact CG-CD1 3.83Å; L484-L488 VanDerWaalsContact O-CB 3.29Å; L484-L488 WeakPolarHBondContact O-CB 3.41Å; L484-L488 WeakPolarHBondContact O-CD1 3.47Å; L484-L488 WeakPolarHBondContact O-CG 3.42Å; L484-L488 PolarHBondContact O-N 3.28Å; C485-L488 PolarHBondContact O-N 3.14Å; Q486-L488 VanDerWaalsContact C-N 3.32Å; Q486-L488 PolarHBondContact O-N 3.28Å; L488-E490 VanDerWaalsContact C-N 3.31Å; L488-E490 PolarHBondContact O-N 3.39Å; L488-R491 PolarHBondContact O-N 3.14Å; L488-C492 WeakPolarHBondContact O-CB 3.29Å; L488-C492 PolarHBondContact O-N 3.12Å; L488-C492 PolarHBondContact O-SG 3.16Å; L488-I498 HydrophobicContact CD2-CD1 3.6Å; L488-I501 HydrophobicContact CD2-CD1 4.07Å; L488-I501 HydrophobicContact CD2-CG2 4.11Å; L488-I501 HydrophobicContact CG-CG2 4.19Å; L488-F535 HydrophobicContact CD2-CD2 4.44Å
489	R	93.5	Very high	93.2	Very high	124 Å²	124	41.7 Å²	41.7	47%	0.468	20%	0.203	S	C	.	.	H	α-helix	trans	-64.9	-34.2	-177.1	-67.2	-178.7	84.2	-170.9	4.7	112.8	T332 E335 C485 Q486 P493	T332-R489 HydrophobicContact CG2-CG 3.81Å; E335-R489 IonicContact OE2-CZ 2.57Å; E335-R489 VanDerWaalsContact OE2-CZ 3.24Å; E335-R489 IonicContact OE2-NE 2.75Å; E335-R489 PolarHBondContact OE2-NE 2.81Å; E335-R489 IonicContact OE2-NH2 3.69Å; E335-R489 PolarHBondContact OE2-NH2 2.81Å; C485-R489 VanDerWaalsContact O-CG 3.27Å; C485-R489 WeakPolarHBondContact O-CG 3.35Å; C485-R489 PolarHBondContact O-N 3.24Å; Q486-R489 PolarHBondContact O-N 3.27Å; R489-P493 WeakPolarHBondContact O-CD 3.39Å; R489-P493 VanDerWaalsContact O-CG 3.32Å; R489-P493 WeakPolarHBondContact O-CG 3.46Å
490	E	93.4	Very high	93.4	Very high	110 Å²	110	42.9 Å²	42.9	51%	0.514	21%	0.214	S	C	.	.	H	α-helix	trans	-79.5	-35.4	179.6	-69.3	176.4	-167.2	0	0	113.1	Q486 L488 R494	Q486-E490 WeakPolarHBondContact CG-OE1 3.27Å; Q486-E490 PolarHBondContact NE2-OE1 3.31Å; Q486-E490 WeakPolarHBondContact O-CG 3.42Å; Q486-E490 PolarHBondContact O-N 2.86Å; L488-E490 VanDerWaalsContact C-N 3.31Å; L488-E490 PolarHBondContact O-N 3.39Å; E490-R494 WeakPolarHBondContact O-CD 3.36Å
491	R	93.1	Very high	93.6	Very high	38 Å²	38	42.8 Å²	42.8	14%	0.143	21%	0.214	C	C	.	.	H	α-helix	trans	-104.1	-27.4	-168.8	-63.5	177.1	169.1	-94.1	6.5	114.5	S487 L488 R494 G495 D496 I501 E504	S487-R491 WeakPolarHBondContact O-CB 3.42Å; S487-R491 WeakPolarHBondContact O-CG 3.19Å; S487-R491 PolarHBondContact O-N 3.26Å; L488-R491 PolarHBondContact O-N 3.14Å; R491-R494 WeakPolarHBondContact O-CB 3.38Å; R491-R494 PolarHBondContact O-N 3.23Å; R491-G495 PolarHBondContact O-N 2.93Å; R491-D496 HydrophobicContact CB-CB 4.01Å; R491-D496 WeakPolarHBondContact CB-OD2 3.37Å; R491-D496 IonicContact NH1-OD2 2.8Å; R491-D496 PolarHBondContact NH1-OD2 3.05Å; R491-D496 VanDerWaalsContact NH1-OD2 3.07Å; R491-D496 PolarHBondContact O-N 3.07Å; R491-I501 HydrophobicContact CB-CD1 4.04Å; R491-I501 HydrophobicContact CB-CG1 3.83Å; R491-E504 IonicContact CZ-OE1 3.09Å; R491-E504 IonicContact NE-OE1 3.61Å; R491-E504 IonicContact NH2-OE1 3.96Å; R491-E504 PolarHBondContact NH2-OE1 2.92Å; R491-E504 IonicContact NH2-OE2 3.24Å; R491-E504 PolarHBondContact NH2-OE2 3.47Å
492	C	92.4	Very high	93.5	Very high	2 Å²	2	42.8 Å²	42.8	1%	0.014	21%	0.214	C	C	.	.	G	3₁₀ helix	trans	-57.6	-42.5	173.7	-72.4	0	0	0	0	113	L336 L488 R494 G495 F535	L336-C492 HydrophobicContact CD2-CB 3.8Å; L488-C492 WeakPolarHBondContact O-CB 3.29Å; L488-C492 PolarHBondContact O-N 3.12Å; L488-C492 PolarHBondContact O-SG 3.16Å; C492-R494 PolarHBondContact O-N 3.38Å; C492-G495 PolarHBondContact O-N 2.98Å; C492-F535 WeakPolarHBondContact CB-O 3.44Å
493	P	91.8	Very high	93.4	Very high	77 Å²	77	44.6 Å²	44.6	50%	0.5	23%	0.229	S	C	.	.	G	3₁₀ helix	trans	-63.3	-22	175.2	-23.6	35.1	0	0	0	114.1	R489 G495 S537	R489-P493 WeakPolarHBondContact O-CD 3.39Å; R489-P493 VanDerWaalsContact O-CG 3.32Å; R489-P493 WeakPolarHBondContact O-CG 3.46Å; P493-G495 VanDerWaalsContact C-N 3.3Å; P493-S537 WeakPolarHBondContact CA-OG 3.28Å
494	R	91.4	Very high	93.3	Very high	169 Å²	169	47.2 Å²	47.2	64%	0.638	24%	0.241	S	C	*	.	G	3₁₀ helix	trans	-83.1	-9.1	176.9	-60.8	170.5	54.6	-169	-4.6	112.7	E490 R491 C492	E490-R494 WeakPolarHBondContact O-CD 3.36Å; R491-R494 WeakPolarHBondContact O-CB 3.38Å; R491-R494 PolarHBondContact O-N 3.23Å; C492-R494 PolarHBondContact O-N 3.38Å
495	G	90.3	Very high	93.2	Very high	47 Å²	47	47.2 Å²	47.2	49%	0.485	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	84.4	12.2	-177.9	0	0	0	0	0	114.7	R491 C492 P493	R491-G495 PolarHBondContact O-N 2.93Å; C492-G495 PolarHBondContact O-N 2.98Å; P493-G495 VanDerWaalsContact C-N 3.3Å
496	D	93	Very high	92.9	Very high	33 Å²	33	48.2 Å²	48.2	18%	0.176	25%	0.246	C	C	.	.			trans	-63.8	139.2	177.1	-70.3	0.2	0	0	0	110.2	R491 T500 I501	R491-D496 HydrophobicContact CB-CB 4.01Å; R491-D496 WeakPolarHBondContact CB-OD2 3.37Å; R491-D496 IonicContact NH1-OD2 2.8Å; R491-D496 PolarHBondContact NH1-OD2 3.05Å; R491-D496 VanDerWaalsContact NH1-OD2 3.07Å; R491-D496 PolarHBondContact O-N 3.07Å; D496-T500 HydrophobicContact CB-CG2 4.5Å; D496-I501 HydrophobicContact CB-CD1 4.35Å; D496-I501 HydrophobicContact CB-CG1 4.03Å
497	D	94.4	Very high	92.6	Very high	23 Å²	23	49.8 Å²	49.8	12%	0.123	25%	0.248	C	C	.	.	B	Isolated β-bridge	trans	-76.2	156.9	173.4	77	-87.2	0	0	0	112.1	L499 T500 I501 K532 L533 V534	D497-L499 PolarHBondContact O-N 3.05Å; D497-L499 VanDerWaalsContact O-N 3.14Å; D497-L499 WeakPolarHBondContact OD2-CA 3.3Å; D497-L499 VanDerWaalsContact OD2-CB 3.3Å; D497-L499 WeakPolarHBondContact OD2-CB 3.31Å; D497-L499 PolarHBondContact OD2-N 3.18Å; D497-T500 WeakPolarHBondContact O-CB 3.19Å; D497-T500 PolarHBondContact O-N 3.39Å; D497-T500 VanDerWaalsContact O-N 3.13Å; D497-T500 PolarHBondContact OD1-OG1 3.42Å; D497-T500 PolarHBondContact OD2-N 3.29Å; D497-I501 WeakPolarHBondContact O-CG1 3.49Å; D497-I501 PolarHBondContact O-N 3.07Å; D497-K532 HydrophobicContact CB-CB 4.39Å; D497-L533 CarbonylContact C-O 3.49Å; D497-L533 WeakPolarHBondContact CA-O 3.48Å; D497-V534 HydrophobicContact CB-CG1 3.95Å
498	I	95.3	Very high	92.4	Very high	1 Å²	1	52.8 Å²	52.8	1%	0.005	26%	0.262	C	S	.	.	H	α-helix	trans	-59.4	-28.8	-174.3	-163.9	55.3	0	0	0	113.9	L459 L488 I501 L502 L529 L533 F535	L459-I498 HydrophobicContact CD2-CB 4.28Å; L459-I498 HydrophobicContact CD2-CG1 3.58Å; L459-I498 HydrophobicContact CD2-CG2 3.64Å; L488-I498 HydrophobicContact CD2-CD1 3.6Å; I498-I501 PolarHBondContact O-N 3.18Å; I498-L502 HydrophobicContact CG1-CD1 4.06Å; I498-L502 HydrophobicContact CG1-CG 4.41Å; I498-L502 WeakPolarHBondContact O-CB 3.43Å; I498-L502 WeakPolarHBondContact O-CG 3.25Å; I498-L502 PolarHBondContact O-N 3.38Å; I498-L529 HydrophobicContact CG2-CD1 4.16Å; I498-L533 HydrophobicContact CB-CB 4.45Å; I498-L533 HydrophobicContact CB-CG 4.38Å; I498-L533 HydrophobicContact CG2-CB 3.73Å; I498-L533 HydrophobicContact CG2-CD2 4.02Å; I498-L533 HydrophobicContact CG2-CG 4.03Å; I498-L533 PolarHBondContact N-O 3.13Å; I498-F535 HydrophobicContact CD1-CD2 4.49Å; I498-F535 HydrophobicContact CD1-CE2 3.97Å; I498-F535 HydrophobicContact CG1-CE2 4.3Å
499	L	93.7	Very high	92	Very high	45 Å²	45	52.8 Å²	52.8	24%	0.236	26%	0.262	C	S	.	.	H	α-helix	trans	-75.7	-38.5	-179.3	-58.9	179.6	0	0	0	110.2	L459 D497 I501 L502 T503 F527 L529	L459-L499 HydrophobicContact CD1-CD2 3.96Å; D497-L499 PolarHBondContact O-N 3.05Å; D497-L499 VanDerWaalsContact O-N 3.14Å; D497-L499 WeakPolarHBondContact OD2-CA 3.3Å; D497-L499 VanDerWaalsContact OD2-CB 3.3Å; D497-L499 WeakPolarHBondContact OD2-CB 3.31Å; D497-L499 PolarHBondContact OD2-N 3.18Å; L499-I501 VanDerWaalsContact C-N 3.34Å; L499-L502 PolarHBondContact O-N 3.42Å; L499-T503 WeakPolarHBondContact O-CB 3.31Å; L499-T503 PolarHBondContact O-N 3.48Å; L499-T503 PolarHBondContact O-OG1 2.69Å; L499-F527 HydrophobicContact CD1-CD1 4.27Å; L499-F527 HydrophobicContact CD1-CD2 4.24Å; L499-F527 HydrophobicContact CD1-CE1 3.98Å; L499-F527 HydrophobicContact CD1-CE2 3.94Å; L499-F527 HydrophobicContact CD1-CG 4.4Å; L499-F527 HydrophobicContact CD1-CZ 3.8Å; L499-F527 HydrophobicContact CD2-CB 4.45Å; L499-F527 HydrophobicContact CD2-CD1 3.68Å; L499-F527 HydrophobicContact CD2-CE1 4.04Å; L499-F527 HydrophobicContact CD2-CG 4.02Å; L499-L529 HydrophobicContact CD2-CD1 4.42Å
500	T	93.6	Very high	91.5	Very high	62 Å²	62	48.5 Å²	48.5	38%	0.38	25%	0.251	S	S	.	.	H	α-helix	trans	-59.4	-46.7	168.8	-61.2	0	0	0	0	110.6	D496 D497 L502 T503 E504	D496-T500 HydrophobicContact CB-CG2 4.5Å; D497-T500 WeakPolarHBondContact O-CB 3.19Å; D497-T500 PolarHBondContact O-N 3.39Å; D497-T500 VanDerWaalsContact O-N 3.13Å; D497-T500 PolarHBondContact OD1-OG1 3.42Å; D497-T500 PolarHBondContact OD2-N 3.29Å; T500-L502 PolarHBondContact O-N 2.88Å; T500-T503 WeakPolarHBondContact O-CB 3.17Å; T500-T503 PolarHBondContact O-N 2.87Å; T500-E504 PolarHBondContact O-N 2.62Å; T500-E504 VanDerWaalsContact O-N 3.14Å
501	I	94.2	Very high	91	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-61.2	-44.9	177.9	-62.9	174.8	0	0	0	111.1	L488 R491 D496 D497 I498 L499 T503 E504 V505	L488-I501 HydrophobicContact CD2-CD1 4.07Å; L488-I501 HydrophobicContact CD2-CG2 4.11Å; L488-I501 HydrophobicContact CG-CG2 4.19Å; R491-I501 HydrophobicContact CB-CD1 4.04Å; R491-I501 HydrophobicContact CB-CG1 3.83Å; D496-I501 HydrophobicContact CB-CD1 4.35Å; D496-I501 HydrophobicContact CB-CG1 4.03Å; D497-I501 WeakPolarHBondContact O-CG1 3.49Å; D497-I501 PolarHBondContact O-N 3.07Å; I498-I501 PolarHBondContact O-N 3.18Å; L499-I501 VanDerWaalsContact C-N 3.34Å; I501-T503 VanDerWaalsContact C-N 3.28Å; I501-T503 PolarHBondContact O-N 3.44Å; I501-E504 WeakPolarHBondContact O-CB 3.44Å; I501-E504 PolarHBondContact O-N 3.4Å; I501-V505 WeakPolarHBondContact O-CG2 3.44Å; I501-V505 PolarHBondContact O-N 2.86Å
502	L	93.3	Very high	90.5	Very high	0 Å²	0	48.3 Å²	48.3	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-67.8	-27.7	178.6	-75	168.1	0	0	0	113.1	F415 L459 L484 I498 L499 T500 V505 N506 P525	F415-L502 HydrophobicContact CE1-CD2 4.17Å; L459-L502 HydrophobicContact CD1-CD1 3.9Å; L459-L502 HydrophobicContact CD2-CD1 3.93Å; L459-L502 HydrophobicContact CG-CD1 4.32Å; L484-L502 HydrophobicContact CD1-CD2 3.86Å; I498-L502 HydrophobicContact CG1-CD1 4.06Å; I498-L502 HydrophobicContact CG1-CG 4.41Å; I498-L502 WeakPolarHBondContact O-CB 3.43Å; I498-L502 WeakPolarHBondContact O-CG 3.25Å; I498-L502 PolarHBondContact O-N 3.38Å; L499-L502 PolarHBondContact O-N 3.42Å; T500-L502 PolarHBondContact O-N 2.88Å; L502-V505 PolarHBondContact O-N 2.8Å; L502-N506 VanDerWaalsContact O-CG 3.31Å; L502-N506 PolarHBondContact O-N 2.94Å; L502-N506 PolarHBondContact O-OD1 2.98Å; L502-P525 HydrophobicContact CB-CB 4.46Å; L502-P525 HydrophobicContact CB-CG 4.27Å; L502-P525 HydrophobicContact CD1-CB 3.96Å
503	T	91.4	Very high	89.9	Confident	91 Å²	91	52.1 Å²	52.1	56%	0.558	27%	0.273	S	S	*	.	H	α-helix	trans	-66.7	-40.7	172.1	-56.8	0	0	0	0	110.8	L499 T500 I501 N506 Y507	L499-T503 WeakPolarHBondContact O-CB 3.31Å; L499-T503 PolarHBondContact O-N 3.48Å; L499-T503 PolarHBondContact O-OG1 2.69Å; T500-T503 WeakPolarHBondContact O-CB 3.17Å; T500-T503 PolarHBondContact O-N 2.87Å; I501-T503 VanDerWaalsContact C-N 3.28Å; I501-T503 PolarHBondContact O-N 3.44Å; T503-N506 WeakPolarHBondContact O-CB 3.35Å; T503-N506 PolarHBondContact O-N 2.91Å; T503-Y507 PolarHBondContact O-N 2.93Å; T503-Y507 VanDerWaalsContact O-N 3.1Å
504	E	91.8	Very high	89.1	Confident	56 Å²	56	50 Å²	50	26%	0.262	26%	0.258	S	S	.	.	H	α-helix	trans	-63	-43.3	172.1	-172.7	75.5	155.8	0	0	111.8	R491 T500 I501 N506 Y507 E508	R491-E504 IonicContact CZ-OE1 3.09Å; R491-E504 IonicContact NE-OE1 3.61Å; R491-E504 IonicContact NH2-OE1 3.96Å; R491-E504 PolarHBondContact NH2-OE1 2.92Å; R491-E504 IonicContact NH2-OE2 3.24Å; R491-E504 PolarHBondContact NH2-OE2 3.47Å; T500-E504 PolarHBondContact O-N 2.62Å; T500-E504 VanDerWaalsContact O-N 3.14Å; I501-E504 WeakPolarHBondContact O-CB 3.44Å; I501-E504 PolarHBondContact O-N 3.4Å; E504-N506 PolarHBondContact O-N 2.79Å; E504-Y507 WeakPolarHBondContact O-CA 3.47Å; E504-Y507 WeakPolarHBondContact O-CB 3.17Å; E504-Y507 PolarHBondContact O-N 2.97Å; E504-E508 HydrophobicContact CG-CG 4.45Å; E504-E508 PolarHBondContact O-N 3.14Å
505	V	92.4	Very high	88.2	Confident	0 Å²	0	50.2 Å²	50.2	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-59.2	-38.9	176.7	174.6	0	0	0	0	110.9	Y480 L484 I501 L502 V509	Y480-V505 HydrophobicContact CD2-CG1 3.68Å; Y480-V505 HydrophobicContact CE2-CG1 3.69Å; L484-V505 HydrophobicContact CB-CG2 4.35Å; L484-V505 HydrophobicContact CD1-CG2 4.26Å; I501-V505 WeakPolarHBondContact O-CG2 3.44Å; I501-V505 PolarHBondContact O-N 2.86Å; L502-V505 PolarHBondContact O-N 2.8Å; V505-V509 HydrophobicContact CG1-CG2 4.16Å; V505-V509 WeakPolarHBondContact O-CB 3.44Å; V505-V509 VanDerWaalsContact O-CG2 3.22Å; V505-V509 WeakPolarHBondContact O-CG2 3.5Å; V505-V509 PolarHBondContact O-N 3.46Å
506	N	89.2	Confident	87.3	Confident	27 Å²	27	56.5 Å²	56.5	14%	0.144	28%	0.277	C	S	.	.	H	α-helix	trans	-60.5	-46.5	173.2	-72	-12.4	0	0	0	111.4	L502 T503 E504 S510 M522 P523	L502-N506 VanDerWaalsContact O-CG 3.31Å; L502-N506 PolarHBondContact O-N 2.94Å; L502-N506 PolarHBondContact O-OD1 2.98Å; T503-N506 WeakPolarHBondContact O-CB 3.35Å; T503-N506 PolarHBondContact O-N 2.91Å; E504-N506 PolarHBondContact O-N 2.79Å; N506-S510 WeakPolarHBondContact O-CB 3.28Å; N506-S510 PolarHBondContact O-N 3.09Å; N506-S510 PolarHBondContact O-OG 3.36Å; N506-M522 HydrophobicContact CB-CE 3.79Å; N506-P523 WeakPolarHBondContact OD1-CB 3.4Å; N506-P523 PolarHBondContact OD1-O 3.42Å
507	Y	88.6	Confident	86.2	Confident	136 Å²	136	58.7 Å²	58.7	53%	0.533	29%	0.289	S	S	.	.	H	α-helix	trans	-59	-53.7	177.9	-178.9	-98.3	0	0	0	111.6	T503 E504 V509 S510 N511	T503-Y507 PolarHBondContact O-N 2.93Å; T503-Y507 VanDerWaalsContact O-N 3.1Å; E504-Y507 WeakPolarHBondContact O-CA 3.47Å; E504-Y507 WeakPolarHBondContact O-CB 3.17Å; E504-Y507 PolarHBondContact O-N 2.97Å; Y507-V509 PolarHBondContact O-N 3Å; Y507-S510 PolarHBondContact O-N 2.98Å; Y507-S510 VanDerWaalsContact O-N 3.17Å; Y507-S510 PolarHBondContact O-OG 3.45Å; Y507-N511 WeakPolarHBondContact CE1-ND2 3.45Å; Y507-N511 PolarHBondContact O-N 3.37Å; Y507-N511 PolarHBondContact O-ND2 2.81Å
508	E	88.8	Confident	85.1	Confident	67 Å²	67	64.9 Å²	64.9	31%	0.313	32%	0.319	S	S	.	.	H	α-helix	trans	-59	-47.6	-179.9	-77.6	-60.6	137.9	0	0	112.8	S483 E504 S510 N511 K512	S483-E508 WeakPolarHBondContact OG-CB 3.37Å; E504-E508 HydrophobicContact CG-CG 4.45Å; E504-E508 PolarHBondContact O-N 3.14Å; E508-S510 VanDerWaalsContact C-N 3.32Å; E508-S510 PolarHBondContact O-N 3.35Å; E508-N511 PolarHBondContact O-N 2.76Å; E508-K512 PolarHBondContact O-N 3.49Å
509	V	87	Confident	84	Confident	0 Å²	0	64.8 Å²	64.8	0%	0	32%	0.319	C	S	.	.	H	α-helix	trans	-68	-34.9	178.6	178.8	0	0	0	0	111.2	W479 V505 Y507 N511 K512 Q521 P523	W479-V509 HydrophobicContact CB-CG1 4.47Å; V505-V509 HydrophobicContact CG1-CG2 4.16Å; V505-V509 WeakPolarHBondContact O-CB 3.44Å; V505-V509 VanDerWaalsContact O-CG2 3.22Å; V505-V509 WeakPolarHBondContact O-CG2 3.5Å; V505-V509 PolarHBondContact O-N 3.46Å; Y507-V509 PolarHBondContact O-N 3Å; V509-N511 PolarHBondContact O-N 3.37Å; V509-K512 PolarHBondContact O-N 3.13Å; V509-Q521 HydrophobicContact CG1-CB 3.74Å; V509-Q521 HydrophobicContact CG1-CG 3.71Å; V509-P523 HydrophobicContact CB-CG 3.63Å; V509-P523 HydrophobicContact CG1-CG 3.67Å; V509-P523 HydrophobicContact CG2-CG 3.84Å
510	S	82.8	Confident	83.4	Confident	34 Å²	34	65 Å²	65	24%	0.238	32%	0.318	C	S	.	.	H	α-helix	trans	-66.8	-25.2	176.6	78.5	0	0	0	0	113	N506 Y507 E508 K520	N506-S510 WeakPolarHBondContact O-CB 3.28Å; N506-S510 PolarHBondContact O-N 3.09Å; N506-S510 PolarHBondContact O-OG 3.36Å; Y507-S510 PolarHBondContact O-N 2.98Å; Y507-S510 VanDerWaalsContact O-N 3.17Å; Y507-S510 PolarHBondContact O-OG 3.45Å; E508-S510 VanDerWaalsContact C-N 3.32Å; E508-S510 PolarHBondContact O-N 3.35Å; S510-K520 WeakPolarHBondContact O-CE 3.45Å; S510-K520 PolarHBondContact O-NZ 3.48Å
511	N	82.7	Confident	82.7	Confident	83 Å²	83	62.1 Å²	62.1	44%	0.444	30%	0.3	S	S	.	.	H	α-helix	trans	-78.9	-24.3	175.3	-71.4	-27.7	0	0	0	112.6	Y507 E508 V509 K520	Y507-N511 WeakPolarHBondContact CE1-ND2 3.45Å; Y507-N511 PolarHBondContact O-N 3.37Å; Y507-N511 PolarHBondContact O-ND2 2.81Å; E508-N511 PolarHBondContact O-N 2.76Å; V509-N511 PolarHBondContact O-N 3.37Å; N511-K520 PolarHBondContact O-NZ 2.82Å
512	K	82.6	Confident	82.4	Confident	62 Å²	62	65.3 Å²	65.3	27%	0.27	32%	0.316	S	S	.	.			trans	-68.8	144.4	175.1	-64.6	179.1	-177.9	-175	0	111.2	W479 E508 V509 K520	W479-K512 HydrophobicContact CB-CD 3.81Å; W479-K512 HydrophobicContact CD2-CB 3.83Å; W479-K512 HydrophobicContact CD2-CD 3.84Å; W479-K512 HydrophobicContact CD2-CG 4.43Å; W479-K512 HydrophobicContact CE3-CB 3.67Å; W479-K512 HydrophobicContact CE3-CD 4.38Å; W479-K512 HydrophobicContact CG-CB 4.47Å; W479-K512 HydrophobicContact CG-CD 3.56Å; W479-K512 HydrophobicContact CH2-CB 4.24Å; W479-K512 HydrophobicContact CZ2-CB 4.35Å; W479-K512 HydrophobicContact CZ3-CB 3.89Å; E508-K512 PolarHBondContact O-N 3.49Å; V509-K512 PolarHBondContact O-N 3.13Å; K512-K520 WeakPolarHBondContact O-CE 3.37Å; K512-K520 PolarHBondContact O-NZ 2.87Å
513	D	79.1	Confident	82.1	Confident	82 Å²	82	65.4 Å²	65.4	44%	0.439	32%	0.316	S	S	.	.			trans	-135.8	145.7	177.9	62.5	37.2	0	0	0	112.2	W479 K515 K520	W479-D513 VanDerWaalsContact CH2-C 3.4Å; D513-K515 VanDerWaalsContact OD1-CG 3.3Å; D513-K515 WeakPolarHBondContact OD1-CG 3.37Å; D513-K520 HydrophobicContact CB-CD 4.11Å
514	D	74.7	Confident	81.8	Confident	32 Å²	32	65.3 Å²	65.3	17%	0.171	31%	0.31	C	S	.	.	B	Isolated β-bridge	trans	-92.5	97.1	168	176.4	15	0	0	0	108	Y471 W479 K516 N517 M518 G519	Y471-D514 HydrophobicContact CD1-CB 4.05Å; Y471-D514 HydrophobicContact CE1-CB 3.5Å; Y471-D514 VanDerWaalsContact CE1-CB 3.5Å; Y471-D514 WeakPolarHBondContact CE1-OD2 3.43Å; W479-D514 HydrophobicContact CH2-CB 4.15Å; D514-K516 PolarHBondContact O-N 3.44Å; D514-K516 VanDerWaalsContact OD1-CB 3.3Å; D514-K516 WeakPolarHBondContact OD1-CB 3.27Å; D514-K516 PolarHBondContact OD1-N 3.42Å; D514-N517 PolarHBondContact O-N 3.08Å; D514-N517 WeakPolarHBondContact OD2-CB 3.33Å; D514-N517 PolarHBondContact OD2-ND2 2.93Å; D514-M518 VanDerWaalsContact O-CA 3.31Å; D514-M518 WeakPolarHBondContact O-CA 3.27Å; D514-M518 PolarHBondContact O-N 3.48Å; D514-G519 PolarHBondContact N-O 2.95Å; D514-G519 PolarHBondContact O-N 3.21Å
515	K	74.3	Confident	81.6	Confident	174 Å²	174	64.4 Å²	64.4	76%	0.757	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.7	-20.9	178.6	-61.6	-175.2	-179.6	176.6	0	113.6	D513	D513-K515 VanDerWaalsContact OD1-CG 3.3Å; D513-K515 WeakPolarHBondContact OD1-CG 3.37Å
516	K	70.3	Confident	81.3	Confident	179 Å²	179	68 Å²	68	78%	0.778	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.8	-40.8	-178.8	-170.4	176.3	179.4	178	0	112.6	D514	D514-K516 PolarHBondContact O-N 3.44Å; D514-K516 VanDerWaalsContact OD1-CB 3.3Å; D514-K516 WeakPolarHBondContact OD1-CB 3.27Å; D514-K516 PolarHBondContact OD1-N 3.42Å
517	N	70.1	Confident	81.4	Confident	78 Å²	78	71.9 Å²	71.9	42%	0.417	35%	0.346	S	S	.	.	T	Hydrogen-bonded Turn	trans	-113.9	5.6	-175.8	-58.3	-57	0	0	0	113.4	Y424 D514 G519	Y424-N517 HydrophobicContact CD1-CB 4.39Å; Y424-N517 HydrophobicContact CE1-CB 4.27Å; D514-N517 PolarHBondContact O-N 3.08Å; D514-N517 WeakPolarHBondContact OD2-CB 3.33Å; D514-N517 PolarHBondContact OD2-ND2 2.93Å; N517-G519 PolarHBondContact O-N 2.86Å
518	M	71	Confident	81.3	Confident	153 Å²	153	68.6 Å²	68.6	75%	0.754	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	52	33.4	-171.2	-59.7	-65.7	170.7	0	0	112.1	D514	D514-M518 VanDerWaalsContact O-CA 3.31Å; D514-M518 WeakPolarHBondContact O-CA 3.27Å; D514-M518 PolarHBondContact O-N 3.48Å
519	G	72.3	Confident	81.4	Confident	0 Å²	0	66.4 Å²	66.4	0%	0	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	142.5	-173	0	0	0	0	0	111.6	Y471 D514 N517	Y471-G519 VanDerWaalsContact OH-CA 3.31Å; Y471-G519 WeakPolarHBondContact OH-CA 3.36Å; D514-G519 PolarHBondContact N-O 2.95Å; D514-G519 PolarHBondContact O-N 3.21Å; N517-G519 PolarHBondContact O-N 2.86Å
520	K	80.8	Confident	81.5	Confident	50 Å²	50	71.7 Å²	71.7	22%	0.217	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	164.8	172	-58.1	-65.6	-74.2	174.6	0	110.1	Q425 Y471 S510 N511 K512 D513	Q425-K520 HydrophobicContact CB-CB 4.41Å; Q425-K520 WeakPolarHBondContact CB-O 3.28Å; Q425-K520 HydrophobicContact CG-CB 4.5Å; Q425-K520 PolarHBondContact O-N 2.97Å; Q425-K520 VanDerWaalsContact O-N 3.14Å; Y471-K520 WeakPolarHBondContact CE2-O 3.4Å; S510-K520 WeakPolarHBondContact O-CE 3.45Å; S510-K520 PolarHBondContact O-NZ 3.48Å; N511-K520 PolarHBondContact O-NZ 2.82Å; K512-K520 WeakPolarHBondContact O-CE 3.37Å; K512-K520 PolarHBondContact O-NZ 2.87Å; D513-K520 HydrophobicContact CB-CD 4.11Å
521	Q	78.8	Confident	81.8	Confident	1 Å²	1	74.4 Å²	74.4	1%	0.005	36%	0.358	C	S	.	.			trans	-128.5	138	170.8	-174.4	175.2	-28.1	0	0	108.7	A463 Y471 W479 V509	A463-Q521 PolarHBondContact O-NE2 3.22Å; Y471-Q521 HydrophobicContact CD2-CB 3.92Å; Y471-Q521 HydrophobicContact CE2-CB 4.21Å; W479-Q521 HydrophobicContact CE3-CB 3.98Å; W479-Q521 HydrophobicContact CZ3-CB 4.15Å; V509-Q521 HydrophobicContact CG1-CB 3.74Å; V509-Q521 HydrophobicContact CG1-CG 3.71Å
522	M	88.7	Confident	82.4	Confident	67 Å²	67	74.6 Å²	74.6	33%	0.33	36%	0.355	S	S	.	.			trans	-132	104.4	177.3	-171.1	66.8	-161.1	0	0	108.7	T464 V465 N506	T464-M522 CarbonylContact C-O 3.51Å; T464-M522 VanDerWaalsContact CA-O 3.25Å; T464-M522 WeakPolarHBondContact CA-O 3.13Å; V465-M522 HydrophobicContact CG1-CB 4.22Å; V465-M522 HydrophobicContact CG1-CG 4.26Å; V465-M522 WeakPolarHBondContact CG1-O 3.35Å; V465-M522 PolarHBondContact N-O 3.41Å; N506-M522 HydrophobicContact CB-CE 3.79Å
523	P	86	Confident	83	Confident	2 Å²	2	71.7 Å²	71.7	1%	0.013	34%	0.342	C	S	.	.			trans	-65.5	157.5	172.8	-12.1	26.7	0	0	0	111.1	M462 A463 Y480 N506 V509	M462-P523 WeakPolarHBondContact O-CA 3.39Å; M462-P523 WeakPolarHBondContact O-CB 3.35Å; A463-P523 WeakPolarHBondContact O-CA 3.45Å; Y480-P523 HydrophobicContact CD2-CB 3.64Å; Y480-P523 HydrophobicContact CD2-CG 3.69Å; Y480-P523 HydrophobicContact CE2-CB 3.69Å; Y480-P523 HydrophobicContact CE2-CG 4.2Å; N506-P523 WeakPolarHBondContact OD1-CB 3.4Å; N506-P523 PolarHBondContact OD1-O 3.42Å; V509-P523 HydrophobicContact CB-CG 3.63Å; V509-P523 HydrophobicContact CG1-CG 3.67Å; V509-P523 HydrophobicContact CG2-CG 3.84Å
524	Q	85.6	Confident	83.8	Confident	89 Å²	89	69 Å²	69	42%	0.416	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	97.9	-177.4	-171.7	-176.9	-26.6	0	0	110.7	M462 V465	M462-Q524 WeakPolarHBondContact CB-O 3.44Å; M462-Q524 PolarHBondContact N-O 3.19Å; M462-Q524 PolarHBondContact O-N 2.91Å; V465-Q524 HydrophobicContact CG1-CB 4.07Å
525	P	87.6	Confident	84.7	Confident	36 Å²	36	67.7 Å²	67.7	23%	0.234	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	146.6	170.1	30.9	-33.9	0	0	0	111.2	L460 L502	L460-P525 CarbonylContact O-C 3.2Å; L460-P525 VanDerWaalsContact O-CA 3.31Å; L460-P525 WeakPolarHBondContact O-CA 3.27Å; L502-P525 HydrophobicContact CB-CB 4.46Å; L502-P525 HydrophobicContact CB-CG 4.27Å; L502-P525 HydrophobicContact CD1-CB 3.96Å
526	T	86.8	Confident	85.4	Confident	76 Å²	76	62.1 Å²	62.1	47%	0.466	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	138.9	169.7	-57.9	0	0	0	0	108.1	L460	L460-T526 PolarHBondContact N-O 2.97Å; L460-T526 PolarHBondContact O-N 3.48Å
527	F	91.6	Very high	85.5	Confident	109 Å²	109	55.3 Å²	55.3	48%	0.478	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	152.4	-174.7	64.3	-89.9	0	0	0	113.4	F458 L459 L499 L529	F458-F527 CarbonylContact O-C 3.58Å; F458-F527 VanDerWaalsContact O-CA 3.31Å; F458-F527 WeakPolarHBondContact O-CA 3.46Å; L459-F527 HydrophobicContact CD1-CB 3.81Å; L499-F527 HydrophobicContact CD1-CD1 4.27Å; L499-F527 HydrophobicContact CD1-CD2 4.24Å; L499-F527 HydrophobicContact CD1-CE1 3.98Å; L499-F527 HydrophobicContact CD1-CE2 3.94Å; L499-F527 HydrophobicContact CD1-CG 4.4Å; L499-F527 HydrophobicContact CD1-CZ 3.8Å; L499-F527 HydrophobicContact CD2-CB 4.45Å; L499-F527 HydrophobicContact CD2-CD1 3.68Å; L499-F527 HydrophobicContact CD2-CE1 4.04Å; L499-F527 HydrophobicContact CD2-CG 4.02Å; F527-L529 HydrophobicContact CB-CG 4.17Å; F527-L529 HydrophobicContact CD2-CB 4.2Å
528	T	86.4	Confident	85.2	Confident	66 Å²	66	59.1 Å²	59.1	41%	0.405	30%	0.298	S	S	.	.			trans	-124.4	24.6	167.3	61.2	0	0	0	0	110.3	E455 D457 F458	E455-T528 PolarHBondContact O-OG1 3.05Å; D457-T528 PolarHBondContact N-O 3.45Å; F458-T528 PolarHBondContact N-OG1 2.92Å; F458-T528 PolarHBondContact O-N 3.32Å
529	L	89.8	Confident	85.9	Confident	21 Å²	21	54.4 Å²	54.4	11%	0.11	28%	0.276	C	S	.	.			trans	-59.6	141.6	172.7	-62.9	-179.7	0	0	0	110.4	Y285 P411 F458 L459 I498 L499 F527 L533	Y285-L529 HydrophobicContact CE2-CB 4.21Å; Y285-L529 HydrophobicContact CE2-CD2 3.88Å; Y285-L529 HydrophobicContact CE2-CG 4.5Å; Y285-L529 WeakPolarHBondContact OH-CA 3.36Å; P411-L529 HydrophobicContact CB-CD2 4.31Å; F458-L529 PolarHBondContact O-N 3.18Å; L459-L529 HydrophobicContact CB-CD1 4.16Å; L459-L529 HydrophobicContact CB-CD2 4.31Å; L459-L529 HydrophobicContact CB-CG 4.26Å; L459-L529 HydrophobicContact CD2-CD1 4.35Å; I498-L529 HydrophobicContact CG2-CD1 4.16Å; L499-L529 HydrophobicContact CD2-CD1 4.42Å; F527-L529 HydrophobicContact CB-CG 4.17Å; F527-L529 HydrophobicContact CD2-CB 4.2Å; L529-L533 HydrophobicContact CD1-CB 4.12Å; L529-L533 HydrophobicContact CD1-CD2 4.32Å
530	R	88.8	Confident	86.6	Confident	112 Å²	112	57.3 Å²	57.3	42%	0.423	29%	0.29	S	S	.	.			trans	-113	-3.4	-176.9	-59.7	-178	-65.7	141	-2.6	113.2	Y285 D457	Y285-R530 PolarHBondContact OH-N 3.44Å; D457-R530 IonicContact OD1-CZ 3.88Å; D457-R530 IonicContact OD1-NE 2.88Å; D457-R530 PolarHBondContact OD1-NE 3.27Å; D457-R530 IonicContact OD1-NH2 3.29Å; D457-R530 PolarHBondContact OD1-NH2 3.07Å; D457-R530 VanDerWaalsContact OD1-NH2 3.13Å; D457-R530 IonicContact OD2-CZ 2.64Å; D457-R530 IonicContact OD2-NE 2.77Å; D457-R530 PolarHBondContact OD2-NE 3.23Å; D457-R530 IonicContact OD2-NH2 2.65Å; D457-R530 PolarHBondContact OD2-NH2 3Å
531	K	90.7	Very high	86.9	Confident	91 Å²	91	57.7 Å²	57.7	40%	0.396	29%	0.294	S	S	.	.	S	Bend	trans	-147.4	158.6	-175.7	-64.6	-172.2	-176	-178.4	0	108.8	K283 Y285 L533	K283-K531 HydrophobicContact CB-CD 4.29Å; K283-K531 HydrophobicContact CB-CG 3.97Å; K283-K531 CarbonylContact O-C 3.59Å; K283-K531 WeakPolarHBondContact O-CA 3.42Å; K283-K531 WeakPolarHBondContact O-CB 3.42Å; Y285-K531 HydrophobicContact CD1-CB 4.18Å; Y285-K531 HydrophobicContact CD1-CD 4.15Å; Y285-K531 HydrophobicContact CD2-CB 3.63Å; Y285-K531 WeakPolarHBondContact CD2-O 3.46Å; Y285-K531 HydrophobicContact CE1-CB 4.15Å; Y285-K531 HydrophobicContact CE1-CD 4.33Å; Y285-K531 HydrophobicContact CE1-CG 4.39Å; Y285-K531 HydrophobicContact CE2-CB 3.6Å; Y285-K531 WeakPolarHBondContact CE2-O 3.42Å; Y285-K531 HydrophobicContact CG-CB 3.93Å; Y285-K531 HydrophobicContact CG-CD 4.46Å; K531-L533 PolarHBondContact O-N 3.4Å
532	K	94.3	Very high	87.4	Confident	86 Å²	86	61 Å²	61	37%	0.374	31%	0.311	S	S	.	.	B	Isolated β-bridge	trans	-62	131.9	169.8	-75	-173.3	176.1	-177.1	0	109.5	D282 K283 V284 Y285 D497	D282-K532 HydrophobicContact CB-CD 4.07Å; D282-K532 WeakPolarHBondContact OD2-CE 3.24Å; D282-K532 IonicContact OD2-NZ 3.07Å; D282-K532 PolarHBondContact OD2-NZ 3.49Å; K283-K532 PolarHBondContact O-N 2.95Å; V284-K532 CarbonylContact C-O 3.44Å; V284-K532 WeakPolarHBondContact CA-O 3.15Å; V284-K532 WeakPolarHBondContact CG1-O 3.36Å; V284-K532 HydrophobicContact CG2-CB 4.22Å; Y285-K532 WeakPolarHBondContact CD2-O 3.47Å; Y285-K532 PolarHBondContact N-O 3.16Å; D497-K532 HydrophobicContact CB-CB 4.39Å
533	L	95.8	Very high	87.3	Confident	1 Å²	1	60.6 Å²	60.6	1%	0.005	31%	0.31	C	S	.	.			trans	-106.3	103.6	176.2	176.4	55.4	0	0	0	108.4	Y285 M287 P411 V413 D497 I498 L529 K531 F535	Y285-L533 HydrophobicContact CD2-CB 3.94Å; Y285-L533 HydrophobicContact CD2-CD1 4.25Å; Y285-L533 HydrophobicContact CE2-CB 4.45Å; M287-L533 HydrophobicContact CE-CD1 3.34Å; P411-L533 HydrophobicContact CB-CD1 3.94Å; P411-L533 HydrophobicContact CB-CD2 3.69Å; P411-L533 HydrophobicContact CB-CG 4.44Å; P411-L533 HydrophobicContact CG-CD1 3.73Å; P411-L533 HydrophobicContact CG-CD2 4.37Å; V413-L533 HydrophobicContact CG2-CD2 3.75Å; D497-L533 CarbonylContact C-O 3.49Å; D497-L533 WeakPolarHBondContact CA-O 3.48Å; I498-L533 HydrophobicContact CB-CB 4.45Å; I498-L533 HydrophobicContact CB-CG 4.38Å; I498-L533 HydrophobicContact CG2-CB 3.73Å; I498-L533 HydrophobicContact CG2-CD2 4.02Å; I498-L533 HydrophobicContact CG2-CG 4.03Å; I498-L533 PolarHBondContact N-O 3.13Å; L529-L533 HydrophobicContact CD1-CB 4.12Å; L529-L533 HydrophobicContact CD1-CD2 4.32Å; K531-L533 PolarHBondContact O-N 3.4Å; L533-F535 HydrophobicContact CD1-CD1 4.48Å; L533-F535 HydrophobicContact CD1-CE1 3.8Å; L533-F535 HydrophobicContact CD1-CZ 3.98Å; L533-F535 HydrophobicContact CD2-CE1 4.44Å; L533-F535 HydrophobicContact CD2-CE2 4.48Å; L533-F535 HydrophobicContact CD2-CZ 3.83Å; L533-F535 HydrophobicContact CG-CE1 4.19Å; L533-F535 HydrophobicContact CG-CE2 4.35Å; L533-F535 HydrophobicContact CG-CZ 3.86Å
534	V	95.1	Very high	87.4	Confident	27 Å²	27	64.5 Å²	64.5	16%	0.164	33%	0.33	C	S	.	.	B	Isolated β-bridge	trans	-111.1	146.3	175.3	-59.1	0	0	0	0	108.9	V284 M287 D497 P536	V284-V534 HydrophobicContact CG1-CG2 3.51Å; M287-V534 WeakPolarHBondContact CG-O 3.43Å; D497-V534 HydrophobicContact CB-CG1 3.95Å; V534-P536 HydrophobicContact CG2-CG 4.36Å; V534-P536 WeakPolarHBondContact O-CD 3.14Å
535	F	93.4	Very high	87.5	Confident	4 Å²	4	62.8 Å²	62.8	2%	0.018	32%	0.324	C	S	.	.			trans	-115.7	92.9	173.2	-59.4	-60.8	0	0	0	109	M287 L336 F338 I370 L488 C492 I498 L533 S537	M287-F535 HydrophobicContact CE-CD1 4.08Å; M287-F535 HydrophobicContact CE-CE1 3.82Å; M287-F535 HydrophobicContact CG-CD1 4.03Å; M287-F535 HydrophobicContact SD-CD1 3.96Å; M287-F535 HydrophobicContact SD-CE1 4.06Å; L336-F535 HydrophobicContact CD1-CB 4.14Å; L336-F535 HydrophobicContact CD1-CD2 4.42Å; L336-F535 HydrophobicContact CD1-CG 4.44Å; L336-F535 HydrophobicContact CD2-CB 4.03Å; F338-F535 HydrophobicContact CE2-CD1 4.03Å; F338-F535 HydrophobicContact CE2-CE1 4.13Å; F338-F535 HydrophobicContact CZ-CD1 4.05Å; F338-F535 AromaticContact CZ-CE1 3.74Å; F338-F535 HydrophobicContact CZ-CE1 3.74Å; I370-F535 HydrophobicContact CD1-CZ 4.35Å; L488-F535 HydrophobicContact CD2-CD2 4.44Å; C492-F535 WeakPolarHBondContact CB-O 3.44Å; I498-F535 HydrophobicContact CD1-CD2 4.49Å; I498-F535 HydrophobicContact CD1-CE2 3.97Å; I498-F535 HydrophobicContact CG1-CE2 4.3Å; L533-F535 HydrophobicContact CD1-CD1 4.48Å; L533-F535 HydrophobicContact CD1-CE1 3.8Å; L533-F535 HydrophobicContact CD1-CZ 3.98Å; L533-F535 HydrophobicContact CD2-CE1 4.44Å; L533-F535 HydrophobicContact CD2-CE2 4.48Å; L533-F535 HydrophobicContact CD2-CZ 3.83Å; L533-F535 HydrophobicContact CG-CE1 4.19Å; L533-F535 HydrophobicContact CG-CE2 4.35Å; L533-F535 HydrophobicContact CG-CZ 3.86Å; F535-S537 PolarHBondContact O-N 3.34Å
536	P	89	Confident	87.5	Confident	56 Å²	56	64.8 Å²	64.8	36%	0.364	33%	0.331	S	S	.	.			trans	-67.9	123.9	177.7	-16.7	30.8	0	0	0	109.9	V534	V534-P536 HydrophobicContact CG2-CG 4.36Å; V534-P536 WeakPolarHBondContact O-CD 3.14Å
537	S	74.1	Confident	87.6	Confident	36 Å²	36	63.9 Å²	63.9	25%	0.252	32%	0.319	S	S	.	.			trans	-78	134	158.2	65.3	0	0	0	0	107.7	P493 F535	P493-S537 WeakPolarHBondContact CA-OG 3.28Å; F535-S537 PolarHBondContact O-N 3.34Å
538	D	62.1	Low	87.2	Confident	158 Å²	158	59.8 Å²	59.8	85%	0.845	31%	0.305	S	S	*	.			trans	-48	0	-177.7	-76.8	-33.3	0	0	0	115.2	K290 H337	K290-D538 WeakPolarHBondContact CE-OD1 3.46Å; K290-D538 IonicContact NZ-OD1 3.73Å; K290-D538 PolarHBondContact NZ-OD1 3.49Å; K290-D538 IonicContact NZ-OD2 2.84Å; K290-D538 PolarHBondContact NZ-OD2 3.41Å; H337-D538 IonicContact CE1-OD2 3.44Å; H337-D538 PolarHBondContact CE1-OD2 2.98Å; H337-D538 VanDerWaalsContact CE1-OD2 3.25Å; H337-D538 IonicContact NE2-OD1 3.71Å; H337-D538 IonicContact NE2-OD2 3.22Å; H337-D538 PolarHBondContact NE2-OD2 2.82Å; H337-D538 VanDerWaalsContact NE2-OD2 3.07Å

Retrieved 538 of 538 residues in 185.7 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).