A0A087Y936_POEFO Loading...

PDZ binding kinase

AlphaFold DB , UniProt , Accession A0A087Y936, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 358 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	25.7	Very low	28.3	Very low	243 Å²	243	118 Å²	118	100%	1.197	77%	0.771	S	S	*	*				0	90.6	0	-80.9	174.7	164.3	0	0	106.7
2	C	22.9	Very low	28.4	Very low	134 Å²	134	123.8 Å²	123.8	91%	0.905	78%	0.775	S	S	*	*			trans	-76.2	136	177.6	-68.1	0	0	0	0	109
3	S	23.8	Very low	28.4	Very low	115 Å²	115	121.9 Å²	121.9	80%	0.804	78%	0.779	S	S	*	*			trans	-126.2	109.2	164	-68.1	0	0	0	0	107.2
4	A	26.4	Very low	28.1	Very low	101 Å²	101	127.3 Å²	127.3	84%	0.835	79%	0.785	S	S	*	*			trans	-59.5	128.6	173.6	0	0	0	0	0	110
5	V	25.8	Very low	27.9	Very low	119 Å²	119	125.6 Å²	125.6	72%	0.721	79%	0.789	S	S	*	*			trans	-115.4	89	161.1	-172	0	0	0	0	105.2	L7	V5-L7 HydrophobicContact CG1-CD1 4.13Å; V5-L7 HydrophobicContact CG1-CG 4.08Å; V5-L7 PolarHBondContact O-N 3.13Å
6	G	26.6	Very low	27.7	Very low	73 Å²	73	132.8 Å²	132.8	75%	0.753	80%	0.796	S	S	*	*			trans	-65.1	117.9	168	0	0	0	0	0	108.6
7	L	33.1	Very low	27.7	Very low	116 Å²	116	139.6 Å²	139.6	61%	0.607	81%	0.805	S	S	*	*			trans	-124.9	81.3	169.3	-76.4	170	0	0	0	107.2	V5	V5-L7 HydrophobicContact CG1-CD1 4.13Å; V5-L7 HydrophobicContact CG1-CG 4.08Å; V5-L7 PolarHBondContact O-N 3.13Å
8	D	30.9	Very low	27.7	Very low	150 Å²	150	142.9 Å²	142.9	80%	0.802	81%	0.808	S	S	*	*			trans	-70.9	132.2	172.3	-138.6	-20.1	0	0	0	109.3	G10	D8-G10 PolarHBondContact O-N 3.28Å
9	T	36.6	Very low	27.7	Very low	69 Å²	69	146.8 Å²	146.8	42%	0.423	82%	0.815	S	S	.	*			trans	-72.3	91.9	-173.9	47.5	0	0	0	0	109.9	C11	T9-C11 VanDerWaalsContact C-N 3.27Å; T9-C11 PolarHBondContact O-N 3.14Å
10	G	28.4	Very low	27.7	Very low	64 Å²	64	148.1 Å²	148.1	66%	0.66	82%	0.819	S	S	*	*			trans	-70.8	74.2	179.9	0	0	0	0	0	113.8	D8	D8-G10 PolarHBondContact O-N 3.28Å
11	C	31.2	Very low	27.7	Very low	114 Å²	114	152.7 Å²	152.7	77%	0.77	82%	0.824	S	S	*	*			trans	-115	51.8	157.2	-145.8	0	0	0	0	110.1	T9	T9-C11 VanDerWaalsContact C-N 3.27Å; T9-C11 PolarHBondContact O-N 3.14Å
12	F	29.2	Very low	27.6	Very low	188 Å²	188	150.5 Å²	150.5	83%	0.825	81%	0.814	S	S	*	*			trans	-114.8	104.2	169.2	-76.3	-80.3	0	0	0	109.4
13	A	28.8	Very low	27.9	Very low	99 Å²	99	148.9 Å²	148.9	82%	0.818	81%	0.81	S	S	*	*			trans	-144.2	97.2	163.1	0	0	0	0	0	110.5	A15	A13-A15 PolarHBondContact O-N 3.11Å
14	F	24.4	Very low	28	Very low	197 Å²	197	148.6 Å²	148.6	86%	0.864	81%	0.808	S	S	*	*			trans	-40.7	125.9	165	-91.4	-102.7	0	0	0	112.8	R16	F14-R16 PolarHBondContact O-N 3.3Å; F14-R16 VanDerWaalsContact O-N 3.11Å
15	A	25	Very low	28.1	Very low	102 Å²	102	152.1 Å²	152.1	84%	0.843	81%	0.811	S	S	*	*			trans	-63.8	106.4	168.4	0	0	0	0	0	110.6	A13	A13-A15 PolarHBondContact O-N 3.11Å
16	R	24.8	Very low	28.2	Very low	241 Å²	241	153.2 Å²	153.2	91%	0.909	81%	0.814	S	S	*	*			trans	-100.5	111.3	163	-82.6	-169.6	173.8	-163.9	-0.3	110.4	F14	F14-R16 PolarHBondContact O-N 3.3Å; F14-R16 VanDerWaalsContact O-N 3.11Å
17	R	28	Very low	28.3	Very low	249 Å²	249	157.4 Å²	157.4	94%	0.94	81%	0.813	S	S	*	*			trans	-47.3	130.8	171.2	-70.9	174.4	173.6	167.7	-2.6	112
18	K	27.3	Very low	28.1	Very low	198 Å²	198	158.4 Å²	158.4	86%	0.861	82%	0.819	S	S	*	*			trans	-125.8	114.7	154	-86.1	-172.9	177	179.7	0	109.7	L20	K18-L20 PolarHBondContact O-N 3.37Å
19	K	27.6	Very low	28	Very low	217 Å²	217	163.4 Å²	163.4	94%	0.943	83%	0.827	S	S	*	*	P	Polyproline II helix	trans	-60.6	122.4	167	-84.7	177.1	172.3	175.6	0	109.3
20	L	28.4	Very low	27.5	Very low	173 Å²	173	164 Å²	164	91%	0.906	84%	0.838	S	S	*	*	P	Polyproline II helix	trans	-91.7	123.4	166.2	-91.1	144.8	0	0	0	109.2	K18	K18-L20 PolarHBondContact O-N 3.37Å
21	R	26.1	Very low	27.3	Very low	244 Å²	244	169.8 Å²	169.8	92%	0.921	85%	0.846	S	S	*	*	P	Polyproline II helix	trans	-79.7	132.9	167.5	-91.9	179.9	168	178.5	-3.7	108.9
22	M	24.9	Very low	27.1	Very low	198 Å²	198	173.1 Å²	173.1	98%	0.975	85%	0.847	S	S	*	*	P	Polyproline II helix	trans	-68.7	139	168.1	-78.4	-169.6	166.1	0	0	111
23	A	28	Very low	27	Very low	100 Å²	100	170.7 Å²	170.7	83%	0.826	85%	0.848	S	S	*	*			trans	-126.8	124.7	161.8	0	0	0	0	0	108.4
24	S	27	Very low	27	Very low	109 Å²	109	171.7 Å²	171.7	76%	0.762	85%	0.846	S	S	*	*			trans	-76.2	146.5	174.9	61.7	0	0	0	0	111.3
25	L	29	Very low	27.3	Very low	174 Å²	174	170.2 Å²	170.2	91%	0.911	85%	0.845	S	S	*	*			trans	-128.4	123.1	160.4	-75.8	170.7	0	0	0	109.4
26	N	27.5	Very low	27.5	Very low	143 Å²	143	177.4 Å²	177.4	77%	0.765	85%	0.851	S	S	*	*			trans	-83.9	137.2	171	-95.9	4.3	0	0	0	111
27	E	28.3	Very low	27.7	Very low	160 Å²	160	169.1 Å²	169.1	75%	0.748	84%	0.84	S	S	*	*			trans	52.8	136.8	135.7	-72.3	-178.5	161.2	0	0	124.3
28	D	28	Very low	27.8	Very low	137 Å²	137	169.5 Å²	169.5	73%	0.733	84%	0.842	S	S	*	*			trans	77.7	107.4	141.4	-69.9	-10.6	0	0	0	121.5
29	R	28.6	Very low	27.9	Very low	256 Å²	256	166.8 Å²	166.8	97%	0.966	84%	0.842	S	S	*	*				-162.5	127.8	123.4	-100.3	159.2	-164.8	-151	5.1	111.4
30	A	27.5	Very low	28	Very low	80 Å²	80	167.5 Å²	167.5	66%	0.661	84%	0.838	S	S	*	*			trans	-89	166.8	-174.5	0	0	0	0	0	114.6
31	F	23.1	Very low	28.2	Very low	186 Å²	186	165.1 Å²	165.1	82%	0.816	84%	0.836	S	S	*	*			trans	79	138.4	159.9	-69.3	-67.9	0	0	0	117.5
32	K	26.7	Very low	28.4	Very low	185 Å²	185	158.8 Å²	158.8	80%	0.804	83%	0.83	S	S	*	*			cis	-159.4	154.5	15.8	-107	158	-166.6	-176.9	0	109.9
33	T	27.5	Very low	28.9	Very low	136 Å²	136	153.4 Å²	153.4	83%	0.834	82%	0.824	S	S	*	*	P	Polyproline II helix	trans	-72.8	130.6	174.8	-46.3	0	0	0	0	113.1
34	P	28.4	Very low	29.1	Very low	120 Å²	120	154.2 Å²	154.2	78%	0.779	82%	0.824	S	S	*	*	P	Polyproline II helix	trans	-90.2	137.3	166.2	-7.8	26.9	0	0	0	112.8
35	I	31.2	Very low	29.4	Very low	166 Å²	166	154.6 Å²	154.6	85%	0.851	83%	0.827	S	S	*	*	P	Polyproline II helix	trans	-58.3	143.6	-178	-67.2	156.5	0	0	0	112.8	G37	I35-G37 PolarHBondContact O-N 2.99Å; I35-G37 VanDerWaalsContact O-N 3.13Å
36	R	30.4	Very low	29.8	Very low	253 Å²	253	150 Å²	150	96%	0.955	82%	0.821	S	S	*	*			trans	-59.4	107.8	173.7	-80.3	179.4	172.6	176.5	-2.5	111.3
37	G	27.5	Very low	30.2	Very low	67 Å²	67	150.9 Å²	150.9	69%	0.691	83%	0.826	S	S	*	*			trans	-93.1	121.5	164.6	0	0	0	0	0	111	I35	I35-G37 PolarHBondContact O-N 2.99Å; I35-G37 VanDerWaalsContact O-N 3.13Å
38	R	31.5	Very low	30.5	Very low	257 Å²	257	147 Å²	147	97%	0.97	83%	0.829	S	S	*	*			trans	-65.8	124.7	174.6	-151.9	178.9	-169.6	-179.8	2.5	109.2
39	V	29.7	Very low	30.9	Very low	141 Å²	141	146.1 Å²	146.1	86%	0.855	83%	0.829	S	S	*	*			trans	-119.6	125.5	171.8	-177.6	0	0	0	0	110.2
40	R	28.3	Very low	31.8	Very low	232 Å²	232	139.5 Å²	139.5	88%	0.875	82%	0.819	S	S	*	*			trans	-63.7	144.6	178.1	-78.4	171.4	155.8	172.9	-7.7	111.5
41	S	32.8	Very low	33.3	Very low	124 Å²	124	139 Å²	139	87%	0.867	81%	0.805	S	S	*	*			trans	-67.2	122.7	166.2	55.7	0	0	0	0	110.9
42	S	31	Very low	35	Very low	111 Å²	111	135.1 Å²	135.1	78%	0.776	80%	0.796	S	S	*	*			trans	-128.7	119.7	158.5	56.3	0	0	0	0	108
43	G	36	Very low	36.8	Very low	84 Å²	84	127.3 Å²	127.3	87%	0.866	76%	0.763	S	S	*	*			trans	-61	144.5	173.7	0	0	0	0	0	111.4
44	S	30.7	Very low	38.4	Very low	118 Å²	118	123.2 Å²	123.2	83%	0.825	74%	0.738	S	S	*	*			trans	-143	118.3	168.9	175.6	0	0	0	0	108.5
45	S	32.9	Very low	39.8	Very low	117 Å²	117	120.2 Å²	120.2	82%	0.818	72%	0.724	S	S	*	*			trans	-51.8	148.6	171.3	-50.6	0	0	0	0	112.1	N47	S45-N47 PolarHBondContact O-N 2.9Å
46	G	39	Very low	41.1	Very low	77 Å²	77	114.1 Å²	114.1	79%	0.794	70%	0.696	S	S	*	*			trans	-59	118	-175.6	0	0	0	0	0	113.7
47	N	34	Very low	42.4	Very low	162 Å²	162	107.6 Å²	107.6	87%	0.866	69%	0.686	S	S	*	*			trans	-149.8	105.7	144.1	-96.7	-18.8	0	0	0	106.1	S45 T49	S45-N47 PolarHBondContact O-N 2.9Å; N47-T49 PolarHBondContact O-N 3.17Å
48	G	35.5	Very low	44	Very low	78 Å²	78	112.9 Å²	112.9	80%	0.804	69%	0.691	S	S	*	*	P	Polyproline II helix	trans	-62	124.5	-178.2	0	0	0	0	0	110.6
49	T	36.7	Very low	46	Very low	119 Å²	119	101.5 Å²	101.5	73%	0.73	65%	0.649	S	S	*	*	P	Polyproline II helix	trans	-52.8	133.3	172.8	-42.6	0	0	0	0	109.6	N47 I51	N47-T49 PolarHBondContact O-N 3.17Å; T49-I51 PolarHBondContact O-N 2.79Å; T49-I51 VanDerWaalsContact O-N 3.11Å
50	P	46.7	Very low	48.3	Very low	117 Å²	117	101.5 Å²	101.5	76%	0.76	64%	0.637	S	S	*	*	P	Polyproline II helix	trans	-56.7	118.5	177.9	-22.6	31.5	0	0	0	110.7
51	I	60.7	Low	50.7	Low	70 Å²	70	95.5 Å²	95.5	36%	0.359	62%	0.618	S	S	.	*	P	Polyproline II helix	trans	-86.8	122.2	178.6	-63	177.6	0	0	0	108.4	T49 W84	T49-I51 PolarHBondContact O-N 2.79Å; T49-I51 VanDerWaalsContact O-N 3.11Å; I51-W84 HydrophobicContact CD1-CH2 3.4Å; I51-W84 VanDerWaalsContact CD1-CH2 3.4Å; I51-W84 HydrophobicContact CD1-CZ2 4.44Å; I51-W84 HydrophobicContact CD1-CZ3 3.91Å; I51-W84 HydrophobicContact CG2-CZ3 4.04Å
52	T	58.6	Low	52.8	Low	104 Å²	104	92.7 Å²	92.7	64%	0.638	59%	0.592	S	S	*	*	P	Polyproline II helix	trans	-92.9	117.3	173.4	-57.4	0	0	0	0	109.5
53	I	63.1	Low	54.8	Low	20 Å²	20	88.8 Å²	88.8	10%	0.103	57%	0.57	C	S	.	*	P	Polyproline II helix	trans	-81.9	125.3	174.1	-58.8	176.1	0	0	0	108.3	M73 V86 A127 C135 A137	I53-M73 HydrophobicContact CG2-SD 4.19Å; I53-V86 HydrophobicContact CD1-CG1 4.11Å; I53-V86 HydrophobicContact CG2-CG1 4.04Å; I53-A127 HydrophobicContact CD1-CB 4.3Å; I53-C135 HydrophobicContact CD1-CB 3.68Å; I53-A137 HydrophobicContact CD1-CB 4.38Å
54	P	61.9	Low	56.3	Low	50 Å²	50	89 Å²	89	33%	0.325	56%	0.557	S	S	.	*	P	Polyproline II helix	trans	-68.4	169.4	-178.7	29.5	-35	0	0	0	112.4	M59 M73 K88	P54-M59 HydrophobicContact CG-SD 4.5Å; P54-M73 HydrophobicContact CG-CE 4Å; P54-M73 HydrophobicContact CG-SD 4.33Å; P54-K88 PolarHBondContact O-NZ 3.03Å
55	A	57.7	Low	57.8	Low	58 Å²	58	85.4 Å²	85.4	48%	0.479	54%	0.539	S	S	.	.	P	Polyproline II helix	trans	-65.4	144.6	176.7	0	0	0	0	0	111.4	P57 F58	A55-P57 VanDerWaalsContact C-N 3.34Å; A55-P57 WeakPolarHBondContact O-CD 3.33Å; A55-F58 HydrophobicContact CB-CD2 4.42Å; A55-F58 PolarHBondContact O-N 2.92Å
56	S	59	Low	59.3	Low	38 Å²	38	83.9 Å²	83.9	27%	0.266	52%	0.524	S	S	.	.	G	3₁₀ helix	trans	-48.9	-37.3	-177.3	179.4	0	0	0	0	115.9	F58 M59 Y71	S56-F58 PolarHBondContact O-N 2.76Å; S56-M59 PolarHBondContact O-N 2.92Å; S56-Y71 WeakPolarHBondContact OG-CE1 3.47Å; S56-Y71 PolarHBondContact OG-OH 2.86Å
57	P	57.8	Low	60.7	Low	115 Å²	115	80.8 Å²	80.8	75%	0.747	49%	0.493	S	S	*	.	G	3₁₀ helix	trans	-60.6	-18.8	-178.6	-26.2	36	0	0	0	115.6	A55	A55-P57 VanDerWaalsContact C-N 3.34Å; A55-P57 WeakPolarHBondContact O-CD 3.33Å
58	F	60	Low	62.8	Low	178 Å²	178	74 Å²	74	78%	0.781	46%	0.457	S	S	*	.	G	3₁₀ helix	trans	-94.2	5.5	178.7	-60.6	-80.1	0	0	0	113.1	A55 S56	A55-F58 HydrophobicContact CB-CD2 4.42Å; A55-F58 PolarHBondContact O-N 2.92Å; S56-F58 PolarHBondContact O-N 2.76Å
59	M	73.1	Confident	65.2	Low	18 Å²	18	70.5 Å²	70.5	9%	0.089	42%	0.42	C	S	.	.	S	Bend	trans	-117.7	140.3	-175.6	-59.7	167.2	70.6	0	0	110.4	P54 S56 K61 Y71 L72 M73 V86	P54-M59 HydrophobicContact CG-SD 4.5Å; S56-M59 PolarHBondContact O-N 2.92Å; M59-K61 PolarHBondContact O-N 2.8Å; M59-Y71 HydrophobicContact CB-CD1 4.23Å; M59-Y71 HydrophobicContact CB-CG 4.36Å; M59-Y71 VanDerWaalsContact CE-CB 3.41Å; M59-Y71 HydrophobicContact CE-CG 4.33Å; M59-L72 WeakPolarHBondContact CB-O 3.4Å; M59-M73 HydrophobicContact CE-CB 3.85Å; M59-V86 HydrophobicContact CE-CB 3.56Å; M59-V86 HydrophobicContact CE-CG1 4.13Å; M59-V86 HydrophobicContact CE-CG2 3.72Å
60	K	78.1	Confident	67.6	Low	142 Å²	142	66.6 Å²	66.6	62%	0.617	40%	0.396	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76.8	122.3	175.5	179.2	-174	177.5	-170.6	0	108.8	L62 Y71 L72	K60-L62 PolarHBondContact O-N 2.79Å; K60-Y71 CarbonylContact O-C 3.51Å; K60-Y71 WeakPolarHBondContact O-CA 3.13Å; K60-L72 HydrophobicContact CB-CB 4.21Å; K60-L72 HydrophobicContact CD-CD2 4.49Å; K60-L72 PolarHBondContact N-O 2.94Å; K60-L72 PolarHBondContact O-N 2.61Å
61	K	79.6	Confident	69.5	Low	106 Å²	106	62.7 Å²	62.7	46%	0.461	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.1	129	175	-165.6	-177.9	-178.7	-164.7	0	109.5	M59 G63 Y71	M59-K61 PolarHBondContact O-N 2.8Å; K61-G63 WeakPolarHBondContact CE-O 3.21Å; K61-Y71 HydrophobicContact CB-CD1 4.04Å; K61-Y71 HydrophobicContact CB-CE1 4.06Å; K61-Y71 HydrophobicContact CG-CD1 4.24Å; K61-Y71 HydrophobicContact CG-CE1 4.02Å
62	L	77.6	Confident	70.8	Confident	64 Å²	64	60.1 Å²	60.1	34%	0.335	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	-38	177	-66.4	176.6	0	0	0	111.4	K60 V70 L72 A85 Y140	K60-L62 PolarHBondContact O-N 2.79Å; L62-V70 HydrophobicContact CB-CG1 4.29Å; L62-V70 HydrophobicContact CD1-CG1 4.28Å; L62-V70 PolarHBondContact N-O 3.25Å; L62-L72 HydrophobicContact CD1-CB 3.93Å; L62-L72 HydrophobicContact CD1-CD1 4.45Å; L62-L72 HydrophobicContact CD2-CB 3.98Å; L62-L72 HydrophobicContact CG-CB 3.9Å; L62-A85 HydrophobicContact CD1-CB 4.33Å; L62-Y140 HydrophobicContact CD1-CD2 4.18Å; L62-Y140 HydrophobicContact CD1-CE2 3.87Å; L62-Y140 HydrophobicContact CD2-CE2 4.35Å
63	G	72.3	Confident	72	Confident	29 Å²	29	56.2 Å²	56.2	30%	0.299	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-164.9	170.4	-179.6	0	0	0	0	0	112.8	K61 V70	K61-G63 WeakPolarHBondContact CE-O 3.21Å; G63-V70 PolarHBondContact N-O 2.68Å; G63-V70 PolarHBondContact O-N 2.95Å
64	C	66.9	Low	72.9	Confident	90 Å²	90	60.8 Å²	60.8	61%	0.608	35%	0.353	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-132.2	137.6	167.9	42.8	0	0	0	0	110.5
65	G	61.8	Low	73.6	Confident	42 Å²	42	61.4 Å²	61.4	43%	0.433	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	-179.8	165.8	0	0	0	0	0	110.1	G67 V68	G65-G67 PolarHBondContact O-N 3.01Å; G65-G67 VanDerWaalsContact O-N 3.11Å; G65-V68 PolarHBondContact N-O 3.02Å; G65-V68 PolarHBondContact O-N 3.23Å
66	T	64.4	Low	73.7	Confident	84 Å²	84	65.6 Å²	65.6	52%	0.515	37%	0.368	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.5	115	176.8	-44.1	0	0	0	0	109.6	V68 Y101	T66-V68 PolarHBondContact O-N 3.13Å; T66-V68 VanDerWaalsContact O-N 3.15Å; T66-Y101 WeakPolarHBondContact CG2-OH 3.47Å; T66-Y101 WeakPolarHBondContact O-CE1 2.98Å
67	G	68.9	Low	73.7	Confident	13 Å²	13	65.9 Å²	65.9	13%	0.134	38%	0.377	C	S	.	.	T	Hydrogen-bonded Turn	trans	75.3	-8.1	179.1	0	0	0	0	0	116.6	G65 I89 N90	G65-G67 PolarHBondContact O-N 3.01Å; G65-G67 VanDerWaalsContact O-N 3.11Å; G67-I89 WeakPolarHBondContact O-CA 3.38Å; G67-N90 PolarHBondContact O-N 3.47Å
68	V	78.4	Confident	73.4	Confident	20 Å²	20	70.8 Å²	70.8	12%	0.121	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	158.1	-178.4	-65.6	0	0	0	0	112.8	G65 T66 K87 K88 I89	G65-V68 PolarHBondContact N-O 3.02Å; G65-V68 PolarHBondContact O-N 3.23Å; T66-V68 PolarHBondContact O-N 3.13Å; T66-V68 VanDerWaalsContact O-N 3.15Å; V68-K87 HydrophobicContact CB-CG 4.3Å; V68-K88 CarbonylContact C-O 3.57Å; V68-K88 VanDerWaalsContact CA-O 3.28Å; V68-K88 WeakPolarHBondContact CA-O 3.42Å; V68-I89 HydrophobicContact CG1-CG1 4.4Å
69	S	85.1	Confident	72.9	Confident	3 Å²	3	69.9 Å²	69.9	2%	0.021	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	141.2	175.1	-71	0	0	0	0	110.3	Y71 K87 K88	S69-Y71 VanDerWaalsContact CB-CE2 3.43Å; S69-K87 WeakPolarHBondContact O-CA 3.42Å; S69-K88 PolarHBondContact N-O 3.28Å; S69-K88 PolarHBondContact O-N 3.31Å
70	V	87.2	Confident	71.9	Confident	37 Å²	37	74 Å²	74	22%	0.224	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	133.6	-179.7	-174.6	0	0	0	0	108.8	L62 G63 A85 V86 K87	L62-V70 HydrophobicContact CB-CG1 4.29Å; L62-V70 HydrophobicContact CD1-CG1 4.28Å; L62-V70 PolarHBondContact N-O 3.25Å; G63-V70 PolarHBondContact N-O 2.68Å; G63-V70 PolarHBondContact O-N 2.95Å; V70-A85 HydrophobicContact CG1-CB 4.19Å; V70-V86 WeakPolarHBondContact CA-O 3.32Å; V70-K87 HydrophobicContact CG2-CB 4.32Å; V70-K87 HydrophobicContact CG2-CG 4.06Å
71	Y	87.3	Confident	71.3	Confident	36 Å²	36	71.5 Å²	71.5	14%	0.141	41%	0.412	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	140.1	-175	-61.2	-90.2	0	0	0	111	S56 M59 K60 K61 S69 A85 V86 K88	S56-Y71 WeakPolarHBondContact OG-CE1 3.47Å; S56-Y71 PolarHBondContact OG-OH 2.86Å; M59-Y71 HydrophobicContact CB-CD1 4.23Å; M59-Y71 HydrophobicContact CB-CG 4.36Å; M59-Y71 VanDerWaalsContact CE-CB 3.41Å; M59-Y71 HydrophobicContact CE-CG 4.33Å; K60-Y71 CarbonylContact O-C 3.51Å; K60-Y71 WeakPolarHBondContact O-CA 3.13Å; K61-Y71 HydrophobicContact CB-CD1 4.04Å; K61-Y71 HydrophobicContact CB-CE1 4.06Å; K61-Y71 HydrophobicContact CG-CD1 4.24Å; K61-Y71 HydrophobicContact CG-CE1 4.02Å; S69-Y71 VanDerWaalsContact CB-CE2 3.43Å; Y71-A85 CarbonylContact O-C 3.55Å; Y71-A85 WeakPolarHBondContact O-CA 3.39Å; Y71-V86 PolarHBondContact N-O 2.79Å; Y71-V86 PolarHBondContact O-N 3.12Å; Y71-K88 HydrophobicContact CD2-CG 4.4Å; Y71-K88 HydrophobicContact CE2-CB 4.3Å
72	L	87.7	Confident	71.2	Confident	16 Å²	16	68.9 Å²	68.9	8%	0.084	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	126.8	169	-174.6	60.7	0	0	0	110	M59 K60 L62 P83 Y140	M59-L72 WeakPolarHBondContact CB-O 3.4Å; K60-L72 HydrophobicContact CB-CB 4.21Å; K60-L72 HydrophobicContact CD-CD2 4.49Å; K60-L72 PolarHBondContact N-O 2.94Å; K60-L72 PolarHBondContact O-N 2.61Å; L62-L72 HydrophobicContact CD1-CB 3.93Å; L62-L72 HydrophobicContact CD1-CD1 4.45Å; L62-L72 HydrophobicContact CD2-CB 3.98Å; L62-L72 HydrophobicContact CG-CB 3.9Å; L72-P83 HydrophobicContact CD1-CB 3.82Å; L72-Y140 HydrophobicContact CD1-CD1 4.32Å; L72-Y140 HydrophobicContact CD1-CD2 3.48Å; L72-Y140 VanDerWaalsContact CD1-CD2 3.48Å; L72-Y140 HydrophobicContact CD1-CE1 4.35Å; L72-Y140 HydrophobicContact CD1-CE2 3.55Å; L72-Y140 HydrophobicContact CD1-CG 3.86Å
73	M	85.1	Confident	71.6	Confident	21 Å²	21	68 Å²	68	10%	0.103	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	105.2	172.7	-177.4	178	170.1	0	0	109.7	I53 P54 M59 R75 P83 W84 V86	I53-M73 HydrophobicContact CG2-SD 4.19Å; P54-M73 HydrophobicContact CG-CE 4Å; P54-M73 HydrophobicContact CG-SD 4.33Å; M59-M73 HydrophobicContact CE-CB 3.85Å; M73-R75 HydrophobicContact CE-CG 4.45Å; M73-R75 PolarHBondContact O-N 3.12Å; M73-P83 WeakPolarHBondContact O-CA 3.48Å; M73-W84 HydrophobicContact CB-CB 4.47Å; M73-W84 PolarHBondContact N-O 3.02Å; M73-W84 PolarHBondContact O-N 2.97Å; M73-V86 HydrophobicContact CB-CG2 3.92Å; M73-V86 HydrophobicContact SD-CG2 4.3Å
74	D	80.9	Confident	72.5	Confident	116 Å²	116	67.2 Å²	67.2	62%	0.62	39%	0.393	S	S	*	.			trans	-71.5	120.5	170.2	-66.9	-42.6	0	0	0	109.7
75	R	77.4	Confident	73.7	Confident	63 Å²	63	63.4 Å²	63.4	24%	0.238	37%	0.368	C	S	.	.			trans	-94.1	104.7	179.4	-71.2	-165.2	55.3	-177.1	-7.2	110	M73 S81 W84	M73-R75 HydrophobicContact CE-CG 4.45Å; M73-R75 PolarHBondContact O-N 3.12Å; R75-S81 WeakPolarHBondContact O-CA 3.45Å; R75-W84 VanDerWaalsContact NH1-CE2 3.32Å
76	V	60.2	Low	75	Confident	147 Å²	147	61.4 Å²	61.4	89%	0.891	35%	0.347	S	S	*	.			trans	-95.5	118.7	173.8	-170.2	0	0	0	0	109.5
77	G	57.9	Low	76.3	Confident	44 Å²	44	58 Å²	58	45%	0.454	33%	0.325	S	S	.	.	S	Bend	trans	174.7	158.8	178.6	0	0	0	0	0	114.6	L79	G77-L79 VanDerWaalsContact C-N 3.28Å; G77-L79 PolarHBondContact O-N 2.96Å; G77-L79 VanDerWaalsContact O-N 3.14Å
78	K	50.7	Low	77.2	Confident	217 Å²	217	58.2 Å²	58.2	94%	0.943	32%	0.322	S	S	*	.	S	Bend	trans	-68	-6.6	-167.8	-79.4	-175.9	177.4	178.1	0	117
79	L	49.5	Very low	77.4	Confident	160 Å²	160	58.3 Å²	58.3	84%	0.838	32%	0.322	S	S	*	.	S	Bend	trans	-137.2	-13.3	-174.2	-136.9	79.8	0	0	0	116.5	G77	G77-L79 VanDerWaalsContact C-N 3.28Å; G77-L79 PolarHBondContact O-N 2.96Å; G77-L79 VanDerWaalsContact O-N 3.14Å
80	N	53.2	Low	77	Confident	104 Å²	104	60.7 Å²	60.7	56%	0.556	34%	0.335	S	S	*	.			trans	-157.8	95	179	-84.9	-36.9	0	0	0	110.8
81	S	65.6	Low	76.1	Confident	89 Å²	89	64.7 Å²	64.7	62%	0.622	36%	0.364	S	S	*	.			trans	-94.3	7.1	-172.5	-33.8	0	0	0	0	114.1	R75	R75-S81 WeakPolarHBondContact O-CA 3.45Å
82	S	77.5	Confident	75.3	Confident	52 Å²	52	71.9 Å²	71.9	36%	0.364	40%	0.396	S	S	.	.			trans	-70.1	128.1	-175	64.2	0	0	0	0	110.7
83	P	86.3	Confident	74.3	Confident	45 Å²	45	72 Å²	72	29%	0.292	40%	0.398	S	S	.	.			trans	-65.6	149.6	174.6	29	-35.1	0	0	0	110.9	L72 M73 Y140	L72-P83 HydrophobicContact CD1-CB 3.82Å; M73-P83 WeakPolarHBondContact O-CA 3.48Å; P83-Y140 HydrophobicContact CB-CD1 4.35Å; P83-Y140 HydrophobicContact CB-CG 4.46Å; P83-Y140 HydrophobicContact CG-CD1 3.74Å; P83-Y140 HydrophobicContact CG-CE1 4.46Å; P83-Y140 HydrophobicContact CG-CG 4.23Å; P83-Y140 WeakPolarHBondContact O-CB 3.37Å
84	W	90.4	Very high	73.4	Confident	13 Å²	13	73.7 Å²	73.7	5%	0.049	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	145.9	179.1	-69.1	-5.5	0	0	0	111	I51 M73 R75 R124 A125 A137	I51-W84 HydrophobicContact CD1-CH2 3.4Å; I51-W84 VanDerWaalsContact CD1-CH2 3.4Å; I51-W84 HydrophobicContact CD1-CZ2 4.44Å; I51-W84 HydrophobicContact CD1-CZ3 3.91Å; I51-W84 HydrophobicContact CG2-CZ3 4.04Å; M73-W84 HydrophobicContact CB-CB 4.47Å; M73-W84 PolarHBondContact N-O 3.02Å; M73-W84 PolarHBondContact O-N 2.97Å; R75-W84 VanDerWaalsContact NH1-CE2 3.32Å; W84-R124 HydrophobicContact CD2-CB 4.15Å; W84-R124 HydrophobicContact CD2-CG 4.29Å; W84-R124 HydrophobicContact CE3-CB 4.39Å; W84-R124 HydrophobicContact CG-CG 4.41Å; W84-R124 HydrophobicContact CH2-CB 3.99Å; W84-R124 HydrophobicContact CZ2-CB 3.78Å; W84-R124 HydrophobicContact CZ2-CG 4.16Å; W84-R124 HydrophobicContact CZ3-CB 4.32Å; W84-A125 HydrophobicContact CH2-CB 4.49Å; W84-A125 HydrophobicContact CZ3-CB 4.33Å; W84-A137 HydrophobicContact CE3-CB 3.74Å; W84-A137 HydrophobicContact CZ3-CB 4.04Å
85	A	91.4	Very high	72.9	Confident	9 Å²	9	73.3 Å²	73.3	7%	0.074	42%	0.422	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	131.7	164.6	0	0	0	0	0	108.6	L62 V70 Y71 A137 M138	L62-A85 HydrophobicContact CD1-CB 4.33Å; V70-A85 HydrophobicContact CG1-CB 4.19Å; Y71-A85 CarbonylContact O-C 3.55Å; Y71-A85 WeakPolarHBondContact O-CA 3.39Å; A85-A137 CarbonylContact O-C 3.54Å; A85-A137 WeakPolarHBondContact O-CA 3.4Å; A85-M138 HydrophobicContact CB-CB 4.39Å; A85-M138 PolarHBondContact N-O 2.94Å; A85-M138 VanDerWaalsContact N-O 3.08Å; A85-M138 PolarHBondContact O-N 3.22Å
86	V	90.3	Very high	72.4	Confident	0 Å²	0	79.7 Å²	79.7	0%	0	45%	0.451	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	114.4	-177.4	-176.8	0	0	0	0	109.3	I53 M59 V70 Y71 M73 K88 C135 L136 A137	I53-V86 HydrophobicContact CD1-CG1 4.11Å; I53-V86 HydrophobicContact CG2-CG1 4.04Å; M59-V86 HydrophobicContact CE-CB 3.56Å; M59-V86 HydrophobicContact CE-CG1 4.13Å; M59-V86 HydrophobicContact CE-CG2 3.72Å; V70-V86 WeakPolarHBondContact CA-O 3.32Å; Y71-V86 PolarHBondContact N-O 2.79Å; Y71-V86 PolarHBondContact O-N 3.12Å; M73-V86 HydrophobicContact CB-CG2 3.92Å; M73-V86 HydrophobicContact SD-CG2 4.3Å; V86-K88 HydrophobicContact CG1-CD 4.4Å; V86-K88 HydrophobicContact CG1-CG 3.87Å; V86-C135 HydrophobicContact CG1-CB 4.35Å; V86-L136 CarbonylContact C-O 3.5Å; V86-L136 VanDerWaalsContact CA-O 3.3Å; V86-L136 WeakPolarHBondContact CA-O 3.41Å; V86-A137 HydrophobicContact CG2-CB 4.22Å
87	K	90.4	Very high	73.2	Confident	12 Å²	12	77.4 Å²	77.4	5%	0.052	43%	0.431	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	123.9	174.3	-163.7	171.1	-171.5	-179.6	0	108.8	V68 S69 V70 L105 E108 L136 D209	V68-K87 HydrophobicContact CB-CG 4.3Å; S69-K87 WeakPolarHBondContact O-CA 3.42Å; V70-K87 HydrophobicContact CG2-CB 4.32Å; V70-K87 HydrophobicContact CG2-CG 4.06Å; K87-L105 HydrophobicContact CB-CD1 4.13Å; K87-L105 HydrophobicContact CD-CD1 3.83Å; K87-L105 HydrophobicContact CG-CD1 3.82Å; K87-E108 WeakPolarHBondContact CE-OE2 3.16Å; K87-E108 IonicContact NZ-OE1 2.72Å; K87-E108 PolarHBondContact NZ-OE1 3.04Å; K87-E108 IonicContact NZ-OE2 3Å; K87-E108 PolarHBondContact NZ-OE2 3.1Å; K87-L136 HydrophobicContact CB-CB 4.36Å; K87-L136 PolarHBondContact N-O 2.75Å; K87-L136 PolarHBondContact O-N 3.3Å; K87-D209 IonicContact NZ-OD1 2.68Å; K87-D209 PolarHBondContact NZ-OD1 2.89Å; K87-D209 IonicContact NZ-OD2 2.83Å
88	K	88.1	Confident	74.2	Confident	19 Å²	19	77.1 Å²	77.1	8%	0.083	42%	0.42	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	149.6	-179.5	-59	-166.2	175.4	-179.1	0	110.4	P54 V68 S69 Y71 V86 C135	P54-K88 PolarHBondContact O-NZ 3.03Å; V68-K88 CarbonylContact C-O 3.57Å; V68-K88 VanDerWaalsContact CA-O 3.28Å; V68-K88 WeakPolarHBondContact CA-O 3.42Å; S69-K88 PolarHBondContact N-O 3.28Å; S69-K88 PolarHBondContact O-N 3.31Å; Y71-K88 HydrophobicContact CD2-CG 4.4Å; Y71-K88 HydrophobicContact CE2-CB 4.3Å; V86-K88 HydrophobicContact CG1-CD 4.4Å; V86-K88 HydrophobicContact CG1-CG 3.87Å; K88-C135 VanDerWaalsContact CE-SG 3.55Å; K88-C135 HydrophobicContact CG-CB 4.33Å
89	I	82.3	Confident	75.7	Confident	21 Å²	21	74 Å²	74	11%	0.108	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.8	137.3	173	-58.3	173.4	0	0	0	109.1	G67 V68 S91 C93 Q102 L105	G67-I89 WeakPolarHBondContact O-CA 3.38Å; V68-I89 HydrophobicContact CG1-CG1 4.4Å; I89-S91 PolarHBondContact O-N 3.08Å; I89-C93 HydrophobicContact CG2-CB 4.33Å; I89-Q102 HydrophobicContact CD1-CB 4.03Å; I89-Q102 HydrophobicContact CD1-CG 3.18Å; I89-L105 HydrophobicContact CG1-CD2 4.37Å
90	N	76.6	Confident	77.3	Confident	54 Å²	54	69.6 Å²	69.6	29%	0.289	39%	0.389	S	S	.	.			trans	-67	128.1	178.5	-173.1	-16.4	0	0	0	109.8	G67 K92 C93	G67-N90 PolarHBondContact O-N 3.47Å; N90-K92 PolarHBondContact O-N 2.75Å; N90-K92 VanDerWaalsContact O-N 3.09Å; N90-K92 PolarHBondContact OD1-N 2.79Å; N90-C93 WeakPolarHBondContact O-CB 3.32Å; N90-C93 PolarHBondContact O-N 2.62Å
91	S	69.9	Low	78.7	Confident	121 Å²	121	65.7 Å²	65.7	85%	0.846	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.1	-16.5	178.8	63.6	0	0	0	0	113.7	I89	I89-S91 PolarHBondContact O-N 3.08Å
92	K	69.3	Low	79.7	Confident	186 Å²	186	64.2 Å²	64.2	81%	0.809	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.1	-1	175.4	-61.5	-175.9	178.4	-176.9	0	113.6	N90	N90-K92 PolarHBondContact O-N 2.75Å; N90-K92 VanDerWaalsContact O-N 3.09Å; N90-K92 PolarHBondContact OD1-N 2.79Å
93	C	67.1	Low	80.1	Confident	19 Å²	19	67.4 Å²	67.4	13%	0.128	36%	0.36	C	S	.	.	S	Bend	trans	-65.5	135.1	178.7	-168.5	0	0	0	0	110.2	I89 N90 Q97 V98 Y101	I89-C93 HydrophobicContact CG2-CB 4.33Å; N90-C93 WeakPolarHBondContact O-CB 3.32Å; N90-C93 PolarHBondContact O-N 2.62Å; C93-Q97 VanDerWaalsContact SG-CB 3.59Å; C93-V98 HydrophobicContact CB-CG2 4.06Å; C93-Y101 WeakPolarHBondContact SG-CD2 3.49Å; C93-Y101 WeakPolarHBondContact SG-CE2 3.48Å
94	A	67.2	Low	80.1	Confident	57 Å²	57	70.9 Å²	70.9	47%	0.471	37%	0.367	S	S	.	.			trans	-60.3	139	178.5	0	0	0	0	0	110.2	K96 Q97 V98	A94-K96 PolarHBondContact O-N 2.98Å; A94-Q97 PolarHBondContact O-N 3.41Å; A94-V98 PolarHBondContact O-N 3.03Å
95	S	69.4	Low	80	Confident	107 Å²	107	70.4 Å²	70.4	75%	0.748	37%	0.366	S	S	*	.	H	α-helix	trans	-52.5	-34	-171.9	-40	0	0	0	0	114	Q97 V98	S95-Q97 VanDerWaalsContact C-N 3.34Å; S95-Q97 PolarHBondContact O-N 3.12Å; S95-V98 PolarHBondContact O-N 2.83Å
96	K	67.3	Low	80	Confident	197 Å²	197	73.1 Å²	73.1	86%	0.857	38%	0.379	S	S	*	.	H	α-helix	trans	-70.2	-24.8	177.6	-65.1	-175.6	179.4	-177.8	0	114.2	A94	A94-K96 PolarHBondContact O-N 2.98Å
97	Q	77.1	Confident	80	Confident	100 Å²	100	77.9 Å²	77.9	47%	0.467	40%	0.401	S	S	.	.	H	α-helix	trans	-92.5	-19.2	179	-65.7	-177.2	1.7	0	0	112.3	C93 A94 S95 E99 V100 Y101	C93-Q97 VanDerWaalsContact SG-CB 3.59Å; A94-Q97 PolarHBondContact O-N 3.41Å; S95-Q97 VanDerWaalsContact C-N 3.34Å; S95-Q97 PolarHBondContact O-N 3.12Å; Q97-E99 VanDerWaalsContact C-N 3.29Å; Q97-E99 PolarHBondContact O-N 3.26Å; Q97-V100 WeakPolarHBondContact O-CB 3.25Å; Q97-V100 PolarHBondContact O-N 3.17Å; Q97-V100 VanDerWaalsContact O-N 3.16Å; Q97-Y101 HydrophobicContact CB-CD2 4.05Å; Q97-Y101 HydrophobicContact CB-CE2 3.77Å; Q97-Y101 WeakPolarHBondContact O-CD2 2.92Å; Q97-Y101 PolarHBondContact O-N 3.08Å
98	V	78.6	Confident	80.1	Confident	38 Å²	38	77.6 Å²	77.6	23%	0.23	40%	0.4	C	S	.	.	H	α-helix	trans	-57.6	-41.7	-180	171.4	0	0	0	0	111.6	C93 A94 S95 Y101 Q102	C93-V98 HydrophobicContact CB-CG2 4.06Å; A94-V98 PolarHBondContact O-N 3.03Å; S95-V98 PolarHBondContact O-N 2.83Å; V98-Y101 PolarHBondContact O-N 3.3Å; V98-Q102 HydrophobicContact CG1-CG 4.37Å; V98-Q102 VanDerWaalsContact CG1-NE2 3.28Å; V98-Q102 WeakPolarHBondContact O-CB 3.35Å; V98-Q102 VanDerWaalsContact O-CG 3.3Å; V98-Q102 WeakPolarHBondContact O-CG 3.5Å; V98-Q102 PolarHBondContact O-N 3.14Å
99	E	81.9	Confident	80.3	Confident	150 Å²	150	76.7 Å²	76.7	70%	0.701	40%	0.396	S	S	*	.	H	α-helix	trans	-62.8	-42.9	177.6	-70.6	179.2	-177.3	0	0	112	Q97 Q102 M103	Q97-E99 VanDerWaalsContact C-N 3.29Å; Q97-E99 PolarHBondContact O-N 3.26Å; E99-Q102 PolarHBondContact O-N 2.85Å; E99-M103 PolarHBondContact O-N 2.68Å
100	V	83.8	Confident	80.9	Confident	68 Å²	68	80.2 Å²	80.2	41%	0.412	41%	0.412	S	S	.	.	H	α-helix	trans	-61.4	-47	176.8	177	0	0	0	0	110.9	Q97 Q102 M103 R104	Q97-V100 WeakPolarHBondContact O-CB 3.25Å; Q97-V100 PolarHBondContact O-N 3.17Å; Q97-V100 VanDerWaalsContact O-N 3.16Å; V100-Q102 VanDerWaalsContact C-N 3.33Å; V100-Q102 PolarHBondContact O-N 2.96Å; V100-M103 WeakPolarHBondContact O-CB 3.5Å; V100-M103 PolarHBondContact O-N 2.94Å; V100-R104 WeakPolarHBondContact O-CG 3.28Å; V100-R104 PolarHBondContact O-N 2.96Å
101	Y	82.6	Confident	81.7	Confident	22 Å²	22	79.6 Å²	79.6	9%	0.086	41%	0.409	C	S	.	.	H	α-helix	trans	-68.9	-30.2	177.8	-69.1	-64.8	0	0	0	113	T66 C93 Q97 V98 L105	T66-Y101 WeakPolarHBondContact CG2-OH 3.47Å; T66-Y101 WeakPolarHBondContact O-CE1 2.98Å; C93-Y101 WeakPolarHBondContact SG-CD2 3.49Å; C93-Y101 WeakPolarHBondContact SG-CE2 3.48Å; Q97-Y101 HydrophobicContact CB-CD2 4.05Å; Q97-Y101 HydrophobicContact CB-CE2 3.77Å; Q97-Y101 WeakPolarHBondContact O-CD2 2.92Å; Q97-Y101 PolarHBondContact O-N 3.08Å; V98-Y101 PolarHBondContact O-N 3.3Å; Y101-L105 VanDerWaalsContact O-CB 3.22Å; Y101-L105 WeakPolarHBondContact O-CB 3.5Å; Y101-L105 PolarHBondContact O-N 3.47Å
102	Q	85.9	Confident	82.8	Confident	58 Å²	58	73.9 Å²	73.9	27%	0.271	37%	0.369	S	S	.	.	H	α-helix	trans	-66.8	-41.5	172.1	-76.6	-174.2	39.7	0	0	111.8	I89 V98 E99 V100 L105 N106 K134	I89-Q102 HydrophobicContact CD1-CB 4.03Å; I89-Q102 HydrophobicContact CD1-CG 3.18Å; V98-Q102 HydrophobicContact CG1-CG 4.37Å; V98-Q102 VanDerWaalsContact CG1-NE2 3.28Å; V98-Q102 WeakPolarHBondContact O-CB 3.35Å; V98-Q102 VanDerWaalsContact O-CG 3.3Å; V98-Q102 WeakPolarHBondContact O-CG 3.5Å; V98-Q102 PolarHBondContact O-N 3.14Å; E99-Q102 PolarHBondContact O-N 2.85Å; V100-Q102 VanDerWaalsContact C-N 3.33Å; V100-Q102 PolarHBondContact O-N 2.96Å; Q102-L105 PolarHBondContact O-N 3.11Å; Q102-N106 WeakPolarHBondContact O-CB 3.3Å; Q102-N106 PolarHBondContact O-N 3.19Å; Q102-K134 HydrophobicContact CB-CG 4.45Å; Q102-K134 HydrophobicContact CG-CB 4.41Å; Q102-K134 HydrophobicContact CG-CG 4.14Å
103	M	85.9	Confident	84	Confident	119 Å²	119	70 Å²	70	59%	0.586	35%	0.352	S	S	*	.	H	α-helix	trans	-61.1	-53	175.7	-173	-177.8	-60	0	0	110.7	E99 V100 L105 N106 E107	E99-M103 PolarHBondContact O-N 2.68Å; V100-M103 WeakPolarHBondContact O-CB 3.5Å; V100-M103 PolarHBondContact O-N 2.94Å; M103-L105 VanDerWaalsContact C-N 3.33Å; M103-L105 PolarHBondContact O-N 3.32Å; M103-N106 WeakPolarHBondContact O-CA 3.45Å; M103-N106 WeakPolarHBondContact O-CB 3.28Å; M103-N106 PolarHBondContact O-N 3.03Å; M103-E107 WeakPolarHBondContact O-CG 3.25Å; M103-E107 PolarHBondContact O-N 3.41Å
104	R	86.3	Confident	85.3	Confident	118 Å²	118	70.9 Å²	70.9	45%	0.445	37%	0.365	S	S	.	.	H	α-helix	trans	-57.4	-43	177.1	-70.4	178.7	177.7	-176.5	-3.2	112.8	V100 N106 E107 E108	V100-R104 WeakPolarHBondContact O-CG 3.28Å; V100-R104 PolarHBondContact O-N 2.96Å; R104-N106 VanDerWaalsContact C-N 3.29Å; R104-N106 PolarHBondContact O-N 2.99Å; R104-E107 PolarHBondContact O-N 3.12Å; R104-E108 WeakPolarHBondContact O-CB 3.27Å; R104-E108 PolarHBondContact O-N 3.32Å
105	L	88.9	Confident	86.6	Confident	3 Å²	3	68.7 Å²	68.7	2%	0.016	35%	0.345	C	S	.	.	H	α-helix	trans	-67.6	-30.9	178.3	-165.5	69.8	0	0	0	112.3	K87 I89 Y101 Q102 M103 A109 F126 K134 L136	K87-L105 HydrophobicContact CB-CD1 4.13Å; K87-L105 HydrophobicContact CD-CD1 3.83Å; K87-L105 HydrophobicContact CG-CD1 3.82Å; I89-L105 HydrophobicContact CG1-CD2 4.37Å; Y101-L105 VanDerWaalsContact O-CB 3.22Å; Y101-L105 WeakPolarHBondContact O-CB 3.5Å; Y101-L105 PolarHBondContact O-N 3.47Å; Q102-L105 PolarHBondContact O-N 3.11Å; M103-L105 VanDerWaalsContact C-N 3.33Å; M103-L105 PolarHBondContact O-N 3.32Å; L105-A109 WeakPolarHBondContact O-CB 3.49Å; L105-A109 PolarHBondContact O-N 3.03Å; L105-A109 VanDerWaalsContact O-N 3.11Å; L105-F126 HydrophobicContact CD2-CE2 4.28Å; L105-F126 HydrophobicContact CG-CE2 4.12Å; L105-K134 HydrophobicContact CD2-CB 4.16Å; L105-K134 WeakPolarHBondContact CD2-O 3.43Å; L105-L136 HydrophobicContact CD1-CB 3.83Å; L105-L136 HydrophobicContact CD1-CD2 4.06Å; L105-L136 HydrophobicContact CD2-CB 4.4Å; L105-L136 HydrophobicContact CG-CB 4.03Å
106	N	91.1	Very high	87.9	Confident	66 Å²	66	70.2 Å²	70.2	35%	0.353	35%	0.345	S	S	.	.	H	α-helix	trans	-71.7	-44	174.1	-174.7	73.1	0	0	0	111.2	Q102 M103 R104 A109 E110 F126	Q102-N106 WeakPolarHBondContact O-CB 3.3Å; Q102-N106 PolarHBondContact O-N 3.19Å; M103-N106 WeakPolarHBondContact O-CA 3.45Å; M103-N106 WeakPolarHBondContact O-CB 3.28Å; M103-N106 PolarHBondContact O-N 3.03Å; R104-N106 VanDerWaalsContact C-N 3.29Å; R104-N106 PolarHBondContact O-N 2.99Å; N106-A109 WeakPolarHBondContact O-CB 3.46Å; N106-A109 PolarHBondContact O-N 2.96Å; N106-E110 WeakPolarHBondContact O-CG 3.33Å; N106-E110 PolarHBondContact O-N 3.35Å; N106-F126 HydrophobicContact CB-CE1 4.26Å; N106-F126 HydrophobicContact CB-CZ 3.94Å; N106-F126 WeakPolarHBondContact OD1-CE1 3.36Å
107	E	90.1	Very high	89.4	Confident	101 Å²	101	62.4 Å²	62.4	47%	0.472	31%	0.311	S	S	.	.	H	α-helix	trans	-59	-47.9	174.5	-70.9	165.8	174	0	0	111.4	M103 R104 A109 E110 L111	M103-E107 WeakPolarHBondContact O-CG 3.25Å; M103-E107 PolarHBondContact O-N 3.41Å; R104-E107 PolarHBondContact O-N 3.12Å; E107-A109 VanDerWaalsContact C-N 3.28Å; E107-A109 PolarHBondContact O-N 2.92Å; E107-E110 PolarHBondContact O-N 2.91Å; E107-E110 VanDerWaalsContact O-N 3.12Å; E107-L111 PolarHBondContact O-N 2.89Å
108	E	92.4	Very high	90.3	Very high	6 Å²	6	62 Å²	62	3%	0.028	32%	0.317	C	S	.	.	H	α-helix	trans	-57.4	-41.4	174.6	-174	-179.3	171.2	0	0	111.6	K87 R104 L111 L112 L136 V210	K87-E108 WeakPolarHBondContact CE-OE2 3.16Å; K87-E108 IonicContact NZ-OE1 2.72Å; K87-E108 PolarHBondContact NZ-OE1 3.04Å; K87-E108 IonicContact NZ-OE2 3Å; K87-E108 PolarHBondContact NZ-OE2 3.1Å; R104-E108 WeakPolarHBondContact O-CB 3.27Å; R104-E108 PolarHBondContact O-N 3.32Å; E108-L111 PolarHBondContact O-N 3.27Å; E108-L112 HydrophobicContact CG-CD1 3.97Å; E108-L112 WeakPolarHBondContact O-CB 3.37Å; E108-L112 WeakPolarHBondContact O-CG 3.41Å; E108-L112 PolarHBondContact O-N 3.13Å; E108-L136 HydrophobicContact CB-CD2 4.31Å; E108-L136 HydrophobicContact CG-CD2 3.84Å; E108-V210 HydrophobicContact CG-CG2 4.22Å
109	A	93.6	Very high	91.3	Very high	0 Å²	0	60.6 Å²	60.6	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-64.2	-41.4	176.7	0	0	0	0	0	112.4	L105 N106 E107 K113 F123 F126 L136	L105-A109 WeakPolarHBondContact O-CB 3.49Å; L105-A109 PolarHBondContact O-N 3.03Å; L105-A109 VanDerWaalsContact O-N 3.11Å; N106-A109 WeakPolarHBondContact O-CB 3.46Å; N106-A109 PolarHBondContact O-N 2.96Å; E107-A109 VanDerWaalsContact C-N 3.28Å; E107-A109 PolarHBondContact O-N 2.92Å; A109-K113 WeakPolarHBondContact O-CG 3.3Å; A109-K113 PolarHBondContact O-N 3.5Å; A109-K113 VanDerWaalsContact O-N 3.13Å; A109-F123 HydrophobicContact CB-CE2 4.25Å; A109-F126 HydrophobicContact CB-CB 4.06Å; A109-F126 HydrophobicContact CB-CD1 4.37Å; A109-F126 HydrophobicContact CB-CD2 3.6Å; A109-F126 HydrophobicContact CB-CE2 4.06Å; A109-F126 HydrophobicContact CB-CG 3.78Å; A109-L136 HydrophobicContact CB-CD1 3.87Å
110	E	93.8	Very high	92.1	Very high	95 Å²	95	53.5 Å²	53.5	44%	0.444	28%	0.275	S	S	.	.	H	α-helix	trans	-66.6	-41.3	177.2	-66	-48.5	138.9	0	0	111.9	N106 E107 K113	N106-E110 WeakPolarHBondContact O-CG 3.33Å; N106-E110 PolarHBondContact O-N 3.35Å; E107-E110 PolarHBondContact O-N 2.91Å; E107-E110 VanDerWaalsContact O-N 3.12Å; E110-K113 IonicContact OE1-NZ 2.86Å; E110-K113 PolarHBondContact OE1-NZ 2.92Å; E110-K113 IonicContact OE2-NZ 2.9Å; E110-K113 PolarHBondContact OE2-NZ 3.37Å
111	L	93.3	Very high	92.7	Very high	40 Å²	40	50.5 Å²	50.5	21%	0.209	26%	0.257	C	S	.	.	H	α-helix	trans	-60.3	-50.4	173.8	-70.7	175.1	0	0	0	111.4	E107 E108 K113 G114 L186 V210	E107-L111 PolarHBondContact O-N 2.89Å; E108-L111 PolarHBondContact O-N 3.27Å; L111-K113 VanDerWaalsContact C-N 3.31Å; L111-K113 PolarHBondContact O-N 3.29Å; L111-G114 PolarHBondContact O-N 3.36Å; L111-G114 VanDerWaalsContact O-N 3.12Å; L111-L186 HydrophobicContact CD2-CD1 3.93Å; L111-L186 HydrophobicContact CD2-CD2 4.43Å; L111-V210 HydrophobicContact CB-CG2 4.48Å
112	L	94.3	Very high	93.2	Very high	2 Å²	2	50 Å²	50	1%	0.01	26%	0.259	C	S	.	.	H	α-helix	trans	-63.7	-31.6	-177.1	-77.7	170.6	0	0	0	113.7	E108 G114 I115 V121 F123 L136 M138 V210	E108-L112 HydrophobicContact CG-CD1 3.97Å; E108-L112 WeakPolarHBondContact O-CB 3.37Å; E108-L112 WeakPolarHBondContact O-CG 3.41Å; E108-L112 PolarHBondContact O-N 3.13Å; L112-G114 PolarHBondContact O-N 3.24Å; L112-I115 HydrophobicContact CD2-CD1 4.38Å; L112-I115 PolarHBondContact O-N 2.95Å; L112-V121 WeakPolarHBondContact CD2-O 3.48Å; L112-F123 HydrophobicContact CB-CB 3.95Å; L112-F123 HydrophobicContact CB-CD2 4.15Å; L112-F123 WeakPolarHBondContact O-CB 3.37Å; L112-L136 HydrophobicContact CD1-CD1 4.44Å; L112-L136 HydrophobicContact CD1-CD2 3.83Å; L112-M138 HydrophobicContact CD1-CE 3.7Å; L112-V210 HydrophobicContact CD1-CG2 4.2Å; L112-V210 HydrophobicContact CD2-CG2 3.46Å; L112-V210 VanDerWaalsContact CD2-CG2 3.46Å; L112-V210 HydrophobicContact CG-CG2 3.47Å; L112-V210 VanDerWaalsContact CG-CG2 3.47Å
113	K	94.4	Very high	93.6	Very high	103 Å²	103	49.9 Å²	49.9	45%	0.448	26%	0.257	S	S	.	.	H	α-helix	trans	-57.5	-32.9	175.7	-79.2	172.7	-166.3	170.7	0	112.4	A109 E110 L111 I115 F123	A109-K113 WeakPolarHBondContact O-CG 3.3Å; A109-K113 PolarHBondContact O-N 3.5Å; A109-K113 VanDerWaalsContact O-N 3.13Å; E110-K113 IonicContact OE1-NZ 2.86Å; E110-K113 PolarHBondContact OE1-NZ 2.92Å; E110-K113 IonicContact OE2-NZ 2.9Å; E110-K113 PolarHBondContact OE2-NZ 3.37Å; L111-K113 VanDerWaalsContact C-N 3.31Å; L111-K113 PolarHBondContact O-N 3.29Å; K113-I115 VanDerWaalsContact C-N 3.34Å; K113-F123 HydrophobicContact CD-CZ 4.44Å; K113-F123 HydrophobicContact CG-CD1 3.79Å; K113-F123 HydrophobicContact CG-CD2 4.09Å; K113-F123 HydrophobicContact CG-CE1 3.7Å; K113-F123 HydrophobicContact CG-CE2 4.01Å; K113-F123 HydrophobicContact CG-CG 3.98Å; K113-F123 HydrophobicContact CG-CZ 3.8Å
114	G	93	Very high	94	Very high	39 Å²	39	49.6 Å²	49.6	40%	0.402	25%	0.25	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.1	-14.2	177.9	0	0	0	0	0	113.8	L111 L112 K184	L111-G114 PolarHBondContact O-N 3.36Å; L111-G114 VanDerWaalsContact O-N 3.12Å; L112-G114 PolarHBondContact O-N 3.24Å; G114-K184 WeakPolarHBondContact O-CE 3.32Å; G114-K184 PolarHBondContact O-NZ 3.38Å
115	I	95.8	Very high	94.3	Very high	10 Å²	10	44.9 Å²	44.9	5%	0.051	24%	0.236	C	C	.	.			trans	-96.7	123.9	-170.6	-68.6	170.3	0	0	0	110.4	L112 K113 I120 Y179 L180 L186 V210	L112-I115 HydrophobicContact CD2-CD1 4.38Å; L112-I115 PolarHBondContact O-N 2.95Å; K113-I115 VanDerWaalsContact C-N 3.34Å; I115-I120 HydrophobicContact CG2-CB 4.04Å; I115-I120 HydrophobicContact CG2-CD1 4.12Å; I115-I120 HydrophobicContact CG2-CG2 3.68Å; I115-Y179 HydrophobicContact CG2-CE1 4.12Å; I115-L180 HydrophobicContact CD1-CD2 3.97Å; I115-L180 HydrophobicContact CG1-CD2 4.46Å; I115-L186 HydrophobicContact CD1-CD2 4.34Å; I115-V210 HydrophobicContact CD1-CG1 4.26Å; I115-V210 HydrophobicContact CD1-CG2 4.38Å
116	N	96.2	Very high	94.4	Very high	140 Å²	140	47 Å²	47	75%	0.749	25%	0.245	S	C	*	.			trans	-144.6	97.9	173.2	-178.4	30.5	0	0	0	109.8	Y179	N116-Y179 PolarHBondContact N-OH 3.47Å; N116-Y179 PolarHBondContact O-OH 3.06Å
117	H	98.1	Very high	94.3	Very high	33 Å²	33	45.1 Å²	45.1	15%	0.153	24%	0.239	C	C	.	.			trans	-148.7	140.8	-178.2	-171.9	-94.1	0	0	0	110.4	N119 I120 Y179	H117-N119 PolarHBondContact CE1-OD1 3.29Å; H117-N119 PolarHBondContact ND1-N 2.99Å; H117-N119 VanDerWaalsContact ND1-N 3.12Å; H117-N119 PolarHBondContact O-N 2.99Å; H117-N119 VanDerWaalsContact O-N 3.17Å; H117-I120 HydrophobicContact CB-CB 4.31Å; H117-I120 HydrophobicContact CB-CD1 3.96Å; H117-I120 HydrophobicContact CB-CG1 4.08Å; H117-I120 PolarHBondContact O-N 2.93Å; H117-I120 VanDerWaalsContact O-N 3.14Å; H117-Y179 HydrophobicContact CB-CD1 3.81Å; H117-Y179 HydrophobicContact CB-CD2 4.2Å; H117-Y179 HydrophobicContact CB-CE1 3.94Å; H117-Y179 HydrophobicContact CB-CE2 4.32Å; H117-Y179 HydrophobicContact CB-CG 3.91Å; H117-Y179 AromaticContact CD2-CD2 3.6Å; H117-Y179 AromaticContact CD2-CG 3.62Å; H117-Y179 AromaticContact CG-CG 3.81Å
118	P	97.5	Very high	94	Very high	90 Å²	90	44 Å²	44	58%	0.584	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.2	-30.8	-178.4	21.5	-34.7	0	0	0	113.8	K206	P118-K206 VanDerWaalsContact O-CE 3.25Å; P118-K206 WeakPolarHBondContact O-CE 3.13Å; P118-K206 VanDerWaalsContact O-CG 3.27Å; P118-K206 WeakPolarHBondContact O-CG 3.47Å; P118-K206 PolarHBondContact O-NZ 3.05Å
119	N	98.4	Very high	93.4	Very high	9 Å²	9	44.7 Å²	44.7	5%	0.048	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.9	18.5	-179.5	-55.9	109.5	0	0	0	114.5	H117 H172 I205 K206 I207	H117-N119 PolarHBondContact CE1-OD1 3.29Å; H117-N119 PolarHBondContact ND1-N 2.99Å; H117-N119 VanDerWaalsContact ND1-N 3.12Å; H117-N119 PolarHBondContact O-N 2.99Å; H117-N119 VanDerWaalsContact O-N 3.17Å; N119-H172 WeakPolarHBondContact CB-O 3.43Å; N119-H172 VanDerWaalsContact CG-O 3.25Å; N119-H172 WeakPolarHBondContact ND2-CB 3.41Å; N119-H172 PolarHBondContact ND2-ND1 3.03Å; N119-I205 PolarHBondContact ND2-O 3.48Å; N119-K206 CarbonylContact O-C 3.6Å; N119-K206 WeakPolarHBondContact O-CA 3.13Å; N119-I207 PolarHBondContact O-N 3.49Å
120	I	98.1	Very high	92.5	Very high	1 Å²	1	54.5 Å²	54.5	1%	0.005	29%	0.289	C	S	.	.	B	Isolated β-bridge	trans	-132.1	142	172.7	-51.7	173.4	0	0	0	108.3	I115 H117 G122 Y179 L180 K206 I207	I115-I120 HydrophobicContact CG2-CB 4.04Å; I115-I120 HydrophobicContact CG2-CD1 4.12Å; I115-I120 HydrophobicContact CG2-CG2 3.68Å; H117-I120 HydrophobicContact CB-CB 4.31Å; H117-I120 HydrophobicContact CB-CD1 3.96Å; H117-I120 HydrophobicContact CB-CG1 4.08Å; H117-I120 PolarHBondContact O-N 2.93Å; H117-I120 VanDerWaalsContact O-N 3.14Å; I120-G122 PolarHBondContact O-N 3.15Å; I120-Y179 HydrophobicContact CD1-CD1 3.53Å; I120-Y179 HydrophobicContact CD1-CE1 4.17Å; I120-Y179 HydrophobicContact CD1-CG 4.4Å; I120-L180 HydrophobicContact CD1-CD1 4.17Å; I120-L180 HydrophobicContact CD1-CD2 3.67Å; I120-L180 HydrophobicContact CD1-CG 3.62Å; I120-K206 PolarHBondContact O-NZ 3.49Å; I120-I207 CarbonylContact C-O 3.46Å; I120-I207 WeakPolarHBondContact CA-O 3.42Å
121	V	96.5	Very high	91.7	Very high	6 Å²	6	56.2 Å²	56.2	4%	0.036	30%	0.301	C	S	.	.	P	Polyproline II helix	trans	-66.2	119.3	174	168.9	0	0	0	0	109.5	L112 M138 E139 V197 K206 I207 C208	L112-V121 WeakPolarHBondContact CD2-O 3.48Å; V121-M138 HydrophobicContact CG1-CB 3.91Å; V121-M138 HydrophobicContact CG1-CE 3.87Å; V121-E139 HydrophobicContact CG1-CB 4.2Å; V121-E139 VanDerWaalsContact CG1-O 3.28Å; V121-E139 WeakPolarHBondContact CG1-O 3.36Å; V121-V197 HydrophobicContact CG2-CG2 3.76Å; V121-K206 HydrophobicContact CG2-CB 3.99Å; V121-K206 HydrophobicContact CG2-CD 4.32Å; V121-I207 PolarHBondContact N-O 3.06Å; V121-C208 HydrophobicContact CB-CB 4.06Å; V121-C208 HydrophobicContact CG2-CB 3.7Å
122	G	93.9	Very high	91	Very high	12 Å²	12	56.3 Å²	56.3	12%	0.124	31%	0.311	C	S	.	.	P	Polyproline II helix	trans	-82.1	159.2	-177.2	0	0	0	0	0	115	I120 M138 E139	I120-G122 PolarHBondContact O-N 3.15Å; G122-M138 CarbonylContact O-C 3.58Å; G122-M138 WeakPolarHBondContact O-CA 3.33Å; G122-E139 PolarHBondContact N-OE2 3.16Å; G122-E139 VanDerWaalsContact N-OE2 3.08Å; G122-E139 WeakPolarHBondContact O-CB 3.03Å; G122-E139 PolarHBondContact O-N 2.74Å
123	F	94.9	Very high	90.2	Very high	54 Å²	54	57.4 Å²	57.4	24%	0.237	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.1	148	170.1	-178	-102.9	0	0	0	112.7	A109 L112 K113 A125 F126 L136	A109-F123 HydrophobicContact CB-CE2 4.25Å; L112-F123 HydrophobicContact CB-CB 3.95Å; L112-F123 HydrophobicContact CB-CD2 4.15Å; L112-F123 WeakPolarHBondContact O-CB 3.37Å; K113-F123 HydrophobicContact CD-CZ 4.44Å; K113-F123 HydrophobicContact CG-CD1 3.79Å; K113-F123 HydrophobicContact CG-CD2 4.09Å; K113-F123 HydrophobicContact CG-CE1 3.7Å; K113-F123 HydrophobicContact CG-CE2 4.01Å; K113-F123 HydrophobicContact CG-CG 3.98Å; K113-F123 HydrophobicContact CG-CZ 3.8Å; F123-A125 VanDerWaalsContact CZ-CA 3.47Å; F123-F126 HydrophobicContact CE2-CB 4.01Å; F123-F126 HydrophobicContact CZ-CB 3.99Å; F123-L136 HydrophobicContact CD2-CD1 3.76Å; F123-L136 HydrophobicContact CE2-CD1 3.66Å
124	R	93.4	Very high	89.8	Confident	114 Å²	114	55.5 Å²	55.5	43%	0.43	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	-52.6	168.1	-62.3	-65.5	-178.6	-176.2	-0.4	113	W84 A137 M138	W84-R124 HydrophobicContact CD2-CB 4.15Å; W84-R124 HydrophobicContact CD2-CG 4.29Å; W84-R124 HydrophobicContact CE3-CB 4.39Å; W84-R124 HydrophobicContact CG-CG 4.41Å; W84-R124 HydrophobicContact CH2-CB 3.99Å; W84-R124 HydrophobicContact CZ2-CB 3.78Å; W84-R124 HydrophobicContact CZ2-CG 4.16Å; W84-R124 HydrophobicContact CZ3-CB 4.32Å; R124-A137 WeakPolarHBondContact CA-O 3.22Å; R124-A137 HydrophobicContact CB-CB 4.3Å; R124-A137 WeakPolarHBondContact CB-O 3.26Å; R124-A137 PolarHBondContact N-O 2.99Å; R124-M138 VanDerWaalsContact CG-C 3.4Å
125	A	91.8	Very high	89.6	Confident	19 Å²	19	53.7 Å²	53.7	16%	0.157	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.7	155.8	-179.8	0	0	0	0	0	111.4	W84 F123 A137	W84-A125 HydrophobicContact CH2-CB 4.49Å; W84-A125 HydrophobicContact CZ3-CB 4.33Å; F123-A125 VanDerWaalsContact CZ-CA 3.47Å; A125-A137 HydrophobicContact CB-CB 4.19Å; A125-A137 PolarHBondContact N-O 2.86Å; A125-A137 PolarHBondContact O-N 3.42Å
126	F	92.3	Very high	89.5	Confident	47 Å²	47	53.2 Å²	53.2	21%	0.206	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	126.1	167.5	-173.5	-117.1	0	0	0	108	L105 N106 A109 F123 K134 C135 L136	L105-F126 HydrophobicContact CD2-CE2 4.28Å; L105-F126 HydrophobicContact CG-CE2 4.12Å; N106-F126 HydrophobicContact CB-CE1 4.26Å; N106-F126 HydrophobicContact CB-CZ 3.94Å; N106-F126 WeakPolarHBondContact OD1-CE1 3.36Å; A109-F126 HydrophobicContact CB-CB 4.06Å; A109-F126 HydrophobicContact CB-CD1 4.37Å; A109-F126 HydrophobicContact CB-CD2 3.6Å; A109-F126 HydrophobicContact CB-CE2 4.06Å; A109-F126 HydrophobicContact CB-CG 3.78Å; F123-F126 HydrophobicContact CE2-CB 4.01Å; F123-F126 HydrophobicContact CZ-CB 3.99Å; F126-K134 HydrophobicContact CE1-CD 3.95Å; F126-K134 HydrophobicContact CE2-CB 4.08Å; F126-K134 HydrophobicContact CZ-CB 3.84Å; F126-K134 HydrophobicContact CZ-CD 3.79Å; F126-K134 HydrophobicContact CZ-CG 4Å; F126-C135 WeakPolarHBondContact CA-O 3.37Å; F126-C135 WeakPolarHBondContact CD2-O 3.25Å; F126-L136 HydrophobicContact CD2-CB 4.11Å; F126-L136 HydrophobicContact CD2-CD1 4.43Å
127	A	88.1	Confident	89.3	Confident	26 Å²	26	46.5 Å²	46.5	22%	0.215	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	156.2	-171	0	0	0	0	0	112	I53 C135	I53-A127 HydrophobicContact CD1-CB 4.3Å; A127-C135 PolarHBondContact N-O 2.87Å; A127-C135 PolarHBondContact O-N 3.21Å
128	T	84.7	Confident	89.1	Confident	77 Å²	77	45.5 Å²	45.5	47%	0.472	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	124.2	168	-67.4	0	0	0	0	108.9	S133 K134	T128-S133 CarbonylContact C-O 3.3Å; T128-S133 WeakPolarHBondContact CA-O 3.48Å; T128-K134 WeakPolarHBondContact OG1-CD 3.39Å; T128-K134 WeakPolarHBondContact OG1-CE 3.44Å; T128-K134 PolarHBondContact OG1-NZ 3.03Å
129	A	78.6	Confident	88.9	Confident	22 Å²	22	43.3 Å²	43.3	18%	0.182	23%	0.231	C	C	.	.			trans	-71.2	167.4	173.2	0	0	0	0	0	111.2	D131 G132 S133	A129-D131 WeakPolarHBondContact CB-OD1 3.47Å; A129-D131 PolarHBondContact O-N 3.18Å; A129-D131 VanDerWaalsContact O-N 3.17Å; A129-G132 PolarHBondContact O-N 2.85Å; A129-S133 PolarHBondContact N-O 2.94Å
130	K	76.1	Confident	88.6	Confident	206 Å²	206	44.6 Å²	44.6	90%	0.896	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61	-25.9	-177	-68.3	-173.8	177.9	-176.5	0	114
131	D	76.1	Confident	88.1	Confident	131 Å²	131	44.8 Å²	44.8	70%	0.701	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	-84.2	5	176.5	59.5	11.4	0	0	0	113.1	A129 S133	A129-D131 WeakPolarHBondContact CB-OD1 3.47Å; A129-D131 PolarHBondContact O-N 3.18Å; A129-D131 VanDerWaalsContact O-N 3.17Å; D131-S133 VanDerWaalsContact C-N 3.32Å; D131-S133 VanDerWaalsContact OD1-CB 3.28Å; D131-S133 WeakPolarHBondContact OD1-CB 3.29Å; D131-S133 PolarHBondContact OD1-N 2.7Å; D131-S133 PolarHBondContact OD1-OG 2.88Å
132	G	77.9	Confident	87.8	Confident	41 Å²	41	44.9 Å²	44.9	42%	0.423	24%	0.24	S	C	.	.	S	Bend	trans	86.8	-8	-178.6	0	0	0	0	0	114.4	A129	A129-G132 PolarHBondContact O-N 2.85Å
133	S	77.8	Confident	87.5	Confident	25 Å²	25	48.9 Å²	48.9	18%	0.175	26%	0.255	C	S	.	.			trans	-71.7	142.5	-178.9	65.9	0	0	0	0	112.6	T128 A129 D131	T128-S133 CarbonylContact C-O 3.3Å; T128-S133 WeakPolarHBondContact CA-O 3.48Å; A129-S133 PolarHBondContact N-O 2.94Å; D131-S133 VanDerWaalsContact C-N 3.32Å; D131-S133 VanDerWaalsContact OD1-CB 3.28Å; D131-S133 WeakPolarHBondContact OD1-CB 3.29Å; D131-S133 PolarHBondContact OD1-N 2.7Å; D131-S133 PolarHBondContact OD1-OG 2.88Å
134	K	85.9	Confident	87.3	Confident	64 Å²	64	49.6 Å²	49.6	28%	0.278	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	140.9	173.3	-64.4	-66.5	-176.9	178.1	0	110.8	Q102 L105 F126 T128	Q102-K134 HydrophobicContact CB-CG 4.45Å; Q102-K134 HydrophobicContact CG-CB 4.41Å; Q102-K134 HydrophobicContact CG-CG 4.14Å; L105-K134 HydrophobicContact CD2-CB 4.16Å; L105-K134 WeakPolarHBondContact CD2-O 3.43Å; F126-K134 HydrophobicContact CE1-CD 3.95Å; F126-K134 HydrophobicContact CE2-CB 4.08Å; F126-K134 HydrophobicContact CZ-CB 3.84Å; F126-K134 HydrophobicContact CZ-CD 3.79Å; F126-K134 HydrophobicContact CZ-CG 4Å; T128-K134 WeakPolarHBondContact OG1-CD 3.39Å; T128-K134 WeakPolarHBondContact OG1-CE 3.44Å; T128-K134 PolarHBondContact OG1-NZ 3.03Å
135	C	89.8	Confident	87.4	Confident	0 Å²	0	44.9 Å²	44.9	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	128.7	-179.3	-64.2	0	0	0	0	109.6	I53 V86 K88 F126 A127	I53-C135 HydrophobicContact CD1-CB 3.68Å; V86-C135 HydrophobicContact CG1-CB 4.35Å; K88-C135 VanDerWaalsContact CE-SG 3.55Å; K88-C135 HydrophobicContact CG-CB 4.33Å; F126-C135 WeakPolarHBondContact CA-O 3.37Å; F126-C135 WeakPolarHBondContact CD2-O 3.25Å; A127-C135 PolarHBondContact N-O 2.87Å; A127-C135 PolarHBondContact O-N 3.21Å
136	L	92.4	Very high	87.7	Confident	0 Å²	0	44 Å²	44	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	117.6	173.5	171.3	58.6	0	0	0	108.9	V86 K87 L105 E108 A109 L112 F123 F126 M138	V86-L136 CarbonylContact C-O 3.5Å; V86-L136 VanDerWaalsContact CA-O 3.3Å; V86-L136 WeakPolarHBondContact CA-O 3.41Å; K87-L136 HydrophobicContact CB-CB 4.36Å; K87-L136 PolarHBondContact N-O 2.75Å; K87-L136 PolarHBondContact O-N 3.3Å; L105-L136 HydrophobicContact CD1-CB 3.83Å; L105-L136 HydrophobicContact CD1-CD2 4.06Å; L105-L136 HydrophobicContact CD2-CB 4.4Å; L105-L136 HydrophobicContact CG-CB 4.03Å; E108-L136 HydrophobicContact CB-CD2 4.31Å; E108-L136 HydrophobicContact CG-CD2 3.84Å; A109-L136 HydrophobicContact CB-CD1 3.87Å; L112-L136 HydrophobicContact CD1-CD1 4.44Å; L112-L136 HydrophobicContact CD1-CD2 3.83Å; F123-L136 HydrophobicContact CD2-CD1 3.76Å; F123-L136 HydrophobicContact CE2-CD1 3.66Å; F126-L136 HydrophobicContact CD2-CB 4.11Å; F126-L136 HydrophobicContact CD2-CD1 4.43Å; L136-M138 HydrophobicContact CD2-CG 4.44Å; L136-M138 HydrophobicContact CG-CG 3.97Å
137	A	92.4	Very high	87.9	Confident	0 Å²	0	42.5 Å²	42.5	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	133.1	171.4	0	0	0	0	0	110.2	I53 W84 A85 V86 R124 A125	I53-A137 HydrophobicContact CD1-CB 4.38Å; W84-A137 HydrophobicContact CE3-CB 3.74Å; W84-A137 HydrophobicContact CZ3-CB 4.04Å; A85-A137 CarbonylContact O-C 3.54Å; A85-A137 WeakPolarHBondContact O-CA 3.4Å; V86-A137 HydrophobicContact CG2-CB 4.22Å; R124-A137 WeakPolarHBondContact CA-O 3.22Å; R124-A137 HydrophobicContact CB-CB 4.3Å; R124-A137 WeakPolarHBondContact CB-O 3.26Å; R124-A137 PolarHBondContact N-O 2.99Å; A125-A137 HydrophobicContact CB-CB 4.19Å; A125-A137 PolarHBondContact N-O 2.86Å; A125-A137 PolarHBondContact O-N 3.42Å
138	M	94.4	Very high	88.2	Confident	11 Å²	11	44.2 Å²	44.2	5%	0.054	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	161.7	-171.9	-42.3	171.2	78	0	0	109.5	A85 L112 V121 G122 R124 L136 Y140	A85-M138 HydrophobicContact CB-CB 4.39Å; A85-M138 PolarHBondContact N-O 2.94Å; A85-M138 VanDerWaalsContact N-O 3.08Å; A85-M138 PolarHBondContact O-N 3.22Å; L112-M138 HydrophobicContact CD1-CE 3.7Å; V121-M138 HydrophobicContact CG1-CB 3.91Å; V121-M138 HydrophobicContact CG1-CE 3.87Å; G122-M138 CarbonylContact O-C 3.58Å; G122-M138 WeakPolarHBondContact O-CA 3.33Å; R124-M138 VanDerWaalsContact CG-C 3.4Å; L136-M138 HydrophobicContact CD2-CG 4.44Å; L136-M138 HydrophobicContact CG-CG 3.97Å; M138-Y140 PolarHBondContact O-N 3.24Å
139	E	93.5	Very high	88.8	Confident	44 Å²	44	42.1 Å²	42.1	21%	0.206	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-54.7	137.1	164.9	-178.8	-173.4	-172.2	0	0	109.9	V121 G122 G141 K206	V121-E139 HydrophobicContact CG1-CB 4.2Å; V121-E139 VanDerWaalsContact CG1-O 3.28Å; V121-E139 WeakPolarHBondContact CG1-O 3.36Å; G122-E139 PolarHBondContact N-OE2 3.16Å; G122-E139 VanDerWaalsContact N-OE2 3.08Å; G122-E139 WeakPolarHBondContact O-CB 3.03Å; G122-E139 PolarHBondContact O-N 2.74Å; E139-G141 PolarHBondContact O-N 3.16Å; E139-K206 WeakPolarHBondContact OE1-CE 3.11Å; E139-K206 IonicContact OE1-NZ 3.39Å; E139-K206 PolarHBondContact OE1-NZ 2.83Å; E139-K206 IonicContact OE2-NZ 2.61Å; E139-K206 PolarHBondContact OE2-NZ 3.28Å
140	Y	92.4	Very high	89.6	Confident	36 Å²	36	41.1 Å²	41.1	14%	0.141	21%	0.213	C	C	.	.			trans	-77.2	108.8	168.3	-179.5	-119	0	0	0	109.5	L62 L72 P83 M138 G142 E143	L62-Y140 HydrophobicContact CD1-CD2 4.18Å; L62-Y140 HydrophobicContact CD1-CE2 3.87Å; L62-Y140 HydrophobicContact CD2-CE2 4.35Å; L72-Y140 HydrophobicContact CD1-CD1 4.32Å; L72-Y140 HydrophobicContact CD1-CD2 3.48Å; L72-Y140 VanDerWaalsContact CD1-CD2 3.48Å; L72-Y140 HydrophobicContact CD1-CE1 4.35Å; L72-Y140 HydrophobicContact CD1-CE2 3.55Å; L72-Y140 HydrophobicContact CD1-CG 3.86Å; P83-Y140 HydrophobicContact CB-CD1 4.35Å; P83-Y140 HydrophobicContact CB-CG 4.46Å; P83-Y140 HydrophobicContact CG-CD1 3.74Å; P83-Y140 HydrophobicContact CG-CE1 4.46Å; P83-Y140 HydrophobicContact CG-CG 4.23Å; P83-Y140 WeakPolarHBondContact O-CB 3.37Å; M138-Y140 PolarHBondContact O-N 3.24Å; Y140-G142 WeakPolarHBondContact CE2-O 3.31Å; Y140-G142 PolarHBondContact OH-O 3.24Å; Y140-G142 VanDerWaalsContact OH-O 3.06Å; Y140-E143 VanDerWaalsContact OH-CA 3.26Å; Y140-E143 WeakPolarHBondContact OH-CA 3.01Å
141	G	87.3	Confident	90.5	Very high	6 Å²	6	34.8 Å²	34.8	6%	0.062	19%	0.187	C	C	.	.			trans	-83.9	-15.3	-171.9	0	0	0	0	0	115.7	E139	E139-G141 PolarHBondContact O-N 3.16Å
142	G	89.6	Confident	91.4	Very high	7 Å²	7	33.6 Å²	33.6	7%	0.072	18%	0.176	C	C	.	.			trans	161.1	169.2	-178.6	0	0	0	0	0	114.4	Y140 Q144 I198	Y140-G142 WeakPolarHBondContact CE2-O 3.31Å; Y140-G142 PolarHBondContact OH-O 3.24Å; Y140-G142 VanDerWaalsContact OH-O 3.06Å; G142-Q144 VanDerWaalsContact C-N 3.35Å; G142-I198 CarbonylContact C-O 3.59Å; G142-I198 WeakPolarHBondContact CA-O 3.43Å
143	E	87.2	Confident	92.3	Very high	97 Å²	97	34.2 Å²	34.2	45%	0.453	17%	0.165	S	C	.	.	S	Bend	trans	-69.9	-31.4	-179	-64.1	78.8	-166.5	0	0	113.4	Y140 I198 K199 G200	Y140-E143 VanDerWaalsContact OH-CA 3.26Å; Y140-E143 WeakPolarHBondContact OH-CA 3.01Å; E143-I198 PolarHBondContact N-O 3.42Å; E143-I198 VanDerWaalsContact N-O 3.15Å; E143-K199 VanDerWaalsContact OE2-CA 3.25Å; E143-K199 WeakPolarHBondContact OE2-CA 3.17Å; E143-K199 WeakPolarHBondContact OE2-CG 3.4Å; E143-G200 PolarHBondContact OE2-N 3.09Å
144	Q	91.3	Very high	93	Very high	69 Å²	69	38.4 Å²	38.4	32%	0.322	18%	0.177	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	151.9	-169.6	-65.9	-171.4	-99.3	0	0	111	G142 D148 L149 I198	G142-Q144 VanDerWaalsContact C-N 3.35Å; Q144-D148 WeakPolarHBondContact CA-OD2 3.46Å; Q144-D148 HydrophobicContact CB-CB 4.07Å; Q144-D148 HydrophobicContact CG-CB 4.48Å; Q144-L149 HydrophobicContact CB-CD2 4.31Å; Q144-L149 HydrophobicContact CB-CG 4.38Å; Q144-I198 PolarHBondContact O-N 3.37Å
145	S	95.9	Very high	93.4	Very high	15 Å²	15	42.8 Å²	42.8	11%	0.105	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	161.4	162.7	77.3	0	0	0	0	110.5	N147 D148 L149 I196	S145-N147 PolarHBondContact O-N 3.19Å; S145-N147 PolarHBondContact OG-N 3.07Å; S145-D148 PolarHBondContact N-OD2 2.86Å; S145-D148 PolarHBondContact O-N 3.3Å; S145-D148 PolarHBondContact OG-N 3.1Å; S145-D148 PolarHBondContact OG-OD1 2.98Å; S145-D148 PolarHBondContact OG-OD2 3.44Å; S145-L149 PolarHBondContact O-N 2.89Å; S145-I196 CarbonylContact C-O 3.51Å; S145-I196 VanDerWaalsContact CA-O 3.29Å; S145-I196 WeakPolarHBondContact CA-O 3.29Å
146	L	97.6	Very high	93.7	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-62.1	-35.1	171.4	177.9	63	0	0	0	110.5	L149 I150 V169 S193 I196 I198 F202 T259 M263	L146-L149 WeakPolarHBondContact O-CB 3.43Å; L146-L149 PolarHBondContact O-N 2.77Å; L146-I150 HydrophobicContact CG-CD1 3.98Å; L146-I150 WeakPolarHBondContact O-CG1 3.49Å; L146-I150 PolarHBondContact O-N 3.28Å; L146-V169 HydrophobicContact CD2-CG1 4.09Å; L146-S193 WeakPolarHBondContact CB-O 3.45Å; L146-S193 PolarHBondContact N-O 3.13Å; L146-I196 HydrophobicContact CB-CB 4.05Å; L146-I196 HydrophobicContact CB-CG2 4.18Å; L146-I196 HydrophobicContact CD2-CB 4.46Å; L146-I196 HydrophobicContact CD2-CD1 4.03Å; L146-I196 HydrophobicContact CD2-CG2 4.44Å; L146-I196 PolarHBondContact N-O 2.92Å; L146-I198 HydrophobicContact CB-CG1 4.42Å; L146-F202 HydrophobicContact CD1-CE1 4.44Å; L146-T259 HydrophobicContact CD2-CG2 3.84Å; L146-M263 HydrophobicContact CD1-CE 3.94Å; L146-M263 HydrophobicContact CD1-CG 4.16Å; L146-M263 HydrophobicContact CD1-SD 4.03Å; L146-M263 HydrophobicContact CD2-CG 4Å; L146-M263 HydrophobicContact CD2-SD 3.89Å; L146-M263 HydrophobicContact CG-CG 4.41Å
147	N	96.4	Very high	93.7	Very high	15 Å²	15	50.8 Å²	50.8	8%	0.08	26%	0.257	C	S	.	.	H	α-helix	trans	-59.1	-45.6	172.6	-174.6	68.7	0	0	0	111.9	S145 L149 I150 E151 S193 C194	S145-N147 PolarHBondContact O-N 3.19Å; S145-N147 PolarHBondContact OG-N 3.07Å; N147-L149 PolarHBondContact O-N 3.17Å; N147-I150 WeakPolarHBondContact O-CB 3.45Å; N147-I150 PolarHBondContact O-N 3.21Å; N147-E151 PolarHBondContact ND2-OE1 3.46Å; N147-E151 WeakPolarHBondContact O-CG 3.38Å; N147-E151 PolarHBondContact O-N 2.96Å; N147-S193 WeakPolarHBondContact CB-OG 3.43Å; N147-S193 PolarHBondContact N-O 3.15Å; N147-C194 HydrophobicContact CB-CB 4.39Å; N147-C194 VanDerWaalsContact CB-SG 3.55Å
148	D	95.1	Very high	93.9	Very high	63 Å²	63	54.9 Å²	54.9	34%	0.337	28%	0.279	S	S	.	.	H	α-helix	trans	-59.9	-35.5	178.7	-53.1	-18	0	0	0	111.2	Q144 S145 K152	Q144-D148 WeakPolarHBondContact CA-OD2 3.46Å; Q144-D148 HydrophobicContact CB-CB 4.07Å; Q144-D148 HydrophobicContact CG-CB 4.48Å; S145-D148 PolarHBondContact N-OD2 2.86Å; S145-D148 PolarHBondContact O-N 3.3Å; S145-D148 PolarHBondContact OG-N 3.1Å; S145-D148 PolarHBondContact OG-OD1 2.98Å; S145-D148 PolarHBondContact OG-OD2 3.44Å; D148-K152 VanDerWaalsContact O-CB 3.28Å; D148-K152 WeakPolarHBondContact O-CB 3.43Å; D148-K152 PolarHBondContact O-N 3.22Å
149	L	96.4	Very high	93.9	Very high	32 Å²	32	59.7 Å²	59.7	17%	0.168	31%	0.309	C	S	.	.	H	α-helix	trans	-71	-40.1	175.7	-63.9	179.1	0	0	0	111.7	Q144 S145 L146 N147 R153 F161 I198 F202	Q144-L149 HydrophobicContact CB-CD2 4.31Å; Q144-L149 HydrophobicContact CB-CG 4.38Å; S145-L149 PolarHBondContact O-N 2.89Å; L146-L149 WeakPolarHBondContact O-CB 3.43Å; L146-L149 PolarHBondContact O-N 2.77Å; N147-L149 PolarHBondContact O-N 3.17Å; L149-R153 WeakPolarHBondContact O-CB 3.16Å; L149-R153 PolarHBondContact O-N 3.33Å; L149-F161 HydrophobicContact CB-CE1 4.37Å; L149-F161 HydrophobicContact CB-CZ 3.93Å; L149-I198 HydrophobicContact CD1-CB 4.02Å; L149-I198 HydrophobicContact CD1-CG1 3.89Å; L149-I198 HydrophobicContact CD1-CG2 4.09Å; L149-F202 HydrophobicContact CD1-CE1 4.48Å; L149-F202 HydrophobicContact CD1-CE2 4.43Å; L149-F202 HydrophobicContact CD1-CZ 4Å
150	I	96.7	Very high	94	Very high	2 Å²	2	58 Å²	58	1%	0.01	30%	0.303	C	S	.	.	H	α-helix	trans	-61.5	-49.9	175.2	-72.9	157.8	0	0	0	110.5	L146 N147 R153 R154 F161 E262 M263 L266	L146-I150 HydrophobicContact CG-CD1 3.98Å; L146-I150 WeakPolarHBondContact O-CG1 3.49Å; L146-I150 PolarHBondContact O-N 3.28Å; N147-I150 WeakPolarHBondContact O-CB 3.45Å; N147-I150 PolarHBondContact O-N 3.21Å; I150-R153 PolarHBondContact O-N 3.44Å; I150-R154 PolarHBondContact O-N 2.86Å; I150-F161 HydrophobicContact CB-CE2 4.37Å; I150-F161 HydrophobicContact CG1-CE2 3.61Å; I150-F161 HydrophobicContact CG1-CZ 4.25Å; I150-E262 HydrophobicContact CD1-CB 3.87Å; I150-M263 HydrophobicContact CD1-CG 4.5Å; I150-L266 HydrophobicContact CG1-CD2 4.42Å; I150-L266 HydrophobicContact CG2-CB 4.11Å; I150-L266 HydrophobicContact CG2-CD2 4.13Å
151	E	94.7	Very high	94.3	Very high	72 Å²	72	56.9 Å²	56.9	34%	0.336	30%	0.298	S	S	.	.	H	α-helix	trans	-59.2	-49.9	178.7	-71.7	-179.1	172.8	0	0	111.4	N147 R153 R154 E155	N147-E151 PolarHBondContact ND2-OE1 3.46Å; N147-E151 WeakPolarHBondContact O-CG 3.38Å; N147-E151 PolarHBondContact O-N 2.96Å; E151-R153 VanDerWaalsContact C-N 3.31Å; E151-R153 PolarHBondContact O-N 3.05Å; E151-R154 WeakPolarHBondContact O-CB 3.42Å; E151-R154 PolarHBondContact O-N 3.23Å; E151-E155 WeakPolarHBondContact O-CG 3.44Å; E151-E155 PolarHBondContact O-N 2.98Å
152	K	94.6	Very high	94.7	Very high	107 Å²	107	59.6 Å²	59.6	47%	0.465	32%	0.315	S	S	.	.	H	α-helix	trans	-58.7	-43.6	177.3	-178.2	-179.3	176.2	-172.4	0	111.9	D148 R154 E155 D156	D148-K152 VanDerWaalsContact O-CB 3.28Å; D148-K152 WeakPolarHBondContact O-CB 3.43Å; D148-K152 PolarHBondContact O-N 3.22Å; K152-R154 VanDerWaalsContact C-N 3.3Å; K152-R154 PolarHBondContact O-N 2.96Å; K152-E155 PolarHBondContact O-N 3.31Å; K152-D156 WeakPolarHBondContact O-CB 3.35Å; K152-D156 VanDerWaalsContact O-CG 3.27Å; K152-D156 PolarHBondContact O-N 3Å
153	R	95.8	Very high	95.1	Very high	53 Å²	53	59.8 Å²	59.8	20%	0.2	32%	0.316	C	S	.	.	H	α-helix	trans	-63.2	-38.9	179.4	-169.9	170.9	-179	78.8	4.5	111.5	L149 I150 E151 D156 G157 L158 T159 A160 F161 L266	L149-R153 WeakPolarHBondContact O-CB 3.16Å; L149-R153 PolarHBondContact O-N 3.33Å; I150-R153 PolarHBondContact O-N 3.44Å; E151-R153 VanDerWaalsContact C-N 3.31Å; E151-R153 PolarHBondContact O-N 3.05Å; R153-D156 PolarHBondContact O-N 3.15Å; R153-G157 PolarHBondContact O-N 2.74Å; R153-L158 HydrophobicContact CG-CB 3.57Å; R153-L158 HydrophobicContact CG-CD1 4.02Å; R153-L158 HydrophobicContact CG-CG 4.39Å; R153-L158 WeakPolarHBondContact O-CB 3.43Å; R153-L158 PolarHBondContact O-N 3.5Å; R153-T159 PolarHBondContact NE-O 3.25Å; R153-T159 PolarHBondContact NH2-O 2.9Å; R153-A160 PolarHBondContact NE-O 3.4Å; R153-A160 PolarHBondContact NH2-O 3.01Å; R153-F161 HydrophobicContact CB-CE2 4.44Å; R153-F161 HydrophobicContact CB-CZ 4.28Å; R153-L266 HydrophobicContact CB-CD1 4.21Å; R153-L266 HydrophobicContact CB-CD2 4.44Å; R153-L266 HydrophobicContact CG-CD1 3.84Å; R153-L266 HydrophobicContact CG-CD2 4.37Å
154	R	93.6	Very high	95.5	Very high	113 Å²	113	58.4 Å²	58.4	43%	0.426	32%	0.321	S	S	.	.	H	α-helix	trans	-64.8	-45.7	173.3	-175.8	176.5	65.2	-131.7	2.4	111.7	I150 E151 K152 D156 G157 L266	I150-R154 PolarHBondContact O-N 2.86Å; E151-R154 WeakPolarHBondContact O-CB 3.42Å; E151-R154 PolarHBondContact O-N 3.23Å; K152-R154 VanDerWaalsContact C-N 3.3Å; K152-R154 PolarHBondContact O-N 2.96Å; R154-D156 VanDerWaalsContact C-N 3.29Å; R154-D156 PolarHBondContact O-N 2.72Å; R154-G157 PolarHBondContact O-N 2.97Å; R154-L266 HydrophobicContact CB-CB 4.34Å; R154-L266 PolarHBondContact NH1-O 3.22Å
155	E	93.8	Very high	95.7	Very high	156 Å²	156	56.6 Å²	56.6	73%	0.729	32%	0.316	S	S	*	.	H	α-helix	trans	-61.7	-35.9	176.4	-72.1	178.7	171.3	0	0	112.7	E151 K152 G157	E151-E155 WeakPolarHBondContact O-CG 3.44Å; E151-E155 PolarHBondContact O-N 2.98Å; K152-E155 PolarHBondContact O-N 3.31Å; E155-G157 PolarHBondContact O-N 3.33Å
156	D	95.9	Very high	95.9	Very high	102 Å²	102	55.9 Å²	55.9	55%	0.545	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.9	-0.4	176	-70.4	-23.1	0	0	0	112.8	K152 R153 R154 L158	K152-D156 WeakPolarHBondContact O-CB 3.35Å; K152-D156 VanDerWaalsContact O-CG 3.27Å; K152-D156 PolarHBondContact O-N 3Å; R153-D156 PolarHBondContact O-N 3.15Å; R154-D156 VanDerWaalsContact C-N 3.29Å; R154-D156 PolarHBondContact O-N 2.72Å; D156-L158 VanDerWaalsContact C-N 3.26Å; D156-L158 HydrophobicContact CB-CD1 4.09Å; D156-L158 HydrophobicContact CB-CG 4.04Å; D156-L158 PolarHBondContact O-N 3.46Å
157	G	94.2	Very high	95.8	Very high	67 Å²	67	57.8 Å²	57.8	69%	0.691	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	68.4	23.1	179.8	0	0	0	0	0	113.8	R153 R154 E155	R153-G157 PolarHBondContact O-N 2.74Å; R154-G157 PolarHBondContact O-N 2.97Å; E155-G157 PolarHBondContact O-N 3.33Å
158	L	95.2	Very high	95.9	Very high	86 Å²	86	60.9 Å²	60.9	45%	0.45	33%	0.332	S	S	.	.			trans	-87.2	158.3	179	-60.5	174.6	0	0	0	110.8	R153 D156 L266	R153-L158 HydrophobicContact CG-CB 3.57Å; R153-L158 HydrophobicContact CG-CD1 4.02Å; R153-L158 HydrophobicContact CG-CG 4.39Å; R153-L158 WeakPolarHBondContact O-CB 3.43Å; R153-L158 PolarHBondContact O-N 3.5Å; D156-L158 VanDerWaalsContact C-N 3.26Å; D156-L158 HydrophobicContact CB-CD1 4.09Å; D156-L158 HydrophobicContact CB-CG 4.04Å; D156-L158 PolarHBondContact O-N 3.46Å; L158-L266 WeakPolarHBondContact O-CD1 3.42Å
159	T	94.2	Very high	96.1	Very high	112 Å²	112	57.9 Å²	57.9	69%	0.687	32%	0.316	S	S	*	.			trans	-89.6	-168.8	176.5	60.6	0	0	0	0	111.4	R153	R153-T159 PolarHBondContact NE-O 3.25Å; R153-T159 PolarHBondContact NH2-O 2.9Å
160	A	96.5	Very high	96.2	Very high	9 Å²	9	56.3 Å²	56.3	7%	0.074	31%	0.308	C	S	.	.	S	Bend	trans	-35.5	147.1	175.6	0	0	0	0	0	115	R153 M264 L309 Y313	R153-A160 PolarHBondContact NE-O 3.4Å; R153-A160 PolarHBondContact NH2-O 3.01Å; A160-M264 VanDerWaalsContact CB-O 3.23Å; A160-M264 WeakPolarHBondContact CB-O 3.28Å; A160-L309 HydrophobicContact CB-CD2 3.62Å; A160-Y313 HydrophobicContact CB-CE1 4.01Å
161	F	97.9	Very high	96.3	Very high	11 Å²	11	57.4 Å²	57.4	5%	0.048	31%	0.314	C	S	.	.			trans	-60.4	146.1	169.6	-80.1	-94.6	0	0	0	110.7	L149 I150 R153 A163 I166 F202 M263 L266 Y313	L149-F161 HydrophobicContact CB-CE1 4.37Å; L149-F161 HydrophobicContact CB-CZ 3.93Å; I150-F161 HydrophobicContact CB-CE2 4.37Å; I150-F161 HydrophobicContact CG1-CE2 3.61Å; I150-F161 HydrophobicContact CG1-CZ 4.25Å; R153-F161 HydrophobicContact CB-CE2 4.44Å; R153-F161 HydrophobicContact CB-CZ 4.28Å; F161-A163 PolarHBondContact O-N 2.83Å; F161-I166 HydrophobicContact CB-CD1 4.26Å; F161-I166 HydrophobicContact CB-CG1 3.88Å; F161-I166 WeakPolarHBondContact O-CD1 3.47Å; F161-F202 AromaticContact CD1-CZ 3.94Å; F161-F202 HydrophobicContact CD1-CZ 3.94Å; F161-F202 HydrophobicContact CE1-CE2 4.43Å; F161-F202 AromaticContact CE1-CZ 3.8Å; F161-F202 HydrophobicContact CE1-CZ 3.8Å; F161-M263 HydrophobicContact CB-CB 4.48Å; F161-M263 HydrophobicContact CB-CE 3.93Å; F161-M263 HydrophobicContact CD1-CE 4.12Å; F161-M263 HydrophobicContact CD2-CB 4.07Å; F161-M263 HydrophobicContact CD2-CE 4.2Å; F161-M263 HydrophobicContact CD2-CG 4.46Å; F161-M263 WeakPolarHBondContact CD2-O 3.41Å; F161-M263 HydrophobicContact CG-CE 3.81Å; F161-M263 PolarHBondContact N-O 3.33Å; F161-M263 VanDerWaalsContact N-O 3.08Å; F161-L266 HydrophobicContact CD2-CD2 3.65Å; F161-L266 HydrophobicContact CE2-CD2 3.51Å; F161-Y313 WeakPolarHBondContact O-CE1 3.42Å; F161-Y313 PolarHBondContact O-OH 3.02Å
162	P	97.2	Very high	96.4	Very high	63 Å²	63	55.5 Å²	55.5	41%	0.409	31%	0.305	S	S	.	.			trans	-52.1	136.4	174.4	-24.4	33.4	0	0	0	111.5	A164 C165 I166	P162-A164 PolarHBondContact O-N 3.34Å; P162-A164 VanDerWaalsContact O-N 3.08Å; P162-C165 WeakPolarHBondContact O-CA 3.43Å; P162-C165 VanDerWaalsContact O-CB 3.32Å; P162-C165 WeakPolarHBondContact O-CB 3.31Å; P162-C165 PolarHBondContact O-N 3.47Å; P162-I166 PolarHBondContact O-N 2.82Å
163	A	96.4	Very high	96.6	Very high	12 Å²	12	50.4 Å²	50.4	10%	0.099	28%	0.283	C	S	.	.	H	α-helix	trans	-51.1	-39.6	-176.9	0	0	0	0	0	113	F161 C165 I166 E167 S312 Y313	F161-A163 PolarHBondContact O-N 2.83Å; A163-C165 VanDerWaalsContact C-N 3.32Å; A163-C165 PolarHBondContact O-N 3.01Å; A163-I166 PolarHBondContact O-N 3.08Å; A163-I166 VanDerWaalsContact O-N 3.17Å; A163-E167 WeakPolarHBondContact O-CG 3.49Å; A163-E167 PolarHBondContact O-N 3.41Å; A163-S312 WeakPolarHBondContact CB-O 3.45Å; A163-Y313 HydrophobicContact CB-CD1 4.08Å; A163-Y313 HydrophobicContact CB-CD2 4.38Å; A163-Y313 HydrophobicContact CB-CE1 4.14Å; A163-Y313 HydrophobicContact CB-CE2 4.46Å; A163-Y313 HydrophobicContact CB-CG 4.2Å
164	A	95.5	Very high	96.8	Very high	68 Å²	68	47.9 Å²	47.9	56%	0.562	27%	0.273	S	S	*	.	H	α-helix	trans	-62.7	-34.1	176.5	0	0	0	0	0	113.7	P162 K168	P162-A164 PolarHBondContact O-N 3.34Å; P162-A164 VanDerWaalsContact O-N 3.08Å; A164-K168 WeakPolarHBondContact O-CB 3.28Å; A164-K168 PolarHBondContact O-N 3.48Å
165	C	97.2	Very high	97	Very high	31 Å²	31	46.2 Å²	46.2	21%	0.209	27%	0.267	C	S	.	.	H	α-helix	trans	-68.6	-42.9	174.1	-64.6	0	0	0	0	110.6	P162 A163 K168 V169 F202	P162-C165 WeakPolarHBondContact O-CA 3.43Å; P162-C165 VanDerWaalsContact O-CB 3.32Å; P162-C165 WeakPolarHBondContact O-CB 3.31Å; P162-C165 PolarHBondContact O-N 3.47Å; A163-C165 VanDerWaalsContact C-N 3.32Å; A163-C165 PolarHBondContact O-N 3.01Å; C165-K168 PolarHBondContact O-N 3.37Å; C165-V169 WeakPolarHBondContact O-CG2 3.41Å; C165-V169 PolarHBondContact O-N 2.85Å; C165-F202 HydrophobicContact CB-CZ 4.44Å
166	I	98.3	Very high	97.3	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-61.9	-46.4	176.7	-54.8	178	0	0	0	110.1	F161 P162 A163 K168 V169 A170 L260 M263 M264 Y313 M316	F161-I166 HydrophobicContact CB-CD1 4.26Å; F161-I166 HydrophobicContact CB-CG1 3.88Å; F161-I166 WeakPolarHBondContact O-CD1 3.47Å; P162-I166 PolarHBondContact O-N 2.82Å; A163-I166 PolarHBondContact O-N 3.08Å; A163-I166 VanDerWaalsContact O-N 3.17Å; I166-K168 VanDerWaalsContact C-N 3.31Å; I166-K168 PolarHBondContact O-N 3.44Å; I166-V169 PolarHBondContact O-N 2.89Å; I166-A170 VanDerWaalsContact O-CB 3.3Å; I166-A170 WeakPolarHBondContact O-CB 3.33Å; I166-A170 PolarHBondContact O-N 3.21Å; I166-L260 HydrophobicContact CG2-CD2 4.11Å; I166-M263 HydrophobicContact CB-CE 4.44Å; I166-M263 HydrophobicContact CB-SD 4.48Å; I166-M263 HydrophobicContact CD1-CB 4.14Å; I166-M263 HydrophobicContact CG1-CB 3.97Å; I166-M263 HydrophobicContact CG1-CE 3.91Å; I166-M263 HydrophobicContact CG1-SD 4.28Å; I166-M263 HydrophobicContact CG2-SD 4.33Å; I166-M264 HydrophobicContact CD1-CG 3.64Å; I166-Y313 HydrophobicContact CD1-CD1 4Å; I166-Y313 HydrophobicContact CD1-CE1 3.73Å; I166-M316 HydrophobicContact CB-CG 4.12Å; I166-M316 HydrophobicContact CB-SD 4.42Å; I166-M316 HydrophobicContact CG2-CB 4.2Å; I166-M316 HydrophobicContact CG2-CG 3.79Å; I166-M316 HydrophobicContact CG2-SD 3.84Å
167	E	97.3	Very high	97.4	Very high	40 Å²	40	34 Å²	34	19%	0.187	21%	0.207	C	C	.	.	H	α-helix	trans	-58.5	-41.5	176.2	-76.5	-179.5	174.2	0	0	112.4	A163 A170 L171 R315 M316	A163-E167 WeakPolarHBondContact O-CG 3.49Å; A163-E167 PolarHBondContact O-N 3.41Å; E167-A170 PolarHBondContact O-N 3.33Å; E167-L171 WeakPolarHBondContact O-CB 3.5Å; E167-L171 PolarHBondContact O-N 3.27Å; E167-R315 IonicContact OE1-CZ 3.79Å; E167-R315 VanDerWaalsContact OE1-CZ 3.24Å; E167-R315 IonicContact OE1-NE 2.74Å; E167-R315 PolarHBondContact OE1-NE 3.22Å; E167-R315 IonicContact OE1-NH2 3.23Å; E167-R315 PolarHBondContact OE1-NH2 3.36Å; E167-R315 IonicContact OE2-CZ 3.98Å; E167-R315 IonicContact OE2-NH2 2.94Å; E167-R315 PolarHBondContact OE2-NH2 3.33Å; E167-M316 HydrophobicContact CB-SD 4.23Å; E167-M316 HydrophobicContact CG-CE 3.5Å; E167-M316 HydrophobicContact CG-CG 3.8Å; E167-M316 HydrophobicContact CG-SD 3.49Å; E167-M316 WeakPolarHBondContact CG-SD 3.34Å
168	K	97.5	Very high	97.6	Very high	79 Å²	79	34.7 Å²	34.7	34%	0.343	19%	0.191	S	C	.	.	H	α-helix	trans	-64.4	-44.8	177.1	-166.5	-179	-172.7	-176.2	0	111.8	A164 C165 I166 H172 F202 I205	A164-K168 WeakPolarHBondContact O-CB 3.28Å; A164-K168 PolarHBondContact O-N 3.48Å; C165-K168 PolarHBondContact O-N 3.37Å; I166-K168 VanDerWaalsContact C-N 3.31Å; I166-K168 PolarHBondContact O-N 3.44Å; K168-H172 WeakPolarHBondContact O-CB 3.35Å; K168-H172 PolarHBondContact O-CD2 3.26Å; K168-H172 PolarHBondContact O-N 3.29Å; K168-H172 VanDerWaalsContact O-N 3.1Å; K168-F202 HydrophobicContact CD-CB 4.1Å; K168-F202 WeakPolarHBondContact CE-O 3.35Å; K168-F202 PolarHBondContact NZ-O 3.35Å; K168-I205 HydrophobicContact CB-CD1 4.47Å; K168-I205 HydrophobicContact CD-CD1 4.26Å; K168-I205 HydrophobicContact CG-CD1 3.85Å
169	V	98.6	Very high	97.8	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-61.9	-48.9	174.4	172.3	0	0	0	0	110.4	L146 C165 I166 L171 H172 V173 F202 I205 M263	L146-V169 HydrophobicContact CD2-CG1 4.09Å; C165-V169 WeakPolarHBondContact O-CG2 3.41Å; C165-V169 PolarHBondContact O-N 2.85Å; I166-V169 PolarHBondContact O-N 2.89Å; V169-L171 VanDerWaalsContact C-N 3.34Å; V169-L171 PolarHBondContact O-N 2.98Å; V169-H172 PolarHBondContact O-N 2.93Å; V169-V173 HydrophobicContact CG1-CG2 4.03Å; V169-V173 WeakPolarHBondContact O-CB 3.42Å; V169-V173 VanDerWaalsContact O-CG2 3.31Å; V169-V173 WeakPolarHBondContact O-CG2 3.41Å; V169-V173 PolarHBondContact O-N 3.36Å; V169-F202 HydrophobicContact CG2-CD1 3.69Å; V169-F202 HydrophobicContact CG2-CE1 3.65Å; V169-I205 HydrophobicContact CG2-CD1 4.09Å; V169-I205 HydrophobicContact CG2-CG1 4.41Å; V169-M263 HydrophobicContact CB-CE 4.35Å; V169-M263 HydrophobicContact CB-SD 3.91Å; V169-M263 HydrophobicContact CG1-SD 3.87Å; V169-M263 HydrophobicContact CG2-CE 3.92Å; V169-M263 HydrophobicContact CG2-SD 4.04Å
170	A	98.7	Very high	98	Very high	0 Å²	0	26 Å²	26	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-53.6	-50.2	179.2	0	0	0	0	0	111.5	I166 E167 A174 F256 L260 M316 L319 L341	I166-A170 VanDerWaalsContact O-CB 3.3Å; I166-A170 WeakPolarHBondContact O-CB 3.33Å; I166-A170 PolarHBondContact O-N 3.21Å; E167-A170 PolarHBondContact O-N 3.33Å; A170-A174 WeakPolarHBondContact O-CB 3.22Å; A170-A174 PolarHBondContact O-N 3.49Å; A170-F256 HydrophobicContact CB-CE2 4.48Å; A170-F256 HydrophobicContact CB-CZ 4Å; A170-L260 HydrophobicContact CB-CD1 4.33Å; A170-L260 HydrophobicContact CB-CD2 3.77Å; A170-M316 HydrophobicContact CB-SD 4.17Å; A170-L319 HydrophobicContact CB-CD2 4.23Å; A170-L341 HydrophobicContact CB-CD1 3.94Å
171	L	98.5	Very high	98.1	Very high	25 Å²	25	25.7 Å²	25.7	13%	0.131	14%	0.136	C	C	.	.	H	α-helix	trans	-63.3	-45.7	179.7	176.3	60.1	0	0	0	112.3	E167 V169 R175 L341 E342	E167-L171 WeakPolarHBondContact O-CB 3.5Å; E167-L171 PolarHBondContact O-N 3.27Å; V169-L171 VanDerWaalsContact C-N 3.34Å; V169-L171 PolarHBondContact O-N 2.98Å; L171-R175 HydrophobicContact CD1-CG 4.39Å; L171-R175 WeakPolarHBondContact O-CG 3.16Å; L171-R175 PolarHBondContact O-N 3.35Å; L171-L341 HydrophobicContact CB-CB 4.42Å; L171-L341 HydrophobicContact CB-CD1 4.08Å; L171-L341 HydrophobicContact CD1-CB 3.9Å; L171-E342 HydrophobicContact CD1-CG 3.79Å
172	H	98.6	Very high	98.1	Very high	31 Å²	31	28 Å²	28	14%	0.144	15%	0.15	C	C	.	.	H	α-helix	trans	-68.2	-42.5	-176.9	-80.5	-133.9	0	0	0	112	N119 K168 V169 R175 G176 I205	N119-H172 WeakPolarHBondContact CB-O 3.43Å; N119-H172 VanDerWaalsContact CG-O 3.25Å; N119-H172 WeakPolarHBondContact ND2-CB 3.41Å; N119-H172 PolarHBondContact ND2-ND1 3.03Å; K168-H172 WeakPolarHBondContact O-CB 3.35Å; K168-H172 PolarHBondContact O-CD2 3.26Å; K168-H172 PolarHBondContact O-N 3.29Å; K168-H172 VanDerWaalsContact O-N 3.1Å; V169-H172 PolarHBondContact O-N 2.93Å; H172-R175 PolarHBondContact O-N 2.79Å; H172-G176 PolarHBondContact O-N 2.79Å; H172-G176 VanDerWaalsContact O-N 3.15Å; H172-I205 HydrophobicContact CB-CB 3.74Å; H172-I205 HydrophobicContact CB-CD1 4.02Å; H172-I205 HydrophobicContact CB-CG2 3.84Å
173	V	98.8	Very high	98.1	Very high	1 Å²	1	31.1 Å²	31.1	1%	0.006	16%	0.159	C	C	.	.	H	α-helix	trans	-67.6	-43.3	176.4	175.7	0	0	0	0	110.3	V169 R175 G176 L177 M191 I196 I205 I207 F256	V169-V173 HydrophobicContact CG1-CG2 4.03Å; V169-V173 WeakPolarHBondContact O-CB 3.42Å; V169-V173 VanDerWaalsContact O-CG2 3.31Å; V169-V173 WeakPolarHBondContact O-CG2 3.41Å; V169-V173 PolarHBondContact O-N 3.36Å; V173-R175 VanDerWaalsContact C-N 3.3Å; V173-R175 PolarHBondContact O-N 2.96Å; V173-G176 WeakPolarHBondContact O-CA 3.33Å; V173-G176 PolarHBondContact O-N 3.22Å; V173-L177 HydrophobicContact CG1-CD1 4.18Å; V173-L177 HydrophobicContact CG1-CG 4.39Å; V173-L177 PolarHBondContact O-N 3.19Å; V173-M191 HydrophobicContact CG1-CE 3.77Å; V173-I196 HydrophobicContact CG2-CD1 3.76Å; V173-I196 HydrophobicContact CG2-CG1 4.07Å; V173-I196 HydrophobicContact CG2-CG2 4.27Å; V173-I205 HydrophobicContact CG2-CG2 4.13Å; V173-I207 HydrophobicContact CG1-CD1 4.01Å; V173-I207 HydrophobicContact CG1-CG1 4.21Å; V173-F256 HydrophobicContact CB-CD2 4.17Å; V173-F256 HydrophobicContact CB-CE2 3.94Å; V173-F256 HydrophobicContact CG1-CD2 3.57Å; V173-F256 HydrophobicContact CG1-CE2 3.88Å
174	A	98.8	Very high	98.2	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-60.3	-37.7	176.5	0	0	0	0	0	112.6	A170 L177 K178 F256 I337 V338	A170-A174 WeakPolarHBondContact O-CB 3.22Å; A170-A174 PolarHBondContact O-N 3.49Å; A174-L177 PolarHBondContact O-N 3.29Å; A174-K178 VanDerWaalsContact O-CB 3.27Å; A174-K178 WeakPolarHBondContact O-CB 3.43Å; A174-K178 PolarHBondContact O-N 3.15Å; A174-F256 HydrophobicContact CB-CZ 4.49Å; A174-I337 HydrophobicContact CB-CB 4.16Å; A174-I337 HydrophobicContact CB-CG2 3.63Å; A174-V338 VanDerWaalsContact C-CG2 3.42Å; A174-V338 HydrophobicContact CB-CG2 3.72Å
175	R	98.8	Very high	98.3	Very high	77 Å²	77	34.5 Å²	34.5	29%	0.291	16%	0.158	S	C	.	.	H	α-helix	trans	-62.5	-42.9	172.3	-75.7	173.2	174.5	158.4	-2.9	112.1	L171 H172 V173 Y179 V338 E342	L171-R175 HydrophobicContact CD1-CG 4.39Å; L171-R175 WeakPolarHBondContact O-CG 3.16Å; L171-R175 PolarHBondContact O-N 3.35Å; H172-R175 PolarHBondContact O-N 2.79Å; V173-R175 VanDerWaalsContact C-N 3.3Å; V173-R175 PolarHBondContact O-N 2.96Å; R175-Y179 PolarHBondContact O-N 2.8Å; R175-Y179 VanDerWaalsContact O-N 3.12Å; R175-V338 HydrophobicContact CB-CG2 4.42Å; R175-V338 HydrophobicContact CG-CG1 4.05Å; R175-V338 HydrophobicContact CG-CG2 3.87Å; R175-E342 IonicContact CZ-OE1 2.79Å; R175-E342 VanDerWaalsContact CZ-OE1 3.23Å; R175-E342 IonicContact NE-OE1 3.02Å; R175-E342 PolarHBondContact NE-OE1 3.28Å; R175-E342 IonicContact NH2-OE1 3.24Å; R175-E342 PolarHBondContact NH2-OE1 3.42Å
176	G	98.8	Very high	98.3	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-61.3	-47.9	174.5	0	0	0	0	0	112.6	H172 V173 Y179 L180	H172-G176 PolarHBondContact O-N 2.79Å; H172-G176 VanDerWaalsContact O-N 3.15Å; V173-G176 WeakPolarHBondContact O-CA 3.33Å; V173-G176 PolarHBondContact O-N 3.22Å; G176-Y179 WeakPolarHBondContact O-CB 3.41Å; G176-Y179 PolarHBondContact O-N 3.02Å; G176-L180 WeakPolarHBondContact O-CG 3.45Å; G176-L180 PolarHBondContact O-N 2.86Å
177	L	98.8	Very high	98.3	Very high	1 Å²	1	33.2 Å²	33.2	1%	0.005	15%	0.149	C	C	.	.	H	α-helix	trans	-63.3	-42.9	177.4	-71.9	177.7	0	0	0	112.2	V173 A174 Y179 L180 H181 H188 M191 I207 D252 F256 A334	V173-L177 HydrophobicContact CG1-CD1 4.18Å; V173-L177 HydrophobicContact CG1-CG 4.39Å; V173-L177 PolarHBondContact O-N 3.19Å; A174-L177 PolarHBondContact O-N 3.29Å; L177-Y179 VanDerWaalsContact C-N 3.28Å; L177-Y179 PolarHBondContact O-N 2.82Å; L177-L180 PolarHBondContact O-N 2.82Å; L177-L180 VanDerWaalsContact O-N 3.13Å; L177-H181 WeakPolarHBondContact O-CB 3.33Å; L177-H181 PolarHBondContact O-N 3.22Å; L177-H188 HydrophobicContact CD2-CB 4.28Å; L177-M191 HydrophobicContact CD2-CG 4.01Å; L177-M191 HydrophobicContact CD2-SD 3.85Å; L177-I207 HydrophobicContact CD2-CD1 4.12Å; L177-I207 HydrophobicContact CG-CD1 3.99Å; L177-D252 HydrophobicContact CD1-CB 4.49Å; L177-D252 HydrophobicContact CD2-CB 4.07Å; L177-F256 HydrophobicContact CD1-CB 3.99Å; L177-F256 HydrophobicContact CD1-CD2 4.33Å; L177-F256 HydrophobicContact CD1-CG 4.27Å; L177-A334 HydrophobicContact CB-CB 3.8Å
178	K	98.8	Very high	98.4	Very high	82 Å²	82	31.3 Å²	31.3	36%	0.357	14%	0.14	S	C	.	.	H	α-helix	trans	-54.6	-46	174.6	178.8	-170	174.9	-177.7	0	111.2	A174 N182 A334 A335 V338	A174-K178 VanDerWaalsContact O-CB 3.27Å; A174-K178 WeakPolarHBondContact O-CB 3.43Å; A174-K178 PolarHBondContact O-N 3.15Å; K178-N182 WeakPolarHBondContact CG-OD1 3.27Å; K178-N182 VanDerWaalsContact O-CB 3.29Å; K178-N182 WeakPolarHBondContact O-CB 3.4Å; K178-N182 PolarHBondContact O-N 3.29Å; K178-N182 PolarHBondContact O-OD1 2.87Å; K178-A334 HydrophobicContact CB-CB 3.99Å; K178-A335 HydrophobicContact CD-CB 4.33Å; K178-A335 HydrophobicContact CG-CB 4.15Å; K178-V338 HydrophobicContact CB-CG2 4.34Å; K178-V338 HydrophobicContact CD-CB 4.38Å; K178-V338 HydrophobicContact CD-CG2 4.2Å
179	Y	98.8	Very high	98.3	Very high	17 Å²	17	27.6 Å²	27.6	7%	0.067	13%	0.125	C	C	.	.	I	π-helix	trans	-61.2	-48	176.5	175.7	-94.2	0	0	0	111.9	I115 N116 H117 I120 R175 G176 L177 E183 K184	I115-Y179 HydrophobicContact CG2-CE1 4.12Å; N116-Y179 PolarHBondContact N-OH 3.47Å; N116-Y179 PolarHBondContact O-OH 3.06Å; H117-Y179 HydrophobicContact CB-CD1 3.81Å; H117-Y179 HydrophobicContact CB-CD2 4.2Å; H117-Y179 HydrophobicContact CB-CE1 3.94Å; H117-Y179 HydrophobicContact CB-CE2 4.32Å; H117-Y179 HydrophobicContact CB-CG 3.91Å; H117-Y179 AromaticContact CD2-CD2 3.6Å; H117-Y179 AromaticContact CD2-CG 3.62Å; H117-Y179 AromaticContact CG-CG 3.81Å; I120-Y179 HydrophobicContact CD1-CD1 3.53Å; I120-Y179 HydrophobicContact CD1-CE1 4.17Å; I120-Y179 HydrophobicContact CD1-CG 4.4Å; R175-Y179 PolarHBondContact O-N 2.8Å; R175-Y179 VanDerWaalsContact O-N 3.12Å; G176-Y179 WeakPolarHBondContact O-CB 3.41Å; G176-Y179 PolarHBondContact O-N 3.02Å; L177-Y179 VanDerWaalsContact C-N 3.28Å; L177-Y179 PolarHBondContact O-N 2.82Å; Y179-E183 HydrophobicContact CD2-CB 4.12Å; Y179-E183 HydrophobicContact CD2-CG 4.23Å; Y179-E183 WeakPolarHBondContact CD2-OE1 3.27Å; Y179-E183 VanDerWaalsContact CD2-OE2 3.32Å; Y179-E183 WeakPolarHBondContact CD2-OE2 3.1Å; Y179-E183 HydrophobicContact CE2-CB 4.32Å; Y179-E183 VanDerWaalsContact CE2-OE2 3.25Å; Y179-E183 WeakPolarHBondContact CE2-OE2 3.43Å; Y179-E183 WeakPolarHBondContact O-CA 3.49Å; Y179-E183 WeakPolarHBondContact O-CB 3.47Å; Y179-E183 PolarHBondContact O-N 3.32Å; Y179-K184 HydrophobicContact CD1-CG 4.11Å; Y179-K184 HydrophobicContact CE1-CD 4.3Å; Y179-K184 HydrophobicContact CE1-CG 3.62Å; Y179-K184 PolarHBondContact O-N 3.37Å; Y179-K184 VanDerWaalsContact O-N 3.1Å; Y179-K184 WeakPolarHBondContact OH-CE 3.22Å
180	L	98.6	Very high	98.1	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	13%	0.129	C	C	.	.	I	π-helix	trans	-60.4	-51.8	178.4	-69.5	178.4	0	0	0	111.8	I115 I120 G176 L177 K184 K185 L186 H188	I115-L180 HydrophobicContact CD1-CD2 3.97Å; I115-L180 HydrophobicContact CG1-CD2 4.46Å; I120-L180 HydrophobicContact CD1-CD1 4.17Å; I120-L180 HydrophobicContact CD1-CD2 3.67Å; I120-L180 HydrophobicContact CD1-CG 3.62Å; G176-L180 WeakPolarHBondContact O-CG 3.45Å; G176-L180 PolarHBondContact O-N 2.86Å; L177-L180 PolarHBondContact O-N 2.82Å; L177-L180 VanDerWaalsContact O-N 3.13Å; L180-K184 CarbonylContact O-C 3.43Å; L180-K184 WeakPolarHBondContact O-CA 3.49Å; L180-K184 WeakPolarHBondContact O-CB 3.45Å; L180-K184 PolarHBondContact O-N 2.86Å; L180-K185 PolarHBondContact O-N 3Å; L180-L186 CarbonylContact C-O 3.5Å; L180-L186 VanDerWaalsContact C-O 3.3Å; L180-L186 WeakPolarHBondContact CB-O 3.1Å; L180-L186 HydrophobicContact CD2-CD2 4.21Å; L180-L186 PolarHBondContact O-N 3.05Å; L180-H188 HydrophobicContact CD1-CB 4.17Å
181	H	98.6	Very high	98.1	Very high	1 Å²	1	28.4 Å²	28.4	1%	0.005	13%	0.129	C	C	.	.	I	π-helix	trans	-67.5	-49.7	-176	-60.6	166.8	0	0	0	112.2	L177 K185 L186 D249 D252	L177-H181 WeakPolarHBondContact O-CB 3.33Å; L177-H181 PolarHBondContact O-N 3.22Å; H181-K185 WeakPolarHBondContact O-CA 3.38Å; H181-K185 PolarHBondContact O-N 3.09Å; H181-L186 PolarHBondContact CD2-O 3.25Å; H181-D249 HydrophobicContact CB-CB 4.39Å; H181-D249 PolarHBondContact CE1-O 3Å; H181-D252 IonicContact CD2-OD2 3.57Å; H181-D252 IonicContact CE1-OD2 2.85Å; H181-D252 IonicContact NE2-OD2 3.67Å; H181-D252 PolarHBondContact NE2-OD2 3.44Å
182	N	98.2	Very high	98	Very high	61 Å²	61	28.5 Å²	28.5	33%	0.326	13%	0.128	S	C	.	.	I	π-helix	trans	-90.5	-39.1	-168.8	-57.5	127.6	0	0	0	113.4	K178	K178-N182 WeakPolarHBondContact CG-OD1 3.27Å; K178-N182 VanDerWaalsContact O-CB 3.29Å; K178-N182 WeakPolarHBondContact O-CB 3.4Å; K178-N182 PolarHBondContact O-N 3.29Å; K178-N182 PolarHBondContact O-OD1 2.87Å
183	E	97.6	Very high	98	Very high	128 Å²	128	27 Å²	27	60%	0.598	12%	0.121	S	C	*	.	I	π-helix	trans	-94.7	-35.1	-176.7	-60.3	-178.9	-138.1	0	0	112.8	Y179	Y179-E183 HydrophobicContact CD2-CB 4.12Å; Y179-E183 HydrophobicContact CD2-CG 4.23Å; Y179-E183 WeakPolarHBondContact CD2-OE1 3.27Å; Y179-E183 VanDerWaalsContact CD2-OE2 3.32Å; Y179-E183 WeakPolarHBondContact CD2-OE2 3.1Å; Y179-E183 HydrophobicContact CE2-CB 4.32Å; Y179-E183 VanDerWaalsContact CE2-OE2 3.25Å; Y179-E183 WeakPolarHBondContact CE2-OE2 3.43Å; Y179-E183 WeakPolarHBondContact O-CA 3.49Å; Y179-E183 WeakPolarHBondContact O-CB 3.47Å; Y179-E183 PolarHBondContact O-N 3.32Å
184	K	97.4	Very high	97.8	Very high	77 Å²	77	29 Å²	29	34%	0.335	13%	0.134	S	C	.	.	S	Bend	trans	-99	-11.5	179.8	-60.4	-57.2	-179.6	-174.5	0	114.9	G114 Y179 L180 L186	G114-K184 WeakPolarHBondContact O-CE 3.32Å; G114-K184 PolarHBondContact O-NZ 3.38Å; Y179-K184 HydrophobicContact CD1-CG 4.11Å; Y179-K184 HydrophobicContact CE1-CD 4.3Å; Y179-K184 HydrophobicContact CE1-CG 3.62Å; Y179-K184 PolarHBondContact O-N 3.37Å; Y179-K184 VanDerWaalsContact O-N 3.1Å; Y179-K184 WeakPolarHBondContact OH-CE 3.22Å; L180-K184 CarbonylContact O-C 3.43Å; L180-K184 WeakPolarHBondContact O-CA 3.49Å; L180-K184 WeakPolarHBondContact O-CB 3.45Å; L180-K184 PolarHBondContact O-N 2.86Å; K184-L186 HydrophobicContact CB-CB 4.08Å; K184-L186 PolarHBondContact O-N 2.76Å
185	K	97.9	Very high	97.7	Very high	74 Å²	74	29.5 Å²	29.5	32%	0.322	14%	0.137	S	C	.	.			trans	49.3	51.1	-174	-57	-63.8	-175.1	173.8	0	110.1	L180 H181 L216 M220	L180-K185 PolarHBondContact O-N 3Å; H181-K185 WeakPolarHBondContact O-CA 3.38Å; H181-K185 PolarHBondContact O-N 3.09Å; K185-L216 HydrophobicContact CB-CB 4.31Å; K185-L216 PolarHBondContact O-N 3.41Å; K185-M220 HydrophobicContact CD-CE 4.16Å
186	L	97.8	Very high	97.7	Very high	4 Å²	4	25.8 Å²	25.8	2%	0.021	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	124.6	-174.7	-165.2	76.3	0	0	0	109.3	L111 I115 L180 H181 K184 L214	L111-L186 HydrophobicContact CD2-CD1 3.93Å; L111-L186 HydrophobicContact CD2-CD2 4.43Å; I115-L186 HydrophobicContact CD1-CD2 4.34Å; L180-L186 CarbonylContact C-O 3.5Å; L180-L186 VanDerWaalsContact C-O 3.3Å; L180-L186 WeakPolarHBondContact CB-O 3.1Å; L180-L186 HydrophobicContact CD2-CD2 4.21Å; L180-L186 PolarHBondContact O-N 3.05Å; H181-L186 PolarHBondContact CD2-O 3.25Å; K184-L186 HydrophobicContact CB-CB 4.08Å; K184-L186 PolarHBondContact O-N 2.76Å; L186-L214 CarbonylContact C-O 3.59Å; L186-L214 WeakPolarHBondContact CA-O 3.5Å
187	L	98.1	Very high	97.6	Very high	0 Å²	0	27 Å²	27	0%	0	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	130.5	166.2	-172.8	72.1	0	0	0	108.3	S213 L214 L216 V222 Y229 I247 T248 A251 D252	L187-S213 CarbonylContact O-C 3.35Å; L187-S213 WeakPolarHBondContact O-CA 3.42Å; L187-S213 WeakPolarHBondContact O-CB 3.37Å; L187-S213 PolarHBondContact O-OG 3.02Å; L187-L214 HydrophobicContact CB-CB 4.26Å; L187-L214 HydrophobicContact CD2-CB 4.41Å; L187-L214 HydrophobicContact CD2-CD1 4.34Å; L187-L214 PolarHBondContact N-O 3.46Å; L187-L214 PolarHBondContact O-N 2.94Å; L187-L216 HydrophobicContact CB-CD1 4.35Å; L187-L216 HydrophobicContact CB-CD2 3.99Å; L187-L216 HydrophobicContact CB-CG 4.14Å; L187-V222 HydrophobicContact CD2-CG2 3.92Å; L187-Y229 HydrophobicContact CD2-CD2 3.82Å; L187-Y229 HydrophobicContact CD2-CE2 3.65Å; L187-Y229 HydrophobicContact CG-CE2 4.42Å; L187-I247 HydrophobicContact CD2-CG2 3.74Å; L187-T248 WeakPolarHBondContact CD1-O 3.43Å; L187-A251 HydrophobicContact CD1-CB 4.49Å; L187-D252 HydrophobicContact CD1-CB 4.22Å; L187-D252 WeakPolarHBondContact CD1-OD2 3.41Å
188	H	97.9	Very high	97.4	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	13%	0.131	C	C	.	.			trans	-63.9	-50	178	-178.2	-87.2	0	0	0	111.2	L177 L180 D190 M191 I207 C208 D209 S213 D252	L177-H188 HydrophobicContact CD2-CB 4.28Å; L180-H188 HydrophobicContact CD1-CB 4.17Å; H188-D190 PolarHBondContact CE1-O 3.19Å; H188-D190 VanDerWaalsContact CE1-O 3.32Å; H188-D190 PolarHBondContact ND1-N 3.04Å; H188-D190 PolarHBondContact ND1-O 2.97Å; H188-D190 PolarHBondContact O-N 2.95Å; H188-M191 HydrophobicContact CB-CG 3.97Å; H188-M191 HydrophobicContact CB-SD 3.88Å; H188-M191 PolarHBondContact ND1-N 2.81Å; H188-M191 PolarHBondContact ND1-SD 3.23Å; H188-M191 VanDerWaalsContact ND1-SD 3.36Å; H188-I207 VanDerWaalsContact CD2-CG2 3.5Å; H188-I207 WeakPolarHBondContact CD2-CG2 3.1Å; H188-I207 WeakPolarHBondContact NE2-CG2 3.4Å; H188-C208 PolarHBondContact NE2-O 3.16Å; H188-C208 VanDerWaalsContact NE2-O 3.09Å; H188-D209 PolarHBondContact NE2-O 2.93Å; H188-S213 VanDerWaalsContact O-CA 3.27Å; H188-S213 WeakPolarHBondContact O-CA 3.38Å; H188-S213 PolarHBondContact O-N 3.35Å; H188-S213 PolarHBondContact O-OG 2.75Å; H188-D252 WeakPolarHBondContact CB-OD2 3.35Å; H188-D252 PolarHBondContact N-OD2 2.94Å
189	G	95.4	Very high	97.1	Very high	1 Å²	1	27.6 Å²	27.6	1%	0.01	13%	0.133	C	C	.	.	S	Bend	trans	89.2	-12.4	169	0	0	0	0	0	116	Y229 G231 D252	G189-Y229 VanDerWaalsContact O-CE1 3.3Å; G189-Y229 WeakPolarHBondContact O-CE1 3.39Å; G189-Y229 PolarHBondContact O-OH 3.04Å; G189-G231 WeakPolarHBondContact O-CA 3.24Å; G189-G231 PolarHBondContact O-N 2.83Å; G189-D252 PolarHBondContact N-OD1 3.12Å
190	D	95.9	Very high	96.8	Very high	16 Å²	16	28.8 Å²	28.8	9%	0.086	15%	0.151	C	C	.	.			trans	-146.6	55	175.2	-173.4	34.9	0	0	0	111.9	H188 K192 N195 V212 T232	H188-D190 PolarHBondContact CE1-O 3.19Å; H188-D190 VanDerWaalsContact CE1-O 3.32Å; H188-D190 PolarHBondContact ND1-N 3.04Å; H188-D190 PolarHBondContact ND1-O 2.97Å; H188-D190 PolarHBondContact O-N 2.95Å; D190-K192 VanDerWaalsContact CG-NZ 3.26Å; D190-K192 PolarHBondContact O-N 3.37Å; D190-K192 IonicContact OD1-NZ 3.67Å; D190-K192 PolarHBondContact OD1-NZ 3.36Å; D190-K192 VanDerWaalsContact OD2-CE 3.28Å; D190-K192 WeakPolarHBondContact OD2-CE 3.37Å; D190-K192 IonicContact OD2-NZ 3.59Å; D190-K192 PolarHBondContact OD2-NZ 3.28Å; D190-N195 PolarHBondContact O-ND2 3.33Å; D190-N195 PolarHBondContact OD2-ND2 3.15Å; D190-V212 HydrophobicContact CB-CG2 3.57Å; D190-T232 PolarHBondContact OD1-N 3.41Å; D190-T232 PolarHBondContact OD1-OG1 2.79Å
191	M	97.6	Very high	96.5	Very high	1 Å²	1	34.8 Å²	34.8	1%	0.005	18%	0.183	C	C	.	.			trans	-73.4	125	177.7	-74.5	-54.9	-50.5	0	0	111.4	V173 L177 H188 I196 I207 D252 A255	V173-M191 HydrophobicContact CG1-CE 3.77Å; L177-M191 HydrophobicContact CD2-CG 4.01Å; L177-M191 HydrophobicContact CD2-SD 3.85Å; H188-M191 HydrophobicContact CB-CG 3.97Å; H188-M191 HydrophobicContact CB-SD 3.88Å; H188-M191 PolarHBondContact ND1-N 2.81Å; H188-M191 PolarHBondContact ND1-SD 3.23Å; H188-M191 VanDerWaalsContact ND1-SD 3.36Å; M191-I196 HydrophobicContact CE-CD1 4.39Å; M191-I196 HydrophobicContact CE-CG1 4.35Å; M191-I207 HydrophobicContact CE-CD1 4.28Å; M191-I207 HydrophobicContact CE-CG1 4.3Å; M191-I207 HydrophobicContact CE-CG2 4.27Å; M191-I207 HydrophobicContact SD-CD1 4.37Å; M191-I207 HydrophobicContact SD-CG2 3.84Å; M191-D252 HydrophobicContact CG-CB 4.16Å; M191-A255 HydrophobicContact CB-CB 3.77Å; M191-A255 WeakPolarHBondContact O-CB 3.45Å
192	K	96.9	Very high	96.4	Very high	27 Å²	27	35.5 Å²	35.5	12%	0.117	19%	0.186	C	C	.	.	S	Bend	trans	-167.6	168.1	176.8	58.8	-170.5	175.7	-150.2	0	110.6	D190 C194 N195 T232 W235	D190-K192 VanDerWaalsContact CG-NZ 3.26Å; D190-K192 PolarHBondContact O-N 3.37Å; D190-K192 IonicContact OD1-NZ 3.67Å; D190-K192 PolarHBondContact OD1-NZ 3.36Å; D190-K192 VanDerWaalsContact OD2-CE 3.28Å; D190-K192 WeakPolarHBondContact OD2-CE 3.37Å; D190-K192 IonicContact OD2-NZ 3.59Å; D190-K192 PolarHBondContact OD2-NZ 3.28Å; K192-C194 HydrophobicContact CD-CB 4.23Å; K192-C194 HydrophobicContact CG-CB 4.08Å; K192-C194 PolarHBondContact O-N 2.89Å; K192-N195 WeakPolarHBondContact CE-ND2 3.45Å; K192-N195 HydrophobicContact CG-CB 4.33Å; K192-N195 PolarHBondContact O-N 2.98Å; K192-T232 PolarHBondContact NZ-OG1 3.23Å; K192-W235 HydrophobicContact CB-CD2 3.83Å; K192-W235 HydrophobicContact CB-CE3 4.49Å; K192-W235 HydrophobicContact CB-CG 4.03Å; K192-W235 HydrophobicContact CB-CH2 4.48Å; K192-W235 HydrophobicContact CB-CZ2 3.87Å; K192-W235 HydrophobicContact CD-CE3 4.44Å; K192-W235 HydrophobicContact CD-CH2 4.41Å; K192-W235 HydrophobicContact CD-CZ3 4.37Å
193	S	97.6	Very high	96.1	Very high	0 Å²	0	39 Å²	39	0%	0	20%	0.201	C	C	.	.	G	3₁₀ helix	trans	-56.2	-33.9	177.9	64.8	0	0	0	0	114.1	L146 N147 N195 I196 E262	L146-S193 WeakPolarHBondContact CB-O 3.45Å; L146-S193 PolarHBondContact N-O 3.13Å; N147-S193 WeakPolarHBondContact CB-OG 3.43Å; N147-S193 PolarHBondContact N-O 3.15Å; S193-N195 PolarHBondContact O-N 2.82Å; S193-I196 PolarHBondContact O-N 2.98Å; S193-E262 VanDerWaalsContact CB-OE1 3.25Å; S193-E262 WeakPolarHBondContact CB-OE1 3.4Å; S193-E262 WeakPolarHBondContact CB-OE2 3.43Å; S193-E262 PolarHBondContact N-OE2 3.26Å; S193-E262 PolarHBondContact OG-OE1 3Å
194	C	95.3	Very high	96	Very high	41 Å²	41	35 Å²	35	28%	0.277	19%	0.185	S	C	.	.	G	3₁₀ helix	trans	-62.9	-26.7	176.2	-58.6	0	0	0	0	113.7	N147 K192	N147-C194 HydrophobicContact CB-CB 4.39Å; N147-C194 VanDerWaalsContact CB-SG 3.55Å; K192-C194 HydrophobicContact CD-CB 4.23Å; K192-C194 HydrophobicContact CG-CB 4.08Å; K192-C194 PolarHBondContact O-N 2.89Å
195	N	97	Very high	96.1	Very high	11 Å²	11	31.3 Å²	31.3	6%	0.059	17%	0.169	C	C	.	.	G	3₁₀ helix	trans	-100.3	15.6	-176.7	-71.6	-13.1	0	0	0	112.7	D190 K192 S193 C208	D190-N195 PolarHBondContact O-ND2 3.33Å; D190-N195 PolarHBondContact OD2-ND2 3.15Å; K192-N195 WeakPolarHBondContact CE-ND2 3.45Å; K192-N195 HydrophobicContact CG-CB 4.33Å; K192-N195 PolarHBondContact O-N 2.98Å; S193-N195 PolarHBondContact O-N 2.82Å; N195-C208 PolarHBondContact O-N 3.27Å; N195-C208 PolarHBondContact O-SG 3.48Å
196	I	98.2	Very high	96.1	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	118.6	171.4	-63.5	161.8	0	0	0	107.6	S145 L146 V173 M191 S193 I198 I205 K206 T259	S145-I196 CarbonylContact C-O 3.51Å; S145-I196 VanDerWaalsContact CA-O 3.29Å; S145-I196 WeakPolarHBondContact CA-O 3.29Å; L146-I196 HydrophobicContact CB-CB 4.05Å; L146-I196 HydrophobicContact CB-CG2 4.18Å; L146-I196 HydrophobicContact CD2-CB 4.46Å; L146-I196 HydrophobicContact CD2-CD1 4.03Å; L146-I196 HydrophobicContact CD2-CG2 4.44Å; L146-I196 PolarHBondContact N-O 2.92Å; V173-I196 HydrophobicContact CG2-CD1 3.76Å; V173-I196 HydrophobicContact CG2-CG1 4.07Å; V173-I196 HydrophobicContact CG2-CG2 4.27Å; M191-I196 HydrophobicContact CE-CD1 4.39Å; M191-I196 HydrophobicContact CE-CG1 4.35Å; S193-I196 PolarHBondContact O-N 2.98Å; I196-I198 HydrophobicContact CG2-CD1 3.98Å; I196-I205 HydrophobicContact CG2-CG2 3.84Å; I196-K206 WeakPolarHBondContact CA-O 3.48Å; I196-T259 HydrophobicContact CD1-CG2 3.39Å
197	V	96.9	Very high	96.1	Very high	24 Å²	24	28.3 Å²	28.3	15%	0.145	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	138.1	178.6	-66.5	0	0	0	0	111	V121 K206	V121-V197 HydrophobicContact CG2-CG2 3.76Å; V197-K206 HydrophobicContact CG2-CB 3.96Å; V197-K206 WeakPolarHBondContact CG2-O 3.31Å; V197-K206 PolarHBondContact N-O 3.21Å; V197-K206 PolarHBondContact O-N 3.01Å
198	I	95.6	Very high	96	Very high	4 Å²	4	29.3 Å²	29.3	2%	0.021	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	130.7	-173.5	-52	-65.9	0	0	0	108.9	G142 E143 Q144 L146 L149 I196 F202 T204 I205	G142-I198 CarbonylContact C-O 3.59Å; G142-I198 WeakPolarHBondContact CA-O 3.43Å; E143-I198 PolarHBondContact N-O 3.42Å; E143-I198 VanDerWaalsContact N-O 3.15Å; Q144-I198 PolarHBondContact O-N 3.37Å; L146-I198 HydrophobicContact CB-CG1 4.42Å; L149-I198 HydrophobicContact CD1-CB 4.02Å; L149-I198 HydrophobicContact CD1-CG1 3.89Å; L149-I198 HydrophobicContact CD1-CG2 4.09Å; I196-I198 HydrophobicContact CG2-CD1 3.98Å; I198-F202 HydrophobicContact CD1-CD1 4.23Å; I198-F202 HydrophobicContact CD1-CE1 4.37Å; I198-F202 HydrophobicContact CG2-CD1 4.21Å; I198-F202 HydrophobicContact CG2-CG 4.3Å; I198-T204 WeakPolarHBondContact CA-O 3.49Å; I198-I205 HydrophobicContact CD1-CB 4.14Å; I198-I205 HydrophobicContact CD1-CG1 3.62Å; I198-I205 HydrophobicContact CD1-CG2 3.95Å
199	K	92.6	Very high	95.6	Very high	92 Å²	92	31.8 Å²	31.8	40%	0.4	18%	0.176	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	132	172.3	-163.8	-176.7	174.4	-176.5	0	111.4	E143 E203 T204	E143-K199 VanDerWaalsContact OE2-CA 3.25Å; E143-K199 WeakPolarHBondContact OE2-CA 3.17Å; E143-K199 WeakPolarHBondContact OE2-CG 3.4Å; K199-E203 PolarHBondContact O-N 3.32Å; K199-T204 PolarHBondContact N-O 2.9Å; K199-T204 PolarHBondContact O-N 3.36Å
200	G	91.4	Very high	95.4	Very high	43 Å²	43	31.8 Å²	31.8	44%	0.443	18%	0.175	S	C	.	.	T	Hydrogen-bonded Turn	trans	60.1	-151.7	-178.9	0	0	0	0	0	112.4	E143 F202	E143-G200 PolarHBondContact OE2-N 3.09Å; G200-F202 VanDerWaalsContact C-N 3.26Å; G200-F202 PolarHBondContact O-N 2.91Å
201	D	92.8	Very high	95	Very high	125 Å²	125	32.1 Å²	32.1	67%	0.668	18%	0.182	S	C	*	.	T	Hydrogen-bonded Turn	trans	-82.3	72.2	175.4	-172.3	20.7	0	0	0	110.9	E203	D201-E203 PolarHBondContact O-N 2.76Å
202	F	95.2	Very high	94.6	Very high	17 Å²	17	34.2 Å²	34.2	8%	0.075	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	55.1	25	-174.8	-64.4	-97.7	0	0	0	113.6	L146 L149 F161 C165 K168 V169 I198 G200 I205 M263	L146-F202 HydrophobicContact CD1-CE1 4.44Å; L149-F202 HydrophobicContact CD1-CE1 4.48Å; L149-F202 HydrophobicContact CD1-CE2 4.43Å; L149-F202 HydrophobicContact CD1-CZ 4Å; F161-F202 AromaticContact CD1-CZ 3.94Å; F161-F202 HydrophobicContact CD1-CZ 3.94Å; F161-F202 HydrophobicContact CE1-CE2 4.43Å; F161-F202 AromaticContact CE1-CZ 3.8Å; F161-F202 HydrophobicContact CE1-CZ 3.8Å; C165-F202 HydrophobicContact CB-CZ 4.44Å; K168-F202 HydrophobicContact CD-CB 4.1Å; K168-F202 WeakPolarHBondContact CE-O 3.35Å; K168-F202 PolarHBondContact NZ-O 3.35Å; V169-F202 HydrophobicContact CG2-CD1 3.69Å; V169-F202 HydrophobicContact CG2-CE1 3.65Å; I198-F202 HydrophobicContact CD1-CD1 4.23Å; I198-F202 HydrophobicContact CD1-CE1 4.37Å; I198-F202 HydrophobicContact CG2-CD1 4.21Å; I198-F202 HydrophobicContact CG2-CG 4.3Å; G200-F202 VanDerWaalsContact C-N 3.26Å; G200-F202 PolarHBondContact O-N 2.91Å; F202-I205 HydrophobicContact CB-CD1 4.46Å; F202-I205 HydrophobicContact CD1-CD1 4.45Å; F202-M263 HydrophobicContact CE1-CE 4.25Å
203	E	93.8	Very high	94.5	Very high	135 Å²	135	33.6 Å²	33.6	63%	0.631	19%	0.194	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.4	-40.9	-178.1	-64.8	177.7	-180	0	0	111.2	K199 D201	K199-E203 PolarHBondContact O-N 3.32Å; D201-E203 PolarHBondContact O-N 2.76Å
204	T	95.4	Very high	94.4	Very high	43 Å²	43	34.6 Å²	34.6	26%	0.264	20%	0.199	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	135.8	173.5	-52.6	0	0	0	0	109.5	I198 K199 K206	I198-T204 WeakPolarHBondContact CA-O 3.49Å; K199-T204 PolarHBondContact N-O 2.9Å; K199-T204 PolarHBondContact O-N 3.36Å; T204-K206 HydrophobicContact CG2-CD 3.87Å; T204-K206 HydrophobicContact CG2-CG 3.95Å
205	I	98.4	Very high	94.5	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	120.1	178.3	-62.2	145.8	0	0	0	106.3	N119 K168 V169 H172 V173 I196 I198 F202	N119-I205 PolarHBondContact ND2-O 3.48Å; K168-I205 HydrophobicContact CB-CD1 4.47Å; K168-I205 HydrophobicContact CD-CD1 4.26Å; K168-I205 HydrophobicContact CG-CD1 3.85Å; V169-I205 HydrophobicContact CG2-CD1 4.09Å; V169-I205 HydrophobicContact CG2-CG1 4.41Å; H172-I205 HydrophobicContact CB-CB 3.74Å; H172-I205 HydrophobicContact CB-CD1 4.02Å; H172-I205 HydrophobicContact CB-CG2 3.84Å; V173-I205 HydrophobicContact CG2-CG2 4.13Å; I196-I205 HydrophobicContact CG2-CG2 3.84Å; I198-I205 HydrophobicContact CD1-CB 4.14Å; I198-I205 HydrophobicContact CD1-CG1 3.62Å; I198-I205 HydrophobicContact CD1-CG2 3.95Å; F202-I205 HydrophobicContact CB-CD1 4.46Å; F202-I205 HydrophobicContact CD1-CD1 4.45Å
206	K	98.4	Very high	94.5	Very high	14 Å²	14	37.7 Å²	37.7	6%	0.061	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	139.4	-176.3	-74.7	167	175.4	-84.4	0	111.3	P118 N119 I120 V121 E139 I196 V197 T204	P118-K206 VanDerWaalsContact O-CE 3.25Å; P118-K206 WeakPolarHBondContact O-CE 3.13Å; P118-K206 VanDerWaalsContact O-CG 3.27Å; P118-K206 WeakPolarHBondContact O-CG 3.47Å; P118-K206 PolarHBondContact O-NZ 3.05Å; N119-K206 CarbonylContact O-C 3.6Å; N119-K206 WeakPolarHBondContact O-CA 3.13Å; I120-K206 PolarHBondContact O-NZ 3.49Å; V121-K206 HydrophobicContact CG2-CB 3.99Å; V121-K206 HydrophobicContact CG2-CD 4.32Å; E139-K206 WeakPolarHBondContact OE1-CE 3.11Å; E139-K206 IonicContact OE1-NZ 3.39Å; E139-K206 PolarHBondContact OE1-NZ 2.83Å; E139-K206 IonicContact OE2-NZ 2.61Å; E139-K206 PolarHBondContact OE2-NZ 3.28Å; I196-K206 WeakPolarHBondContact CA-O 3.48Å; V197-K206 HydrophobicContact CG2-CB 3.96Å; V197-K206 WeakPolarHBondContact CG2-O 3.31Å; V197-K206 PolarHBondContact N-O 3.21Å; V197-K206 PolarHBondContact O-N 3.01Å; T204-K206 HydrophobicContact CG2-CD 3.87Å; T204-K206 HydrophobicContact CG2-CG 3.95Å
207	I	98.4	Very high	94.5	Very high	0 Å²	0	40 Å²	40	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	140.7	165.9	-54.5	173.1	0	0	0	108.5	N119 I120 V121 V173 L177 H188 M191	N119-I207 PolarHBondContact O-N 3.49Å; I120-I207 CarbonylContact C-O 3.46Å; I120-I207 WeakPolarHBondContact CA-O 3.42Å; V121-I207 PolarHBondContact N-O 3.06Å; V173-I207 HydrophobicContact CG1-CD1 4.01Å; V173-I207 HydrophobicContact CG1-CG1 4.21Å; L177-I207 HydrophobicContact CD2-CD1 4.12Å; L177-I207 HydrophobicContact CG-CD1 3.99Å; H188-I207 VanDerWaalsContact CD2-CG2 3.5Å; H188-I207 WeakPolarHBondContact CD2-CG2 3.1Å; H188-I207 WeakPolarHBondContact NE2-CG2 3.4Å; M191-I207 HydrophobicContact CE-CD1 4.28Å; M191-I207 HydrophobicContact CE-CG1 4.3Å; M191-I207 HydrophobicContact CE-CG2 4.27Å; M191-I207 HydrophobicContact SD-CD1 4.37Å; M191-I207 HydrophobicContact SD-CG2 3.84Å
208	C	95.2	Very high	94.4	Very high	22 Å²	22	47.2 Å²	47.2	15%	0.149	25%	0.254	C	S	.	.			trans	-134.2	172.9	173.4	69	0	0	0	0	111.7	V121 H188 N195	V121-C208 HydrophobicContact CB-CB 4.06Å; V121-C208 HydrophobicContact CG2-CB 3.7Å; H188-C208 PolarHBondContact NE2-O 3.16Å; H188-C208 VanDerWaalsContact NE2-O 3.09Å; N195-C208 PolarHBondContact O-N 3.27Å; N195-C208 PolarHBondContact O-SG 3.48Å
209	D	90	Very high	94.4	Very high	52 Å²	52	52.5 Å²	52.5	28%	0.278	28%	0.282	S	S	.	.			trans	65.7	66.3	177.8	-151.8	0.2	0	0	0	115.2	K87 H188 G211	K87-D209 IonicContact NZ-OD1 2.68Å; K87-D209 PolarHBondContact NZ-OD1 2.89Å; K87-D209 IonicContact NZ-OD2 2.83Å; H188-D209 PolarHBondContact NE2-O 2.93Å; D209-G211 PolarHBondContact O-N 2.98Å
210	V	90.9	Very high	94.7	Very high	1 Å²	1	49.6 Å²	49.6	1%	0.006	27%	0.27	C	S	.	.			trans	-82.1	19.1	172.5	-58.8	0	0	0	0	112.8	E108 L111 L112 I115 V212 S213	E108-V210 HydrophobicContact CG-CG2 4.22Å; L111-V210 HydrophobicContact CB-CG2 4.48Å; L112-V210 HydrophobicContact CD1-CG2 4.2Å; L112-V210 HydrophobicContact CD2-CG2 3.46Å; L112-V210 VanDerWaalsContact CD2-CG2 3.46Å; L112-V210 HydrophobicContact CG-CG2 3.47Å; L112-V210 VanDerWaalsContact CG-CG2 3.47Å; I115-V210 HydrophobicContact CD1-CG1 4.26Å; I115-V210 HydrophobicContact CD1-CG2 4.38Å; V210-V212 PolarHBondContact O-N 2.82Å; V210-S213 WeakPolarHBondContact CA-OG 3.49Å; V210-S213 WeakPolarHBondContact CB-OG 3.41Å; V210-S213 WeakPolarHBondContact O-CB 3.44Å; V210-S213 PolarHBondContact O-N 3.05Å; V210-S213 PolarHBondContact O-OG 2.75Å
211	G	86.5	Confident	94.9	Very high	22 Å²	22	52.1 Å²	52.1	23%	0.227	27%	0.267	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.6	-12.7	-173.4	0	0	0	0	0	114.8	D209	D209-G211 PolarHBondContact O-N 2.98Å
212	V	90	Very high	95.1	Very high	45 Å²	45	47.4 Å²	47.4	27%	0.273	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-120.9	18.9	177.3	-61.8	0	0	0	0	112.3	D190 V210 V230	D190-V212 HydrophobicContact CB-CG2 3.57Å; V210-V212 PolarHBondContact O-N 2.82Å; V212-V230 HydrophobicContact CB-CB 4.44Å; V212-V230 HydrophobicContact CG1-CB 4.27Å; V212-V230 HydrophobicContact CG1-CG2 4.4Å
213	S	94.7	Very high	95	Very high	15 Å²	15	49.5 Å²	49.5	11%	0.105	26%	0.259	C	S	.	.			trans	-71.6	146.2	-178.1	-66.3	0	0	0	0	112.7	L187 H188 V210	L187-S213 CarbonylContact O-C 3.35Å; L187-S213 WeakPolarHBondContact O-CA 3.42Å; L187-S213 WeakPolarHBondContact O-CB 3.37Å; L187-S213 PolarHBondContact O-OG 3.02Å; H188-S213 VanDerWaalsContact O-CA 3.27Å; H188-S213 WeakPolarHBondContact O-CA 3.38Å; H188-S213 PolarHBondContact O-N 3.35Å; H188-S213 PolarHBondContact O-OG 2.75Å; V210-S213 WeakPolarHBondContact CA-OG 3.49Å; V210-S213 WeakPolarHBondContact CB-OG 3.41Å; V210-S213 WeakPolarHBondContact O-CB 3.44Å; V210-S213 PolarHBondContact O-N 3.05Å; V210-S213 PolarHBondContact O-OG 2.75Å
214	L	95.9	Very high	94.9	Very high	20 Å²	20	47.1 Å²	47.1	11%	0.105	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	141.6	-176.1	-57.8	-178.2	0	0	0	111	L186 L187 V222 A227 Y229	L186-L214 CarbonylContact C-O 3.59Å; L186-L214 WeakPolarHBondContact CA-O 3.5Å; L187-L214 HydrophobicContact CB-CB 4.26Å; L187-L214 HydrophobicContact CD2-CB 4.41Å; L187-L214 HydrophobicContact CD2-CD1 4.34Å; L187-L214 PolarHBondContact N-O 3.46Å; L187-L214 PolarHBondContact O-N 2.94Å; L214-V222 HydrophobicContact CB-CG1 4.2Å; L214-V222 HydrophobicContact CB-CG2 4.18Å; L214-V222 HydrophobicContact CD1-CG1 4.08Å; L214-V222 HydrophobicContact CD1-CG2 3.94Å; L214-A227 HydrophobicContact CD1-CB 4.4Å; L214-A227 HydrophobicContact CD2-CB 3.91Å; L214-Y229 HydrophobicContact CD1-CD2 4.17Å
215	H	96.9	Very high	94.4	Very high	107 Å²	107	50.8 Å²	50.8	50%	0.495	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.4	139.7	175.8	-76.1	-74.7	0	0	0	111.4	V222 S223	H215-V222 WeakPolarHBondContact O-CA 3.32Å; H215-S223 WeakPolarHBondContact CB-OG 3.49Å; H215-S223 PolarHBondContact O-N 3.4Å; H215-S223 PolarHBondContact O-OG 3.32Å
216	L	97.9	Very high	93.9	Very high	10 Å²	10	59 Å²	59	5%	0.052	31%	0.314	C	S	.	.	B	Isolated β-bridge	trans	-105.5	146	176.4	-63.8	173.2	0	0	0	110.7	K185 L187 M220 R221 V222 D249	K185-L216 HydrophobicContact CB-CB 4.31Å; K185-L216 PolarHBondContact O-N 3.41Å; L187-L216 HydrophobicContact CB-CD1 4.35Å; L187-L216 HydrophobicContact CB-CD2 3.99Å; L187-L216 HydrophobicContact CB-CG 4.14Å; L216-M220 HydrophobicContact CD1-SD 4.35Å; L216-R221 CarbonylContact C-O 3.48Å; L216-R221 VanDerWaalsContact CA-O 3.22Å; L216-R221 WeakPolarHBondContact CA-O 3.09Å; L216-V222 HydrophobicContact CD2-CG2 4.39Å; L216-D249 HydrophobicContact CD1-CB 4.12Å
217	D	97.3	Very high	93.3	Very high	49 Å²	49	59.6 Å²	59.6	26%	0.262	32%	0.322	S	S	.	.			trans	-83	-174.4	171	79.9	-8.3	0	0	0	112	N219 M220 R221	D217-N219 PolarHBondContact O-N 3.46Å; D217-N219 VanDerWaalsContact OD1-CA 3.24Å; D217-N219 WeakPolarHBondContact OD1-CA 3.46Å; D217-N219 WeakPolarHBondContact OD1-CB 3.36Å; D217-N219 PolarHBondContact OD1-N 3.23Å; D217-N219 PolarHBondContact OD2-ND2 3.42Å; D217-M220 PolarHBondContact O-N 2.97Å; D217-M220 PolarHBondContact OD1-N 3.24Å; D217-R221 PolarHBondContact N-O 2.84Å; D217-R221 PolarHBondContact OD1-N 3.01Å
218	E	95.2	Very high	92.8	Very high	176 Å²	176	67.3 Å²	67.3	82%	0.822	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.1	-23.5	177.7	-62.6	-173.3	159.8	0	0	113.2	M220	E218-M220 VanDerWaalsContact C-N 3.35Å
219	N	95.9	Very high	92.5	Very high	114 Å²	114	67.2 Å²	67.2	61%	0.61	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.6	10.1	179	-54.9	-61.2	0	0	0	113.1	D217 R221	D217-N219 PolarHBondContact O-N 3.46Å; D217-N219 VanDerWaalsContact OD1-CA 3.24Å; D217-N219 WeakPolarHBondContact OD1-CA 3.46Å; D217-N219 WeakPolarHBondContact OD1-CB 3.36Å; D217-N219 PolarHBondContact OD1-N 3.23Å; D217-N219 PolarHBondContact OD2-ND2 3.42Å; N219-R221 VanDerWaalsContact C-N 3.26Å; N219-R221 HydrophobicContact CB-CG 4.34Å; N219-R221 PolarHBondContact O-N 3.05Å
220	M	97.5	Very high	92.3	Very high	31 Å²	31	68.7 Å²	68.7	15%	0.153	37%	0.365	C	S	.	.	S	Bend	trans	62.5	28	-176.9	-55.5	-65.9	152.4	0	0	114.2	K185 L216 D217 E218 T248 D249	K185-M220 HydrophobicContact CD-CE 4.16Å; L216-M220 HydrophobicContact CD1-SD 4.35Å; D217-M220 PolarHBondContact O-N 2.97Å; D217-M220 PolarHBondContact OD1-N 3.24Å; E218-M220 VanDerWaalsContact C-N 3.35Å; M220-T248 CarbonylContact O-C 3.51Å; M220-T248 WeakPolarHBondContact O-CA 3.25Å; M220-T248 WeakPolarHBondContact O-CB 3.39Å; M220-D249 HydrophobicContact CB-CB 4.13Å; M220-D249 WeakPolarHBondContact CB-OD1 3.42Å; M220-D249 PolarHBondContact O-N 2.95Å
221	R	97.3	Very high	92.1	Very high	96 Å²	96	69.2 Å²	69.2	36%	0.362	37%	0.37	S	S	.	.	B	Isolated β-bridge	trans	-100.5	150.2	174	-63.3	163.1	179.4	-146.1	-17.9	109.7	L216 D217 N219 S223 E246 I247 T248	L216-R221 CarbonylContact C-O 3.48Å; L216-R221 VanDerWaalsContact CA-O 3.22Å; L216-R221 WeakPolarHBondContact CA-O 3.09Å; D217-R221 PolarHBondContact N-O 2.84Å; D217-R221 PolarHBondContact OD1-N 3.01Å; N219-R221 VanDerWaalsContact C-N 3.26Å; N219-R221 HydrophobicContact CB-CG 4.34Å; N219-R221 PolarHBondContact O-N 3.05Å; R221-S223 PolarHBondContact O-N 3.18Å; R221-S223 VanDerWaalsContact O-N 3.15Å; R221-E246 HydrophobicContact CG-CG 4.32Å; R221-E246 IonicContact CZ-OE1 2.64Å; R221-E246 IonicContact CZ-OE2 2.84Å; R221-E246 IonicContact NE-OE1 2.72Å; R221-E246 PolarHBondContact NE-OE1 3.39Å; R221-E246 IonicContact NE-OE2 2.98Å; R221-E246 PolarHBondContact NE-OE2 3.01Å; R221-E246 IonicContact NH1-OE1 3.75Å; R221-E246 IonicContact NH1-OE2 3.42Å; R221-E246 PolarHBondContact NH1-OE2 2.79Å; R221-E246 VanDerWaalsContact NH2-CD 3.28Å; R221-E246 IonicContact NH2-OE1 3.59Å; R221-E246 PolarHBondContact NH2-OE1 2.99Å; R221-E246 IonicContact NH2-OE2 3.46Å; R221-E246 PolarHBondContact NH2-OE2 2.56Å; R221-I247 WeakPolarHBondContact CA-O 3.18Å; R221-T248 HydrophobicContact CG-CG2 3.91Å
222	V	96.6	Very high	92.3	Very high	27 Å²	27	69.1 Å²	69.1	16%	0.164	37%	0.365	C	S	.	.	B	Isolated β-bridge	trans	-56.6	122.9	170.9	174.2	0	0	0	0	108.9	L187 L214 H215 L216 A227 I247	L187-V222 HydrophobicContact CD2-CG2 3.92Å; L214-V222 HydrophobicContact CB-CG1 4.2Å; L214-V222 HydrophobicContact CB-CG2 4.18Å; L214-V222 HydrophobicContact CD1-CG1 4.08Å; L214-V222 HydrophobicContact CD1-CG2 3.94Å; H215-V222 WeakPolarHBondContact O-CA 3.32Å; L216-V222 HydrophobicContact CD2-CG2 4.39Å; V222-A227 HydrophobicContact CG1-CB 3.93Å; V222-I247 HydrophobicContact CB-CB 4.47Å; V222-I247 HydrophobicContact CG2-CB 3.79Å; V222-I247 HydrophobicContact CG2-CG2 3.56Å; V222-I247 PolarHBondContact N-O 3.22Å
223	S	93.1	Very high	92.4	Very high	61 Å²	61	70.4 Å²	70.4	43%	0.427	37%	0.368	S	S	.	.	S	Bend	trans	-78.6	-28	-168.2	61.2	0	0	0	0	113.5	H215 R221	H215-S223 WeakPolarHBondContact CB-OG 3.49Å; H215-S223 PolarHBondContact O-N 3.4Å; H215-S223 PolarHBondContact O-OG 3.32Å; R221-S223 PolarHBondContact O-N 3.18Å; R221-S223 VanDerWaalsContact O-N 3.15Å
224	D	91.6	Very high	92.5	Very high	84 Å²	84	70 Å²	70	45%	0.449	37%	0.366	S	S	.	.			trans	-96.9	114.7	179.6	-176.7	-2.3	0	0	0	109.6	E226 A227	D224-E226 PolarHBondContact O-N 3.39Å; D224-E226 PolarHBondContact OD1-N 3.27Å; D224-A227 HydrophobicContact CB-CB 3.87Å; D224-A227 WeakPolarHBondContact O-CB 3.36Å; D224-A227 PolarHBondContact O-N 2.95Å
225	P	84.4	Confident	92.6	Very high	121 Å²	121	69.3 Å²	69.3	79%	0.786	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.7	-22.6	178.1	-21.3	33.6	0	0	0	114.2
226	E	87.3	Confident	92.5	Very high	171 Å²	171	64.7 Å²	64.7	80%	0.799	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.1	-4.9	179.9	-56.1	-61.3	133.1	0	0	112	D224 E228	D224-E226 PolarHBondContact O-N 3.39Å; D224-E226 PolarHBondContact OD1-N 3.27Å; E226-E228 PolarHBondContact O-N 3.4Å
227	A	87.3	Confident	92.5	Very high	28 Å²	28	64.2 Å²	64.2	23%	0.231	34%	0.338	C	S	.	.			trans	-68.9	127.6	177.2	0	0	0	0	0	111	L214 V222 D224	L214-A227 HydrophobicContact CD1-CB 4.4Å; L214-A227 HydrophobicContact CD2-CB 3.91Å; V222-A227 HydrophobicContact CG1-CB 3.93Å; D224-A227 HydrophobicContact CB-CB 3.87Å; D224-A227 WeakPolarHBondContact O-CB 3.36Å; D224-A227 PolarHBondContact O-N 2.95Å
228	E	86.6	Confident	92.4	Very high	161 Å²	161	64.6 Å²	64.6	75%	0.752	34%	0.337	S	S	*	.			trans	-94.5	125.6	176.5	-171.1	175.3	-161.4	0	0	110.1	E226 V230	E226-E228 PolarHBondContact O-N 3.4Å; E228-V230 PolarHBondContact O-N 2.94Å
229	Y	90	Very high	92.4	Very high	21 Å²	21	57 Å²	57	8%	0.082	30%	0.302	C	S	.	.			trans	-76.9	111.5	170.2	-170.2	-75.2	0	0	0	109.1	L187 G189 L214 N236 V240 I247 A251	L187-Y229 HydrophobicContact CD2-CD2 3.82Å; L187-Y229 HydrophobicContact CD2-CE2 3.65Å; L187-Y229 HydrophobicContact CG-CE2 4.42Å; G189-Y229 VanDerWaalsContact O-CE1 3.3Å; G189-Y229 WeakPolarHBondContact O-CE1 3.39Å; G189-Y229 PolarHBondContact O-OH 3.04Å; L214-Y229 HydrophobicContact CD1-CD2 4.17Å; Y229-N236 WeakPolarHBondContact CE1-OD1 3.44Å; Y229-V240 HydrophobicContact CD1-CB 4.27Å; Y229-V240 HydrophobicContact CD1-CG1 3.29Å; Y229-V240 HydrophobicContact CD1-CG2 3.94Å; Y229-V240 HydrophobicContact CD2-CG2 4.06Å; Y229-V240 HydrophobicContact CE1-CG1 3.81Å; Y229-V240 HydrophobicContact CE1-CG2 4.08Å; Y229-V240 HydrophobicContact CE2-CG2 4.2Å; Y229-V240 HydrophobicContact CG-CG1 3.83Å; Y229-V240 HydrophobicContact CG-CG2 3.91Å; Y229-I247 HydrophobicContact CD2-CD1 4.48Å; Y229-I247 HydrophobicContact CD2-CG2 3.85Å; Y229-I247 HydrophobicContact CE2-CG2 4.36Å; Y229-I247 HydrophobicContact CG-CD1 4.37Å; Y229-A251 HydrophobicContact CE2-CB 4.01Å
230	V	84.6	Confident	92.4	Very high	82 Å²	82	52.8 Å²	52.8	50%	0.497	28%	0.28	S	S	.	.			trans	-79.3	-59.3	-177.9	-177.6	0	0	0	0	110.6	V212 E228	V212-V230 HydrophobicContact CB-CB 4.44Å; V212-V230 HydrophobicContact CG1-CB 4.27Å; V212-V230 HydrophobicContact CG1-CG2 4.4Å; E228-V230 PolarHBondContact O-N 2.94Å
231	G	87.1	Confident	92.2	Very high	12 Å²	12	54.8 Å²	54.8	12%	0.124	29%	0.291	C	S	.	.			trans	53	-161.4	179	0	0	0	0	0	115.7	G189 N236	G189-G231 WeakPolarHBondContact O-CA 3.24Å; G189-G231 PolarHBondContact O-N 2.83Å; G231-N236 WeakPolarHBondContact CA-OD1 3.49Å
232	T	91.6	Very high	91.9	Very high	20 Å²	20	55.9 Å²	55.9	12%	0.123	30%	0.3	C	S	.	.			trans	-136.9	122.7	171	-55.2	0	0	0	0	107.5	D190 K192 P234 W235 N236	D190-T232 PolarHBondContact OD1-N 3.41Å; D190-T232 PolarHBondContact OD1-OG1 2.79Å; K192-T232 PolarHBondContact NZ-OG1 3.23Å; T232-P234 VanDerWaalsContact O-N 3.16Å; T232-W235 HydrophobicContact CG2-CE3 3.62Å; T232-W235 HydrophobicContact CG2-CZ3 3.48Å; T232-W235 VanDerWaalsContact CG2-CZ3 3.48Å; T232-W235 PolarHBondContact O-N 3.22Å; T232-N236 PolarHBondContact N-OD1 2.84Å; T232-N236 PolarHBondContact O-N 3.07Å; T232-N236 PolarHBondContact O-OD1 3.08Å
233	E	92.7	Very high	91.3	Very high	72 Å²	72	65 Å²	65	34%	0.336	34%	0.338	S	S	.	.	G	3₁₀ helix	trans	-46.3	-49.2	-163.6	-69.1	172.8	167.3	0	0	115.6	W235 N236 L298	E233-W235 PolarHBondContact O-N 3.28Å; E233-W235 VanDerWaalsContact O-N 3.08Å; E233-N236 PolarHBondContact O-N 2.84Å; E233-N236 VanDerWaalsContact O-N 3.1Å; E233-L298 HydrophobicContact CB-CD1 4.16Å
234	P	95.2	Very high	90.9	Very high	7 Å²	7	66 Å²	66	5%	0.045	36%	0.358	C	S	.	.	G	3₁₀ helix	trans	-59.4	-22	177.8	-22.7	30.7	0	0	0	115.5	T232 L258 M268 P269 Y294	T232-P234 VanDerWaalsContact O-N 3.16Å; P234-L258 WeakPolarHBondContact O-CD1 3.4Å; P234-M268 HydrophobicContact CG-CE 4.26Å; P234-P269 HydrophobicContact CB-CB 4.13Å; P234-P269 HydrophobicContact CB-CG 4.43Å; P234-Y294 WeakPolarHBondContact CG-OH 3.41Å
235	W	97.7	Very high	90.8	Very high	6 Å²	6	63.5 Å²	63.5	2%	0.023	35%	0.352	C	S	.	.	G	3₁₀ helix	trans	-100.1	-8.6	-179.4	-66.8	-100.3	0	0	0	113.6	K192 T232 E233 A255 L258 E262 M268	K192-W235 HydrophobicContact CB-CD2 3.83Å; K192-W235 HydrophobicContact CB-CE3 4.49Å; K192-W235 HydrophobicContact CB-CG 4.03Å; K192-W235 HydrophobicContact CB-CH2 4.48Å; K192-W235 HydrophobicContact CB-CZ2 3.87Å; K192-W235 HydrophobicContact CD-CE3 4.44Å; K192-W235 HydrophobicContact CD-CH2 4.41Å; K192-W235 HydrophobicContact CD-CZ3 4.37Å; T232-W235 HydrophobicContact CG2-CE3 3.62Å; T232-W235 HydrophobicContact CG2-CZ3 3.48Å; T232-W235 VanDerWaalsContact CG2-CZ3 3.48Å; T232-W235 PolarHBondContact O-N 3.22Å; E233-W235 PolarHBondContact O-N 3.28Å; E233-W235 VanDerWaalsContact O-N 3.08Å; W235-A255 HydrophobicContact CB-CB 4.18Å; W235-L258 HydrophobicContact CB-CD1 4.34Å; W235-L258 HydrophobicContact CG-CD1 4.49Å; W235-E262 WeakPolarHBondContact CZ2-OE1 3.36Å; W235-E262 PolarHBondContact NE1-OE2 3.46Å; W235-M268 HydrophobicContact CH2-CE 3.4Å; W235-M268 VanDerWaalsContact CH2-CE 3.4Å; W235-M268 HydrophobicContact CH2-SD 3.38Å; W235-M268 WeakPolarHBondContact CH2-SD 3.43Å; W235-M268 HydrophobicContact CZ2-CE 4.43Å; W235-M268 HydrophobicContact CZ2-SD 3.98Å; W235-M268 HydrophobicContact CZ3-CE 3.72Å; W235-M268 HydrophobicContact CZ3-SD 4.31Å
236	N	96.6	Very high	91.2	Very high	9 Å²	9	62 Å²	62	5%	0.048	34%	0.335	C	S	.	.			trans	-74.1	131.7	-175.9	-71.9	-7.6	0	0	0	110.2	Y229 G231 T232 E233 V240 L241 G299	Y229-N236 WeakPolarHBondContact CE1-OD1 3.44Å; G231-N236 WeakPolarHBondContact CA-OD1 3.49Å; T232-N236 PolarHBondContact N-OD1 2.84Å; T232-N236 PolarHBondContact O-N 3.07Å; T232-N236 PolarHBondContact O-OD1 3.08Å; E233-N236 PolarHBondContact O-N 2.84Å; E233-N236 VanDerWaalsContact O-N 3.1Å; N236-V240 HydrophobicContact CB-CB 4.48Å; N236-V240 HydrophobicContact CB-CG1 4.07Å; N236-L241 HydrophobicContact CB-CD1 4.47Å; N236-L241 HydrophobicContact CB-CD2 3.79Å; N236-L241 HydrophobicContact CB-CG 4.03Å; N236-G299 WeakPolarHBondContact O-CA 3.32Å; N236-G299 PolarHBondContact O-N 3.37Å
237	P	97.2	Very high	91.6	Very high	0 Å²	0	55.4 Å²	55.4	0%	0	30%	0.304	C	S	.	.			trans	-75.8	163.9	174.4	35.8	-40.2	0	0	0	111.7	E239 V240 L241 A251 F254	P237-E239 VanDerWaalsContact C-N 3.31Å; P237-E239 WeakPolarHBondContact CB-OE2 3.37Å; P237-E239 HydrophobicContact CG-CG 4.35Å; P237-E239 WeakPolarHBondContact CG-OE1 3.4Å; P237-E239 PolarHBondContact O-N 2.86Å; P237-V240 HydrophobicContact CG-CB 4.05Å; P237-V240 HydrophobicContact CG-CG2 3.68Å; P237-V240 WeakPolarHBondContact O-CB 3.49Å; P237-V240 PolarHBondContact O-N 3.17Å; P237-L241 PolarHBondContact O-N 3.2Å; P237-A251 HydrophobicContact CG-CB 3.96Å; P237-F254 HydrophobicContact CB-CB 3.91Å; P237-F254 HydrophobicContact CB-CD1 3.63Å; P237-F254 HydrophobicContact CB-CD2 4.16Å; P237-F254 HydrophobicContact CB-CE1 4.14Å; P237-F254 HydrophobicContact CB-CG 3.64Å; P237-F254 HydrophobicContact CG-CD1 4.5Å
238	K	95.8	Very high	92.1	Very high	58 Å²	58	54.9 Å²	54.9	25%	0.252	30%	0.298	S	S	.	.	H	α-helix	trans	-52.4	-43.6	179.4	-80.7	-178.1	179	178.1	0	113.6	V240 L241 E242 E326	K238-V240 PolarHBondContact O-N 3.36Å; K238-V240 VanDerWaalsContact O-N 3.14Å; K238-L241 PolarHBondContact O-N 3.43Å; K238-E242 WeakPolarHBondContact O-CB 3.3Å; K238-E242 WeakPolarHBondContact O-CG 3.49Å; K238-E242 PolarHBondContact O-N 3.3Å; K238-E326 IonicContact NZ-OE1 2.77Å; K238-E326 PolarHBondContact NZ-OE1 3.3Å
239	E	95.4	Very high	92.7	Very high	16 Å²	16	47.8 Å²	47.8	8%	0.075	27%	0.265	C	S	.	.	H	α-helix	trans	-67.3	-14.3	-178.2	70.2	-85	-166.8	0	0	114.5	P237 G245 P328 R331	P237-E239 VanDerWaalsContact C-N 3.31Å; P237-E239 WeakPolarHBondContact CB-OE2 3.37Å; P237-E239 HydrophobicContact CG-CG 4.35Å; P237-E239 WeakPolarHBondContact CG-OE1 3.4Å; P237-E239 PolarHBondContact O-N 2.86Å; E239-G245 CarbonylContact O-C 3.47Å; E239-G245 VanDerWaalsContact O-CA 3.3Å; E239-G245 WeakPolarHBondContact O-CA 3.41Å; E239-P328 HydrophobicContact CB-CG 4.48Å; E239-P328 VanDerWaalsContact CD-CG 3.48Å; E239-P328 HydrophobicContact CG-CG 4.1Å; E239-P328 WeakPolarHBondContact OE2-CG 3.26Å; E239-R331 IonicContact OE1-CZ 2.93Å; E239-R331 IonicContact OE1-NH1 3.72Å; E239-R331 PolarHBondContact OE1-NH1 3.37Å; E239-R331 IonicContact OE1-NH2 3.8Å; E239-R331 PolarHBondContact OE1-NH2 3.18Å; E239-R331 IonicContact OE2-CZ 3.38Å; E239-R331 IonicContact OE2-NH1 2.75Å; E239-R331 IonicContact OE2-NH2 2.83Å; E239-R331 PolarHBondContact OE2-NH2 3.11Å
240	V	95.1	Very high	93.1	Very high	26 Å²	26	48.1 Å²	48.1	16%	0.158	27%	0.267	C	S	.	.	H	α-helix	trans	-87.6	-37	171.5	164.4	0	0	0	0	110.8	Y229 N236 P237 K238 I247 A251	Y229-V240 HydrophobicContact CD1-CB 4.27Å; Y229-V240 HydrophobicContact CD1-CG1 3.29Å; Y229-V240 HydrophobicContact CD1-CG2 3.94Å; Y229-V240 HydrophobicContact CD2-CG2 4.06Å; Y229-V240 HydrophobicContact CE1-CG1 3.81Å; Y229-V240 HydrophobicContact CE1-CG2 4.08Å; Y229-V240 HydrophobicContact CE2-CG2 4.2Å; Y229-V240 HydrophobicContact CG-CG1 3.83Å; Y229-V240 HydrophobicContact CG-CG2 3.91Å; N236-V240 HydrophobicContact CB-CB 4.48Å; N236-V240 HydrophobicContact CB-CG1 4.07Å; P237-V240 HydrophobicContact CG-CB 4.05Å; P237-V240 HydrophobicContact CG-CG2 3.68Å; P237-V240 WeakPolarHBondContact O-CB 3.49Å; P237-V240 PolarHBondContact O-N 3.17Å; K238-V240 PolarHBondContact O-N 3.36Å; K238-V240 VanDerWaalsContact O-N 3.14Å; V240-I247 HydrophobicContact CG2-CD1 4.39Å; V240-I247 HydrophobicContact CG2-CG1 4.07Å; V240-I247 HydrophobicContact CG2-CG2 4.38Å; V240-A251 HydrophobicContact CG2-CB 4.21Å
241	L	92.9	Very high	93.8	Very high	72 Å²	72	44.2 Å²	44.2	38%	0.377	24%	0.244	S	C	.	.	H	α-helix	trans	-77.7	-32.1	-177.9	-61.2	170.4	0	0	0	112.3	N236 P237 K238 L298	N236-L241 HydrophobicContact CB-CD1 4.47Å; N236-L241 HydrophobicContact CB-CD2 3.79Å; N236-L241 HydrophobicContact CB-CG 4.03Å; P237-L241 PolarHBondContact O-N 3.2Å; K238-L241 PolarHBondContact O-N 3.43Å; L241-L298 HydrophobicContact CD1-CB 3.53Å
242	E	90.4	Very high	94.3	Very high	120 Å²	120	43.7 Å²	43.7	56%	0.561	24%	0.238	S	C	*	.	S	Bend	trans	-80.4	133.5	-179.6	-71	177.1	-176.7	0	0	111.7	K238 G244 G245	K238-E242 WeakPolarHBondContact O-CB 3.3Å; K238-E242 WeakPolarHBondContact O-CG 3.49Å; K238-E242 PolarHBondContact O-N 3.3Å; E242-G244 PolarHBondContact O-N 3.37Å; E242-G244 VanDerWaalsContact O-N 3.17Å; E242-G245 PolarHBondContact O-N 3.23Å; E242-G245 VanDerWaalsContact O-N 3.13Å
243	K	85.5	Confident	94.7	Very high	217 Å²	217	42.7 Å²	42.7	94%	0.943	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.9	120.6	178.5	-172.1	178.2	-178.2	178	0	111.1
244	G	83.9	Confident	95	Very high	83 Å²	83	39.3 Å²	39.3	86%	0.856	22%	0.216	S	C	*	.	T	Hydrogen-bonded Turn	trans	83.1	12.9	178.5	0	0	0	0	0	114.1	E242	E242-G244 PolarHBondContact O-N 3.37Å; E242-G244 VanDerWaalsContact O-N 3.17Å
245	G	88.6	Confident	95.1	Very high	31 Å²	31	39 Å²	39	32%	0.32	21%	0.214	S	C	.	.			trans	-63.8	143.9	169.5	0	0	0	0	0	112.2	E239 E242 I247	E239-G245 CarbonylContact O-C 3.47Å; E239-G245 VanDerWaalsContact O-CA 3.3Å; E239-G245 WeakPolarHBondContact O-CA 3.41Å; E242-G245 PolarHBondContact O-N 3.23Å; E242-G245 VanDerWaalsContact O-N 3.13Å; G245-I247 PolarHBondContact O-N 3.23Å
246	E	93.8	Very high	95.2	Very high	91 Å²	91	38.9 Å²	38.9	43%	0.425	21%	0.214	S	C	.	.			trans	-85	110.2	178.8	-177.2	174.2	80.7	0	0	109.7	R221 T248	R221-E246 HydrophobicContact CG-CG 4.32Å; R221-E246 IonicContact CZ-OE1 2.64Å; R221-E246 IonicContact CZ-OE2 2.84Å; R221-E246 IonicContact NE-OE1 2.72Å; R221-E246 PolarHBondContact NE-OE1 3.39Å; R221-E246 IonicContact NE-OE2 2.98Å; R221-E246 PolarHBondContact NE-OE2 3.01Å; R221-E246 IonicContact NH1-OE1 3.75Å; R221-E246 IonicContact NH1-OE2 3.42Å; R221-E246 PolarHBondContact NH1-OE2 2.79Å; R221-E246 VanDerWaalsContact NH2-CD 3.28Å; R221-E246 IonicContact NH2-OE1 3.59Å; R221-E246 PolarHBondContact NH2-OE1 2.99Å; R221-E246 IonicContact NH2-OE2 3.46Å; R221-E246 PolarHBondContact NH2-OE2 2.56Å; E246-T248 HydrophobicContact CG-CG2 4.28Å
247	I	96.8	Very high	95.3	Very high	31 Å²	31	38.4 Å²	38.4	16%	0.159	21%	0.212	C	C	.	.			trans	-83.1	129.7	-179.6	-56.3	165.3	0	0	0	109.7	L187 R221 V222 Y229 V240 G245 A251	L187-I247 HydrophobicContact CD2-CG2 3.74Å; R221-I247 WeakPolarHBondContact CA-O 3.18Å; V222-I247 HydrophobicContact CB-CB 4.47Å; V222-I247 HydrophobicContact CG2-CB 3.79Å; V222-I247 HydrophobicContact CG2-CG2 3.56Å; V222-I247 PolarHBondContact N-O 3.22Å; Y229-I247 HydrophobicContact CD2-CD1 4.48Å; Y229-I247 HydrophobicContact CD2-CG2 3.85Å; Y229-I247 HydrophobicContact CE2-CG2 4.36Å; Y229-I247 HydrophobicContact CG-CD1 4.37Å; V240-I247 HydrophobicContact CG2-CD1 4.39Å; V240-I247 HydrophobicContact CG2-CG1 4.07Å; V240-I247 HydrophobicContact CG2-CG2 4.38Å; G245-I247 PolarHBondContact O-N 3.23Å; I247-A251 HydrophobicContact CG2-CB 4.29Å
248	T	97.8	Very high	95.4	Very high	18 Å²	18	38.4 Å²	38.4	11%	0.11	21%	0.212	C	C	.	.	B	Isolated β-bridge	trans	-134.6	175.8	-179	59.7	0	0	0	0	111.1	L187 M220 R221 E246 K250 A251	L187-T248 WeakPolarHBondContact CD1-O 3.43Å; M220-T248 CarbonylContact O-C 3.51Å; M220-T248 WeakPolarHBondContact O-CA 3.25Å; M220-T248 WeakPolarHBondContact O-CB 3.39Å; R221-T248 HydrophobicContact CG-CG2 3.91Å; E246-T248 HydrophobicContact CG-CG2 4.28Å; T248-K250 PolarHBondContact O-N 3.4Å; T248-K250 WeakPolarHBondContact OG1-CB 3.28Å; T248-K250 PolarHBondContact OG1-N 3.13Å; T248-A251 WeakPolarHBondContact O-CB 3.33Å; T248-A251 PolarHBondContact O-N 3.11Å
249	D	98.4	Very high	95.5	Very high	11 Å²	11	35.7 Å²	35.7	6%	0.059	20%	0.2	C	C	.	.	T	Hydrogen-bonded Turn	trans	-48.6	-26.1	169.5	72.5	-53.4	0	0	0	113.4	H181 L216 M220 A251 D252	H181-D249 HydrophobicContact CB-CB 4.39Å; H181-D249 PolarHBondContact CE1-O 3Å; L216-D249 HydrophobicContact CD1-CB 4.12Å; M220-D249 HydrophobicContact CB-CB 4.13Å; M220-D249 WeakPolarHBondContact CB-OD1 3.42Å; M220-D249 PolarHBondContact O-N 2.95Å; D249-A251 PolarHBondContact O-N 3.5Å; D249-D252 PolarHBondContact O-N 3.15Å
250	K	98.7	Very high	95.7	Very high	29 Å²	29	35 Å²	35	13%	0.126	20%	0.196	C	C	.	.	H	α-helix	trans	-67.7	-14.8	179.4	-54	-53.7	-170.9	73.1	0	114.6	T248 I253 F254 P328 R331	T248-K250 PolarHBondContact O-N 3.4Å; T248-K250 WeakPolarHBondContact OG1-CB 3.28Å; T248-K250 PolarHBondContact OG1-N 3.13Å; K250-I253 HydrophobicContact CD-CG1 4.17Å; K250-I253 PolarHBondContact O-N 2.94Å; K250-F254 PolarHBondContact O-N 3.5Å; K250-F254 VanDerWaalsContact O-N 3.14Å; K250-P328 HydrophobicContact CB-CB 3.89Å; K250-P328 HydrophobicContact CG-CB 4.36Å; K250-P328 WeakPolarHBondContact CG-O 3.42Å; K250-P328 PolarHBondContact NZ-O 2.96Å; K250-P328 VanDerWaalsContact NZ-O 3.13Å; K250-R331 HydrophobicContact CD-CB 4.36Å; K250-R331 PolarHBondContact NZ-O 2.84Å; K250-R331 PolarHBondContact O-NH1 3.01Å
251	A	98.4	Very high	95.8	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-66.4	-44.4	171.6	0	0	0	0	0	111.1	L187 Y229 P237 V240 I247 T248 D249 I253 F254 A255	L187-A251 HydrophobicContact CD1-CB 4.49Å; Y229-A251 HydrophobicContact CE2-CB 4.01Å; P237-A251 HydrophobicContact CG-CB 3.96Å; V240-A251 HydrophobicContact CG2-CB 4.21Å; I247-A251 HydrophobicContact CG2-CB 4.29Å; T248-A251 WeakPolarHBondContact O-CB 3.33Å; T248-A251 PolarHBondContact O-N 3.11Å; D249-A251 PolarHBondContact O-N 3.5Å; A251-I253 PolarHBondContact O-N 3.32Å; A251-F254 PolarHBondContact O-N 2.61Å; A251-A255 PolarHBondContact O-N 3.02Å
252	D	98.8	Very high	96.1	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-63.1	-33.5	173.7	-76.4	-19.3	0	0	0	111.8	L177 H181 L187 H188 G189 M191 D249 F256	L177-D252 HydrophobicContact CD1-CB 4.49Å; L177-D252 HydrophobicContact CD2-CB 4.07Å; H181-D252 IonicContact CD2-OD2 3.57Å; H181-D252 IonicContact CE1-OD2 2.85Å; H181-D252 IonicContact NE2-OD2 3.67Å; H181-D252 PolarHBondContact NE2-OD2 3.44Å; L187-D252 HydrophobicContact CD1-CB 4.22Å; L187-D252 WeakPolarHBondContact CD1-OD2 3.41Å; H188-D252 WeakPolarHBondContact CB-OD2 3.35Å; H188-D252 PolarHBondContact N-OD2 2.94Å; G189-D252 PolarHBondContact N-OD1 3.12Å; M191-D252 HydrophobicContact CG-CB 4.16Å; D249-D252 PolarHBondContact O-N 3.15Å; D252-F256 WeakPolarHBondContact O-CB 3.16Å; D252-F256 PolarHBondContact O-N 3.27Å
253	I	98.9	Very high	96.5	Very high	0 Å²	0	24.8 Å²	24.8	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-67.3	-39.5	179.4	-55.6	-58.3	0	0	0	111.4	K250 A251 F256 G257 C323 R331 P332 A334 I337	K250-I253 HydrophobicContact CD-CG1 4.17Å; K250-I253 PolarHBondContact O-N 2.94Å; A251-I253 PolarHBondContact O-N 3.32Å; I253-F256 WeakPolarHBondContact O-CB 3.44Å; I253-F256 PolarHBondContact O-N 3.47Å; I253-G257 PolarHBondContact O-N 3.37Å; I253-C323 HydrophobicContact CG2-CB 4.03Å; I253-C323 WeakPolarHBondContact O-CB 3.48Å; I253-R331 HydrophobicContact CG2-CB 4.14Å; I253-P332 HydrophobicContact CG2-CG 4.46Å; I253-P332 WeakPolarHBondContact CG2-O 3.44Å; I253-A334 HydrophobicContact CD1-CB 3.99Å; I253-I337 HydrophobicContact CD1-CD1 4.11Å; I253-I337 HydrophobicContact CG2-CD1 4.12Å
254	F	98.8	Very high	97	Very high	1 Å²	1	14.7 Å²	14.7	0%	0.004	10%	0.101	C	C	.	.	H	α-helix	trans	-62.6	-51.6	175.2	-177.3	-90.9	0	0	0	111.2	P237 K250 A251 F256 G257 L258 G299 C323 T324	P237-F254 HydrophobicContact CB-CB 3.91Å; P237-F254 HydrophobicContact CB-CD1 3.63Å; P237-F254 HydrophobicContact CB-CD2 4.16Å; P237-F254 HydrophobicContact CB-CE1 4.14Å; P237-F254 HydrophobicContact CB-CG 3.64Å; P237-F254 HydrophobicContact CG-CD1 4.5Å; K250-F254 PolarHBondContact O-N 3.5Å; K250-F254 VanDerWaalsContact O-N 3.14Å; A251-F254 PolarHBondContact O-N 2.61Å; F254-F256 VanDerWaalsContact C-N 3.29Å; F254-F256 PolarHBondContact O-N 3.14Å; F254-G257 WeakPolarHBondContact O-CA 3.3Å; F254-G257 PolarHBondContact O-N 3.33Å; F254-L258 HydrophobicContact CD1-CD1 3.87Å; F254-L258 HydrophobicContact CD1-CG 4.3Å; F254-L258 HydrophobicContact CE1-CD1 3.4Å; F254-L258 HydrophobicContact CE1-CG 4.04Å; F254-L258 HydrophobicContact CZ-CD1 4.2Å; F254-L258 PolarHBondContact O-N 2.8Å; F254-G299 VanDerWaalsContact CZ-O 3.3Å; F254-G299 WeakPolarHBondContact CZ-O 3.47Å; F254-C323 WeakPolarHBondContact CA-O 3.48Å; F254-T324 HydrophobicContact CD2-CG2 4.13Å; F254-T324 HydrophobicContact CE2-CG2 4.13Å
255	A	98.6	Very high	97.6	Very high	1 Å²	1	12.3 Å²	12.3	1%	0.008	7%	0.07	C	C	.	.	H	α-helix	trans	-62.8	-34.8	178.4	0	0	0	0	0	112.7	M191 W235 A251 L258 T259	M191-A255 HydrophobicContact CB-CB 3.77Å; M191-A255 WeakPolarHBondContact O-CB 3.45Å; W235-A255 HydrophobicContact CB-CB 4.18Å; A251-A255 PolarHBondContact O-N 3.02Å; A255-L258 PolarHBondContact O-N 2.68Å; A255-T259 PolarHBondContact O-N 2.72Å; A255-T259 PolarHBondContact O-OG1 3.2Å
256	F	98.8	Very high	98	Very high	2 Å²	2	11.2 Å²	11.2	1%	0.009	6%	0.057	C	C	.	.	H	α-helix	trans	-60.5	-45.1	168.7	165	-101.9	0	0	0	112	A170 V173 A174 L177 D252 I253 F254 L258 T259 L260 L319 I337	A170-F256 HydrophobicContact CB-CE2 4.48Å; A170-F256 HydrophobicContact CB-CZ 4Å; V173-F256 HydrophobicContact CB-CD2 4.17Å; V173-F256 HydrophobicContact CB-CE2 3.94Å; V173-F256 HydrophobicContact CG1-CD2 3.57Å; V173-F256 HydrophobicContact CG1-CE2 3.88Å; A174-F256 HydrophobicContact CB-CZ 4.49Å; L177-F256 HydrophobicContact CD1-CB 3.99Å; L177-F256 HydrophobicContact CD1-CD2 4.33Å; L177-F256 HydrophobicContact CD1-CG 4.27Å; D252-F256 WeakPolarHBondContact O-CB 3.16Å; D252-F256 PolarHBondContact O-N 3.27Å; I253-F256 WeakPolarHBondContact O-CB 3.44Å; I253-F256 PolarHBondContact O-N 3.47Å; F254-F256 VanDerWaalsContact C-N 3.29Å; F254-F256 PolarHBondContact O-N 3.14Å; F256-L258 VanDerWaalsContact C-N 3.31Å; F256-L258 PolarHBondContact O-N 3.28Å; F256-T259 WeakPolarHBondContact O-CB 3.2Å; F256-T259 PolarHBondContact O-N 3.46Å; F256-T259 VanDerWaalsContact O-N 3.12Å; F256-L260 HydrophobicContact CE1-CD1 3.94Å; F256-L260 HydrophobicContact CE1-CG 4.45Å; F256-L260 HydrophobicContact CE2-CD2 4.18Å; F256-L260 HydrophobicContact CE2-CG 4.47Å; F256-L260 HydrophobicContact CZ-CD1 3.93Å; F256-L260 HydrophobicContact CZ-CD2 4.18Å; F256-L260 HydrophobicContact CZ-CG 4.24Å; F256-L260 PolarHBondContact O-N 3.15Å; F256-L260 VanDerWaalsContact O-N 3.15Å; F256-L319 HydrophobicContact CE1-CD2 4.25Å; F256-L319 HydrophobicContact CE1-CG 4.48Å; F256-L319 HydrophobicContact CZ-CD2 4.39Å; F256-I337 HydrophobicContact CD1-CD1 4.13Å; F256-I337 HydrophobicContact CE1-CD1 3.91Å; F256-I337 HydrophobicContact CE1-CG2 4.28Å; F256-I337 HydrophobicContact CZ-CG2 4.42Å
257	G	98.8	Very high	97.9	Very high	0 Å²	0	8.3 Å²	8.3	0%	0	5%	0.047	C	C	.	.	H	α-helix	trans	-57.9	-44.2	174.1	0	0	0	0	0	112	I253 F254 T259 L260 W261 F320	I253-G257 PolarHBondContact O-N 3.37Å; F254-G257 WeakPolarHBondContact O-CA 3.3Å; F254-G257 PolarHBondContact O-N 3.33Å; G257-T259 VanDerWaalsContact C-N 3.3Å; G257-T259 PolarHBondContact O-N 3.37Å; G257-L260 WeakPolarHBondContact O-CB 3.49Å; G257-L260 PolarHBondContact O-N 3.43Å; G257-L260 VanDerWaalsContact O-N 3.13Å; G257-W261 PolarHBondContact O-N 3.25Å; G257-W261 VanDerWaalsContact O-N 3.08Å; G257-F320 WeakPolarHBondContact O-CD2 3.41Å
258	L	98.6	Very high	97.7	Very high	0 Å²	0	9.9 Å²	9.9	0%	0	5%	0.054	C	C	.	.	H	α-helix	trans	-63.3	-34.8	175.1	-65.5	-178.1	0	0	0	112.7	P234 W235 F254 A255 F256 L260 W261 E262 P269 P302 F320 T324	P234-L258 WeakPolarHBondContact O-CD1 3.4Å; W235-L258 HydrophobicContact CB-CD1 4.34Å; W235-L258 HydrophobicContact CG-CD1 4.49Å; F254-L258 HydrophobicContact CD1-CD1 3.87Å; F254-L258 HydrophobicContact CD1-CG 4.3Å; F254-L258 HydrophobicContact CE1-CD1 3.4Å; F254-L258 HydrophobicContact CE1-CG 4.04Å; F254-L258 HydrophobicContact CZ-CD1 4.2Å; F254-L258 PolarHBondContact O-N 2.8Å; A255-L258 PolarHBondContact O-N 2.68Å; F256-L258 VanDerWaalsContact C-N 3.31Å; F256-L258 PolarHBondContact O-N 3.28Å; L258-L260 VanDerWaalsContact C-N 3.31Å; L258-L260 PolarHBondContact O-N 2.69Å; L258-W261 CarbonylContact O-C 3.58Å; L258-W261 WeakPolarHBondContact O-CA 3.43Å; L258-W261 VanDerWaalsContact O-CB 3.3Å; L258-W261 WeakPolarHBondContact O-CB 3.48Å; L258-W261 PolarHBondContact O-N 2.94Å; L258-W261 VanDerWaalsContact O-N 3.09Å; L258-E262 WeakPolarHBondContact O-CG 3.4Å; L258-E262 PolarHBondContact O-N 2.97Å; L258-P269 HydrophobicContact CB-CG 4.21Å; L258-P269 HydrophobicContact CD1-CB 4.48Å; L258-P269 HydrophobicContact CD1-CG 4.39Å; L258-P302 HydrophobicContact CD2-CG 3.56Å; L258-F320 HydrophobicContact CD2-CE2 4.37Å; L258-T324 HydrophobicContact CD2-CG2 4.02Å; L258-T324 HydrophobicContact CG-CG2 4.23Å
259	T	98.6	Very high	97.4	Very high	1 Å²	1	9 Å²	9	1%	0.006	5%	0.049	C	C	.	.	H	α-helix	trans	-62.1	-38.3	173.1	-52.1	0	0	0	0	112	L146 I196 A255 F256 G257 W261 E262 M263	L146-T259 HydrophobicContact CD2-CG2 3.84Å; I196-T259 HydrophobicContact CD1-CG2 3.39Å; A255-T259 PolarHBondContact O-N 2.72Å; A255-T259 PolarHBondContact O-OG1 3.2Å; F256-T259 WeakPolarHBondContact O-CB 3.2Å; F256-T259 PolarHBondContact O-N 3.46Å; F256-T259 VanDerWaalsContact O-N 3.12Å; G257-T259 VanDerWaalsContact C-N 3.3Å; G257-T259 PolarHBondContact O-N 3.37Å; T259-W261 VanDerWaalsContact C-N 3.31Å; T259-E262 WeakPolarHBondContact CA-OE2 3.43Å; T259-E262 PolarHBondContact O-N 3.08Å; T259-M263 PolarHBondContact O-N 3Å
260	L	98.6	Very high	96.8	Very high	1 Å²	1	8.8 Å²	8.8	1%	0.005	5%	0.047	C	C	.	.	H	α-helix	trans	-65.9	-38.2	173.7	-56.1	-175.9	0	0	0	111.3	I166 A170 F256 G257 L258 M263 M264 L319	I166-L260 HydrophobicContact CG2-CD2 4.11Å; A170-L260 HydrophobicContact CB-CD1 4.33Å; A170-L260 HydrophobicContact CB-CD2 3.77Å; F256-L260 HydrophobicContact CE1-CD1 3.94Å; F256-L260 HydrophobicContact CE1-CG 4.45Å; F256-L260 HydrophobicContact CE2-CD2 4.18Å; F256-L260 HydrophobicContact CE2-CG 4.47Å; F256-L260 HydrophobicContact CZ-CD1 3.93Å; F256-L260 HydrophobicContact CZ-CD2 4.18Å; F256-L260 HydrophobicContact CZ-CG 4.24Å; F256-L260 PolarHBondContact O-N 3.15Å; F256-L260 VanDerWaalsContact O-N 3.15Å; G257-L260 WeakPolarHBondContact O-CB 3.49Å; G257-L260 PolarHBondContact O-N 3.43Å; G257-L260 VanDerWaalsContact O-N 3.13Å; L258-L260 VanDerWaalsContact C-N 3.31Å; L258-L260 PolarHBondContact O-N 2.69Å; L260-M263 PolarHBondContact O-N 2.84Å; L260-M264 PolarHBondContact O-N 2.9Å; L260-L319 HydrophobicContact CD1-CD2 3.73Å; L260-L319 HydrophobicContact CD1-CG 3.93Å
261	W	98.4	Very high	95.9	Very high	2 Å²	2	10.5 Å²	10.5	1%	0.008	6%	0.058	C	C	.	.	H	α-helix	trans	-61.2	-43.9	174.8	-177.8	95	0	0	0	111.6	G257 L258 T259 M263 M264 T265 S267 M268 P269 Q272 P302 P303 F320	G257-W261 PolarHBondContact O-N 3.25Å; G257-W261 VanDerWaalsContact O-N 3.08Å; L258-W261 CarbonylContact O-C 3.58Å; L258-W261 WeakPolarHBondContact O-CA 3.43Å; L258-W261 VanDerWaalsContact O-CB 3.3Å; L258-W261 WeakPolarHBondContact O-CB 3.48Å; L258-W261 PolarHBondContact O-N 2.94Å; L258-W261 VanDerWaalsContact O-N 3.09Å; T259-W261 VanDerWaalsContact C-N 3.31Å; W261-M263 PolarHBondContact O-N 2.78Å; W261-M264 PolarHBondContact O-N 3.27Å; W261-T265 HydrophobicContact CD2-CG2 3.88Å; W261-T265 VanDerWaalsContact CE2-CG2 3.48Å; W261-T265 HydrophobicContact CE3-CG2 4.49Å; W261-T265 HydrophobicContact CG-CG2 4.22Å; W261-T265 HydrophobicContact CH2-CG2 4.4Å; W261-T265 WeakPolarHBondContact CH2-OG1 3.21Å; W261-T265 HydrophobicContact CZ2-CG2 3.77Å; W261-T265 VanDerWaalsContact CZ3-OG1 3.26Å; W261-T265 WeakPolarHBondContact CZ3-OG1 3.43Å; W261-T265 PolarHBondContact O-N 3.44Å; W261-T265 PolarHBondContact O-OG1 3.32Å; W261-T265 VanDerWaalsContact O-OG1 3.13Å; W261-S267 VanDerWaalsContact CZ3-O 3.24Å; W261-S267 WeakPolarHBondContact CZ3-O 3.17Å; W261-M268 VanDerWaalsContact CZ3-C 3.49Å; W261-M268 WeakPolarHBondContact CZ3-O 2.99Å; W261-P269 HydrophobicContact CE3-CG 4.24Å; W261-P269 HydrophobicContact CZ3-CB 4.4Å; W261-P269 HydrophobicContact CZ3-CG 4.29Å; W261-Q272 HydrophobicContact CH2-CG 4.19Å; W261-P302 HydrophobicContact CD2-CB 4.41Å; W261-P302 HydrophobicContact CD2-CG 3.87Å; W261-P302 HydrophobicContact CE3-CG 4.48Å; W261-P302 HydrophobicContact CG-CG 3.99Å; W261-P302 HydrophobicContact CZ2-CB 3.97Å; W261-P302 HydrophobicContact CZ2-CG 4.33Å; W261-P303 PolarHBondContact NE1-O 3.13Å; W261-F320 HydrophobicContact CB-CD2 3.85Å; W261-F320 HydrophobicContact CB-CE2 3.66Å; W261-F320 HydrophobicContact CB-CZ 4.3Å; W261-F320 AromaticContact CD1-CE1 3.95Å; W261-F320 AromaticContact CD1-CE2 3.72Å; W261-F320 AromaticContact CD1-CZ 3.44Å; W261-F320 VanDerWaalsContact CD1-CZ 3.44Å; W261-F320 AromaticContact CG-CE2 3.95Å; W261-F320 HydrophobicContact CG-CE2 3.95Å; W261-F320 HydrophobicContact CG-CZ 4.13Å
262	E	98.3	Very high	94.2	Very high	1 Å²	1	13.2 Å²	13.2	1%	0.005	7%	0.07	C	C	.	.	H	α-helix	trans	-55.6	-37.8	175	-65	177	80.4	0	0	112.1	I150 S193 W235 L258 T259 L266 P269	I150-E262 HydrophobicContact CD1-CB 3.87Å; S193-E262 VanDerWaalsContact CB-OE1 3.25Å; S193-E262 WeakPolarHBondContact CB-OE1 3.4Å; S193-E262 WeakPolarHBondContact CB-OE2 3.43Å; S193-E262 PolarHBondContact N-OE2 3.26Å; S193-E262 PolarHBondContact OG-OE1 3Å; W235-E262 WeakPolarHBondContact CZ2-OE1 3.36Å; W235-E262 PolarHBondContact NE1-OE2 3.46Å; L258-E262 WeakPolarHBondContact O-CG 3.4Å; L258-E262 PolarHBondContact O-N 2.97Å; T259-E262 WeakPolarHBondContact CA-OE2 3.43Å; T259-E262 PolarHBondContact O-N 3.08Å; E262-L266 WeakPolarHBondContact O-CA 3.48Å; E262-L266 PolarHBondContact O-N 3.33Å; E262-P269 HydrophobicContact CG-CG 4.44Å
263	M	98.4	Very high	92.1	Very high	0 Å²	0	17 Å²	17	0%	0	9%	0.089	C	C	.	.	H	α-helix	trans	-71.9	-28.7	176.3	-63.7	-172.3	72.4	0	0	113.6	L146 I150 F161 I166 V169 F202 T259 L260 W261	L146-M263 HydrophobicContact CD1-CE 3.94Å; L146-M263 HydrophobicContact CD1-CG 4.16Å; L146-M263 HydrophobicContact CD1-SD 4.03Å; L146-M263 HydrophobicContact CD2-CG 4Å; L146-M263 HydrophobicContact CD2-SD 3.89Å; L146-M263 HydrophobicContact CG-CG 4.41Å; I150-M263 HydrophobicContact CD1-CG 4.5Å; F161-M263 HydrophobicContact CB-CB 4.48Å; F161-M263 HydrophobicContact CB-CE 3.93Å; F161-M263 HydrophobicContact CD1-CE 4.12Å; F161-M263 HydrophobicContact CD2-CB 4.07Å; F161-M263 HydrophobicContact CD2-CE 4.2Å; F161-M263 HydrophobicContact CD2-CG 4.46Å; F161-M263 WeakPolarHBondContact CD2-O 3.41Å; F161-M263 HydrophobicContact CG-CE 3.81Å; F161-M263 PolarHBondContact N-O 3.33Å; F161-M263 VanDerWaalsContact N-O 3.08Å; I166-M263 HydrophobicContact CB-CE 4.44Å; I166-M263 HydrophobicContact CB-SD 4.48Å; I166-M263 HydrophobicContact CD1-CB 4.14Å; I166-M263 HydrophobicContact CG1-CB 3.97Å; I166-M263 HydrophobicContact CG1-CE 3.91Å; I166-M263 HydrophobicContact CG1-SD 4.28Å; I166-M263 HydrophobicContact CG2-SD 4.33Å; V169-M263 HydrophobicContact CB-CE 4.35Å; V169-M263 HydrophobicContact CB-SD 3.91Å; V169-M263 HydrophobicContact CG1-SD 3.87Å; V169-M263 HydrophobicContact CG2-CE 3.92Å; V169-M263 HydrophobicContact CG2-SD 4.04Å; F202-M263 HydrophobicContact CE1-CE 4.25Å; T259-M263 PolarHBondContact O-N 3Å; L260-M263 PolarHBondContact O-N 2.84Å; W261-M263 PolarHBondContact O-N 2.78Å
264	M	97.9	Very high	89.9	Confident	6 Å²	6	18.5 Å²	18.5	3%	0.03	10%	0.097	C	C	.	.	H	α-helix	trans	-81.5	-30.1	178.6	-70	-174.7	-71.2	0	0	112	A160 I166 L260 W261 L304 L309 Y313 M316 V317 F320	A160-M264 VanDerWaalsContact CB-O 3.23Å; A160-M264 WeakPolarHBondContact CB-O 3.28Å; I166-M264 HydrophobicContact CD1-CG 3.64Å; L260-M264 PolarHBondContact O-N 2.9Å; W261-M264 PolarHBondContact O-N 3.27Å; M264-L304 HydrophobicContact CB-CD1 4.13Å; M264-L304 HydrophobicContact CE-CD2 3.59Å; M264-L304 HydrophobicContact SD-CD2 4.01Å; M264-L309 HydrophobicContact CB-CD1 4.09Å; M264-L309 HydrophobicContact CB-CD2 4.44Å; M264-L309 HydrophobicContact CG-CD1 4.25Å; M264-L309 HydrophobicContact SD-CD1 3.88Å; M264-Y313 HydrophobicContact CG-CD1 4.35Å; M264-M316 HydrophobicContact SD-CB 4.29Å; M264-V317 HydrophobicContact SD-CG2 4.1Å; M264-F320 HydrophobicContact CE-CB 3.89Å; M264-F320 HydrophobicContact CE-CD1 4.45Å; M264-F320 HydrophobicContact CE-CG 4.14Å
265	T	96.2	Very high	87.4	Confident	32 Å²	32	24 Å²	24	20%	0.196	13%	0.126	C	C	.	.	H	α-helix	trans	-113.2	-15.9	-171.9	71.2	0	0	0	0	114.5	W261 S267 Q272 L304	W261-T265 HydrophobicContact CD2-CG2 3.88Å; W261-T265 VanDerWaalsContact CE2-CG2 3.48Å; W261-T265 HydrophobicContact CE3-CG2 4.49Å; W261-T265 HydrophobicContact CG-CG2 4.22Å; W261-T265 HydrophobicContact CH2-CG2 4.4Å; W261-T265 WeakPolarHBondContact CH2-OG1 3.21Å; W261-T265 HydrophobicContact CZ2-CG2 3.77Å; W261-T265 VanDerWaalsContact CZ3-OG1 3.26Å; W261-T265 WeakPolarHBondContact CZ3-OG1 3.43Å; W261-T265 PolarHBondContact O-N 3.44Å; W261-T265 PolarHBondContact O-OG1 3.32Å; W261-T265 VanDerWaalsContact O-OG1 3.13Å; T265-S267 PolarHBondContact O-N 2.82Å; T265-S267 PolarHBondContact OG1-N 2.68Å; T265-Q272 VanDerWaalsContact CB-NE2 3.25Å; T265-Q272 PolarHBondContact OG1-NE2 3.38Å; T265-L304 HydrophobicContact CG2-CD1 3.46Å; T265-L304 VanDerWaalsContact CG2-CD1 3.46Å
266	L	95.9	Very high	84.7	Confident	9 Å²	9	29.6 Å²	29.6	5%	0.047	16%	0.156	C	C	.	.	S	Bend	trans	59.9	22.6	-175.8	-50.7	-177.3	0	0	0	115.3	I150 R153 R154 L158 F161 E262	I150-L266 HydrophobicContact CG1-CD2 4.42Å; I150-L266 HydrophobicContact CG2-CB 4.11Å; I150-L266 HydrophobicContact CG2-CD2 4.13Å; R153-L266 HydrophobicContact CB-CD1 4.21Å; R153-L266 HydrophobicContact CB-CD2 4.44Å; R153-L266 HydrophobicContact CG-CD1 3.84Å; R153-L266 HydrophobicContact CG-CD2 4.37Å; R154-L266 HydrophobicContact CB-CB 4.34Å; R154-L266 PolarHBondContact NH1-O 3.22Å; L158-L266 WeakPolarHBondContact O-CD1 3.42Å; F161-L266 HydrophobicContact CD2-CD2 3.65Å; F161-L266 HydrophobicContact CE2-CD2 3.51Å; E262-L266 WeakPolarHBondContact O-CA 3.48Å; E262-L266 PolarHBondContact O-N 3.33Å
267	S	92.4	Very high	82	Confident	30 Å²	30	35.9 Å²	35.9	21%	0.21	19%	0.19	C	C	.	.	S	Bend	trans	-129.5	171.2	176.4	-44.3	0	0	0	0	112.4	W261 T265 Q272	W261-S267 VanDerWaalsContact CZ3-O 3.24Å; W261-S267 WeakPolarHBondContact CZ3-O 3.17Å; T265-S267 PolarHBondContact O-N 2.82Å; T265-S267 PolarHBondContact OG1-N 2.68Å; S267-Q272 VanDerWaalsContact CB-CG 3.41Å; S267-Q272 WeakPolarHBondContact OG-CG 3.19Å; S267-Q272 PolarHBondContact OG-NE2 3.18Å
268	M	91.3	Very high	79.4	Confident	64 Å²	64	43.1 Å²	43.1	32%	0.315	22%	0.223	S	C	.	.			trans	-74.6	142.1	171.2	-66.1	-87.4	-65.3	0	0	110.8	P234 W235 W261 L271	P234-M268 HydrophobicContact CG-CE 4.26Å; W235-M268 HydrophobicContact CH2-CE 3.4Å; W235-M268 VanDerWaalsContact CH2-CE 3.4Å; W235-M268 HydrophobicContact CH2-SD 3.38Å; W235-M268 WeakPolarHBondContact CH2-SD 3.43Å; W235-M268 HydrophobicContact CZ2-CE 4.43Å; W235-M268 HydrophobicContact CZ2-SD 3.98Å; W235-M268 HydrophobicContact CZ3-CE 3.72Å; W235-M268 HydrophobicContact CZ3-SD 4.31Å; W261-M268 VanDerWaalsContact CZ3-C 3.49Å; W261-M268 WeakPolarHBondContact CZ3-O 2.99Å; M268-L271 HydrophobicContact CB-CB 4.2Å; M268-L271 HydrophobicContact CB-CD1 3.36Å; M268-L271 HydrophobicContact CB-CG 4.36Å; M268-L271 HydrophobicContact CE-CD1 3.99Å; M268-L271 HydrophobicContact CG-CD1 3.95Å
269	P	92.5	Very high	76.8	Confident	0 Å²	0	52.7 Å²	52.7	0%	0	27%	0.268	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55	141	176	-25.5	34.7	0	0	0	112	P234 L258 W261 E262 L271	P234-P269 HydrophobicContact CB-CB 4.13Å; P234-P269 HydrophobicContact CB-CG 4.43Å; L258-P269 HydrophobicContact CB-CG 4.21Å; L258-P269 HydrophobicContact CD1-CB 4.48Å; L258-P269 HydrophobicContact CD1-CG 4.39Å; W261-P269 HydrophobicContact CE3-CG 4.24Å; W261-P269 HydrophobicContact CZ3-CB 4.4Å; W261-P269 HydrophobicContact CZ3-CG 4.29Å; E262-P269 HydrophobicContact CG-CG 4.44Å; P269-L271 PolarHBondContact O-N 3.25Å
270	H	86.1	Confident	74	Confident	5 Å²	5	57.3 Å²	57.3	2%	0.023	29%	0.293	C	S	.	.	T	Hydrogen-bonded Turn	trans	64.4	-7.5	174.9	-50.2	-66.8	0	0	0	117.6	Y294 R297 T300	H270-Y294 HydrophobicContact CB-CD2 4.36Å; H270-Y294 HydrophobicContact CB-CE2 4.4Å; H270-R297 HydrophobicContact CB-CB 4.49Å; H270-R297 PolarHBondContact CE1-O 2.95Å; H270-T300 PolarHBondContact CE1-O 3.39Å; H270-T300 PolarHBondContact CE1-OG1 3.37Å; H270-T300 PolarHBondContact NE2-O 3.46Å
271	L	79.1	Confident	71.6	Confident	66 Å²	66	67.2 Å²	67.2	35%	0.346	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.4	-28.4	178.5	-84	150.9	0	0	0	114.1	M268 P269 M273 L274	M268-L271 HydrophobicContact CB-CB 4.2Å; M268-L271 HydrophobicContact CB-CD1 3.36Å; M268-L271 HydrophobicContact CB-CG 4.36Å; M268-L271 HydrophobicContact CE-CD1 3.99Å; M268-L271 HydrophobicContact CG-CD1 3.95Å; P269-L271 PolarHBondContact O-N 3.25Å; L271-M273 PolarHBondContact O-N 2.97Å; L271-L274 HydrophobicContact CD2-CD1 3.98Å; L271-L274 WeakPolarHBondContact O-CB 3.42Å; L271-L274 WeakPolarHBondContact O-CG 3.19Å; L271-L274 PolarHBondContact O-N 2.83Å
272	Q	63.1	Low	69	Low	56 Å²	56	72.8 Å²	72.8	26%	0.262	37%	0.369	S	S	.	.	G	3₁₀ helix	trans	-63.8	-24.5	-177.9	-70.5	177.2	-6.5	0	0	114.6	W261 T265 S267 L274	W261-Q272 HydrophobicContact CH2-CG 4.19Å; T265-Q272 VanDerWaalsContact CB-NE2 3.25Å; T265-Q272 PolarHBondContact OG1-NE2 3.38Å; S267-Q272 VanDerWaalsContact CB-CG 3.41Å; S267-Q272 WeakPolarHBondContact OG-CG 3.19Å; S267-Q272 PolarHBondContact OG-NE2 3.18Å; Q272-L274 PolarHBondContact O-N 3.39Å; Q272-L274 VanDerWaalsContact O-N 3.17Å
273	M	54.7	Low	66.4	Low	80 Å²	80	81.1 Å²	81.1	39%	0.394	41%	0.414	S	S	.	.	G	3₁₀ helix	trans	-79.3	7.5	-176.1	-63	-62.3	-65.1	0	0	112.6	L271 P303	L271-M273 PolarHBondContact O-N 2.97Å; M273-P303 HydrophobicContact CG-CG 4.1Å; M273-P303 HydrophobicContact SD-CG 3.62Å
274	L	52.1	Low	64.1	Low	32 Å²	32	85.7 Å²	85.7	17%	0.168	45%	0.446	C	S	.	.	G	3₁₀ helix	trans	-106.7	-9.4	-176.9	-53	172.8	0	0	0	112.3	L271 Q272 F289	L271-L274 HydrophobicContact CD2-CD1 3.98Å; L271-L274 WeakPolarHBondContact O-CB 3.42Å; L271-L274 WeakPolarHBondContact O-CG 3.19Å; L271-L274 PolarHBondContact O-N 2.83Å; Q272-L274 PolarHBondContact O-N 3.39Å; Q272-L274 VanDerWaalsContact O-N 3.17Å; L274-F289 HydrophobicContact CD1-CD2 3.85Å; L274-F289 HydrophobicContact CD1-CE2 3.63Å
275	D	46.4	Very low	61.6	Low	116 Å²	116	90.2 Å²	90.2	62%	0.62	47%	0.468	S	S	*	.	S	Bend	trans	-96.2	3.3	179.1	-67.3	-23.5	0	0	0	112.8
276	N	42.7	Very low	59.5	Low	119 Å²	119	97.9 Å²	97.9	64%	0.636	50%	0.501	S	S	*	.			trans	-90	4.5	-175.1	-82.3	-20.9	0	0	0	114.7	E278	N276-E278 PolarHBondContact O-N 3.11Å; N276-E278 VanDerWaalsContact O-N 3.16Å
277	D	42.5	Very low	57.4	Low	133 Å²	133	103.1 Å²	103.1	71%	0.711	53%	0.527	S	S	*	.	S	Bend	trans	-84.9	92.8	170.7	-69.1	-24.2	0	0	0	108.5
278	E	44.1	Very low	55.8	Low	152 Å²	152	106.6 Å²	106.6	71%	0.71	55%	0.551	S	S	*	*			trans	27.4	120.2	156.5	-62.9	-177.3	169.7	0	0	117.4	N276 N280	N276-E278 PolarHBondContact O-N 3.11Å; N276-E278 VanDerWaalsContact O-N 3.16Å; E278-N280 PolarHBondContact O-N 2.92Å; E278-N280 PolarHBondContact O-ND2 2.82Å
279	E	42.5	Very low	54.7	Low	201 Å²	201	108.5 Å²	108.5	94%	0.939	56%	0.558	S	S	*	*			trans	-44.6	80.6	158.7	-64.9	177.8	166.2	0	0	111.7
280	N	41.3	Very low	54	Low	99 Å²	99	112.6 Å²	112.6	53%	0.529	58%	0.58	S	S	.	*			trans	-95.3	103.1	164.9	-73.7	-68.6	0	0	0	105.9	E278 D282 M285	E278-N280 PolarHBondContact O-N 2.92Å; E278-N280 PolarHBondContact O-ND2 2.82Å; N280-D282 PolarHBondContact O-N 3.08Å; N280-M285 HydrophobicContact CB-CE 3.89Å
281	E	47.3	Very low	53.8	Low	208 Å²	208	117 Å²	117	97%	0.972	60%	0.601	S	S	*	*			trans	-65.6	55.3	170.8	-67.2	-177.3	145.8	0	0	111.6
282	D	44.2	Very low	54	Low	119 Å²	119	119.7 Å²	119.7	64%	0.636	62%	0.616	S	S	*	*			trans	-125.3	116.4	167.1	-158	10.4	0	0	0	109.9	N280 S284	N280-D282 PolarHBondContact O-N 3.08Å; D282-S284 PolarHBondContact O-N 2.84Å
283	D	44	Very low	55.1	Low	176 Å²	176	117.6 Å²	117.6	94%	0.941	61%	0.608	S	S	*	*	S	Bend	trans	-76.3	36.5	-164.6	-148.6	9	0	0	0	112.3
284	S	50	Low	56.7	Low	96 Å²	96	114.7 Å²	114.7	67%	0.671	59%	0.593	S	S	*	*			trans	-142.3	60	174.5	73	0	0	0	0	111.6	D282	D282-S284 PolarHBondContact O-N 2.84Å
285	M	45.9	Very low	58.4	Low	101 Å²	101	118.5 Å²	118.5	50%	0.498	61%	0.605	S	S	.	*			trans	-107.8	95.6	178.9	-162.7	175	-75.9	0	0	110	N280 M287	N280-M285 HydrophobicContact CB-CE 3.89Å; M285-M287 HydrophobicContact CG-CG 4.34Å; M285-M287 PolarHBondContact O-N 3.29Å; M285-M287 HydrophobicContact SD-CG 4.46Å
286	E	50.6	Low	60.4	Low	193 Å²	193	120.8 Å²	120.8	90%	0.902	61%	0.612	S	S	*	*			trans	-57.6	101.4	142.1	-93	-178.5	160.9	0	0	104.7	S288	E286-S288 PolarHBondContact O-N 3.18Å
287	M	51.8	Low	62.8	Low	120 Å²	120	118.9 Å²	118.9	59%	0.591	60%	0.596	S	S	*	*			trans	-56.4	114	168	-59.7	-147.4	-34.3	0	0	105.8	M285 F289	M285-M287 HydrophobicContact CG-CG 4.34Å; M285-M287 PolarHBondContact O-N 3.29Å; M285-M287 HydrophobicContact SD-CG 4.46Å; M287-F289 PolarHBondContact O-N 2.86Å
288	S	59.4	Low	65.2	Low	102 Å²	102	113.1 Å²	113.1	71%	0.713	57%	0.565	S	S	*	*			trans	-70	91.8	176.4	56.7	0	0	0	0	106.8	E286 D290	E286-S288 PolarHBondContact O-N 3.18Å; S288-D290 PolarHBondContact O-N 3.13Å
289	F	68.1	Low	67.6	Low	105 Å²	105	106 Å²	106	46%	0.461	53%	0.532	S	S	.	.			trans	-56.3	106.6	170.9	176.1	-109.7	0	0	0	107.5	L274 M287 E291 Y294	L274-F289 HydrophobicContact CD1-CD2 3.85Å; L274-F289 HydrophobicContact CD1-CE2 3.63Å; M287-F289 PolarHBondContact O-N 2.86Å; F289-E291 HydrophobicContact CD1-CB 3.68Å; F289-E291 HydrophobicContact CD1-CG 4.3Å; F289-E291 HydrophobicContact CE1-CB 3.6Å; F289-E291 HydrophobicContact CE1-CG 3.8Å; F289-E291 PolarHBondContact O-N 3.19Å; F289-Y294 HydrophobicContact CE2-CG 4.39Å; F289-Y294 AromaticContact CZ-CD1 3.92Å; F289-Y294 HydrophobicContact CZ-CD1 3.92Å; F289-Y294 AromaticContact CZ-CG 3.88Å; F289-Y294 HydrophobicContact CZ-CG 3.88Å
290	D	77.3	Confident	70.2	Confident	86 Å²	86	98 Å²	98	46%	0.46	50%	0.497	S	S	.	.			trans	-73.7	82.2	173.5	-171.5	-13.1	0	0	0	108.4	S288 D292 A293 Y294	S288-D290 PolarHBondContact O-N 3.13Å; D290-D292 VanDerWaalsContact C-N 3.27Å; D290-D292 PolarHBondContact O-N 2.9Å; D290-D292 PolarHBondContact OD1-N 3.22Å; D290-A293 HydrophobicContact CB-CB 4.09Å; D290-A293 PolarHBondContact O-N 3.11Å; D290-A293 WeakPolarHBondContact OD1-CB 3.48Å; D290-A293 PolarHBondContact OD1-N 3.24Å; D290-A293 VanDerWaalsContact OD2-CB 3.29Å; D290-A293 WeakPolarHBondContact OD2-CB 3.22Å; D290-Y294 PolarHBondContact O-N 2.95Å
291	E	81.9	Confident	72.8	Confident	98 Å²	98	97.2 Å²	97.2	46%	0.458	49%	0.487	S	S	.	.	H	α-helix	trans	-60.2	-38.6	-178.2	-177.2	165.9	-157.7	0	0	111.3	F289 Y294 Y295	F289-E291 HydrophobicContact CD1-CB 3.68Å; F289-E291 HydrophobicContact CD1-CG 4.3Å; F289-E291 HydrophobicContact CE1-CB 3.6Å; F289-E291 HydrophobicContact CE1-CG 3.8Å; F289-E291 PolarHBondContact O-N 3.19Å; E291-Y294 WeakPolarHBondContact O-CB 3.45Å; E291-Y294 PolarHBondContact O-N 3.34Å; E291-Y295 HydrophobicContact CG-CD2 3.67Å; E291-Y295 HydrophobicContact CG-CE2 3.26Å; E291-Y295 WeakPolarHBondContact O-CD2 3.37Å; E291-Y295 PolarHBondContact O-N 2.9Å; E291-Y295 WeakPolarHBondContact OE1-CE2 3.4Å; E291-Y295 PolarHBondContact OE1-OH 3.09Å
292	D	84.9	Confident	75.1	Confident	122 Å²	122	87.5 Å²	87.5	65%	0.652	44%	0.442	S	S	*	.	H	α-helix	trans	-65.2	-48.8	179.2	-70.9	-25.3	0	0	0	110.6	D290 Y294 Y295 E296	D290-D292 VanDerWaalsContact C-N 3.27Å; D290-D292 PolarHBondContact O-N 2.9Å; D290-D292 PolarHBondContact OD1-N 3.22Å; D292-Y294 VanDerWaalsContact C-N 3.26Å; D292-Y294 PolarHBondContact O-N 3.39Å; D292-Y295 PolarHBondContact O-N 3.13Å; D292-E296 WeakPolarHBondContact O-CG 3.43Å; D292-E296 PolarHBondContact O-N 3.08Å
293	A	85.4	Confident	77.5	Confident	12 Å²	12	85.2 Å²	85.2	10%	0.099	43%	0.433	C	S	.	.	H	α-helix	trans	-65	-29.9	176.7	0	0	0	0	0	112.9	D290 R297	D290-A293 HydrophobicContact CB-CB 4.09Å; D290-A293 PolarHBondContact O-N 3.11Å; D290-A293 WeakPolarHBondContact OD1-CB 3.48Å; D290-A293 PolarHBondContact OD1-N 3.24Å; D290-A293 VanDerWaalsContact OD2-CB 3.29Å; D290-A293 WeakPolarHBondContact OD2-CB 3.22Å; A293-R297 WeakPolarHBondContact O-CD 3.34Å; A293-R297 WeakPolarHBondContact O-CG 3.38Å; A293-R297 PolarHBondContact O-N 2.8Å; A293-R297 PolarHBondContact O-NE 3.47Å
294	Y	87.1	Confident	79.9	Confident	19 Å²	19	78.6 Å²	78.6	8%	0.075	40%	0.398	C	S	.	.	H	α-helix	trans	-65	-51.6	172.1	167.3	-101.7	0	0	0	111.2	P234 H270 F289 D290 E291 D292 E296 R297 L298	P234-Y294 WeakPolarHBondContact CG-OH 3.41Å; H270-Y294 HydrophobicContact CB-CD2 4.36Å; H270-Y294 HydrophobicContact CB-CE2 4.4Å; F289-Y294 HydrophobicContact CE2-CG 4.39Å; F289-Y294 AromaticContact CZ-CD1 3.92Å; F289-Y294 HydrophobicContact CZ-CD1 3.92Å; F289-Y294 AromaticContact CZ-CG 3.88Å; F289-Y294 HydrophobicContact CZ-CG 3.88Å; D290-Y294 PolarHBondContact O-N 2.95Å; E291-Y294 WeakPolarHBondContact O-CB 3.45Å; E291-Y294 PolarHBondContact O-N 3.34Å; D292-Y294 VanDerWaalsContact C-N 3.26Å; D292-Y294 PolarHBondContact O-N 3.39Å; Y294-E296 PolarHBondContact O-N 2.83Å; Y294-R297 PolarHBondContact O-N 2.97Å; Y294-R297 VanDerWaalsContact O-N 3.16Å; Y294-L298 HydrophobicContact CE1-CD1 4.2Å; Y294-L298 HydrophobicContact CE1-CD2 4.31Å; Y294-L298 HydrophobicContact CE1-CG 4.48Å; Y294-L298 HydrophobicContact CE2-CD2 3.95Å; Y294-L298 PolarHBondContact O-N 2.91Å
295	Y	88.2	Confident	81.9	Confident	111 Å²	111	78.8 Å²	78.8	44%	0.435	39%	0.391	S	S	.	.	H	α-helix	trans	-64.6	-36.1	-179.7	-74.6	-62.8	0	0	0	113.1	E291 D292 R297 L298	E291-Y295 HydrophobicContact CG-CD2 3.67Å; E291-Y295 HydrophobicContact CG-CE2 3.26Å; E291-Y295 WeakPolarHBondContact O-CD2 3.37Å; E291-Y295 PolarHBondContact O-N 2.9Å; E291-Y295 WeakPolarHBondContact OE1-CE2 3.4Å; E291-Y295 PolarHBondContact OE1-OH 3.09Å; D292-Y295 PolarHBondContact O-N 3.13Å; Y295-R297 PolarHBondContact O-N 2.85Å; Y295-L298 HydrophobicContact CD1-CD1 3.75Å; Y295-L298 HydrophobicContact CE1-CD1 4.34Å; Y295-L298 PolarHBondContact O-N 3.36Å
296	E	89.9	Confident	84	Confident	164 Å²	164	76.1 Å²	76.1	77%	0.766	39%	0.385	S	S	*	.	H	α-helix	trans	-63.8	-25.9	176.1	-75.6	-173.6	169.7	0	0	113.4	D292 Y294	D292-E296 WeakPolarHBondContact O-CG 3.43Å; D292-E296 PolarHBondContact O-N 3.08Å; Y294-E296 PolarHBondContact O-N 2.83Å
297	R	91.4	Very high	85.8	Confident	80 Å²	80	71.2 Å²	71.2	30%	0.302	38%	0.378	S	S	.	.	H	α-helix	trans	-87.7	-18.3	-179.3	-69.8	168.6	-171.5	145.4	1	113.1	H270 A293 Y294 Y295 T300	H270-R297 HydrophobicContact CB-CB 4.49Å; H270-R297 PolarHBondContact CE1-O 2.95Å; A293-R297 WeakPolarHBondContact O-CD 3.34Å; A293-R297 WeakPolarHBondContact O-CG 3.38Å; A293-R297 PolarHBondContact O-N 2.8Å; A293-R297 PolarHBondContact O-NE 3.47Å; Y294-R297 PolarHBondContact O-N 2.97Å; Y294-R297 VanDerWaalsContact O-N 3.16Å; Y295-R297 PolarHBondContact O-N 2.85Å; R297-T300 WeakPolarHBondContact O-CB 3.3Å; R297-T300 WeakPolarHBondContact O-CG2 3.41Å; R297-T300 PolarHBondContact O-N 2.97Å; R297-T300 VanDerWaalsContact O-N 3.11Å; R297-T300 PolarHBondContact O-OG1 2.86Å
298	L	93.6	Very high	87.6	Confident	12 Å²	12	69.6 Å²	69.6	6%	0.063	38%	0.378	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.6	142.1	-178.7	-66.2	-176.3	0	0	0	111.6	E233 L241 Y294 Y295 T300	E233-L298 HydrophobicContact CB-CD1 4.16Å; L241-L298 HydrophobicContact CD1-CB 3.53Å; Y294-L298 HydrophobicContact CE1-CD1 4.2Å; Y294-L298 HydrophobicContact CE1-CD2 4.31Å; Y294-L298 HydrophobicContact CE1-CG 4.48Å; Y294-L298 HydrophobicContact CE2-CD2 3.95Å; Y294-L298 PolarHBondContact O-N 2.91Å; Y295-L298 HydrophobicContact CD1-CD1 3.75Å; Y295-L298 HydrophobicContact CE1-CD1 4.34Å; Y295-L298 PolarHBondContact O-N 3.36Å; L298-T300 PolarHBondContact O-N 3.39Å
299	G	95	Very high	89	Confident	1 Å²	1	66.1 Å²	66.1	1%	0.01	35%	0.351	C	S	.	.	T	Hydrogen-bonded Turn	trans	72.7	-1.7	-176.4	0	0	0	0	0	115.6	N236 F254	N236-G299 WeakPolarHBondContact O-CA 3.32Å; N236-G299 PolarHBondContact O-N 3.37Å; F254-G299 VanDerWaalsContact CZ-O 3.3Å; F254-G299 WeakPolarHBondContact CZ-O 3.47Å
300	T	96.3	Very high	90.1	Very high	34 Å²	34	62.8 Å²	62.8	21%	0.209	35%	0.347	C	S	.	.	S	Bend	trans	-87.9	165.2	170.9	71.2	0	0	0	0	111.5	H270 R297 L298 P302	H270-T300 PolarHBondContact CE1-O 3.39Å; H270-T300 PolarHBondContact CE1-OG1 3.37Å; H270-T300 PolarHBondContact NE2-O 3.46Å; R297-T300 WeakPolarHBondContact O-CB 3.3Å; R297-T300 WeakPolarHBondContact O-CG2 3.41Å; R297-T300 PolarHBondContact O-N 2.97Å; R297-T300 VanDerWaalsContact O-N 3.11Å; R297-T300 PolarHBondContact O-OG1 2.86Å; L298-T300 PolarHBondContact O-N 3.39Å; T300-P302 WeakPolarHBondContact O-CD 3.43Å
301	R	97.4	Very high	90.9	Very high	83 Å²	83	61.9 Å²	61.9	31%	0.313	36%	0.358	S	S	.	.	P	Polyproline II helix	trans	-73.6	119.5	170.7	-177.8	180	-52.9	161.7	14.3	109.4	F320 C321 T324 E325	R301-F320 HydrophobicContact CG-CE1 3.93Å; R301-F320 HydrophobicContact CG-CE2 4.14Å; R301-F320 HydrophobicContact CG-CZ 3.43Å; R301-F320 VanDerWaalsContact CG-CZ 3.43Å; R301-C321 PolarHBondContact NH2-O 3.13Å; R301-T324 WeakPolarHBondContact CD-OG1 3.21Å; R301-T324 WeakPolarHBondContact CG-OG1 3.39Å; R301-T324 PolarHBondContact NE-O 3.42Å; R301-T324 PolarHBondContact NE-OG1 3.41Å; R301-T324 VanDerWaalsContact NH2-C 3.31Å; R301-T324 PolarHBondContact NH2-O 3Å; R301-E325 IonicContact CZ-OE1 3.71Å; R301-E325 IonicContact NH1-OE1 3.32Å; R301-E325 IonicContact NH2-OE1 2.76Å; R301-E325 PolarHBondContact NH2-OE1 3.11Å
302	P	95.5	Very high	91.4	Very high	3 Å²	3	61.1 Å²	61.1	2%	0.019	36%	0.364	C	S	.	.	P	Polyproline II helix	trans	-66	153	175.4	28.2	-35	0	0	0	111.1	L258 W261 T300 F320	L258-P302 HydrophobicContact CD2-CG 3.56Å; W261-P302 HydrophobicContact CD2-CB 4.41Å; W261-P302 HydrophobicContact CD2-CG 3.87Å; W261-P302 HydrophobicContact CE3-CG 4.48Å; W261-P302 HydrophobicContact CG-CG 3.99Å; W261-P302 HydrophobicContact CZ2-CB 3.97Å; W261-P302 HydrophobicContact CZ2-CG 4.33Å; T300-P302 WeakPolarHBondContact O-CD 3.43Å; P302-F320 HydrophobicContact CG-CE2 4.35Å; P302-F320 HydrophobicContact CG-CZ 4.19Å
303	P	94.1	Very high	92	Very high	71 Å²	71	56.6 Å²	56.6	46%	0.461	34%	0.337	S	S	.	.	P	Polyproline II helix	trans	-64	146.7	177.9	27	-32.9	0	0	0	110.9	W261 M273	W261-P303 PolarHBondContact NE1-O 3.13Å; M273-P303 HydrophobicContact CG-CG 4.1Å; M273-P303 HydrophobicContact SD-CG 3.62Å
304	L	94.2	Very high	92.4	Very high	37 Å²	37	64 Å²	64	19%	0.194	36%	0.363	C	S	.	.			trans	-139.1	120.2	175.7	-177.8	64.8	0	0	0	108.4	M264 T265 A306 L309 V317 F320	M264-L304 HydrophobicContact CB-CD1 4.13Å; M264-L304 HydrophobicContact CE-CD2 3.59Å; M264-L304 HydrophobicContact SD-CD2 4.01Å; T265-L304 HydrophobicContact CG2-CD1 3.46Å; T265-L304 VanDerWaalsContact CG2-CD1 3.46Å; L304-A306 PolarHBondContact O-N 3.08Å; L304-L309 HydrophobicContact CD1-CD1 3.99Å; L304-L309 HydrophobicContact CD2-CD1 4.29Å; L304-L309 HydrophobicContact CG-CD1 4.22Å; L304-V317 HydrophobicContact CD2-CG1 4.31Å; L304-V317 HydrophobicContact CD2-CG2 4.01Å; L304-F320 HydrophobicContact CB-CE1 3.93Å; L304-F320 HydrophobicContact CD2-CD1 3.63Å; L304-F320 HydrophobicContact CD2-CE1 3.84Å; L304-F320 HydrophobicContact CD2-CG 4.5Å
305	D	91.7	Very high	92.8	Very high	101 Å²	101	66.8 Å²	66.8	54%	0.54	37%	0.373	S	S	.	.			trans	-76.3	77.9	172.4	-179.5	17.7	0	0	0	110.4	A307 S308	D305-A307 PolarHBondContact O-N 2.85Å; D305-A307 PolarHBondContact OD1-N 2.95Å; D305-S308 PolarHBondContact O-N 3.32Å; D305-S308 PolarHBondContact O-OG 3.36Å; D305-S308 VanDerWaalsContact O-OG 3.04Å; D305-S308 PolarHBondContact OD1-N 3.42Å; D305-S308 WeakPolarHBondContact OD2-CB 3.49Å; D305-S308 PolarHBondContact OD2-OG 2.91Å
306	A	90.3	Very high	93.2	Very high	45 Å²	45	61.6 Å²	61.6	37%	0.372	35%	0.353	S	S	.	.	H	α-helix	trans	-62.3	-22.2	180	0	0	0	0	0	113	L304 V317	L304-A306 PolarHBondContact O-N 3.08Å; A306-V317 HydrophobicContact CB-CG1 3.86Å; A306-V317 HydrophobicContact CB-CG2 4.21Å
307	A	88.6	Confident	93.6	Very high	89 Å²	89	54.9 Å²	54.9	74%	0.736	32%	0.323	S	S	*	.	H	α-helix	trans	-71.1	-37.8	-179.4	0	0	0	0	0	111.7	D305	D305-A307 PolarHBondContact O-N 2.85Å; D305-A307 PolarHBondContact OD1-N 2.95Å
308	S	89.3	Confident	93.9	Very high	87 Å²	87	55.3 Å²	55.3	61%	0.608	33%	0.329	S	S	*	.	H	α-helix	trans	-76.4	-24.7	178.9	59.4	0	0	0	0	114.3	D305 G310	D305-S308 PolarHBondContact O-N 3.32Å; D305-S308 PolarHBondContact O-OG 3.36Å; D305-S308 VanDerWaalsContact O-OG 3.04Å; D305-S308 PolarHBondContact OD1-N 3.42Å; D305-S308 WeakPolarHBondContact OD2-CB 3.49Å; D305-S308 PolarHBondContact OD2-OG 2.91Å; S308-G310 VanDerWaalsContact C-N 3.34Å
309	L	89.9	Confident	94.1	Very high	28 Å²	28	55.7 Å²	55.7	15%	0.147	33%	0.33	C	S	.	.	H	α-helix	trans	-68.6	-33.1	176.6	-67.5	173.9	0	0	0	112.5	A160 M264 L304 Y313 V317	A160-L309 HydrophobicContact CB-CD2 3.62Å; M264-L309 HydrophobicContact CB-CD1 4.09Å; M264-L309 HydrophobicContact CB-CD2 4.44Å; M264-L309 HydrophobicContact CG-CD1 4.25Å; M264-L309 HydrophobicContact SD-CD1 3.88Å; L304-L309 HydrophobicContact CD1-CD1 3.99Å; L304-L309 HydrophobicContact CD2-CD1 4.29Å; L304-L309 HydrophobicContact CG-CD1 4.22Å; L309-Y313 HydrophobicContact CB-CD1 4.44Å; L309-Y313 HydrophobicContact CB-CD2 3.83Å; L309-Y313 HydrophobicContact CB-CE2 4.43Å; L309-Y313 HydrophobicContact CB-CG 3.83Å; L309-Y313 HydrophobicContact CD2-CD1 4.4Å; L309-Y313 HydrophobicContact CD2-CE1 4.41Å; L309-Y313 WeakPolarHBondContact O-CD2 3.3Å; L309-Y313 WeakPolarHBondContact O-CE2 3.35Å; L309-V317 HydrophobicContact CD1-CG2 4.12Å
310	G	90.8	Very high	94.3	Very high	35 Å²	35	55.8 Å²	55.8	36%	0.361	33%	0.331	S	S	.	.			trans	83.2	170.4	-179.5	0	0	0	0	0	114.6	S308 S312 Y313	S308-G310 VanDerWaalsContact C-N 3.34Å; G310-S312 VanDerWaalsContact C-N 3.26Å; G310-S312 PolarHBondContact O-N 3.27Å; G310-S312 VanDerWaalsContact O-N 3.11Å; G310-Y313 PolarHBondContact O-N 2.79Å; G310-Y313 VanDerWaalsContact O-N 3.13Å
311	G	92.7	Very high	94.4	Very high	68 Å²	68	56 Å²	56	70%	0.701	33%	0.333	S	S	*	.	G	3₁₀ helix	trans	-62.6	-23.6	-166.8	0	0	0	0	0	116.1	Y313 R314	G311-Y313 PolarHBondContact O-N 3.28Å; G311-R314 WeakPolarHBondContact O-CB 3.48Å; G311-R314 PolarHBondContact O-N 2.82Å
312	S	93.6	Very high	94.4	Very high	82 Å²	82	56.4 Å²	56.4	57%	0.573	34%	0.341	S	S	*	.	G	3₁₀ helix	trans	-65.5	-23.4	177.5	67.2	0	0	0	0	113.4	A163 G310	A163-S312 WeakPolarHBondContact CB-O 3.45Å; G310-S312 VanDerWaalsContact C-N 3.26Å; G310-S312 PolarHBondContact O-N 3.27Å; G310-S312 VanDerWaalsContact O-N 3.11Å
313	Y	96.1	Very high	94.6	Very high	26 Å²	26	56.3 Å²	56.3	10%	0.102	34%	0.34	C	S	.	.	G	3₁₀ helix	trans	-88.6	-4.7	178.6	-66.9	-100.2	0	0	0	113	A160 F161 A163 I166 M264 L309 G310 G311 R315 M316 V317	A160-Y313 HydrophobicContact CB-CE1 4.01Å; F161-Y313 WeakPolarHBondContact O-CE1 3.42Å; F161-Y313 PolarHBondContact O-OH 3.02Å; A163-Y313 HydrophobicContact CB-CD1 4.08Å; A163-Y313 HydrophobicContact CB-CD2 4.38Å; A163-Y313 HydrophobicContact CB-CE1 4.14Å; A163-Y313 HydrophobicContact CB-CE2 4.46Å; A163-Y313 HydrophobicContact CB-CG 4.2Å; I166-Y313 HydrophobicContact CD1-CD1 4Å; I166-Y313 HydrophobicContact CD1-CE1 3.73Å; M264-Y313 HydrophobicContact CG-CD1 4.35Å; L309-Y313 HydrophobicContact CB-CD1 4.44Å; L309-Y313 HydrophobicContact CB-CD2 3.83Å; L309-Y313 HydrophobicContact CB-CE2 4.43Å; L309-Y313 HydrophobicContact CB-CG 3.83Å; L309-Y313 HydrophobicContact CD2-CD1 4.4Å; L309-Y313 HydrophobicContact CD2-CE1 4.41Å; L309-Y313 WeakPolarHBondContact O-CD2 3.3Å; L309-Y313 WeakPolarHBondContact O-CE2 3.35Å; G310-Y313 PolarHBondContact O-N 2.79Å; G310-Y313 VanDerWaalsContact O-N 3.13Å; G311-Y313 PolarHBondContact O-N 3.28Å; Y313-R315 VanDerWaalsContact C-N 3.25Å; Y313-R315 PolarHBondContact O-N 3.25Å; Y313-R315 VanDerWaalsContact O-N 3.11Å; Y313-M316 WeakPolarHBondContact O-CA 3.41Å; Y313-M316 PolarHBondContact O-N 3.42Å; Y313-V317 WeakPolarHBondContact O-CG2 3.29Å; Y313-V317 PolarHBondContact O-N 2.67Å
314	R	95.4	Very high	94.8	Very high	168 Å²	168	53 Å²	53	63%	0.634	32%	0.319	S	S	*	.	H	α-helix	trans	-47.9	-47	-173.5	177.8	177.3	176	166.5	0.9	112.6	G311 M316 V317 E318	G311-R314 WeakPolarHBondContact O-CB 3.48Å; G311-R314 PolarHBondContact O-N 2.82Å; R314-M316 PolarHBondContact O-N 3.1Å; R314-V317 PolarHBondContact O-N 3.29Å; R314-E318 HydrophobicContact CG-CG 4.49Å; R314-E318 WeakPolarHBondContact CG-OE1 3.4Å; R314-E318 IonicContact CZ-OE1 2.97Å; R314-E318 IonicContact NE-OE1 3.84Å; R314-E318 PolarHBondContact NE-OE1 3.35Å; R314-E318 IonicContact NH2-OE1 2.81Å; R314-E318 WeakPolarHBondContact O-CB 3.35Å; R314-E318 VanDerWaalsContact O-CG 3.3Å; R314-E318 WeakPolarHBondContact O-CG 3.2Å; R314-E318 PolarHBondContact O-N 3.42Å
315	R	94.3	Very high	95	Very high	78 Å²	78	53.6 Å²	53.6	29%	0.294	32%	0.321	S	S	.	.	H	α-helix	trans	-62.4	-41.8	179.3	-63	-163.4	-66.8	-155.7	1	112.4	E167 Y313 E318 L319 D348	E167-R315 IonicContact OE1-CZ 3.79Å; E167-R315 VanDerWaalsContact OE1-CZ 3.24Å; E167-R315 IonicContact OE1-NE 2.74Å; E167-R315 PolarHBondContact OE1-NE 3.22Å; E167-R315 IonicContact OE1-NH2 3.23Å; E167-R315 PolarHBondContact OE1-NH2 3.36Å; E167-R315 IonicContact OE2-CZ 3.98Å; E167-R315 IonicContact OE2-NH2 2.94Å; E167-R315 PolarHBondContact OE2-NH2 3.33Å; Y313-R315 VanDerWaalsContact C-N 3.25Å; Y313-R315 PolarHBondContact O-N 3.25Å; Y313-R315 VanDerWaalsContact O-N 3.11Å; R315-E318 PolarHBondContact O-N 3.44Å; R315-L319 WeakPolarHBondContact O-CB 3.46Å; R315-L319 PolarHBondContact O-N 3.25Å; R315-D348 IonicContact CZ-OD2 3.22Å; R315-D348 IonicContact NH1-OD1 2.83Å; R315-D348 IonicContact NH1-OD2 2.78Å; R315-D348 PolarHBondContact NH1-OD2 3.3Å; R315-D348 IonicContact NH2-OD2 2.84Å; R315-D348 PolarHBondContact NH2-OD2 2.98Å
316	M	97.2	Very high	95.2	Very high	1 Å²	1	54.3 Å²	54.3	1%	0.005	32%	0.321	C	S	.	.	H	α-helix	trans	-73.2	-35.4	-179.8	-64.6	-58.6	90	0	0	112.2	I166 E167 A170 M264 Y313 R314 L319 F320 L341	I166-M316 HydrophobicContact CB-CG 4.12Å; I166-M316 HydrophobicContact CB-SD 4.42Å; I166-M316 HydrophobicContact CG2-CB 4.2Å; I166-M316 HydrophobicContact CG2-CG 3.79Å; I166-M316 HydrophobicContact CG2-SD 3.84Å; E167-M316 HydrophobicContact CB-SD 4.23Å; E167-M316 HydrophobicContact CG-CE 3.5Å; E167-M316 HydrophobicContact CG-CG 3.8Å; E167-M316 HydrophobicContact CG-SD 3.49Å; E167-M316 WeakPolarHBondContact CG-SD 3.34Å; A170-M316 HydrophobicContact CB-SD 4.17Å; M264-M316 HydrophobicContact SD-CB 4.29Å; Y313-M316 WeakPolarHBondContact O-CA 3.41Å; Y313-M316 PolarHBondContact O-N 3.42Å; R314-M316 PolarHBondContact O-N 3.1Å; M316-L319 HydrophobicContact CE-CB 4.48Å; M316-L319 HydrophobicContact CE-CD2 4.12Å; M316-L319 PolarHBondContact O-N 3.28Å; M316-F320 VanDerWaalsContact O-CB 3.29Å; M316-F320 WeakPolarHBondContact O-CB 3.16Å; M316-F320 PolarHBondContact O-N 3.06Å; M316-L341 HydrophobicContact CE-CD2 3.94Å
317	V	97.9	Very high	95.5	Very high	23 Å²	23	55.6 Å²	55.6	14%	0.139	32%	0.321	C	S	.	.	H	α-helix	trans	-64	-46.2	171.8	174.2	0	0	0	0	110.7	M264 L304 A306 L309 Y313 R314 F320 C321	M264-V317 HydrophobicContact SD-CG2 4.1Å; L304-V317 HydrophobicContact CD2-CG1 4.31Å; L304-V317 HydrophobicContact CD2-CG2 4.01Å; A306-V317 HydrophobicContact CB-CG1 3.86Å; A306-V317 HydrophobicContact CB-CG2 4.21Å; L309-V317 HydrophobicContact CD1-CG2 4.12Å; Y313-V317 WeakPolarHBondContact O-CG2 3.29Å; Y313-V317 PolarHBondContact O-N 2.67Å; R314-V317 PolarHBondContact O-N 3.29Å; V317-F320 PolarHBondContact O-N 3.37Å; V317-C321 WeakPolarHBondContact O-CB 3.37Å; V317-C321 PolarHBondContact O-N 3.2Å; V317-C321 PolarHBondContact O-SG 2.84Å; V317-C321 VanDerWaalsContact O-SG 3.36Å
318	E	97.6	Very high	95.9	Very high	90 Å²	90	52.7 Å²	52.7	42%	0.421	30%	0.295	S	S	.	.	H	α-helix	trans	-60.9	-45.2	176.4	-74.3	172.1	-171.9	0	0	111.3	R314 R315 C321 L322	R314-E318 HydrophobicContact CG-CG 4.49Å; R314-E318 WeakPolarHBondContact CG-OE1 3.4Å; R314-E318 IonicContact CZ-OE1 2.97Å; R314-E318 IonicContact NE-OE1 3.84Å; R314-E318 PolarHBondContact NE-OE1 3.35Å; R314-E318 IonicContact NH2-OE1 2.81Å; R314-E318 WeakPolarHBondContact O-CB 3.35Å; R314-E318 VanDerWaalsContact O-CG 3.3Å; R314-E318 WeakPolarHBondContact O-CG 3.2Å; R314-E318 PolarHBondContact O-N 3.42Å; R315-E318 PolarHBondContact O-N 3.44Å; E318-C321 PolarHBondContact O-N 2.64Å; E318-L322 WeakPolarHBondContact O-CG 3.47Å; E318-L322 PolarHBondContact O-N 2.77Å
319	L	98.3	Very high	96.2	Very high	19 Å²	19	56.8 Å²	56.8	10%	0.099	30%	0.302	C	S	.	.	H	α-helix	trans	-63.5	-45	176.7	-178.6	59.3	0	0	0	112.2	A170 F256 L260 R315 M316 C321 L322 C323 I337 L341	A170-L319 HydrophobicContact CB-CD2 4.23Å; F256-L319 HydrophobicContact CE1-CD2 4.25Å; F256-L319 HydrophobicContact CE1-CG 4.48Å; F256-L319 HydrophobicContact CZ-CD2 4.39Å; L260-L319 HydrophobicContact CD1-CD2 3.73Å; L260-L319 HydrophobicContact CD1-CG 3.93Å; R315-L319 WeakPolarHBondContact O-CB 3.46Å; R315-L319 PolarHBondContact O-N 3.25Å; M316-L319 HydrophobicContact CE-CB 4.48Å; M316-L319 HydrophobicContact CE-CD2 4.12Å; M316-L319 PolarHBondContact O-N 3.28Å; L319-C321 VanDerWaalsContact C-N 3.32Å; L319-C321 PolarHBondContact O-N 2.96Å; L319-L322 PolarHBondContact O-N 3.38Å; L319-C323 WeakPolarHBondContact O-CB 3.29Å; L319-C323 PolarHBondContact O-N 3.05Å; L319-C323 PolarHBondContact O-SG 3.04Å; L319-I337 HydrophobicContact CD1-CD1 4.49Å; L319-I337 HydrophobicContact CD1-CG1 4.11Å; L319-I337 HydrophobicContact CD1-CG2 4.08Å; L319-I337 HydrophobicContact CD2-CG2 4.21Å; L319-L341 HydrophobicContact CD2-CD1 4.26Å; L319-L341 HydrophobicContact CD2-CD2 4.32Å
320	F	98.6	Very high	96.6	Very high	3 Å²	3	61.9 Å²	61.9	1%	0.013	32%	0.323	C	S	.	.	H	α-helix	trans	-53.8	-49.8	173.6	158.1	-113.3	0	0	0	111.1	G257 L258 W261 M264 R301 P302 L304 M316 V317 C323 T324	G257-F320 WeakPolarHBondContact O-CD2 3.41Å; L258-F320 HydrophobicContact CD2-CE2 4.37Å; W261-F320 HydrophobicContact CB-CD2 3.85Å; W261-F320 HydrophobicContact CB-CE2 3.66Å; W261-F320 HydrophobicContact CB-CZ 4.3Å; W261-F320 AromaticContact CD1-CE1 3.95Å; W261-F320 AromaticContact CD1-CE2 3.72Å; W261-F320 AromaticContact CD1-CZ 3.44Å; W261-F320 VanDerWaalsContact CD1-CZ 3.44Å; W261-F320 AromaticContact CG-CE2 3.95Å; W261-F320 HydrophobicContact CG-CE2 3.95Å; W261-F320 HydrophobicContact CG-CZ 4.13Å; M264-F320 HydrophobicContact CE-CB 3.89Å; M264-F320 HydrophobicContact CE-CD1 4.45Å; M264-F320 HydrophobicContact CE-CG 4.14Å; R301-F320 HydrophobicContact CG-CE1 3.93Å; R301-F320 HydrophobicContact CG-CE2 4.14Å; R301-F320 HydrophobicContact CG-CZ 3.43Å; R301-F320 VanDerWaalsContact CG-CZ 3.43Å; P302-F320 HydrophobicContact CG-CE2 4.35Å; P302-F320 HydrophobicContact CG-CZ 4.19Å; L304-F320 HydrophobicContact CB-CE1 3.93Å; L304-F320 HydrophobicContact CD2-CD1 3.63Å; L304-F320 HydrophobicContact CD2-CE1 3.84Å; L304-F320 HydrophobicContact CD2-CG 4.5Å; M316-F320 VanDerWaalsContact O-CB 3.29Å; M316-F320 WeakPolarHBondContact O-CB 3.16Å; M316-F320 PolarHBondContact O-N 3.06Å; V317-F320 PolarHBondContact O-N 3.37Å; F320-C323 PolarHBondContact O-N 3.44Å; F320-T324 HydrophobicContact CD2-CG2 3.99Å; F320-T324 HydrophobicContact CE2-CG2 3.8Å; F320-T324 WeakPolarHBondContact O-CB 3.4Å; F320-T324 PolarHBondContact O-N 3.02Å; F320-T324 PolarHBondContact O-OG1 3.23Å
321	C	98.4	Very high	97	Very high	38 Å²	38	60.4 Å²	60.4	26%	0.257	31%	0.306	S	S	.	.	H	α-helix	trans	-59.2	-48.7	177.8	-75.3	0	0	0	0	111.8	R301 V317 E318 L319 C323 T324 E325	R301-C321 PolarHBondContact NH2-O 3.13Å; V317-C321 WeakPolarHBondContact O-CB 3.37Å; V317-C321 PolarHBondContact O-N 3.2Å; V317-C321 PolarHBondContact O-SG 2.84Å; V317-C321 VanDerWaalsContact O-SG 3.36Å; E318-C321 PolarHBondContact O-N 2.64Å; L319-C321 VanDerWaalsContact C-N 3.32Å; L319-C321 PolarHBondContact O-N 2.96Å; C321-C323 VanDerWaalsContact C-N 3.35Å; C321-C323 PolarHBondContact O-N 3.27Å; C321-T324 CarbonylContact O-C 3.58Å; C321-T324 PolarHBondContact O-N 3.17Å; C321-E325 PolarHBondContact O-N 3.14Å
322	L	98.4	Very high	97.3	Very high	93 Å²	93	58.1 Å²	58.1	49%	0.487	28%	0.279	S	S	.	.	H	α-helix	trans	-61.8	-42	179.3	-70.9	170.5	0	0	0	112.5	E318 L319 T324 R331 P332	E318-L322 WeakPolarHBondContact O-CG 3.47Å; E318-L322 PolarHBondContact O-N 2.77Å; L319-L322 PolarHBondContact O-N 3.38Å; L322-T324 VanDerWaalsContact C-N 3.29Å; L322-T324 PolarHBondContact O-N 3.47Å; L322-R331 WeakPolarHBondContact O-CA 3.24Å; L322-P332 HydrophobicContact CB-CG 4.41Å; L322-P332 WeakPolarHBondContact O-CD 3.38Å
323	C	98.8	Very high	97.5	Very high	0 Å²	0	55.4 Å²	55.4	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-67.6	-29.6	179.2	-72.2	0	0	0	0	112.7	I253 F254 L319 F320 C321 R331	I253-C323 HydrophobicContact CG2-CB 4.03Å; I253-C323 WeakPolarHBondContact O-CB 3.48Å; F254-C323 WeakPolarHBondContact CA-O 3.48Å; L319-C323 WeakPolarHBondContact O-CB 3.29Å; L319-C323 PolarHBondContact O-N 3.05Å; L319-C323 PolarHBondContact O-SG 3.04Å; F320-C323 PolarHBondContact O-N 3.44Å; C321-C323 VanDerWaalsContact C-N 3.35Å; C321-C323 PolarHBondContact O-N 3.27Å; C323-R331 WeakPolarHBondContact O-CD 3.3Å; C323-R331 WeakPolarHBondContact O-CG 3.35Å
324	T	98.5	Very high	97.6	Very high	1 Å²	1	54.2 Å²	54.2	1%	0.006	26%	0.256	C	S	.	.	T	Hydrogen-bonded Turn	trans	-105.9	28.8	-177.2	57.6	0	0	0	0	112.4	F254 L258 R301 F320 C321 L322	F254-T324 HydrophobicContact CD2-CG2 4.13Å; F254-T324 HydrophobicContact CE2-CG2 4.13Å; L258-T324 HydrophobicContact CD2-CG2 4.02Å; L258-T324 HydrophobicContact CG-CG2 4.23Å; R301-T324 WeakPolarHBondContact CD-OG1 3.21Å; R301-T324 WeakPolarHBondContact CG-OG1 3.39Å; R301-T324 PolarHBondContact NE-O 3.42Å; R301-T324 PolarHBondContact NE-OG1 3.41Å; R301-T324 VanDerWaalsContact NH2-C 3.31Å; R301-T324 PolarHBondContact NH2-O 3Å; F320-T324 HydrophobicContact CD2-CG2 3.99Å; F320-T324 HydrophobicContact CE2-CG2 3.8Å; F320-T324 WeakPolarHBondContact O-CB 3.4Å; F320-T324 PolarHBondContact O-N 3.02Å; F320-T324 PolarHBondContact O-OG1 3.23Å; C321-T324 CarbonylContact O-C 3.58Å; C321-T324 PolarHBondContact O-N 3.17Å; L322-T324 VanDerWaalsContact C-N 3.29Å; L322-T324 PolarHBondContact O-N 3.47Å
325	E	98.3	Very high	97.8	Very high	51 Å²	51	47.7 Å²	47.7	24%	0.238	24%	0.238	C	C	.	.			trans	-62.1	136.3	167.1	-80.5	-66.4	121.4	0	0	110.7	R301 C321 N327 K330 R331	R301-E325 IonicContact CZ-OE1 3.71Å; R301-E325 IonicContact NH1-OE1 3.32Å; R301-E325 IonicContact NH2-OE1 2.76Å; R301-E325 PolarHBondContact NH2-OE1 3.11Å; C321-E325 PolarHBondContact O-N 3.14Å; E325-N327 VanDerWaalsContact C-N 3.3Å; E325-N327 PolarHBondContact O-N 2.88Å; E325-K330 HydrophobicContact CB-CB 4Å; E325-K330 HydrophobicContact CG-CB 4.09Å; E325-R331 HydrophobicContact CB-CG 4.03Å; E325-R331 PolarHBondContact O-NE 3.22Å; E325-R331 PolarHBondContact O-NH2 3.2Å
326	E	95.4	Very high	98	Very high	115 Å²	115	48.8 Å²	48.8	54%	0.537	25%	0.246	S	C	.	.	S	Bend	trans	-59.2	-43.6	-179.8	-65.5	-164.6	134.8	0	0	111.5	K238 P328 R331	K238-E326 IonicContact NZ-OE1 2.77Å; K238-E326 PolarHBondContact NZ-OE1 3.3Å; E326-P328 VanDerWaalsContact O-CD 3.29Å; E326-P328 WeakPolarHBondContact O-CD 3.39Å; E326-R331 PolarHBondContact O-NH2 3.49Å
327	N	96.7	Very high	98	Very high	73 Å²	73	49 Å²	49	39%	0.39	25%	0.247	S	C	.	.	S	Bend	trans	-78.4	115.8	176.7	-176.5	-19.5	0	0	0	110.6	E325 K329 K330	E325-N327 VanDerWaalsContact C-N 3.3Å; E325-N327 PolarHBondContact O-N 2.88Å; N327-K329 PolarHBondContact O-N 2.78Å; N327-K329 VanDerWaalsContact O-N 3.08Å; N327-K329 WeakPolarHBondContact OD1-CB 3.23Å; N327-K329 PolarHBondContact OD1-N 3.48Å; N327-K330 HydrophobicContact CB-CD 4.18Å; N327-K330 HydrophobicContact CB-CG 4.13Å; N327-K330 WeakPolarHBondContact O-CB 3.47Å; N327-K330 PolarHBondContact O-N 2.93Å
328	P	97.5	Very high	98.1	Very high	28 Å²	28	48 Å²	48	18%	0.182	24%	0.241	C	C	.	.	G	3₁₀ helix	trans	-58.1	-29.2	-178.3	-23.7	34	0	0	0	113.8	E239 K250 E326 K330 R331	E239-P328 HydrophobicContact CB-CG 4.48Å; E239-P328 VanDerWaalsContact CD-CG 3.48Å; E239-P328 HydrophobicContact CG-CG 4.1Å; E239-P328 WeakPolarHBondContact OE2-CG 3.26Å; K250-P328 HydrophobicContact CB-CB 3.89Å; K250-P328 HydrophobicContact CG-CB 4.36Å; K250-P328 WeakPolarHBondContact CG-O 3.42Å; K250-P328 PolarHBondContact NZ-O 2.96Å; K250-P328 VanDerWaalsContact NZ-O 3.13Å; E326-P328 VanDerWaalsContact O-CD 3.29Å; E326-P328 WeakPolarHBondContact O-CD 3.39Å; P328-K330 PolarHBondContact O-N 2.92Å; P328-R331 WeakPolarHBondContact O-CB 3.39Å; P328-R331 PolarHBondContact O-N 3.28Å
329	K	96.9	Very high	98	Very high	172 Å²	172	48.8 Å²	48.8	75%	0.748	25%	0.245	S	C	*	.	G	3₁₀ helix	trans	-68.5	-23.6	179.2	-61.7	-178.6	179.3	177.3	0	112.8	N327	N327-K329 PolarHBondContact O-N 2.78Å; N327-K329 VanDerWaalsContact O-N 3.08Å; N327-K329 WeakPolarHBondContact OD1-CB 3.23Å; N327-K329 PolarHBondContact OD1-N 3.48Å
330	K	98	Very high	97.8	Very high	136 Å²	136	51.6 Å²	51.6	59%	0.591	26%	0.262	S	S	*	.	G	3₁₀ helix	trans	-84.5	-21.3	176.6	-67	-175.5	178.9	179.1	0	113.1	E325 N327 P328	E325-K330 HydrophobicContact CB-CB 4Å; E325-K330 HydrophobicContact CG-CB 4.09Å; N327-K330 HydrophobicContact CB-CD 4.18Å; N327-K330 HydrophobicContact CB-CG 4.13Å; N327-K330 WeakPolarHBondContact O-CB 3.47Å; N327-K330 PolarHBondContact O-N 2.93Å; P328-K330 PolarHBondContact O-N 2.92Å
331	R	98.6	Very high	97.6	Very high	3 Å²	3	52.5 Å²	52.5	1%	0.011	27%	0.267	C	S	.	.	S	Bend	trans	-64.1	140.1	174.9	-56.9	176.7	-161.9	150.5	11	109.1	E239 K250 I253 L322 C323 E325 E326 P328	E239-R331 IonicContact OE1-CZ 2.93Å; E239-R331 IonicContact OE1-NH1 3.72Å; E239-R331 PolarHBondContact OE1-NH1 3.37Å; E239-R331 IonicContact OE1-NH2 3.8Å; E239-R331 PolarHBondContact OE1-NH2 3.18Å; E239-R331 IonicContact OE2-CZ 3.38Å; E239-R331 IonicContact OE2-NH1 2.75Å; E239-R331 IonicContact OE2-NH2 2.83Å; E239-R331 PolarHBondContact OE2-NH2 3.11Å; K250-R331 HydrophobicContact CD-CB 4.36Å; K250-R331 PolarHBondContact NZ-O 2.84Å; K250-R331 PolarHBondContact O-NH1 3.01Å; I253-R331 HydrophobicContact CG2-CB 4.14Å; L322-R331 WeakPolarHBondContact O-CA 3.24Å; C323-R331 WeakPolarHBondContact O-CD 3.3Å; C323-R331 WeakPolarHBondContact O-CG 3.35Å; E325-R331 HydrophobicContact CB-CG 4.03Å; E325-R331 PolarHBondContact O-NE 3.22Å; E325-R331 PolarHBondContact O-NH2 3.2Å; E326-R331 PolarHBondContact O-NH2 3.49Å; P328-R331 WeakPolarHBondContact O-CB 3.39Å; P328-R331 PolarHBondContact O-N 3.28Å
332	P	98.6	Very high	97.3	Very high	21 Å²	21	54.5 Å²	54.5	14%	0.136	27%	0.273	C	S	.	.	P	Polyproline II helix	trans	-67	159.3	174.6	29	-34.4	0	0	0	110.8	I253 L322 Q336 I337	I253-P332 HydrophobicContact CG2-CG 4.46Å; I253-P332 WeakPolarHBondContact CG2-O 3.44Å; L322-P332 HydrophobicContact CB-CG 4.41Å; L322-P332 WeakPolarHBondContact O-CD 3.38Å; P332-Q336 HydrophobicContact CB-CB 4.18Å; P332-I337 HydrophobicContact CB-CG1 3.95Å; P332-I337 HydrophobicContact CG-CD1 3.97Å; P332-I337 HydrophobicContact CG-CG1 3.7Å
333	S	98.7	Very high	96.7	Very high	24 Å²	24	54.9 Å²	54.9	17%	0.168	27%	0.272	C	S	.	.	P	Polyproline II helix	trans	-80	159.7	165.8	70.4	0	0	0	0	110.7	A335 Q336 I337	S333-A335 PolarHBondContact O-N 2.76Å; S333-Q336 WeakPolarHBondContact O-CB 3.42Å; S333-Q336 PolarHBondContact O-N 2.85Å; S333-Q336 WeakPolarHBondContact OG-CG 3.3Å; S333-Q336 PolarHBondContact OG-N 2.66Å; S333-I337 WeakPolarHBondContact O-CG1 3.38Å; S333-I337 PolarHBondContact O-N 3.04Å
334	A	98.6	Very high	95.4	Very high	1 Å²	1	57.3 Å²	57.3	1%	0.008	29%	0.285	C	S	.	.	H	α-helix	trans	-55.6	-36	174.2	0	0	0	0	0	112.1	L177 K178 I253 I337 V338	L177-A334 HydrophobicContact CB-CB 3.8Å; K178-A334 HydrophobicContact CB-CB 3.99Å; I253-A334 HydrophobicContact CD1-CB 3.99Å; A334-I337 PolarHBondContact O-N 3.21Å; A334-V338 WeakPolarHBondContact O-CG2 3.39Å; A334-V338 PolarHBondContact O-N 3.45Å
335	A	98.3	Very high	94.3	Very high	31 Å²	31	58.9 Å²	58.9	26%	0.256	30%	0.299	S	S	.	.	H	α-helix	trans	-62.4	-42.9	175.1	0	0	0	0	0	113.1	K178 S333 V338 Q339	K178-A335 HydrophobicContact CD-CB 4.33Å; K178-A335 HydrophobicContact CG-CB 4.15Å; S333-A335 PolarHBondContact O-N 2.76Å; A335-V338 PolarHBondContact O-N 2.97Å; A335-Q339 PolarHBondContact O-N 3.32Å; A335-Q339 VanDerWaalsContact O-N 3.08Å
336	Q	98.4	Very high	92.5	Very high	102 Å²	102	59.5 Å²	59.5	48%	0.477	31%	0.312	S	S	.	.	H	α-helix	trans	-66	-40.5	176.7	-71.9	171.5	-43.3	0	0	111.5	P332 S333 Q339 V340	P332-Q336 HydrophobicContact CB-CB 4.18Å; S333-Q336 WeakPolarHBondContact O-CB 3.42Å; S333-Q336 PolarHBondContact O-N 2.85Å; S333-Q336 WeakPolarHBondContact OG-CG 3.3Å; S333-Q336 PolarHBondContact OG-N 2.66Å; Q336-Q339 PolarHBondContact O-N 3.18Å; Q336-V340 WeakPolarHBondContact O-CG2 3.07Å; Q336-V340 PolarHBondContact O-N 2.95Å
337	I	98.5	Very high	91	Very high	5 Å²	5	59.7 Å²	59.7	3%	0.026	32%	0.316	C	S	.	.	H	α-helix	trans	-60.9	-48	176.6	-62.3	168.6	0	0	0	110.5	A174 I253 F256 L319 P332 S333 A334 Q339 V340 L341	A174-I337 HydrophobicContact CB-CB 4.16Å; A174-I337 HydrophobicContact CB-CG2 3.63Å; I253-I337 HydrophobicContact CD1-CD1 4.11Å; I253-I337 HydrophobicContact CG2-CD1 4.12Å; F256-I337 HydrophobicContact CD1-CD1 4.13Å; F256-I337 HydrophobicContact CE1-CD1 3.91Å; F256-I337 HydrophobicContact CE1-CG2 4.28Å; F256-I337 HydrophobicContact CZ-CG2 4.42Å; L319-I337 HydrophobicContact CD1-CD1 4.49Å; L319-I337 HydrophobicContact CD1-CG1 4.11Å; L319-I337 HydrophobicContact CD1-CG2 4.08Å; L319-I337 HydrophobicContact CD2-CG2 4.21Å; P332-I337 HydrophobicContact CB-CG1 3.95Å; P332-I337 HydrophobicContact CG-CD1 3.97Å; P332-I337 HydrophobicContact CG-CG1 3.7Å; S333-I337 WeakPolarHBondContact O-CG1 3.38Å; S333-I337 PolarHBondContact O-N 3.04Å; A334-I337 PolarHBondContact O-N 3.21Å; I337-Q339 VanDerWaalsContact C-N 3.32Å; I337-Q339 PolarHBondContact O-N 2.89Å; I337-V340 PolarHBondContact O-N 3.32Å; I337-L341 HydrophobicContact CG2-CD1 3.74Å; I337-L341 HydrophobicContact CG2-CG 4.29Å; I337-L341 WeakPolarHBondContact O-CB 3.39Å; I337-L341 WeakPolarHBondContact O-CG 3.37Å; I337-L341 PolarHBondContact O-N 3.21Å
338	V	98.3	Very high	89.3	Confident	3 Å²	3	61.2 Å²	61.2	2%	0.018	32%	0.324	C	S	.	.	H	α-helix	trans	-58	-46.6	177.9	171.8	0	0	0	0	110.9	A174 R175 K178 A334 A335 V340 L341 E342	A174-V338 VanDerWaalsContact C-CG2 3.42Å; A174-V338 HydrophobicContact CB-CG2 3.72Å; R175-V338 HydrophobicContact CB-CG2 4.42Å; R175-V338 HydrophobicContact CG-CG1 4.05Å; R175-V338 HydrophobicContact CG-CG2 3.87Å; K178-V338 HydrophobicContact CB-CG2 4.34Å; K178-V338 HydrophobicContact CD-CB 4.38Å; K178-V338 HydrophobicContact CD-CG2 4.2Å; A334-V338 WeakPolarHBondContact O-CG2 3.39Å; A334-V338 PolarHBondContact O-N 3.45Å; A335-V338 PolarHBondContact O-N 2.97Å; V338-V340 PolarHBondContact O-N 3.32Å; V338-L341 PolarHBondContact O-N 2.6Å; V338-E342 HydrophobicContact CG1-CG 4.22Å; V338-E342 WeakPolarHBondContact O-CB 3.48Å; V338-E342 VanDerWaalsContact O-CG 3.31Å; V338-E342 WeakPolarHBondContact O-CG 3.34Å; V338-E342 PolarHBondContact O-N 3.31Å
339	Q	96.3	Very high	87.5	Confident	106 Å²	106	69.8 Å²	69.8	50%	0.495	35%	0.353	S	S	.	.	H	α-helix	trans	-57	-51.8	179.3	-179.2	179.4	-0.2	0	0	111.6	A335 Q336 I337 L341 E342 E343	A335-Q339 PolarHBondContact O-N 3.32Å; A335-Q339 VanDerWaalsContact O-N 3.08Å; Q336-Q339 PolarHBondContact O-N 3.18Å; I337-Q339 VanDerWaalsContact C-N 3.32Å; I337-Q339 PolarHBondContact O-N 2.89Å; Q339-L341 PolarHBondContact O-N 3.39Å; Q339-E342 PolarHBondContact O-N 3.16Å; Q339-E343 HydrophobicContact CG-CG 4.39Å; Q339-E343 WeakPolarHBondContact CG-OE1 3.1Å; Q339-E343 PolarHBondContact NE2-OE1 3.25Å; Q339-E343 WeakPolarHBondContact O-CB 3.45Å; Q339-E343 WeakPolarHBondContact O-CG 3.35Å; Q339-E343 PolarHBondContact O-N 2.97Å
340	V	94.3	Very high	84.9	Confident	77 Å²	77	64.3 Å²	64.3	47%	0.467	34%	0.34	S	S	.	.	H	α-helix	trans	-63	-41.3	-178.4	171.9	0	0	0	0	111.8	Q336 I337 V338 N344	Q336-V340 WeakPolarHBondContact O-CG2 3.07Å; Q336-V340 PolarHBondContact O-N 2.95Å; I337-V340 PolarHBondContact O-N 3.32Å; V338-V340 PolarHBondContact O-N 3.32Å; V340-N344 WeakPolarHBondContact O-CB 3.21Å; V340-N344 VanDerWaalsContact O-CG 3.24Å; V340-N344 PolarHBondContact O-N 2.99Å; V340-N344 PolarHBondContact O-ND2 2.77Å
341	L	93.9	Very high	82.3	Confident	22 Å²	22	63.2 Å²	63.2	12%	0.115	35%	0.347	C	S	.	.	H	α-helix	trans	-70.2	-33.7	179.9	-68.3	177.8	0	0	0	112.5	A170 L171 M316 L319 I337 V338 Q339 A345	A170-L341 HydrophobicContact CB-CD1 3.94Å; L171-L341 HydrophobicContact CB-CB 4.42Å; L171-L341 HydrophobicContact CB-CD1 4.08Å; L171-L341 HydrophobicContact CD1-CB 3.9Å; M316-L341 HydrophobicContact CE-CD2 3.94Å; L319-L341 HydrophobicContact CD2-CD1 4.26Å; L319-L341 HydrophobicContact CD2-CD2 4.32Å; I337-L341 HydrophobicContact CG2-CD1 3.74Å; I337-L341 HydrophobicContact CG2-CG 4.29Å; I337-L341 WeakPolarHBondContact O-CB 3.39Å; I337-L341 WeakPolarHBondContact O-CG 3.37Å; I337-L341 PolarHBondContact O-N 3.21Å; V338-L341 PolarHBondContact O-N 2.6Å; Q339-L341 PolarHBondContact O-N 3.39Å; L341-A345 WeakPolarHBondContact O-CB 3.17Å; L341-A345 PolarHBondContact O-N 3.17Å
342	E	92.2	Very high	79.8	Confident	80 Å²	80	68.8 Å²	68.8	37%	0.374	39%	0.385	S	S	.	.	H	α-helix	trans	-75.5	-42.2	177.4	-72.1	179.7	164.8	0	0	112.9	L171 R175 V338 Q339 N344 A345 A346	L171-E342 HydrophobicContact CD1-CG 3.79Å; R175-E342 IonicContact CZ-OE1 2.79Å; R175-E342 VanDerWaalsContact CZ-OE1 3.23Å; R175-E342 IonicContact NE-OE1 3.02Å; R175-E342 PolarHBondContact NE-OE1 3.28Å; R175-E342 IonicContact NH2-OE1 3.24Å; R175-E342 PolarHBondContact NH2-OE1 3.42Å; V338-E342 HydrophobicContact CG1-CG 4.22Å; V338-E342 WeakPolarHBondContact O-CB 3.48Å; V338-E342 VanDerWaalsContact O-CG 3.31Å; V338-E342 WeakPolarHBondContact O-CG 3.34Å; V338-E342 PolarHBondContact O-N 3.31Å; Q339-E342 PolarHBondContact O-N 3.16Å; E342-N344 VanDerWaalsContact C-N 3.32Å; E342-N344 PolarHBondContact O-N 3.46Å; E342-A345 PolarHBondContact O-N 2.86Å; E342-A346 PolarHBondContact O-N 3.44Å; E342-A346 VanDerWaalsContact O-N 3.13Å
343	E	85.5	Confident	77	Confident	102 Å²	102	75.7 Å²	75.7	48%	0.477	42%	0.415	S	S	.	.	H	α-helix	trans	-60.1	-43.7	176.6	-74.7	173.2	-175.8	0	0	111.1	Q339 A346 L347	Q339-E343 HydrophobicContact CG-CG 4.39Å; Q339-E343 WeakPolarHBondContact CG-OE1 3.1Å; Q339-E343 PolarHBondContact NE2-OE1 3.25Å; Q339-E343 WeakPolarHBondContact O-CB 3.45Å; Q339-E343 WeakPolarHBondContact O-CG 3.35Å; Q339-E343 PolarHBondContact O-N 2.97Å; E343-A346 WeakPolarHBondContact O-CB 3.47Å; E343-A346 PolarHBondContact O-N 3.02Å; E343-L347 PolarHBondContact O-N 3.5Å; E343-L347 VanDerWaalsContact O-N 3.17Å
344	N	72.8	Confident	74.3	Confident	50 Å²	50	80.1 Å²	80.1	27%	0.267	44%	0.441	S	S	.	.	H	α-helix	trans	-67.3	-37.7	177.5	-72.7	-34.3	0	0	0	112.8	V340 E342 A346 L347 D348	V340-N344 WeakPolarHBondContact O-CB 3.21Å; V340-N344 VanDerWaalsContact O-CG 3.24Å; V340-N344 PolarHBondContact O-N 2.99Å; V340-N344 PolarHBondContact O-ND2 2.77Å; E342-N344 VanDerWaalsContact C-N 3.32Å; E342-N344 PolarHBondContact O-N 3.46Å; N344-A346 PolarHBondContact O-N 3.41Å; N344-L347 PolarHBondContact O-N 3.39Å; N344-D348 PolarHBondContact O-N 3.34Å
345	A	73.8	Confident	71.7	Confident	35 Å²	35	86.5 Å²	86.5	29%	0.289	47%	0.473	S	S	.	.	H	α-helix	trans	-64.5	-26.4	174.8	0	0	0	0	0	112.7	L341 E342 R349	L341-A345 WeakPolarHBondContact O-CB 3.17Å; L341-A345 PolarHBondContact O-N 3.17Å; E342-A345 PolarHBondContact O-N 2.86Å; A345-R349 WeakPolarHBondContact O-CD 3.29Å; A345-R349 VanDerWaalsContact O-CG 3.31Å; A345-R349 WeakPolarHBondContact O-CG 3.4Å
346	A	61.7	Low	68.7	Low	63 Å²	63	90.1 Å²	90.1	52%	0.521	49%	0.492	S	S	.	.	H	α-helix	trans	-75.1	-39.4	173.3	0	0	0	0	0	112	E342 E343 N344 R349 A350	E342-A346 PolarHBondContact O-N 3.44Å; E342-A346 VanDerWaalsContact O-N 3.13Å; E343-A346 WeakPolarHBondContact O-CB 3.47Å; E343-A346 PolarHBondContact O-N 3.02Å; N344-A346 PolarHBondContact O-N 3.41Å; A346-R349 PolarHBondContact O-N 3.42Å; A346-A350 PolarHBondContact O-N 2.95Å
347	L	62.8	Low	66	Low	119 Å²	119	92.4 Å²	92.4	62%	0.623	51%	0.506	S	S	*	.	H	α-helix	trans	-64.5	-41.4	176.4	-68.2	172.6	0	0	0	112.3	E343 N344 R349 A350	E343-L347 PolarHBondContact O-N 3.5Å; E343-L347 VanDerWaalsContact O-N 3.17Å; N344-L347 PolarHBondContact O-N 3.39Å; L347-R349 PolarHBondContact O-N 3.02Å; L347-R349 VanDerWaalsContact O-N 3.16Å; L347-A350 PolarHBondContact O-N 2.82Å; L347-A350 VanDerWaalsContact O-N 3.16Å
348	D	61.6	Low	63.7	Low	105 Å²	105	102.6 Å²	102.6	56%	0.561	56%	0.561	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66	-16.6	177.6	-67.8	-20.5	0	0	0	112.9	R315 N344	R315-D348 IonicContact CZ-OD2 3.22Å; R315-D348 IonicContact NH1-OD1 2.83Å; R315-D348 IonicContact NH1-OD2 2.78Å; R315-D348 PolarHBondContact NH1-OD2 3.3Å; R315-D348 IonicContact NH2-OD2 2.84Å; R315-D348 PolarHBondContact NH2-OD2 2.98Å; N344-D348 PolarHBondContact O-N 3.34Å
349	R	58.9	Low	62	Low	209 Å²	209	107.6 Å²	107.6	79%	0.789	59%	0.588	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.8	-11	177.4	-68.6	176.7	-171.5	-171.2	3.4	113.7	A345 A346 L347	A345-R349 WeakPolarHBondContact O-CD 3.29Å; A345-R349 VanDerWaalsContact O-CG 3.31Å; A345-R349 WeakPolarHBondContact O-CG 3.4Å; A346-R349 PolarHBondContact O-N 3.42Å; L347-R349 PolarHBondContact O-N 3.02Å; L347-R349 VanDerWaalsContact O-N 3.16Å
350	A	43.4	Very low	60.1	Low	57 Å²	57	107.6 Å²	107.6	47%	0.471	59%	0.592	S	S	.	*	S	Bend	trans	-73.4	123.5	175.5	0	0	0	0	0	108.5	A346 L347 C352	A346-A350 PolarHBondContact O-N 2.95Å; L347-A350 PolarHBondContact O-N 2.82Å; L347-A350 VanDerWaalsContact O-N 3.16Å; A350-C352 PolarHBondContact O-N 2.94Å
351	P	43.7	Very low	58.2	Low	112 Å²	112	109.3 Å²	109.3	73%	0.727	60%	0.599	S	S	*	*			trans	-60.9	124.3	169.7	24.2	-29.2	0	0	0	107.7	E353	P351-E353 VanDerWaalsContact C-N 3.31Å; P351-E353 PolarHBondContact O-N 2.64Å
352	C	44.7	Very low	56.1	Low	120 Å²	120	114.5 Å²	114.5	81%	0.811	63%	0.628	S	S	*	*			trans	-57	99.7	165.5	-79.3	0	0	0	0	107.5	A350 V354	A350-C352 PolarHBondContact O-N 2.94Å; C352-V354 PolarHBondContact O-N 2.8Å
353	E	41.5	Very low	53.9	Low	167 Å²	167	116.6 Å²	116.6	78%	0.78	64%	0.644	S	S	*	*			trans	-64.3	93.8	162.9	-76.3	-172.4	167.7	0	0	106.6	P351 I355	P351-E353 VanDerWaalsContact C-N 3.31Å; P351-E353 PolarHBondContact O-N 2.64Å; E353-I355 PolarHBondContact O-N 2.82Å
354	V	41.8	Very low	51.8	Low	117 Å²	117	117.6 Å²	117.6	71%	0.709	66%	0.655	S	S	*	*			trans	-66.7	94.8	162.9	-178.9	0	0	0	0	105.2	C352 V356	C352-V354 PolarHBondContact O-N 2.8Å; V354-V356 VanDerWaalsContact C-N 3.28Å; V354-V356 HydrophobicContact CG1-CG2 4.05Å; V354-V356 PolarHBondContact O-N 3.16Å
355	I	43.6	Very low	50.3	Low	134 Å²	134	122.4 Å²	122.4	69%	0.687	68%	0.683	S	S	*	*			trans	-67.7	96.5	166.6	-57.9	175.9	0	0	0	105.7	E353 I357	E353-I355 PolarHBondContact O-N 2.82Å; I355-I357 HydrophobicContact CG2-CG1 3.95Å; I355-I357 PolarHBondContact O-N 3.24Å
356	V	36	Very low	48.5	Very low	107 Å²	107	129.2 Å²	129.2	65%	0.648	71%	0.713	S	S	*	*			trans	-71.4	108.3	164.5	-176.9	0	0	0	0	105.9	V354	V354-V356 VanDerWaalsContact C-N 3.28Å; V354-V356 HydrophobicContact CG1-CG2 4.05Å; V354-V356 PolarHBondContact O-N 3.16Å
357	I	40.4	Very low	47.4	Very low	151 Å²	151	134.7 Å²	134.7	77%	0.774	73%	0.729	S	S	*	*			trans	-87	109.3	165.9	-55.2	177.6	0	0	0	105.3	I355	I355-I357 HydrophobicContact CG2-CG1 3.95Å; I355-I357 PolarHBondContact O-N 3.24Å
358	D	50.2	Low	46	Very low	218 Å²	218	136.1 Å²	136.1	100%	1.166	74%	0.739	S	S	*	*			trans	-69.1	0	168.2	-87.7	-20.5	0	0	0	111.7

Retrieved 358 of 358 residues in 117.4 ms (Link to these results)

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