A0A087X330_POEFO Loading...

Mitogen-activated protein kinase kinase kinase 19

AlphaFold DB , UniProt , Accession A0A087X330, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 341 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	P	38.4	Very low	30.7	Very low	181 Å²	181	153.5 Å²	153.5	100%	1.175	86%	0.86	S	S	*	*				0	96.3	0	4.1	18.7	0	0	0	111.2
2	K	33.1	Very low	30.4	Very low	206 Å²	206	154 Å²	154	90%	0.896	86%	0.858	S	S	*	*			trans	29.8	125.8	148.7	-60.8	-179.8	179.7	178.3	0	117
3	R	32.5	Very low	30.2	Very low	242 Å²	242	152.5 Å²	152.5	91%	0.913	86%	0.856	S	S	*	*			cis	-168.3	148.5	43.7	-124	174.3	-170.3	-169.7	2.3	110.4
4	N	30.4	Very low	30.2	Very low	157 Å²	157	156.8 Å²	156.8	84%	0.84	86%	0.86	S	S	*	*			trans	-76.2	154.4	171.6	-69.4	-22.5	0	0	0	113.3
5	S	31.2	Very low	30.2	Very low	109 Å²	109	153.9 Å²	153.9	76%	0.762	86%	0.856	S	S	*	*				175.1	107.8	126.3	53.9	0	0	0	0	110.5
6	V	31.6	Very low	30.1	Very low	124 Å²	124	156.8 Å²	156.8	75%	0.752	86%	0.857	S	S	*	*				74.9	115.4	94	-179.9	0	0	0	0	115.8
7	E	28.2	Very low	30.3	Very low	177 Å²	177	155.1 Å²	155.1	83%	0.827	86%	0.855	S	S	*	*			trans	38.3	134.4	144.7	-63.3	172.5	154.5	0	0	122.8
8	S	28	Very low	30.4	Very low	117 Å²	117	157.5 Å²	157.5	82%	0.818	86%	0.856	S	S	*	*				176.2	132.3	98.8	50.7	0	0	0	0	112.5
9	T	27.9	Very low	30.2	Very low	147 Å²	147	155.9 Å²	155.9	90%	0.902	85%	0.854	S	S	*	*			trans	-80.3	127.4	168.1	40.2	0	0	0	0	109.9
10	A	30.2	Very low	30.1	Very low	82 Å²	82	157.4 Å²	157.4	68%	0.678	86%	0.857	S	S	*	*			trans	-139.7	106.4	166.4	0	0	0	0	0	110.8	L12	A10-L12 PolarHBondContact O-N 3.5Å
11	T	26.5	Very low	30	Very low	146 Å²	146	155.4 Å²	155.4	90%	0.896	86%	0.855	S	S	*	*			trans	-58.6	120.4	164	23.4	0	0	0	0	110.9
12	L	27.4	Very low	29.5	Very low	160 Å²	160	151.4 Å²	151.4	84%	0.838	83%	0.831	S	S	*	*			trans	-111.1	110.6	166.1	-102.6	111.1	0	0	0	110.7	A10 K14	A10-L12 PolarHBondContact O-N 3.5Å; L12-K14 PolarHBondContact O-N 3.48Å
13	T	27	Very low	29.3	Very low	135 Å²	135	152.7 Å²	152.7	83%	0.828	83%	0.831	S	S	*	*			trans	-60.6	119.5	167.9	47.5	0	0	0	0	110.9
14	K	31.1	Very low	29.1	Very low	212 Å²	212	148.5 Å²	148.5	92%	0.922	83%	0.825	S	S	*	*			trans	-87.6	109.7	167.3	-85.9	-176.9	177.4	177.3	0	110.3	L12	L12-K14 PolarHBondContact O-N 3.48Å
15	S	29.1	Very low	28.9	Very low	113 Å²	113	149.2 Å²	149.2	79%	0.79	82%	0.82	S	S	*	*	P	Polyproline II helix	trans	-67.7	132.2	172.6	50.1	0	0	0	0	112.3
16	K	29.6	Very low	28.7	Very low	200 Å²	200	150.8 Å²	150.8	87%	0.87	83%	0.825	S	S	*	*	P	Polyproline II helix	trans	-65.9	138	166.9	-73.4	178	174.4	178.7	0	110.8
17	P	32.4	Very low	28.4	Very low	129 Å²	129	152.7 Å²	152.7	84%	0.838	83%	0.826	S	S	*	*	P	Polyproline II helix	trans	-81.3	137.4	166.6	11.8	2.1	0	0	0	111.6
18	K	33.1	Very low	28.3	Very low	198 Å²	198	149.8 Å²	149.8	86%	0.861	83%	0.825	S	S	*	*	P	Polyproline II helix	trans	-76.2	153.5	171.6	-77.3	177.1	175.3	177.2	0	111.2
19	P	26.8	Very low	28.2	Very low	128 Å²	128	149.4 Å²	149.4	83%	0.831	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-79.4	125.8	178.4	32	-31.4	0	0	0	111	S21	P19-S21 PolarHBondContact O-N 3.22Å
20	M	26.9	Very low	28.3	Very low	185 Å²	185	148.9 Å²	148.9	91%	0.911	82%	0.815	S	S	*	*			trans	-83	111.6	166.2	-94.3	-175	89.3	0	0	109.5	S22	M20-S22 PolarHBondContact O-N 3.39Å
21	S	28.9	Very low	28.2	Very low	115 Å²	115	152.2 Å²	152.2	80%	0.804	82%	0.821	S	S	*	*			trans	-68.8	116.2	161.5	173.3	0	0	0	0	109.2	P19	P19-S21 PolarHBondContact O-N 3.22Å
22	S	28.3	Very low	28.4	Very low	98 Å²	98	150.9 Å²	150.9	69%	0.685	82%	0.818	S	S	*	*			trans	-120.9	100.2	163.4	62.5	0	0	0	0	109.7	M20 I24	M20-S22 PolarHBondContact O-N 3.39Å; S22-I24 PolarHBondContact O-N 3.46Å
23	R	27.7	Very low	28.3	Very low	233 Å²	233	148.5 Å²	148.5	88%	0.879	81%	0.814	S	S	*	*			trans	-61.5	103.1	171.3	-169.3	176.7	-170.8	179.8	3	109.6	K25	R23-K25 PolarHBondContact O-N 3.17Å
24	I	28.7	Very low	28.2	Very low	154 Å²	154	153 Å²	153	79%	0.79	82%	0.815	S	S	*	*			trans	-79.9	112.9	169.8	-62.3	177.5	0	0	0	107.8	S22 T26	S22-I24 PolarHBondContact O-N 3.46Å; I24-T26 PolarHBondContact O-N 3.37Å
25	K	26.3	Very low	28.3	Very low	171 Å²	171	149.3 Å²	149.3	74%	0.743	81%	0.811	S	S	*	*			trans	-68.1	121.5	172.3	-71.2	176.2	176.2	177.5	0	108.9	R23 Q27	R23-K25 PolarHBondContact O-N 3.17Å; K25-Q27 PolarHBondContact O-N 3.29Å
26	T	26.8	Very low	28.2	Very low	142 Å²	142	151.3 Å²	151.3	87%	0.871	81%	0.813	S	S	*	*			trans	-66.5	105.2	164.1	44.2	0	0	0	0	108.9	I24	I24-T26 PolarHBondContact O-N 3.37Å
27	Q	24.8	Very low	28.3	Very low	165 Å²	165	151.1 Å²	151.1	77%	0.771	81%	0.812	S	S	*	*			trans	-93.2	111.8	164.8	-77.2	-176	-1.1	0	0	108.6	K25 T29	K25-Q27 PolarHBondContact O-N 3.29Å; Q27-T29 PolarHBondContact O-N 3.49Å
28	S	26.8	Very low	28.2	Very low	115 Å²	115	149.7 Å²	149.7	80%	0.804	81%	0.805	S	S	*	*			trans	-69.8	102.2	163.5	49.1	0	0	0	0	109
29	T	25.8	Very low	28.2	Very low	110 Å²	110	146.6 Å²	146.6	68%	0.675	81%	0.805	S	S	*	*			trans	-99.3	98.1	168.6	48.1	0	0	0	0	109.7	Q27 N31	Q27-T29 PolarHBondContact O-N 3.49Å; T29-N31 PolarHBondContact O-N 3.48Å
30	T	29.3	Very low	28.4	Very low	136 Å²	136	148.6 Å²	148.6	83%	0.834	80%	0.8	S	S	*	*			trans	-70.4	105.5	157.7	46.8	0	0	0	0	108.3
31	N	28.7	Very low	28.6	Very low	151 Å²	151	148.6 Å²	148.6	81%	0.807	80%	0.803	S	S	*	*			trans	-115.9	100.9	167.7	-89.8	-10	0	0	0	109.6	T29	T29-N31 PolarHBondContact O-N 3.48Å
32	S	30.3	Very low	28.9	Very low	118 Å²	118	151.6 Å²	151.6	83%	0.825	80%	0.802	S	S	*	*			trans	-74.6	122.6	157.9	63	0	0	0	0	108.9
33	C	25.3	Very low	29.1	Very low	110 Å²	110	149.8 Å²	149.8	74%	0.743	80%	0.799	S	S	*	*			trans	-153.1	113.3	155.3	-150.1	0	0	0	0	112.5
34	R	25.8	Very low	29.4	Very low	230 Å²	230	146.9 Å²	146.9	87%	0.868	80%	0.8	S	S	*	*			trans	47.3	120.4	138	-65.1	178.1	178.3	-178.6	-1.5	119.2	D36	R34-D36 PolarHBondContact O-N 3.48Å
35	T	32.5	Very low	29.7	Very low	135 Å²	135	144.6 Å²	144.6	83%	0.828	79%	0.793	S	S	*	*			trans	-48.8	121	168.3	51.6	0	0	0	0	113
36	D	27.9	Very low	30.2	Very low	154 Å²	154	141.5 Å²	141.5	82%	0.824	80%	0.799	S	S	*	*			trans	-110.5	127.8	155.9	-158.8	-1.1	0	0	0	109.2	R34 S38	R34-D36 PolarHBondContact O-N 3.48Å; D36-S38 PolarHBondContact O-N 3.19Å
37	K	31.5	Very low	31.1	Very low	197 Å²	197	138.8 Å²	138.8	86%	0.857	78%	0.78	S	S	*	*			trans	-92.2	90.9	-172.2	-74	-178.3	179.9	175.8	0	108.8
38	S	30.9	Very low	32.4	Very low	99 Å²	99	138.7 Å²	138.7	69%	0.692	78%	0.784	S	S	*	*			trans	-84.7	145.5	163.4	48.4	0	0	0	0	111	D36 K40	D36-S38 PolarHBondContact O-N 3.19Å; S38-K40 PolarHBondContact O-N 2.91Å
39	P	31.9	Very low	34.7	Very low	132 Å²	132	138.4 Å²	138.4	86%	0.857	78%	0.778	S	S	*	*			trans	-68.6	120.8	-172.4	27	-32.1	0	0	0	110.3	L41	P39-L41 PolarHBondContact O-N 3.1Å
40	K	32	Very low	37.6	Very low	170 Å²	170	135.3 Å²	135.3	74%	0.739	76%	0.757	S	S	*	*			trans	-68.1	114.6	-178.5	-67	179.2	176.1	178.4	0	110.2	S38 K42	S38-K40 PolarHBondContact O-N 2.91Å; K40-K42 HydrophobicContact CB-CG 4.11Å; K40-K42 PolarHBondContact O-N 3.13Å
41	L	31.6	Very low	40.5	Very low	185 Å²	185	133.2 Å²	133.2	97%	0.969	74%	0.744	S	S	*	*			trans	-68.4	85.4	158.1	-152.2	81.3	0	0	0	107.5	P39	P39-L41 PolarHBondContact O-N 3.1Å
42	K	34.1	Very low	43.7	Very low	178 Å²	178	128.7 Å²	128.7	77%	0.774	72%	0.715	S	S	*	*			trans	-93.1	118.3	177.5	-96.3	-176.9	174.5	-171.2	0	109.6	K40	K40-K42 HydrophobicContact CB-CG 4.11Å; K40-K42 PolarHBondContact O-N 3.13Å
43	G	31.7	Very low	46.9	Very low	61 Å²	61	126 Å²	126	63%	0.629	70%	0.7	S	S	*	*			trans	158.9	112.5	161	0	0	0	0	0	113.2
44	L	34.9	Very low	50.3	Low	172 Å²	172	125.8 Å²	125.8	90%	0.901	69%	0.687	S	S	*	*			trans	70.6	128.7	168.5	-67.2	76.9	0	0	0	114.1
45	V	34.8	Very low	53.7	Low	105 Å²	105	116.7 Å²	116.7	64%	0.636	66%	0.664	S	S	*	*			cis	-157	142.7	37.8	175.2	0	0	0	0	107	N47	V45-N47 WeakPolarHBondContact CG1-OD1 3.44Å; V45-N47 PolarHBondContact O-N 2.89Å
46	A	37.1	Very low	56.7	Low	107 Å²	107	115.4 Å²	115.4	88%	0.884	65%	0.649	S	S	*	*			trans	-66.9	98.6	163.3	0	0	0	0	0	108.8
47	N	45.8	Very low	59.9	Low	85 Å²	85	111.3 Å²	111.3	46%	0.455	63%	0.629	S	S	.	*			trans	-115.1	127.6	167.9	-83.1	-14.9	0	0	0	107.1	V45 T49	V45-N47 WeakPolarHBondContact CG1-OD1 3.44Å; V45-N47 PolarHBondContact O-N 2.89Å; N47-T49 PolarHBondContact O-N 3.31Å; N47-T49 PolarHBondContact O-OG1 3.48Å
48	D	52.6	Low	62.8	Low	162 Å²	162	105.4 Å²	105.4	87%	0.866	61%	0.607	S	S	*	*			trans	-46.2	104.4	167.7	-76	-34.9	0	0	0	108.7	I50	D48-I50 PolarHBondContact O-N 2.95Å
49	T	74.2	Confident	65.5	Low	110 Å²	110	102 Å²	102	68%	0.675	59%	0.587	S	S	*	*			trans	-74	103.6	-174.9	-59.9	0	0	0	0	106.6	N47 T51	N47-T49 PolarHBondContact O-N 3.31Å; N47-T49 PolarHBondContact O-OG1 3.48Å; T49-T51 PolarHBondContact O-N 2.8Å; T49-T51 PolarHBondContact O-OG1 2.88Å
50	I	86.1	Confident	68.1	Low	44 Å²	44	103.8 Å²	103.8	23%	0.226	58%	0.582	C	S	.	*			trans	-59.1	108.3	175.5	-60.9	175.1	0	0	0	107	D48 T71 I77 L118 F130	D48-I50 PolarHBondContact O-N 2.95Å; I50-T71 HydrophobicContact CG2-CG2 4.08Å; I50-I77 HydrophobicContact CG2-CD1 4.21Å; I50-L118 HydrophobicContact CD1-CB 4.14Å; I50-F130 HydrophobicContact CB-CD2 4.4Å; I50-F130 HydrophobicContact CB-CE2 4.36Å; I50-F130 HydrophobicContact CB-CZ 4.41Å; I50-F130 HydrophobicContact CD1-CB 3.84Å; I50-F130 HydrophobicContact CD1-CD2 3.89Å; I50-F130 HydrophobicContact CD1-CG 3.86Å; I50-F130 HydrophobicContact CG2-CD1 4.34Å; I50-F130 HydrophobicContact CG2-CE1 4.44Å
51	T	91.9	Very high	70	Confident	92 Å²	92	98.1 Å²	98.1	56%	0.564	57%	0.572	S	S	*	*			trans	-83.9	126.6	174.1	-58.8	0	0	0	0	107.8	T49 T71 S72	T49-T51 PolarHBondContact O-N 2.8Å; T49-T51 PolarHBondContact O-OG1 2.88Å; T51-T71 WeakPolarHBondContact O-CA 3.41Å; T51-S72 PolarHBondContact O-N 2.83Å; T51-S72 VanDerWaalsContact O-N 3.1Å
52	W	95.6	Very high	71.7	Confident	56 Å²	56	94 Å²	94	21%	0.212	57%	0.565	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-147.4	150	-173.5	68.4	-71.7	0	0	0	111.6	K54 L70 I77 V79 F130	W52-K54 HydrophobicContact CE3-CB 4.2Å; W52-K54 HydrophobicContact CH2-CB 3.8Å; W52-K54 HydrophobicContact CH2-CD 4.02Å; W52-K54 HydrophobicContact CH2-CG 3.69Å; W52-K54 HydrophobicContact CZ3-CB 3.53Å; W52-K54 HydrophobicContact CZ3-CD 4.47Å; W52-K54 HydrophobicContact CZ3-CG 3.65Å; W52-L70 CarbonylContact C-O 3.47Å; W52-L70 WeakPolarHBondContact CA-O 3.03Å; W52-I77 HydrophobicContact CB-CD1 4.2Å; W52-V79 HydrophobicContact CD2-CG2 4.11Å; W52-V79 HydrophobicContact CE3-CG2 3.78Å; W52-V79 HydrophobicContact CH2-CB 3.98Å; W52-V79 HydrophobicContact CH2-CG1 3.9Å; W52-V79 HydrophobicContact CH2-CG2 4.07Å; W52-V79 HydrophobicContact CZ2-CB 4.38Å; W52-V79 HydrophobicContact CZ2-CG1 3.84Å; W52-V79 HydrophobicContact CZ2-CG2 4.41Å; W52-V79 HydrophobicContact CZ3-CB 4.06Å; W52-V79 HydrophobicContact CZ3-CG1 4.41Å; W52-V79 HydrophobicContact CZ3-CG2 3.72Å; W52-F130 AromaticContact CD1-CE1 3.47Å; W52-F130 VanDerWaalsContact CD1-CE1 3.47Å; W52-F130 AromaticContact CD1-CZ 3.88Å; W52-F130 HydrophobicContact CD2-CE1 4.22Å; W52-F130 AromaticContact CE2-CE1 3.9Å; W52-F130 AromaticContact CG-CE1 3.99Å; W52-F130 HydrophobicContact CG-CE1 3.99Å; W52-F130 AromaticContact NE1-CE1 3.43Å; W52-F130 AromaticContact NE1-CZ 3.69Å
53	A	96.8	Very high	73.4	Confident	61 Å²	61	88.2 Å²	88.2	50%	0.504	54%	0.538	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	133.5	169	0	0	0	0	0	109.7	G69 L70	A53-G69 VanDerWaalsContact O-CA 3.31Å; A53-G69 WeakPolarHBondContact O-CA 3.24Å; A53-L70 PolarHBondContact N-O 2.82Å; A53-L70 PolarHBondContact O-N 2.75Å
54	K	96.9	Very high	75.9	Confident	107 Å²	107	86.3 Å²	86.3	47%	0.465	52%	0.519	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	125.1	-177.9	-171.1	175.6	-161.7	177.9	0	111.4	W52 Y67 Q81	W52-K54 HydrophobicContact CE3-CB 4.2Å; W52-K54 HydrophobicContact CH2-CB 3.8Å; W52-K54 HydrophobicContact CH2-CD 4.02Å; W52-K54 HydrophobicContact CH2-CG 3.69Å; W52-K54 HydrophobicContact CZ3-CB 3.53Å; W52-K54 HydrophobicContact CZ3-CD 4.47Å; W52-K54 HydrophobicContact CZ3-CG 3.65Å; K54-Y67 HydrophobicContact CD-CD1 4.31Å; K54-Y67 HydrophobicContact CD-CE1 4.49Å; K54-Y67 HydrophobicContact CD-CG 4.45Å; K54-Y67 VanDerWaalsContact CE-CD2 3.44Å; K54-Y67 VanDerWaalsContact CE-CE2 3.46Å; K54-Y67 HydrophobicContact CG-CD1 4.18Å; K54-Y67 HydrophobicContact CG-CG 4.28Å; K54-Y67 VanDerWaalsContact NZ-CZ 3.32Å; K54-Q81 VanDerWaalsContact CE-OE1 3.31Å
55	G	96.6	Very high	78.7	Confident	38 Å²	38	79.7 Å²	79.7	39%	0.392	49%	0.485	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	-150.9	175.6	0	0	0	0	0	113.1	C68	G55-C68 WeakPolarHBondContact CA-O 3.31Å; G55-C68 PolarHBondContact N-O 3.38Å
56	E	95.5	Very high	81.5	Confident	108 Å²	108	76.5 Å²	76.5	51%	0.505	47%	0.466	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.7	162.9	-178.6	71.1	-73.5	169.1	0	0	113.8	L58 Y67 C68	E56-L58 HydrophobicContact CG-CD2 4.42Å; E56-Y67 CarbonylContact O-C 3.57Å; E56-Y67 WeakPolarHBondContact O-CA 3.32Å; E56-C68 VanDerWaalsContact CD-CB 3.42Å; E56-C68 HydrophobicContact CG-CB 4.25Å; E56-C68 PolarHBondContact O-N 2.92Å; E56-C68 WeakPolarHBondContact OE1-CB 3.5Å; E56-C68 PolarHBondContact OE1-SG 2.97Å
57	V	96.3	Very high	84.4	Confident	68 Å²	68	73.6 Å²	73.6	41%	0.412	43%	0.432	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	124.7	172.3	176	0	0	0	0	109.1	K60 T65 Y67	V57-K60 HydrophobicContact CG1-CG 3.95Å; V57-T65 HydrophobicContact CG1-CG2 3.78Å; V57-T65 HydrophobicContact CG2-CG2 4.1Å; V57-Y67 HydrophobicContact CG2-CD1 3.81Å; V57-Y67 HydrophobicContact CG2-CE1 3.46Å; V57-Y67 VanDerWaalsContact CG2-CE1 3.46Å
58	L	91.8	Very high	86.8	Confident	73 Å²	73	69.8 Å²	69.8	38%	0.382	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	-30.8	174.1	-60.2	176.6	0	0	0	112	E56 V66 C68 A78 Y133	E56-L58 HydrophobicContact CG-CD2 4.42Å; L58-V66 HydrophobicContact CB-CB 4.46Å; L58-V66 HydrophobicContact CB-CG1 4.25Å; L58-V66 HydrophobicContact CD1-CG1 4.3Å; L58-V66 PolarHBondContact N-O 3.25Å; L58-C68 HydrophobicContact CD1-CB 4.11Å; L58-C68 HydrophobicContact CD2-CB 4Å; L58-C68 HydrophobicContact CG-CB 4.04Å; L58-A78 HydrophobicContact CD1-CB 4.24Å; L58-Y133 HydrophobicContact CD1-CD2 3.81Å; L58-Y133 HydrophobicContact CD1-CE2 3.62Å; L58-Y133 HydrophobicContact CD2-CE2 3.84Å; L58-Y133 HydrophobicContact CG-CE2 4.39Å
59	G	87.6	Confident	88.9	Confident	28 Å²	28	62.1 Å²	62.1	29%	0.289	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-170.9	154.2	179.2	0	0	0	0	0	113.2	V66	G59-V66 PolarHBondContact N-O 2.82Å; G59-V66 PolarHBondContact O-N 3.32Å
60	K	86.1	Confident	90	Very high	169 Å²	169	60.7 Å²	60.7	74%	0.735	36%	0.359	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-126.5	131.3	173.7	-68.8	-179.5	179.9	-179.5	0	108.8	V57 T65	V57-K60 HydrophobicContact CG1-CG 3.95Å; K60-T65 HydrophobicContact CG-CG2 3.9Å
61	G	72.1	Confident	90.5	Very high	52 Å²	52	59.1 Å²	59.1	54%	0.536	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	-179.8	178	0	0	0	0	0	112.1	Y63 G64	G61-Y63 PolarHBondContact O-N 3.41Å; G61-Y63 VanDerWaalsContact O-N 3.11Å; G61-G64 PolarHBondContact N-O 3.28Å; G61-G64 PolarHBondContact O-N 3.41Å
62	A	67	Low	90.6	Very high	99 Å²	99	58.8 Å²	58.8	82%	0.818	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60	-21.5	177.5	0	0	0	0	0	113.2
63	Y	70.5	Confident	90.4	Very high	56 Å²	56	63.2 Å²	63.2	22%	0.22	38%	0.377	C	S	.	.	T	Hydrogen-bonded Turn	trans	-105.2	18.3	-175.4	-49.5	-72.7	0	0	0	113.4	G61 K80 V82 C198	G61-Y63 PolarHBondContact O-N 3.41Å; G61-Y63 VanDerWaalsContact O-N 3.11Å; Y63-K80 VanDerWaalsContact O-CE 3.27Å; Y63-K80 WeakPolarHBondContact O-CE 3.39Å; Y63-V82 WeakPolarHBondContact O-CG2 3.19Å; Y63-C198 PolarHBondContact OH-SG 3.35Å; Y63-C198 VanDerWaalsContact OH-SG 3.38Å
64	G	84.8	Confident	90.3	Very high	21 Å²	21	62.9 Å²	62.9	22%	0.216	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	120.1	-169	176.4	0	0	0	0	0	114.6	G61 Q81	G61-G64 PolarHBondContact N-O 3.28Å; G61-G64 PolarHBondContact O-N 3.41Å; G64-Q81 WeakPolarHBondContact CA-O 3.5Å
65	T	92.3	Very high	90.2	Very high	32 Å²	32	62.8 Å²	62.8	20%	0.196	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	132.6	179.2	-56.2	0	0	0	0	110	V57 K60 Y67 Q81	V57-T65 HydrophobicContact CG1-CG2 3.78Å; V57-T65 HydrophobicContact CG2-CG2 4.1Å; K60-T65 HydrophobicContact CG-CG2 3.9Å; T65-Y67 HydrophobicContact CG2-CD1 4.5Å; T65-Y67 HydrophobicContact CG2-CD2 4.05Å; T65-Y67 HydrophobicContact CG2-CE1 3.94Å; T65-Y67 HydrophobicContact CG2-CE2 3.42Å; T65-Y67 VanDerWaalsContact CG2-CE2 3.42Å; T65-Q81 PolarHBondContact N-O 3Å; T65-Q81 PolarHBondContact O-N 3.01Å
66	V	94.9	Very high	90.2	Very high	38 Å²	38	65 Å²	65	23%	0.23	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	127.3	175.5	-171.5	0	0	0	0	108.7	L58 G59 A78 V79 K80	L58-V66 HydrophobicContact CB-CB 4.46Å; L58-V66 HydrophobicContact CB-CG1 4.25Å; L58-V66 HydrophobicContact CD1-CG1 4.3Å; L58-V66 PolarHBondContact N-O 3.25Å; G59-V66 PolarHBondContact N-O 2.82Å; G59-V66 PolarHBondContact O-N 3.32Å; V66-A78 HydrophobicContact CG1-CB 4.2Å; V66-V79 CarbonylContact C-O 3.56Å; V66-V79 WeakPolarHBondContact CA-O 3.45Å; V66-K80 HydrophobicContact CG2-CB 4.14Å; V66-K80 HydrophobicContact CG2-CG 4.21Å
67	Y	96.6	Very high	90.3	Very high	46 Å²	46	59.9 Å²	59.9	18%	0.18	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	151	178.3	-62	-90.7	0	0	0	110.8	K54 E56 V57 T65 V79 Q81	K54-Y67 HydrophobicContact CD-CD1 4.31Å; K54-Y67 HydrophobicContact CD-CE1 4.49Å; K54-Y67 HydrophobicContact CD-CG 4.45Å; K54-Y67 VanDerWaalsContact CE-CD2 3.44Å; K54-Y67 VanDerWaalsContact CE-CE2 3.46Å; K54-Y67 HydrophobicContact CG-CD1 4.18Å; K54-Y67 HydrophobicContact CG-CG 4.28Å; K54-Y67 VanDerWaalsContact NZ-CZ 3.32Å; E56-Y67 CarbonylContact O-C 3.57Å; E56-Y67 WeakPolarHBondContact O-CA 3.32Å; V57-Y67 HydrophobicContact CG2-CD1 3.81Å; V57-Y67 HydrophobicContact CG2-CE1 3.46Å; V57-Y67 VanDerWaalsContact CG2-CE1 3.46Å; T65-Y67 HydrophobicContact CG2-CD1 4.5Å; T65-Y67 HydrophobicContact CG2-CD2 4.05Å; T65-Y67 HydrophobicContact CG2-CE1 3.94Å; T65-Y67 HydrophobicContact CG2-CE2 3.42Å; T65-Y67 VanDerWaalsContact CG2-CE2 3.42Å; Y67-V79 PolarHBondContact N-O 3.43Å; Y67-V79 PolarHBondContact O-N 3.28Å; Y67-Q81 HydrophobicContact CD2-CB 4.41Å; Y67-Q81 HydrophobicContact CD2-CG 4.15Å; Y67-Q81 HydrophobicContact CE2-CB 4.2Å; Y67-Q81 HydrophobicContact CE2-CG 4.32Å
68	C	96.9	Very high	90.3	Very high	6 Å²	6	57.2 Å²	57.2	4%	0.041	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71	141.4	160.5	-166.1	0	0	0	0	108.5	G55 E56 L58	G55-C68 WeakPolarHBondContact CA-O 3.31Å; G55-C68 PolarHBondContact N-O 3.38Å; E56-C68 VanDerWaalsContact CD-CB 3.42Å; E56-C68 HydrophobicContact CG-CB 4.25Å; E56-C68 PolarHBondContact O-N 2.92Å; E56-C68 WeakPolarHBondContact OE1-CB 3.5Å; E56-C68 PolarHBondContact OE1-SG 2.97Å; L58-C68 HydrophobicContact CD1-CB 4.11Å; L58-C68 HydrophobicContact CD2-CB 4Å; L58-C68 HydrophobicContact CG-CB 4.04Å
69	G	97.3	Very high	90.5	Very high	1 Å²	1	53.7 Å²	53.7	1%	0.01	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	147.6	177	0	0	0	0	0	111.1	A53 L76 I77	A53-G69 VanDerWaalsContact O-CA 3.31Å; A53-G69 WeakPolarHBondContact O-CA 3.24Å; G69-L76 CarbonylContact O-C 3.54Å; G69-L76 VanDerWaalsContact O-CA 3.32Å; G69-L76 WeakPolarHBondContact O-CA 3.23Å; G69-I77 PolarHBondContact N-O 2.85Å; G69-I77 WeakPolarHBondContact O-CG1 3.45Å; G69-I77 PolarHBondContact O-N 2.82Å
70	L	97.2	Very high	90.8	Very high	79 Å²	79	53 Å²	53	41%	0.414	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	117.8	172.9	-175.3	69.3	0	0	0	109	W52 A53 G74 Q75 L76	W52-L70 CarbonylContact C-O 3.47Å; W52-L70 WeakPolarHBondContact CA-O 3.03Å; A53-L70 PolarHBondContact N-O 2.82Å; A53-L70 PolarHBondContact O-N 2.75Å; L70-G74 WeakPolarHBondContact CD1-O 3.33Å; L70-Q75 WeakPolarHBondContact CA-O 3.33Å; L70-L76 HydrophobicContact CD1-CD2 3.89Å; L70-L76 HydrophobicContact CD1-CG 4.43Å
71	T	96.1	Very high	91.2	Very high	12 Å²	12	46.4 Å²	46.4	7%	0.074	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	165.1	177.9	72.2	0	0	0	0	111.7	I50 T51 Q73 G74 Q75 I77	I50-T71 HydrophobicContact CG2-CG2 4.08Å; T51-T71 WeakPolarHBondContact O-CA 3.41Å; T71-Q73 PolarHBondContact O-N 3.43Å; T71-Q73 VanDerWaalsContact O-N 3.13Å; T71-Q73 PolarHBondContact OG1-N 3.13Å; T71-Q73 PolarHBondContact OG1-OE1 2.9Å; T71-G74 PolarHBondContact O-N 3.02Å; T71-Q75 HydrophobicContact CG2-CB 4.37Å; T71-Q75 PolarHBondContact N-O 3.26Å; T71-Q75 WeakPolarHBondContact OG1-CB 3.37Å; T71-Q75 PolarHBondContact OG1-N 2.78Å; T71-I77 HydrophobicContact CG2-CD1 3.87Å; T71-I77 HydrophobicContact CG2-CG1 4.26Å; T71-I77 HydrophobicContact CG2-CG2 3.75Å
72	S	93.2	Very high	92.2	Very high	85 Å²	85	44.5 Å²	44.5	59%	0.594	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.5	-20.5	172.7	54.4	0	0	0	0	113.8	T51 G74	T51-S72 PolarHBondContact O-N 2.83Å; T51-S72 VanDerWaalsContact O-N 3.1Å; S72-G74 VanDerWaalsContact C-N 3.31Å
73	Q	93.2	Very high	93.3	Very high	149 Å²	149	44.6 Å²	44.6	70%	0.696	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.7	2.8	174.3	-54.3	81.5	5.9	0	0	113.2	T71	T71-Q73 PolarHBondContact O-N 3.43Å; T71-Q73 VanDerWaalsContact O-N 3.13Å; T71-Q73 PolarHBondContact OG1-N 3.13Å; T71-Q73 PolarHBondContact OG1-OE1 2.9Å
74	G	93	Very high	94.3	Very high	53 Å²	53	42.8 Å²	42.8	55%	0.546	25%	0.251	S	S	.	.	S	Bend	trans	79.1	14.6	-178.8	0	0	0	0	0	114.4	L70 T71 S72	L70-G74 WeakPolarHBondContact CD1-O 3.33Å; T71-G74 PolarHBondContact O-N 3.02Å; S72-G74 VanDerWaalsContact C-N 3.31Å
75	Q	95.3	Very high	94.4	Very high	105 Å²	105	45.9 Å²	45.9	49%	0.491	26%	0.263	S	S	.	.			trans	-87.8	132.3	178.3	-176.9	179.5	-13.7	0	0	110.8	L70 T71 I77	L70-Q75 WeakPolarHBondContact CA-O 3.33Å; T71-Q75 HydrophobicContact CG2-CB 4.37Å; T71-Q75 PolarHBondContact N-O 3.26Å; T71-Q75 WeakPolarHBondContact OG1-CB 3.37Å; T71-Q75 PolarHBondContact OG1-N 2.78Å; Q75-I77 HydrophobicContact CG-CG2 4.39Å
76	L	96.9	Very high	94.1	Very high	84 Å²	84	48.4 Å²	48.4	44%	0.44	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	135.4	169.6	-68.3	175.9	0	0	0	111.1	G69 L70 Y133	G69-L76 CarbonylContact O-C 3.54Å; G69-L76 VanDerWaalsContact O-CA 3.32Å; G69-L76 WeakPolarHBondContact O-CA 3.23Å; L70-L76 HydrophobicContact CD1-CD2 3.89Å; L70-L76 HydrophobicContact CD1-CG 4.43Å; L76-Y133 HydrophobicContact CB-CD1 3.78Å; L76-Y133 HydrophobicContact CB-CE1 4.46Å; L76-Y133 HydrophobicContact CB-CG 4.14Å; L76-Y133 HydrophobicContact CD1-CD1 4.09Å; L76-Y133 HydrophobicContact CD1-CE1 3.99Å; L76-Y133 WeakPolarHBondContact O-CB 3.41Å
77	I	97.3	Very high	93.9	Very high	2 Å²	2	51.3 Å²	51.3	1%	0.01	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	157.6	-179.9	62.3	170.7	0	0	0	110.9	I50 W52 G69 T71 Q75 V79 L118 F130	I50-I77 HydrophobicContact CG2-CD1 4.21Å; W52-I77 HydrophobicContact CB-CD1 4.2Å; G69-I77 PolarHBondContact N-O 2.85Å; G69-I77 WeakPolarHBondContact O-CG1 3.45Å; G69-I77 PolarHBondContact O-N 2.82Å; T71-I77 HydrophobicContact CG2-CD1 3.87Å; T71-I77 HydrophobicContact CG2-CG1 4.26Å; T71-I77 HydrophobicContact CG2-CG2 3.75Å; Q75-I77 HydrophobicContact CG-CG2 4.39Å; I77-V79 HydrophobicContact CD1-CG2 3.75Å; I77-V79 HydrophobicContact CG1-CG2 3.89Å; I77-L118 HydrophobicContact CB-CD1 4.08Å; I77-L118 HydrophobicContact CG2-CD1 3.41Å; I77-L118 VanDerWaalsContact CG2-CD1 3.41Å; I77-F130 HydrophobicContact CD1-CD1 3.68Å; I77-F130 HydrophobicContact CD1-CE1 4.35Å
78	A	97	Very high	93.6	Very high	11 Å²	11	52.5 Å²	52.5	9%	0.091	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	131.4	168.2	0	0	0	0	0	109.5	L58 V66 M131	L58-A78 HydrophobicContact CD1-CB 4.24Å; V66-A78 HydrophobicContact CG1-CB 4.2Å; A78-M131 HydrophobicContact CB-CB 4.42Å; A78-M131 PolarHBondContact N-O 3.4Å; A78-M131 PolarHBondContact O-N 3.23Å
79	V	95.8	Very high	93.2	Very high	0 Å²	0	56.7 Å²	56.7	0%	0	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	104.8	-177.4	-166.8	0	0	0	0	110	W52 V66 Y67 I77 Q81 I129 F130	W52-V79 HydrophobicContact CD2-CG2 4.11Å; W52-V79 HydrophobicContact CE3-CG2 3.78Å; W52-V79 HydrophobicContact CH2-CB 3.98Å; W52-V79 HydrophobicContact CH2-CG1 3.9Å; W52-V79 HydrophobicContact CH2-CG2 4.07Å; W52-V79 HydrophobicContact CZ2-CB 4.38Å; W52-V79 HydrophobicContact CZ2-CG1 3.84Å; W52-V79 HydrophobicContact CZ2-CG2 4.41Å; W52-V79 HydrophobicContact CZ3-CB 4.06Å; W52-V79 HydrophobicContact CZ3-CG1 4.41Å; W52-V79 HydrophobicContact CZ3-CG2 3.72Å; V66-V79 CarbonylContact C-O 3.56Å; V66-V79 WeakPolarHBondContact CA-O 3.45Å; Y67-V79 PolarHBondContact N-O 3.43Å; Y67-V79 PolarHBondContact O-N 3.28Å; I77-V79 HydrophobicContact CD1-CG2 3.75Å; I77-V79 HydrophobicContact CG1-CG2 3.89Å; V79-Q81 HydrophobicContact CG1-CG 4.06Å; V79-I129 WeakPolarHBondContact CA-O 3.2Å; V79-F130 HydrophobicContact CB-CD1 4.39Å; V79-F130 HydrophobicContact CG1-CD1 3.85Å; V79-F130 HydrophobicContact CG1-CE1 3.75Å; V79-F130 HydrophobicContact CG2-CD1 3.77Å; V79-F130 HydrophobicContact CG2-CE1 4.06Å
80	K	94.2	Very high	92.9	Very high	12 Å²	12	62.8 Å²	62.8	5%	0.052	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	116.6	172.5	-177.8	176.2	179.6	-178.7	0	108.5	Y63 V66 E102 S128 I129 M131 D195	Y63-K80 VanDerWaalsContact O-CE 3.27Å; Y63-K80 WeakPolarHBondContact O-CE 3.39Å; V66-K80 HydrophobicContact CG2-CB 4.14Å; V66-K80 HydrophobicContact CG2-CG 4.21Å; K80-E102 IonicContact NZ-OE1 3.89Å; K80-E102 PolarHBondContact NZ-OE1 2.92Å; K80-E102 IonicContact NZ-OE2 3.41Å; K80-S128 CarbonylContact O-C 3.58Å; K80-S128 WeakPolarHBondContact O-CA 3.45Å; K80-I129 HydrophobicContact CB-CB 4.33Å; K80-I129 PolarHBondContact N-O 3.22Å; K80-I129 PolarHBondContact O-N 2.94Å; K80-M131 HydrophobicContact CB-CE 3.7Å; K80-D195 IonicContact NZ-OD1 3.96Å; K80-D195 PolarHBondContact NZ-OD1 2.75Å
81	Q	94.2	Very high	92.4	Very high	32 Å²	32	60.9 Å²	60.9	15%	0.15	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	131.7	178.2	-65.1	-162.2	-51.5	0	0	111.4	K54 G64 T65 Y67 V79 V126 V127 S128	K54-Q81 VanDerWaalsContact CE-OE1 3.31Å; G64-Q81 WeakPolarHBondContact CA-O 3.5Å; T65-Q81 PolarHBondContact N-O 3Å; T65-Q81 PolarHBondContact O-N 3.01Å; Y67-Q81 HydrophobicContact CD2-CB 4.41Å; Y67-Q81 HydrophobicContact CD2-CG 4.15Å; Y67-Q81 HydrophobicContact CE2-CB 4.2Å; Y67-Q81 HydrophobicContact CE2-CG 4.32Å; V79-Q81 HydrophobicContact CG1-CG 4.06Å; Q81-V126 HydrophobicContact CB-CG1 3.93Å; Q81-V126 HydrophobicContact CG-CG1 4.24Å; Q81-V127 WeakPolarHBondContact CA-O 3.38Å; Q81-S128 PolarHBondContact NE2-OG 3.07Å; Q81-S128 VanDerWaalsContact NE2-OG 3.13Å
82	V	91.9	Very high	92	Very high	12 Å²	12	60.9 Å²	60.9	7%	0.073	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	119.4	175.6	-167.3	0	0	0	0	108.7	Y63 L99 V126 V127	Y63-V82 WeakPolarHBondContact O-CG2 3.19Å; V82-L99 HydrophobicContact CB-CD1 3.82Å; V82-L99 HydrophobicContact CB-CD2 4.46Å; V82-L99 HydrophobicContact CG1-CD1 3.93Å; V82-L99 HydrophobicContact CG2-CD1 4.15Å; V82-L99 HydrophobicContact CG2-CD2 3.9Å; V82-V126 WeakPolarHBondContact O-CA 3.18Å; V82-V127 PolarHBondContact N-O 2.91Å; V82-V127 PolarHBondContact O-N 3.3Å
83	C	91.4	Very high	91.8	Very high	101 Å²	101	63.5 Å²	63.5	68%	0.682	37%	0.37	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.3	124.2	174.1	-57.9	0	0	0	0	108.9
84	L	90.3	Very high	91.5	Very high	18 Å²	18	64.2 Å²	64.2	9%	0.094	37%	0.371	C	S	.	.			trans	-83.4	137.2	171.3	-55.5	175.6	0	0	0	108.6	S86 A92 E95 Y96 L99 L122 H125 V127	L84-S86 PolarHBondContact O-N 3.06Å; L84-A92 HydrophobicContact CB-CB 4.02Å; L84-E95 HydrophobicContact CD2-CB 4.07Å; L84-E95 HydrophobicContact CD2-CG 3.92Å; L84-Y96 HydrophobicContact CD1-CD2 4.06Å; L84-Y96 HydrophobicContact CD1-CG 4.44Å; L84-L99 HydrophobicContact CD2-CD1 4.17Å; L84-L122 HydrophobicContact CD1-CD1 4.12Å; L84-H125 HydrophobicContact CB-CB 4.33Å; L84-H125 WeakPolarHBondContact CB-O 3.43Å; L84-H125 WeakPolarHBondContact CG-O 3.28Å; L84-H125 PolarHBondContact N-O 3.13Å; L84-V127 HydrophobicContact CD1-CG2 3.96Å; L84-V127 HydrophobicContact CD2-CG2 4.29Å; L84-V127 HydrophobicContact CG-CG2 4.17Å
85	D	87.8	Confident	91.1	Very high	86 Å²	86	64.2 Å²	64.2	46%	0.46	36%	0.357	S	S	.	.			trans	-70.6	103.1	179.7	-171.2	-12	0	0	0	110.7	S87 D88 A92	D85-S87 VanDerWaalsContact CG-OG 3.32Å; D85-S87 PolarHBondContact O-N 3.25Å; D85-S87 WeakPolarHBondContact OD1-CB 3.49Å; D85-S87 PolarHBondContact OD1-N 2.81Å; D85-S87 PolarHBondContact OD1-OG 3.28Å; D85-S87 PolarHBondContact OD2-OG 2.72Å; D85-D88 CarbonylContact O-C 3.59Å; D85-D88 PolarHBondContact O-N 2.91Å; D85-A92 WeakPolarHBondContact O-CB 3.46Å
86	S	85.6	Confident	90.9	Very high	84 Å²	84	62.9 Å²	62.9	59%	0.587	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.2	-15.9	179.2	56.5	0	0	0	0	113.6	L84	L84-S86 PolarHBondContact O-N 3.06Å
87	S	90.3	Very high	90.4	Very high	100 Å²	100	63.3 Å²	63.3	70%	0.699	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.4	-21.4	178.9	73.5	0	0	0	0	113.1	D85	D85-S87 VanDerWaalsContact CG-OG 3.32Å; D85-S87 PolarHBondContact O-N 3.25Å; D85-S87 WeakPolarHBondContact OD1-CB 3.49Å; D85-S87 PolarHBondContact OD1-N 2.81Å; D85-S87 PolarHBondContact OD1-OG 3.28Å; D85-S87 PolarHBondContact OD2-OG 2.72Å
88	D	91.3	Very high	89.8	Confident	71 Å²	71	66 Å²	66	38%	0.38	36%	0.361	S	S	.	.			trans	-125	92.4	175.8	-175.7	-17.2	0	0	0	110.1	D85 D90 A91 A92	D85-D88 CarbonylContact O-C 3.59Å; D85-D88 PolarHBondContact O-N 2.91Å; D88-D90 PolarHBondContact O-N 3.24Å; D88-D90 PolarHBondContact OD1-N 3.04Å; D88-D90 VanDerWaalsContact OD1-N 3.12Å; D88-A91 HydrophobicContact CB-CB 3.89Å; D88-A91 PolarHBondContact O-N 3.14Å; D88-A91 PolarHBondContact OD1-N 2.82Å; D88-A91 VanDerWaalsContact OD2-CB 3.31Å; D88-A91 WeakPolarHBondContact OD2-CB 3.47Å; D88-A92 WeakPolarHBondContact O-CB 2.86Å; D88-A92 PolarHBondContact O-N 3.3Å
89	P	88.7	Confident	89.3	Confident	93 Å²	93	65.5 Å²	65.5	60%	0.604	36%	0.357	S	S	*	.	H	α-helix	trans	-58.8	-32.5	-179	-25.9	35.2	0	0	0	114.3	K93	P89-K93 VanDerWaalsContact O-CB 3.28Å; P89-K93 WeakPolarHBondContact O-CB 2.95Å; P89-K93 PolarHBondContact O-N 3.48Å
90	D	89.8	Confident	88.9	Confident	129 Å²	129	67.9 Å²	67.9	69%	0.69	37%	0.368	S	S	*	.	H	α-helix	trans	-75.5	-43	-178.3	-75.4	-34.2	0	0	0	110.8	D88 K93 K94	D88-D90 PolarHBondContact O-N 3.24Å; D88-D90 PolarHBondContact OD1-N 3.04Å; D88-D90 VanDerWaalsContact OD1-N 3.12Å; D90-K93 PolarHBondContact O-N 2.82Å; D90-K94 WeakPolarHBondContact O-CB 3.46Å; D90-K94 PolarHBondContact O-N 2.96Å
91	A	86.6	Confident	88.5	Confident	40 Å²	40	69.3 Å²	69.3	33%	0.331	39%	0.386	S	S	.	.	H	α-helix	trans	-62.5	-44.1	171.8	0	0	0	0	0	111.6	D88 K93 K94 E95	D88-A91 HydrophobicContact CB-CB 3.89Å; D88-A91 PolarHBondContact O-N 3.14Å; D88-A91 PolarHBondContact OD1-N 2.82Å; D88-A91 VanDerWaalsContact OD2-CB 3.31Å; D88-A91 WeakPolarHBondContact OD2-CB 3.47Å; A91-K93 PolarHBondContact O-N 2.87Å; A91-K94 PolarHBondContact O-N 2.82Å; A91-E95 WeakPolarHBondContact O-CB 3.07Å; A91-E95 PolarHBondContact O-N 3.16Å
92	A	87.8	Confident	88	Confident	12 Å²	12	68.3 Å²	68.3	10%	0.099	38%	0.381	C	S	.	.	H	α-helix	trans	-59.2	-44.9	175.8	0	0	0	0	0	112.3	L84 D85 D88 E95 Y96	L84-A92 HydrophobicContact CB-CB 4.02Å; D85-A92 WeakPolarHBondContact O-CB 3.46Å; D88-A92 WeakPolarHBondContact O-CB 2.86Å; D88-A92 PolarHBondContact O-N 3.3Å; A92-E95 PolarHBondContact O-N 2.81Å; A92-Y96 VanDerWaalsContact O-CB 3.29Å; A92-Y96 WeakPolarHBondContact O-CB 3.37Å; A92-Y96 PolarHBondContact O-N 3.04Å
93	K	88.7	Confident	87.9	Confident	139 Å²	139	67.9 Å²	67.9	60%	0.604	38%	0.379	S	S	*	.	H	α-helix	trans	-63.6	-41.9	177.3	-174.8	177.6	-178.3	-179	0	111.6	P89 D90 A91 Y96 N97	P89-K93 VanDerWaalsContact O-CB 3.28Å; P89-K93 WeakPolarHBondContact O-CB 2.95Å; P89-K93 PolarHBondContact O-N 3.48Å; D90-K93 PolarHBondContact O-N 2.82Å; A91-K93 PolarHBondContact O-N 2.87Å; K93-Y96 PolarHBondContact O-N 2.91Å; K93-N97 WeakPolarHBondContact O-CB 3.11Å; K93-N97 PolarHBondContact O-N 2.85Å; K93-N97 PolarHBondContact O-ND2 2.84Å
94	K	86.7	Confident	87.8	Confident	165 Å²	165	66.4 Å²	66.4	72%	0.717	36%	0.364	S	S	*	.	H	α-helix	trans	-62.5	-45.2	176.8	-174.8	178.5	-179.8	178	0	111.7	D90 A91 N97 R98	D90-K94 WeakPolarHBondContact O-CB 3.46Å; D90-K94 PolarHBondContact O-N 2.96Å; A91-K94 PolarHBondContact O-N 2.82Å; K94-N97 PolarHBondContact O-N 3.24Å; K94-R98 PolarHBondContact O-N 2.88Å
95	E	86.3	Confident	87.7	Confident	53 Å²	53	65.9 Å²	65.9	25%	0.248	36%	0.361	C	S	.	.	H	α-helix	trans	-68.5	-40.5	178.6	-176.4	59.9	-169.2	0	0	111.8	L84 A91 A92 N97 R98 L99	L84-E95 HydrophobicContact CD2-CB 4.07Å; L84-E95 HydrophobicContact CD2-CG 3.92Å; A91-E95 WeakPolarHBondContact O-CB 3.07Å; A91-E95 PolarHBondContact O-N 3.16Å; A92-E95 PolarHBondContact O-N 2.81Å; E95-N97 PolarHBondContact O-N 2.85Å; E95-R98 WeakPolarHBondContact O-CB 3.17Å; E95-R98 PolarHBondContact O-N 2.92Å; E95-R98 IonicContact OE1-CZ 3.87Å; E95-R98 IonicContact OE1-NE 3.98Å; E95-R98 PolarHBondContact OE1-NE 2.82Å; E95-R98 VanDerWaalsContact OE1-NE 3.16Å; E95-R98 IonicContact OE1-NH2 3.94Å; E95-R98 PolarHBondContact OE1-NH2 3.37Å; E95-R98 IonicContact OE2-CZ 2.8Å; E95-R98 IonicContact OE2-NE 3.74Å; E95-R98 PolarHBondContact OE2-NE 2.91Å; E95-R98 IonicContact OE2-NH2 3.32Å; E95-L99 HydrophobicContact CG-CD1 4.27Å; E95-L99 WeakPolarHBondContact O-CG 3.16Å; E95-L99 PolarHBondContact O-N 3.3Å
96	Y	89.5	Confident	87.8	Confident	76 Å²	76	62 Å²	62	30%	0.298	34%	0.341	S	S	.	.	H	α-helix	trans	-58.6	-46.8	172.9	-179.3	-101.2	0	0	0	112	L84 A92 K93 R98 L99 Q100 L122 V127	L84-Y96 HydrophobicContact CD1-CD2 4.06Å; L84-Y96 HydrophobicContact CD1-CG 4.44Å; A92-Y96 VanDerWaalsContact O-CB 3.29Å; A92-Y96 WeakPolarHBondContact O-CB 3.37Å; A92-Y96 PolarHBondContact O-N 3.04Å; K93-Y96 PolarHBondContact O-N 2.91Å; Y96-R98 VanDerWaalsContact C-N 3.29Å; Y96-R98 PolarHBondContact O-N 2.71Å; Y96-L99 PolarHBondContact O-N 2.85Å; Y96-Q100 WeakPolarHBondContact O-CB 3.48Å; Y96-Q100 PolarHBondContact O-N 3.49Å; Y96-L122 HydrophobicContact CD2-CD2 4.33Å; Y96-L122 HydrophobicContact CE2-CB 4.5Å; Y96-L122 HydrophobicContact CE2-CD2 3.8Å; Y96-V127 HydrophobicContact CD2-CG2 3.7Å; Y96-V127 HydrophobicContact CE2-CG2 4.08Å
97	N	87.8	Confident	88.1	Confident	93 Å²	93	61.9 Å²	61.9	50%	0.497	33%	0.33	S	S	.	.	H	α-helix	trans	-61.7	-38.2	176.8	-71.8	-19.8	0	0	0	112	K93 K94 E95 Q100 G101	K93-N97 WeakPolarHBondContact O-CB 3.11Å; K93-N97 PolarHBondContact O-N 2.85Å; K93-N97 PolarHBondContact O-ND2 2.84Å; K94-N97 PolarHBondContact O-N 3.24Å; E95-N97 PolarHBondContact O-N 2.85Å; N97-Q100 PolarHBondContact O-N 3.49Å; N97-G101 PolarHBondContact O-N 3.07Å; N97-G101 VanDerWaalsContact O-N 3.15Å
98	R	85	Confident	88.2	Confident	59 Å²	59	60.6 Å²	60.6	22%	0.223	32%	0.317	C	S	.	.	H	α-helix	trans	-61.7	-47	174.3	-169.6	-164	68.9	68.8	-1.9	111.2	K94 E95 Y96 Q100 G101 E102	K94-R98 PolarHBondContact O-N 2.88Å; E95-R98 WeakPolarHBondContact O-CB 3.17Å; E95-R98 PolarHBondContact O-N 2.92Å; E95-R98 IonicContact OE1-CZ 3.87Å; E95-R98 IonicContact OE1-NE 3.98Å; E95-R98 PolarHBondContact OE1-NE 2.82Å; E95-R98 VanDerWaalsContact OE1-NE 3.16Å; E95-R98 IonicContact OE1-NH2 3.94Å; E95-R98 PolarHBondContact OE1-NH2 3.37Å; E95-R98 IonicContact OE2-CZ 2.8Å; E95-R98 IonicContact OE2-NE 3.74Å; E95-R98 PolarHBondContact OE2-NE 2.91Å; E95-R98 IonicContact OE2-NH2 3.32Å; Y96-R98 VanDerWaalsContact C-N 3.29Å; Y96-R98 PolarHBondContact O-N 2.71Å; R98-Q100 VanDerWaalsContact C-N 3.34Å; R98-G101 PolarHBondContact O-N 3.16Å; R98-E102 IonicContact NH1-OE2 3.23Å; R98-E102 PolarHBondContact NH1-OE2 2.88Å; R98-E102 PolarHBondContact O-N 2.7Å
99	L	86.1	Confident	88.3	Confident	1 Å²	1	57.4 Å²	57.4	1%	0.005	30%	0.3	C	S	.	.	H	α-helix	trans	-64.7	-37.9	177.7	-69.7	167.9	0	0	0	111.8	V82 L84 E95 Y96 G101 E102 V103 V127	V82-L99 HydrophobicContact CB-CD1 3.82Å; V82-L99 HydrophobicContact CB-CD2 4.46Å; V82-L99 HydrophobicContact CG1-CD1 3.93Å; V82-L99 HydrophobicContact CG2-CD1 4.15Å; V82-L99 HydrophobicContact CG2-CD2 3.9Å; L84-L99 HydrophobicContact CD2-CD1 4.17Å; E95-L99 HydrophobicContact CG-CD1 4.27Å; E95-L99 WeakPolarHBondContact O-CG 3.16Å; E95-L99 PolarHBondContact O-N 3.3Å; Y96-L99 PolarHBondContact O-N 2.85Å; L99-G101 VanDerWaalsContact C-N 3.29Å; L99-G101 PolarHBondContact O-N 2.85Å; L99-E102 WeakPolarHBondContact O-CB 3Å; L99-E102 PolarHBondContact O-N 2.92Å; L99-E102 VanDerWaalsContact O-N 3.15Å; L99-V103 VanDerWaalsContact O-CG2 3.26Å; L99-V103 WeakPolarHBondContact O-CG2 3.46Å; L99-V103 PolarHBondContact O-N 2.72Å; L99-V127 HydrophobicContact CD1-CB 3.94Å; L99-V127 HydrophobicContact CD1-CG1 4.18Å; L99-V127 HydrophobicContact CD1-CG2 3.86Å
100	Q	87.6	Confident	88.6	Confident	49 Å²	49	63.3 Å²	63.3	23%	0.229	31%	0.31	C	S	.	.	H	α-helix	trans	-61.5	-39.9	176.3	-168.9	59	53.6	0	0	111.4	Y96 N97 R98 E102 V103 D104	Y96-Q100 WeakPolarHBondContact O-CB 3.48Å; Y96-Q100 PolarHBondContact O-N 3.49Å; N97-Q100 PolarHBondContact O-N 3.49Å; R98-Q100 VanDerWaalsContact C-N 3.34Å; Q100-E102 PolarHBondContact O-N 2.65Å; Q100-V103 PolarHBondContact O-N 2.82Å; Q100-D104 PolarHBondContact NE2-OD1 3.15Å; Q100-D104 PolarHBondContact NE2-OD2 2.98Å; Q100-D104 WeakPolarHBondContact O-CB 3.38Å; Q100-D104 PolarHBondContact O-N 3.28Å
101	G	85	Confident	89	Confident	42 Å²	42	59.8 Å²	59.8	43%	0.433	29%	0.29	S	S	.	.	H	α-helix	trans	-61.9	-39.5	172.9	0	0	0	0	0	113.7	N97 R98 L99 L105	N97-G101 PolarHBondContact O-N 3.07Å; N97-G101 VanDerWaalsContact O-N 3.15Å; R98-G101 PolarHBondContact O-N 3.16Å; L99-G101 VanDerWaalsContact C-N 3.29Å; L99-G101 PolarHBondContact O-N 2.85Å; G101-L105 WeakPolarHBondContact O-CB 3.44Å; G101-L105 PolarHBondContact O-N 3.02Å
102	E	84.3	Confident	89.5	Confident	12 Å²	12	61.1 Å²	61.1	6%	0.056	30%	0.296	C	S	.	.	H	α-helix	trans	-62.5	-44.8	173.7	179.9	177.6	163.4	0	0	111	K80 R98 L99 Q100 L105 L106 G197	K80-E102 IonicContact NZ-OE1 3.89Å; K80-E102 PolarHBondContact NZ-OE1 2.92Å; K80-E102 IonicContact NZ-OE2 3.41Å; R98-E102 IonicContact NH1-OE2 3.23Å; R98-E102 PolarHBondContact NH1-OE2 2.88Å; R98-E102 PolarHBondContact O-N 2.7Å; L99-E102 WeakPolarHBondContact O-CB 3Å; L99-E102 PolarHBondContact O-N 2.92Å; L99-E102 VanDerWaalsContact O-N 3.15Å; Q100-E102 PolarHBondContact O-N 2.65Å; E102-L105 PolarHBondContact O-N 3.07Å; E102-L106 WeakPolarHBondContact O-CB 3.41Å; E102-L106 PolarHBondContact O-N 3.25Å; E102-G197 VanDerWaalsContact CD-CA 3.49Å; E102-G197 WeakPolarHBondContact OE2-CA 3.38Å
103	V	88.8	Confident	90	Very high	2 Å²	2	60.7 Å²	60.7	1%	0.012	29%	0.293	C	S	.	.	H	α-helix	trans	-64	-46.9	178.5	167.5	0	0	0	0	111.7	L99 Q100 L105 L106 K107 F117 T120 I129	L99-V103 VanDerWaalsContact O-CG2 3.26Å; L99-V103 WeakPolarHBondContact O-CG2 3.46Å; L99-V103 PolarHBondContact O-N 2.72Å; Q100-V103 PolarHBondContact O-N 2.82Å; V103-L105 VanDerWaalsContact C-N 3.27Å; V103-L105 PolarHBondContact O-N 3.28Å; V103-L106 PolarHBondContact O-N 3.06Å; V103-K107 HydrophobicContact CG1-CD 4.13Å; V103-K107 HydrophobicContact CG1-CG 4.49Å; V103-K107 WeakPolarHBondContact O-CB 3.33Å; V103-K107 VanDerWaalsContact O-CG 3.31Å; V103-K107 WeakPolarHBondContact O-CG 3.32Å; V103-K107 PolarHBondContact O-N 2.85Å; V103-F117 HydrophobicContact CG1-CE2 4.12Å; V103-F117 HydrophobicContact CG1-CZ 4Å; V103-T120 HydrophobicContact CB-CG2 4.11Å; V103-T120 HydrophobicContact CG1-CG2 3.5Å; V103-T120 VanDerWaalsContact CG1-CG2 3.5Å; V103-T120 HydrophobicContact CG2-CG2 3.43Å; V103-T120 VanDerWaalsContact CG2-CG2 3.43Å; V103-I129 HydrophobicContact CG2-CD1 3.86Å; V103-I129 HydrophobicContact CG2-CG1 4.02Å
104	D	90	Very high	90.4	Very high	70 Å²	70	54.2 Å²	54.2	37%	0.374	26%	0.264	S	S	.	.	H	α-helix	trans	-69.7	-28.1	-178.5	-67	-22.2	0	0	0	112	Q100 K107 R201	Q100-D104 PolarHBondContact NE2-OD1 3.15Å; Q100-D104 PolarHBondContact NE2-OD2 2.98Å; Q100-D104 WeakPolarHBondContact O-CB 3.38Å; Q100-D104 PolarHBondContact O-N 3.28Å; D104-K107 IonicContact OD1-NZ 3.49Å; D104-K107 PolarHBondContact OD1-NZ 2.83Å; D104-R201 PolarHBondContact O-NH2 2.94Å
105	L	88.3	Confident	90.8	Very high	8 Å²	8	46.6 Å²	46.6	4%	0.042	23%	0.232	C	C	.	.	H	α-helix	trans	-66.1	-55.7	167.1	179.5	61.7	0	0	0	110.6	G101 E102 V103 K107 T108 L109 V173 A199 R201	G101-L105 WeakPolarHBondContact O-CB 3.44Å; G101-L105 PolarHBondContact O-N 3.02Å; E102-L105 PolarHBondContact O-N 3.07Å; V103-L105 VanDerWaalsContact C-N 3.27Å; V103-L105 PolarHBondContact O-N 3.28Å; L105-K107 VanDerWaalsContact C-N 3.3Å; L105-K107 PolarHBondContact O-N 3.07Å; L105-T108 PolarHBondContact O-N 2.78Å; L105-T108 PolarHBondContact O-OG1 2.89Å; L105-L109 HydrophobicContact CG-CD1 4.38Å; L105-V173 HydrophobicContact CD1-CB 4.46Å; L105-V173 HydrophobicContact CD1-CG1 4.01Å; L105-V173 HydrophobicContact CD1-CG2 3.58Å; L105-V173 HydrophobicContact CD2-CG1 4.07Å; L105-V173 HydrophobicContact CG-CG1 4.48Å; L105-A199 HydrophobicContact CD2-CB 3.68Å; L105-R201 HydrophobicContact CD1-CG 3.95Å
106	L	90.4	Very high	91.3	Very high	5 Å²	5	45.2 Å²	45.2	3%	0.026	23%	0.232	C	C	.	.	H	α-helix	trans	-62	-36.4	-172.4	-164.5	62.7	0	0	0	112.3	E102 V103 T108 L109 V115 F117 M131 F196	E102-L106 WeakPolarHBondContact O-CB 3.41Å; E102-L106 PolarHBondContact O-N 3.25Å; V103-L106 PolarHBondContact O-N 3.06Å; L106-T108 PolarHBondContact O-N 3.04Å; L106-T108 VanDerWaalsContact O-N 3.15Å; L106-L109 HydrophobicContact CD1-CD1 4.43Å; L106-L109 PolarHBondContact O-N 2.82Å; L106-V115 HydrophobicContact CD1-CG1 4.13Å; L106-F117 HydrophobicContact CB-CD2 4.44Å; L106-F117 HydrophobicContact CD2-CB 4.37Å; L106-F117 HydrophobicContact CD2-CD2 3.93Å; L106-F117 HydrophobicContact CG-CB 4.08Å; L106-F117 HydrophobicContact CG-CD2 4.24Å; L106-M131 HydrophobicContact CD2-CG 4.37Å; L106-M131 HydrophobicContact CD2-SD 4.29Å; L106-F196 HydrophobicContact CD1-CB 4.34Å; L106-F196 HydrophobicContact CD1-CD2 3.47Å; L106-F196 VanDerWaalsContact CD1-CD2 3.47Å; L106-F196 HydrophobicContact CD1-CE2 3.93Å; L106-F196 HydrophobicContact CD1-CG 3.9Å
107	K	91.4	Very high	91.6	Very high	81 Å²	81	43.9 Å²	43.9	35%	0.352	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.6	-31.8	172.4	-81.4	172.1	-178.3	170.2	0	114.1	V103 D104 L105 F117	V103-K107 HydrophobicContact CG1-CD 4.13Å; V103-K107 HydrophobicContact CG1-CG 4.49Å; V103-K107 WeakPolarHBondContact O-CB 3.33Å; V103-K107 VanDerWaalsContact O-CG 3.31Å; V103-K107 WeakPolarHBondContact O-CG 3.32Å; V103-K107 PolarHBondContact O-N 2.85Å; D104-K107 IonicContact OD1-NZ 3.49Å; D104-K107 PolarHBondContact OD1-NZ 2.83Å; L105-K107 VanDerWaalsContact C-N 3.3Å; L105-K107 PolarHBondContact O-N 3.07Å; K107-F117 HydrophobicContact CB-CD1 4.43Å; K107-F117 HydrophobicContact CD-CE1 4.09Å; K107-F117 HydrophobicContact CD-CZ 4.32Å; K107-F117 HydrophobicContact CG-CD1 3.58Å; K107-F117 HydrophobicContact CG-CE1 3.27Å; K107-F117 HydrophobicContact CG-CE2 4.42Å; K107-F117 HydrophobicContact CG-CG 4.27Å; K107-F117 HydrophobicContact CG-CZ 3.72Å
108	T	91.6	Very high	91.9	Very high	72 Å²	72	42.8 Å²	42.8	44%	0.442	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.6	-6.6	-177.4	63.3	0	0	0	0	113.7	L105 L106 R201	L105-T108 PolarHBondContact O-N 2.78Å; L105-T108 PolarHBondContact O-OG1 2.89Å; L106-T108 PolarHBondContact O-N 3.04Å; L106-T108 VanDerWaalsContact O-N 3.15Å; T108-R201 PolarHBondContact OG1-NH2 2.93Å
109	L	94.1	Very high	92.3	Very high	4 Å²	4	40.5 Å²	40.5	2%	0.021	22%	0.217	C	C	.	.			trans	-100.5	113.9	-175.3	-55.2	178.9	0	0	0	110	L105 L106 I114 F167 L168 V173 F196	L105-L109 HydrophobicContact CG-CD1 4.38Å; L106-L109 HydrophobicContact CD1-CD1 4.43Å; L106-L109 PolarHBondContact O-N 2.82Å; L109-I114 HydrophobicContact CB-CD1 4.49Å; L109-I114 HydrophobicContact CB-CG2 4.12Å; L109-F167 HydrophobicContact CB-CE1 4.3Å; L109-F167 HydrophobicContact CD2-CE1 3.95Å; L109-L168 HydrophobicContact CD1-CD2 3.71Å; L109-L168 HydrophobicContact CD2-CD2 3.96Å; L109-L168 HydrophobicContact CG-CD2 4.42Å; L109-V173 HydrophobicContact CD2-CG2 4.2Å; L109-F196 HydrophobicContact CD1-CD1 3.83Å; L109-F196 HydrophobicContact CD1-CE1 3.59Å; L109-F196 HydrophobicContact CD1-CZ 4.12Å
110	R	95.7	Very high	92.7	Very high	217 Å²	217	41.8 Å²	41.8	82%	0.819	22%	0.224	S	C	*	.			trans	-132	103.9	175.9	-66.8	-174.7	179	-174.6	-1.6	109.6	F167	R110-F167 WeakPolarHBondContact O-CZ 3.44Å
111	H	97.2	Very high	93	Very high	56 Å²	56	41.1 Å²	41.1	26%	0.259	23%	0.225	S	C	.	.			trans	-155.1	150.7	-178.9	-170.2	-100	0	0	0	110.2	N113 I114 F167	H111-N113 PolarHBondContact CE1-OD1 3.15Å; H111-N113 VanDerWaalsContact CE1-OD1 3.27Å; H111-N113 PolarHBondContact ND1-N 2.97Å; H111-N113 PolarHBondContact O-N 2.89Å; H111-I114 HydrophobicContact CB-CB 4.16Å; H111-I114 HydrophobicContact CB-CD1 3.84Å; H111-I114 HydrophobicContact CB-CG1 4.03Å; H111-I114 PolarHBondContact O-N 2.94Å; H111-F167 HydrophobicContact CB-CD1 3.95Å; H111-F167 HydrophobicContact CB-CD2 4.15Å; H111-F167 HydrophobicContact CB-CE1 4.09Å; H111-F167 HydrophobicContact CB-CE2 4.31Å; H111-F167 HydrophobicContact CB-CG 3.95Å; H111-F167 HydrophobicContact CB-CZ 4.28Å; H111-F167 AromaticContact CD2-CD2 3.7Å; H111-F167 AromaticContact CD2-CG 3.82Å; H111-F167 AromaticContact CG-CG 3.92Å
112	S	96.8	Very high	93.3	Very high	67 Å²	67	43.3 Å²	43.3	47%	0.469	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.8	-39.7	178.3	43.9	0	0	0	0	112.6	K192	S112-K192 WeakPolarHBondContact O-CE 3.4Å; S112-K192 PolarHBondContact O-NZ 3.46Å; S112-K192 VanDerWaalsContact O-NZ 3.16Å
113	N	98	Very high	93.6	Very high	3 Å²	3	50.1 Å²	50.1	2%	0.016	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.3	18.2	-176.3	-52.1	101.2	0	0	0	114.8	H111 Q160 I191 L193	H111-N113 PolarHBondContact CE1-OD1 3.15Å; H111-N113 VanDerWaalsContact CE1-OD1 3.27Å; H111-N113 PolarHBondContact ND1-N 2.97Å; H111-N113 PolarHBondContact O-N 2.89Å; N113-Q160 WeakPolarHBondContact CB-O 3.34Å; N113-Q160 PolarHBondContact ND2-OE1 2.94Å; N113-I191 WeakPolarHBondContact CA-O 3.22Å; N113-I191 WeakPolarHBondContact CB-O 3.42Å; N113-I191 PolarHBondContact ND2-O 3.34Å; N113-L193 WeakPolarHBondContact O-CG 3.4Å; N113-L193 PolarHBondContact O-N 3.4Å
114	I	97.7	Very high	93.6	Very high	3 Å²	3	56.8 Å²	56.8	2%	0.015	28%	0.284	C	S	.	.	B	Isolated β-bridge	trans	-123.8	142.4	172.6	-65.2	173.2	0	0	0	108.2	L109 H111 G116 F167 L168 F196	L109-I114 HydrophobicContact CB-CD1 4.49Å; L109-I114 HydrophobicContact CB-CG2 4.12Å; H111-I114 HydrophobicContact CB-CB 4.16Å; H111-I114 HydrophobicContact CB-CD1 3.84Å; H111-I114 HydrophobicContact CB-CG1 4.03Å; H111-I114 PolarHBondContact O-N 2.94Å; I114-G116 PolarHBondContact O-N 3.01Å; I114-F167 HydrophobicContact CD1-CD1 3.25Å; I114-F167 HydrophobicContact CD1-CE1 3.65Å; I114-F167 HydrophobicContact CD1-CG 4.25Å; I114-L168 HydrophobicContact CD1-CD2 3.59Å; I114-L168 HydrophobicContact CD1-CG 3.91Å; I114-F196 HydrophobicContact CG2-CE2 3.88Å; I114-F196 HydrophobicContact CG2-CZ 3.65Å
115	V	96.4	Very high	93.6	Very high	5 Å²	5	58.6 Å²	58.6	3%	0.03	29%	0.29	C	S	.	.	P	Polyproline II helix	trans	-58.3	129.1	175.5	70.3	0	0	0	0	111.8	L106 M131 E132 I134 L193 I194 F196	L106-V115 HydrophobicContact CD1-CG1 4.13Å; V115-M131 HydrophobicContact CG2-CB 4.08Å; V115-E132 VanDerWaalsContact CA-OE1 3.29Å; V115-E132 WeakPolarHBondContact CA-OE1 3.37Å; V115-E132 HydrophobicContact CG2-CG 3.84Å; V115-I134 HydrophobicContact CB-CD1 4.49Å; V115-I134 HydrophobicContact CG2-CD1 4.02Å; V115-L193 PolarHBondContact N-O 2.76Å; V115-I194 HydrophobicContact CB-CG2 3.93Å; V115-I194 HydrophobicContact CG1-CG2 4.44Å; V115-I194 HydrophobicContact CG2-CG2 4.21Å; V115-F196 HydrophobicContact CG1-CD2 4.25Å; V115-F196 HydrophobicContact CG1-CE2 3.96Å
116	G	95.6	Very high	93.8	Very high	24 Å²	24	59.8 Å²	59.8	25%	0.247	30%	0.297	C	S	.	.	P	Polyproline II helix	trans	-72.5	124.8	179.2	0	0	0	0	0	111.3	I114 M131 E132	I114-G116 PolarHBondContact O-N 3.01Å; G116-M131 CarbonylContact O-C 3.3Å; G116-M131 VanDerWaalsContact O-CA 3.25Å; G116-M131 WeakPolarHBondContact O-CA 3.48Å; G116-E132 PolarHBondContact N-OE1 3.46Å; G116-E132 PolarHBondContact O-N 2.92Å
117	F	95.3	Very high	93.9	Very high	48 Å²	48	59.9 Å²	59.9	21%	0.211	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	131.4	169.3	179.4	-101.5	0	0	0	111	V103 L106 K107 G119 T120 I129	V103-F117 HydrophobicContact CG1-CE2 4.12Å; V103-F117 HydrophobicContact CG1-CZ 4Å; L106-F117 HydrophobicContact CB-CD2 4.44Å; L106-F117 HydrophobicContact CD2-CB 4.37Å; L106-F117 HydrophobicContact CD2-CD2 3.93Å; L106-F117 HydrophobicContact CG-CB 4.08Å; L106-F117 HydrophobicContact CG-CD2 4.24Å; K107-F117 HydrophobicContact CB-CD1 4.43Å; K107-F117 HydrophobicContact CD-CE1 4.09Å; K107-F117 HydrophobicContact CD-CZ 4.32Å; K107-F117 HydrophobicContact CG-CD1 3.58Å; K107-F117 HydrophobicContact CG-CE1 3.27Å; K107-F117 HydrophobicContact CG-CE2 4.42Å; K107-F117 HydrophobicContact CG-CG 4.27Å; K107-F117 HydrophobicContact CG-CZ 3.72Å; F117-G119 VanDerWaalsContact CE2-O 3.26Å; F117-G119 WeakPolarHBondContact CE2-O 3.4Å; F117-G119 WeakPolarHBondContact CZ-O 3.49Å; F117-T120 HydrophobicContact CE2-CG2 3.76Å; F117-T120 HydrophobicContact CZ-CG2 3.83Å; F117-I129 HydrophobicContact CD2-CG2 4.3Å; F117-I129 HydrophobicContact CE2-CG2 4.06Å
118	L	94.9	Very high	94.1	Very high	70 Å²	70	56.2 Å²	56.2	37%	0.366	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	-33.5	178.3	-56.1	-179.9	0	0	0	112.4	I50 I77 F130 M131	I50-L118 HydrophobicContact CD1-CB 4.14Å; I77-L118 HydrophobicContact CB-CD1 4.08Å; I77-L118 HydrophobicContact CG2-CD1 3.41Å; I77-L118 VanDerWaalsContact CG2-CD1 3.41Å; L118-F130 HydrophobicContact CB-CB 3.98Å; L118-F130 WeakPolarHBondContact CB-O 3.46Å; L118-F130 PolarHBondContact N-O 3.42Å; L118-M131 VanDerWaalsContact CD1-C 3.5Å; L118-M131 WeakPolarHBondContact CD1-O 3.31Å
119	G	93.7	Very high	94.2	Very high	12 Å²	12	52.9 Å²	52.9	12%	0.124	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	166.9	-177	-179.3	0	0	0	0	0	113.7	F117 F130	F117-G119 VanDerWaalsContact CE2-O 3.26Å; F117-G119 WeakPolarHBondContact CE2-O 3.4Å; F117-G119 WeakPolarHBondContact CZ-O 3.49Å; G119-F130 PolarHBondContact N-O 3.28Å; G119-F130 WeakPolarHBondContact O-CD2 3.44Å; G119-F130 PolarHBondContact O-N 2.86Å
120	T	93.8	Very high	94.3	Very high	27 Å²	27	52.8 Å²	52.8	17%	0.166	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	155.8	170.6	49.7	0	0	0	0	112.3	V103 F117 S128 I129	V103-T120 HydrophobicContact CB-CG2 4.11Å; V103-T120 HydrophobicContact CG1-CG2 3.5Å; V103-T120 VanDerWaalsContact CG1-CG2 3.5Å; V103-T120 HydrophobicContact CG2-CG2 3.43Å; V103-T120 VanDerWaalsContact CG2-CG2 3.43Å; F117-T120 HydrophobicContact CE2-CG2 3.76Å; F117-T120 HydrophobicContact CZ-CG2 3.83Å; T120-S128 CarbonylContact C-O 3.59Å; T120-S128 WeakPolarHBondContact CA-O 3.22Å; T120-I129 HydrophobicContact CG2-CB 4.44Å; T120-I129 HydrophobicContact CG2-CG1 4.21Å; T120-I129 HydrophobicContact CG2-CG2 4.29Å
121	S	93.5	Very high	94.3	Very high	35 Å²	35	43.5 Å²	43.5	25%	0.245	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	155.3	166.5	67.5	0	0	0	0	111.4	V127 S128 F130	S121-V127 WeakPolarHBondContact O-CA 3.25Å; S121-S128 PolarHBondContact N-O 3.07Å; S121-S128 PolarHBondContact O-N 3.15Å; S121-F130 WeakPolarHBondContact OG-CE2 3.26Å
122	L	91.9	Very high	94.2	Very high	88 Å²	88	42.7 Å²	42.7	46%	0.461	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	118.3	168.4	172.2	63.3	0	0	0	107.4	L84 Y96 V126 V127	L84-L122 HydrophobicContact CD1-CD1 4.12Å; Y96-L122 HydrophobicContact CD2-CD2 4.33Å; Y96-L122 HydrophobicContact CE2-CB 4.5Å; Y96-L122 HydrophobicContact CE2-CD2 3.8Å; L122-V126 WeakPolarHBondContact CA-O 3.29Å; L122-V127 HydrophobicContact CD1-CG2 3.91Å
123	Y	90.5	Very high	94.2	Very high	155 Å²	155	42.1 Å²	42.1	61%	0.608	21%	0.212	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-142.1	130.1	178.1	-178	-101.1	0	0	0	110.1	H125 V126	Y123-H125 VanDerWaalsContact C-N 3.31Å; Y123-H125 PolarHBondContact O-N 3.27Å; Y123-V126 PolarHBondContact N-O 3.27Å; Y123-V126 WeakPolarHBondContact O-CA 3.46Å; Y123-V126 WeakPolarHBondContact O-CB 2.94Å; Y123-V126 PolarHBondContact O-N 3.24Å
124	Q	89.1	Confident	94	Very high	142 Å²	142	42.5 Å²	42.5	66%	0.664	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	46.1	50.3	179.4	-68.4	179.8	-15.3	0	0	113.4	V126	Q124-V126 PolarHBondContact O-N 3.09Å; Q124-V126 VanDerWaalsContact O-N 3.16Å
125	H	89.3	Confident	93.7	Very high	108 Å²	108	45 Å²	45	50%	0.5	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	62.8	14.9	-177.8	-53.6	-84.4	0	0	0	115.2	L84 Y123	L84-H125 HydrophobicContact CB-CB 4.33Å; L84-H125 WeakPolarHBondContact CB-O 3.43Å; L84-H125 WeakPolarHBondContact CG-O 3.28Å; L84-H125 PolarHBondContact N-O 3.13Å; Y123-H125 VanDerWaalsContact C-N 3.31Å; Y123-H125 PolarHBondContact O-N 3.27Å
126	V	92.5	Very high	93.4	Very high	33 Å²	33	45 Å²	45	20%	0.2	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	118	173.7	-176.9	0	0	0	0	109.5	Q81 V82 L122 Y123 Q124	Q81-V126 HydrophobicContact CB-CG1 3.93Å; Q81-V126 HydrophobicContact CG-CG1 4.24Å; V82-V126 WeakPolarHBondContact O-CA 3.18Å; L122-V126 WeakPolarHBondContact CA-O 3.29Å; Y123-V126 PolarHBondContact N-O 3.27Å; Y123-V126 WeakPolarHBondContact O-CA 3.46Å; Y123-V126 WeakPolarHBondContact O-CB 2.94Å; Y123-V126 PolarHBondContact O-N 3.24Å; Q124-V126 PolarHBondContact O-N 3.09Å; Q124-V126 VanDerWaalsContact O-N 3.16Å
127	V	93.1	Very high	93.3	Very high	7 Å²	7	44.8 Å²	44.8	4%	0.042	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	123.6	168.8	-178.9	0	0	0	0	107.9	Q81 V82 L84 Y96 L99 S121 L122 I129	Q81-V127 WeakPolarHBondContact CA-O 3.38Å; V82-V127 PolarHBondContact N-O 2.91Å; V82-V127 PolarHBondContact O-N 3.3Å; L84-V127 HydrophobicContact CD1-CG2 3.96Å; L84-V127 HydrophobicContact CD2-CG2 4.29Å; L84-V127 HydrophobicContact CG-CG2 4.17Å; Y96-V127 HydrophobicContact CD2-CG2 3.7Å; Y96-V127 HydrophobicContact CE2-CG2 4.08Å; L99-V127 HydrophobicContact CD1-CB 3.94Å; L99-V127 HydrophobicContact CD1-CG1 4.18Å; L99-V127 HydrophobicContact CD1-CG2 3.86Å; S121-V127 WeakPolarHBondContact O-CA 3.25Å; L122-V127 HydrophobicContact CD1-CG2 3.91Å; V127-I129 HydrophobicContact CG1-CG1 4.39Å
128	S	94.6	Very high	93.3	Very high	5 Å²	5	43.4 Å²	43.4	4%	0.035	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	126.7	173.6	-57.1	0	0	0	0	109.7	K80 Q81 T120 S121	K80-S128 CarbonylContact O-C 3.58Å; K80-S128 WeakPolarHBondContact O-CA 3.45Å; Q81-S128 PolarHBondContact NE2-OG 3.07Å; Q81-S128 VanDerWaalsContact NE2-OG 3.13Å; T120-S128 CarbonylContact C-O 3.59Å; T120-S128 WeakPolarHBondContact CA-O 3.22Å; S121-S128 PolarHBondContact N-O 3.07Å; S121-S128 PolarHBondContact O-N 3.15Å
129	I	94.1	Very high	93.4	Very high	1 Å²	1	40 Å²	40	1%	0.005	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	116.3	174	-50.5	177.3	0	0	0	107.5	V79 K80 V103 F117 T120 V127 M131	V79-I129 WeakPolarHBondContact CA-O 3.2Å; K80-I129 HydrophobicContact CB-CB 4.33Å; K80-I129 PolarHBondContact N-O 3.22Å; K80-I129 PolarHBondContact O-N 2.94Å; V103-I129 HydrophobicContact CG2-CD1 3.86Å; V103-I129 HydrophobicContact CG2-CG1 4.02Å; F117-I129 HydrophobicContact CD2-CG2 4.3Å; F117-I129 HydrophobicContact CE2-CG2 4.06Å; T120-I129 HydrophobicContact CG2-CB 4.44Å; T120-I129 HydrophobicContact CG2-CG1 4.21Å; T120-I129 HydrophobicContact CG2-CG2 4.29Å; V127-I129 HydrophobicContact CG1-CG1 4.39Å; I129-M131 HydrophobicContact CG2-CG 4.22Å; I129-M131 HydrophobicContact CG2-SD 4.47Å
130	F	95.6	Very high	93.5	Very high	2 Å²	2	40.3 Å²	40.3	1%	0.009	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	126.7	-178.5	-56.1	-78.8	0	0	0	109.7	I50 W52 I77 V79 L118 G119 S121	I50-F130 HydrophobicContact CB-CD2 4.4Å; I50-F130 HydrophobicContact CB-CE2 4.36Å; I50-F130 HydrophobicContact CB-CZ 4.41Å; I50-F130 HydrophobicContact CD1-CB 3.84Å; I50-F130 HydrophobicContact CD1-CD2 3.89Å; I50-F130 HydrophobicContact CD1-CG 3.86Å; I50-F130 HydrophobicContact CG2-CD1 4.34Å; I50-F130 HydrophobicContact CG2-CE1 4.44Å; W52-F130 AromaticContact CD1-CE1 3.47Å; W52-F130 VanDerWaalsContact CD1-CE1 3.47Å; W52-F130 AromaticContact CD1-CZ 3.88Å; W52-F130 HydrophobicContact CD2-CE1 4.22Å; W52-F130 AromaticContact CE2-CE1 3.9Å; W52-F130 AromaticContact CG-CE1 3.99Å; W52-F130 HydrophobicContact CG-CE1 3.99Å; W52-F130 AromaticContact NE1-CE1 3.43Å; W52-F130 AromaticContact NE1-CZ 3.69Å; I77-F130 HydrophobicContact CD1-CD1 3.68Å; I77-F130 HydrophobicContact CD1-CE1 4.35Å; V79-F130 HydrophobicContact CB-CD1 4.39Å; V79-F130 HydrophobicContact CG1-CD1 3.85Å; V79-F130 HydrophobicContact CG1-CE1 3.75Å; V79-F130 HydrophobicContact CG2-CD1 3.77Å; V79-F130 HydrophobicContact CG2-CE1 4.06Å; L118-F130 HydrophobicContact CB-CB 3.98Å; L118-F130 WeakPolarHBondContact CB-O 3.46Å; L118-F130 PolarHBondContact N-O 3.42Å; G119-F130 PolarHBondContact N-O 3.28Å; G119-F130 WeakPolarHBondContact O-CD2 3.44Å; G119-F130 PolarHBondContact O-N 2.86Å; S121-F130 WeakPolarHBondContact OG-CE2 3.26Å
131	M	95.8	Very high	93.5	Very high	22 Å²	22	41.5 Å²	41.5	11%	0.108	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135	160.3	-175.6	-62	171.5	-68.2	0	0	110.1	A78 K80 L106 V115 G116 L118 I129	A78-M131 HydrophobicContact CB-CB 4.42Å; A78-M131 PolarHBondContact N-O 3.4Å; A78-M131 PolarHBondContact O-N 3.23Å; K80-M131 HydrophobicContact CB-CE 3.7Å; L106-M131 HydrophobicContact CD2-CG 4.37Å; L106-M131 HydrophobicContact CD2-SD 4.29Å; V115-M131 HydrophobicContact CG2-CB 4.08Å; G116-M131 CarbonylContact O-C 3.3Å; G116-M131 VanDerWaalsContact O-CA 3.25Å; G116-M131 WeakPolarHBondContact O-CA 3.48Å; L118-M131 VanDerWaalsContact CD1-C 3.5Å; L118-M131 WeakPolarHBondContact CD1-O 3.31Å; I129-M131 HydrophobicContact CG2-CG 4.22Å; I129-M131 HydrophobicContact CG2-SD 4.47Å
132	E	95.4	Very high	93.6	Very high	39 Å²	39	40 Å²	40	18%	0.182	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-57.9	142.8	170.8	75	-179.3	140.4	0	0	110.9	V115 G116 I134 K192	V115-E132 VanDerWaalsContact CA-OE1 3.29Å; V115-E132 WeakPolarHBondContact CA-OE1 3.37Å; V115-E132 HydrophobicContact CG2-CG 3.84Å; G116-E132 PolarHBondContact N-OE1 3.46Å; G116-E132 PolarHBondContact O-N 2.92Å; E132-I134 HydrophobicContact CG-CD1 4.46Å; E132-I134 HydrophobicContact CG-CG1 4.2Å; E132-K192 WeakPolarHBondContact OE1-CD 3.48Å; E132-K192 WeakPolarHBondContact OE1-CE 3.47Å; E132-K192 IonicContact OE1-NZ 2.71Å; E132-K192 PolarHBondContact OE1-NZ 2.75Å; E132-K192 VanDerWaalsContact OE2-CE 3.28Å; E132-K192 WeakPolarHBondContact OE2-CE 3.34Å; E132-K192 IonicContact OE2-NZ 2.92Å; E132-K192 PolarHBondContact OE2-NZ 2.8Å
133	Y	96.3	Very high	93.8	Very high	56 Å²	56	36.3 Å²	36.3	22%	0.22	19%	0.188	C	C	.	.			trans	-84	132.3	175	178.5	-115.8	0	0	0	110.9	L58 L76 P135	L58-Y133 HydrophobicContact CD1-CD2 3.81Å; L58-Y133 HydrophobicContact CD1-CE2 3.62Å; L58-Y133 HydrophobicContact CD2-CE2 3.84Å; L58-Y133 HydrophobicContact CG-CE2 4.39Å; L76-Y133 HydrophobicContact CB-CD1 3.78Å; L76-Y133 HydrophobicContact CB-CE1 4.46Å; L76-Y133 HydrophobicContact CB-CG 4.14Å; L76-Y133 HydrophobicContact CD1-CD1 4.09Å; L76-Y133 HydrophobicContact CD1-CE1 3.99Å; L76-Y133 WeakPolarHBondContact O-CB 3.41Å; Y133-P135 HydrophobicContact CD1-CB 4.31Å; Y133-P135 HydrophobicContact CD1-CG 4.42Å; Y133-P135 HydrophobicContact CE1-CB 3.57Å; Y133-P135 HydrophobicContact CE1-CG 4.14Å
134	I	95.5	Very high	94	Very high	10 Å²	10	37 Å²	37	5%	0.051	20%	0.197	C	C	.	.			trans	-120.1	98	-179.1	-57.7	158.1	0	0	0	108.8	V115 E132 G136 M184 L185 M186 K192 I194	V115-I134 HydrophobicContact CB-CD1 4.49Å; V115-I134 HydrophobicContact CG2-CD1 4.02Å; E132-I134 HydrophobicContact CG-CD1 4.46Å; E132-I134 HydrophobicContact CG-CG1 4.2Å; I134-G136 PolarHBondContact O-N 2.84Å; I134-M184 HydrophobicContact CB-CB 4.2Å; I134-M184 HydrophobicContact CB-CE 3.97Å; I134-M184 HydrophobicContact CB-SD 4.03Å; I134-M184 HydrophobicContact CD1-CB 4.12Å; I134-M184 HydrophobicContact CD1-SD 4.08Å; I134-M184 HydrophobicContact CG2-CB 3.52Å; I134-M184 HydrophobicContact CG2-CE 4.1Å; I134-M184 HydrophobicContact CG2-SD 4.32Å; I134-M184 WeakPolarHBondContact O-CE 3.43Å; I134-L185 VanDerWaalsContact CG2-O 3.32Å; I134-L185 WeakPolarHBondContact CG2-O 3.42Å; I134-M186 HydrophobicContact CB-SD 3.97Å; I134-M186 HydrophobicContact CG1-SD 3.87Å; I134-M186 HydrophobicContact CG2-CG 4.2Å; I134-M186 HydrophobicContact CG2-SD 3.65Å; I134-K192 HydrophobicContact CD1-CB 3.7Å; I134-K192 HydrophobicContact CD1-CD 3.94Å; I134-K192 HydrophobicContact CD1-CG 4.22Å; I134-K192 HydrophobicContact CG1-CD 4.16Å; I134-I194 HydrophobicContact CD1-CG2 3.72Å
135	P	91.2	Very high	94.2	Very high	55 Å²	55	35.7 Å²	35.7	36%	0.357	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.3	-20.3	-168	21.5	-27.8	0	0	0	115.3	Y133 G137 P187	Y133-P135 HydrophobicContact CD1-CB 4.31Å; Y133-P135 HydrophobicContact CD1-CG 4.42Å; Y133-P135 HydrophobicContact CE1-CB 3.57Å; Y133-P135 HydrophobicContact CE1-CG 4.14Å; P135-G137 PolarHBondContact O-N 3.49Å; P135-G137 VanDerWaalsContact O-N 3.14Å; P135-P187 HydrophobicContact CG-CG 3.72Å
136	G	89.9	Confident	94.4	Very high	6 Å²	6	33.8 Å²	33.8	6%	0.062	18%	0.176	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.9	5.1	-171.3	0	0	0	0	0	115.4	I134 L185 Y332	I134-G136 PolarHBondContact O-N 2.84Å; G136-L185 CarbonylContact C-O 3.46Å; G136-L185 WeakPolarHBondContact CA-O 3.49Å; G136-L185 PolarHBondContact N-O 2.88Å; G136-Y332 WeakPolarHBondContact CA-OH 3.42Å
137	G	93.2	Very high	94.6	Very high	19 Å²	19	33.3 Å²	33.3	20%	0.196	18%	0.178	C	C	.	.			trans	76.8	177.3	178.5	0	0	0	0	0	113.7	P135 M184 L185	P135-G137 PolarHBondContact O-N 3.49Å; P135-G137 VanDerWaalsContact O-N 3.14Å; G137-M184 VanDerWaalsContact O-CA 3.29Å; G137-M184 WeakPolarHBondContact O-CA 3.41Å; G137-L185 PolarHBondContact O-N 3.11Å
138	S	95.9	Very high	94.7	Very high	19 Å²	19	36.5 Å²	36.5	13%	0.133	20%	0.199	C	C	.	.	B	Isolated β-bridge	trans	-80.8	156.2	174.1	69.4	0	0	0	0	111.1	A140 S141 I142 G180 N181 V183	S138-A140 PolarHBondContact O-N 3.08Å; S138-S141 PolarHBondContact N-OG 3.39Å; S138-S141 VanDerWaalsContact N-OG 3.07Å; S138-S141 WeakPolarHBondContact O-CB 3.47Å; S138-S141 PolarHBondContact O-N 3.45Å; S138-S141 PolarHBondContact O-OG 3.16Å; S138-S141 PolarHBondContact OG-N 2.86Å; S138-S141 VanDerWaalsContact OG-N 3.16Å; S138-I142 WeakPolarHBondContact O-CG1 3.4Å; S138-I142 PolarHBondContact O-N 3Å; S138-G180 WeakPolarHBondContact CB-O 3.45Å; S138-N181 WeakPolarHBondContact CB-O 3.29Å; S138-V183 CarbonylContact C-O 3.6Å; S138-V183 VanDerWaalsContact CA-O 3.28Å; S138-V183 WeakPolarHBondContact CA-O 3.28Å
139	I	96.7	Very high	94.8	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-55.4	-39.2	172	-70.1	-64	0	0	0	110.8	S141 I142 L143 Y157 G180 V183 I191 M252	I139-S141 VanDerWaalsContact C-N 3.33Å; I139-S141 PolarHBondContact O-N 3.46Å; I139-I142 HydrophobicContact CD1-CD1 4.18Å; I139-I142 WeakPolarHBondContact O-CB 3.36Å; I139-I142 PolarHBondContact O-N 2.99Å; I139-I142 VanDerWaalsContact O-N 3.15Å; I139-L143 HydrophobicContact CG2-CD1 3.88Å; I139-L143 HydrophobicContact CG2-CG 4.19Å; I139-L143 VanDerWaalsContact O-CG 3.26Å; I139-L143 WeakPolarHBondContact O-CG 3.2Å; I139-L143 PolarHBondContact O-N 2.9Å; I139-Y157 HydrophobicContact CD1-CD2 3.8Å; I139-Y157 HydrophobicContact CD1-CE2 3.99Å; I139-G180 WeakPolarHBondContact CB-O 3.36Å; I139-G180 PolarHBondContact N-O 3.41Å; I139-G180 VanDerWaalsContact N-O 3.09Å; I139-V183 HydrophobicContact CB-CB 4.34Å; I139-V183 HydrophobicContact CG1-CB 3.83Å; I139-V183 HydrophobicContact CG1-CG1 3.57Å; I139-V183 PolarHBondContact N-O 2.98Å; I139-I191 HydrophobicContact CD1-CD1 3.98Å; I139-I191 HydrophobicContact CG1-CD1 4.5Å; I139-M252 HydrophobicContact CD1-SD 4.45Å; I139-M252 HydrophobicContact CG2-CG 3.51Å; I139-M252 HydrophobicContact CG2-SD 4.1Å
140	A	95.3	Very high	94.9	Very high	17 Å²	17	40 Å²	40	14%	0.14	22%	0.221	C	C	.	.	H	α-helix	trans	-59.2	-42.5	174.7	0	0	0	0	0	112.3	S138 I142 L143 H144 G180 N181	S138-A140 PolarHBondContact O-N 3.08Å; A140-I142 VanDerWaalsContact C-N 3.33Å; A140-I142 PolarHBondContact O-N 2.93Å; A140-L143 PolarHBondContact O-N 3.07Å; A140-H144 WeakPolarHBondContact O-CB 3.44Å; A140-H144 PolarHBondContact O-N 2.78Å; A140-G180 PolarHBondContact N-O 3.48Å; A140-N181 HydrophobicContact CB-CB 4.49Å; A140-N181 WeakPolarHBondContact CB-OD1 3.39Å
141	S	94.5	Very high	94.9	Very high	53 Å²	53	42.6 Å²	42.6	37%	0.371	23%	0.233	S	C	.	.	H	α-helix	trans	-66.6	-35.2	176.1	73.7	0	0	0	0	112.7	S138 I139 H144 R145	S138-S141 PolarHBondContact N-OG 3.39Å; S138-S141 VanDerWaalsContact N-OG 3.07Å; S138-S141 WeakPolarHBondContact O-CB 3.47Å; S138-S141 PolarHBondContact O-N 3.45Å; S138-S141 PolarHBondContact O-OG 3.16Å; S138-S141 PolarHBondContact OG-N 2.86Å; S138-S141 VanDerWaalsContact OG-N 3.16Å; I139-S141 VanDerWaalsContact C-N 3.33Å; I139-S141 PolarHBondContact O-N 3.46Å; S141-H144 PolarHBondContact O-N 3.09Å; S141-R145 PolarHBondContact O-N 3.01Å; S141-R145 VanDerWaalsContact O-N 3.08Å
142	I	94.6	Very high	94.8	Very high	2 Å²	2	49.6 Å²	49.6	1%	0.01	26%	0.258	C	S	.	.	H	α-helix	trans	-66	-48.2	176.3	-70.4	165.7	0	0	0	110.2	S138 I139 A140 H144 R145 F146 L149 L185 W331	S138-I142 WeakPolarHBondContact O-CG1 3.4Å; S138-I142 PolarHBondContact O-N 3Å; I139-I142 HydrophobicContact CD1-CD1 4.18Å; I139-I142 WeakPolarHBondContact O-CB 3.36Å; I139-I142 PolarHBondContact O-N 2.99Å; I139-I142 VanDerWaalsContact O-N 3.15Å; A140-I142 VanDerWaalsContact C-N 3.33Å; A140-I142 PolarHBondContact O-N 2.93Å; I142-H144 VanDerWaalsContact C-N 3.29Å; I142-H144 PolarHBondContact O-N 2.88Å; I142-R145 PolarHBondContact O-N 2.97Å; I142-R145 VanDerWaalsContact O-N 3.11Å; I142-F146 HydrophobicContact CG2-CD2 4.04Å; I142-F146 WeakPolarHBondContact O-CD2 3.26Å; I142-F146 PolarHBondContact O-N 3.4Å; I142-L149 HydrophobicContact CG2-CD2 4.21Å; I142-L185 HydrophobicContact CD1-CB 3.71Å; I142-L185 HydrophobicContact CD1-CD2 3.56Å; I142-L185 HydrophobicContact CD1-CG 4.28Å; I142-W331 HydrophobicContact CG2-CH2 3.64Å; I142-W331 HydrophobicContact CG2-CZ3 4.29Å
143	L	95.9	Very high	94.8	Very high	11 Å²	11	48.9 Å²	48.9	6%	0.058	26%	0.256	C	S	.	.	H	α-helix	trans	-62.3	-37.6	177.3	-66.8	171.5	0	0	0	111.9	I139 A140 R145 G147 L149 E251	I139-L143 HydrophobicContact CG2-CD1 3.88Å; I139-L143 HydrophobicContact CG2-CG 4.19Å; I139-L143 VanDerWaalsContact O-CG 3.26Å; I139-L143 WeakPolarHBondContact O-CG 3.2Å; I139-L143 PolarHBondContact O-N 2.9Å; A140-L143 PolarHBondContact O-N 3.07Å; L143-R145 VanDerWaalsContact C-N 3.33Å; L143-R145 PolarHBondContact O-N 3.25Å; L143-G147 WeakPolarHBondContact CD2-O 3.36Å; L143-G147 WeakPolarHBondContact O-CA 3.4Å; L143-G147 PolarHBondContact O-N 2.6Å; L143-L149 HydrophobicContact CD2-CD2 4.38Å; L143-L149 HydrophobicContact CD2-CG 4Å; L143-E251 HydrophobicContact CD1-CG 3.75Å; L143-E251 WeakPolarHBondContact CD1-O 3.31Å
144	H	95.1	Very high	94.8	Very high	171 Å²	171	46.2 Å²	46.2	79%	0.792	25%	0.246	S	C	*	.	H	α-helix	trans	-63.1	-39.1	174.1	178.8	-85.1	0	0	0	112.2	A140 S141 I142	A140-H144 WeakPolarHBondContact O-CB 3.44Å; A140-H144 PolarHBondContact O-N 2.78Å; S141-H144 PolarHBondContact O-N 3.09Å; I142-H144 VanDerWaalsContact C-N 3.29Å; I142-H144 PolarHBondContact O-N 2.88Å
145	R	93.8	Very high	94.8	Very high	114 Å²	114	46.1 Å²	46.1	43%	0.43	25%	0.247	S	C	.	.	H	α-helix	trans	-81	-36	-177.1	-171.6	166.5	61.9	157.1	-0.7	113.5	S141 I142 L143 C336	S141-R145 PolarHBondContact O-N 3.01Å; S141-R145 VanDerWaalsContact O-N 3.08Å; I142-R145 PolarHBondContact O-N 2.97Å; I142-R145 VanDerWaalsContact O-N 3.11Å; L143-R145 VanDerWaalsContact C-N 3.33Å; L143-R145 PolarHBondContact O-N 3.25Å; R145-C336 PolarHBondContact NH1-O 3.11Å; R145-C336 PolarHBondContact NH2-O 3.37Å; R145-C336 PolarHBondContact NH2-SG 2.85Å
146	F	93.3	Very high	95.1	Very high	68 Å²	68	45.1 Å²	45.1	30%	0.298	24%	0.238	S	C	.	.	H	α-helix	trans	-120.5	-7.7	-170.9	-57.3	-65.8	0	0	0	115.2	I142 W331 H335 C336	I142-F146 HydrophobicContact CG2-CD2 4.04Å; I142-F146 WeakPolarHBondContact O-CD2 3.26Å; I142-F146 PolarHBondContact O-N 3.4Å; F146-W331 HydrophobicContact CD2-CH2 4.07Å; F146-W331 HydrophobicContact CD2-CZ2 4.49Å; F146-H335 HydrophobicContact CD1-CB 4.12Å; F146-H335 HydrophobicContact CE1-CB 3.78Å; F146-H335 WeakPolarHBondContact CE1-O 3.15Å; F146-H335 HydrophobicContact CZ-CB 4.08Å; F146-H335 WeakPolarHBondContact CZ-O 3.33Å; F146-C336 WeakPolarHBondContact CE2-SG 3.47Å; F146-C336 HydrophobicContact CZ-CB 4.44Å
147	G	96.2	Very high	95.5	Very high	23 Å²	23	45.1 Å²	45.1	24%	0.237	24%	0.236	C	C	.	.			trans	76.7	-164.9	-170.9	0	0	0	0	0	113.1	L143	L143-G147 WeakPolarHBondContact CD2-O 3.36Å; L143-G147 WeakPolarHBondContact O-CA 3.4Å; L143-G147 PolarHBondContact O-N 2.6Å
148	P	96.6	Very high	95.7	Very high	74 Å²	74	44.2 Å²	44.2	48%	0.481	23%	0.227	S	C	.	.	S	Bend	trans	-62.4	150	-173.4	-20.8	32.4	0	0	0	114.2	A253	P148-A253 WeakPolarHBondContact CB-O 3.47Å
149	L	95.6	Very high	95.8	Very high	5 Å²	5	45.8 Å²	45.8	3%	0.026	23%	0.232	C	C	.	.	P	Polyproline II helix	trans	-81.6	140.3	-179.3	-58.5	-176.2	0	0	0	111.8	I142 L143 V153 Y157 M252 W331	I142-L149 HydrophobicContact CG2-CD2 4.21Å; L143-L149 HydrophobicContact CD2-CD2 4.38Å; L143-L149 HydrophobicContact CD2-CG 4Å; L149-V153 HydrophobicContact CD1-CG1 4.26Å; L149-Y157 HydrophobicContact CD1-CD2 3.64Å; L149-Y157 HydrophobicContact CD1-CE2 3.9Å; L149-M252 HydrophobicContact CD1-CB 4.1Å; L149-M252 HydrophobicContact CD1-CG 4.08Å; L149-M252 HydrophobicContact CD1-SD 4.02Å; L149-M252 PolarHBondContact N-O 3.34Å; L149-W331 HydrophobicContact CD2-CH2 4.27Å; L149-W331 HydrophobicContact CD2-CZ2 4.2Å
150	P	95.6	Very high	95.9	Very high	74 Å²	74	46.5 Å²	46.5	48%	0.481	24%	0.236	S	C	.	.	P	Polyproline II helix	trans	-60	145.4	168.7	-21.6	32.4	0	0	0	111.6	R152 V153 L154	P150-R152 PolarHBondContact O-N 3.29Å; P150-R152 VanDerWaalsContact O-N 3.07Å; P150-V153 PolarHBondContact O-N 3.36Å; P150-L154 PolarHBondContact O-N 3.2Å
151	E	96.1	Very high	96	Very high	57 Å²	57	45.9 Å²	45.9	27%	0.266	23%	0.23	S	C	.	.	H	α-helix	trans	-53.2	-37.5	-174.2	-173.6	174.1	151.1	0	0	113.7	V153 L154 A155 F285 S286 A289 F315	E151-V153 VanDerWaalsContact C-N 3.34Å; E151-V153 PolarHBondContact O-N 3.31Å; E151-L154 WeakPolarHBondContact O-CB 3.16Å; E151-L154 PolarHBondContact O-N 3.43Å; E151-A155 WeakPolarHBondContact O-CB 3.35Å; E151-A155 PolarHBondContact O-N 3.47Å; E151-F285 HydrophobicContact CB-CD1 3.9Å; E151-F285 HydrophobicContact CB-CE1 3.98Å; E151-F285 HydrophobicContact CG-CD1 3.96Å; E151-F285 HydrophobicContact CG-CE1 4.4Å; E151-F285 VanDerWaalsContact OE2-CA 3.31Å; E151-F285 WeakPolarHBondContact OE2-CA 3.45Å; E151-S286 WeakPolarHBondContact OE1-CB 3.48Å; E151-S286 PolarHBondContact OE1-OG 3.15Å; E151-S286 PolarHBondContact OE2-N 2.94Å; E151-A289 HydrophobicContact CG-CB 4.44Å; E151-F315 HydrophobicContact CG-CE2 4.04Å
152	R	93.9	Very high	96.2	Very high	169 Å²	169	43.3 Å²	43.3	64%	0.638	21%	0.212	S	C	*	.	H	α-helix	trans	-59.8	-44	176.4	-174.3	179.3	-169.7	-177.2	5.6	112.4	P150 L156 M327	P150-R152 PolarHBondContact O-N 3.29Å; P150-R152 VanDerWaalsContact O-N 3.07Å; R152-L156 WeakPolarHBondContact O-CG 3.41Å; R152-L156 PolarHBondContact O-N 3.42Å; R152-M327 PolarHBondContact NH2-SD 2.86Å
153	V	94.7	Very high	96.4	Very high	23 Å²	23	46.3 Å²	46.3	14%	0.139	23%	0.226	C	C	.	.	H	α-helix	trans	-71.2	-42.1	178.3	-178.4	0	0	0	0	109.5	L149 P150 E151 A155 L156 Y157	L149-V153 HydrophobicContact CD1-CG1 4.26Å; P150-V153 PolarHBondContact O-N 3.36Å; E151-V153 VanDerWaalsContact C-N 3.34Å; E151-V153 PolarHBondContact O-N 3.31Å; V153-A155 VanDerWaalsContact C-N 3.32Å; V153-A155 PolarHBondContact O-N 3.48Å; V153-L156 PolarHBondContact O-N 3.42Å; V153-Y157 HydrophobicContact CG1-CD1 4.38Å; V153-Y157 HydrophobicContact CG1-CD2 3.86Å; V153-Y157 HydrophobicContact CG1-CE1 4.05Å; V153-Y157 HydrophobicContact CG1-CE2 3.48Å; V153-Y157 VanDerWaalsContact CG1-CE2 3.48Å; V153-Y157 HydrophobicContact CG1-CG 4.29Å; V153-Y157 PolarHBondContact O-N 2.98Å
154	L	96.3	Very high	96.5	Very high	0 Å²	0	45.8 Å²	45.8	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-52.5	-48.8	174.8	-176.6	71.9	0	0	0	111.6	P150 E151 Y157 T158 V249 M252 A253 F285 F315	P150-L154 PolarHBondContact O-N 3.2Å; E151-L154 WeakPolarHBondContact O-CB 3.16Å; E151-L154 PolarHBondContact O-N 3.43Å; L154-Y157 PolarHBondContact O-N 3.41Å; L154-T158 VanDerWaalsContact O-CB 3.26Å; L154-T158 WeakPolarHBondContact O-CB 3.45Å; L154-T158 PolarHBondContact O-N 3.08Å; L154-T158 PolarHBondContact O-OG1 3.16Å; L154-V249 HydrophobicContact CD1-CG1 4.04Å; L154-V249 HydrophobicContact CD2-CG1 4.22Å; L154-V249 HydrophobicContact CG-CG1 4.21Å; L154-M252 HydrophobicContact CD1-CB 3.21Å; L154-M252 HydrophobicContact CD1-CE 3.86Å; L154-M252 HydrophobicContact CD1-CG 4.29Å; L154-M252 HydrophobicContact CD1-SD 4.32Å; L154-A253 HydrophobicContact CD1-CB 4.33Å; L154-A253 HydrophobicContact CD2-CB 3.85Å; L154-F285 HydrophobicContact CD2-CD1 4.18Å; L154-F285 HydrophobicContact CD2-CE1 3.72Å; L154-F315 HydrophobicContact CB-CZ 4.44Å; L154-F315 HydrophobicContact CD2-CZ 3.86Å; L154-F315 HydrophobicContact CG-CZ 3.88Å
155	A	97.4	Very high	96.7	Very high	8 Å²	8	37.7 Å²	37.7	7%	0.066	19%	0.186	C	C	.	.	H	α-helix	trans	-63.5	-42.8	179.7	0	0	0	0	0	112.4	E151 V153 T158 H159 F315 P317	E151-A155 WeakPolarHBondContact O-CB 3.35Å; E151-A155 PolarHBondContact O-N 3.47Å; V153-A155 VanDerWaalsContact C-N 3.32Å; V153-A155 PolarHBondContact O-N 3.48Å; A155-T158 PolarHBondContact O-N 3.23Å; A155-H159 PolarHBondContact O-N 3.46Å; A155-F315 HydrophobicContact CB-CD2 4.4Å; A155-F315 HydrophobicContact CB-CE1 4.45Å; A155-F315 HydrophobicContact CB-CE2 3.81Å; A155-F315 HydrophobicContact CB-CZ 3.84Å; A155-P317 HydrophobicContact CB-CG 4.13Å
156	L	96.4	Very high	96.9	Very high	34 Å²	34	32.4 Å²	32.4	18%	0.178	17%	0.166	C	C	.	.	H	α-helix	trans	-66	-41.6	178.4	-70.1	170.3	0	0	0	112.7	R152 V153 Q160 P317 I322 M327	R152-L156 WeakPolarHBondContact O-CG 3.41Å; R152-L156 PolarHBondContact O-N 3.42Å; V153-L156 PolarHBondContact O-N 3.42Å; L156-Q160 PolarHBondContact O-N 3.4Å; L156-P317 HydrophobicContact CD2-CG 4.2Å; L156-I322 HydrophobicContact CD2-CD1 4.15Å; L156-M327 HydrophobicContact CD1-CE 4.44Å
157	Y	97.6	Very high	97.1	Very high	6 Å²	6	30.9 Å²	30.9	2%	0.024	16%	0.16	C	C	.	.	H	α-helix	trans	-71.8	-38.3	176.9	-68.5	-4.8	0	0	0	111.1	I139 L149 V153 L154 H159 Q160 I161 L185 I191 M252	I139-Y157 HydrophobicContact CD1-CD2 3.8Å; I139-Y157 HydrophobicContact CD1-CE2 3.99Å; L149-Y157 HydrophobicContact CD1-CD2 3.64Å; L149-Y157 HydrophobicContact CD1-CE2 3.9Å; V153-Y157 HydrophobicContact CG1-CD1 4.38Å; V153-Y157 HydrophobicContact CG1-CD2 3.86Å; V153-Y157 HydrophobicContact CG1-CE1 4.05Å; V153-Y157 HydrophobicContact CG1-CE2 3.48Å; V153-Y157 VanDerWaalsContact CG1-CE2 3.48Å; V153-Y157 HydrophobicContact CG1-CG 4.29Å; V153-Y157 PolarHBondContact O-N 2.98Å; L154-Y157 PolarHBondContact O-N 3.41Å; Y157-H159 VanDerWaalsContact C-N 3.33Å; Y157-H159 PolarHBondContact O-N 2.8Å; Y157-Q160 PolarHBondContact O-N 2.91Å; Y157-I161 VanDerWaalsContact O-CG1 3.26Å; Y157-I161 WeakPolarHBondContact O-CG1 3.26Å; Y157-I161 PolarHBondContact O-N 2.67Å; Y157-L185 HydrophobicContact CE1-CD1 4.04Å; Y157-L185 HydrophobicContact CE2-CD1 4.5Å; Y157-L185 WeakPolarHBondContact OH-CD2 3.33Å; Y157-I191 HydrophobicContact CD1-CD1 3.91Å; Y157-I191 HydrophobicContact CD1-CG1 3.77Å; Y157-I191 HydrophobicContact CD2-CD1 3.99Å; Y157-I191 HydrophobicContact CE1-CD1 4.25Å; Y157-I191 HydrophobicContact CE1-CG1 4.39Å; Y157-I191 HydrophobicContact CE2-CD1 4.32Å; Y157-I191 HydrophobicContact CG-CD1 3.78Å; Y157-I191 HydrophobicContact CG-CG1 3.91Å; Y157-M252 HydrophobicContact CD2-SD 4.42Å
158	T	98.5	Very high	97.1	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-60.1	-43	174.8	-56.6	0	0	0	0	111.6	L154 A155 Q160 I161 L162 V249 F292 F315 I316	L154-T158 VanDerWaalsContact O-CB 3.26Å; L154-T158 WeakPolarHBondContact O-CB 3.45Å; L154-T158 PolarHBondContact O-N 3.08Å; L154-T158 PolarHBondContact O-OG1 3.16Å; A155-T158 PolarHBondContact O-N 3.23Å; T158-Q160 PolarHBondContact O-N 3.27Å; T158-I161 PolarHBondContact O-N 3.35Å; T158-L162 HydrophobicContact CG2-CD1 4.2Å; T158-L162 HydrophobicContact CG2-CG 4.42Å; T158-L162 WeakPolarHBondContact O-CB 3.48Å; T158-L162 WeakPolarHBondContact O-CG 3.45Å; T158-L162 PolarHBondContact O-N 2.93Å; T158-V249 HydrophobicContact CG2-CG2 3.66Å; T158-V249 WeakPolarHBondContact OG1-CG2 3.42Å; T158-F292 HydrophobicContact CG2-CE1 3.69Å; T158-F292 HydrophobicContact CG2-CE2 4.29Å; T158-F292 HydrophobicContact CG2-CZ 3.52Å; T158-F315 HydrophobicContact CG2-CE1 4.07Å; T158-I316 HydrophobicContact CG2-CD1 3.79Å
159	H	98.1	Very high	97.1	Very high	53 Å²	53	26.6 Å²	26.6	25%	0.245	13%	0.127	C	C	.	.	H	α-helix	trans	-55.2	-52.4	174.3	178	-100.7	0	0	0	111.8	A155 Y157 I161 L162 E163 I316	A155-H159 PolarHBondContact O-N 3.46Å; Y157-H159 VanDerWaalsContact C-N 3.33Å; Y157-H159 PolarHBondContact O-N 2.8Å; H159-I161 PolarHBondContact O-N 3.25Å; H159-L162 WeakPolarHBondContact O-CB 3.27Å; H159-L162 PolarHBondContact O-N 3.27Å; H159-L162 VanDerWaalsContact O-N 3.14Å; H159-E163 IonicContact CE1-OE1 2.69Å; H159-E163 PolarHBondContact CE1-OE1 3.36Å; H159-E163 IonicContact CE1-OE2 2.84Å; H159-E163 PolarHBondContact CE1-OE2 3.12Å; H159-E163 VanDerWaalsContact CE1-OE2 3.32Å; H159-E163 IonicContact ND1-OE1 3.84Å; H159-E163 IonicContact ND1-OE2 3.15Å; H159-E163 PolarHBondContact ND1-OE2 3.43Å; H159-E163 IonicContact NE2-OE1 3.59Å; H159-E163 WeakPolarHBondContact O-CG 3.3Å; H159-E163 PolarHBondContact O-N 2.85Å; H159-I316 HydrophobicContact CB-CG2 4.09Å; H159-I316 WeakPolarHBondContact CD2-CG2 3.14Å
160	Q	98.1	Very high	97.1	Very high	15 Å²	15	32 Å²	32	7%	0.07	15%	0.152	C	C	.	.	H	α-helix	trans	-64.9	-36.6	-179.3	-71.7	-173.3	73.3	0	0	113.5	N113 L156 Y157 T158 E163 G164 G189 I191	N113-Q160 WeakPolarHBondContact CB-O 3.34Å; N113-Q160 PolarHBondContact ND2-OE1 2.94Å; L156-Q160 PolarHBondContact O-N 3.4Å; Y157-Q160 PolarHBondContact O-N 2.91Å; T158-Q160 PolarHBondContact O-N 3.27Å; Q160-E163 PolarHBondContact O-N 3.46Å; Q160-G164 PolarHBondContact O-N 2.91Å; Q160-G164 VanDerWaalsContact O-N 3.12Å; Q160-G189 PolarHBondContact NE2-O 3.32Å; Q160-I191 HydrophobicContact CB-CB 3.86Å; Q160-I191 HydrophobicContact CB-CG1 4.2Å
161	I	98.6	Very high	97	Very high	3 Å²	3	31.9 Å²	31.9	2%	0.015	15%	0.147	C	C	.	.	H	α-helix	trans	-60.9	-47.7	172.2	-69.2	163.7	0	0	0	109.5	Y157 T158 H159 E163 G164 V165 V183 I191 L193 V245 M252	Y157-I161 VanDerWaalsContact O-CG1 3.26Å; Y157-I161 WeakPolarHBondContact O-CG1 3.26Å; Y157-I161 PolarHBondContact O-N 2.67Å; T158-I161 PolarHBondContact O-N 3.35Å; H159-I161 PolarHBondContact O-N 3.25Å; I161-E163 PolarHBondContact O-N 3.12Å; I161-G164 PolarHBondContact O-N 2.97Å; I161-V165 HydrophobicContact CG2-CG2 4.31Å; I161-V165 VanDerWaalsContact O-CG2 3.31Å; I161-V165 WeakPolarHBondContact O-CG2 3.39Å; I161-V165 PolarHBondContact O-N 3.43Å; I161-V183 HydrophobicContact CD1-CG1 4.06Å; I161-V183 HydrophobicContact CD1-CG2 4.41Å; I161-V183 HydrophobicContact CG1-CG1 4.04Å; I161-I191 HydrophobicContact CG1-CG2 3.89Å; I161-L193 HydrophobicContact CG2-CD2 4.43Å; I161-V245 HydrophobicContact CG2-CG1 4.43Å; I161-V245 HydrophobicContact CG2-CG2 4.04Å; I161-M252 HydrophobicContact CD1-CE 3.76Å; I161-M252 HydrophobicContact CD1-SD 4.31Å
162	L	98.6	Very high	96.8	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-63.5	-38	178.7	-73	173.2	0	0	0	112.7	T158 H159 V165 A166 V245 F292 A307 L310 L311 I316	T158-L162 HydrophobicContact CG2-CD1 4.2Å; T158-L162 HydrophobicContact CG2-CG 4.42Å; T158-L162 WeakPolarHBondContact O-CB 3.48Å; T158-L162 WeakPolarHBondContact O-CG 3.45Å; T158-L162 PolarHBondContact O-N 2.93Å; H159-L162 WeakPolarHBondContact O-CB 3.27Å; H159-L162 PolarHBondContact O-N 3.27Å; H159-L162 VanDerWaalsContact O-N 3.14Å; L162-V165 PolarHBondContact O-N 3.34Å; L162-A166 WeakPolarHBondContact O-CB 3.36Å; L162-A166 PolarHBondContact O-N 3.48Å; L162-V245 HydrophobicContact CD2-CG1 4.15Å; L162-F292 HydrophobicContact CD1-CE2 3.94Å; L162-F292 HydrophobicContact CD1-CZ 3.86Å; L162-F292 HydrophobicContact CG-CZ 4.5Å; L162-A307 HydrophobicContact CD2-CB 4.41Å; L162-L310 HydrophobicContact CD1-CB 3.8Å; L162-L310 HydrophobicContact CD2-CB 3.87Å; L162-L310 HydrophobicContact CD2-CD1 3.92Å; L162-L311 HydrophobicContact CB-CD2 3.54Å; L162-L311 HydrophobicContact CB-CG 3.87Å; L162-L311 HydrophobicContact CD1-CD2 4.18Å; L162-L311 HydrophobicContact CD1-CG 4.39Å; L162-I316 HydrophobicContact CD1-CD1 3.82Å; L162-I316 HydrophobicContact CD1-CG1 4.08Å
163	E	98.3	Very high	96.6	Very high	65 Å²	65	29 Å²	29	30%	0.304	13%	0.134	S	C	.	.	H	α-helix	trans	-59.6	-46.6	174	-72.4	179.3	125.9	0	0	111.1	H159 Q160 I161 A166 F167 L311	H159-E163 IonicContact CE1-OE1 2.69Å; H159-E163 PolarHBondContact CE1-OE1 3.36Å; H159-E163 IonicContact CE1-OE2 2.84Å; H159-E163 PolarHBondContact CE1-OE2 3.12Å; H159-E163 VanDerWaalsContact CE1-OE2 3.32Å; H159-E163 IonicContact ND1-OE1 3.84Å; H159-E163 IonicContact ND1-OE2 3.15Å; H159-E163 PolarHBondContact ND1-OE2 3.43Å; H159-E163 IonicContact NE2-OE1 3.59Å; H159-E163 WeakPolarHBondContact O-CG 3.3Å; H159-E163 PolarHBondContact O-N 2.85Å; Q160-E163 PolarHBondContact O-N 3.46Å; I161-E163 PolarHBondContact O-N 3.12Å; E163-A166 PolarHBondContact O-N 3.44Å; E163-F167 WeakPolarHBondContact O-CB 3.5Å; E163-F167 PolarHBondContact O-N 2.92Å; E163-L311 HydrophobicContact CG-CD2 4.09Å
164	G	98.2	Very high	96.4	Very high	0 Å²	0	28 Å²	28	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-60.7	-46.1	174.3	0	0	0	0	0	112.8	Q160 I161 F167 L168	Q160-G164 PolarHBondContact O-N 2.91Å; Q160-G164 VanDerWaalsContact O-N 3.12Å; I161-G164 PolarHBondContact O-N 2.97Å; G164-F167 PolarHBondContact O-N 3.44Å; G164-L168 WeakPolarHBondContact O-CG 3.48Å; G164-L168 PolarHBondContact O-N 2.99Å
165	V	98.3	Very high	96.2	Very high	0 Å²	0	28 Å²	28	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-66.7	-41.5	179.8	174.8	0	0	0	0	111.8	I161 L162 F167 L168 H169 L178 L193 D241 I242 V245 A307	I161-V165 HydrophobicContact CG2-CG2 4.31Å; I161-V165 VanDerWaalsContact O-CG2 3.31Å; I161-V165 WeakPolarHBondContact O-CG2 3.39Å; I161-V165 PolarHBondContact O-N 3.43Å; L162-V165 PolarHBondContact O-N 3.34Å; V165-F167 PolarHBondContact O-N 3.23Å; V165-L168 PolarHBondContact O-N 2.83Å; V165-H169 WeakPolarHBondContact CG1-CE1 3.39Å; V165-H169 WeakPolarHBondContact CG1-NE2 3.28Å; V165-H169 WeakPolarHBondContact O-CB 3.29Å; V165-H169 PolarHBondContact O-CD2 3.2Å; V165-H169 VanDerWaalsContact O-CG 3.29Å; V165-H169 PolarHBondContact O-N 3.4Å; V165-L178 HydrophobicContact CG2-CD1 3.65Å; V165-L178 HydrophobicContact CG2-CD2 4.41Å; V165-L193 HydrophobicContact CG2-CD1 4.02Å; V165-D241 HydrophobicContact CG1-CB 4.38Å; V165-I242 HydrophobicContact CG1-CD1 4.24Å; V165-V245 HydrophobicContact CG2-CG2 4.08Å; V165-A307 HydrophobicContact CB-CB 4.44Å; V165-A307 HydrophobicContact CG1-CB 4.04Å
166	A	98	Very high	95.8	Very high	3 Å²	3	29.5 Å²	29.5	3%	0.025	13%	0.132	C	C	.	.	H	α-helix	trans	-59.7	-46.7	175.6	0	0	0	0	0	110.7	L162 E163 L168 H169 Q170 A307 L311	L162-A166 WeakPolarHBondContact O-CB 3.36Å; L162-A166 PolarHBondContact O-N 3.48Å; E163-A166 PolarHBondContact O-N 3.44Å; A166-L168 PolarHBondContact O-N 3.2Å; A166-H169 PolarHBondContact O-N 3.04Å; A166-Q170 WeakPolarHBondContact O-CB 3.26Å; A166-Q170 WeakPolarHBondContact O-CG 3.44Å; A166-Q170 PolarHBondContact O-N 3.48Å; A166-A307 HydrophobicContact CB-CB 3.86Å; A166-L311 HydrophobicContact CB-CD1 4.12Å
167	F	98	Very high	95.5	Very high	37 Å²	37	29 Å²	29	16%	0.162	13%	0.129	C	C	.	.	H	α-helix	trans	-57	-46.2	174.5	174.4	-87.8	0	0	0	112.1	L109 R110 H111 I114 E163 G164 V165 H169 Q170 N171	L109-F167 HydrophobicContact CB-CE1 4.3Å; L109-F167 HydrophobicContact CD2-CE1 3.95Å; R110-F167 WeakPolarHBondContact O-CZ 3.44Å; H111-F167 HydrophobicContact CB-CD1 3.95Å; H111-F167 HydrophobicContact CB-CD2 4.15Å; H111-F167 HydrophobicContact CB-CE1 4.09Å; H111-F167 HydrophobicContact CB-CE2 4.31Å; H111-F167 HydrophobicContact CB-CG 3.95Å; H111-F167 HydrophobicContact CB-CZ 4.28Å; H111-F167 AromaticContact CD2-CD2 3.7Å; H111-F167 AromaticContact CD2-CG 3.82Å; H111-F167 AromaticContact CG-CG 3.92Å; I114-F167 HydrophobicContact CD1-CD1 3.25Å; I114-F167 HydrophobicContact CD1-CE1 3.65Å; I114-F167 HydrophobicContact CD1-CG 4.25Å; E163-F167 WeakPolarHBondContact O-CB 3.5Å; E163-F167 PolarHBondContact O-N 2.92Å; G164-F167 PolarHBondContact O-N 3.44Å; V165-F167 PolarHBondContact O-N 3.23Å; F167-H169 PolarHBondContact O-N 2.92Å; F167-Q170 PolarHBondContact O-N 3.3Å; F167-N171 WeakPolarHBondContact CE2-ND2 3.34Å; F167-N171 WeakPolarHBondContact CZ-ND2 3.4Å; F167-N171 PolarHBondContact O-N 3.25Å; F167-N171 VanDerWaalsContact O-N 3.08Å; F167-N171 PolarHBondContact O-ND2 3.38Å
168	L	96.7	Very high	95.4	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-59.4	-48.3	176.8	-68.9	176.5	0	0	0	111.2	L109 I114 G164 V165 A166 Q170 N171 R172 V173 H175 L193 F196	L109-L168 HydrophobicContact CD1-CD2 3.71Å; L109-L168 HydrophobicContact CD2-CD2 3.96Å; L109-L168 HydrophobicContact CG-CD2 4.42Å; I114-L168 HydrophobicContact CD1-CD2 3.59Å; I114-L168 HydrophobicContact CD1-CG 3.91Å; G164-L168 WeakPolarHBondContact O-CG 3.48Å; G164-L168 PolarHBondContact O-N 2.99Å; V165-L168 PolarHBondContact O-N 2.83Å; A166-L168 PolarHBondContact O-N 3.2Å; L168-Q170 VanDerWaalsContact C-N 3.35Å; L168-Q170 PolarHBondContact O-N 3.33Å; L168-N171 CarbonylContact O-C 3.52Å; L168-N171 WeakPolarHBondContact O-CA 3.35Å; L168-N171 PolarHBondContact O-N 2.97Å; L168-N171 VanDerWaalsContact O-N 3.12Å; L168-R172 PolarHBondContact O-N 3.41Å; L168-V173 CarbonylContact C-O 3.52Å; L168-V173 VanDerWaalsContact C-O 3.3Å; L168-V173 HydrophobicContact CB-CB 4.25Å; L168-V173 HydrophobicContact CD2-CB 4.2Å; L168-V173 HydrophobicContact CD2-CG1 4.04Å; L168-V173 PolarHBondContact O-N 3.27Å; L168-H175 HydrophobicContact CD1-CB 4.14Å; L168-L193 HydrophobicContact CD1-CD1 4.31Å; L168-F196 HydrophobicContact CD1-CE1 3.93Å; L168-F196 HydrophobicContact CD1-CZ 4.37Å; L168-F196 HydrophobicContact CD2-CE1 3.67Å; L168-F196 HydrophobicContact CD2-CZ 4.26Å; L168-F196 HydrophobicContact CG-CE1 4.47Å
169	H	95.9	Very high	95.2	Very high	7 Å²	7	29.8 Å²	29.8	3%	0.032	13%	0.133	C	C	.	.	H	α-helix	trans	-64.8	-38.9	-176.5	-72.7	-173	0	0	0	112.3	V165 A166 F167 N171 R172 V173 R238 D241	V165-H169 WeakPolarHBondContact CG1-CE1 3.39Å; V165-H169 WeakPolarHBondContact CG1-NE2 3.28Å; V165-H169 WeakPolarHBondContact O-CB 3.29Å; V165-H169 PolarHBondContact O-CD2 3.2Å; V165-H169 VanDerWaalsContact O-CG 3.29Å; V165-H169 PolarHBondContact O-N 3.4Å; A166-H169 PolarHBondContact O-N 3.04Å; F167-H169 PolarHBondContact O-N 2.92Å; H169-N171 VanDerWaalsContact C-N 3.33Å; H169-R172 PolarHBondContact O-N 3.32Å; H169-R172 VanDerWaalsContact O-N 3.08Å; H169-V173 PolarHBondContact CD2-O 2.9Å; H169-R238 HydrophobicContact CB-CG 4.06Å; H169-R238 PolarHBondContact CE1-O 2.89Å; H169-R238 PolarHBondContact O-NE 3.47Å; H169-R238 VanDerWaalsContact O-NE 3.07Å; H169-R238 PolarHBondContact O-NH2 3.44Å; H169-D241 IonicContact CD2-OD2 3.56Å; H169-D241 IonicContact CE1-OD2 2.76Å; H169-D241 IonicContact NE2-OD2 2.8Å; H169-D241 PolarHBondContact NE2-OD2 2.96Å
170	Q	95.4	Very high	95.1	Very high	119 Å²	119	27.2 Å²	27.2	56%	0.556	12%	0.121	S	C	*	.	H	α-helix	trans	-61.5	-40.7	173.2	-71.7	170.4	19	0	0	111.3	A166 F167 L168 R172 D308	A166-Q170 WeakPolarHBondContact O-CB 3.26Å; A166-Q170 WeakPolarHBondContact O-CG 3.44Å; A166-Q170 PolarHBondContact O-N 3.48Å; F167-Q170 PolarHBondContact O-N 3.3Å; L168-Q170 VanDerWaalsContact C-N 3.35Å; L168-Q170 PolarHBondContact O-N 3.33Å; Q170-R172 PolarHBondContact O-N 3.23Å; Q170-D308 PolarHBondContact NE2-OD1 3.36Å; Q170-D308 VanDerWaalsContact NE2-OD1 3.1Å
171	N	93.7	Very high	94.8	Very high	70 Å²	70	30.2 Å²	30.2	37%	0.374	14%	0.137	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.8	11.8	174.2	-73.9	-80.9	0	0	0	114	F167 L168 H169 V173	F167-N171 WeakPolarHBondContact CE2-ND2 3.34Å; F167-N171 WeakPolarHBondContact CZ-ND2 3.4Å; F167-N171 PolarHBondContact O-N 3.25Å; F167-N171 VanDerWaalsContact O-N 3.08Å; F167-N171 PolarHBondContact O-ND2 3.38Å; L168-N171 CarbonylContact O-C 3.52Å; L168-N171 WeakPolarHBondContact O-CA 3.35Å; L168-N171 PolarHBondContact O-N 2.97Å; L168-N171 VanDerWaalsContact O-N 3.12Å; H169-N171 VanDerWaalsContact C-N 3.33Å; N171-V173 VanDerWaalsContact C-N 3.25Å; N171-V173 HydrophobicContact CB-CG2 4.35Å; N171-V173 PolarHBondContact O-N 3.15Å
172	R	91.5	Very high	94.7	Very high	167 Å²	167	30.5 Å²	30.5	63%	0.63	14%	0.139	S	C	*	.	T	Hydrogen-bonded Turn	trans	57.9	36	-179.3	-53.1	-179.2	-178.9	-176.3	-0.5	112.7	L168 H169 Q170 R201 L202	L168-R172 PolarHBondContact O-N 3.41Å; H169-R172 PolarHBondContact O-N 3.32Å; H169-R172 VanDerWaalsContact O-N 3.08Å; Q170-R172 PolarHBondContact O-N 3.23Å; R172-R201 CarbonylContact O-C 3.54Å; R172-R201 WeakPolarHBondContact O-CA 3.44Å; R172-L202 HydrophobicContact CB-CB 4.09Å; R172-L202 PolarHBondContact O-N 3.32Å
173	V	90.8	Very high	94.6	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	137.9	175.5	-177.4	0	0	0	0	109.3	L105 L109 L168 H169 N171 A199 R200	L105-V173 HydrophobicContact CD1-CB 4.46Å; L105-V173 HydrophobicContact CD1-CG1 4.01Å; L105-V173 HydrophobicContact CD1-CG2 3.58Å; L105-V173 HydrophobicContact CD2-CG1 4.07Å; L105-V173 HydrophobicContact CG-CG1 4.48Å; L109-V173 HydrophobicContact CD2-CG2 4.2Å; L168-V173 CarbonylContact C-O 3.52Å; L168-V173 VanDerWaalsContact C-O 3.3Å; L168-V173 HydrophobicContact CB-CB 4.25Å; L168-V173 HydrophobicContact CD2-CB 4.2Å; L168-V173 HydrophobicContact CD2-CG1 4.04Å; L168-V173 PolarHBondContact O-N 3.27Å; H169-V173 PolarHBondContact CD2-O 2.9Å; N171-V173 VanDerWaalsContact C-N 3.25Å; N171-V173 HydrophobicContact CB-CG2 4.35Å; N171-V173 PolarHBondContact O-N 3.15Å; V173-A199 HydrophobicContact CG1-CB 4.42Å; V173-R200 WeakPolarHBondContact CA-O 3.31Å
174	I	90.3	Very high	94.5	Very high	1 Å²	1	29.2 Å²	29.2	1%	0.005	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	131.5	173	-58.5	164	0	0	0	107.3	R176 A199 R200 L202 L205 R238 D241	I174-R176 HydrophobicContact CB-CG 4.34Å; I174-R176 HydrophobicContact CG2-CG 3.69Å; I174-A199 VanDerWaalsContact O-CA 3.22Å; I174-A199 WeakPolarHBondContact O-CA 3.47Å; I174-A199 WeakPolarHBondContact O-CB 3.45Å; I174-R200 PolarHBondContact N-O 3.49Å; I174-R200 PolarHBondContact O-N 3.09Å; I174-R200 VanDerWaalsContact O-N 3.1Å; I174-L202 HydrophobicContact CD1-CD1 3.85Å; I174-L205 HydrophobicContact CD1-CD1 3.56Å; I174-R238 HydrophobicContact CG1-CG 4.38Å; I174-D241 WeakPolarHBondContact CA-OD2 3.36Å; I174-D241 WeakPolarHBondContact CG2-OD1 3.49Å; I174-D241 WeakPolarHBondContact CG2-OD2 3.45Å
175	H	92.4	Very high	94.4	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	13%	0.134	C	C	.	.			trans	-74.9	-44.7	-174.5	-168.4	-79.5	0	0	0	112.3	L168 D177 L178 I194 F196 A199 D241	L168-H175 HydrophobicContact CD1-CB 4.14Å; H175-D177 PolarHBondContact CE1-O 3.42Å; H175-D177 VanDerWaalsContact ND1-C 3.35Å; H175-D177 PolarHBondContact ND1-N 2.72Å; H175-D177 PolarHBondContact ND1-O 2.98Å; H175-D177 PolarHBondContact O-N 3.4Å; H175-D177 VanDerWaalsContact O-N 3.09Å; H175-L178 HydrophobicContact CB-CD1 4.22Å; H175-L178 HydrophobicContact CB-CD2 4.14Å; H175-L178 HydrophobicContact CB-CG 3.88Å; H175-I194 PolarHBondContact CE1-O 2.87Å; H175-I194 PolarHBondContact NE2-O 2.65Å; H175-I194 VanDerWaalsContact NE2-O 3.08Å; H175-F196 AromaticContact CD2-CE1 3.79Å; H175-A199 WeakPolarHBondContact O-CA 3.47Å; H175-D241 PolarHBondContact N-OD1 3.36Å; H175-D241 PolarHBondContact N-OD2 3.03Å
176	R	89.3	Confident	94.1	Very high	40 Å²	40	31.2 Å²	31.2	15%	0.151	14%	0.143	C	C	.	.	S	Bend	trans	68.2	-10	177.8	-58.2	176.1	59.7	-161.3	13.5	117.1	I174 C198 E214 D241	I174-R176 HydrophobicContact CB-CG 4.34Å; I174-R176 HydrophobicContact CG2-CG 3.69Å; R176-C198 HydrophobicContact CB-CB 4.28Å; R176-C198 WeakPolarHBondContact CD-O 3.5Å; R176-C198 PolarHBondContact NH1-O 3.47Å; R176-E214 IonicContact CZ-OE2 3.15Å; R176-E214 IonicContact NH1-OE1 3.11Å; R176-E214 IonicContact NH1-OE2 3.62Å; R176-E214 PolarHBondContact NH1-OE2 3.39Å; R176-E214 IonicContact NH2-OE2 3.93Å; R176-E214 PolarHBondContact NH2-OE2 3.04Å; R176-D241 PolarHBondContact N-OD1 3.22Å
177	D	89.3	Confident	93.6	Very high	22 Å²	22	33.1 Å²	33.1	12%	0.118	16%	0.156	C	C	.	.			trans	-137.4	50.4	176.8	-163.3	28.8	0	0	0	112.9	H175 K179 N182 C198 T222	H175-D177 PolarHBondContact CE1-O 3.42Å; H175-D177 VanDerWaalsContact ND1-C 3.35Å; H175-D177 PolarHBondContact ND1-N 2.72Å; H175-D177 PolarHBondContact ND1-O 2.98Å; H175-D177 PolarHBondContact O-N 3.4Å; H175-D177 VanDerWaalsContact O-N 3.09Å; D177-K179 WeakPolarHBondContact OD1-CE 3.45Å; D177-K179 IonicContact OD1-NZ 2.67Å; D177-K179 PolarHBondContact OD1-NZ 3.04Å; D177-K179 WeakPolarHBondContact OD2-CE 3.47Å; D177-K179 IonicContact OD2-NZ 2.93Å; D177-K179 PolarHBondContact OD2-NZ 3.48Å; D177-N182 VanDerWaalsContact CG-ND2 3.3Å; D177-N182 PolarHBondContact O-ND2 3.01Å; D177-N182 PolarHBondContact OD2-ND2 2.76Å; D177-C198 HydrophobicContact CB-CB 4.18Å; D177-T222 PolarHBondContact OD1-OG1 3.19Å
178	L	94.8	Very high	93	Very high	2 Å²	2	34.6 Å²	34.6	1%	0.01	17%	0.168	C	C	.	.			trans	-80.7	121.5	176.2	-69.5	168.2	0	0	0	110.4	V165 H175 L193 D241 V245	V165-L178 HydrophobicContact CG2-CD1 3.65Å; V165-L178 HydrophobicContact CG2-CD2 4.41Å; H175-L178 HydrophobicContact CB-CD1 4.22Å; H175-L178 HydrophobicContact CB-CD2 4.14Å; H175-L178 HydrophobicContact CB-CG 3.88Å; L178-L193 HydrophobicContact CD2-CD1 4.19Å; L178-L193 HydrophobicContact CD2-CD2 3.95Å; L178-D241 HydrophobicContact CD1-CB 3.78Å; L178-V245 HydrophobicContact CD1-CG2 3.85Å
179	K	94.8	Very high	92.6	Very high	21 Å²	21	34.7 Å²	34.7	9%	0.091	17%	0.169	C	C	.	.	S	Bend	trans	-165.9	164.7	-177.8	58.3	-174.5	-179.5	-143.7	0	109.7	D177 N181 N182 V183 T222 W225 T248	D177-K179 WeakPolarHBondContact OD1-CE 3.45Å; D177-K179 IonicContact OD1-NZ 2.67Å; D177-K179 PolarHBondContact OD1-NZ 3.04Å; D177-K179 WeakPolarHBondContact OD2-CE 3.47Å; D177-K179 IonicContact OD2-NZ 2.93Å; D177-K179 PolarHBondContact OD2-NZ 3.48Å; K179-N181 HydrophobicContact CD-CB 4.25Å; K179-N181 HydrophobicContact CG-CB 4.13Å; K179-N181 PolarHBondContact O-N 3.48Å; K179-N182 WeakPolarHBondContact CE-ND2 3.38Å; K179-N182 HydrophobicContact CG-CB 4.29Å; K179-N182 PolarHBondContact O-N 3.08Å; K179-V183 WeakPolarHBondContact O-CG2 3.36Å; K179-V183 PolarHBondContact O-N 2.87Å; K179-T222 HydrophobicContact CD-CG2 3.32Å; K179-T222 PolarHBondContact NZ-OG1 3.15Å; K179-W225 HydrophobicContact CB-CD2 3.99Å; K179-W225 HydrophobicContact CB-CG 4.09Å; K179-W225 HydrophobicContact CB-CZ2 4.29Å; K179-T248 WeakPolarHBondContact CA-OG1 3.39Å
180	G	95.3	Very high	92.6	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	18%	0.18	C	C	.	.	G	3₁₀ helix	trans	-54.6	-26.8	179.3	0	0	0	0	0	114.9	S138 I139 A140 N182 E251	S138-G180 WeakPolarHBondContact CB-O 3.45Å; I139-G180 WeakPolarHBondContact CB-O 3.36Å; I139-G180 PolarHBondContact N-O 3.41Å; I139-G180 VanDerWaalsContact N-O 3.09Å; A140-G180 PolarHBondContact N-O 3.48Å; G180-N182 VanDerWaalsContact C-N 3.35Å; G180-E251 WeakPolarHBondContact CA-OE2 3.4Å; G180-E251 PolarHBondContact N-OE2 3.46Å
181	N	93.5	Very high	92.7	Very high	77 Å²	77	30.7 Å²	30.7	41%	0.412	15%	0.153	S	C	.	.	G	3₁₀ helix	trans	-69.7	-29.2	175.3	-70.4	-69	0	0	0	113.8	S138 A140 K179	S138-N181 WeakPolarHBondContact CB-O 3.29Å; A140-N181 HydrophobicContact CB-CB 4.49Å; A140-N181 WeakPolarHBondContact CB-OD1 3.39Å; K179-N181 HydrophobicContact CD-CB 4.25Å; K179-N181 HydrophobicContact CG-CB 4.13Å; K179-N181 PolarHBondContact O-N 3.48Å
182	N	95.4	Very high	92.9	Very high	10 Å²	10	28.4 Å²	28.4	5%	0.053	14%	0.14	C	C	.	.	G	3₁₀ helix	trans	-104.3	13.1	-175.2	-66.9	-7.4	0	0	0	112.8	D177 K179 G180 I194	D177-N182 VanDerWaalsContact CG-ND2 3.3Å; D177-N182 PolarHBondContact O-ND2 3.01Å; D177-N182 PolarHBondContact OD2-ND2 2.76Å; K179-N182 WeakPolarHBondContact CE-ND2 3.38Å; K179-N182 HydrophobicContact CG-CB 4.29Å; K179-N182 PolarHBondContact O-N 3.08Å; G180-N182 VanDerWaalsContact C-N 3.35Å; N182-I194 HydrophobicContact CB-CG1 4.21Å; N182-I194 VanDerWaalsContact O-CG1 3.3Å; N182-I194 WeakPolarHBondContact O-CG1 3.49Å; N182-I194 PolarHBondContact O-N 2.85Å
183	V	97.6	Very high	93.2	Very high	1 Å²	1	20.5 Å²	20.5	1%	0.006	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	113.6	172.7	-177.3	0	0	0	0	106.7	S138 I139 I161 K179 I191 L193 T248	S138-V183 CarbonylContact C-O 3.6Å; S138-V183 VanDerWaalsContact CA-O 3.28Å; S138-V183 WeakPolarHBondContact CA-O 3.28Å; I139-V183 HydrophobicContact CB-CB 4.34Å; I139-V183 HydrophobicContact CG1-CB 3.83Å; I139-V183 HydrophobicContact CG1-CG1 3.57Å; I139-V183 PolarHBondContact N-O 2.98Å; I161-V183 HydrophobicContact CD1-CG1 4.06Å; I161-V183 HydrophobicContact CD1-CG2 4.41Å; I161-V183 HydrophobicContact CG1-CG1 4.04Å; K179-V183 WeakPolarHBondContact O-CG2 3.36Å; K179-V183 PolarHBondContact O-N 2.87Å; V183-I191 HydrophobicContact CG1-CD1 4.21Å; V183-I191 HydrophobicContact CG1-CG2 3.34Å; V183-L193 HydrophobicContact CG2-CD2 3.9Å; V183-T248 HydrophobicContact CG2-CG2 4.41Å
184	M	96.3	Very high	93.3	Very high	37 Å²	37	22 Å²	22	18%	0.182	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	153.6	-179.9	-64.6	-168	77.5	0	0	112.3	I134 G137 I191 K192 I194	I134-M184 HydrophobicContact CB-CB 4.2Å; I134-M184 HydrophobicContact CB-CE 3.97Å; I134-M184 HydrophobicContact CB-SD 4.03Å; I134-M184 HydrophobicContact CD1-CB 4.12Å; I134-M184 HydrophobicContact CD1-SD 4.08Å; I134-M184 HydrophobicContact CG2-CB 3.52Å; I134-M184 HydrophobicContact CG2-CE 4.1Å; I134-M184 HydrophobicContact CG2-SD 4.32Å; I134-M184 WeakPolarHBondContact O-CE 3.43Å; G137-M184 VanDerWaalsContact O-CA 3.29Å; G137-M184 WeakPolarHBondContact O-CA 3.41Å; M184-I191 CarbonylContact O-C 3.52Å; M184-I191 WeakPolarHBondContact O-CA 3.38Å; M184-K192 PolarHBondContact N-O 2.86Å; M184-K192 PolarHBondContact O-N 3.37Å; M184-I194 HydrophobicContact CB-CG2 4.36Å; M184-I194 HydrophobicContact CG-CD1 3.75Å; M184-I194 HydrophobicContact CG-CG1 4.01Å; M184-I194 HydrophobicContact CG-CG2 3.95Å; M184-I194 HydrophobicContact SD-CD1 3.69Å; M184-I194 HydrophobicContact SD-CG1 4.36Å; M184-I194 HydrophobicContact SD-CG2 3.89Å
185	L	95.2	Very high	93.1	Very high	2 Å²	2	24.1 Å²	24.1	1%	0.01	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	129.8	-179.3	-177.8	63.1	0	0	0	110.7	I134 G136 G137 I142 Y157 I191 W331 Y332	I134-L185 VanDerWaalsContact CG2-O 3.32Å; I134-L185 WeakPolarHBondContact CG2-O 3.42Å; G136-L185 CarbonylContact C-O 3.46Å; G136-L185 WeakPolarHBondContact CA-O 3.49Å; G136-L185 PolarHBondContact N-O 2.88Å; G137-L185 PolarHBondContact O-N 3.11Å; I142-L185 HydrophobicContact CD1-CB 3.71Å; I142-L185 HydrophobicContact CD1-CD2 3.56Å; I142-L185 HydrophobicContact CD1-CG 4.28Å; Y157-L185 HydrophobicContact CE1-CD1 4.04Å; Y157-L185 HydrophobicContact CE2-CD1 4.5Å; Y157-L185 WeakPolarHBondContact OH-CD2 3.33Å; L185-I191 HydrophobicContact CB-CD1 4.48Å; L185-I191 HydrophobicContact CD1-CD1 3.83Å; L185-W331 HydrophobicContact CD2-CZ3 4.46Å; L185-Y332 HydrophobicContact CD2-CD2 4.16Å
186	M	92.5	Very high	92.6	Very high	39 Å²	39	24.3 Å²	24.3	19%	0.192	13%	0.13	C	C	.	.			trans	-82.6	149.6	164.5	-66.8	-68	-70.8	0	0	110	I134 T188 G189 V190 K192	I134-M186 HydrophobicContact CB-SD 3.97Å; I134-M186 HydrophobicContact CG1-SD 3.87Å; I134-M186 HydrophobicContact CG2-CG 4.2Å; I134-M186 HydrophobicContact CG2-SD 3.65Å; M186-T188 WeakPolarHBondContact CB-OG1 3.41Å; M186-T188 PolarHBondContact O-N 3.19Å; M186-G189 WeakPolarHBondContact O-CA 3.33Å; M186-G189 PolarHBondContact O-N 2.99Å; M186-V190 HydrophobicContact CB-CB 4.07Å; M186-V190 WeakPolarHBondContact CB-O 3.43Å; M186-V190 HydrophobicContact CG-CB 4.21Å; M186-V190 PolarHBondContact N-O 3.35Å; M186-K192 HydrophobicContact CG-CD 4.44Å; M186-K192 HydrophobicContact CG-CG 4.3Å
187	P	86.4	Confident	91.9	Very high	44 Å²	44	22.4 Å²	22.4	29%	0.286	12%	0.123	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.1	-23.1	174	-26.2	35	0	0	0	114	P135 G189 Y332	P135-P187 HydrophobicContact CG-CG 3.72Å; P187-G189 PolarHBondContact O-N 2.89Å; P187-Y332 HydrophobicContact CB-CD1 4.19Å; P187-Y332 HydrophobicContact CB-CE1 3.98Å; P187-Y332 HydrophobicContact CG-CE1 4.24Å
188	T	86.3	Confident	91.1	Very high	67 Å²	67	22.5 Å²	22.5	41%	0.411	13%	0.125	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73	-4.3	173.3	55.7	0	0	0	0	113.6	M186	M186-T188 WeakPolarHBondContact CB-OG1 3.41Å; M186-T188 PolarHBondContact O-N 3.19Å
189	G	88.3	Confident	90	Very high	3 Å²	3	22.5 Å²	22.5	3%	0.031	13%	0.126	C	C	.	.	S	Bend	trans	84.2	8.8	-175.2	0	0	0	0	0	115	Q160 M186 P187	Q160-G189 PolarHBondContact NE2-O 3.32Å; M186-G189 WeakPolarHBondContact O-CA 3.33Å; M186-G189 PolarHBondContact O-N 2.99Å; P187-G189 PolarHBondContact O-N 2.89Å
190	V	95.1	Very high	89.1	Confident	42 Å²	42	24.6 Å²	24.6	26%	0.255	13%	0.133	S	C	.	.			trans	-81.8	126.3	178.1	177	0	0	0	0	109.8	M186 K192	M186-V190 HydrophobicContact CB-CB 4.07Å; M186-V190 WeakPolarHBondContact CB-O 3.43Å; M186-V190 HydrophobicContact CG-CB 4.21Å; M186-V190 PolarHBondContact N-O 3.35Å; V190-K192 HydrophobicContact CG1-CG 4.34Å
191	I	97.3	Very high	88.2	Confident	0 Å²	0	28.9 Å²	28.9	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	137.9	172.9	-67.1	-65.3	0	0	0	109.8	N113 I139 Y157 Q160 I161 V183 M184 L185	N113-I191 WeakPolarHBondContact CA-O 3.22Å; N113-I191 WeakPolarHBondContact CB-O 3.42Å; N113-I191 PolarHBondContact ND2-O 3.34Å; I139-I191 HydrophobicContact CD1-CD1 3.98Å; I139-I191 HydrophobicContact CG1-CD1 4.5Å; Y157-I191 HydrophobicContact CD1-CD1 3.91Å; Y157-I191 HydrophobicContact CD1-CG1 3.77Å; Y157-I191 HydrophobicContact CD2-CD1 3.99Å; Y157-I191 HydrophobicContact CE1-CD1 4.25Å; Y157-I191 HydrophobicContact CE1-CG1 4.39Å; Y157-I191 HydrophobicContact CE2-CD1 4.32Å; Y157-I191 HydrophobicContact CG-CD1 3.78Å; Y157-I191 HydrophobicContact CG-CG1 3.91Å; Q160-I191 HydrophobicContact CB-CB 3.86Å; Q160-I191 HydrophobicContact CB-CG1 4.2Å; I161-I191 HydrophobicContact CG1-CG2 3.89Å; V183-I191 HydrophobicContact CG1-CD1 4.21Å; V183-I191 HydrophobicContact CG1-CG2 3.34Å; M184-I191 CarbonylContact O-C 3.52Å; M184-I191 WeakPolarHBondContact O-CA 3.38Å; L185-I191 HydrophobicContact CB-CD1 4.48Å; L185-I191 HydrophobicContact CD1-CD1 3.83Å
192	K	97.8	Very high	87	Confident	22 Å²	22	28.1 Å²	28.1	10%	0.096	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	126.2	174.9	-60.8	-145.6	175.3	-130.5	0	111.5	S112 E132 I134 M184 M186 V190	S112-K192 WeakPolarHBondContact O-CE 3.4Å; S112-K192 PolarHBondContact O-NZ 3.46Å; S112-K192 VanDerWaalsContact O-NZ 3.16Å; E132-K192 WeakPolarHBondContact OE1-CD 3.48Å; E132-K192 WeakPolarHBondContact OE1-CE 3.47Å; E132-K192 IonicContact OE1-NZ 2.71Å; E132-K192 PolarHBondContact OE1-NZ 2.75Å; E132-K192 VanDerWaalsContact OE2-CE 3.28Å; E132-K192 WeakPolarHBondContact OE2-CE 3.34Å; E132-K192 IonicContact OE2-NZ 2.92Å; E132-K192 PolarHBondContact OE2-NZ 2.8Å; I134-K192 HydrophobicContact CD1-CB 3.7Å; I134-K192 HydrophobicContact CD1-CD 3.94Å; I134-K192 HydrophobicContact CD1-CG 4.22Å; I134-K192 HydrophobicContact CG1-CD 4.16Å; M184-K192 PolarHBondContact N-O 2.86Å; M184-K192 PolarHBondContact O-N 3.37Å; M186-K192 HydrophobicContact CG-CD 4.44Å; M186-K192 HydrophobicContact CG-CG 4.3Å; V190-K192 HydrophobicContact CG1-CG 4.34Å
193	L	97.8	Very high	85.5	Confident	0 Å²	0	32.1 Å²	32.1	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	130.4	169.3	-56.2	-178.5	0	0	0	109.2	N113 V115 I161 V165 L168 L178 V183	N113-L193 WeakPolarHBondContact O-CG 3.4Å; N113-L193 PolarHBondContact O-N 3.4Å; V115-L193 PolarHBondContact N-O 2.76Å; I161-L193 HydrophobicContact CG2-CD2 4.43Å; V165-L193 HydrophobicContact CG2-CD1 4.02Å; L168-L193 HydrophobicContact CD1-CD1 4.31Å; L178-L193 HydrophobicContact CD2-CD1 4.19Å; L178-L193 HydrophobicContact CD2-CD2 3.95Å; V183-L193 HydrophobicContact CG2-CD2 3.9Å
194	I	94.1	Very high	83.4	Confident	32 Å²	32	36.1 Å²	36.1	16%	0.164	20%	0.201	C	C	.	.			trans	-125	173.2	-178.3	63.6	150.5	0	0	0	111	V115 I134 H175 N182 M184	V115-I194 HydrophobicContact CB-CG2 3.93Å; V115-I194 HydrophobicContact CG1-CG2 4.44Å; V115-I194 HydrophobicContact CG2-CG2 4.21Å; I134-I194 HydrophobicContact CD1-CG2 3.72Å; H175-I194 PolarHBondContact CE1-O 2.87Å; H175-I194 PolarHBondContact NE2-O 2.65Å; H175-I194 VanDerWaalsContact NE2-O 3.08Å; N182-I194 HydrophobicContact CB-CG1 4.21Å; N182-I194 VanDerWaalsContact O-CG1 3.3Å; N182-I194 WeakPolarHBondContact O-CG1 3.49Å; N182-I194 PolarHBondContact O-N 2.85Å; M184-I194 HydrophobicContact CB-CG2 4.36Å; M184-I194 HydrophobicContact CG-CD1 3.75Å; M184-I194 HydrophobicContact CG-CG1 4.01Å; M184-I194 HydrophobicContact CG-CG2 3.95Å; M184-I194 HydrophobicContact SD-CD1 3.69Å; M184-I194 HydrophobicContact SD-CG1 4.36Å; M184-I194 HydrophobicContact SD-CG2 3.89Å
195	D	85.1	Confident	81.6	Confident	45 Å²	45	35.9 Å²	35.9	24%	0.241	20%	0.2	C	C	.	.			trans	59.6	81.5	174.6	-159.2	12	0	0	0	115.5	K80 G197	K80-D195 IonicContact NZ-OD1 3.96Å; K80-D195 PolarHBondContact NZ-OD1 2.75Å; D195-G197 VanDerWaalsContact C-N 3.31Å; D195-G197 PolarHBondContact O-N 2.88Å; D195-G197 PolarHBondContact OD1-N 2.79Å
196	F	82.4	Confident	79.7	Confident	4 Å²	4	40.7 Å²	40.7	2%	0.018	23%	0.225	C	C	.	.			trans	-90.2	14.2	179	-70.7	-95.5	0	0	0	113.3	L106 L109 I114 V115 L168 H175 C198 A199	L106-F196 HydrophobicContact CD1-CB 4.34Å; L106-F196 HydrophobicContact CD1-CD2 3.47Å; L106-F196 VanDerWaalsContact CD1-CD2 3.47Å; L106-F196 HydrophobicContact CD1-CE2 3.93Å; L106-F196 HydrophobicContact CD1-CG 3.9Å; L109-F196 HydrophobicContact CD1-CD1 3.83Å; L109-F196 HydrophobicContact CD1-CE1 3.59Å; L109-F196 HydrophobicContact CD1-CZ 4.12Å; I114-F196 HydrophobicContact CG2-CE2 3.88Å; I114-F196 HydrophobicContact CG2-CZ 3.65Å; V115-F196 HydrophobicContact CG1-CD2 4.25Å; V115-F196 HydrophobicContact CG1-CE2 3.96Å; L168-F196 HydrophobicContact CD1-CE1 3.93Å; L168-F196 HydrophobicContact CD1-CZ 4.37Å; L168-F196 HydrophobicContact CD2-CE1 3.67Å; L168-F196 HydrophobicContact CD2-CZ 4.26Å; L168-F196 HydrophobicContact CG-CE1 4.47Å; H175-F196 AromaticContact CD2-CE1 3.79Å; F196-C198 PolarHBondContact O-N 2.85Å; F196-A199 HydrophobicContact CB-CB 3.98Å; F196-A199 HydrophobicContact CD1-CB 3.74Å; F196-A199 HydrophobicContact CG-CB 4.34Å; F196-A199 WeakPolarHBondContact O-CB 3.43Å; F196-A199 PolarHBondContact O-N 3.4Å
197	G	74.4	Confident	77.7	Confident	1 Å²	1	45.2 Å²	45.2	1%	0.01	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-31.1	-178.8	0	0	0	0	0	114.1	E102 D195 R200	E102-G197 VanDerWaalsContact CD-CA 3.49Å; E102-G197 WeakPolarHBondContact OE2-CA 3.38Å; D195-G197 VanDerWaalsContact C-N 3.31Å; D195-G197 PolarHBondContact O-N 2.88Å; D195-G197 PolarHBondContact OD1-N 2.79Å; G197-R200 PolarHBondContact O-NH1 3.38Å
198	C	71.9	Confident	75.6	Confident	23 Å²	23	49.4 Å²	49.4	16%	0.155	28%	0.283	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.1	-13.6	175.1	-65.9	0	0	0	0	113.4	Y63 R176 D177 F196	Y63-C198 PolarHBondContact OH-SG 3.35Å; Y63-C198 VanDerWaalsContact OH-SG 3.38Å; R176-C198 HydrophobicContact CB-CB 4.28Å; R176-C198 WeakPolarHBondContact CD-O 3.5Å; R176-C198 PolarHBondContact NH1-O 3.47Å; D177-C198 HydrophobicContact CB-CB 4.18Å; F196-C198 PolarHBondContact O-N 2.85Å
199	A	72.7	Confident	73.6	Confident	3 Å²	3	48.1 Å²	48.1	3%	0.025	28%	0.279	C	S	.	.			trans	-69.9	148	-172.2	0	0	0	0	0	112.2	L105 V173 I174 H175 F196	L105-A199 HydrophobicContact CD2-CB 3.68Å; V173-A199 HydrophobicContact CG1-CB 4.42Å; I174-A199 VanDerWaalsContact O-CA 3.22Å; I174-A199 WeakPolarHBondContact O-CA 3.47Å; I174-A199 WeakPolarHBondContact O-CB 3.45Å; H175-A199 WeakPolarHBondContact O-CA 3.47Å; F196-A199 HydrophobicContact CB-CB 3.98Å; F196-A199 HydrophobicContact CD1-CB 3.74Å; F196-A199 HydrophobicContact CG-CB 4.34Å; F196-A199 WeakPolarHBondContact O-CB 3.43Å; F196-A199 PolarHBondContact O-N 3.4Å
200	R	76.4	Confident	71.5	Confident	64 Å²	64	52.8 Å²	52.8	24%	0.242	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	148.1	-178.2	-64.6	-65.9	178	-95.4	0.6	111.6	V173 I174 G197 L205 E214	V173-R200 WeakPolarHBondContact CA-O 3.31Å; I174-R200 PolarHBondContact N-O 3.49Å; I174-R200 PolarHBondContact O-N 3.09Å; I174-R200 VanDerWaalsContact O-N 3.1Å; G197-R200 PolarHBondContact O-NH1 3.38Å; R200-L205 HydrophobicContact CB-CD2 4.49Å; R200-E214 IonicContact CZ-OE1 3.16Å; R200-E214 IonicContact NE-OE1 3.27Å; R200-E214 IonicContact NH2-OE1 3.32Å; R200-E214 PolarHBondContact NH2-OE1 2.96Å
201	R	75.4	Confident	69.5	Low	91 Å²	91	53.2 Å²	53.2	34%	0.343	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73	137.3	165.5	-64.3	-177.6	-176	-90.4	-4.2	108.9	D104 L105 T108 R172 S203 C204	D104-R201 PolarHBondContact O-NH2 2.94Å; L105-R201 HydrophobicContact CD1-CG 3.95Å; T108-R201 PolarHBondContact OG1-NH2 2.93Å; R172-R201 CarbonylContact O-C 3.54Å; R172-R201 WeakPolarHBondContact O-CA 3.44Å; R201-S203 PolarHBondContact O-N 3.47Å; R201-C204 WeakPolarHBondContact O-CB 3.35Å; R201-C204 PolarHBondContact O-N 2.9Å
202	L	68.7	Low	66.9	Low	61 Å²	61	56.3 Å²	56.3	32%	0.319	33%	0.331	S	S	.	.	G	3₁₀ helix	trans	-59.1	-31.3	-179.2	-171.9	59.3	0	0	0	112.3	R172 I174 C204 L205	R172-L202 HydrophobicContact CB-CB 4.09Å; R172-L202 PolarHBondContact O-N 3.32Å; I174-L202 HydrophobicContact CD1-CD1 3.85Å; L202-C204 PolarHBondContact O-N 3.14Å; L202-L205 HydrophobicContact CD1-CD1 3.87Å; L202-L205 PolarHBondContact O-N 3.26Å
203	S	63.3	Low	64.4	Low	94 Å²	94	57.7 Å²	57.7	66%	0.657	35%	0.352	S	S	*	.	G	3₁₀ helix	trans	-65.1	-18.8	175.1	54.7	0	0	0	0	114.3	R201	R201-S203 PolarHBondContact O-N 3.47Å
204	C	55.3	Low	62.3	Low	85 Å²	85	60.7 Å²	60.7	57%	0.574	37%	0.366	S	S	*	.	G	3₁₀ helix	trans	-94.6	-4.7	178.7	-56.7	0	0	0	0	112.4	R201 L202 N206	R201-C204 WeakPolarHBondContact O-CB 3.35Å; R201-C204 PolarHBondContact O-N 2.9Å; L202-C204 PolarHBondContact O-N 3.14Å; C204-N206 PolarHBondContact O-N 2.91Å
205	L	58	Low	60.3	Low	31 Å²	31	60.2 Å²	60.2	16%	0.162	36%	0.363	C	S	.	.			trans	-86.6	105.5	176.3	-68.8	172.1	0	0	0	108.6	I174 R200 L202 P207	I174-L205 HydrophobicContact CD1-CD1 3.56Å; R200-L205 HydrophobicContact CB-CD2 4.49Å; L202-L205 HydrophobicContact CD1-CD1 3.87Å; L202-L205 PolarHBondContact O-N 3.26Å; L205-P207 WeakPolarHBondContact O-CD 3.42Å
206	N	54	Low	58.4	Low	103 Å²	103	63.1 Å²	63.1	55%	0.551	38%	0.378	S	S	*	.			trans	-80.2	121.6	169.1	-71.7	-19.3	0	0	0	108.7	C204 T208 A209	C204-N206 PolarHBondContact O-N 2.91Å; N206-T208 PolarHBondContact O-N 3.28Å; N206-T208 VanDerWaalsContact O-N 3.12Å; N206-A209 HydrophobicContact CB-CB 3.94Å
207	P	50.6	Low	56.8	Low	134 Å²	134	69.7 Å²	69.7	87%	0.87	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.2	-15.1	176.8	-20.5	31.7	0	0	0	114.1	L205	L205-P207 WeakPolarHBondContact O-CD 3.42Å
208	T	42.9	Very low	55.7	Low	132 Å²	132	71.4 Å²	71.4	81%	0.81	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	-114.9	-2	-168	52.6	0	0	0	0	114.5	N206	N206-T208 PolarHBondContact O-N 3.28Å; N206-T208 VanDerWaalsContact O-N 3.12Å
209	A	45.4	Very low	54.6	Low	41 Å²	41	72 Å²	72	34%	0.339	42%	0.42	S	S	.	.	S	Bend	trans	-97.4	123.5	-179.7	0	0	0	0	0	110.7	N206 N211	N206-A209 HydrophobicContact CB-CB 3.94Å; A209-N211 PolarHBondContact O-N 2.73Å; A209-N211 VanDerWaalsContact O-N 3.13Å
210	P	43	Very low	53.5	Low	101 Å²	101	78.7 Å²	78.7	66%	0.656	45%	0.45	S	S	*	.			trans	-66.5	113.6	174.3	24.8	-29.9	0	0	0	109.6	S212	P210-S212 PolarHBondContact O-N 3.18Å
211	N	52.4	Low	52.5	Low	51 Å²	51	77.8 Å²	77.8	27%	0.273	46%	0.461	S	S	.	.			trans	-87.7	33.8	177.7	-70.7	-35.8	0	0	0	111.9	A209 G213 E214 L215	A209-N211 PolarHBondContact O-N 2.73Å; A209-N211 VanDerWaalsContact O-N 3.13Å; N211-G213 PolarHBondContact O-N 2.78Å; N211-G213 VanDerWaalsContact O-N 3.1Å; N211-E214 PolarHBondContact O-N 3.32Å; N211-L215 PolarHBondContact O-N 2.9Å; N211-L215 VanDerWaalsContact O-N 3.11Å
212	S	44.2	Very low	52.2	Low	64 Å²	64	74.3 Å²	74.3	45%	0.448	45%	0.45	S	S	.	.	H	α-helix	trans	-59.4	-27.9	-167.5	28.3	0	0	0	0	113.9	P210 L216	P210-S212 PolarHBondContact O-N 3.18Å; S212-L216 WeakPolarHBondContact O-CG 3.48Å; S212-L216 PolarHBondContact O-N 3.23Å
213	G	45.6	Very low	52.8	Low	51 Å²	51	71.5 Å²	71.5	53%	0.526	44%	0.435	S	S	.	.	H	α-helix	trans	-74.9	-26.8	172.7	0	0	0	0	0	115.3	N211	N211-G213 PolarHBondContact O-N 2.78Å; N211-G213 VanDerWaalsContact O-N 3.1Å
214	E	52.8	Low	54.1	Low	64 Å²	64	68.6 Å²	68.6	30%	0.299	41%	0.41	S	S	.	.	H	α-helix	trans	-81.7	-35	173.5	-83.3	-166	167.8	0	0	111.5	R176 R200 N211 L216 K217 S218	R176-E214 IonicContact CZ-OE2 3.15Å; R176-E214 IonicContact NH1-OE1 3.11Å; R176-E214 IonicContact NH1-OE2 3.62Å; R176-E214 PolarHBondContact NH1-OE2 3.39Å; R176-E214 IonicContact NH2-OE2 3.93Å; R176-E214 PolarHBondContact NH2-OE2 3.04Å; R200-E214 IonicContact CZ-OE1 3.16Å; R200-E214 IonicContact NE-OE1 3.27Å; R200-E214 IonicContact NH2-OE1 3.32Å; R200-E214 PolarHBondContact NH2-OE1 2.96Å; N211-E214 PolarHBondContact O-N 3.32Å; E214-L216 VanDerWaalsContact C-N 3.33Å; E214-L216 PolarHBondContact O-N 3.49Å; E214-K217 PolarHBondContact O-N 2.89Å; E214-S218 WeakPolarHBondContact O-CB 3.42Å; E214-S218 PolarHBondContact O-N 3.39Å
215	L	50.9	Low	56	Low	21 Å²	21	65.6 Å²	65.6	11%	0.11	39%	0.387	C	S	.	.	H	α-helix	trans	-60.6	-44.3	176	-174.5	70.8	0	0	0	110.5	N211 K217 S218 I219 M226 E233	N211-L215 PolarHBondContact O-N 2.9Å; N211-L215 VanDerWaalsContact O-N 3.11Å; L215-K217 VanDerWaalsContact C-N 3.33Å; L215-K217 PolarHBondContact O-N 3.01Å; L215-S218 CarbonylContact O-C 3.59Å; L215-S218 WeakPolarHBondContact O-CB 3.26Å; L215-S218 PolarHBondContact O-N 3.1Å; L215-S218 VanDerWaalsContact O-N 3.09Å; L215-I219 HydrophobicContact CD1-CD1 4.31Å; L215-I219 HydrophobicContact CD1-CG1 4.26Å; L215-I219 HydrophobicContact CD2-CD1 3.92Å; L215-I219 HydrophobicContact CG-CD1 3.62Å; L215-I219 HydrophobicContact CG-CG1 4.03Å; L215-I219 WeakPolarHBondContact O-CB 3.33Å; L215-I219 WeakPolarHBondContact O-CG1 3.48Å; L215-I219 PolarHBondContact O-N 2.91Å; L215-M226 HydrophobicContact CD1-CE 3.79Å; L215-E233 HydrophobicContact CD2-CG 3.87Å; L215-E233 WeakPolarHBondContact CD2-OE1 3.37Å
216	L	46.3	Very low	57.5	Low	106 Å²	106	64.7 Å²	64.7	56%	0.555	38%	0.382	S	S	*	.	H	α-helix	trans	-58.9	-41.5	176.2	-73	168.4	0	0	0	112.2	S212 E214 H220	S212-L216 WeakPolarHBondContact O-CG 3.48Å; S212-L216 PolarHBondContact O-N 3.23Å; E214-L216 VanDerWaalsContact C-N 3.33Å; E214-L216 PolarHBondContact O-N 3.49Å; L216-H220 PolarHBondContact O-N 3.42Å; L216-H220 PolarHBondContact O-ND1 3.22Å
217	K	48.8	Very low	59.3	Low	142 Å²	142	59.8 Å²	59.8	62%	0.617	36%	0.356	S	S	*	.	H	α-helix	trans	-67.8	-36	174.7	-70.2	-176.1	179.5	-176.1	0	112.5	E214 L215	E214-K217 PolarHBondContact O-N 2.89Å; L215-K217 VanDerWaalsContact C-N 3.33Å; L215-K217 PolarHBondContact O-N 3.01Å
218	S	51.1	Low	61.2	Low	37 Å²	37	53.4 Å²	53.4	26%	0.259	32%	0.315	S	S	.	.	H	α-helix	trans	-69.7	-43.1	178	-167.6	0	0	0	0	112.8	E214 L215 H220 G221 T222	E214-S218 WeakPolarHBondContact O-CB 3.42Å; E214-S218 PolarHBondContact O-N 3.39Å; L215-S218 CarbonylContact O-C 3.59Å; L215-S218 WeakPolarHBondContact O-CB 3.26Å; L215-S218 PolarHBondContact O-N 3.1Å; L215-S218 VanDerWaalsContact O-N 3.09Å; S218-H220 PolarHBondContact O-N 3.1Å; S218-G221 PolarHBondContact O-N 3.41Å; S218-G221 VanDerWaalsContact O-N 3.08Å; S218-T222 PolarHBondContact O-N 3.34Å
219	I	49.3	Very low	63.4	Low	36 Å²	36	47.2 Å²	47.2	19%	0.185	28%	0.277	C	S	.	.	H	α-helix	trans	-57.2	-36.4	176.1	-73.9	168.6	0	0	0	111.2	L215 M265 L268	L215-I219 HydrophobicContact CD1-CD1 4.31Å; L215-I219 HydrophobicContact CD1-CG1 4.26Å; L215-I219 HydrophobicContact CD2-CD1 3.92Å; L215-I219 HydrophobicContact CG-CD1 3.62Å; L215-I219 HydrophobicContact CG-CG1 4.03Å; L215-I219 WeakPolarHBondContact O-CB 3.33Å; L215-I219 WeakPolarHBondContact O-CG1 3.48Å; L215-I219 PolarHBondContact O-N 2.91Å; I219-M265 HydrophobicContact CG2-CE 3.92Å; I219-L268 HydrophobicContact CG1-CD1 4.35Å; I219-L268 HydrophobicContact CG2-CD1 3.96Å
220	H	48.4	Very low	65.3	Low	143 Å²	143	45.8 Å²	45.8	66%	0.662	26%	0.264	S	S	*	.	H	α-helix	trans	-76.3	-22.5	179.8	-75	79.4	0	0	0	113.5	L216 S218	L216-H220 PolarHBondContact O-N 3.42Å; L216-H220 PolarHBondContact O-ND1 3.22Å; S218-H220 PolarHBondContact O-N 3.1Å
221	G	55.7	Low	67.4	Low	46 Å²	46	42.5 Å²	42.5	47%	0.474	24%	0.24	S	C	.	.	H	α-helix	trans	-85.5	-60	-172.8	0	0	0	0	0	114.4	S218	S218-G221 PolarHBondContact O-N 3.41Å; S218-G221 VanDerWaalsContact O-N 3.08Å
222	T	69	Low	68.8	Low	18 Å²	18	43.7 Å²	43.7	11%	0.11	25%	0.246	C	C	.	.			trans	-156.6	68.7	-167.9	5.5	0	0	0	0	114.6	D177 K179 S218 Y224 W225	D177-T222 PolarHBondContact OD1-OG1 3.19Å; K179-T222 HydrophobicContact CD-CG2 3.32Å; K179-T222 PolarHBondContact NZ-OG1 3.15Å; S218-T222 PolarHBondContact O-N 3.34Å; T222-Y224 VanDerWaalsContact C-N 3.32Å; T222-Y224 PolarHBondContact O-N 2.84Å; T222-W225 HydrophobicContact CG2-CD2 4.33Å; T222-W225 HydrophobicContact CG2-CE3 3.37Å; T222-W225 HydrophobicContact CG2-CH2 4.08Å; T222-W225 HydrophobicContact CG2-CZ3 3.23Å; T222-W225 PolarHBondContact O-N 3.08Å
223	P	81	Confident	70.2	Confident	1 Å²	1	44.8 Å²	44.8	1%	0.006	24%	0.244	C	C	.	.	G	3₁₀ helix	trans	-63.6	-30.5	-170.9	22.9	-33	0	0	0	114.8	W225 M226 K264 L268	P223-W225 PolarHBondContact O-N 3.07Å; P223-M226 WeakPolarHBondContact O-CB 3.31Å; P223-M226 PolarHBondContact O-N 3.18Å; P223-M226 VanDerWaalsContact O-N 3.14Å; P223-K264 HydrophobicContact CG-CB 3.74Å; P223-K264 HydrophobicContact CG-CD 3.93Å; P223-K264 HydrophobicContact CG-CG 3.66Å; P223-L268 HydrophobicContact CB-CD1 3.91Å; P223-L268 HydrophobicContact CB-CD2 3.51Å; P223-L268 HydrophobicContact CB-CG 3.57Å
224	Y	91.5	Very high	71.2	Confident	34 Å²	34	45.9 Å²	45.9	13%	0.133	24%	0.244	C	C	.	.	G	3₁₀ helix	trans	-69	-14.1	-174	-54	-72.8	0	0	0	114.9	T222 C247 P257 L259 M262 K264 A267	T222-Y224 VanDerWaalsContact C-N 3.32Å; T222-Y224 PolarHBondContact O-N 2.84Å; Y224-C247 PolarHBondContact O-SG 3.12Å; Y224-C247 VanDerWaalsContact O-SG 3.34Å; Y224-P257 HydrophobicContact CD2-CG 4.05Å; Y224-P257 HydrophobicContact CG-CB 4.43Å; Y224-P257 HydrophobicContact CG-CG 4.04Å; Y224-L259 HydrophobicContact CD1-CB 4.2Å; Y224-L259 VanDerWaalsContact CE1-O 3.25Å; Y224-L259 WeakPolarHBondContact CE1-O 3.49Å; Y224-M262 PolarHBondContact OH-O 3.05Å; Y224-K264 HydrophobicContact CE2-CG 4.01Å; Y224-A267 HydrophobicContact CD1-CB 3.71Å; Y224-A267 HydrophobicContact CE1-CB 3.63Å
225	W	93.9	Very high	71.6	Confident	21 Å²	21	43.9 Å²	43.9	8%	0.08	24%	0.241	C	C	.	.	G	3₁₀ helix	trans	-103.1	-2.1	177.3	-63.6	-105.3	0	0	0	112.3	K179 T222 P223 W243 S244 C247 E251 P257	K179-W225 HydrophobicContact CB-CD2 3.99Å; K179-W225 HydrophobicContact CB-CG 4.09Å; K179-W225 HydrophobicContact CB-CZ2 4.29Å; T222-W225 HydrophobicContact CG2-CD2 4.33Å; T222-W225 HydrophobicContact CG2-CE3 3.37Å; T222-W225 HydrophobicContact CG2-CH2 4.08Å; T222-W225 HydrophobicContact CG2-CZ3 3.23Å; T222-W225 PolarHBondContact O-N 3.08Å; P223-W225 PolarHBondContact O-N 3.07Å; W225-W243 VanDerWaalsContact O-CD1 3.24Å; W225-S244 PolarHBondContact O-OG 2.83Å; W225-S244 VanDerWaalsContact O-OG 3.13Å; W225-C247 HydrophobicContact CB-CB 4.25Å; W225-C247 HydrophobicContact CG-CB 3.87Å; W225-E251 HydrophobicContact CZ2-CG 4.46Å; W225-E251 WeakPolarHBondContact CZ2-OE1 3.37Å; W225-E251 WeakPolarHBondContact CZ2-OE2 3.5Å; W225-E251 PolarHBondContact NE1-OE2 3.49Å; W225-P257 HydrophobicContact CH2-CB 3.87Å; W225-P257 HydrophobicContact CH2-CG 3.62Å; W225-P257 HydrophobicContact CZ2-CB 3.67Å; W225-P257 HydrophobicContact CZ2-CG 3.89Å; W225-P257 HydrophobicContact CZ3-CB 4.35Å; W225-P257 HydrophobicContact CZ3-CG 4.16Å
226	M	90.9	Very high	72.4	Confident	12 Å²	12	44.7 Å²	44.7	6%	0.059	24%	0.243	C	C	.	.			trans	-76.1	132.6	-176.8	-66.6	177.9	66.3	0	0	111	L215 P223 V230 I231 W243 L268	L215-M226 HydrophobicContact CD1-CE 3.79Å; P223-M226 WeakPolarHBondContact O-CB 3.31Å; P223-M226 PolarHBondContact O-N 3.18Å; P223-M226 VanDerWaalsContact O-N 3.14Å; M226-V230 HydrophobicContact CE-CG1 3.68Å; M226-I231 HydrophobicContact CB-CD1 4.12Å; M226-I231 HydrophobicContact CB-CG1 3.89Å; M226-I231 HydrophobicContact CE-CG1 4.22Å; M226-W243 PolarHBondContact O-NE1 3.42Å; M226-L268 HydrophobicContact SD-CD2 3.97Å
227	A	91.6	Very high	74	Confident	1 Å²	1	40.2 Å²	40.2	1%	0.008	22%	0.223	C	C	.	.			trans	-74	152.4	177.2	0	0	0	0	0	111.7	E229 V230 I231 W243	A227-E229 VanDerWaalsContact C-N 3.26Å; A227-E229 VanDerWaalsContact CB-CD 3.47Å; A227-E229 HydrophobicContact CB-CG 4.38Å; A227-E229 WeakPolarHBondContact CB-OE1 3.49Å; A227-E229 WeakPolarHBondContact CB-OE2 3.43Å; A227-E229 PolarHBondContact O-N 2.83Å; A227-V230 HydrophobicContact CB-CG2 4.27Å; A227-V230 WeakPolarHBondContact O-CB 3.22Å; A227-V230 PolarHBondContact O-N 2.78Å; A227-I231 WeakPolarHBondContact O-CG1 3.27Å; A227-I231 PolarHBondContact O-N 3.06Å; A227-I231 VanDerWaalsContact O-N 3.08Å; A227-W243 HydrophobicContact CB-CB 3.72Å; A227-W243 HydrophobicContact CB-CD2 4.16Å; A227-W243 HydrophobicContact CB-CG 3.64Å
228	P	91.2	Very high	76.1	Confident	0 Å²	0	38.2 Å²	38.2	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-54.7	-40.6	179.2	-23.9	31.1	0	0	0	113.3	V230 I231 N232 W243 I271 R274	P228-V230 VanDerWaalsContact C-N 3.27Å; P228-V230 PolarHBondContact O-N 2.83Å; P228-I231 PolarHBondContact O-N 2.78Å; P228-N232 WeakPolarHBondContact O-CB 3.32Å; P228-N232 PolarHBondContact O-N 3.39Å; P228-N232 PolarHBondContact O-ND2 3.37Å; P228-W243 HydrophobicContact CG-CE3 4.35Å; P228-W243 HydrophobicContact CG-CH2 3.81Å; P228-W243 HydrophobicContact CG-CZ2 4.29Å; P228-W243 HydrophobicContact CG-CZ3 3.84Å; P228-I271 HydrophobicContact CB-CG2 4.26Å; P228-I271 HydrophobicContact CG-CG2 3.7Å; P228-R274 HydrophobicContact CB-CG 4.37Å
229	E	88.2	Confident	78.2	Confident	2 Å²	2	38.9 Å²	38.9	1%	0.009	21%	0.209	C	C	.	.	H	α-helix	trans	-66.9	-29.6	-179.4	64.4	-86.1	-165.4	0	0	113.5	A227 E233 S234 G235 S240 R304	A227-E229 VanDerWaalsContact C-N 3.26Å; A227-E229 VanDerWaalsContact CB-CD 3.47Å; A227-E229 HydrophobicContact CB-CG 4.38Å; A227-E229 WeakPolarHBondContact CB-OE1 3.49Å; A227-E229 WeakPolarHBondContact CB-OE2 3.43Å; A227-E229 PolarHBondContact O-N 2.83Å; E229-E233 PolarHBondContact O-N 2.83Å; E229-S234 VanDerWaalsContact CA-OG 3.28Å; E229-S234 WeakPolarHBondContact CA-OG 3.41Å; E229-S234 PolarHBondContact O-N 3.44Å; E229-S234 PolarHBondContact O-OG 2.99Å; E229-S234 VanDerWaalsContact O-OG 3.12Å; E229-G235 CarbonylContact C-O 3.45Å; E229-G235 PolarHBondContact O-N 3.48Å; E229-S240 WeakPolarHBondContact OE1-CA 3.22Å; E229-S240 PolarHBondContact OE1-N 3.22Å; E229-R304 IonicContact OE1-CZ 2.89Å; E229-R304 IonicContact OE1-NH1 3.33Å; E229-R304 PolarHBondContact OE1-NH1 3.39Å; E229-R304 IonicContact OE1-NH2 2.9Å; E229-R304 IonicContact OE2-CZ 2.8Å; E229-R304 IonicContact OE2-NH1 3.88Å; E229-R304 IonicContact OE2-NH2 3.99Å; E229-R304 PolarHBondContact OE2-NH2 3.33Å; E229-R304 VanDerWaalsContact OE2-NH2 3.11Å
230	V	85.8	Confident	80.2	Confident	11 Å²	11	37.4 Å²	37.4	7%	0.067	20%	0.202	C	C	.	.	H	α-helix	trans	-74.6	-42.5	176.2	167.8	0	0	0	0	110.4	M226 A227 P228 N232 E233 Y236	M226-V230 HydrophobicContact CE-CG1 3.68Å; A227-V230 HydrophobicContact CB-CG2 4.27Å; A227-V230 WeakPolarHBondContact O-CB 3.22Å; A227-V230 PolarHBondContact O-N 2.78Å; P228-V230 VanDerWaalsContact C-N 3.27Å; P228-V230 PolarHBondContact O-N 2.83Å; V230-N232 VanDerWaalsContact C-N 3.35Å; V230-E233 PolarHBondContact O-N 3.24Å; V230-Y236 HydrophobicContact CB-CD1 4.44Å; V230-Y236 HydrophobicContact CB-CE1 4.18Å; V230-Y236 HydrophobicContact CG1-CD1 4.13Å; V230-Y236 HydrophobicContact CG1-CE1 3.49Å; V230-Y236 VanDerWaalsContact CG1-CE1 3.49Å; V230-Y236 HydrophobicContact CG2-CD1 3.79Å; V230-Y236 HydrophobicContact CG2-CE1 4.03Å
231	I	85.6	Confident	82.5	Confident	31 Å²	31	30.6 Å²	30.6	16%	0.159	17%	0.17	C	C	.	.	H	α-helix	trans	-64	-42.4	177.5	-64.2	172	0	0	0	110.7	M226 A227 P228 E233 L268 I271	M226-I231 HydrophobicContact CB-CD1 4.12Å; M226-I231 HydrophobicContact CB-CG1 3.89Å; M226-I231 HydrophobicContact CE-CG1 4.22Å; A227-I231 WeakPolarHBondContact O-CG1 3.27Å; A227-I231 PolarHBondContact O-N 3.06Å; A227-I231 VanDerWaalsContact O-N 3.08Å; P228-I231 PolarHBondContact O-N 2.78Å; I231-E233 PolarHBondContact O-N 3.12Å; I231-L268 HydrophobicContact CD1-CD2 3.69Å; I231-L268 HydrophobicContact CG1-CD2 3.91Å; I231-I271 HydrophobicContact CD1-CB 3.7Å; I231-I271 HydrophobicContact CD1-CD1 4.49Å; I231-I271 HydrophobicContact CD1-CG2 3.56Å
232	N	82.8	Confident	84.5	Confident	76 Å²	76	28.4 Å²	28.4	41%	0.406	15%	0.148	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.2	6.1	-177.7	-65.2	-20.7	0	0	0	113.6	P228 V230 S234 G272	P228-N232 WeakPolarHBondContact O-CB 3.32Å; P228-N232 PolarHBondContact O-N 3.39Å; P228-N232 PolarHBondContact O-ND2 3.37Å; V230-N232 VanDerWaalsContact C-N 3.35Å; N232-S234 PolarHBondContact O-N 3.48Å; N232-G272 PolarHBondContact ND2-O 3.14Å; N232-G272 PolarHBondContact OD1-O 3.42Å
233	E	73.9	Confident	85.8	Confident	87 Å²	87	27.6 Å²	27.6	41%	0.407	14%	0.143	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.1	15.2	-175.8	-56.8	-170.6	157.9	0	0	114.9	L215 E229 V230 I231 G235	L215-E233 HydrophobicContact CD2-CG 3.87Å; L215-E233 WeakPolarHBondContact CD2-OE1 3.37Å; E229-E233 PolarHBondContact O-N 2.83Å; V230-E233 PolarHBondContact O-N 3.24Å; I231-E233 PolarHBondContact O-N 3.12Å; E233-G235 PolarHBondContact O-N 3Å
234	S	65.8	Low	86.6	Confident	74 Å²	74	28 Å²	28	52%	0.517	15%	0.146	S	C	.	.	S	Bend	trans	-77	-6.6	-178.3	58.9	0	0	0	0	113.5	E229 N232	E229-S234 VanDerWaalsContact CA-OG 3.28Å; E229-S234 WeakPolarHBondContact CA-OG 3.41Å; E229-S234 PolarHBondContact O-N 3.44Å; E229-S234 PolarHBondContact O-OG 2.99Å; E229-S234 VanDerWaalsContact O-OG 3.12Å; N232-S234 PolarHBondContact O-N 3.48Å
235	G	62.6	Low	86.9	Confident	23 Å²	23	26.4 Å²	26.4	24%	0.237	14%	0.14	C	C	.	.			trans	160.3	154.6	171.4	0	0	0	0	0	113.2	E229 E233	E229-G235 CarbonylContact C-O 3.45Å; E229-G235 PolarHBondContact O-N 3.48Å; E233-G235 PolarHBondContact O-N 3Å
236	Y	67.1	Low	87.1	Confident	37 Å²	37	25.4 Å²	25.4	15%	0.145	14%	0.136	C	C	.	.			trans	-117.6	135.4	166.9	-65.7	-96.4	0	0	0	107.8	V230	V230-Y236 HydrophobicContact CB-CD1 4.44Å; V230-Y236 HydrophobicContact CB-CE1 4.18Å; V230-Y236 HydrophobicContact CG1-CD1 4.13Å; V230-Y236 HydrophobicContact CG1-CE1 3.49Å; V230-Y236 VanDerWaalsContact CG1-CE1 3.49Å; V230-Y236 HydrophobicContact CG2-CD1 3.79Å; V230-Y236 HydrophobicContact CG2-CE1 4.03Å
237	G	80.3	Confident	87.5	Confident	13 Å²	13	24.9 Å²	24.9	13%	0.134	13%	0.133	C	C	.	.			trans	-163.9	173.8	-173.5	0	0	0	0	0	113.9	K239 S240	G237-K239 PolarHBondContact O-N 3.16Å; G237-K239 VanDerWaalsContact O-N 3.08Å; G237-S240 PolarHBondContact O-N 3.44Å; G237-S240 PolarHBondContact O-OG 3.08Å
238	R	92.4	Very high	87.8	Confident	100 Å²	100	24.9 Å²	24.9	38%	0.377	13%	0.133	S	C	.	.	H	α-helix	trans	-50.7	-35.1	173.4	-68.5	174.8	177.9	143.2	-7.1	112.3	H169 I174 S240 D241 I242	H169-R238 HydrophobicContact CB-CG 4.06Å; H169-R238 PolarHBondContact CE1-O 2.89Å; H169-R238 PolarHBondContact O-NE 3.47Å; H169-R238 VanDerWaalsContact O-NE 3.07Å; H169-R238 PolarHBondContact O-NH2 3.44Å; I174-R238 HydrophobicContact CG1-CG 4.38Å; R238-S240 VanDerWaalsContact C-N 3.33Å; R238-S240 PolarHBondContact O-N 3.48Å; R238-D241 PolarHBondContact O-N 3.27Å; R238-I242 PolarHBondContact O-N 2.55Å
239	K	94.3	Very high	88.1	Confident	51 Å²	51	24.9 Å²	24.9	22%	0.222	13%	0.133	C	C	.	.	H	α-helix	trans	-67.4	-29.4	-179.1	-59.4	-62.1	-170.4	77	0	112.9	G237 D241 I242 W243 Q301 S302 R304	G237-K239 PolarHBondContact O-N 3.16Å; G237-K239 VanDerWaalsContact O-N 3.08Å; K239-D241 VanDerWaalsContact C-N 3.33Å; K239-D241 PolarHBondContact O-N 3.09Å; K239-I242 WeakPolarHBondContact O-CB 3.5Å; K239-I242 PolarHBondContact O-N 3.2Å; K239-I242 VanDerWaalsContact O-N 3.12Å; K239-W243 PolarHBondContact O-N 3.01Å; K239-W243 VanDerWaalsContact O-N 3.15Å; K239-Q301 HydrophobicContact CB-CB 4.03Å; K239-Q301 HydrophobicContact CG-CB 4.46Å; K239-Q301 WeakPolarHBondContact CG-O 3.46Å; K239-Q301 PolarHBondContact NZ-O 3.46Å; K239-S302 PolarHBondContact NZ-O 3.43Å; K239-S302 VanDerWaalsContact NZ-O 3.16Å; K239-R304 VanDerWaalsContact C-NH1 3.26Å; K239-R304 HydrophobicContact CD-CB 4.42Å; K239-R304 WeakPolarHBondContact CD-O 3.45Å; K239-R304 WeakPolarHBondContact CE-O 3.34Å; K239-R304 PolarHBondContact NZ-O 3.4Å; K239-R304 WeakPolarHBondContact O-CD 3.13Å; K239-R304 PolarHBondContact O-NH1 2.99Å
240	S	92.8	Very high	88.6	Confident	4 Å²	4	25.6 Å²	25.6	3%	0.028	14%	0.136	C	C	.	.	H	α-helix	trans	-69.7	-31.9	177.5	63.9	0	0	0	0	112.3	E229 G237 R238 I242 W243 S244	E229-S240 WeakPolarHBondContact OE1-CA 3.22Å; E229-S240 PolarHBondContact OE1-N 3.22Å; G237-S240 PolarHBondContact O-N 3.44Å; G237-S240 PolarHBondContact O-OG 3.08Å; R238-S240 VanDerWaalsContact C-N 3.33Å; R238-S240 PolarHBondContact O-N 3.48Å; S240-I242 VanDerWaalsContact C-N 3.29Å; S240-I242 PolarHBondContact O-N 3.24Å; S240-W243 PolarHBondContact O-N 3.04Å; S240-S244 PolarHBondContact O-N 3.18Å; S240-S244 VanDerWaalsContact O-N 3.1Å; S240-S244 PolarHBondContact O-OG 3.46Å
241	D	95.3	Very high	89.2	Confident	0 Å²	0	25.7 Å²	25.7	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-63.4	-38.1	169.9	-76.3	-12.5	0	0	0	110.8	V165 H169 I174 H175 R176 L178 R238 K239 W243 S244 V245	V165-D241 HydrophobicContact CG1-CB 4.38Å; H169-D241 IonicContact CD2-OD2 3.56Å; H169-D241 IonicContact CE1-OD2 2.76Å; H169-D241 IonicContact NE2-OD2 2.8Å; H169-D241 PolarHBondContact NE2-OD2 2.96Å; I174-D241 WeakPolarHBondContact CA-OD2 3.36Å; I174-D241 WeakPolarHBondContact CG2-OD1 3.49Å; I174-D241 WeakPolarHBondContact CG2-OD2 3.45Å; H175-D241 PolarHBondContact N-OD1 3.36Å; H175-D241 PolarHBondContact N-OD2 3.03Å; R176-D241 PolarHBondContact N-OD1 3.22Å; L178-D241 HydrophobicContact CD1-CB 3.78Å; R238-D241 PolarHBondContact O-N 3.27Å; K239-D241 VanDerWaalsContact C-N 3.33Å; K239-D241 PolarHBondContact O-N 3.09Å; D241-W243 PolarHBondContact O-N 2.9Å; D241-S244 CarbonylContact O-C 3.56Å; D241-S244 WeakPolarHBondContact O-CA 3.22Å; D241-S244 WeakPolarHBondContact O-CB 3.42Å; D241-S244 PolarHBondContact O-N 3.37Å; D241-S244 VanDerWaalsContact O-N 3.12Å; D241-V245 WeakPolarHBondContact O-CG2 3.36Å; D241-V245 PolarHBondContact O-N 3.05Å
242	I	98.1	Very high	89.8	Confident	1 Å²	1	24.2 Å²	24.2	1%	0.005	13%	0.128	C	C	.	.	H	α-helix	trans	-64.6	-39.4	178.4	-56.2	-54.3	0	0	0	112.1	V165 R238 K239 S240 S244 V245 G246 C296 R304 A307 L310	V165-I242 HydrophobicContact CG1-CD1 4.24Å; R238-I242 PolarHBondContact O-N 2.55Å; K239-I242 WeakPolarHBondContact O-CB 3.5Å; K239-I242 PolarHBondContact O-N 3.2Å; K239-I242 VanDerWaalsContact O-N 3.12Å; S240-I242 VanDerWaalsContact C-N 3.29Å; S240-I242 PolarHBondContact O-N 3.24Å; I242-S244 VanDerWaalsContact C-N 3.32Å; I242-V245 WeakPolarHBondContact O-CB 3.49Å; I242-V245 PolarHBondContact O-N 2.91Å; I242-G246 PolarHBondContact O-N 2.96Å; I242-C296 HydrophobicContact CG2-CB 4.41Å; I242-R304 HydrophobicContact CB-CG 4.4Å; I242-R304 HydrophobicContact CG2-CG 3.97Å; I242-A307 HydrophobicContact CD1-CB 3.92Å; I242-L310 HydrophobicContact CD1-CD1 4.33Å; I242-L310 HydrophobicContact CG2-CD1 3.52Å
243	W	97.1	Very high	90.5	Very high	1 Å²	1	20.8 Å²	20.8	0%	0.004	11%	0.111	C	C	.	.	H	α-helix	trans	-59.5	-46.6	170.9	175.8	-78.7	0	0	0	111.2	W225 M226 A227 P228 K239 S240 D241 V245 G246 C247 I271 M278 L297	W225-W243 VanDerWaalsContact O-CD1 3.24Å; M226-W243 PolarHBondContact O-NE1 3.42Å; A227-W243 HydrophobicContact CB-CB 3.72Å; A227-W243 HydrophobicContact CB-CD2 4.16Å; A227-W243 HydrophobicContact CB-CG 3.64Å; P228-W243 HydrophobicContact CG-CE3 4.35Å; P228-W243 HydrophobicContact CG-CH2 3.81Å; P228-W243 HydrophobicContact CG-CZ2 4.29Å; P228-W243 HydrophobicContact CG-CZ3 3.84Å; K239-W243 PolarHBondContact O-N 3.01Å; K239-W243 VanDerWaalsContact O-N 3.15Å; S240-W243 PolarHBondContact O-N 3.04Å; D241-W243 PolarHBondContact O-N 2.9Å; W243-V245 VanDerWaalsContact C-N 3.29Å; W243-V245 PolarHBondContact O-N 3.37Å; W243-G246 WeakPolarHBondContact O-CA 3.22Å; W243-G246 PolarHBondContact O-N 3.42Å; W243-C247 PolarHBondContact O-N 2.98Å; W243-I271 HydrophobicContact CH2-CG2 4.16Å; W243-I271 HydrophobicContact CZ2-CG1 4.4Å; W243-I271 HydrophobicContact CZ2-CG2 3.65Å; W243-M278 HydrophobicContact CH2-CE 4.34Å; W243-M278 HydrophobicContact CH2-CG 3.75Å; W243-M278 HydrophobicContact CH2-SD 3.98Å; W243-M278 HydrophobicContact CZ2-CE 3.87Å; W243-M278 HydrophobicContact CZ2-CG 4.25Å; W243-M278 HydrophobicContact CZ2-SD 4Å; W243-L297 HydrophobicContact CD2-CD2 3.99Å; W243-L297 HydrophobicContact CE3-CD2 4.28Å; W243-L297 HydrophobicContact CG-CD2 4.34Å; W243-L297 HydrophobicContact CZ2-CD2 4.4Å; W243-L297 HydrophobicContact CZ3-CB 4.4Å; W243-L297 VanDerWaalsContact CZ3-O 3.25Å; W243-L297 WeakPolarHBondContact CZ3-O 3.46Å
244	S	96.9	Very high	91.7	Very high	9 Å²	9	18.4 Å²	18.4	6%	0.063	10%	0.102	C	C	.	.	H	α-helix	trans	-62.4	-36.5	179	-52.6	0	0	0	0	112	W225 S240 D241 I242 C247 T248	W225-S244 PolarHBondContact O-OG 2.83Å; W225-S244 VanDerWaalsContact O-OG 3.13Å; S240-S244 PolarHBondContact O-N 3.18Å; S240-S244 VanDerWaalsContact O-N 3.1Å; S240-S244 PolarHBondContact O-OG 3.46Å; D241-S244 CarbonylContact O-C 3.56Å; D241-S244 WeakPolarHBondContact O-CA 3.22Å; D241-S244 WeakPolarHBondContact O-CB 3.42Å; D241-S244 PolarHBondContact O-N 3.37Å; D241-S244 VanDerWaalsContact O-N 3.12Å; I242-S244 VanDerWaalsContact C-N 3.32Å; S244-C247 PolarHBondContact O-N 3.04Å; S244-T248 WeakPolarHBondContact O-CB 3.37Å; S244-T248 PolarHBondContact O-N 2.81Å; S244-T248 PolarHBondContact O-OG1 3.1Å
245	V	98.4	Very high	93.2	Very high	1 Å²	1	16.2 Å²	16.2	1%	0.006	9%	0.091	C	C	.	.	H	α-helix	trans	-60.8	-48.4	170.1	170.6	0	0	0	0	110.2	I161 L162 V165 L178 D241 I242 W243 C247 T248 V249	I161-V245 HydrophobicContact CG2-CG1 4.43Å; I161-V245 HydrophobicContact CG2-CG2 4.04Å; L162-V245 HydrophobicContact CD2-CG1 4.15Å; V165-V245 HydrophobicContact CG2-CG2 4.08Å; L178-V245 HydrophobicContact CD1-CG2 3.85Å; D241-V245 WeakPolarHBondContact O-CG2 3.36Å; D241-V245 PolarHBondContact O-N 3.05Å; I242-V245 WeakPolarHBondContact O-CB 3.49Å; I242-V245 PolarHBondContact O-N 2.91Å; W243-V245 VanDerWaalsContact C-N 3.29Å; W243-V245 PolarHBondContact O-N 3.37Å; V245-C247 VanDerWaalsContact C-N 3.33Å; V245-C247 PolarHBondContact O-N 3.38Å; V245-T248 CarbonylContact O-C 3.39Å; V245-T248 WeakPolarHBondContact O-CB 3.43Å; V245-T248 PolarHBondContact O-N 3.34Å; V245-V249 HydrophobicContact CG1-CG2 4.23Å; V245-V249 WeakPolarHBondContact O-CG2 3.31Å; V245-V249 PolarHBondContact O-N 3.12Å
246	G	98.4	Very high	94.7	Very high	0 Å²	0	21.9 Å²	21.9	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-54.2	-46.9	175.3	0	0	0	0	0	113	I242 W243 T248 V249 F250	I242-G246 PolarHBondContact O-N 2.96Å; W243-G246 WeakPolarHBondContact O-CA 3.22Å; W243-G246 PolarHBondContact O-N 3.42Å; G246-T248 VanDerWaalsContact C-N 3.34Å; G246-T248 PolarHBondContact O-N 3.13Å; G246-V249 PolarHBondContact O-N 3.14Å; G246-F250 PolarHBondContact O-N 3.31Å
247	C	98.3	Very high	96.1	Very high	0 Å²	0	20.9 Å²	20.9	0%	0	11%	0.107	C	C	.	.	H	α-helix	trans	-62.8	-38.5	174.7	-70.6	0	0	0	0	112.6	Y224 W225 W243 S244 V245 F250 E251 P258	Y224-C247 PolarHBondContact O-SG 3.12Å; Y224-C247 VanDerWaalsContact O-SG 3.34Å; W225-C247 HydrophobicContact CB-CB 4.25Å; W225-C247 HydrophobicContact CG-CB 3.87Å; W243-C247 PolarHBondContact O-N 2.98Å; S244-C247 PolarHBondContact O-N 3.04Å; V245-C247 VanDerWaalsContact C-N 3.33Å; V245-C247 PolarHBondContact O-N 3.38Å; C247-F250 PolarHBondContact O-N 2.96Å; C247-E251 WeakPolarHBondContact O-CB 3.19Å; C247-E251 PolarHBondContact O-N 3.49Å; C247-P258 HydrophobicContact CB-CG 4.39Å
248	T	98.3	Very high	96.7	Very high	2 Å²	2	20.5 Å²	20.5	1%	0.012	10%	0.103	C	C	.	.	H	α-helix	trans	-69.1	-37.6	178.2	-55.4	0	0	0	0	111.9	K179 V183 S244 V245 G246 E251 M252	K179-T248 WeakPolarHBondContact CA-OG1 3.39Å; V183-T248 HydrophobicContact CG2-CG2 4.41Å; S244-T248 WeakPolarHBondContact O-CB 3.37Å; S244-T248 PolarHBondContact O-N 2.81Å; S244-T248 PolarHBondContact O-OG1 3.1Å; V245-T248 CarbonylContact O-C 3.39Å; V245-T248 WeakPolarHBondContact O-CB 3.43Å; V245-T248 PolarHBondContact O-N 3.34Å; G246-T248 VanDerWaalsContact C-N 3.34Å; G246-T248 PolarHBondContact O-N 3.13Å; T248-E251 WeakPolarHBondContact O-CB 3.35Å; T248-E251 PolarHBondContact O-N 2.91Å; T248-M252 WeakPolarHBondContact O-CG 3.16Å; T248-M252 PolarHBondContact O-N 3.32Å
249	V	98.5	Very high	96.8	Very high	0 Å²	0	16 Å²	16	0%	0	9%	0.086	C	C	.	.	H	α-helix	trans	-67.1	-41.6	174.4	175.7	0	0	0	0	110.6	L154 T158 V245 G246 E251 M252 A253 F292 V293 F315	L154-V249 HydrophobicContact CD1-CG1 4.04Å; L154-V249 HydrophobicContact CD2-CG1 4.22Å; L154-V249 HydrophobicContact CG-CG1 4.21Å; T158-V249 HydrophobicContact CG2-CG2 3.66Å; T158-V249 WeakPolarHBondContact OG1-CG2 3.42Å; V245-V249 HydrophobicContact CG1-CG2 4.23Å; V245-V249 WeakPolarHBondContact O-CG2 3.31Å; V245-V249 PolarHBondContact O-N 3.12Å; G246-V249 PolarHBondContact O-N 3.14Å; V249-E251 VanDerWaalsContact C-N 3.33Å; V249-E251 PolarHBondContact O-N 3.14Å; V249-M252 HydrophobicContact CB-CE 4.42Å; V249-M252 HydrophobicContact CG2-CE 3.96Å; V249-M252 PolarHBondContact O-N 2.88Å; V249-A253 WeakPolarHBondContact O-CB 3.36Å; V249-A253 PolarHBondContact O-N 3.4Å; V249-F292 HydrophobicContact CG1-CD1 4.43Å; V249-F292 HydrophobicContact CG2-CE1 4.04Å; V249-V293 HydrophobicContact CB-CG2 4.24Å; V249-V293 HydrophobicContact CG1-CG2 3.7Å; V249-F315 HydrophobicContact CG1-CE1 4.39Å
250	F	98.6	Very high	96.8	Very high	17 Å²	17	15.4 Å²	15.4	8%	0.075	9%	0.091	C	C	.	.	H	α-helix	trans	-60.1	-44	172	-171.8	-73.4	0	0	0	111.8	G246 C247 A253 T254 K256 P258 P279 S280 L281 V293	G246-F250 PolarHBondContact O-N 3.31Å; C247-F250 PolarHBondContact O-N 2.96Å; F250-A253 PolarHBondContact O-N 2.8Å; F250-T254 HydrophobicContact CD1-CG2 4.03Å; F250-T254 WeakPolarHBondContact CD1-OG1 3.38Å; F250-T254 HydrophobicContact CE1-CG2 3.63Å; F250-T254 WeakPolarHBondContact CE1-OG1 3.5Å; F250-T254 HydrophobicContact CE2-CG2 4.46Å; F250-T254 HydrophobicContact CZ-CG2 3.88Å; F250-T254 PolarHBondContact O-N 2.89Å; F250-T254 PolarHBondContact O-OG1 3.46Å; F250-K256 VanDerWaalsContact CD1-O 3.31Å; F250-K256 WeakPolarHBondContact CD1-O 3.32Å; F250-P258 HydrophobicContact CB-CG 3.8Å; F250-P258 HydrophobicContact CD1-CB 4.15Å; F250-P258 HydrophobicContact CD1-CG 3.78Å; F250-P258 HydrophobicContact CD2-CB 4.32Å; F250-P258 HydrophobicContact CD2-CG 4.06Å; F250-P258 VanDerWaalsContact CE1-CA 3.45Å; F250-P258 HydrophobicContact CE1-CB 4.3Å; F250-P258 HydrophobicContact CE1-CG 4.42Å; F250-P258 HydrophobicContact CE2-CB 4.44Å; F250-P258 HydrophobicContact CG-CB 4.19Å; F250-P258 HydrophobicContact CG-CG 3.6Å; F250-P258 HydrophobicContact CZ-CB 4.43Å; F250-P279 HydrophobicContact CE2-CB 3.87Å; F250-P279 WeakPolarHBondContact CE2-O 3.37Å; F250-P279 HydrophobicContact CZ-CB 4.06Å; F250-S280 WeakPolarHBondContact CE2-O 3.47Å; F250-L281 HydrophobicContact CB-CD2 4.41Å; F250-L281 HydrophobicContact CD2-CD2 3.8Å; F250-L281 HydrophobicContact CE2-CD2 4.34Å; F250-L281 HydrophobicContact CG-CD2 4.23Å; F250-V293 HydrophobicContact CB-CG1 4.38Å; F250-V293 HydrophobicContact CD2-CG1 4.26Å
251	E	98.2	Very high	96.8	Very high	12 Å²	12	21.9 Å²	21.9	6%	0.056	12%	0.12	C	C	.	.	H	α-helix	trans	-59.2	-46.4	175.7	-179.9	-173.7	-154.1	0	0	111.5	L143 G180 W225 C247 T248 V249 A253 T254 G255 K256	L143-E251 HydrophobicContact CD1-CG 3.75Å; L143-E251 WeakPolarHBondContact CD1-O 3.31Å; G180-E251 WeakPolarHBondContact CA-OE2 3.4Å; G180-E251 PolarHBondContact N-OE2 3.46Å; W225-E251 HydrophobicContact CZ2-CG 4.46Å; W225-E251 WeakPolarHBondContact CZ2-OE1 3.37Å; W225-E251 WeakPolarHBondContact CZ2-OE2 3.5Å; W225-E251 PolarHBondContact NE1-OE2 3.49Å; C247-E251 WeakPolarHBondContact O-CB 3.19Å; C247-E251 PolarHBondContact O-N 3.49Å; T248-E251 WeakPolarHBondContact O-CB 3.35Å; T248-E251 PolarHBondContact O-N 2.91Å; V249-E251 VanDerWaalsContact C-N 3.33Å; V249-E251 PolarHBondContact O-N 3.14Å; E251-A253 VanDerWaalsContact C-N 3.27Å; E251-A253 PolarHBondContact O-N 3.12Å; E251-T254 PolarHBondContact O-N 3.46Å; E251-G255 WeakPolarHBondContact O-CA 3.39Å; E251-G255 PolarHBondContact O-N 3.17Å; E251-K256 WeakPolarHBondContact CA-O 3.37Å
252	M	98.4	Very high	96.6	Very high	0 Å²	0	24 Å²	24	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-60.4	-37	175.5	-75.6	-170.2	-65.6	0	0	112.8	I139 L149 L154 Y157 I161 T248 V249	I139-M252 HydrophobicContact CD1-SD 4.45Å; I139-M252 HydrophobicContact CG2-CG 3.51Å; I139-M252 HydrophobicContact CG2-SD 4.1Å; L149-M252 HydrophobicContact CD1-CB 4.1Å; L149-M252 HydrophobicContact CD1-CG 4.08Å; L149-M252 HydrophobicContact CD1-SD 4.02Å; L149-M252 PolarHBondContact N-O 3.34Å; L154-M252 HydrophobicContact CD1-CB 3.21Å; L154-M252 HydrophobicContact CD1-CE 3.86Å; L154-M252 HydrophobicContact CD1-CG 4.29Å; L154-M252 HydrophobicContact CD1-SD 4.32Å; Y157-M252 HydrophobicContact CD2-SD 4.42Å; I161-M252 HydrophobicContact CD1-CE 3.76Å; I161-M252 HydrophobicContact CD1-SD 4.31Å; T248-M252 WeakPolarHBondContact O-CG 3.16Å; T248-M252 PolarHBondContact O-N 3.32Å; V249-M252 HydrophobicContact CB-CE 4.42Å; V249-M252 HydrophobicContact CG2-CE 3.96Å; V249-M252 PolarHBondContact O-N 2.88Å
253	A	98.2	Very high	96.4	Very high	4 Å²	4	29.1 Å²	29.1	3%	0.033	16%	0.158	C	C	.	.	H	α-helix	trans	-78.6	-23.5	-177.5	0	0	0	0	0	114.2	P148 L154 V249 F250 E251 L281 F285	P148-A253 WeakPolarHBondContact CB-O 3.47Å; L154-A253 HydrophobicContact CD1-CB 4.33Å; L154-A253 HydrophobicContact CD2-CB 3.85Å; V249-A253 WeakPolarHBondContact O-CB 3.36Å; V249-A253 PolarHBondContact O-N 3.4Å; F250-A253 PolarHBondContact O-N 2.8Å; E251-A253 VanDerWaalsContact C-N 3.27Å; E251-A253 PolarHBondContact O-N 3.12Å; A253-L281 HydrophobicContact CB-CD1 4.37Å; A253-L281 HydrophobicContact CB-CD2 3.54Å; A253-F285 HydrophobicContact CB-CE1 3.96Å; A253-F285 HydrophobicContact CB-CE2 4.07Å; A253-F285 HydrophobicContact CB-CZ 3.59Å; A253-F285 WeakPolarHBondContact O-CZ 3.44Å
254	T	97.6	Very high	96	Very high	38 Å²	38	33.7 Å²	33.7	23%	0.233	18%	0.178	C	C	.	.	H	α-helix	trans	-127.2	-7.5	-171.6	66.7	0	0	0	0	114.2	F250 E251 K256 P282	F250-T254 HydrophobicContact CD1-CG2 4.03Å; F250-T254 WeakPolarHBondContact CD1-OG1 3.38Å; F250-T254 HydrophobicContact CE1-CG2 3.63Å; F250-T254 WeakPolarHBondContact CE1-OG1 3.5Å; F250-T254 HydrophobicContact CE2-CG2 4.46Å; F250-T254 HydrophobicContact CZ-CG2 3.88Å; F250-T254 PolarHBondContact O-N 2.89Å; F250-T254 PolarHBondContact O-OG1 3.46Å; E251-T254 PolarHBondContact O-N 3.46Å; T254-K256 PolarHBondContact O-N 2.98Å; T254-K256 PolarHBondContact OG1-N 2.92Å; T254-K256 PolarHBondContact OG1-O 3.11Å; T254-P282 HydrophobicContact CG2-CG 4.14Å
255	G	96.9	Very high	95.6	Very high	28 Å²	28	38.7 Å²	38.7	29%	0.289	20%	0.201	S	C	.	.	S	Bend	trans	76.4	-2.1	-174	0	0	0	0	0	114.4	E251	E251-G255 WeakPolarHBondContact O-CA 3.39Å; E251-G255 PolarHBondContact O-N 3.17Å
256	K	95.8	Very high	95.3	Very high	142 Å²	142	40.8 Å²	40.8	62%	0.617	22%	0.219	S	C	*	.	S	Bend	trans	-144.3	150.2	-177.5	-62.5	-176.9	-176.7	177.6	0	110.8	F250 E251 T254 A260	F250-K256 VanDerWaalsContact CD1-O 3.31Å; F250-K256 WeakPolarHBondContact CD1-O 3.32Å; E251-K256 WeakPolarHBondContact CA-O 3.37Å; T254-K256 PolarHBondContact O-N 2.98Å; T254-K256 PolarHBondContact OG1-N 2.92Å; T254-K256 PolarHBondContact OG1-O 3.11Å; K256-A260 HydrophobicContact CB-CB 3.84Å; K256-A260 HydrophobicContact CD-CB 4.37Å
257	P	95.5	Very high	95	Very high	15 Å²	15	40.8 Å²	40.8	10%	0.097	22%	0.219	C	C	.	.			trans	-66.5	160.4	174.5	28.1	-35.1	0	0	0	112.3	Y224 W225 L259 A260	Y224-P257 HydrophobicContact CD2-CG 4.05Å; Y224-P257 HydrophobicContact CG-CB 4.43Å; Y224-P257 HydrophobicContact CG-CG 4.04Å; W225-P257 HydrophobicContact CH2-CB 3.87Å; W225-P257 HydrophobicContact CH2-CG 3.62Å; W225-P257 HydrophobicContact CZ2-CB 3.67Å; W225-P257 HydrophobicContact CZ2-CG 3.89Å; W225-P257 HydrophobicContact CZ3-CB 4.35Å; W225-P257 HydrophobicContact CZ3-CG 4.16Å; P257-L259 VanDerWaalsContact C-N 3.3Å; P257-L259 PolarHBondContact O-N 3.35Å; P257-L259 VanDerWaalsContact O-N 3.08Å; P257-A260 HydrophobicContact CG-CB 3.94Å; P257-A260 VanDerWaalsContact O-CB 3.3Å; P257-A260 WeakPolarHBondContact O-CB 3.46Å; P257-A260 PolarHBondContact O-N 2.95Å; P257-A260 VanDerWaalsContact O-N 3.07Å
258	P	93.3	Very high	94.6	Very high	6 Å²	6	41.5 Å²	41.5	4%	0.039	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	-49.8	-41	-171.4	-27	30.2	0	0	0	115.9	C247 F250 M278 P279 L297	C247-P258 HydrophobicContact CB-CG 4.39Å; F250-P258 HydrophobicContact CB-CG 3.8Å; F250-P258 HydrophobicContact CD1-CB 4.15Å; F250-P258 HydrophobicContact CD1-CG 3.78Å; F250-P258 HydrophobicContact CD2-CB 4.32Å; F250-P258 HydrophobicContact CD2-CG 4.06Å; F250-P258 VanDerWaalsContact CE1-CA 3.45Å; F250-P258 HydrophobicContact CE1-CB 4.3Å; F250-P258 HydrophobicContact CE1-CG 4.42Å; F250-P258 HydrophobicContact CE2-CB 4.44Å; F250-P258 HydrophobicContact CG-CB 4.19Å; F250-P258 HydrophobicContact CG-CG 3.6Å; F250-P258 HydrophobicContact CZ-CB 4.43Å; P258-M278 HydrophobicContact CB-CE 3.79Å; P258-M278 HydrophobicContact CG-CE 4.19Å; P258-P279 HydrophobicContact CB-CG 4.33Å; P258-P279 WeakPolarHBondContact O-CG 3.38Å; P258-L297 HydrophobicContact CG-CD1 4.23Å
259	L	94.6	Very high	94.2	Very high	4 Å²	4	47 Å²	47	2%	0.021	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	-109.5	26.9	-175.8	-59.1	179.7	0	0	0	113.1	Y224 P257 H261 M262 A267 Y270 I271 M278 P279	Y224-L259 HydrophobicContact CD1-CB 4.2Å; Y224-L259 VanDerWaalsContact CE1-O 3.25Å; Y224-L259 WeakPolarHBondContact CE1-O 3.49Å; P257-L259 VanDerWaalsContact C-N 3.3Å; P257-L259 PolarHBondContact O-N 3.35Å; P257-L259 VanDerWaalsContact O-N 3.08Å; L259-H261 PolarHBondContact O-N 3.41Å; L259-M262 HydrophobicContact CB-SD 4.42Å; L259-M262 HydrophobicContact CD1-SD 4.4Å; L259-M262 HydrophobicContact CD2-CE 4.17Å; L259-M262 HydrophobicContact CD2-SD 4.27Å; L259-M262 PolarHBondContact O-N 3.18Å; L259-A267 HydrophobicContact CB-CB 4.11Å; L259-A267 HydrophobicContact CD1-CB 4.34Å; L259-Y270 HydrophobicContact CD1-CD1 3.64Å; L259-Y270 HydrophobicContact CD1-CE1 4.22Å; L259-Y270 HydrophobicContact CD1-CG 4.37Å; L259-Y270 HydrophobicContact CD2-CD1 4.48Å; L259-Y270 HydrophobicContact CD2-CE1 4.36Å; L259-I271 HydrophobicContact CD1-CD1 3.99Å; L259-I271 HydrophobicContact CD1-CG1 3.7Å; L259-M278 HydrophobicContact CD1-CE 4.27Å; L259-M278 HydrophobicContact CD1-SD 4.16Å; L259-M278 HydrophobicContact CG-CE 4.24Å; L259-P279 HydrophobicContact CD2-CG 3.94Å
260	A	93.7	Very high	93.9	Very high	39 Å²	39	49.9 Å²	49.9	32%	0.322	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.1	-18	-178.4	0	0	0	0	0	114.8	K256 P257 M262	K256-A260 HydrophobicContact CB-CB 3.84Å; K256-A260 HydrophobicContact CD-CB 4.37Å; P257-A260 HydrophobicContact CG-CB 3.94Å; P257-A260 VanDerWaalsContact O-CB 3.3Å; P257-A260 WeakPolarHBondContact O-CB 3.46Å; P257-A260 PolarHBondContact O-N 2.95Å; P257-A260 VanDerWaalsContact O-N 3.07Å; A260-M262 VanDerWaalsContact C-N 3.32Å
261	H	92.2	Very high	93.5	Very high	140 Å²	140	49.2 Å²	49.2	65%	0.648	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.9	-15.8	177	65.2	-83	0	0	0	113.1	L259	L259-H261 PolarHBondContact O-N 3.41Å
262	M	92.9	Very high	93.1	Very high	46 Å²	46	49 Å²	49	23%	0.227	26%	0.256	C	S	.	.	S	Bend	trans	-93.9	150.3	177.5	-61.7	-176.5	179.7	0	0	110.9	Y224 L259 A260 A266 A267 Y270	Y224-M262 PolarHBondContact OH-O 3.05Å; L259-M262 HydrophobicContact CB-SD 4.42Å; L259-M262 HydrophobicContact CD1-SD 4.4Å; L259-M262 HydrophobicContact CD2-CE 4.17Å; L259-M262 HydrophobicContact CD2-SD 4.27Å; L259-M262 PolarHBondContact O-N 3.18Å; A260-M262 VanDerWaalsContact C-N 3.32Å; M262-A266 HydrophobicContact CB-CB 4.39Å; M262-A267 HydrophobicContact CB-CB 4.18Å; M262-Y270 HydrophobicContact CE-CD2 3.93Å; M262-Y270 HydrophobicContact CE-CE2 4.08Å; M262-Y270 HydrophobicContact CE-CG 4.28Å; M262-Y270 HydrophobicContact SD-CD2 4.38Å; M262-Y270 HydrophobicContact SD-CG 4.26Å
263	D	91.9	Very high	92.6	Very high	107 Å²	107	51.2 Å²	51.2	57%	0.572	28%	0.275	S	S	*	.			trans	-56.1	148.8	163.7	176.1	-100.4	0	0	0	110.6	M265 A266 A267	D263-M265 VanDerWaalsContact C-N 3.3Å; D263-M265 PolarHBondContact O-N 3.1Å; D263-M265 WeakPolarHBondContact OD1-CB 3.1Å; D263-M265 PolarHBondContact OD1-N 2.9Å; D263-A266 HydrophobicContact CB-CB 4.21Å; D263-A266 WeakPolarHBondContact O-CB 3.49Å; D263-A266 PolarHBondContact O-N 3.19Å; D263-A266 VanDerWaalsContact O-N 3.11Å; D263-A267 PolarHBondContact O-N 2.94Å
264	K	89.4	Confident	92	Very high	98 Å²	98	57.4 Å²	57.4	43%	0.426	30%	0.297	S	S	.	.	H	α-helix	trans	-53	-44.7	-177.6	-73.3	-177.7	-178.4	-179.9	0	112.7	P223 Y224 A267 L268	P223-K264 HydrophobicContact CG-CB 3.74Å; P223-K264 HydrophobicContact CG-CD 3.93Å; P223-K264 HydrophobicContact CG-CG 3.66Å; Y224-K264 HydrophobicContact CE2-CG 4.01Å; K264-A267 PolarHBondContact O-N 3.43Å; K264-L268 WeakPolarHBondContact O-CG 3.44Å; K264-L268 PolarHBondContact O-N 3.07Å
265	M	89.1	Confident	90.8	Very high	113 Å²	113	62.4 Å²	62.4	56%	0.557	31%	0.312	S	S	*	.	H	α-helix	trans	-73	-37	-179.7	-66.8	-59	177.2	0	0	111.6	I219 D263 A267 L268 F269	I219-M265 HydrophobicContact CG2-CE 3.92Å; D263-M265 VanDerWaalsContact C-N 3.3Å; D263-M265 PolarHBondContact O-N 3.1Å; D263-M265 WeakPolarHBondContact OD1-CB 3.1Å; D263-M265 PolarHBondContact OD1-N 2.9Å; M265-A267 VanDerWaalsContact C-N 3.35Å; M265-L268 PolarHBondContact O-N 2.71Å; M265-L268 HydrophobicContact SD-CD1 3.94Å; M265-F269 WeakPolarHBondContact O-CB 3.33Å; M265-F269 PolarHBondContact O-N 3.21Å
266	A	91.3	Very high	89.9	Confident	46 Å²	46	63.9 Å²	63.9	38%	0.38	33%	0.326	S	S	.	.	H	α-helix	trans	-62.7	-42.3	174.3	0	0	0	0	0	111.5	M262 D263 F269 Y270	M262-A266 HydrophobicContact CB-CB 4.39Å; D263-A266 HydrophobicContact CB-CB 4.21Å; D263-A266 WeakPolarHBondContact O-CB 3.49Å; D263-A266 PolarHBondContact O-N 3.19Å; D263-A266 VanDerWaalsContact O-N 3.11Å; A266-F269 PolarHBondContact O-N 3.19Å; A266-Y270 WeakPolarHBondContact O-CB 3.42Å; A266-Y270 PolarHBondContact O-N 3.27Å
267	A	91.8	Very high	89.3	Confident	0 Å²	0	64.6 Å²	64.6	0%	0	34%	0.336	C	S	.	.	H	α-helix	trans	-63.7	-44.9	175.4	0	0	0	0	0	111.9	Y224 L259 M262 D263 K264 M265 F269 Y270 I271	Y224-A267 HydrophobicContact CD1-CB 3.71Å; Y224-A267 HydrophobicContact CE1-CB 3.63Å; L259-A267 HydrophobicContact CB-CB 4.11Å; L259-A267 HydrophobicContact CD1-CB 4.34Å; M262-A267 HydrophobicContact CB-CB 4.18Å; D263-A267 PolarHBondContact O-N 2.94Å; K264-A267 PolarHBondContact O-N 3.43Å; M265-A267 VanDerWaalsContact C-N 3.35Å; A267-F269 VanDerWaalsContact C-N 3.32Å; A267-F269 PolarHBondContact O-N 3.01Å; A267-Y270 PolarHBondContact O-N 2.84Å; A267-I271 VanDerWaalsContact O-CG1 3.24Å; A267-I271 WeakPolarHBondContact O-CG1 3.3Å; A267-I271 PolarHBondContact O-N 3.08Å
268	L	90.1	Very high	89.3	Confident	14 Å²	14	65.3 Å²	65.3	7%	0.073	34%	0.339	C	S	.	.	H	α-helix	trans	-58.1	-45.8	175.1	-74.5	174.2	0	0	0	111.6	I219 P223 M226 I231 K264 M265 I271 G272	I219-L268 HydrophobicContact CG1-CD1 4.35Å; I219-L268 HydrophobicContact CG2-CD1 3.96Å; P223-L268 HydrophobicContact CB-CD1 3.91Å; P223-L268 HydrophobicContact CB-CD2 3.51Å; P223-L268 HydrophobicContact CB-CG 3.57Å; M226-L268 HydrophobicContact SD-CD2 3.97Å; I231-L268 HydrophobicContact CD1-CD2 3.69Å; I231-L268 HydrophobicContact CG1-CD2 3.91Å; K264-L268 WeakPolarHBondContact O-CG 3.44Å; K264-L268 PolarHBondContact O-N 3.07Å; M265-L268 PolarHBondContact O-N 2.71Å; M265-L268 HydrophobicContact SD-CD1 3.94Å; L268-I271 PolarHBondContact O-N 2.84Å; L268-G272 PolarHBondContact O-N 3.17Å
269	F	90.1	Very high	89.3	Confident	117 Å²	117	67 Å²	67	51%	0.513	35%	0.35	S	S	.	.	H	α-helix	trans	-65.4	-41.7	178.2	-178.4	-107.4	0	0	0	112	M265 A266 A267 A273	M265-F269 WeakPolarHBondContact O-CB 3.33Å; M265-F269 PolarHBondContact O-N 3.21Å; A266-F269 PolarHBondContact O-N 3.19Å; A267-F269 VanDerWaalsContact C-N 3.32Å; A267-F269 PolarHBondContact O-N 3.01Å; F269-A273 HydrophobicContact CE2-CB 4.47Å; F269-A273 WeakPolarHBondContact O-CB 3.47Å; F269-A273 PolarHBondContact O-N 2.77Å
270	Y	92.1	Very high	89.3	Confident	61 Å²	61	70.9 Å²	70.9	24%	0.239	38%	0.377	C	S	.	.	H	α-helix	trans	-58.8	-48.7	176.1	-174	-87.9	0	0	0	111.6	L259 M262 A266 A267 R274 R275 L277	L259-Y270 HydrophobicContact CD1-CD1 3.64Å; L259-Y270 HydrophobicContact CD1-CE1 4.22Å; L259-Y270 HydrophobicContact CD1-CG 4.37Å; L259-Y270 HydrophobicContact CD2-CD1 4.48Å; L259-Y270 HydrophobicContact CD2-CE1 4.36Å; M262-Y270 HydrophobicContact CE-CD2 3.93Å; M262-Y270 HydrophobicContact CE-CE2 4.08Å; M262-Y270 HydrophobicContact CE-CG 4.28Å; M262-Y270 HydrophobicContact SD-CD2 4.38Å; M262-Y270 HydrophobicContact SD-CG 4.26Å; A266-Y270 WeakPolarHBondContact O-CB 3.42Å; A266-Y270 PolarHBondContact O-N 3.27Å; A267-Y270 PolarHBondContact O-N 2.84Å; Y270-R274 PolarHBondContact O-N 3.34Å; Y270-R275 HydrophobicContact CD2-CB 4.05Å; Y270-R275 WeakPolarHBondContact CE1-O 3.25Å; Y270-R275 HydrophobicContact CE2-CB 4.23Å; Y270-R275 WeakPolarHBondContact CE2-O 3.41Å; Y270-R275 HydrophobicContact CG-CB 4.44Å; Y270-R275 PolarHBondContact O-N 2.85Å; Y270-R275 PolarHBondContact OH-O 2.97Å; Y270-R275 VanDerWaalsContact OH-O 3.11Å; Y270-L277 PolarHBondContact OH-O 3.14Å
271	I	91.5	Very high	89.5	Confident	4 Å²	4	69.1 Å²	69.1	2%	0.021	36%	0.362	C	S	.	.	H	α-helix	trans	-67.5	-50.7	178.9	-62	164.9	0	0	0	110.8	P228 I231 W243 L259 A267 L268 R274 M278	P228-I271 HydrophobicContact CB-CG2 4.26Å; P228-I271 HydrophobicContact CG-CG2 3.7Å; I231-I271 HydrophobicContact CD1-CB 3.7Å; I231-I271 HydrophobicContact CD1-CD1 4.49Å; I231-I271 HydrophobicContact CD1-CG2 3.56Å; W243-I271 HydrophobicContact CH2-CG2 4.16Å; W243-I271 HydrophobicContact CZ2-CG1 4.4Å; W243-I271 HydrophobicContact CZ2-CG2 3.65Å; L259-I271 HydrophobicContact CD1-CD1 3.99Å; L259-I271 HydrophobicContact CD1-CG1 3.7Å; A267-I271 VanDerWaalsContact O-CG1 3.24Å; A267-I271 WeakPolarHBondContact O-CG1 3.3Å; A267-I271 PolarHBondContact O-N 3.08Å; L268-I271 PolarHBondContact O-N 2.84Å; I271-R274 WeakPolarHBondContact O-CA 3.5Å; I271-R274 PolarHBondContact O-N 3.47Å; I271-M278 HydrophobicContact CG1-SD 4.4Å
272	G	88.4	Confident	89.6	Confident	6 Å²	6	65.6 Å²	65.6	6%	0.062	35%	0.352	C	S	.	.	H	α-helix	trans	-64	-42.1	-176.6	0	0	0	0	0	112.8	N232 L268 R274	N232-G272 PolarHBondContact ND2-O 3.14Å; N232-G272 PolarHBondContact OD1-O 3.42Å; L268-G272 PolarHBondContact O-N 3.17Å; G272-R274 PolarHBondContact O-N 3.37Å
273	A	88.4	Confident	89.6	Confident	48 Å²	48	70.6 Å²	70.6	40%	0.397	38%	0.379	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.9	1.5	174.4	0	0	0	0	0	113.3	F269 R275	F269-A273 HydrophobicContact CE2-CB 4.47Å; F269-A273 WeakPolarHBondContact O-CB 3.47Å; F269-A273 PolarHBondContact O-N 2.77Å; A273-R275 HydrophobicContact CB-CG 3.77Å; A273-R275 PolarHBondContact O-N 3.49Å; A273-R275 VanDerWaalsContact O-N 3.17Å
274	R	85.8	Confident	89.6	Confident	134 Å²	134	69.2 Å²	69.2	51%	0.506	39%	0.391	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.4	38.3	-179.4	-54.6	178.1	-178.3	-177.6	0.2	112	P228 Y270 I271 G272 G276	P228-R274 HydrophobicContact CB-CG 4.37Å; Y270-R274 PolarHBondContact O-N 3.34Å; I271-R274 WeakPolarHBondContact O-CA 3.5Å; I271-R274 PolarHBondContact O-N 3.47Å; G272-R274 PolarHBondContact O-N 3.37Å; R274-G276 PolarHBondContact O-N 3.4Å
275	R	72.4	Confident	90	Very high	143 Å²	143	66 Å²	66	54%	0.54	38%	0.377	S	S	.	.			trans	-79.1	105.1	-175.2	-74.4	-179.4	177.3	-153.9	-0.4	108.5	Y270 A273	Y270-R275 HydrophobicContact CD2-CB 4.05Å; Y270-R275 WeakPolarHBondContact CE1-O 3.25Å; Y270-R275 HydrophobicContact CE2-CB 4.23Å; Y270-R275 WeakPolarHBondContact CE2-O 3.41Å; Y270-R275 HydrophobicContact CG-CB 4.44Å; Y270-R275 PolarHBondContact O-N 2.85Å; Y270-R275 PolarHBondContact OH-O 2.97Å; Y270-R275 VanDerWaalsContact OH-O 3.11Å; A273-R275 HydrophobicContact CB-CG 3.77Å; A273-R275 PolarHBondContact O-N 3.49Å; A273-R275 VanDerWaalsContact O-N 3.17Å
276	G	77.3	Confident	90.4	Very high	58 Å²	58	62.6 Å²	62.6	60%	0.598	36%	0.364	S	S	*	.	S	Bend	trans	76.5	-172.8	170	0	0	0	0	0	115.3	R274	R274-G276 PolarHBondContact O-N 3.4Å
277	L	84.5	Confident	90.7	Very high	157 Å²	157	66.7 Å²	66.7	82%	0.822	38%	0.376	S	S	*	.	P	Polyproline II helix	trans	-89.9	139	-176.7	-65.5	172.5	0	0	0	110.4	Y270	Y270-L277 PolarHBondContact OH-O 3.14Å
278	M	93.9	Very high	91	Very high	30 Å²	30	70.3 Å²	70.3	15%	0.148	40%	0.395	C	S	.	.	P	Polyproline II helix	trans	-65.8	144.9	169.8	-68.6	-65.5	-69.8	0	0	110.3	W243 P258 L259 I271 S280 L297	W243-M278 HydrophobicContact CH2-CE 4.34Å; W243-M278 HydrophobicContact CH2-CG 3.75Å; W243-M278 HydrophobicContact CH2-SD 3.98Å; W243-M278 HydrophobicContact CZ2-CE 3.87Å; W243-M278 HydrophobicContact CZ2-CG 4.25Å; W243-M278 HydrophobicContact CZ2-SD 4Å; P258-M278 HydrophobicContact CB-CE 3.79Å; P258-M278 HydrophobicContact CG-CE 4.19Å; L259-M278 HydrophobicContact CD1-CE 4.27Å; L259-M278 HydrophobicContact CD1-SD 4.16Å; L259-M278 HydrophobicContact CG-CE 4.24Å; I271-M278 HydrophobicContact CG1-SD 4.4Å; M278-S280 PolarHBondContact O-N 3.28Å; M278-L297 HydrophobicContact CB-CB 3.94Å; M278-L297 HydrophobicContact CB-CD1 3.84Å; M278-L297 HydrophobicContact CE-CD1 4.19Å; M278-L297 HydrophobicContact CG-CB 4.04Å; M278-L297 HydrophobicContact CG-CD1 4.37Å
279	P	94	Very high	91.4	Very high	42 Å²	42	69.6 Å²	69.6	27%	0.273	39%	0.391	S	S	.	.	P	Polyproline II helix	trans	-55.8	137.4	179.7	-28.3	36.9	0	0	0	113	F250 P258 L259	F250-P279 HydrophobicContact CE2-CB 3.87Å; F250-P279 WeakPolarHBondContact CE2-O 3.37Å; F250-P279 HydrophobicContact CZ-CB 4.06Å; P258-P279 HydrophobicContact CB-CG 4.33Å; P258-P279 WeakPolarHBondContact O-CG 3.38Å; L259-P279 HydrophobicContact CD2-CG 3.94Å
280	S	95.1	Very high	91.8	Very high	86 Å²	86	65.6 Å²	65.6	60%	0.601	37%	0.374	S	S	*	.	P	Polyproline II helix	trans	-80.3	162.3	171.4	61.1	0	0	0	0	111.4	F250 M278	F250-S280 WeakPolarHBondContact CE2-O 3.47Å; M278-S280 PolarHBondContact O-N 3.28Å
281	L	96.7	Very high	92.1	Very high	1 Å²	1	65.8 Å²	65.8	1%	0.005	38%	0.379	C	S	.	.	P	Polyproline II helix	trans	-62.8	152.7	168.4	-63	-176.9	0	0	0	111	F250 A253 F285 A289 K290 V293	F250-L281 HydrophobicContact CB-CD2 4.41Å; F250-L281 HydrophobicContact CD2-CD2 3.8Å; F250-L281 HydrophobicContact CE2-CD2 4.34Å; F250-L281 HydrophobicContact CG-CD2 4.23Å; A253-L281 HydrophobicContact CB-CD1 4.37Å; A253-L281 HydrophobicContact CB-CD2 3.54Å; L281-F285 HydrophobicContact CB-CB 4.15Å; L281-F285 HydrophobicContact CB-CD2 4.14Å; L281-F285 HydrophobicContact CB-CG 4.22Å; L281-F285 HydrophobicContact CD1-CB 4.2Å; L281-F285 HydrophobicContact CD1-CD1 4.2Å; L281-F285 HydrophobicContact CD1-CG 4.07Å; L281-A289 HydrophobicContact CD1-CB 3.94Å; L281-K290 HydrophobicContact CB-CG 3.99Å; L281-V293 HydrophobicContact CD1-CG2 3.83Å; L281-V293 HydrophobicContact CD2-CG2 4.11Å; L281-V293 HydrophobicContact CG-CB 4.32Å; L281-V293 HydrophobicContact CG-CG2 3.91Å
282	P	95.2	Very high	92.5	Very high	67 Å²	67	65.6 Å²	65.6	44%	0.435	38%	0.378	S	S	.	.	P	Polyproline II helix	trans	-58.2	161.3	176.2	-24	33.7	0	0	0	113.9	T254 G284 F285 K290	T254-P282 HydrophobicContact CG2-CG 4.14Å; P282-G284 PolarHBondContact O-N 3.46Å; P282-F285 HydrophobicContact CB-CD2 4.43Å; P282-F285 HydrophobicContact CG-CD2 4.5Å; P282-F285 HydrophobicContact CG-CE2 4.46Å; P282-F285 PolarHBondContact O-N 2.99Å; P282-F285 VanDerWaalsContact O-N 3.12Å; P282-K290 WeakPolarHBondContact O-CE 3.23Å
283	D	91.8	Very high	92.9	Very high	150 Å²	150	65.4 Å²	65.4	80%	0.802	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.3	-24.5	-174.3	-69.2	-31.6	0	0	0	115	F285 K290	D283-F285 PolarHBondContact O-N 3.34Å; D283-K290 IonicContact OD1-NZ 3.65Å
284	G	92.7	Very high	93.4	Very high	79 Å²	79	70.3 Å²	70.3	81%	0.814	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71	-6.3	178.2	0	0	0	0	0	115.6	P282	P282-G284 PolarHBondContact O-N 3.46Å
285	F	97.4	Very high	93.9	Very high	30 Å²	30	66 Å²	66	13%	0.132	37%	0.374	C	S	.	.	S	Bend	trans	-95.6	150.1	175.4	-72.9	-89.6	0	0	0	111.8	E151 L154 A253 L281 P282 D283 A289 K290	E151-F285 HydrophobicContact CB-CD1 3.9Å; E151-F285 HydrophobicContact CB-CE1 3.98Å; E151-F285 HydrophobicContact CG-CD1 3.96Å; E151-F285 HydrophobicContact CG-CE1 4.4Å; E151-F285 VanDerWaalsContact OE2-CA 3.31Å; E151-F285 WeakPolarHBondContact OE2-CA 3.45Å; L154-F285 HydrophobicContact CD2-CD1 4.18Å; L154-F285 HydrophobicContact CD2-CE1 3.72Å; A253-F285 HydrophobicContact CB-CE1 3.96Å; A253-F285 HydrophobicContact CB-CE2 4.07Å; A253-F285 HydrophobicContact CB-CZ 3.59Å; A253-F285 WeakPolarHBondContact O-CZ 3.44Å; L281-F285 HydrophobicContact CB-CB 4.15Å; L281-F285 HydrophobicContact CB-CD2 4.14Å; L281-F285 HydrophobicContact CB-CG 4.22Å; L281-F285 HydrophobicContact CD1-CB 4.2Å; L281-F285 HydrophobicContact CD1-CD1 4.2Å; L281-F285 HydrophobicContact CD1-CG 4.07Å; P282-F285 HydrophobicContact CB-CD2 4.43Å; P282-F285 HydrophobicContact CG-CD2 4.5Å; P282-F285 HydrophobicContact CG-CE2 4.46Å; P282-F285 PolarHBondContact O-N 2.99Å; P282-F285 VanDerWaalsContact O-N 3.12Å; D283-F285 PolarHBondContact O-N 3.34Å; F285-A289 HydrophobicContact CB-CB 4.24Å; F285-A289 HydrophobicContact CD1-CB 4.43Å; F285-K290 WeakPolarHBondContact O-CE 3.46Å; F285-K290 PolarHBondContact O-NZ 3.05Å
286	S	98.1	Very high	95.1	Very high	42 Å²	42	59.2 Å²	59.2	29%	0.294	35%	0.349	S	S	.	.			trans	-62.6	155.8	176.7	75.1	0	0	0	0	112.8	E151 N288 A289 K290	E151-S286 WeakPolarHBondContact OE1-CB 3.48Å; E151-S286 PolarHBondContact OE1-OG 3.15Å; E151-S286 PolarHBondContact OE2-N 2.94Å; S286-N288 PolarHBondContact O-N 3.11Å; S286-A289 WeakPolarHBondContact O-CB 3.21Å; S286-A289 PolarHBondContact O-N 2.9Å; S286-A289 PolarHBondContact OG-N 2.87Å; S286-K290 PolarHBondContact O-N 3.1Å
287	E	98.2	Very high	96.1	Very high	131 Å²	131	56.9 Å²	56.9	61%	0.612	32%	0.323	S	S	*	.	H	α-helix	trans	-60.2	-30.7	174.2	-64.6	-52.4	122.9	0	0	112.1	K290 D291	E287-K290 PolarHBondContact O-N 3.15Å; E287-K290 WeakPolarHBondContact OE1-CD 3.49Å; E287-K290 IonicContact OE1-NZ 2.73Å; E287-K290 PolarHBondContact OE1-NZ 2.89Å; E287-D291 VanDerWaalsContact O-CB 3.23Å; E287-D291 WeakPolarHBondContact O-CB 3.38Å; E287-D291 PolarHBondContact O-N 3.2Å
288	N	98.2	Very high	96.6	Very high	76 Å²	76	51.6 Å²	51.6	41%	0.406	30%	0.297	S	S	.	.	H	α-helix	trans	-64.8	-42	173.5	-70.4	-37	0	0	0	111.8	S286 F292 H313 F315	S286-N288 PolarHBondContact O-N 3.11Å; N288-F292 WeakPolarHBondContact O-CB 3.47Å; N288-F292 PolarHBondContact O-N 3.46Å; N288-H313 PolarHBondContact O-CE1 2.87Å; N288-H313 VanDerWaalsContact O-CE1 3.31Å; N288-F315 HydrophobicContact CB-CB 4.28Å
289	A	98.2	Very high	96.4	Very high	0 Å²	0	51.8 Å²	51.8	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-67.4	-43.5	177.8	0	0	0	0	0	111.5	E151 L281 F285 S286 F292 V293 F315	E151-A289 HydrophobicContact CG-CB 4.44Å; L281-A289 HydrophobicContact CD1-CB 3.94Å; F285-A289 HydrophobicContact CB-CB 4.24Å; F285-A289 HydrophobicContact CD1-CB 4.43Å; S286-A289 WeakPolarHBondContact O-CB 3.21Å; S286-A289 PolarHBondContact O-N 2.9Å; S286-A289 PolarHBondContact OG-N 2.87Å; A289-F292 PolarHBondContact O-N 3.25Å; A289-V293 PolarHBondContact O-N 3.29Å; A289-F315 HydrophobicContact CB-CD2 3.6Å; A289-F315 HydrophobicContact CB-CE2 3.52Å; A289-F315 HydrophobicContact CB-CG 4.44Å; A289-F315 HydrophobicContact CB-CZ 4.29Å
290	K	98.6	Very high	96.3	Very high	32 Å²	32	53.2 Å²	53.2	14%	0.139	31%	0.306	C	S	.	.	H	α-helix	trans	-60	-47	174.9	-70.1	172.6	-171.1	166.4	0	111.3	L281 P282 D283 F285 S286 E287 V293 K294	L281-K290 HydrophobicContact CB-CG 3.99Å; P282-K290 WeakPolarHBondContact O-CE 3.23Å; D283-K290 IonicContact OD1-NZ 3.65Å; F285-K290 WeakPolarHBondContact O-CE 3.46Å; F285-K290 PolarHBondContact O-NZ 3.05Å; S286-K290 PolarHBondContact O-N 3.1Å; E287-K290 PolarHBondContact O-N 3.15Å; E287-K290 WeakPolarHBondContact OE1-CD 3.49Å; E287-K290 IonicContact OE1-NZ 2.73Å; E287-K290 PolarHBondContact OE1-NZ 2.89Å; K290-V293 PolarHBondContact O-N 3.32Å; K290-K294 WeakPolarHBondContact O-CB 3.45Å; K290-K294 PolarHBondContact O-N 3.43Å
291	D	98.3	Very high	96.1	Very high	66 Å²	66	52.3 Å²	52.3	35%	0.353	29%	0.293	S	S	.	.	H	α-helix	trans	-63.5	-43.7	179	-170.4	62	0	0	0	111.7	E287 V293 K294 I295 H313	E287-D291 VanDerWaalsContact O-CB 3.23Å; E287-D291 WeakPolarHBondContact O-CB 3.38Å; E287-D291 PolarHBondContact O-N 3.2Å; D291-V293 VanDerWaalsContact C-N 3.35Å; D291-V293 PolarHBondContact O-N 2.69Å; D291-K294 WeakPolarHBondContact O-CB 3.25Å; D291-K294 PolarHBondContact O-N 3.41Å; D291-K294 VanDerWaalsContact O-N 3.14Å; D291-I295 WeakPolarHBondContact O-CG1 3.33Å; D291-I295 WeakPolarHBondContact O-CG2 3.35Å; D291-I295 PolarHBondContact O-N 2.73Å; D291-H313 IonicContact OD2-CE1 3.84Å; D291-H313 IonicContact OD2-NE2 3.59Å; D291-H313 PolarHBondContact OD2-NE2 3.31Å; D291-H313 VanDerWaalsContact OD2-NE2 3.15Å
292	F	98.6	Very high	95.8	Very high	0 Å²	0	56.2 Å²	56.2	0%	0	32%	0.32	C	S	.	.	H	α-helix	trans	-54.7	-49	176.2	-178.6	-83.5	0	0	0	112.1	T158 L162 V249 N288 A289 I295 C296 L310 H313 F315 I316	T158-F292 HydrophobicContact CG2-CE1 3.69Å; T158-F292 HydrophobicContact CG2-CE2 4.29Å; T158-F292 HydrophobicContact CG2-CZ 3.52Å; L162-F292 HydrophobicContact CD1-CE2 3.94Å; L162-F292 HydrophobicContact CD1-CZ 3.86Å; L162-F292 HydrophobicContact CG-CZ 4.5Å; V249-F292 HydrophobicContact CG1-CD1 4.43Å; V249-F292 HydrophobicContact CG2-CE1 4.04Å; N288-F292 WeakPolarHBondContact O-CB 3.47Å; N288-F292 PolarHBondContact O-N 3.46Å; A289-F292 PolarHBondContact O-N 3.25Å; F292-I295 VanDerWaalsContact O-CG1 3.25Å; F292-I295 WeakPolarHBondContact O-CG1 3.38Å; F292-C296 PolarHBondContact O-N 2.67Å; F292-C296 PolarHBondContact O-SG 2.89Å; F292-L310 HydrophobicContact CD2-CD2 4.03Å; F292-L310 HydrophobicContact CE2-CB 3.93Å; F292-L310 HydrophobicContact CE2-CD1 4.43Å; F292-L310 HydrophobicContact CE2-CD2 3.69Å; F292-L310 HydrophobicContact CE2-CG 4.23Å; F292-L310 HydrophobicContact CZ-CB 4.36Å; F292-L310 HydrophobicContact CZ-CD1 4.2Å; F292-L310 HydrophobicContact CZ-CD2 4.18Å; F292-L310 HydrophobicContact CZ-CG 4.49Å; F292-H313 HydrophobicContact CD2-CB 4Å; F292-H313 AromaticContact CD2-CG 3.82Å; F292-H313 AromaticContact CD2-ND1 3.64Å; F292-H313 HydrophobicContact CE2-CB 4.43Å; F292-F315 HydrophobicContact CB-CB 3.85Å; F292-F315 HydrophobicContact CB-CD1 3.81Å; F292-F315 HydrophobicContact CB-CG 4.01Å; F292-F315 AromaticContact CD1-CD1 3.91Å; F292-F315 HydrophobicContact CD1-CD1 3.91Å; F292-F315 HydrophobicContact CD1-CE1 4.27Å; F292-F315 HydrophobicContact CD2-CB 4.13Å; F292-F315 AromaticContact CD2-CD1 3.77Å; F292-F315 HydrophobicContact CD2-CD1 3.77Å; F292-F315 HydrophobicContact CD2-CG 4.42Å; F292-F315 HydrophobicContact CE1-CD1 4.5Å; F292-F315 HydrophobicContact CE2-CD1 4.32Å; F292-F315 HydrophobicContact CG-CB 4.21Å; F292-F315 AromaticContact CG-CD1 3.54Å; F292-F315 HydrophobicContact CG-CD1 3.54Å; F292-F315 HydrophobicContact CG-CE1 4.34Å; F292-F315 HydrophobicContact CG-CG 4.21Å; F292-I316 HydrophobicContact CD2-CD1 4.45Å; F292-I316 HydrophobicContact CD2-CG1 4.49Å; F292-I316 HydrophobicContact CE2-CD1 3.91Å; F292-I316 HydrophobicContact CE2-CG1 4.07Å; F292-I316 HydrophobicContact CZ-CD1 4.43Å
293	V	98.4	Very high	95.8	Very high	2 Å²	2	57.7 Å²	57.7	1%	0.012	33%	0.328	C	S	.	.	H	α-helix	trans	-65.5	-43.5	178.7	173.2	0	0	0	0	110.5	V249 F250 L281 A289 K290 D291 I295 C296 L297	V249-V293 HydrophobicContact CB-CG2 4.24Å; V249-V293 HydrophobicContact CG1-CG2 3.7Å; F250-V293 HydrophobicContact CB-CG1 4.38Å; F250-V293 HydrophobicContact CD2-CG1 4.26Å; L281-V293 HydrophobicContact CD1-CG2 3.83Å; L281-V293 HydrophobicContact CD2-CG2 4.11Å; L281-V293 HydrophobicContact CG-CB 4.32Å; L281-V293 HydrophobicContact CG-CG2 3.91Å; A289-V293 PolarHBondContact O-N 3.29Å; K290-V293 PolarHBondContact O-N 3.32Å; D291-V293 VanDerWaalsContact C-N 3.35Å; D291-V293 PolarHBondContact O-N 2.69Å; V293-I295 PolarHBondContact O-N 3.41Å; V293-C296 PolarHBondContact O-N 3.15Å; V293-L297 HydrophobicContact CG1-CD1 3.73Å; V293-L297 HydrophobicContact CG1-CG 4.26Å; V293-L297 WeakPolarHBondContact O-CB 3.49Å; V293-L297 WeakPolarHBondContact O-CG 3.44Å; V293-L297 PolarHBondContact O-N 3.5Å
294	K	97.6	Very high	96	Very high	150 Å²	150	50.6 Å²	50.6	65%	0.652	29%	0.29	S	S	*	.	H	α-helix	trans	-57.2	-48.9	178.4	-179.4	-172.8	176.6	-172.2	0	112.1	K290 D291 C296 L297 T298	K290-K294 WeakPolarHBondContact O-CB 3.45Å; K290-K294 PolarHBondContact O-N 3.43Å; D291-K294 WeakPolarHBondContact O-CB 3.25Å; D291-K294 PolarHBondContact O-N 3.41Å; D291-K294 VanDerWaalsContact O-N 3.14Å; K294-C296 VanDerWaalsContact C-N 3.34Å; K294-C296 PolarHBondContact O-N 3.08Å; K294-L297 CarbonylContact O-C 3.49Å; K294-L297 PolarHBondContact O-N 3.37Å; K294-T298 PolarHBondContact O-N 3.01Å; K294-T298 PolarHBondContact O-OG1 2.95Å
295	I	97.6	Very high	96.2	Very high	44 Å²	44	47.6 Å²	47.6	23%	0.226	26%	0.256	C	S	.	.	H	α-helix	trans	-68.2	-34	-178.8	65.7	179.1	0	0	0	111.9	D291 F292 V293 L297 T298 P305 L310	D291-I295 WeakPolarHBondContact O-CG1 3.33Å; D291-I295 WeakPolarHBondContact O-CG2 3.35Å; D291-I295 PolarHBondContact O-N 2.73Å; F292-I295 VanDerWaalsContact O-CG1 3.25Å; F292-I295 WeakPolarHBondContact O-CG1 3.38Å; V293-I295 PolarHBondContact O-N 3.41Å; I295-L297 VanDerWaalsContact C-N 3.35Å; I295-T298 WeakPolarHBondContact O-CB 3.24Å; I295-T298 PolarHBondContact O-N 2.78Å; I295-T298 PolarHBondContact O-OG1 3.24Å; I295-P305 HydrophobicContact CB-CG 4.48Å; I295-P305 HydrophobicContact CD1-CG 4.14Å; I295-P305 HydrophobicContact CG1-CG 4.16Å; I295-L310 HydrophobicContact CD1-CD2 3.67Å; I295-L310 HydrophobicContact CG1-CD2 4.06Å
296	C	97.9	Very high	96.2	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-64.1	-40.3	173.4	-68.1	0	0	0	0	112	I242 F292 V293 K294 T298 R304 L310	I242-C296 HydrophobicContact CG2-CB 4.41Å; F292-C296 PolarHBondContact O-N 2.67Å; F292-C296 PolarHBondContact O-SG 2.89Å; V293-C296 PolarHBondContact O-N 3.15Å; K294-C296 VanDerWaalsContact C-N 3.34Å; K294-C296 PolarHBondContact O-N 3.08Å; C296-T298 PolarHBondContact O-N 3.12Å; C296-R304 VanDerWaalsContact O-CD 3.24Å; C296-R304 WeakPolarHBondContact O-CD 3.39Å; C296-R304 PolarHBondContact O-NE 2.96Å; C296-L310 VanDerWaalsContact SG-CD1 3.53Å
297	L	96.9	Very high	96.2	Very high	9 Å²	9	45.8 Å²	45.8	5%	0.047	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.7	24.6	-178.9	-60.8	-176.1	0	0	0	113.4	W243 P258 M278 V293 K294 I295 S299	W243-L297 HydrophobicContact CD2-CD2 3.99Å; W243-L297 HydrophobicContact CE3-CD2 4.28Å; W243-L297 HydrophobicContact CG-CD2 4.34Å; W243-L297 HydrophobicContact CZ2-CD2 4.4Å; W243-L297 HydrophobicContact CZ3-CB 4.4Å; W243-L297 VanDerWaalsContact CZ3-O 3.25Å; W243-L297 WeakPolarHBondContact CZ3-O 3.46Å; P258-L297 HydrophobicContact CG-CD1 4.23Å; M278-L297 HydrophobicContact CB-CB 3.94Å; M278-L297 HydrophobicContact CB-CD1 3.84Å; M278-L297 HydrophobicContact CE-CD1 4.19Å; M278-L297 HydrophobicContact CG-CB 4.04Å; M278-L297 HydrophobicContact CG-CD1 4.37Å; V293-L297 HydrophobicContact CG1-CD1 3.73Å; V293-L297 HydrophobicContact CG1-CG 4.26Å; V293-L297 WeakPolarHBondContact O-CB 3.49Å; V293-L297 WeakPolarHBondContact O-CG 3.44Å; V293-L297 PolarHBondContact O-N 3.5Å; K294-L297 CarbonylContact O-C 3.49Å; K294-L297 PolarHBondContact O-N 3.37Å; I295-L297 VanDerWaalsContact C-N 3.35Å; L297-S299 PolarHBondContact O-N 3.04Å
298	T	94.6	Very high	96.2	Very high	46 Å²	46	42.5 Å²	42.5	28%	0.282	23%	0.233	S	C	.	.			trans	-72.5	124.1	172.1	-56.3	0	0	0	0	110.3	K294 I295 C296 D300 V303 R304	K294-T298 PolarHBondContact O-N 3.01Å; K294-T298 PolarHBondContact O-OG1 2.95Å; I295-T298 WeakPolarHBondContact O-CB 3.24Å; I295-T298 PolarHBondContact O-N 2.78Å; I295-T298 PolarHBondContact O-OG1 3.24Å; C296-T298 PolarHBondContact O-N 3.12Å; T298-D300 VanDerWaalsContact C-N 3.33Å; T298-D300 PolarHBondContact O-N 3.49Å; T298-V303 HydrophobicContact CG2-CG2 3.6Å; T298-R304 PolarHBondContact O-NE 2.84Å; T298-R304 PolarHBondContact O-NH2 3.11Å
299	S	91.3	Very high	96.2	Very high	34 Å²	34	44.3 Å²	44.3	24%	0.238	24%	0.239	C	C	.	.	S	Bend	trans	-63.6	-34.7	-177.1	-57.8	0	0	0	0	113.5	L297 Q301	L297-S299 PolarHBondContact O-N 3.04Å; S299-Q301 PolarHBondContact O-N 3.27Å
300	D	90.6	Very high	96.2	Very high	72 Å²	72	44.3 Å²	44.3	39%	0.385	24%	0.24	S	C	.	.			trans	-79.3	110.2	173.9	-179.2	-1.3	0	0	0	110.5	T298 S302 V303 R304	T298-D300 VanDerWaalsContact C-N 3.33Å; T298-D300 PolarHBondContact O-N 3.49Å; D300-S302 PolarHBondContact O-N 3.49Å; D300-S302 VanDerWaalsContact OD1-CB 3.31Å; D300-S302 WeakPolarHBondContact OD1-CB 3.45Å; D300-S302 PolarHBondContact OD1-N 3.27Å; D300-S302 PolarHBondContact OD1-OG 2.93Å; D300-S302 PolarHBondContact OD2-OG 2.8Å; D300-V303 HydrophobicContact CB-CG2 3.85Å; D300-V303 VanDerWaalsContact O-CG2 3.3Å; D300-V303 WeakPolarHBondContact O-CG2 3.39Å; D300-R304 PolarHBondContact O-N 3.45Å
301	Q	91.3	Very high	96.2	Very high	68 Å²	68	44.9 Å²	44.9	32%	0.318	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-21.9	179.6	64.2	168.7	-13.6	0	0	113.8	K239 S299	K239-Q301 HydrophobicContact CB-CB 4.03Å; K239-Q301 HydrophobicContact CG-CB 4.46Å; K239-Q301 WeakPolarHBondContact CG-O 3.46Å; K239-Q301 PolarHBondContact NZ-O 3.46Å; S299-Q301 PolarHBondContact O-N 3.27Å
302	S	90.9	Very high	96.1	Very high	82 Å²	82	49.7 Å²	49.7	57%	0.573	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.6	-42.6	-177.2	72.1	0	0	0	0	111	K239 D300	K239-S302 PolarHBondContact NZ-O 3.43Å; K239-S302 VanDerWaalsContact NZ-O 3.16Å; D300-S302 PolarHBondContact O-N 3.49Å; D300-S302 VanDerWaalsContact OD1-CB 3.31Å; D300-S302 WeakPolarHBondContact OD1-CB 3.45Å; D300-S302 PolarHBondContact OD1-N 3.27Å; D300-S302 PolarHBondContact OD1-OG 2.93Å; D300-S302 PolarHBondContact OD2-OG 2.8Å
303	V	94.4	Very high	96.1	Very high	98 Å²	98	51 Å²	51	59%	0.594	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.2	-19	179.2	-60.4	0	0	0	0	113.6	T298 D300	T298-V303 HydrophobicContact CG2-CG2 3.6Å; D300-V303 HydrophobicContact CB-CG2 3.85Å; D300-V303 VanDerWaalsContact O-CG2 3.3Å; D300-V303 WeakPolarHBondContact O-CG2 3.39Å
304	R	96	Very high	96	Very high	1 Å²	1	54.5 Å²	54.5	0%	0.004	29%	0.292	C	S	.	.	S	Bend	trans	-56.1	131.5	175.5	-167.2	-176.1	-57.9	146	6.8	109.8	E229 K239 I242 C296 T298 D300	E229-R304 IonicContact OE1-CZ 2.89Å; E229-R304 IonicContact OE1-NH1 3.33Å; E229-R304 PolarHBondContact OE1-NH1 3.39Å; E229-R304 IonicContact OE1-NH2 2.9Å; E229-R304 IonicContact OE2-CZ 2.8Å; E229-R304 IonicContact OE2-NH1 3.88Å; E229-R304 IonicContact OE2-NH2 3.99Å; E229-R304 PolarHBondContact OE2-NH2 3.33Å; E229-R304 VanDerWaalsContact OE2-NH2 3.11Å; K239-R304 VanDerWaalsContact C-NH1 3.26Å; K239-R304 HydrophobicContact CD-CB 4.42Å; K239-R304 WeakPolarHBondContact CD-O 3.45Å; K239-R304 WeakPolarHBondContact CE-O 3.34Å; K239-R304 PolarHBondContact NZ-O 3.4Å; K239-R304 WeakPolarHBondContact O-CD 3.13Å; K239-R304 PolarHBondContact O-NH1 2.99Å; I242-R304 HydrophobicContact CB-CG 4.4Å; I242-R304 HydrophobicContact CG2-CG 3.97Å; C296-R304 VanDerWaalsContact O-CD 3.24Å; C296-R304 WeakPolarHBondContact O-CD 3.39Å; C296-R304 PolarHBondContact O-NE 2.96Å; T298-R304 PolarHBondContact O-NE 2.84Å; T298-R304 PolarHBondContact O-NH2 3.11Å; D300-R304 PolarHBondContact O-N 3.45Å
305	P	97.7	Very high	96	Very high	17 Å²	17	48 Å²	48	11%	0.11	26%	0.264	C	S	.	.	P	Polyproline II helix	trans	-66.9	161.7	-175.8	27.4	-35.9	0	0	0	112.6	I295 Q309 L310	I295-P305 HydrophobicContact CB-CG 4.48Å; I295-P305 HydrophobicContact CD1-CG 4.14Å; I295-P305 HydrophobicContact CG1-CG 4.16Å; P305-Q309 VanDerWaalsContact CA-OE1 3.32Å; P305-Q309 HydrophobicContact CB-CB 4.02Å; P305-L310 HydrophobicContact CB-CD2 4.08Å; P305-L310 HydrophobicContact CB-CG 4Å; P305-L310 HydrophobicContact CG-CD1 4.15Å; P305-L310 HydrophobicContact CG-CD2 3.45Å; P305-L310 VanDerWaalsContact CG-CD2 3.45Å; P305-L310 HydrophobicContact CG-CG 3.7Å
306	S	98.1	Very high	96	Very high	33 Å²	33	46.1 Å²	46.1	23%	0.231	25%	0.254	C	S	.	.	P	Polyproline II helix	trans	-81.6	166.8	166.8	73.3	0	0	0	0	111.8	D308 Q309 L310	S306-D308 VanDerWaalsContact C-N 3.31Å; S306-D308 PolarHBondContact O-N 3.04Å; S306-Q309 PolarHBondContact O-N 3.22Å; S306-Q309 WeakPolarHBondContact OG-CG 3.39Å; S306-Q309 PolarHBondContact OG-N 3.36Å; S306-L310 WeakPolarHBondContact O-CG 3.45Å; S306-L310 PolarHBondContact O-N 3.46Å
307	A	98	Very high	95.6	Very high	0 Å²	0	48.8 Å²	48.8	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-57.8	-43.4	173.5	0	0	0	0	0	111.9	L162 V165 A166 I242 Q309 L310 L311	L162-A307 HydrophobicContact CD2-CB 4.41Å; V165-A307 HydrophobicContact CB-CB 4.44Å; V165-A307 HydrophobicContact CG1-CB 4.04Å; A166-A307 HydrophobicContact CB-CB 3.86Å; I242-A307 HydrophobicContact CD1-CB 3.92Å; A307-Q309 VanDerWaalsContact C-N 3.29Å; A307-Q309 PolarHBondContact O-N 3.08Å; A307-L310 PolarHBondContact O-N 3.38Å; A307-L311 WeakPolarHBondContact O-CG 3.47Å; A307-L311 PolarHBondContact O-N 2.91Å
308	D	97.6	Very high	94.8	Very high	62 Å²	62	56.7 Å²	56.7	33%	0.332	31%	0.306	S	S	.	.	H	α-helix	trans	-64.4	-31.1	177.6	-53.7	-84.3	0	0	0	113.3	Q170 S306	Q170-D308 PolarHBondContact NE2-OD1 3.36Å; Q170-D308 VanDerWaalsContact NE2-OD1 3.1Å; S306-D308 VanDerWaalsContact C-N 3.31Å; S306-D308 PolarHBondContact O-N 3.04Å
309	Q	98.1	Very high	93.2	Very high	114 Å²	114	57.6 Å²	57.6	53%	0.533	32%	0.324	S	S	.	.	H	α-helix	trans	-73	-42.1	173.4	-73	173.1	-40.8	0	0	110.8	P305 S306 A307 L311 K312	P305-Q309 VanDerWaalsContact CA-OE1 3.32Å; P305-Q309 HydrophobicContact CB-CB 4.02Å; S306-Q309 PolarHBondContact O-N 3.22Å; S306-Q309 WeakPolarHBondContact OG-CG 3.39Å; S306-Q309 PolarHBondContact OG-N 3.36Å; A307-Q309 VanDerWaalsContact C-N 3.29Å; A307-Q309 PolarHBondContact O-N 3.08Å; Q309-L311 VanDerWaalsContact C-N 3.34Å; Q309-L311 PolarHBondContact O-N 3.03Å; Q309-K312 WeakPolarHBondContact O-CB 3.49Å; Q309-K312 PolarHBondContact O-N 3.11Å; Q309-K312 VanDerWaalsContact O-N 3.1Å
310	L	98.3	Very high	90.9	Very high	1 Å²	1	64.6 Å²	64.6	1%	0.005	35%	0.352	C	S	.	.	H	α-helix	trans	-65.7	-33.4	178	-74.5	176.5	0	0	0	113.1	L162 I242 F292 I295 C296 P305 S306 A307 K312 H313 I316	L162-L310 HydrophobicContact CD1-CB 3.8Å; L162-L310 HydrophobicContact CD2-CB 3.87Å; L162-L310 HydrophobicContact CD2-CD1 3.92Å; I242-L310 HydrophobicContact CD1-CD1 4.33Å; I242-L310 HydrophobicContact CG2-CD1 3.52Å; F292-L310 HydrophobicContact CD2-CD2 4.03Å; F292-L310 HydrophobicContact CE2-CB 3.93Å; F292-L310 HydrophobicContact CE2-CD1 4.43Å; F292-L310 HydrophobicContact CE2-CD2 3.69Å; F292-L310 HydrophobicContact CE2-CG 4.23Å; F292-L310 HydrophobicContact CZ-CB 4.36Å; F292-L310 HydrophobicContact CZ-CD1 4.2Å; F292-L310 HydrophobicContact CZ-CD2 4.18Å; F292-L310 HydrophobicContact CZ-CG 4.49Å; I295-L310 HydrophobicContact CD1-CD2 3.67Å; I295-L310 HydrophobicContact CG1-CD2 4.06Å; C296-L310 VanDerWaalsContact SG-CD1 3.53Å; P305-L310 HydrophobicContact CB-CD2 4.08Å; P305-L310 HydrophobicContact CB-CG 4Å; P305-L310 HydrophobicContact CG-CD1 4.15Å; P305-L310 HydrophobicContact CG-CD2 3.45Å; P305-L310 VanDerWaalsContact CG-CD2 3.45Å; P305-L310 HydrophobicContact CG-CG 3.7Å; S306-L310 WeakPolarHBondContact O-CG 3.45Å; S306-L310 PolarHBondContact O-N 3.46Å; A307-L310 PolarHBondContact O-N 3.38Å; L310-K312 PolarHBondContact O-N 3.4Å; L310-K312 VanDerWaalsContact O-N 3.11Å; L310-H313 WeakPolarHBondContact O-CB 3.45Å; L310-H313 PolarHBondContact O-N 3.03Å; L310-I316 VanDerWaalsContact O-CG1 3.27Å; L310-I316 WeakPolarHBondContact O-CG1 3.41Å
311	L	97.6	Very high	88.7	Confident	44 Å²	44	67.4 Å²	67.4	23%	0.23	37%	0.372	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.5	-20.3	172.9	-77.6	169.9	0	0	0	113.1	L162 E163 A166 A307 Q309	L162-L311 HydrophobicContact CB-CD2 3.54Å; L162-L311 HydrophobicContact CB-CG 3.87Å; L162-L311 HydrophobicContact CD1-CD2 4.18Å; L162-L311 HydrophobicContact CD1-CG 4.39Å; E163-L311 HydrophobicContact CG-CD2 4.09Å; A166-L311 HydrophobicContact CB-CD1 4.12Å; A307-L311 WeakPolarHBondContact O-CG 3.47Å; A307-L311 PolarHBondContact O-N 2.91Å; Q309-L311 VanDerWaalsContact C-N 3.34Å; Q309-L311 PolarHBondContact O-N 3.03Å
312	K	97.1	Very high	86.6	Confident	167 Å²	167	67.2 Å²	67.2	73%	0.726	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.4	-3.5	177.7	-59	172	-174.1	177.1	0	113	Q309 L310	Q309-K312 WeakPolarHBondContact O-CB 3.49Å; Q309-K312 PolarHBondContact O-N 3.11Å; Q309-K312 VanDerWaalsContact O-N 3.1Å; L310-K312 PolarHBondContact O-N 3.4Å; L310-K312 VanDerWaalsContact O-N 3.11Å
313	H	98.1	Very high	84.2	Confident	28 Å²	28	71 Å²	71	13%	0.13	38%	0.381	C	S	.	.	S	Bend	trans	-66.2	146.8	-177.9	-168.8	-93.4	0	0	0	111.7	N288 D291 F292 L310 F315 I316	N288-H313 PolarHBondContact O-CE1 2.87Å; N288-H313 VanDerWaalsContact O-CE1 3.31Å; D291-H313 IonicContact OD2-CE1 3.84Å; D291-H313 IonicContact OD2-NE2 3.59Å; D291-H313 PolarHBondContact OD2-NE2 3.31Å; D291-H313 VanDerWaalsContact OD2-NE2 3.15Å; F292-H313 HydrophobicContact CD2-CB 4Å; F292-H313 AromaticContact CD2-CG 3.82Å; F292-H313 AromaticContact CD2-ND1 3.64Å; F292-H313 HydrophobicContact CE2-CB 4.43Å; L310-H313 WeakPolarHBondContact O-CB 3.45Å; L310-H313 PolarHBondContact O-N 3.03Å; H313-F315 VanDerWaalsContact ND1-CB 3.32Å; H313-F315 WeakPolarHBondContact ND1-CB 3.37Å; H313-F315 PolarHBondContact ND1-N 3.37Å; H313-F315 VanDerWaalsContact ND1-N 3.14Å; H313-F315 PolarHBondContact O-N 3.33Å; H313-F315 VanDerWaalsContact O-N 3.14Å; H313-I316 HydrophobicContact CB-CG1 4.38Å; H313-I316 WeakPolarHBondContact O-CB 3.24Å; H313-I316 PolarHBondContact O-N 3.12Å
314	S	97.2	Very high	81.9	Confident	75 Å²	75	70 Å²	70	52%	0.524	38%	0.378	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-20.5	-176.9	-61.7	0	0	0	0	114.8	I316	S314-I316 VanDerWaalsContact C-N 3.26Å
315	F	97.3	Very high	79.4	Confident	12 Å²	12	73.3 Å²	73.3	5%	0.053	40%	0.402	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.7	-30.4	171.1	177.5	-124.6	0	0	0	112.5	E151 L154 A155 T158 V249 N288 A289 F292 H313	E151-F315 HydrophobicContact CG-CE2 4.04Å; L154-F315 HydrophobicContact CB-CZ 4.44Å; L154-F315 HydrophobicContact CD2-CZ 3.86Å; L154-F315 HydrophobicContact CG-CZ 3.88Å; A155-F315 HydrophobicContact CB-CD2 4.4Å; A155-F315 HydrophobicContact CB-CE1 4.45Å; A155-F315 HydrophobicContact CB-CE2 3.81Å; A155-F315 HydrophobicContact CB-CZ 3.84Å; T158-F315 HydrophobicContact CG2-CE1 4.07Å; V249-F315 HydrophobicContact CG1-CE1 4.39Å; N288-F315 HydrophobicContact CB-CB 4.28Å; A289-F315 HydrophobicContact CB-CD2 3.6Å; A289-F315 HydrophobicContact CB-CE2 3.52Å; A289-F315 HydrophobicContact CB-CG 4.44Å; A289-F315 HydrophobicContact CB-CZ 4.29Å; F292-F315 HydrophobicContact CB-CB 3.85Å; F292-F315 HydrophobicContact CB-CD1 3.81Å; F292-F315 HydrophobicContact CB-CG 4.01Å; F292-F315 AromaticContact CD1-CD1 3.91Å; F292-F315 HydrophobicContact CD1-CD1 3.91Å; F292-F315 HydrophobicContact CD1-CE1 4.27Å; F292-F315 HydrophobicContact CD2-CB 4.13Å; F292-F315 AromaticContact CD2-CD1 3.77Å; F292-F315 HydrophobicContact CD2-CD1 3.77Å; F292-F315 HydrophobicContact CD2-CG 4.42Å; F292-F315 HydrophobicContact CE1-CD1 4.5Å; F292-F315 HydrophobicContact CE2-CD1 4.32Å; F292-F315 HydrophobicContact CG-CB 4.21Å; F292-F315 AromaticContact CG-CD1 3.54Å; F292-F315 HydrophobicContact CG-CD1 3.54Å; F292-F315 HydrophobicContact CG-CE1 4.34Å; F292-F315 HydrophobicContact CG-CG 4.21Å; H313-F315 VanDerWaalsContact ND1-CB 3.32Å; H313-F315 WeakPolarHBondContact ND1-CB 3.37Å; H313-F315 PolarHBondContact ND1-N 3.37Å; H313-F315 VanDerWaalsContact ND1-N 3.14Å; H313-F315 PolarHBondContact O-N 3.33Å; H313-F315 VanDerWaalsContact O-N 3.14Å
316	I	96.7	Very high	76.9	Confident	5 Å²	5	80.3 Å²	80.3	3%	0.026	43%	0.431	C	S	.	.	S	Bend	trans	-82.9	128.9	-176	-60.3	-53.4	0	0	0	109.3	T158 H159 L162 F292 L310 H313 S314 K318	T158-I316 HydrophobicContact CG2-CD1 3.79Å; H159-I316 HydrophobicContact CB-CG2 4.09Å; H159-I316 WeakPolarHBondContact CD2-CG2 3.14Å; L162-I316 HydrophobicContact CD1-CD1 3.82Å; L162-I316 HydrophobicContact CD1-CG1 4.08Å; F292-I316 HydrophobicContact CD2-CD1 4.45Å; F292-I316 HydrophobicContact CD2-CG1 4.49Å; F292-I316 HydrophobicContact CE2-CD1 3.91Å; F292-I316 HydrophobicContact CE2-CG1 4.07Å; F292-I316 HydrophobicContact CZ-CD1 4.43Å; L310-I316 VanDerWaalsContact O-CG1 3.27Å; L310-I316 WeakPolarHBondContact O-CG1 3.41Å; H313-I316 HydrophobicContact CB-CG1 4.38Å; H313-I316 WeakPolarHBondContact O-CB 3.24Å; H313-I316 PolarHBondContact O-N 3.12Å; S314-I316 VanDerWaalsContact C-N 3.26Å; I316-K318 PolarHBondContact O-N 3.13Å
317	P	90	Very high	74.5	Confident	57 Å²	57	82.9 Å²	82.9	37%	0.37	44%	0.44	S	S	.	.			trans	-60.2	123.7	-180	-22.9	33.9	0	0	0	111.4	A155 L156 G319	A155-P317 HydrophobicContact CB-CG 4.13Å; L156-P317 HydrophobicContact CD2-CG 4.2Å; P317-G319 PolarHBondContact O-N 3.25Å
318	K	79.8	Confident	72.2	Confident	175 Å²	175	83.8 Å²	83.8	76%	0.761	45%	0.445	S	S	*	.			trans	-79.3	108.5	175.4	-67.4	-179.8	-178.2	177	0	109.6	I316	I316-K318 PolarHBondContact O-N 3.13Å
319	G	60.8	Low	69.9	Low	64 Å²	64	83.4 Å²	83.4	66%	0.66	44%	0.442	S	S	*	.	S	Bend	trans	58.9	97.7	165.5	0	0	0	0	0	115.1	P317	P317-G319 PolarHBondContact O-N 3.25Å
320	H	44.4	Very low	67.4	Low	181 Å²	181	82.2 Å²	82.2	84%	0.838	44%	0.439	S	S	*	.				-164.3	117.7	124.6	-98.9	74.9	0	0	0	104.3	I322	H320-I322 PolarHBondContact O-N 3.27Å
321	T	44.1	Very low	65.3	Low	131 Å²	131	84.3 Å²	84.3	80%	0.804	45%	0.447	S	S	*	.			trans	-36.7	117.4	155.7	-42.2	0	0	0	0	106.4	H323	T321-H323 PolarHBondContact O-N 2.86Å
322	I	46	Very low	63	Low	64 Å²	64	84.3 Å²	84.3	33%	0.328	44%	0.444	S	S	.	.			trans	-58.4	101.1	172.4	-58.7	179.4	0	0	0	104.4	L156 H320 S324	L156-I322 HydrophobicContact CD2-CD1 4.15Å; H320-I322 PolarHBondContact O-N 3.27Å; I322-S324 VanDerWaalsContact C-N 3.26Å; I322-S324 PolarHBondContact O-N 2.8Å
323	H	41.7	Very low	60.8	Low	162 Å²	162	80.5 Å²	80.5	75%	0.75	43%	0.429	S	S	*	.			trans	-55.5	108.2	156.6	-105.5	-75.2	0	0	0	103.7	T321 S325	T321-H323 PolarHBondContact O-N 2.86Å; H323-S325 PolarHBondContact O-N 3.16Å
324	S	45.9	Very low	58.6	Low	76 Å²	76	84.8 Å²	84.8	53%	0.531	45%	0.453	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.1	8.6	-164.8	63.4	0	0	0	0	114.8	I322	I322-S324 VanDerWaalsContact C-N 3.26Å; I322-S324 PolarHBondContact O-N 2.8Å
325	S	43.4	Very low	56.6	Low	72 Å²	72	85.7 Å²	85.7	50%	0.503	45%	0.449	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.4	-15.4	-155.7	46.9	0	0	0	0	116.2	H323	H323-S325 PolarHBondContact O-N 3.16Å
326	K	45.2	Very low	54.2	Low	163 Å²	163	85.4 Å²	85.4	71%	0.709	45%	0.448	S	S	*	.	S	Bend	trans	-137.5	-39.7	-174.6	-69	-172.7	177.6	179	0	118.1	L330	K326-L330 WeakPolarHBondContact O-CD1 3.48Å; K326-L330 WeakPolarHBondContact O-CG 3.25Å
327	M	47.6	Very low	51.7	Low	88 Å²	88	91.2 Å²	91.2	43%	0.433	48%	0.475	S	S	.	.	H	α-helix	trans	-88.3	-32.3	-167.1	-127.9	173.5	74.5	0	0	115.2	R152 L156	R152-M327 PolarHBondContact NH2-SD 2.86Å; L156-M327 HydrophobicContact CD1-CE 4.44Å
328	N	49.1	Very low	49.3	Very low	18 Å²	18	98 Å²	98	10%	0.096	50%	0.495	C	S	.	.	H	α-helix	trans	-83.3	-31.6	177.9	-69.6	-18.6	0	0	0	112.6	Y332	N328-Y332 PolarHBondContact O-N 3.11Å
329	I	49.9	Very low	46.9	Very low	54 Å²	54	95.3 Å²	95.3	28%	0.277	49%	0.493	S	S	.	.	H	α-helix	trans	-62.7	-43.7	175.2	-70.9	174.2	0	0	0	110	Y332 Q333	I329-Y332 PolarHBondContact O-N 3.38Å; I329-Q333 HydrophobicContact CG2-CG 3.94Å; I329-Q333 WeakPolarHBondContact O-CB 3.41Å; I329-Q333 VanDerWaalsContact O-CG 3.23Å; I329-Q333 WeakPolarHBondContact O-CG 3.12Å; I329-Q333 PolarHBondContact O-N 3.33Å
330	L	44.3	Very low	45.7	Very low	90 Å²	90	97.4 Å²	97.4	47%	0.471	50%	0.495	S	S	.	.	H	α-helix	trans	-67.3	-38.7	-178.1	-74.3	169.3	0	0	0	113.7	K326 N334	K326-L330 WeakPolarHBondContact O-CD1 3.48Å; K326-L330 WeakPolarHBondContact O-CG 3.25Å; L330-N334 WeakPolarHBondContact O-CB 3.28Å; L330-N334 PolarHBondContact O-N 3.17Å; L330-N334 PolarHBondContact O-ND2 3.31Å
331	W	55.4	Low	45.1	Very low	45 Å²	45	99.8 Å²	99.8	17%	0.17	51%	0.514	C	S	.	.	H	α-helix	trans	-67.3	-45.5	176.5	-173.1	86.3	0	0	0	111.1	I142 F146 L149 L185 H335	I142-W331 HydrophobicContact CG2-CH2 3.64Å; I142-W331 HydrophobicContact CG2-CZ3 4.29Å; F146-W331 HydrophobicContact CD2-CH2 4.07Å; F146-W331 HydrophobicContact CD2-CZ2 4.49Å; L149-W331 HydrophobicContact CD2-CH2 4.27Å; L149-W331 HydrophobicContact CD2-CZ2 4.2Å; L185-W331 HydrophobicContact CD2-CZ3 4.46Å; W331-H335 AromaticContact CD1-ND1 3.95Å; W331-H335 WeakPolarHBondContact O-CB 3.3Å; W331-H335 PolarHBondContact O-N 2.88Å; W331-H335 PolarHBondContact O-ND1 3.01Å; W331-H335 VanDerWaalsContact O-ND1 3.13Å
332	Y	49.3	Very low	45.1	Very low	44 Å²	44	98.3 Å²	98.3	17%	0.173	50%	0.5	C	S	.	.	I	π-helix	trans	-65.4	-42	176.4	-169.3	-85.4	0	0	0	112.2	G136 L185 P187 N328 I329 C336 E337	G136-Y332 WeakPolarHBondContact CA-OH 3.42Å; L185-Y332 HydrophobicContact CD2-CD2 4.16Å; P187-Y332 HydrophobicContact CB-CD1 4.19Å; P187-Y332 HydrophobicContact CB-CE1 3.98Å; P187-Y332 HydrophobicContact CG-CE1 4.24Å; N328-Y332 PolarHBondContact O-N 3.11Å; I329-Y332 PolarHBondContact O-N 3.38Å; Y332-C336 HydrophobicContact CD1-CB 3.93Å; Y332-C336 HydrophobicContact CD2-CB 3.53Å; Y332-C336 HydrophobicContact CE1-CB 3.97Å; Y332-C336 HydrophobicContact CE2-CB 3.57Å; Y332-C336 HydrophobicContact CG-CB 3.7Å; Y332-C336 CarbonylContact O-C 3.55Å; Y332-C336 WeakPolarHBondContact O-CA 3.04Å; Y332-C336 WeakPolarHBondContact O-CB 3.09Å; Y332-C336 PolarHBondContact O-N 3.22Å; Y332-E337 PolarHBondContact O-N 3.36Å
333	Q	50	Low	45.1	Very low	87 Å²	87	100.1 Å²	100.1	41%	0.407	51%	0.509	S	S	.	.	I	π-helix	trans	-67.2	-44.3	177.2	-76.2	178.3	-27.6	0	0	112	I329 H335	I329-Q333 HydrophobicContact CG2-CG 3.94Å; I329-Q333 WeakPolarHBondContact O-CB 3.41Å; I329-Q333 VanDerWaalsContact O-CG 3.23Å; I329-Q333 WeakPolarHBondContact O-CG 3.12Å; I329-Q333 PolarHBondContact O-N 3.33Å; Q333-H335 VanDerWaalsContact C-N 3.32Å; Q333-H335 PolarHBondContact O-N 2.99Å
334	N	52.9	Low	45.3	Very low	117 Å²	117	96.6 Å²	96.6	63%	0.626	50%	0.495	S	S	*	.	I	π-helix	trans	-75.5	-19.4	-176.3	-67.3	-25.6	0	0	0	113.9	L330	L330-N334 WeakPolarHBondContact O-CB 3.28Å; L330-N334 PolarHBondContact O-N 3.17Å; L330-N334 PolarHBondContact O-ND2 3.31Å
335	H	54.3	Low	45.2	Very low	94 Å²	94	97.8 Å²	97.8	44%	0.435	49%	0.493	S	S	.	.	I	π-helix	trans	-123.4	-38.2	-175.4	-58.6	75.7	0	0	0	112.1	F146 W331 Q333	F146-H335 HydrophobicContact CD1-CB 4.12Å; F146-H335 HydrophobicContact CE1-CB 3.78Å; F146-H335 WeakPolarHBondContact CE1-O 3.15Å; F146-H335 HydrophobicContact CZ-CB 4.08Å; F146-H335 WeakPolarHBondContact CZ-O 3.33Å; W331-H335 AromaticContact CD1-ND1 3.95Å; W331-H335 WeakPolarHBondContact O-CB 3.3Å; W331-H335 PolarHBondContact O-N 2.88Å; W331-H335 PolarHBondContact O-ND1 3.01Å; W331-H335 VanDerWaalsContact O-ND1 3.13Å; Q333-H335 VanDerWaalsContact C-N 3.32Å; Q333-H335 PolarHBondContact O-N 2.99Å
336	C	47.8	Very low	45.4	Very low	7 Å²	7	99.4 Å²	99.4	5%	0.047	49%	0.493	C	S	.	.	I	π-helix	trans	-89.9	-12.3	-172.4	-62.4	0	0	0	0	116.5	R145 F146 Y332 Y338	R145-C336 PolarHBondContact NH1-O 3.11Å; R145-C336 PolarHBondContact NH2-O 3.37Å; R145-C336 PolarHBondContact NH2-SG 2.85Å; F146-C336 WeakPolarHBondContact CE2-SG 3.47Å; F146-C336 HydrophobicContact CZ-CB 4.44Å; Y332-C336 HydrophobicContact CD1-CB 3.93Å; Y332-C336 HydrophobicContact CD2-CB 3.53Å; Y332-C336 HydrophobicContact CE1-CB 3.97Å; Y332-C336 HydrophobicContact CE2-CB 3.57Å; Y332-C336 HydrophobicContact CG-CB 3.7Å; Y332-C336 CarbonylContact O-C 3.55Å; Y332-C336 WeakPolarHBondContact O-CA 3.04Å; Y332-C336 WeakPolarHBondContact O-CB 3.09Å; Y332-C336 PolarHBondContact O-N 3.22Å; C336-Y338 PolarHBondContact O-N 3.02Å
337	E	42.8	Very low	45.4	Very low	127 Å²	127	95.2 Å²	95.2	59%	0.593	48%	0.478	S	S	*	.	S	Bend	trans	-63.8	129.2	174.7	-79.8	-175.1	-176.1	0	0	111.3	Y332 T339	Y332-E337 PolarHBondContact O-N 3.36Å; E337-T339 PolarHBondContact O-N 2.76Å
338	Y	39.7	Very low	45.2	Very low	200 Å²	200	95.7 Å²	95.7	78%	0.784	48%	0.481	S	S	*	.			trans	-69.7	111.7	174.4	-156.5	-91.8	0	0	0	107.3	C336 P340	C336-Y338 PolarHBondContact O-N 3.02Å; Y338-P340 VanDerWaalsContact O-CD 3.24Å; Y338-P340 WeakPolarHBondContact O-CD 3.31Å
339	T	31.2	Very low	44.9	Very low	117 Å²	117	101.7 Å²	101.7	72%	0.718	51%	0.511	S	S	*	.			trans	-72.2	111.5	160.9	49.3	0	0	0	0	106.9	E337 N341	E337-T339 PolarHBondContact O-N 2.76Å; T339-N341 PolarHBondContact O-N 3.21Å
340	P	34.1	Very low	44.5	Very low	109 Å²	109	105.7 Å²	105.7	71%	0.708	53%	0.531	S	S	*	.			trans	-70.9	121.8	171.6	9.5	6	0	0	0	107.3	Y338	Y338-P340 VanDerWaalsContact O-CD 3.24Å; Y338-P340 WeakPolarHBondContact O-CD 3.31Å
341	N	32.3	Very low	44.5	Very low	231 Å²	231	107.1 Å²	107.1	100%	1.235	54%	0.536	S	S	*	.			trans	-92.7	0	158.6	-90.3	-15.1	0	0	0	109.2	T339	T339-N341 PolarHBondContact O-N 3.21Å

Retrieved 341 of 341 residues in 91.5 ms (Link to these results)

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