A0A087X9W9_POEFO Loading...

GIPC PDZ domain containing family, member 1

AlphaFold DB , UniProt , Accession A0A087X9W9, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 335 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	28.6	Very low	37.2	Very low	239 Å²	239	169.6 Å²	169.6	100%	1.177	90%	0.895	S	S	*	*				0	163.2	0	-51.9	-171.7	-159.9	0	0	108.5
2	P	48.6	Very low	37.2	Very low	119 Å²	119	164.3 Å²	164.3	77%	0.773	88%	0.881	S	S	*	*			cis	-113.2	-151.8	-40.4	40.1	-25	0	0	0	107.6
3	L	38.1	Very low	37.5	Very low	174 Å²	174	161.3 Å²	161.3	91%	0.911	88%	0.876	S	S	*	*			cis	-134.1	176.7	-13.8	-98.5	-175.9	0	0	0	106
4	G	35.8	Very low	37.4	Very low	75 Å²	75	161.4 Å²	161.4	77%	0.773	87%	0.874	S	S	*	*			trans	161.6	17.5	165.6	0	0	0	0	0	120.3	G6	G4-G6 PolarHBondContact O-N 2.69Å; G4-G6 VanDerWaalsContact O-N 3.16Å
5	L	37	Very low	37.6	Very low	178 Å²	178	158.1 Å²	158.1	93%	0.932	86%	0.861	S	S	*	*			trans	-77.2	100.7	-171.8	-83.2	156.5	0	0	0	114.2	R7	L5-R7 PolarHBondContact O-N 2.68Å
6	G	36.8	Very low	37.3	Very low	79 Å²	79	158.8 Å²	158.8	81%	0.814	86%	0.857	S	S	*	*			trans	-75.4	104.5	172.4	0	0	0	0	0	113.4	G4	G4-G6 PolarHBondContact O-N 2.69Å; G4-G6 VanDerWaalsContact O-N 3.16Å
7	R	38.5	Very low	37.2	Very low	245 Å²	245	157.9 Å²	157.9	93%	0.925	85%	0.852	S	S	*	*			trans	-70.1	127.3	174.8	-71.1	173.7	167.5	173.4	-6.1	111.9	L5	L5-R7 PolarHBondContact O-N 2.68Å
8	R	39.3	Very low	37.2	Very low	250 Å²	250	159.2 Å²	159.2	94%	0.943	85%	0.851	S	S	*	*			trans	-108	139.4	150.4	-81.8	-174.9	167.7	177.4	-3.2	109.2
9	K	38	Very low	36.9	Very low	205 Å²	205	161.1 Å²	161.1	89%	0.891	86%	0.855	S	S	*	*	P	Polyproline II helix	trans	-83	144.8	-169.8	-65	179.3	177.6	178.6	0	111.3
10	K	32.6	Very low	36.7	Very low	203 Å²	203	158.3 Å²	158.3	88%	0.883	86%	0.855	S	S	*	*	P	Polyproline II helix	trans	-69.3	150.6	156.4	-67	-175	176.1	-174.2	0	109.2
11	A	35.7	Very low	36.7	Very low	99 Å²	99	159.2 Å²	159.2	82%	0.818	85%	0.854	S	S	*	*	P	Polyproline II helix	trans	-100.8	151.8	157.2	0	0	0	0	0	108.9
12	S	37.8	Very low	37.1	Very low	105 Å²	105	153.6 Å²	153.6	73%	0.734	84%	0.835	S	S	*	*			trans	-139	157.8	179.2	-65.2	0	0	0	0	108.3
13	P	41	Very low	36.4	Very low	126 Å²	126	155.8 Å²	155.8	82%	0.818	84%	0.839	S	S	*	*			trans	-85.3	170.6	-148.5	33.3	-36.1	0	0	0	114.1
14	L	35.8	Very low	36.1	Very low	162 Å²	162	159.5 Å²	159.5	85%	0.848	84%	0.841	S	S	*	*			trans	-131.9	115.3	172.1	-79.3	172.6	0	0	0	111.7
15	V	39.8	Very low	35.9	Very low	112 Å²	112	159.2 Å²	159.2	68%	0.679	84%	0.838	S	S	*	*			trans	75.1	113	141.1	-177.2	0	0	0	0	118.1
16	E	33.1	Very low	35.7	Very low	170 Å²	170	154.7 Å²	154.7	79%	0.794	84%	0.835	S	S	*	*			trans	-67.5	154.4	158.8	-56.9	105.7	134.9	0	0	112.6
17	N	35.8	Very low	35.5	Very low	144 Å²	144	159.3 Å²	159.3	77%	0.77	84%	0.84	S	S	*	*			trans	-131.5	100.3	149.1	-67.5	-93.5	0	0	0	104.4
18	E	36.7	Very low	35.2	Very low	180 Å²	180	154.8 Å²	154.8	84%	0.841	83%	0.834	S	S	*	*				69.1	121.2	88.3	-75.2	-154.9	115.9	0	0	113.3
19	E	32.5	Very low	35.1	Very low	195 Å²	195	149.1 Å²	149.1	91%	0.911	83%	0.827	S	S	*	*			trans	-84.1	134.7	-174.8	-63.7	163	107.2	0	0	110.7	E21	E19-E21 PolarHBondContact O-N 3.24Å
20	A	33.4	Very low	34.9	Very low	105 Å²	105	144.8 Å²	144.8	87%	0.868	82%	0.819	S	S	*	*			trans	-99.1	82.9	179.4	0	0	0	0	0	111.6
21	E	36.5	Very low	34.8	Very low	178 Å²	178	138.8 Å²	138.8	83%	0.832	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-67.4	144.5	165.4	-77.6	-150.3	129.7	0	0	111.5	E19	E19-E21 PolarHBondContact O-N 3.24Å
22	P	35.5	Very low	34.7	Very low	121 Å²	121	143.2 Å²	143.2	79%	0.786	82%	0.821	S	S	*	*	P	Polyproline II helix	trans	-76.6	128.7	-175.9	29.8	-34.6	0	0	0	113	R24	P22-R24 PolarHBondContact O-N 2.85Å
23	I	34.7	Very low	34.3	Very low	165 Å²	165	147.4 Å²	147.4	85%	0.846	83%	0.829	S	S	*	*	P	Polyproline II helix	trans	-61.7	122.4	178.8	-66.4	169.6	0	0	0	111.4	G25	I23-G25 PolarHBondContact O-N 3.4Å
24	R	32.6	Very low	33.7	Very low	252 Å²	252	144.4 Å²	144.4	95%	0.951	82%	0.822	S	S	*	*			trans	-71.6	112.3	165.6	-75.8	-179.2	169.6	-177	-2.2	110.3	P22	P22-R24 PolarHBondContact O-N 2.85Å
25	G	32	Very low	33.4	Very low	69 Å²	69	144.9 Å²	144.9	71%	0.711	82%	0.824	S	S	*	*			trans	-134.9	41.5	-177.2	0	0	0	0	0	114.7	I23 L27	I23-G25 PolarHBondContact O-N 3.4Å; G25-L27 PolarHBondContact O-N 3.05Å
26	G	30.8	Very low	32.9	Very low	84 Å²	84	146.9 Å²	146.9	87%	0.866	83%	0.831	S	S	*	*			trans	-79.1	97.9	-178.4	0	0	0	0	0	113.5
27	L	34.5	Very low	32.7	Very low	175 Å²	175	142 Å²	142	92%	0.916	83%	0.827	S	S	*	*			trans	-86.9	136.1	165.1	-83.7	167.6	0	0	0	110.7	G25	G25-L27 PolarHBondContact O-N 3.05Å
28	N	30.3	Very low	32.3	Very low	150 Å²	150	139 Å²	139	80%	0.802	83%	0.829	S	S	*	*			trans	-102.5	112.4	-172.6	179.7	30.1	0	0	0	111.6
29	V	38.7	Very low	31.9	Very low	131 Å²	131	137.6 Å²	137.6	79%	0.794	83%	0.833	S	S	*	*			trans	-142.2	125.1	168.2	-171.4	0	0	0	0	108.9
30	P	34.3	Very low	31.8	Very low	114 Å²	114	133.2 Å²	133.2	74%	0.74	83%	0.829	S	S	*	*			trans	-98.3	149.5	-175.7	36.3	-33.9	0	0	0	114.1
31	G	30.4	Very low	31.6	Very low	77 Å²	77	131.9 Å²	131.9	79%	0.794	83%	0.826	S	S	*	*			trans	96.1	104.7	149.1	0	0	0	0	0	118.1
32	M	33.3	Very low	31.2	Very low	192 Å²	192	133.2 Å²	133.2	95%	0.946	83%	0.832	S	S	*	*				-154.8	148.2	124.8	-151.2	63.4	175	0	0	109.5
33	E	28.4	Very low	31.1	Very low	193 Å²	193	132.1 Å²	132.1	90%	0.902	83%	0.834	S	S	*	*			trans	-96.4	161.4	-175.6	-58	172.5	116.6	0	0	112.4
34	G	29.3	Very low	30.9	Very low	64 Å²	64	129.3 Å²	129.3	66%	0.66	84%	0.835	S	S	*	*			trans	135.7	101	145.6	0	0	0	0	0	118.2
35	L	30	Very low	30.9	Very low	171 Å²	171	120.3 Å²	120.3	90%	0.895	82%	0.821	S	S	*	*			trans	65.8	148.2	144.3	-52.3	169.7	0	0	0	117
36	D	28.9	Very low	31.1	Very low	155 Å²	155	123 Å²	123	83%	0.829	83%	0.828	S	S	*	*			cis	-153.1	172.6	5.2	-153.9	-16.6	0	0	0	110.4
37	G	28	Very low	31.4	Very low	68 Å²	68	126.9 Å²	126.9	70%	0.701	83%	0.83	S	S	*	*			trans	95	81.1	147.6	0	0	0	0	0	120.4
38	G	27.4	Very low	31.8	Very low	79 Å²	79	121.4 Å²	121.4	81%	0.814	82%	0.815	S	S	*	*			trans	91.3	113.7	130.9	0	0	0	0	0	120.4
39	V	29.2	Very low	32.3	Very low	152 Å²	152	122.3 Å²	122.3	92%	0.921	82%	0.819	S	S	*	*			trans	-148.3	129.7	157	-164.1	0	0	0	0	109.7
40	A	29.3	Very low	32.8	Very low	102 Å²	102	121.2 Å²	121.2	84%	0.843	82%	0.815	S	S	*	*			trans	179.9	101.6	141.2	0	0	0	0	0	113
41	G	28.8	Very low	33.5	Very low	77 Å²	77	120.7 Å²	120.7	79%	0.794	81%	0.811	S	S	*	*			trans	81.8	92.3	139.1	0	0	0	0	0	120
42	E	29.4	Very low	34.2	Very low	206 Å²	206	120.7 Å²	120.7	96%	0.963	80%	0.797	S	S	*	*			trans	-146.6	161	130.4	-125.2	169.1	-174.4	0	0	110.2
43	A	32.4	Very low	35.1	Very low	99 Å²	99	115.5 Å²	115.5	82%	0.818	78%	0.778	S	S	*	*			trans	-83.5	131.7	-159.4	0	0	0	0	0	113.9	G45	A43-G45 PolarHBondContact O-N 3.48Å
44	A	31.4	Very low	36.5	Very low	105 Å²	105	111.9 Å²	111.9	87%	0.868	77%	0.765	S	S	*	*			trans	-74.5	92.5	169.8	0	0	0	0	0	110.5
45	G	32.4	Very low	37.7	Very low	64 Å²	64	116.7 Å²	116.7	66%	0.66	78%	0.776	S	S	*	*			trans	-60.8	143.2	159.4	0	0	0	0	0	110.1	A43 D47	A43-G45 PolarHBondContact O-N 3.48Å; G45-D47 VanDerWaalsContact C-N 3.27Å; G45-D47 PolarHBondContact O-N 2.88Å
46	S	37	Very low	38.5	Very low	124 Å²	124	115.9 Å²	115.9	87%	0.867	77%	0.769	S	S	*	*			trans	-76.3	79.3	178.8	57.9	0	0	0	0	110.6	G48	S46-G48 PolarHBondContact O-N 2.69Å
47	D	37	Very low	39.9	Very low	167 Å²	167	114.6 Å²	114.6	89%	0.893	75%	0.752	S	S	*	*			trans	-64.4	106.5	177.7	-128.5	-1.8	0	0	0	109.5	G45	G45-D47 VanDerWaalsContact C-N 3.27Å; G45-D47 PolarHBondContact O-N 2.88Å
48	G	42.6	Very low	41.5	Very low	60 Å²	60	116.6 Å²	116.6	62%	0.619	75%	0.753	S	S	*	*	P	Polyproline II helix	trans	-65.9	146.7	176	0	0	0	0	0	110.5	S46	S46-G48 PolarHBondContact O-N 2.69Å
49	L	39.9	Very low	43.8	Very low	169 Å²	169	121.3 Å²	121.3	89%	0.885	75%	0.746	S	S	*	*	P	Polyproline II helix	trans	-51.5	133.4	177.9	-72	171	0	0	0	110.6
50	P	49.6	Very low	46.5	Very low	108 Å²	108	116.3 Å²	116.3	70%	0.701	71%	0.714	S	S	*	*	P	Polyproline II helix	trans	-58.4	137.4	-177	23.4	-33.7	0	0	0	110.2
51	P	48.5	Very low	49.4	Very low	102 Å²	102	114.2 Å²	114.2	66%	0.662	69%	0.688	S	S	*	*	P	Polyproline II helix	trans	-60.2	135.1	-170.8	23.4	-34	0	0	0	110.7
52	P	44.5	Very low	52.6	Low	78 Å²	78	110.7 Å²	110.7	51%	0.506	65%	0.651	S	S	.	*	P	Polyproline II helix	trans	-60	143.8	-170.2	22	-33.1	0	0	0	111.6	R57	P52-R57 PolarHBondContact O-NE 2.67Å; P52-R57 PolarHBondContact O-NH2 2.93Å
53	P	52.8	Low	55.7	Low	83 Å²	83	104.6 Å²	104.6	54%	0.539	62%	0.623	S	S	.	*	P	Polyproline II helix	trans	-59.5	145.5	-174.9	24.9	-34.6	0	0	0	110.9	N55 M56	P53-N55 PolarHBondContact O-N 2.91Å; P53-M56 HydrophobicContact CG-SD 4.5Å; P53-M56 PolarHBondContact O-N 2.9Å
54	N	57.8	Low	58.8	Low	117 Å²	117	99.9 Å²	99.9	63%	0.626	58%	0.584	S	S	*	*	G	3₁₀ helix	trans	-50.9	-29.4	-172.2	-72.9	-10.7	0	0	0	114.1	M56 R57	N54-M56 PolarHBondContact O-N 3.04Å; N54-M56 VanDerWaalsContact O-N 3.17Å; N54-R57 PolarHBondContact O-N 3.44Å
55	N	54.1	Low	61.9	Low	165 Å²	165	97.3 Å²	97.3	88%	0.882	55%	0.554	S	S	*	*	G	3₁₀ helix	trans	-65.8	-12.5	179.9	-58.6	3.9	0	0	0	114.4	P53	P53-N55 PolarHBondContact O-N 2.91Å
56	M	48.5	Very low	65	Low	153 Å²	153	95 Å²	95	75%	0.754	53%	0.526	S	S	*	.	G	3₁₀ helix	trans	-103	-3.7	177.1	-78.3	178.8	162.4	0	0	114.1	P53 N54	P53-M56 HydrophobicContact CG-SD 4.5Å; P53-M56 PolarHBondContact O-N 2.9Å; N54-M56 PolarHBondContact O-N 3.04Å; N54-M56 VanDerWaalsContact O-N 3.17Å
57	R	56.7	Low	67.9	Low	128 Å²	128	89.1 Å²	89.1	48%	0.483	49%	0.485	S	S	.	.	S	Bend	trans	-83.6	135.4	179.1	-57.6	-176.4	-167.4	-172.1	4.8	109.8	P52 N54 R59	P52-R57 PolarHBondContact O-NE 2.67Å; P52-R57 PolarHBondContact O-NH2 2.93Å; N54-R57 PolarHBondContact O-N 3.44Å; R57-R59 PolarHBondContact O-N 2.79Å
58	P	62	Low	70.6	Confident	111 Å²	111	84 Å²	84	72%	0.721	46%	0.456	S	S	*	.			trans	-54.2	125.6	172.8	-26	35	0	0	0	110.7	L60	P58-L60 HydrophobicContact CB-CD2 4.38Å; P58-L60 PolarHBondContact O-N 2.83Å
59	R	76.2	Confident	73	Confident	178 Å²	178	83.6 Å²	83.6	67%	0.672	45%	0.451	S	S	*	.			trans	-74.9	101	178.7	-56.1	-175.7	90.1	-121.6	-1.5	107.9	R57 I61 E76	R57-R59 PolarHBondContact O-N 2.79Å; R59-I61 PolarHBondContact O-N 2.86Å; R59-E76 IonicContact CZ-OE1 3.15Å; R59-E76 IonicContact CZ-OE2 3.46Å; R59-E76 IonicContact NE-OE2 3.88Å; R59-E76 IonicContact NH1-OE1 3.06Å; R59-E76 PolarHBondContact NH1-OE1 3.19Å; R59-E76 IonicContact NH1-OE2 3.4Å; R59-E76 PolarHBondContact NH1-OE2 3.33Å; R59-E76 IonicContact NH2-OE1 3Å; R59-E76 PolarHBondContact NH2-OE1 3.45Å; R59-E76 IonicContact NH2-OE2 2.74Å; R59-E76 PolarHBondContact NH2-OE2 3.06Å
60	L	85.6	Confident	75.7	Confident	47 Å²	47	76.8 Å²	76.8	25%	0.246	42%	0.418	C	S	.	.			trans	-74.4	112.5	177.1	-52.4	-174.1	0	0	0	108.7	P58 F62 E76 L121 L245 V255	P58-L60 HydrophobicContact CB-CD2 4.38Å; P58-L60 PolarHBondContact O-N 2.83Å; L60-F62 HydrophobicContact CB-CE2 3.7Å; L60-F62 HydrophobicContact CB-CZ 4.23Å; L60-E76 WeakPolarHBondContact O-CA 3.47Å; L60-E76 VanDerWaalsContact O-CB 3.3Å; L60-E76 WeakPolarHBondContact O-CB 3.1Å; L60-L121 HydrophobicContact CD1-CD2 4.06Å; L60-L121 HydrophobicContact CD2-CD2 3.94Å; L60-L245 HydrophobicContact CD1-CD1 3.9Å; L60-L245 HydrophobicContact CD1-CD2 4.21Å; L60-L245 HydrophobicContact CD1-CG 4.44Å; L60-V255 HydrophobicContact CD1-CG2 3.74Å
61	I	91.1	Very high	77.9	Confident	57 Å²	57	77 Å²	77	29%	0.292	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	113.2	-177.6	-54.2	176.1	0	0	0	108.7	R59 R74 I75 E76	R59-I61 PolarHBondContact O-N 2.86Å; I61-R74 HydrophobicContact CG2-CB 4.27Å; I61-I75 WeakPolarHBondContact CA-O 3.4Å; I61-E76 HydrophobicContact CG1-CB 4.15Å; I61-E76 WeakPolarHBondContact CG1-OE2 3.12Å
62	F	94.2	Very high	80.1	Confident	4 Å²	4	75.5 Å²	75.5	2%	0.018	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	153.5	177.1	-59.2	-92.1	0	0	0	110.7	L60 R74 I75 F78 I119 L121 I125 L245	L60-F62 HydrophobicContact CB-CE2 3.7Å; L60-F62 HydrophobicContact CB-CZ 4.23Å; F62-R74 WeakPolarHBondContact O-CA 3.31Å; F62-I75 HydrophobicContact CB-CG1 4.11Å; F62-I75 PolarHBondContact N-O 3.04Å; F62-I75 PolarHBondContact O-N 2.81Å; F62-F78 AromaticContact CD2-CE1 3.74Å; F62-F78 HydrophobicContact CD2-CE1 3.74Å; F62-F78 AromaticContact CD2-CZ 3.46Å; F62-F78 HydrophobicContact CD2-CZ 3.46Å; F62-F78 VanDerWaalsContact CD2-CZ 3.46Å; F62-F78 HydrophobicContact CE2-CE1 4.23Å; F62-F78 HydrophobicContact CE2-CE2 4.46Å; F62-F78 AromaticContact CE2-CZ 3.65Å; F62-F78 HydrophobicContact CE2-CZ 3.65Å; F62-F78 HydrophobicContact CG-CZ 4.24Å; F62-I119 HydrophobicContact CD1-CG2 3.7Å; F62-I119 HydrophobicContact CE1-CB 4.15Å; F62-I119 HydrophobicContact CE1-CG2 3.46Å; F62-I119 VanDerWaalsContact CE1-CG2 3.46Å; F62-I119 HydrophobicContact CZ-CG2 4.29Å; F62-L121 HydrophobicContact CZ-CD2 4.41Å; F62-I125 HydrophobicContact CB-CD1 3.74Å; F62-I125 HydrophobicContact CD1-CD1 4.27Å; F62-I125 HydrophobicContact CG-CD1 4.07Å; F62-L245 HydrophobicContact CE2-CD2 3.67Å; F62-L245 HydrophobicContact CZ-CB 4.08Å; F62-L245 HydrophobicContact CZ-CD2 3.65Å
63	H	95	Very high	82.6	Confident	78 Å²	78	72.3 Å²	72.3	36%	0.361	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	141.1	176.1	-63.9	91.5	0	0	0	109.6	T72 F124 I125	H63-T72 HydrophobicContact CB-CG2 4.06Å; H63-F124 HydrophobicContact CB-CD2 3.72Å; H63-F124 HydrophobicContact CB-CE2 3.59Å; H63-F124 HydrophobicContact CB-CG 4.43Å; H63-F124 HydrophobicContact CB-CZ 4.2Å; H63-I125 PolarHBondContact O-N 2.92Å
64	T	97.4	Very high	84.6	Confident	0 Å²	0	76.2 Å²	76.2	0%	0	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	152.7	-175.6	-177.9	0	0	0	0	112.9	T72 G73 I75 F92 I125	T64-T72 CarbonylContact O-C 3.49Å; T64-T72 WeakPolarHBondContact O-CA 3.18Å; T64-G73 PolarHBondContact N-O 2.85Å; T64-G73 PolarHBondContact O-N 3.4Å; T64-I75 HydrophobicContact CG2-CD1 3.98Å; T64-I75 HydrophobicContact CG2-CG1 4.1Å; T64-I75 HydrophobicContact CG2-CG2 3.94Å; T64-F92 HydrophobicContact CG2-CE2 3.79Å; T64-F92 HydrophobicContact CG2-CZ 4Å; T64-I125 WeakPolarHBondContact CA-O 3.47Å; T64-I125 VanDerWaalsContact CB-O 3.24Å; T64-I125 WeakPolarHBondContact CB-O 3.33Å; T64-I125 PolarHBondContact OG1-O 2.82Å
65	Q	97.7	Very high	86.4	Confident	51 Å²	51	70.9 Å²	70.9	24%	0.238	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	154.9	168.9	-77.8	175.3	4.2	0	0	109.6	S70 T72 F124 I125 F126 A127	Q65-S70 WeakPolarHBondContact CA-OG 3.41Å; Q65-T72 PolarHBondContact NE2-OG1 2.66Å; Q65-F124 HydrophobicContact CB-CE1 3.93Å; Q65-F124 HydrophobicContact CG-CE1 3.71Å; Q65-F124 HydrophobicContact CG-CZ 3.81Å; Q65-I125 PolarHBondContact N-O 3.37Å; Q65-F126 HydrophobicContact CB-CD1 4.04Å; Q65-F126 HydrophobicContact CB-CE1 4.05Å; Q65-F126 CarbonylContact O-C 3.46Å; Q65-F126 WeakPolarHBondContact O-CA 3.48Å; Q65-A127 PolarHBondContact O-N 3.47Å
66	L	97.5	Very high	88.2	Confident	14 Å²	14	65.6 Å²	65.6	7%	0.073	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	134.3	164.3	-53.5	-178.7	0	0	0	109	H68 G69 S70 F92 I94 A127 I129	L66-H68 PolarHBondContact O-N 3.21Å; L66-H68 VanDerWaalsContact O-N 3.14Å; L66-G69 WeakPolarHBondContact O-CA 3.36Å; L66-G69 PolarHBondContact O-N 2.89Å; L66-S70 PolarHBondContact N-OG 2.96Å; L66-F92 HydrophobicContact CD1-CB 4.23Å; L66-F92 HydrophobicContact CD1-CD1 4.41Å; L66-F92 HydrophobicContact CD1-CG 4.14Å; L66-F92 HydrophobicContact CD2-CB 4.27Å; L66-F92 HydrophobicContact CD2-CD2 3.4Å; L66-F92 HydrophobicContact CD2-CE2 3.83Å; L66-F92 HydrophobicContact CD2-CG 3.81Å; L66-F92 HydrophobicContact CG-CB 4.45Å; L66-F92 HydrophobicContact CG-CD1 4.16Å; L66-F92 HydrophobicContact CG-CD2 3.89Å; L66-F92 HydrophobicContact CG-CE1 4.44Å; L66-F92 HydrophobicContact CG-CE2 4.16Å; L66-F92 HydrophobicContact CG-CG 3.89Å; L66-F92 HydrophobicContact CG-CZ 4.44Å; L66-I94 HydrophobicContact CD2-CD1 4.01Å; L66-A127 WeakPolarHBondContact CA-O 3.26Å; L66-A127 HydrophobicContact CD2-CB 4.16Å; L66-I129 HydrophobicContact CD2-CG2 3.97Å
67	A	96.4	Very high	90.2	Very high	2 Å²	2	61.6 Å²	61.6	2%	0.017	33%	0.332	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-25	-171.9	0	0	0	0	0	114.4	G69 A127 H128	A67-G69 VanDerWaalsContact C-N 3.31Å; A67-A127 PolarHBondContact N-O 2.81Å; A67-H128 HydrophobicContact CB-CB 4.48Å; A67-H128 VanDerWaalsContact CB-CE1 3.45Å; A67-H128 WeakPolarHBondContact CB-CE1 3.35Å; A67-H128 WeakPolarHBondContact CB-ND1 3.41Å
68	H	94.3	Very high	91.9	Very high	59 Å²	59	56.3 Å²	56.3	27%	0.273	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.3	-6.5	174.1	62.4	-95.4	0	0	0	114.6	L66 L217	L66-H68 PolarHBondContact O-N 3.21Å; L66-H68 VanDerWaalsContact O-N 3.14Å; H68-L217 HydrophobicContact CB-CB 3.86Å
69	G	94.1	Very high	93.1	Very high	51 Å²	51	53.1 Å²	53.1	53%	0.526	29%	0.293	S	S	.	.			trans	114.4	116.8	180	0	0	0	0	0	113.2	L66 A67	L66-G69 WeakPolarHBondContact O-CA 3.36Å; L66-G69 PolarHBondContact O-N 2.89Å; A67-G69 VanDerWaalsContact C-N 3.31Å
70	S	94.8	Very high	93.7	Very high	27 Å²	27	46.8 Å²	46.8	19%	0.189	27%	0.273	C	S	.	.			trans	-145.5	168.6	170.8	71.6	0	0	0	0	110.6	Q65 L66 F92	Q65-S70 WeakPolarHBondContact CA-OG 3.41Å; L66-S70 PolarHBondContact N-OG 2.96Å; S70-F92 WeakPolarHBondContact OG-CE1 3.41Å
71	P	95.9	Very high	94	Very high	111 Å²	111	45.9 Å²	45.9	72%	0.721	27%	0.269	S	S	*	.	P	Polyproline II helix	trans	-56	158.6	156.7	-21.1	33.9	0	0	0	111.2	G73 F92	P71-G73 PolarHBondContact O-N 2.89Å; P71-F92 WeakPolarHBondContact O-CE1 3.2Å
72	T	96.7	Very high	94	Very high	72 Å²	72	50.9 Å²	50.9	44%	0.442	28%	0.284	S	S	.	.	P	Polyproline II helix	trans	-74.3	116.4	175.1	-56.6	0	0	0	0	111.2	H63 T64 Q65 F124	H63-T72 HydrophobicContact CB-CG2 4.06Å; T64-T72 CarbonylContact O-C 3.49Å; T64-T72 WeakPolarHBondContact O-CA 3.18Å; Q65-T72 PolarHBondContact NE2-OG1 2.66Å; T72-F124 HydrophobicContact CG2-CE2 3.96Å; T72-F124 HydrophobicContact CG2-CZ 3.69Å
73	G	95.1	Very high	94	Very high	10 Å²	10	54.2 Å²	54.2	10%	0.103	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	161.9	165.7	0	0	0	0	0	112	T64 P71	T64-G73 PolarHBondContact N-O 2.85Å; T64-G73 PolarHBondContact O-N 3.4Å; P71-G73 PolarHBondContact O-N 2.89Å
74	R	95.5	Very high	94	Very high	165 Å²	165	50.5 Å²	50.5	62%	0.623	28%	0.283	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-126.2	131.3	172.7	-67.5	175.6	69.6	-146.2	1.6	108.3	I61 F62	I61-R74 HydrophobicContact CG2-CB 4.27Å; F62-R74 WeakPolarHBondContact O-CA 3.31Å
75	I	95.3	Very high	93.9	Very high	5 Å²	5	51 Å²	51	3%	0.026	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	144.7	-175.4	55.8	175.8	0	0	0	110.8	I61 F62 T64 F78 L84 K87 I88 A91 I125	I61-I75 WeakPolarHBondContact CA-O 3.4Å; F62-I75 HydrophobicContact CB-CG1 4.11Å; F62-I75 PolarHBondContact N-O 3.04Å; F62-I75 PolarHBondContact O-N 2.81Å; T64-I75 HydrophobicContact CG2-CD1 3.98Å; T64-I75 HydrophobicContact CG2-CG1 4.1Å; T64-I75 HydrophobicContact CG2-CG2 3.94Å; I75-F78 HydrophobicContact CD1-CE1 4.23Å; I75-F78 HydrophobicContact CG1-CE1 4.26Å; I75-L84 HydrophobicContact CD1-CD1 3.54Å; I75-K87 HydrophobicContact CB-CB 4.19Å; I75-K87 HydrophobicContact CG2-CB 4.1Å; I75-K87 WeakPolarHBondContact CG2-O 2.85Å; I75-I88 HydrophobicContact CD1-CD1 4.3Å; I75-I88 HydrophobicContact CD1-CG1 3.72Å; I75-A91 HydrophobicContact CG2-CB 3.84Å; I75-I125 HydrophobicContact CD1-CD1 4.23Å
76	E	93.4	Very high	93.9	Very high	55 Å²	55	50.1 Å²	50.1	26%	0.257	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.3	164.6	-177.5	60.4	176.9	177.7	0	0	110.1	R59 L60 I61 K87	R59-E76 IonicContact CZ-OE1 3.15Å; R59-E76 IonicContact CZ-OE2 3.46Å; R59-E76 IonicContact NE-OE2 3.88Å; R59-E76 IonicContact NH1-OE1 3.06Å; R59-E76 PolarHBondContact NH1-OE1 3.19Å; R59-E76 IonicContact NH1-OE2 3.4Å; R59-E76 PolarHBondContact NH1-OE2 3.33Å; R59-E76 IonicContact NH2-OE1 3Å; R59-E76 PolarHBondContact NH2-OE1 3.45Å; R59-E76 IonicContact NH2-OE2 2.74Å; R59-E76 PolarHBondContact NH2-OE2 3.06Å; L60-E76 WeakPolarHBondContact O-CA 3.47Å; L60-E76 VanDerWaalsContact O-CB 3.3Å; L60-E76 WeakPolarHBondContact O-CB 3.1Å; I61-E76 HydrophobicContact CG1-CB 4.15Å; I61-E76 WeakPolarHBondContact CG1-OE2 3.12Å; E76-K87 WeakPolarHBondContact O-CD 3.43Å
77	G	89.8	Confident	93.9	Very high	68 Å²	68	52.2 Å²	52.2	70%	0.701	30%	0.295	S	S	*	.			trans	69.8	41.8	170.2	0	0	0	0	0	114.8
78	F	92.1	Very high	93.9	Very high	18 Å²	18	52.1 Å²	52.1	8%	0.079	29%	0.294	C	S	.	.			trans	-113.5	144.8	167	56.3	-92.6	0	0	0	110.3	F62 I75 E83 L84 K87 I119 L245 L247	F62-F78 AromaticContact CD2-CE1 3.74Å; F62-F78 HydrophobicContact CD2-CE1 3.74Å; F62-F78 AromaticContact CD2-CZ 3.46Å; F62-F78 HydrophobicContact CD2-CZ 3.46Å; F62-F78 VanDerWaalsContact CD2-CZ 3.46Å; F62-F78 HydrophobicContact CE2-CE1 4.23Å; F62-F78 HydrophobicContact CE2-CE2 4.46Å; F62-F78 AromaticContact CE2-CZ 3.65Å; F62-F78 HydrophobicContact CE2-CZ 3.65Å; F62-F78 HydrophobicContact CG-CZ 4.24Å; I75-F78 HydrophobicContact CD1-CE1 4.23Å; I75-F78 HydrophobicContact CG1-CE1 4.26Å; F78-E83 HydrophobicContact CB-CB 3.65Å; F78-L84 HydrophobicContact CB-CB 4.44Å; F78-L84 HydrophobicContact CD1-CD1 4.15Å; F78-L84 HydrophobicContact CD2-CB 3.89Å; F78-L84 HydrophobicContact CD2-CD1 4.31Å; F78-L84 HydrophobicContact CE1-CD1 3.85Å; F78-L84 HydrophobicContact CE2-CB 4.3Å; F78-L84 HydrophobicContact CE2-CD1 4.02Å; F78-L84 HydrophobicContact CG-CB 4.07Å; F78-L84 HydrophobicContact CG-CD1 4.37Å; F78-L84 HydrophobicContact CZ-CD1 3.78Å; F78-K87 HydrophobicContact CB-CG 4.48Å; F78-I119 HydrophobicContact CE2-CD1 4.14Å; F78-I119 HydrophobicContact CZ-CD1 4.36Å; F78-L245 HydrophobicContact CD2-CD2 4.48Å; F78-L245 HydrophobicContact CE2-CD2 3.69Å; F78-L245 HydrophobicContact CZ-CD2 4.16Å; F78-L247 HydrophobicContact CD2-CD2 4.36Å; F78-L247 HydrophobicContact CE2-CD1 4.47Å; F78-L247 HydrophobicContact CE2-CD2 4.34Å
79	S	86.8	Confident	94	Very high	44 Å²	44	49.5 Å²	49.5	31%	0.308	28%	0.283	S	S	.	.	S	Bend	trans	-116.6	-3.7	-177.8	69.8	0	0	0	0	113.9	E83 A253	S79-E83 WeakPolarHBondContact CB-OE2 3.45Å; S79-E83 PolarHBondContact N-OE2 3.27Å; S79-E83 VanDerWaalsContact OG-CD 3.3Å; S79-E83 PolarHBondContact OG-OE1 3.32Å; S79-E83 PolarHBondContact OG-OE2 2.92Å; S79-A253 VanDerWaalsContact O-CB 3.24Å; S79-A253 WeakPolarHBondContact O-CB 3.31Å; S79-A253 PolarHBondContact O-N 2.84Å; S79-A253 VanDerWaalsContact O-N 3.14Å
80	N	89.2	Confident	94.2	Very high	44 Å²	44	53.1 Å²	53.1	24%	0.235	29%	0.286	C	S	.	.	S	Bend	trans	-160.7	170.3	-178.7	56.4	73.2	0	0	0	110.3	R82 E83 L84	N80-R82 VanDerWaalsContact C-N 3.31Å; N80-R82 PolarHBondContact O-N 2.91Å; N80-R82 WeakPolarHBondContact OD1-CB 3.46Å; N80-R82 PolarHBondContact OD1-N 2.89Å; N80-E83 PolarHBondContact ND2-OE1 3.19Å; N80-E83 PolarHBondContact O-N 2.77Å; N80-E83 PolarHBondContact OD1-N 3.27Å; N80-L84 PolarHBondContact O-N 3.5Å
81	V	90.9	Very high	94.3	Very high	28 Å²	28	53.8 Å²	53.8	17%	0.17	29%	0.294	C	S	.	.	H	α-helix	trans	-66.3	-30.1	-175	-174.7	0	0	0	0	112.9	L84 Y85 N152 L247	V81-L84 WeakPolarHBondContact O-CB 3.45Å; V81-L84 PolarHBondContact O-N 2.86Å; V81-Y85 HydrophobicContact CG1-CD1 4.43Å; V81-Y85 HydrophobicContact CG1-CD2 4.25Å; V81-Y85 HydrophobicContact CG1-CE1 3.78Å; V81-Y85 HydrophobicContact CG1-CE2 3.58Å; V81-Y85 WeakPolarHBondContact CG1-OH 3.19Å; V81-Y85 PolarHBondContact O-N 3.33Å; V81-N152 VanDerWaalsContact CG1-O 3.27Å; V81-N152 WeakPolarHBondContact CG1-O 3.43Å; V81-L247 HydrophobicContact CG2-CB 4.27Å; V81-L247 HydrophobicContact CG2-CD1 3.85Å
82	R	91.6	Very high	94.3	Very high	162 Å²	162	50.5 Å²	50.5	61%	0.611	27%	0.268	S	S	*	.	H	α-helix	trans	-67.6	-42.8	176.2	-175.8	-174.1	-62	-86.4	-4	111.6	N80 Y85 A86	N80-R82 VanDerWaalsContact C-N 3.31Å; N80-R82 PolarHBondContact O-N 2.91Å; N80-R82 WeakPolarHBondContact OD1-CB 3.46Å; N80-R82 PolarHBondContact OD1-N 2.89Å; R82-Y85 PolarHBondContact O-N 2.98Å; R82-A86 PolarHBondContact O-N 3.39Å
83	E	94.1	Very high	94.3	Very high	74 Å²	74	50.5 Å²	50.5	35%	0.346	28%	0.282	S	S	.	.	H	α-helix	trans	-67.3	-36.5	173.4	-77.7	164.5	-149.8	0	0	112.3	F78 S79 N80 A86 K87	F78-E83 HydrophobicContact CB-CB 3.65Å; S79-E83 WeakPolarHBondContact CB-OE2 3.45Å; S79-E83 PolarHBondContact N-OE2 3.27Å; S79-E83 VanDerWaalsContact OG-CD 3.3Å; S79-E83 PolarHBondContact OG-OE1 3.32Å; S79-E83 PolarHBondContact OG-OE2 2.92Å; N80-E83 PolarHBondContact ND2-OE1 3.19Å; N80-E83 PolarHBondContact O-N 2.77Å; N80-E83 PolarHBondContact OD1-N 3.27Å; E83-A86 WeakPolarHBondContact O-CB 3.3Å; E83-A86 PolarHBondContact O-N 3.37Å; E83-K87 WeakPolarHBondContact O-CG 3.38Å; E83-K87 PolarHBondContact O-N 2.97Å
84	L	95	Very high	94.4	Very high	0 Å²	0	52 Å²	52	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-57.6	-49.1	172.6	170.9	60.5	0	0	0	111.1	I75 F78 N80 V81 A86 K87 I88 L115 I119 I125 L247	I75-L84 HydrophobicContact CD1-CD1 3.54Å; F78-L84 HydrophobicContact CB-CB 4.44Å; F78-L84 HydrophobicContact CD1-CD1 4.15Å; F78-L84 HydrophobicContact CD2-CB 3.89Å; F78-L84 HydrophobicContact CD2-CD1 4.31Å; F78-L84 HydrophobicContact CE1-CD1 3.85Å; F78-L84 HydrophobicContact CE2-CB 4.3Å; F78-L84 HydrophobicContact CE2-CD1 4.02Å; F78-L84 HydrophobicContact CG-CB 4.07Å; F78-L84 HydrophobicContact CG-CD1 4.37Å; F78-L84 HydrophobicContact CZ-CD1 3.78Å; N80-L84 PolarHBondContact O-N 3.5Å; V81-L84 WeakPolarHBondContact O-CB 3.45Å; V81-L84 PolarHBondContact O-N 2.86Å; L84-A86 VanDerWaalsContact C-N 3.33Å; L84-A86 PolarHBondContact O-N 2.91Å; L84-K87 PolarHBondContact O-N 3.06Å; L84-I88 HydrophobicContact CD1-CD1 3.8Å; L84-I88 HydrophobicContact CD1-CG1 4.28Å; L84-I88 HydrophobicContact CG-CD1 3.97Å; L84-I88 WeakPolarHBondContact O-CG1 3.33Å; L84-I88 PolarHBondContact O-N 3.08Å; L84-L115 HydrophobicContact CD2-CD2 3.45Å; L84-L115 VanDerWaalsContact CD2-CD2 3.45Å; L84-I119 HydrophobicContact CD2-CD1 4.08Å; L84-I125 HydrophobicContact CD1-CD1 4.15Å; L84-L247 HydrophobicContact CD2-CD1 4.27Å
85	Y	96.2	Very high	94.5	Very high	10 Å²	10	48 Å²	48	4%	0.039	28%	0.283	C	S	.	.	H	α-helix	trans	-67.7	-31.6	177.9	-60.5	-16.2	0	0	0	112.8	V81 R82 I88 G89 V99 C102 N152 A154	V81-Y85 HydrophobicContact CG1-CD1 4.43Å; V81-Y85 HydrophobicContact CG1-CD2 4.25Å; V81-Y85 HydrophobicContact CG1-CE1 3.78Å; V81-Y85 HydrophobicContact CG1-CE2 3.58Å; V81-Y85 WeakPolarHBondContact CG1-OH 3.19Å; V81-Y85 PolarHBondContact O-N 3.33Å; R82-Y85 PolarHBondContact O-N 2.98Å; Y85-I88 HydrophobicContact CD1-CD1 4.3Å; Y85-G89 PolarHBondContact O-N 2.85Å; Y85-V99 HydrophobicContact CD1-CB 4.49Å; Y85-V99 HydrophobicContact CD1-CG1 3.64Å; Y85-V99 HydrophobicContact CD2-CG1 4.41Å; Y85-V99 HydrophobicContact CE1-CG1 4.07Å; Y85-V99 HydrophobicContact CG-CB 4.24Å; Y85-V99 HydrophobicContact CG-CG1 3.85Å; Y85-C102 HydrophobicContact CE1-CB 4.44Å; Y85-N152 HydrophobicContact CE2-CB 3.87Å; Y85-N152 WeakPolarHBondContact CE2-ND2 3.27Å; Y85-N152 WeakPolarHBondContact CE2-O 3.46Å; Y85-N152 PolarHBondContact OH-O 2.97Å; Y85-A154 HydrophobicContact CD2-CB 3.87Å; Y85-A154 HydrophobicContact CE2-CB 3.92Å
86	A	96.8	Very high	94.4	Very high	34 Å²	34	49.9 Å²	49.9	28%	0.281	30%	0.299	S	S	.	.	H	α-helix	trans	-63.6	-45.8	170.1	0	0	0	0	0	112.1	R82 E83 L84 I88 G89 E90	R82-A86 PolarHBondContact O-N 3.39Å; E83-A86 WeakPolarHBondContact O-CB 3.3Å; E83-A86 PolarHBondContact O-N 3.37Å; L84-A86 VanDerWaalsContact C-N 3.33Å; L84-A86 PolarHBondContact O-N 2.91Å; A86-I88 PolarHBondContact O-N 2.84Å; A86-G89 PolarHBondContact O-N 2.83Å; A86-G89 VanDerWaalsContact O-N 3.16Å; A86-E90 WeakPolarHBondContact O-CG 3.47Å; A86-E90 PolarHBondContact O-N 3.07Å
87	K	97.4	Very high	94.5	Very high	58 Å²	58	49.7 Å²	49.7	25%	0.252	30%	0.304	S	S	.	.	H	α-helix	trans	-67.1	-35.1	178.5	-70	-76.1	164.2	-109.3	0	112.9	I75 E76 F78 E83 L84 E90 A91	I75-K87 HydrophobicContact CB-CB 4.19Å; I75-K87 HydrophobicContact CG2-CB 4.1Å; I75-K87 WeakPolarHBondContact CG2-O 2.85Å; E76-K87 WeakPolarHBondContact O-CD 3.43Å; F78-K87 HydrophobicContact CB-CG 4.48Å; E83-K87 WeakPolarHBondContact O-CG 3.38Å; E83-K87 PolarHBondContact O-N 2.97Å; L84-K87 PolarHBondContact O-N 3.06Å; K87-E90 IonicContact NZ-OE1 2.98Å; K87-E90 PolarHBondContact NZ-OE1 2.9Å; K87-E90 IonicContact NZ-OE2 2.69Å; K87-E90 PolarHBondContact NZ-OE2 3.34Å; K87-A91 VanDerWaalsContact O-CB 3.31Å; K87-A91 WeakPolarHBondContact O-CB 3.41Å; K87-A91 PolarHBondContact O-N 3.45Å
88	I	97.3	Very high	94.7	Very high	0 Å²	0	49.2 Å²	49.2	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-64.2	-44.5	169.9	-70.5	165.5	0	0	0	110.4	I75 L84 Y85 A86 A91 F92 V99 I125 A127	I75-I88 HydrophobicContact CD1-CD1 4.3Å; I75-I88 HydrophobicContact CD1-CG1 3.72Å; L84-I88 HydrophobicContact CD1-CD1 3.8Å; L84-I88 HydrophobicContact CD1-CG1 4.28Å; L84-I88 HydrophobicContact CG-CD1 3.97Å; L84-I88 WeakPolarHBondContact O-CG1 3.33Å; L84-I88 PolarHBondContact O-N 3.08Å; Y85-I88 HydrophobicContact CD1-CD1 4.3Å; A86-I88 PolarHBondContact O-N 2.84Å; I88-A91 PolarHBondContact O-N 3.02Å; I88-F92 HydrophobicContact CG2-CD2 3.99Å; I88-F92 HydrophobicContact CG2-CE2 4.26Å; I88-F92 VanDerWaalsContact O-CD2 3.28Å; I88-F92 WeakPolarHBondContact O-CD2 3.39Å; I88-F92 PolarHBondContact O-N 3.46Å; I88-F92 VanDerWaalsContact O-N 3.16Å; I88-V99 HydrophobicContact CB-CG2 4.45Å; I88-V99 HydrophobicContact CG2-CG2 3.82Å; I88-I125 HydrophobicContact CD1-CG2 4.23Å; I88-A127 HydrophobicContact CD1-CB 4.28Å; I88-A127 HydrophobicContact CG2-CB 3.63Å
89	G	96.8	Very high	95	Very high	3 Å²	3	48.4 Å²	48.4	3%	0.031	28%	0.28	C	S	.	.	H	α-helix	trans	-58.5	-48.9	175.3	0	0	0	0	0	113	Y85 A86 A91 F92 G93 I94	Y85-G89 PolarHBondContact O-N 2.85Å; A86-G89 PolarHBondContact O-N 2.83Å; A86-G89 VanDerWaalsContact O-N 3.16Å; G89-A91 PolarHBondContact O-N 3.11Å; G89-F92 PolarHBondContact O-N 2.77Å; G89-G93 PolarHBondContact O-N 2.64Å; G89-I94 CarbonylContact C-O 3.49Å; G89-I94 VanDerWaalsContact C-O 3.31Å; G89-I94 WeakPolarHBondContact CA-O 3.01Å; G89-I94 PolarHBondContact O-N 2.71Å
90	E	97	Very high	95.4	Very high	127 Å²	127	46.3 Å²	46.3	59%	0.593	27%	0.265	S	S	*	.	H	α-helix	trans	-55.8	-46.3	173.3	-73.1	168.6	-140.8	0	0	112.2	A86 K87 F92	A86-E90 WeakPolarHBondContact O-CG 3.47Å; A86-E90 PolarHBondContact O-N 3.07Å; K87-E90 IonicContact NZ-OE1 2.98Å; K87-E90 PolarHBondContact NZ-OE1 2.9Å; K87-E90 IonicContact NZ-OE2 2.69Å; K87-E90 PolarHBondContact NZ-OE2 3.34Å; E90-F92 VanDerWaalsContact C-N 3.29Å; E90-F92 PolarHBondContact O-N 2.67Å
91	A	97.1	Very high	95.8	Very high	42 Å²	42	44.3 Å²	44.3	35%	0.347	25%	0.254	S	S	.	.	H	α-helix	trans	-67.5	-24.8	-176.8	0	0	0	0	0	114.2	I75 K87 I88 G89	I75-A91 HydrophobicContact CG2-CB 3.84Å; K87-A91 VanDerWaalsContact O-CB 3.31Å; K87-A91 WeakPolarHBondContact O-CB 3.41Å; K87-A91 PolarHBondContact O-N 3.45Å; I88-A91 PolarHBondContact O-N 3.02Å; G89-A91 PolarHBondContact O-N 3.11Å
92	F	97.2	Very high	96	Very high	42 Å²	42	43 Å²	43	18%	0.184	25%	0.246	C	C	.	.	H	α-helix	trans	-112.9	0.5	-179.4	-64.8	-61.3	0	0	0	114.7	T64 L66 S70 P71 I88 G89 E90 I94	T64-F92 HydrophobicContact CG2-CE2 3.79Å; T64-F92 HydrophobicContact CG2-CZ 4Å; L66-F92 HydrophobicContact CD1-CB 4.23Å; L66-F92 HydrophobicContact CD1-CD1 4.41Å; L66-F92 HydrophobicContact CD1-CG 4.14Å; L66-F92 HydrophobicContact CD2-CB 4.27Å; L66-F92 HydrophobicContact CD2-CD2 3.4Å; L66-F92 HydrophobicContact CD2-CE2 3.83Å; L66-F92 HydrophobicContact CD2-CG 3.81Å; L66-F92 HydrophobicContact CG-CB 4.45Å; L66-F92 HydrophobicContact CG-CD1 4.16Å; L66-F92 HydrophobicContact CG-CD2 3.89Å; L66-F92 HydrophobicContact CG-CE1 4.44Å; L66-F92 HydrophobicContact CG-CE2 4.16Å; L66-F92 HydrophobicContact CG-CG 3.89Å; L66-F92 HydrophobicContact CG-CZ 4.44Å; S70-F92 WeakPolarHBondContact OG-CE1 3.41Å; P71-F92 WeakPolarHBondContact O-CE1 3.2Å; I88-F92 HydrophobicContact CG2-CD2 3.99Å; I88-F92 HydrophobicContact CG2-CE2 4.26Å; I88-F92 VanDerWaalsContact O-CD2 3.28Å; I88-F92 WeakPolarHBondContact O-CD2 3.39Å; I88-F92 PolarHBondContact O-N 3.46Å; I88-F92 VanDerWaalsContact O-N 3.16Å; G89-F92 PolarHBondContact O-N 2.77Å; E90-F92 VanDerWaalsContact C-N 3.29Å; E90-F92 PolarHBondContact O-N 2.67Å; F92-I94 VanDerWaalsContact C-N 3.29Å; F92-I94 HydrophobicContact CB-CD1 4.42Å; F92-I94 HydrophobicContact CB-CG1 4.26Å; F92-I94 PolarHBondContact O-N 2.87Å
93	G	96.8	Very high	96.3	Very high	72 Å²	72	35.2 Å²	35.2	74%	0.742	22%	0.217	S	C	*	.	T	Hydrogen-bonded Turn	trans	68.6	25.3	-178.6	0	0	0	0	0	114.1	G89	G89-G93 PolarHBondContact O-N 2.64Å
94	I	96.8	Very high	96.3	Very high	40 Å²	40	32.7 Å²	32.7	21%	0.205	21%	0.206	C	C	.	.			trans	-112.3	150.8	-179.2	65.1	178.1	0	0	0	111.2	L66 G89 F92 A96 V99 I129	L66-I94 HydrophobicContact CD2-CD1 4.01Å; G89-I94 CarbonylContact C-O 3.49Å; G89-I94 VanDerWaalsContact C-O 3.31Å; G89-I94 WeakPolarHBondContact CA-O 3.01Å; G89-I94 PolarHBondContact O-N 2.71Å; F92-I94 VanDerWaalsContact C-N 3.29Å; F92-I94 HydrophobicContact CB-CD1 4.42Å; F92-I94 HydrophobicContact CB-CG1 4.26Å; F92-I94 PolarHBondContact O-N 2.87Å; I94-A96 PolarHBondContact O-N 3.49Å; I94-V99 HydrophobicContact CD1-CG2 4.41Å; I94-I129 HydrophobicContact CD1-CD1 4.42Å; I94-I129 HydrophobicContact CD1-CG2 3.91Å
95	P	96.5	Very high	96.3	Very high	82 Å²	82	36.7 Å²	36.7	53%	0.532	23%	0.227	S	C	.	.			trans	-59.8	139.2	171.4	-20.5	32.3	0	0	0	110.9	S97 E98	P95-S97 PolarHBondContact O-N 3.16Å; P95-E98 HydrophobicContact CB-CG 4.24Å; P95-E98 HydrophobicContact CG-CG 4.28Å; P95-E98 PolarHBondContact O-N 3.5Å
96	A	94.3	Very high	96.3	Very high	44 Å²	44	37.1 Å²	37.1	36%	0.364	23%	0.231	S	C	.	.	G	3₁₀ helix	trans	-58.1	-23.1	176	0	0	0	0	0	112.9	I94 E98 V99	I94-A96 PolarHBondContact O-N 3.49Å; A96-E98 PolarHBondContact O-N 2.88Å; A96-V99 PolarHBondContact O-N 3.06Å
97	S	94.2	Very high	96.1	Very high	51 Å²	51	39.4 Å²	39.4	36%	0.357	24%	0.236	S	C	.	.	G	3₁₀ helix	trans	-63.4	-21.8	172.4	62.9	0	0	0	0	113.6	P95 K130 Y156	P95-S97 PolarHBondContact O-N 3.16Å; S97-K130 WeakPolarHBondContact O-CE 3.43Å; S97-K130 PolarHBondContact O-NZ 2.81Å; S97-Y156 WeakPolarHBondContact CA-OH 3.34Å; S97-Y156 WeakPolarHBondContact CB-OH 3.27Å; S97-Y156 WeakPolarHBondContact O-CE2 3.17Å; S97-Y156 PolarHBondContact O-OH 2.88Å
98	E	95.7	Very high	96	Very high	58 Å²	58	42.5 Å²	42.5	27%	0.271	25%	0.249	S	C	.	.	G	3₁₀ helix	trans	-83.2	-18.3	-176.9	-57.1	-45.5	96.4	0	0	112.3	P95 A96 M100 I129 K130	P95-E98 HydrophobicContact CB-CG 4.24Å; P95-E98 HydrophobicContact CG-CG 4.28Å; P95-E98 PolarHBondContact O-N 3.5Å; A96-E98 PolarHBondContact O-N 2.88Å; E98-M100 PolarHBondContact O-N 3.26Å; E98-I129 CarbonylContact O-C 3.59Å; E98-I129 WeakPolarHBondContact O-CA 3.4Å; E98-I129 VanDerWaalsContact O-CB 3.24Å; E98-I129 WeakPolarHBondContact O-CB 3.33Å; E98-K130 PolarHBondContact O-N 3.04Å; E98-K130 IonicContact OE1-NZ 3.98Å; E98-K130 PolarHBondContact OE1-NZ 2.95Å; E98-K130 IonicContact OE2-NZ 2.73Å
99	V	96.6	Very high	95.9	Very high	1 Å²	1	44.4 Å²	44.4	1%	0.006	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	118.2	171.2	-173.2	0	0	0	0	109.6	Y85 I88 I94 A96 A127 Y156	Y85-V99 HydrophobicContact CD1-CB 4.49Å; Y85-V99 HydrophobicContact CD1-CG1 3.64Å; Y85-V99 HydrophobicContact CD2-CG1 4.41Å; Y85-V99 HydrophobicContact CE1-CG1 4.07Å; Y85-V99 HydrophobicContact CG-CB 4.24Å; Y85-V99 HydrophobicContact CG-CG1 3.85Å; I88-V99 HydrophobicContact CB-CG2 4.45Å; I88-V99 HydrophobicContact CG2-CG2 3.82Å; I94-V99 HydrophobicContact CD1-CG2 4.41Å; A96-V99 PolarHBondContact O-N 3.06Å; V99-A127 HydrophobicContact CG1-CB 4.43Å; V99-Y156 WeakPolarHBondContact O-CD2 3.34Å; V99-Y156 WeakPolarHBondContact O-CE2 3.4Å
100	M	96.1	Very high	95.8	Very high	1 Å²	1	46.4 Å²	46.4	1%	0.005	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85	-57.5	179.2	-58.1	177.1	62.6	0	0	110.6	E98 H128 I129 K130 N152 M179 V214 P216	E98-M100 PolarHBondContact O-N 3.26Å; M100-H128 WeakPolarHBondContact CB-O 3.46Å; M100-H128 PolarHBondContact N-O 3.45Å; M100-I129 VanDerWaalsContact SD-C 3.51Å; M100-K130 HydrophobicContact CG-CG 3.76Å; M100-K130 VanDerWaalsContact SD-CA 3.55Å; M100-K130 HydrophobicContact SD-CB 4.46Å; M100-K130 HydrophobicContact SD-CG 4.17Å; M100-N152 WeakPolarHBondContact O-CB 3.39Å; M100-N152 PolarHBondContact O-ND2 3.36Å; M100-M179 HydrophobicContact CB-CE 4.04Å; M100-M179 HydrophobicContact CE-CB 3.58Å; M100-M179 HydrophobicContact CE-CE 4.01Å; M100-M179 HydrophobicContact CG-CE 3.64Å; M100-M179 HydrophobicContact SD-CE 4.47Å; M100-V214 WeakPolarHBondContact CE-O 3.22Å; M100-P216 HydrophobicContact CE-CB 4.19Å; M100-P216 WeakPolarHBondContact SD-CA 3.15Å; M100-P216 HydrophobicContact SD-CB 3.71Å
101	F	96.7	Very high	95.6	Very high	1 Å²	1	41 Å²	41	0%	0.004	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-159	177.3	-179.9	56.9	-91.8	0	0	0	109.4	T103 V109 M111 L114 H128 N152 F158 P216	F101-T103 HydrophobicContact CD2-CG2 4.44Å; F101-T103 HydrophobicContact CE2-CG2 4.26Å; F101-V109 HydrophobicContact CZ-CG1 4.18Å; F101-V109 HydrophobicContact CZ-CG2 4.5Å; F101-M111 HydrophobicContact CE2-CE 4.33Å; F101-M111 HydrophobicContact CZ-CE 4.17Å; F101-L114 HydrophobicContact CB-CD1 4.13Å; F101-L114 HydrophobicContact CD2-CD1 3.76Å; F101-L114 HydrophobicContact CG-CD1 4.21Å; F101-H128 HydrophobicContact CD1-CB 4.28Å; F101-H128 HydrophobicContact CD2-CB 3.98Å; F101-H128 AromaticContact CD2-CD2 3.62Å; F101-H128 AromaticContact CD2-CG 3.89Å; F101-H128 HydrophobicContact CE1-CB 4Å; F101-H128 HydrophobicContact CE2-CB 3.7Å; F101-H128 AromaticContact CE2-CD2 3.27Å; F101-H128 WeakPolarHBondContact CE2-CD2 3.17Å; F101-H128 AromaticContact CE2-CG 3.31Å; F101-H128 AromaticContact CE2-ND1 3.91Å; F101-H128 AromaticContact CE2-NE2 3.82Å; F101-H128 HydrophobicContact CG-CB 4.26Å; F101-H128 HydrophobicContact CZ-CB 3.69Å; F101-H128 AromaticContact CZ-CG 3.61Å; F101-H128 AromaticContact CZ-ND1 3.99Å; F101-H128 PolarHBondContact O-N 3.22Å; F101-N152 HydrophobicContact CB-CB 4.43Å; F101-F158 HydrophobicContact CB-CE1 3.78Å; F101-F158 HydrophobicContact CB-CE2 4.4Å; F101-F158 HydrophobicContact CB-CZ 3.66Å; F101-F158 HydrophobicContact CD1-CD1 4.19Å; F101-F158 HydrophobicContact CD1-CD2 4.11Å; F101-F158 HydrophobicContact CD1-CE1 4.11Å; F101-F158 HydrophobicContact CD1-CE2 4.01Å; F101-F158 HydrophobicContact CD1-CG 4.2Å; F101-F158 HydrophobicContact CD1-CZ 4.01Å; F101-F158 HydrophobicContact CE1-CD2 4.31Å; F101-F158 HydrophobicContact CE1-CE2 4.44Å; F101-F158 HydrophobicContact CG-CE1 4.18Å; F101-F158 HydrophobicContact CG-CE2 4.07Å; F101-F158 AromaticContact CG-CZ 3.83Å; F101-F158 HydrophobicContact CG-CZ 3.83Å; F101-P216 HydrophobicContact CE1-CB 4.37Å; F101-P216 HydrophobicContact CE1-CG 4.36Å; F101-P216 HydrophobicContact CZ-CB 4.36Å; F101-P216 HydrophobicContact CZ-CG 4.23Å
102	C	96.9	Very high	95.2	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	143.4	175.6	-72.4	0	0	0	0	111.3	Y85 L115 I125 F126	Y85-C102 HydrophobicContact CE1-CB 4.44Å; C102-L115 HydrophobicContact CB-CB 4.24Å; C102-L115 HydrophobicContact CB-CD2 4.14Å; C102-L115 WeakPolarHBondContact O-CB 3.43Å; C102-L115 PolarHBondContact O-N 3.45Å; C102-I125 HydrophobicContact CB-CG2 3.86Å; C102-F126 CarbonylContact C-O 3.51Å; C102-F126 VanDerWaalsContact CA-O 3.25Å; C102-F126 WeakPolarHBondContact CA-O 3.38Å
103	T	96.4	Very high	95.1	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	146.4	168.3	49.3	0	0	0	0	110.3	F101 T106 D110 K113 F126 H128	F101-T103 HydrophobicContact CD2-CG2 4.44Å; F101-T103 HydrophobicContact CE2-CG2 4.26Å; T103-T106 PolarHBondContact OG1-O 3.31Å; T103-D110 WeakPolarHBondContact CG2-O 3.37Å; T103-K113 CarbonylContact C-O 3.4Å; T103-K113 WeakPolarHBondContact CA-O 3.13Å; T103-K113 WeakPolarHBondContact CB-O 3.17Å; T103-F126 PolarHBondContact N-O 2.86Å; T103-F126 PolarHBondContact O-N 2.85Å; T103-H128 PolarHBondContact OG1-NE2 2.91Å
104	L	95.3	Very high	94.9	Very high	21 Å²	21	45.9 Å²	45.9	11%	0.11	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	132.1	-178.9	-58.4	180	0	0	0	110.4	T106 K113 L115 I119 D123 I125	L104-T106 PolarHBondContact O-N 3.4Å; L104-K113 PolarHBondContact N-O 2.82Å; L104-L115 HydrophobicContact CD1-CD1 4.4Å; L104-I119 HydrophobicContact CD2-CG2 4.27Å; L104-D123 HydrophobicContact CD2-CB 4.43Å; L104-I125 HydrophobicContact CD2-CG1 3.95Å
105	N	95.2	Very high	94.7	Very high	83 Å²	83	45 Å²	45	44%	0.444	24%	0.241	S	C	.	.	S	Bend	trans	57.2	21.8	174.9	-55	-46.8	0	0	0	115.3	D123 F124	N105-D123 PolarHBondContact ND2-OD1 3.02Å; N105-F124 PolarHBondContact N-O 2.88Å; N105-F124 PolarHBondContact OD1-N 3Å
106	T	94.9	Very high	94.1	Very high	19 Å²	19	42.4 Å²	42.4	12%	0.117	23%	0.229	C	C	.	.			trans	-155.1	137.2	174.5	-174.9	0	0	0	0	111.4	T103 L104 K108 D110 K113 F126	T103-T106 PolarHBondContact OG1-O 3.31Å; L104-T106 PolarHBondContact O-N 3.4Å; T106-K108 VanDerWaalsContact C-N 3.33Å; T106-K108 PolarHBondContact OG1-N 3.37Å; T106-D110 HydrophobicContact CG2-CB 3.74Å; T106-K113 HydrophobicContact CG2-CB 3.76Å; T106-K113 HydrophobicContact CG2-CD 3.7Å; T106-K113 HydrophobicContact CG2-CG 4.36Å; T106-F126 WeakPolarHBondContact O-CB 3.49Å; T106-F126 WeakPolarHBondContact O-CD2 3.1Å; T106-F126 WeakPolarHBondContact O-CG 3.5Å
107	H	93.8	Very high	93.5	Very high	83 Å²	83	40.5 Å²	40.5	38%	0.384	21%	0.214	S	C	.	.	S	Bend	trans	-84.5	-8.2	171.8	65.3	-96	0	0	0	112.8	F126 H128	H107-F126 HydrophobicContact CB-CD1 3.6Å; H107-F126 HydrophobicContact CB-CE1 3.82Å; H107-F126 HydrophobicContact CB-CG 4.19Å; H107-H128 PolarHBondContact O-CE1 3.48Å
108	K	95.1	Very high	93.1	Very high	122 Å²	122	40.1 Å²	40.1	53%	0.53	21%	0.207	S	C	.	.	S	Bend	trans	-79.3	156.8	-179.1	-64	-168	172.2	-166.7	0	110.5	T106 D110 H128	T106-K108 VanDerWaalsContact C-N 3.33Å; T106-K108 PolarHBondContact OG1-N 3.37Å; K108-D110 HydrophobicContact CB-CB 4.41Å; K108-D110 PolarHBondContact O-N 2.79Å; K108-H128 PolarHBondContact O-CE1 3.11Å; K108-H128 PolarHBondContact O-NE2 2.84Å
109	V	94.6	Very high	92.8	Very high	41 Å²	41	37.3 Å²	37.3	25%	0.248	19%	0.194	C	C	.	.			trans	-73.9	86.6	168.1	-177.3	0	0	0	0	107.2	F101 M111 V176 P216 K218	F101-V109 HydrophobicContact CZ-CG1 4.18Å; F101-V109 HydrophobicContact CZ-CG2 4.5Å; V109-M111 HydrophobicContact CG1-CE 3.83Å; V109-V176 HydrophobicContact CG1-CG1 4.44Å; V109-V176 WeakPolarHBondContact CG1-O 3.33Å; V109-P216 HydrophobicContact CG2-CG 3.81Å; V109-K218 HydrophobicContact CG2-CG 4.41Å
110	D	94.3	Very high	92.5	Very high	44 Å²	44	37.9 Å²	37.9	24%	0.235	20%	0.2	C	C	.	.			trans	-126.4	103.2	-169.7	176.7	-10	0	0	0	107.1	T103 T106 K108 D112 K113 L114	T103-D110 WeakPolarHBondContact CG2-O 3.37Å; T106-D110 HydrophobicContact CG2-CB 3.74Å; K108-D110 HydrophobicContact CB-CB 4.41Å; K108-D110 PolarHBondContact O-N 2.79Å; D110-D112 VanDerWaalsContact C-N 3.34Å; D110-K113 CarbonylContact O-C 3.48Å; D110-K113 PolarHBondContact O-N 2.93Å; D110-K113 WeakPolarHBondContact OD2-CD 3.42Å; D110-L114 PolarHBondContact O-N 2.9Å
111	M	92.4	Very high	92	Very high	15 Å²	15	41.3 Å²	41.3	7%	0.074	22%	0.218	C	C	.	.	G	3₁₀ helix	trans	-81.8	-14.4	-167.3	-69.6	-62.9	176.5	0	0	114	F101 V109 L114 F158 K160 V176 G177	F101-M111 HydrophobicContact CE2-CE 4.33Å; F101-M111 HydrophobicContact CZ-CE 4.17Å; V109-M111 HydrophobicContact CG1-CE 3.83Å; M111-L114 WeakPolarHBondContact O-CB 3.22Å; M111-L114 PolarHBondContact O-N 3.4Å; M111-L114 HydrophobicContact SD-CB 4.4Å; M111-L114 HydrophobicContact SD-CD1 4.23Å; M111-L114 HydrophobicContact SD-CD2 4.12Å; M111-L114 HydrophobicContact SD-CG 4.49Å; M111-F158 HydrophobicContact CE-CD2 3.74Å; M111-F158 HydrophobicContact CE-CE2 3.64Å; M111-F158 HydrophobicContact SD-CD2 4.47Å; M111-F158 HydrophobicContact SD-CE2 3.85Å; M111-K160 HydrophobicContact CB-CG 3.93Å; M111-K160 HydrophobicContact CG-CG 4.15Å; M111-K160 WeakPolarHBondContact CG-O 3.32Å; M111-K160 HydrophobicContact SD-CG 4.22Å; M111-V176 HydrophobicContact CE-CG1 3.8Å; M111-V176 HydrophobicContact CG-CG1 3.46Å; M111-V176 VanDerWaalsContact CG-CG1 3.46Å; M111-G177 VanDerWaalsContact CE-CA 3.42Å
112	D	90.4	Very high	91.5	Very high	130 Å²	130	48 Å²	48	70%	0.695	25%	0.249	S	C	*	.	G	3₁₀ helix	trans	-80.8	-11	171	-52.5	-36.7	0	0	0	110.6	D110 R161	D110-D112 VanDerWaalsContact C-N 3.34Å; D112-R161 IonicContact OD1-NH2 3.35Å
113	K	93.3	Very high	91.2	Very high	98 Å²	98	49.6 Å²	49.6	43%	0.426	26%	0.258	S	S	.	.	G	3₁₀ helix	trans	-113.6	20.2	170.4	-65.2	-173.2	-179.1	172.6	0	113.5	T103 L104 T106 D110	T103-K113 CarbonylContact C-O 3.4Å; T103-K113 WeakPolarHBondContact CA-O 3.13Å; T103-K113 WeakPolarHBondContact CB-O 3.17Å; L104-K113 PolarHBondContact N-O 2.82Å; T106-K113 HydrophobicContact CG2-CB 3.76Å; T106-K113 HydrophobicContact CG2-CD 3.7Å; T106-K113 HydrophobicContact CG2-CG 4.36Å; D110-K113 CarbonylContact O-C 3.48Å; D110-K113 PolarHBondContact O-N 2.93Å; D110-K113 WeakPolarHBondContact OD2-CD 3.42Å
114	L	93.9	Very high	91.1	Very high	30 Å²	30	51.9 Å²	51.9	16%	0.157	27%	0.268	C	S	.	.	B	Isolated β-bridge	trans	-64.7	145.7	172.5	-176.3	66	0	0	0	110.8	F101 D110 M111 G116 T150 F158	F101-L114 HydrophobicContact CB-CD1 4.13Å; F101-L114 HydrophobicContact CD2-CD1 3.76Å; F101-L114 HydrophobicContact CG-CD1 4.21Å; D110-L114 PolarHBondContact O-N 2.9Å; M111-L114 WeakPolarHBondContact O-CB 3.22Å; M111-L114 PolarHBondContact O-N 3.4Å; M111-L114 HydrophobicContact SD-CB 4.4Å; M111-L114 HydrophobicContact SD-CD1 4.23Å; M111-L114 HydrophobicContact SD-CD2 4.12Å; M111-L114 HydrophobicContact SD-CG 4.49Å; L114-G116 PolarHBondContact O-N 2.79Å; L114-T150 HydrophobicContact CD2-CG2 3.87Å; L114-F158 HydrophobicContact CD1-CE2 4.01Å; L114-F158 HydrophobicContact CD1-CZ 3.75Å; L114-F158 HydrophobicContact CD2-CE2 4.01Å; L114-F158 HydrophobicContact CD2-CZ 3.88Å; L114-F158 HydrophobicContact CG-CZ 4.45Å
115	L	92.1	Very high	91.2	Very high	21 Å²	21	50.9 Å²	50.9	11%	0.11	26%	0.263	C	S	.	.			trans	-63.7	95.2	174.1	174.9	57.5	0	0	0	111.8	L84 C102 L104 G117 Q118 I119	L84-L115 HydrophobicContact CD2-CD2 3.45Å; L84-L115 VanDerWaalsContact CD2-CD2 3.45Å; C102-L115 HydrophobicContact CB-CB 4.24Å; C102-L115 HydrophobicContact CB-CD2 4.14Å; C102-L115 WeakPolarHBondContact O-CB 3.43Å; C102-L115 PolarHBondContact O-N 3.45Å; L104-L115 HydrophobicContact CD1-CD1 4.4Å; L115-G117 PolarHBondContact O-N 3.26Å; L115-Q118 WeakPolarHBondContact CD1-O 3.22Å; L115-I119 HydrophobicContact CD1-CD1 3.93Å; L115-I119 HydrophobicContact CD1-CG1 3.51Å
116	G	84.4	Confident	91.3	Very high	27 Å²	27	48 Å²	48	28%	0.278	25%	0.246	S	C	.	.			trans	-92.5	33.7	-177.8	0	0	0	0	0	115.8	L114	L114-G116 PolarHBondContact O-N 2.79Å
117	G	82.3	Confident	91.4	Very high	5 Å²	5	47.1 Å²	47.1	5%	0.052	24%	0.241	C	C	.	.	S	Bend	trans	80.9	13.8	-179.4	0	0	0	0	0	115.6	L115 R246 L247	L115-G117 PolarHBondContact O-N 3.26Å; G117-R246 PolarHBondContact O-NH1 3.21Å; G117-L247 PolarHBondContact O-N 2.73Å; G117-L247 VanDerWaalsContact O-O 3.1Å
118	Q	85.8	Confident	91.6	Very high	42 Å²	42	43.2 Å²	43.2	20%	0.196	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	148.2	170.1	-70.5	-169.3	14.6	0	0	110.7	L115 L245 P259	L115-Q118 WeakPolarHBondContact CD1-O 3.22Å; Q118-L245 WeakPolarHBondContact CA-O 3.45Å; Q118-P259 VanDerWaalsContact OE1-CD 3.24Å
119	I	89	Confident	91.7	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141	113.8	175.2	-48.5	-179.7	0	0	0	108.6	F62 F78 L84 L104 L115 D123 I125 T244 L245 L247	F62-I119 HydrophobicContact CD1-CG2 3.7Å; F62-I119 HydrophobicContact CE1-CB 4.15Å; F62-I119 HydrophobicContact CE1-CG2 3.46Å; F62-I119 VanDerWaalsContact CE1-CG2 3.46Å; F62-I119 HydrophobicContact CZ-CG2 4.29Å; F78-I119 HydrophobicContact CE2-CD1 4.14Å; F78-I119 HydrophobicContact CZ-CD1 4.36Å; L84-I119 HydrophobicContact CD2-CD1 4.08Å; L104-I119 HydrophobicContact CD2-CG2 4.27Å; L115-I119 HydrophobicContact CD1-CD1 3.93Å; L115-I119 HydrophobicContact CD1-CG1 3.51Å; I119-D123 HydrophobicContact CG2-CB 4Å; I119-I125 HydrophobicContact CD1-CD1 4.02Å; I119-I125 HydrophobicContact CG2-CD1 4.19Å; I119-I125 HydrophobicContact CG2-CG1 4.39Å; I119-T244 PolarHBondContact O-OG1 2.89Å; I119-L245 HydrophobicContact CB-CB 4.48Å; I119-L245 PolarHBondContact N-O 2.81Å; I119-L245 PolarHBondContact O-N 2.78Å; I119-L247 HydrophobicContact CD1-CD1 3.87Å; I119-L247 HydrophobicContact CG1-CD1 4.42Å
120	G	88.7	Confident	91.8	Very high	13 Å²	13	38.2 Å²	38.2	13%	0.134	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.8	144.3	173.7	0	0	0	0	0	111.2	E122 D123	G120-E122 PolarHBondContact O-N 2.82Å; G120-D123 WeakPolarHBondContact CA-OD2 3.29Å; G120-D123 PolarHBondContact N-OD2 3.29Å; G120-D123 WeakPolarHBondContact O-CB 3.41Å; G120-D123 PolarHBondContact O-N 2.76Å
121	L	85.9	Confident	91.9	Very high	73 Å²	73	37.2 Å²	37.2	38%	0.382	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-6.7	-170.8	-66.6	175.1	0	0	0	116	L60 F62 G243	L60-L121 HydrophobicContact CD1-CD2 4.06Å; L60-L121 HydrophobicContact CD2-CD2 3.94Å; F62-L121 HydrophobicContact CZ-CD2 4.41Å; L121-G243 WeakPolarHBondContact CG-O 3.12Å; L121-G243 PolarHBondContact N-O 3.4Å
122	E	86.1	Confident	92.1	Very high	141 Å²	141	42.8 Å²	42.8	66%	0.659	22%	0.224	S	C	*	.	T	Hydrogen-bonded Turn	trans	-119.6	5.1	174.5	-66.2	172.3	-154.9	0	0	113	G120 R242	G120-E122 PolarHBondContact O-N 2.82Å; E122-R242 VanDerWaalsContact CD-NH2 3.25Å; E122-R242 IonicContact OE1-CZ 3.66Å; E122-R242 IonicContact OE1-NH1 2.85Å; E122-R242 PolarHBondContact OE1-NH1 2.73Å; E122-R242 IonicContact OE1-NH2 3.79Å; E122-R242 IonicContact OE2-CZ 3.24Å; E122-R242 VanDerWaalsContact OE2-CZ 3.24Å; E122-R242 IonicContact OE2-NH1 2.86Å; E122-R242 PolarHBondContact OE2-NH1 2.86Å; E122-R242 IonicContact OE2-NH2 2.72Å; E122-R242 PolarHBondContact OE2-NH2 3.2Å
123	D	92.4	Very high	92.4	Very high	33 Å²	33	41.8 Å²	41.8	18%	0.176	21%	0.213	C	C	.	.			trans	-68.1	145	-175.7	-75.9	-21.5	0	0	0	112.7	L104 N105 I119 G120	L104-D123 HydrophobicContact CD2-CB 4.43Å; N105-D123 PolarHBondContact ND2-OD1 3.02Å; I119-D123 HydrophobicContact CG2-CB 4Å; G120-D123 WeakPolarHBondContact CA-OD2 3.29Å; G120-D123 PolarHBondContact N-OD2 3.29Å; G120-D123 WeakPolarHBondContact O-CB 3.41Å; G120-D123 PolarHBondContact O-N 2.76Å
124	F	93.9	Very high	92.5	Very high	49 Å²	49	38.3 Å²	38.3	22%	0.215	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	119.3	177	-155.4	-71.9	0	0	0	110.5	H63 Q65 T72 N105 F126	H63-F124 HydrophobicContact CB-CD2 3.72Å; H63-F124 HydrophobicContact CB-CE2 3.59Å; H63-F124 HydrophobicContact CB-CG 4.43Å; H63-F124 HydrophobicContact CB-CZ 4.2Å; Q65-F124 HydrophobicContact CB-CE1 3.93Å; Q65-F124 HydrophobicContact CG-CE1 3.71Å; Q65-F124 HydrophobicContact CG-CZ 3.81Å; T72-F124 HydrophobicContact CG2-CE2 3.96Å; T72-F124 HydrophobicContact CG2-CZ 3.69Å; N105-F124 PolarHBondContact N-O 2.88Å; N105-F124 PolarHBondContact OD1-N 3Å; F124-F126 HydrophobicContact CB-CE2 4.12Å; F124-F126 AromaticContact CD1-CD2 3.91Å; F124-F126 HydrophobicContact CD1-CD2 3.91Å; F124-F126 HydrophobicContact CD1-CE1 4.07Å; F124-F126 AromaticContact CD1-CE2 3.39Å; F124-F126 HydrophobicContact CD1-CE2 3.39Å; F124-F126 HydrophobicContact CD1-CG 4.47Å; F124-F126 AromaticContact CD1-CZ 3.48Å; F124-F126 HydrophobicContact CD1-CZ 3.48Å; F124-F126 VanDerWaalsContact CD1-CZ 3.48Å; F124-F126 AromaticContact CE1-CE1 3.98Å; F124-F126 HydrophobicContact CE1-CE1 3.98Å; F124-F126 HydrophobicContact CE1-CE2 4.14Å; F124-F126 AromaticContact CE1-CZ 3.77Å; F124-F126 HydrophobicContact CE1-CZ 3.77Å; F124-F126 HydrophobicContact CG-CE2 4.06Å; F124-F126 HydrophobicContact CG-CZ 4.29Å
125	I	96.9	Very high	92.7	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	109.9	-170.6	-56.8	172.5	0	0	0	110.2	F62 H63 T64 Q65 I75 L84 I88 C102 L104 I119	F62-I125 HydrophobicContact CB-CD1 3.74Å; F62-I125 HydrophobicContact CD1-CD1 4.27Å; F62-I125 HydrophobicContact CG-CD1 4.07Å; H63-I125 PolarHBondContact O-N 2.92Å; T64-I125 WeakPolarHBondContact CA-O 3.47Å; T64-I125 VanDerWaalsContact CB-O 3.24Å; T64-I125 WeakPolarHBondContact CB-O 3.33Å; T64-I125 PolarHBondContact OG1-O 2.82Å; Q65-I125 PolarHBondContact N-O 3.37Å; I75-I125 HydrophobicContact CD1-CD1 4.23Å; L84-I125 HydrophobicContact CD1-CD1 4.15Å; I88-I125 HydrophobicContact CD1-CG2 4.23Å; C102-I125 HydrophobicContact CB-CG2 3.86Å; L104-I125 HydrophobicContact CD2-CG1 3.95Å; I119-I125 HydrophobicContact CD1-CD1 4.02Å; I119-I125 HydrophobicContact CG2-CD1 4.19Å; I119-I125 HydrophobicContact CG2-CG1 4.39Å
126	F	97.6	Very high	92.9	Very high	23 Å²	23	42.6 Å²	42.6	10%	0.101	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	115.7	175.4	-68.6	-89.9	0	0	0	110.7	Q65 C102 T103 T106 H107 F124	Q65-F126 HydrophobicContact CB-CD1 4.04Å; Q65-F126 HydrophobicContact CB-CE1 4.05Å; Q65-F126 CarbonylContact O-C 3.46Å; Q65-F126 WeakPolarHBondContact O-CA 3.48Å; C102-F126 CarbonylContact C-O 3.51Å; C102-F126 VanDerWaalsContact CA-O 3.25Å; C102-F126 WeakPolarHBondContact CA-O 3.38Å; T103-F126 PolarHBondContact N-O 2.86Å; T103-F126 PolarHBondContact O-N 2.85Å; T106-F126 WeakPolarHBondContact O-CB 3.49Å; T106-F126 WeakPolarHBondContact O-CD2 3.1Å; T106-F126 WeakPolarHBondContact O-CG 3.5Å; H107-F126 HydrophobicContact CB-CD1 3.6Å; H107-F126 HydrophobicContact CB-CE1 3.82Å; H107-F126 HydrophobicContact CB-CG 4.19Å; F124-F126 HydrophobicContact CB-CE2 4.12Å; F124-F126 AromaticContact CD1-CD2 3.91Å; F124-F126 HydrophobicContact CD1-CD2 3.91Å; F124-F126 HydrophobicContact CD1-CE1 4.07Å; F124-F126 AromaticContact CD1-CE2 3.39Å; F124-F126 HydrophobicContact CD1-CE2 3.39Å; F124-F126 HydrophobicContact CD1-CG 4.47Å; F124-F126 AromaticContact CD1-CZ 3.48Å; F124-F126 HydrophobicContact CD1-CZ 3.48Å; F124-F126 VanDerWaalsContact CD1-CZ 3.48Å; F124-F126 AromaticContact CE1-CE1 3.98Å; F124-F126 HydrophobicContact CE1-CE1 3.98Å; F124-F126 HydrophobicContact CE1-CE2 4.14Å; F124-F126 AromaticContact CE1-CZ 3.77Å; F124-F126 HydrophobicContact CE1-CZ 3.77Å; F124-F126 HydrophobicContact CG-CE2 4.06Å; F124-F126 HydrophobicContact CG-CZ 4.29Å
127	A	97.6	Very high	93.4	Very high	0 Å²	0	47 Å²	47	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89	115.5	-178.6	0	0	0	0	0	110.9	Q65 L66 A67 I88 V99	Q65-A127 PolarHBondContact O-N 3.47Å; L66-A127 WeakPolarHBondContact CA-O 3.26Å; L66-A127 HydrophobicContact CD2-CB 4.16Å; A67-A127 PolarHBondContact N-O 2.81Å; I88-A127 HydrophobicContact CD1-CB 4.28Å; I88-A127 HydrophobicContact CG2-CB 3.63Å; V99-A127 HydrophobicContact CG1-CB 4.43Å
128	H	97.8	Very high	94.1	Very high	1 Å²	1	47 Å²	47	1%	0.005	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83	128.8	172.3	-66.5	-93.3	0	0	0	108.5	A67 M100 F101 T103 H107 K108 P216	A67-H128 HydrophobicContact CB-CB 4.48Å; A67-H128 VanDerWaalsContact CB-CE1 3.45Å; A67-H128 WeakPolarHBondContact CB-CE1 3.35Å; A67-H128 WeakPolarHBondContact CB-ND1 3.41Å; M100-H128 WeakPolarHBondContact CB-O 3.46Å; M100-H128 PolarHBondContact N-O 3.45Å; F101-H128 HydrophobicContact CD1-CB 4.28Å; F101-H128 HydrophobicContact CD2-CB 3.98Å; F101-H128 AromaticContact CD2-CD2 3.62Å; F101-H128 AromaticContact CD2-CG 3.89Å; F101-H128 HydrophobicContact CE1-CB 4Å; F101-H128 HydrophobicContact CE2-CB 3.7Å; F101-H128 AromaticContact CE2-CD2 3.27Å; F101-H128 WeakPolarHBondContact CE2-CD2 3.17Å; F101-H128 AromaticContact CE2-CG 3.31Å; F101-H128 AromaticContact CE2-ND1 3.91Å; F101-H128 AromaticContact CE2-NE2 3.82Å; F101-H128 HydrophobicContact CG-CB 4.26Å; F101-H128 HydrophobicContact CZ-CB 3.69Å; F101-H128 AromaticContact CZ-CG 3.61Å; F101-H128 AromaticContact CZ-ND1 3.99Å; F101-H128 PolarHBondContact O-N 3.22Å; T103-H128 PolarHBondContact OG1-NE2 2.91Å; H107-H128 PolarHBondContact O-CE1 3.48Å; K108-H128 PolarHBondContact O-CE1 3.11Å; K108-H128 PolarHBondContact O-NE2 2.84Å; H128-P216 HydrophobicContact CB-CB 4.07Å
129	I	97.1	Very high	94.5	Very high	17 Å²	17	50.2 Å²	50.2	9%	0.087	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	156.8	-178.2	76	161.1	0	0	0	112.1	L66 I94 E98 M100 G131 P216 L217	L66-I129 HydrophobicContact CD2-CG2 3.97Å; I94-I129 HydrophobicContact CD1-CD1 4.42Å; I94-I129 HydrophobicContact CD1-CG2 3.91Å; E98-I129 CarbonylContact O-C 3.59Å; E98-I129 WeakPolarHBondContact O-CA 3.4Å; E98-I129 VanDerWaalsContact O-CB 3.24Å; E98-I129 WeakPolarHBondContact O-CB 3.33Å; M100-I129 VanDerWaalsContact SD-C 3.51Å; I129-G131 PolarHBondContact O-N 2.85Å; I129-P216 WeakPolarHBondContact O-CA 3.48Å; I129-L217 HydrophobicContact CD1-CD1 4.11Å; I129-L217 HydrophobicContact CG1-CB 4.41Å; I129-L217 HydrophobicContact CG1-CD1 3.98Å; I129-L217 HydrophobicContact CG1-CG 4.46Å; I129-L217 PolarHBondContact O-N 3.04Å
130	K	97.1	Very high	94.8	Very high	40 Å²	40	50.3 Å²	50.3	17%	0.174	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-55.2	130.1	-177.4	-68.6	-178.5	-164.9	147.5	0	112.7	S97 E98 M100 Y156 M179 V214	S97-K130 WeakPolarHBondContact O-CE 3.43Å; S97-K130 PolarHBondContact O-NZ 2.81Å; E98-K130 PolarHBondContact O-N 3.04Å; E98-K130 IonicContact OE1-NZ 3.98Å; E98-K130 PolarHBondContact OE1-NZ 2.95Å; E98-K130 IonicContact OE2-NZ 2.73Å; M100-K130 HydrophobicContact CG-CG 3.76Å; M100-K130 VanDerWaalsContact SD-CA 3.55Å; M100-K130 HydrophobicContact SD-CB 4.46Å; M100-K130 HydrophobicContact SD-CG 4.17Å; K130-Y156 PolarHBondContact NZ-OH 2.69Å; K130-M179 HydrophobicContact CG-CE 4.18Å; K130-V214 HydrophobicContact CB-CG1 3.9Å; K130-V214 HydrophobicContact CD-CG1 4.5Å; K130-V214 HydrophobicContact CG-CG1 4.01Å
131	G	95.8	Very high	94.8	Very high	23 Å²	23	51.6 Å²	51.6	24%	0.237	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	-126	174.2	0	0	0	0	0	111.9	I129 K133 E215 L217	I129-G131 PolarHBondContact O-N 2.85Å; G131-K133 PolarHBondContact O-N 3.46Å; G131-E215 CarbonylContact C-O 3.48Å; G131-E215 WeakPolarHBondContact CA-O 3.46Å; G131-E215 PolarHBondContact N-O 2.89Å; G131-L217 VanDerWaalsContact CA-CD2 3.45Å
132	Q	95.3	Very high	95	Very high	132 Å²	132	53.6 Å²	53.6	62%	0.617	26%	0.264	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-68.4	127	-170.5	-176.1	55.7	47.8	0	0	111.9	K134 E215	Q132-K134 HydrophobicContact CG-CG 4.33Å; Q132-E215 PolarHBondContact O-N 3.39Å
133	K	96.8	Very high	94.9	Very high	109 Å²	109	51.9 Å²	51.9	47%	0.474	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	138.2	168	-65.3	-153.9	166.6	-161.7	0	111	G131 E181 L213 V214	G131-K133 PolarHBondContact O-N 3.46Å; K133-E181 IonicContact NZ-OE1 2.67Å; K133-E181 PolarHBondContact NZ-OE1 3.15Å; K133-E181 IonicContact NZ-OE2 2.69Å; K133-E181 PolarHBondContact NZ-OE2 2.74Å; K133-L213 WeakPolarHBondContact CA-O 3.48Å; K133-V214 HydrophobicContact CG-CG2 4.21Å
134	K	96.4	Very high	94.7	Very high	26 Å²	26	53.2 Å²	53.2	11%	0.113	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	142.6	-178.4	-57.8	179.5	-65.6	-169.9	0	108.9	Q132 I136 V173 D178 K212 L213 E215	Q132-K134 HydrophobicContact CG-CG 4.33Å; K134-I136 HydrophobicContact CB-CD1 3.93Å; K134-V173 HydrophobicContact CD-CG1 3.95Å; K134-V173 PolarHBondContact NZ-O 2.88Å; K134-D178 WeakPolarHBondContact CE-OD1 3.34Å; K134-D178 WeakPolarHBondContact CE-OD2 3.4Å; K134-D178 IonicContact NZ-OD1 3.97Å; K134-D178 PolarHBondContact NZ-OD1 2.99Å; K134-D178 IonicContact NZ-OD2 2.71Å; K134-D178 PolarHBondContact NZ-OD2 3Å; K134-K212 CarbonylContact O-C 3.59Å; K134-K212 WeakPolarHBondContact O-CA 3.19Å; K134-L213 HydrophobicContact CB-CB 4.36Å; K134-L213 PolarHBondContact N-O 2.72Å; K134-L213 PolarHBondContact O-N 2.98Å; K134-E215 WeakPolarHBondContact CE-OE2 3.24Å; K134-E215 IonicContact NZ-OE2 3.67Å; K134-E215 PolarHBondContact NZ-OE2 3.14Å
135	E	97.1	Very high	94.6	Very high	117 Å²	117	51.3 Å²	51.3	55%	0.547	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	122	178.2	-178.2	158.1	-176.4	0	0	108.2	I210 I211 K212	E135-I210 HydrophobicContact CG-CG2 3.81Å; E135-I211 WeakPolarHBondContact CA-O 3.33Å; E135-K212 HydrophobicContact CB-CG 4.42Å; E135-K212 HydrophobicContact CG-CG 4.04Å; E135-K212 WeakPolarHBondContact OE1-CE 3.38Å; E135-K212 IonicContact OE1-NZ 2.69Å; E135-K212 PolarHBondContact OE1-NZ 3.21Å; E135-K212 IonicContact OE2-NZ 2.68Å; E135-K212 PolarHBondContact OE2-NZ 2.88Å
136	I	96.4	Very high	94.4	Very high	23 Å²	23	51.9 Å²	51.9	12%	0.118	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	132.4	-169.6	-49.7	91.5	0	0	0	108.8	K134 I138 I171 V173 I174 I210 I211 L213	K134-I136 HydrophobicContact CB-CD1 3.93Å; I136-I138 HydrophobicContact CB-CG1 4.36Å; I136-I138 HydrophobicContact CG2-CD1 4.32Å; I136-I138 HydrophobicContact CG2-CG1 3.82Å; I136-I171 HydrophobicContact CG2-CG2 4.23Å; I136-V173 HydrophobicContact CD1-CG1 4.46Å; I136-V173 HydrophobicContact CG1-CG1 4.18Å; I136-I174 HydrophobicContact CD1-CG1 4.23Å; I136-I174 HydrophobicContact CG1-CG1 4.41Å; I136-I210 WeakPolarHBondContact O-CA 3.45Å; I136-I211 HydrophobicContact CB-CG2 4.19Å; I136-I211 HydrophobicContact CD1-CG2 4.3Å; I136-I211 PolarHBondContact N-O 2.9Å; I136-I211 PolarHBondContact O-N 2.91Å; I136-L213 HydrophobicContact CD1-CD1 3.87Å; I136-L213 HydrophobicContact CD1-CG 4.21Å
137	E	96.4	Very high	94.2	Very high	121 Å²	121	52 Å²	52	57%	0.565	28%	0.275	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93.6	130.5	168.1	-158.5	-170.4	-174.6	0	0	109.5	M208 F209 I210	E137-M208 HydrophobicContact CB-CE 4.25Å; E137-M208 HydrophobicContact CG-CB 3.97Å; E137-M208 HydrophobicContact CG-CE 3.67Å; E137-M208 HydrophobicContact CG-CG 4.48Å; E137-M208 WeakPolarHBondContact OE1-CB 3.47Å; E137-M208 WeakPolarHBondContact OE1-CG 3.47Å; E137-F209 CarbonylContact C-O 3.57Å; E137-F209 WeakPolarHBondContact CA-O 3.4Å; E137-I210 HydrophobicContact CB-CG1 4.38Å; E137-I210 HydrophobicContact CG-CG1 4Å
138	I	95.4	Very high	94.1	Very high	4 Å²	4	52.6 Å²	52.6	2%	0.021	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	131.7	-169.1	-54.1	-179.5	0	0	0	109.8	I136 I167 I168 I171 I174 M208 F209 I211	I136-I138 HydrophobicContact CB-CG1 4.36Å; I136-I138 HydrophobicContact CG2-CD1 4.32Å; I136-I138 HydrophobicContact CG2-CG1 3.82Å; I138-I167 HydrophobicContact CG2-CG2 4.31Å; I138-I168 HydrophobicContact CD1-CD1 3.72Å; I138-I168 HydrophobicContact CG2-CD1 4.05Å; I138-I171 HydrophobicContact CD1-CD1 4.24Å; I138-I171 HydrophobicContact CG1-CD1 4.06Å; I138-I171 HydrophobicContact CG2-CD1 3.95Å; I138-I174 HydrophobicContact CD1-CD1 3.59Å; I138-M208 CarbonylContact O-C 3.03Å; I138-M208 VanDerWaalsContact O-CA 3.3Å; I138-M208 WeakPolarHBondContact O-CA 3.49Å; I138-F209 HydrophobicContact CB-CD1 4.15Å; I138-F209 HydrophobicContact CB-CE1 3.64Å; I138-F209 HydrophobicContact CB-CE2 4.19Å; I138-F209 HydrophobicContact CB-CZ 3.67Å; I138-F209 HydrophobicContact CD1-CE2 4.12Å; I138-F209 HydrophobicContact CD1-CZ 3.97Å; I138-F209 HydrophobicContact CG1-CZ 4.34Å; I138-F209 HydrophobicContact CG2-CD1 4.5Å; I138-F209 HydrophobicContact CG2-CE1 3.62Å; I138-F209 HydrophobicContact CG2-CZ 3.73Å; I138-F209 PolarHBondContact N-O 3.36Å; I138-F209 WeakPolarHBondContact O-CD1 3.39Å; I138-F209 PolarHBondContact O-N 2.8Å; I138-I211 HydrophobicContact CD1-CG2 3.57Å; I138-I211 HydrophobicContact CG1-CG2 4.37Å
139	F	94.9	Very high	94	Very high	110 Å²	110	52.7 Å²	52.7	48%	0.482	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	119.5	172.8	-176	-108	0	0	0	111	G141 G206 M208	F139-G141 PolarHBondContact O-N 2.8Å; F139-G206 VanDerWaalsContact CE2-C 3.5Å; F139-M208 HydrophobicContact CB-CE 4.33Å; F139-M208 HydrophobicContact CB-SD 3.64Å; F139-M208 HydrophobicContact CD2-SD 3.74Å; F139-M208 HydrophobicContact CG-SD 4.18Å
140	K	94.8	Very high	93.9	Very high	1 Å²	1	52.1 Å²	52.1	0%	0.004	28%	0.276	C	S	.	.			trans	-82	83.9	173.5	-173	168.7	176.4	-178.3	0	110.8	E142 D143 L145 L200 K201 L203 K205 G206 K207 F209	K140-E142 WeakPolarHBondContact CE-O 3.47Å; K140-E142 VanDerWaalsContact CG-O 3.22Å; K140-E142 WeakPolarHBondContact CG-O 3.41Å; K140-D143 WeakPolarHBondContact CE-O 3.25Å; K140-L145 HydrophobicContact CG-CD2 4.14Å; K140-L200 PolarHBondContact NZ-O 3.16Å; K140-K201 PolarHBondContact NZ-O 3.33Å; K140-L203 HydrophobicContact CD-CB 3.65Å; K140-L203 WeakPolarHBondContact CD-O 3.19Å; K140-L203 WeakPolarHBondContact CE-O 3.48Å; K140-L203 PolarHBondContact NZ-O 2.97Å; K140-K205 CarbonylContact O-C 3.57Å; K140-K205 WeakPolarHBondContact O-CA 3.36Å; K140-G206 PolarHBondContact O-N 2.72Å; K140-K207 PolarHBondContact N-O 2.78Å; K140-F209 HydrophobicContact CB-CD1 4.16Å; K140-F209 HydrophobicContact CB-CE1 4.1Å
141	G	90.1	Very high	93.8	Very high	40 Å²	40	50.9 Å²	50.9	41%	0.412	27%	0.272	S	S	.	.			trans	-71.9	-36.4	175.5	0	0	0	0	0	114.1	F139	F139-G141 PolarHBondContact O-N 2.8Å
142	E	88.9	Confident	93.5	Very high	116 Å²	116	50.2 Å²	50.2	54%	0.542	26%	0.263	S	S	.	.	S	Bend	trans	-117	170.2	-173.3	-67.3	177.5	-158.7	0	0	112.2	K140 I167	K140-E142 WeakPolarHBondContact CE-O 3.47Å; K140-E142 VanDerWaalsContact CG-O 3.22Å; K140-E142 WeakPolarHBondContact CG-O 3.41Å; E142-I167 HydrophobicContact CB-CD1 3.98Å; E142-I167 HydrophobicContact CG-CD1 4.14Å
143	D	85.2	Confident	93	Very high	105 Å²	105	46 Å²	46	56%	0.561	25%	0.254	S	S	*	.	S	Bend	trans	-64.1	-48.2	171.3	-65	-75.4	0	0	0	111.7	K140 K205	K140-D143 WeakPolarHBondContact CE-O 3.25Å; D143-K205 VanDerWaalsContact OD1-CD 3.29Å; D143-K205 WeakPolarHBondContact OD1-CD 3.48Å; D143-K205 VanDerWaalsContact OD1-CE 3.22Å; D143-K205 WeakPolarHBondContact OD1-CE 3.32Å; D143-K205 IonicContact OD1-NZ 2.64Å; D143-K205 PolarHBondContact OD1-NZ 2.61Å; D143-K205 WeakPolarHBondContact OD2-CE 3.45Å; D143-K205 IonicContact OD2-NZ 2.96Å; D143-K205 PolarHBondContact OD2-NZ 3.39Å
144	A	87.3	Confident	92.6	Very high	60 Å²	60	42 Å²	42	50%	0.496	24%	0.242	S	C	.	.			trans	-99.4	126.5	-177.8	0	0	0	0	0	110.5	G146	A144-G146 PolarHBondContact O-N 2.91Å
145	L	91.4	Very high	92.2	Very high	9 Å²	9	41.1 Å²	41.1	5%	0.047	24%	0.24	C	C	.	.			trans	-78.1	-11.1	175	-65.3	170.6	0	0	0	112.9	K140 L147 I168 L200 F209	K140-L145 HydrophobicContact CG-CD2 4.14Å; L145-L147 HydrophobicContact CB-CG 4.46Å; L145-I168 HydrophobicContact CB-CG1 3.99Å; L145-I168 VanDerWaalsContact O-CG1 3.29Å; L145-I168 WeakPolarHBondContact O-CG1 3.42Å; L145-L200 HydrophobicContact CD1-CB 4.25Å; L145-L200 HydrophobicContact CD1-CD2 3.7Å; L145-F209 HydrophobicContact CD1-CE1 4.17Å; L145-F209 HydrophobicContact CD1-CE2 4.47Å; L145-F209 HydrophobicContact CD1-CZ 3.63Å; L145-F209 HydrophobicContact CD2-CE1 4Å; L145-F209 HydrophobicContact CD2-CZ 4.11Å
146	G	92.7	Very high	92.1	Very high	13 Å²	13	36.9 Å²	36.9	13%	0.134	22%	0.219	C	C	.	.	S	Bend	trans	76.7	31.5	-173.5	0	0	0	0	0	113.8	A144 I162 R163	A144-G146 PolarHBondContact O-N 2.91Å; G146-I162 CarbonylContact O-C 3.58Å; G146-I162 WeakPolarHBondContact O-CA 3.31Å; G146-R163 PolarHBondContact O-N 2.93Å
147	L	94.7	Very high	92.1	Very high	26 Å²	26	35.8 Å²	35.8	14%	0.136	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	138.2	175.1	-71.3	177.1	0	0	0	110.8	L145 I149 I159 I162 I168 L200	L145-L147 HydrophobicContact CB-CG 4.46Å; L147-I149 HydrophobicContact CB-CD1 3.99Å; L147-I149 HydrophobicContact CD1-CD1 4.4Å; L147-I159 HydrophobicContact CD2-CD1 3.78Å; L147-I159 HydrophobicContact CD2-CG1 4.07Å; L147-I159 HydrophobicContact CD2-CG2 3.87Å; L147-I162 HydrophobicContact CD2-CG1 4.04Å; L147-I168 HydrophobicContact CD1-CG1 4.2Å; L147-I168 HydrophobicContact CD2-CB 4.23Å; L147-I168 HydrophobicContact CD2-CG1 4.28Å; L147-I168 HydrophobicContact CD2-CG2 3.85Å; L147-I168 HydrophobicContact CG-CB 4.44Å; L147-I168 HydrophobicContact CG-CG1 4Å; L147-I168 HydrophobicContact CG-CG2 4.48Å; L147-L200 HydrophobicContact CD1-CD1 4.2Å
148	T	95.3	Very high	92.1	Very high	12 Å²	12	30.1 Å²	30.1	7%	0.074	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	122.2	161.6	-48.2	0	0	0	0	109	K160 R161 E275 G279 R281	T148-K160 PolarHBondContact O-N 3.28Å; T148-R161 PolarHBondContact N-O 3.24Å; T148-R161 PolarHBondContact O-N 3.48Å; T148-E275 VanDerWaalsContact CB-OE1 3.27Å; T148-E275 WeakPolarHBondContact CB-OE1 3.34Å; T148-E275 HydrophobicContact CG2-CB 4.47Å; T148-E275 HydrophobicContact CG2-CG 3.93Å; T148-E275 WeakPolarHBondContact CG2-OE1 3.3Å; T148-E275 PolarHBondContact OG1-OE1 3.19Å; T148-G279 WeakPolarHBondContact CA-O 3.43Å; T148-R281 HydrophobicContact CG2-CB 4.06Å; T148-R281 HydrophobicContact CG2-CG 3.76Å
149	I	95.8	Very high	92.2	Very high	2 Å²	2	30 Å²	30	1%	0.01	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	144.2	-178	-49.7	-54.7	0	0	0	110.4	L147 A157 I159 I180 H193 V196 A197 L200 G279 I280 R281	L147-I149 HydrophobicContact CB-CD1 3.99Å; L147-I149 HydrophobicContact CD1-CD1 4.4Å; I149-A157 HydrophobicContact CG2-CB 3.98Å; I149-I159 HydrophobicContact CD1-CG1 4.35Å; I149-I180 HydrophobicContact CD1-CD1 3.73Å; I149-H193 HydrophobicContact CB-CB 4.41Å; I149-H193 HydrophobicContact CG2-CB 3.86Å; I149-V196 HydrophobicContact CG2-CB 4.42Å; I149-V196 HydrophobicContact CG2-CG1 4.35Å; I149-A197 HydrophobicContact CB-CB 4.48Å; I149-A197 HydrophobicContact CG1-CB 4.29Å; I149-L200 HydrophobicContact CD1-CD1 4.02Å; I149-L200 HydrophobicContact CG1-CD1 4.09Å; I149-G279 PolarHBondContact N-O 2.71Å; I149-I280 CarbonylContact O-C 3.31Å; I149-I280 WeakPolarHBondContact O-CA 3.49Å; I149-R281 PolarHBondContact O-N 3.46Å
150	T	94.8	Very high	92.3	Very high	6 Å²	6	25.4 Å²	25.4	4%	0.037	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	173.7	167	-165.4	0	0	0	0	108.8	L114 A157 F158 K160 R281	L114-T150 HydrophobicContact CD2-CG2 3.87Å; T150-A157 CarbonylContact O-C 3.58Å; T150-A157 VanDerWaalsContact O-CA 3.25Å; T150-A157 WeakPolarHBondContact O-CA 3.22Å; T150-F158 HydrophobicContact CG2-CD1 4.39Å; T150-F158 HydrophobicContact CG2-CD2 3.72Å; T150-F158 HydrophobicContact CG2-CE1 3.99Å; T150-F158 HydrophobicContact CG2-CE2 3.26Å; T150-F158 HydrophobicContact CG2-CG 4.26Å; T150-F158 HydrophobicContact CG2-CZ 3.42Å; T150-F158 VanDerWaalsContact CG2-CZ 3.42Å; T150-F158 PolarHBondContact N-O 3.16Å; T150-F158 PolarHBondContact O-N 3.34Å; T150-K160 HydrophobicContact CG2-CB 3.7Å; T150-K160 HydrophobicContact CG2-CD 4.29Å; T150-K160 HydrophobicContact CG2-CG 4.05Å; T150-R281 WeakPolarHBondContact CB-O 3.28Å; T150-R281 PolarHBondContact OG1-O 3Å
151	D	93.8	Very high	92.3	Very high	14 Å²	14	29.6 Å²	29.6	8%	0.075	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	168.9	172.9	75.8	55.8	0	0	0	112.6	G153 Y156 A157 R192 H193	D151-G153 WeakPolarHBondContact OD1-CA 3.22Å; D151-G153 PolarHBondContact OD1-N 3.37Å; D151-Y156 VanDerWaalsContact CA-O 3.3Å; D151-Y156 WeakPolarHBondContact CA-O 3.29Å; D151-Y156 WeakPolarHBondContact CB-O 3.35Å; D151-A157 HydrophobicContact CB-CB 4.22Å; D151-R192 VanDerWaalsContact CG-NE 3.35Å; D151-R192 IonicContact OD1-CZ 2.82Å; D151-R192 IonicContact OD1-NE 3.31Å; D151-R192 PolarHBondContact OD1-NE 3.27Å; D151-R192 IonicContact OD1-NH2 3.8Å; D151-R192 PolarHBondContact OD1-NH2 2.7Å; D151-R192 WeakPolarHBondContact OD2-CA 3.34Å; D151-R192 IonicContact OD2-CZ 2.67Å; D151-R192 IonicContact OD2-NE 2.76Å; D151-R192 PolarHBondContact OD2-NE 2.81Å; D151-R192 IonicContact OD2-NH2 2.73Å; D151-R192 PolarHBondContact OD2-NH2 3.18Å; D151-R192 VanDerWaalsContact OD2-NH2 3.15Å; D151-H193 HydrophobicContact CB-CB 4.18Å; D151-H193 VanDerWaalsContact CG-CD2 3.5Å; D151-H193 IonicContact OD2-CD2 3.46Å; D151-H193 PolarHBondContact OD2-CD2 3.21Å; D151-H193 IonicContact OD2-CG 3.22Å; D151-H193 PolarHBondContact OD2-N 2.82Å; D151-H193 IonicContact OD2-NE2 3.18Å
152	N	90.1	Very high	92.6	Very high	9 Å²	9	29.5 Å²	29.5	5%	0.048	17%	0.172	C	C	.	.			trans	-90.8	12.5	-173	74.3	-15.8	0	0	0	114.3	V81 Y85 M100 F101 A154 G155 Y156 F158	V81-N152 VanDerWaalsContact CG1-O 3.27Å; V81-N152 WeakPolarHBondContact CG1-O 3.43Å; Y85-N152 HydrophobicContact CE2-CB 3.87Å; Y85-N152 WeakPolarHBondContact CE2-ND2 3.27Å; Y85-N152 WeakPolarHBondContact CE2-O 3.46Å; Y85-N152 PolarHBondContact OH-O 2.97Å; M100-N152 WeakPolarHBondContact O-CB 3.39Å; M100-N152 PolarHBondContact O-ND2 3.36Å; F101-N152 HydrophobicContact CB-CB 4.43Å; N152-A154 PolarHBondContact O-N 3.12Å; N152-A154 WeakPolarHBondContact OD1-CA 3.32Å; N152-A154 PolarHBondContact OD1-N 2.98Å; N152-G155 PolarHBondContact OD1-N 2.94Å; N152-Y156 PolarHBondContact N-O 2.98Å; N152-Y156 VanDerWaalsContact N-O 3.11Å; N152-Y156 VanDerWaalsContact ND2-CD2 3.33Å; N152-Y156 WeakPolarHBondContact ND2-CD2 3.42Å; N152-Y156 PolarHBondContact OD1-N 3.38Å; N152-Y156 PolarHBondContact OD1-O 3.5Å; N152-F158 HydrophobicContact CB-CE1 4.07Å
153	G	85.7	Confident	92.8	Very high	43 Å²	43	32.7 Å²	32.7	44%	0.443	18%	0.179	S	C	.	.	S	Bend	trans	65.1	1.4	-173.3	0	0	0	0	0	115.2	D151	D151-G153 WeakPolarHBondContact OD1-CA 3.22Å; D151-G153 PolarHBondContact OD1-N 3.37Å
154	A	87.8	Confident	93.2	Very high	26 Å²	26	35.5 Å²	35.5	22%	0.215	19%	0.188	C	C	.	.	S	Bend	trans	-126.8	7.4	-174.8	0	0	0	0	0	113.7	Y85 N152	Y85-A154 HydrophobicContact CD2-CB 3.87Å; Y85-A154 HydrophobicContact CE2-CB 3.92Å; N152-A154 PolarHBondContact O-N 3.12Å; N152-A154 WeakPolarHBondContact OD1-CA 3.32Å; N152-A154 PolarHBondContact OD1-N 2.98Å
155	G	87.8	Confident	93.4	Very high	7 Å²	7	35 Å²	35	7%	0.072	19%	0.19	C	C	.	.	S	Bend	trans	100.2	19.9	173.7	0	0	0	0	0	115.8	N152 G190	N152-G155 PolarHBondContact OD1-N 2.94Å; G155-G190 PolarHBondContact O-N 2.79Å
156	Y	95.2	Very high	93.4	Very high	27 Å²	27	35.2 Å²	35.2	11%	0.106	19%	0.192	C	C	.	.			trans	-116.1	109.9	167.4	-59.6	-34.3	0	0	0	110.7	S97 V99 K130 D151 N152 F158 M179 I189	S97-Y156 WeakPolarHBondContact CA-OH 3.34Å; S97-Y156 WeakPolarHBondContact CB-OH 3.27Å; S97-Y156 WeakPolarHBondContact O-CE2 3.17Å; S97-Y156 PolarHBondContact O-OH 2.88Å; V99-Y156 WeakPolarHBondContact O-CD2 3.34Å; V99-Y156 WeakPolarHBondContact O-CE2 3.4Å; K130-Y156 PolarHBondContact NZ-OH 2.69Å; D151-Y156 VanDerWaalsContact CA-O 3.3Å; D151-Y156 WeakPolarHBondContact CA-O 3.29Å; D151-Y156 WeakPolarHBondContact CB-O 3.35Å; N152-Y156 PolarHBondContact N-O 2.98Å; N152-Y156 VanDerWaalsContact N-O 3.11Å; N152-Y156 VanDerWaalsContact ND2-CD2 3.33Å; N152-Y156 WeakPolarHBondContact ND2-CD2 3.42Å; N152-Y156 PolarHBondContact OD1-N 3.38Å; N152-Y156 PolarHBondContact OD1-O 3.5Å; Y156-F158 WeakPolarHBondContact O-CD1 3.38Å; Y156-M179 HydrophobicContact CD1-CE 3.97Å; Y156-M179 HydrophobicContact CD1-SD 3.72Å; Y156-M179 HydrophobicContact CD2-CE 3.46Å; Y156-M179 VanDerWaalsContact CD2-CE 3.46Å; Y156-M179 HydrophobicContact CD2-SD 4.33Å; Y156-M179 HydrophobicContact CE1-CE 4.45Å; Y156-M179 HydrophobicContact CE1-SD 4.27Å; Y156-M179 HydrophobicContact CE2-CE 3.99Å; Y156-M179 HydrophobicContact CG-CE 3.46Å; Y156-M179 VanDerWaalsContact CG-CE 3.46Å; Y156-M179 HydrophobicContact CG-SD 3.78Å; Y156-I189 HydrophobicContact CD1-CD1 3.75Å; Y156-I189 HydrophobicContact CD1-CG2 4.24Å; Y156-I189 HydrophobicContact CE1-CD1 3.82Å; Y156-I189 HydrophobicContact CE1-CG2 3.69Å
157	A	96.5	Very high	93.3	Very high	1 Å²	1	36 Å²	36	1%	0.008	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	141.3	169.4	0	0	0	0	0	111.2	I149 T150 D151 M179 I180 V196	I149-A157 HydrophobicContact CG2-CB 3.98Å; T150-A157 CarbonylContact O-C 3.58Å; T150-A157 VanDerWaalsContact O-CA 3.25Å; T150-A157 WeakPolarHBondContact O-CA 3.22Å; D151-A157 HydrophobicContact CB-CB 4.22Å; A157-M179 WeakPolarHBondContact O-CA 3.49Å; A157-M179 WeakPolarHBondContact O-CG 3.24Å; A157-I180 PolarHBondContact O-N 3.35Å; A157-V196 HydrophobicContact CB-CB 4.25Å; A157-V196 HydrophobicContact CB-CG1 4.5Å; A157-V196 HydrophobicContact CB-CG2 3.82Å
158	F	97.1	Very high	93.3	Very high	2 Å²	2	34.9 Å²	34.9	1%	0.009	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.6	164.1	-179	57.8	-85.6	0	0	0	112.2	F101 M111 L114 T150 N152 Y156 K160 D178 M179	F101-F158 HydrophobicContact CB-CE1 3.78Å; F101-F158 HydrophobicContact CB-CE2 4.4Å; F101-F158 HydrophobicContact CB-CZ 3.66Å; F101-F158 HydrophobicContact CD1-CD1 4.19Å; F101-F158 HydrophobicContact CD1-CD2 4.11Å; F101-F158 HydrophobicContact CD1-CE1 4.11Å; F101-F158 HydrophobicContact CD1-CE2 4.01Å; F101-F158 HydrophobicContact CD1-CG 4.2Å; F101-F158 HydrophobicContact CD1-CZ 4.01Å; F101-F158 HydrophobicContact CE1-CD2 4.31Å; F101-F158 HydrophobicContact CE1-CE2 4.44Å; F101-F158 HydrophobicContact CG-CE1 4.18Å; F101-F158 HydrophobicContact CG-CE2 4.07Å; F101-F158 AromaticContact CG-CZ 3.83Å; F101-F158 HydrophobicContact CG-CZ 3.83Å; M111-F158 HydrophobicContact CE-CD2 3.74Å; M111-F158 HydrophobicContact CE-CE2 3.64Å; M111-F158 HydrophobicContact SD-CD2 4.47Å; M111-F158 HydrophobicContact SD-CE2 3.85Å; L114-F158 HydrophobicContact CD1-CE2 4.01Å; L114-F158 HydrophobicContact CD1-CZ 3.75Å; L114-F158 HydrophobicContact CD2-CE2 4.01Å; L114-F158 HydrophobicContact CD2-CZ 3.88Å; L114-F158 HydrophobicContact CG-CZ 4.45Å; T150-F158 HydrophobicContact CG2-CD1 4.39Å; T150-F158 HydrophobicContact CG2-CD2 3.72Å; T150-F158 HydrophobicContact CG2-CE1 3.99Å; T150-F158 HydrophobicContact CG2-CE2 3.26Å; T150-F158 HydrophobicContact CG2-CG 4.26Å; T150-F158 HydrophobicContact CG2-CZ 3.42Å; T150-F158 VanDerWaalsContact CG2-CZ 3.42Å; T150-F158 PolarHBondContact N-O 3.16Å; T150-F158 PolarHBondContact O-N 3.34Å; N152-F158 HydrophobicContact CB-CE1 4.07Å; Y156-F158 WeakPolarHBondContact O-CD1 3.38Å; F158-K160 PolarHBondContact O-N 2.99Å; F158-D178 WeakPolarHBondContact CA-O 3.46Å; F158-D178 VanDerWaalsContact CB-O 3.27Å; F158-D178 WeakPolarHBondContact CB-O 3.43Å; F158-M179 HydrophobicContact CB-CB 4.45Å
159	I	97.3	Very high	93.2	Very high	1 Å²	1	37.9 Å²	37.9	1%	0.005	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	112.1	-177.5	-60.1	174.3	0	0	0	109.9	L147 I149 R161 I162 I174 G177 D178	L147-I159 HydrophobicContact CD2-CD1 3.78Å; L147-I159 HydrophobicContact CD2-CG1 4.07Å; L147-I159 HydrophobicContact CD2-CG2 3.87Å; I149-I159 HydrophobicContact CD1-CG1 4.35Å; I159-R161 WeakPolarHBondContact CG2-O 3.49Å; I159-I162 HydrophobicContact CG2-CD1 4.24Å; I159-I162 HydrophobicContact CG2-CG1 3.61Å; I159-I174 HydrophobicContact CD1-CG2 3.47Å; I159-I174 VanDerWaalsContact CD1-CG2 3.47Å; I159-G177 PolarHBondContact O-N 2.59Å; I159-D178 HydrophobicContact CD1-CB 4.24Å; I159-D178 PolarHBondContact N-O 2.75Å
160	K	95.8	Very high	92.9	Very high	13 Å²	13	44.4 Å²	44.4	6%	0.057	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	-39.4	173.3	-159.6	-176.6	-179.4	-179.6	0	111.3	M111 T148 T150 F158 V176 D271 R281	M111-K160 HydrophobicContact CB-CG 3.93Å; M111-K160 HydrophobicContact CG-CG 4.15Å; M111-K160 WeakPolarHBondContact CG-O 3.32Å; M111-K160 HydrophobicContact SD-CG 4.22Å; T148-K160 PolarHBondContact O-N 3.28Å; T150-K160 HydrophobicContact CG2-CB 3.7Å; T150-K160 HydrophobicContact CG2-CD 4.29Å; T150-K160 HydrophobicContact CG2-CG 4.05Å; F158-K160 PolarHBondContact O-N 2.99Å; K160-V176 WeakPolarHBondContact O-CG1 3.39Å; K160-D271 IonicContact NZ-OD1 3.1Å; K160-D271 IonicContact NZ-OD2 3.08Å; K160-D271 PolarHBondContact NZ-OD2 2.87Å; K160-R281 HydrophobicContact CD-CB 3.45Å; K160-R281 VanDerWaalsContact CD-CB 3.45Å; K160-R281 HydrophobicContact CD-CG 4.26Å
161	R	95.6	Very high	92.8	Very high	90 Å²	90	46.1 Å²	46.1	34%	0.34	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.4	152.6	178.7	-63.2	-175.6	174.1	168.4	-0.8	111.6	D112 T148 I159 E275	D112-R161 IonicContact OD1-NH2 3.35Å; T148-R161 PolarHBondContact N-O 3.24Å; T148-R161 PolarHBondContact O-N 3.48Å; I159-R161 WeakPolarHBondContact CG2-O 3.49Å; R161-E275 WeakPolarHBondContact CD-OE1 3.18Å; R161-E275 IonicContact NH1-OE2 3.23Å; R161-E275 PolarHBondContact NH1-OE2 3.37Å
162	I	96	Very high	92.5	Very high	37 Å²	37	52.9 Å²	52.9	19%	0.19	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	122.9	169.5	-56.7	174.5	0	0	0	106.5	G146 L147 I159 E164 I168 H169 I174 V176	G146-I162 CarbonylContact O-C 3.58Å; G146-I162 WeakPolarHBondContact O-CA 3.31Å; L147-I162 HydrophobicContact CD2-CG1 4.04Å; I159-I162 HydrophobicContact CG2-CD1 4.24Å; I159-I162 HydrophobicContact CG2-CG1 3.61Å; I162-E164 PolarHBondContact O-N 2.95Å; I162-I168 HydrophobicContact CD1-CG2 4.39Å; I162-I168 HydrophobicContact CG2-CB 4.32Å; I162-I168 HydrophobicContact CG2-CG2 4.2Å; I162-H169 HydrophobicContact CG2-CB 4.05Å; I162-I174 HydrophobicContact CD1-CG2 4.36Å; I162-V176 HydrophobicContact CD1-CG2 4.3Å; I162-V176 HydrophobicContact CG1-CG2 4.08Å
163	R	93.9	Very high	92.7	Very high	184 Å²	184	56.2 Å²	56.2	69%	0.694	29%	0.29	S	S	*	.			trans	-71	126.2	179.9	-179.1	-179.4	175.4	-176.4	-0	110.1	G146 S166 H169	G146-R163 PolarHBondContact O-N 2.93Å; R163-S166 WeakPolarHBondContact O-CB 3.48Å; R163-S166 PolarHBondContact O-N 2.69Å; R163-S166 PolarHBondContact O-OG 3.01Å; R163-H169 WeakPolarHBondContact O-CB 3.28Å
164	E	92.7	Very high	93.1	Very high	163 Å²	163	54.7 Å²	54.7	76%	0.762	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.6	141.9	176.2	-168.2	173.3	-165.5	0	0	111.8	I162 S166	I162-E164 PolarHBondContact O-N 2.95Å; E164-S166 PolarHBondContact O-N 3.38Å
165	G	90.8	Very high	93.5	Very high	51 Å²	51	56.1 Å²	56.1	53%	0.526	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	77.7	-16.3	-177.5	0	0	0	0	0	116	H169 Q170	G165-H169 PolarHBondContact N-ND1 2.85Å; G165-Q170 PolarHBondContact O-NE2 2.75Å
166	S	92.9	Very high	93.9	Very high	12 Å²	12	58.1 Å²	58.1	8%	0.084	29%	0.287	C	S	.	.	S	Bend	trans	-62.3	166.7	-179.5	68.2	0	0	0	0	114.5	R163 E164 I168 H169 Q170	R163-S166 WeakPolarHBondContact O-CB 3.48Å; R163-S166 PolarHBondContact O-N 2.69Å; R163-S166 PolarHBondContact O-OG 3.01Å; E164-S166 PolarHBondContact O-N 3.38Å; S166-I168 PolarHBondContact O-N 3.3Å; S166-H169 WeakPolarHBondContact O-CB 3.24Å; S166-H169 PolarHBondContact O-N 3.05Å; S166-H169 VanDerWaalsContact O-N 3.16Å; S166-H169 PolarHBondContact OG-N 2.93Å; S166-Q170 WeakPolarHBondContact O-CG 3.33Å; S166-Q170 PolarHBondContact O-N 3.05Å
167	I	90.6	Very high	94	Very high	30 Å²	30	56.9 Å²	56.9	15%	0.154	28%	0.282	C	S	.	.	T	Hydrogen-bonded Turn	trans	-50.7	-45.2	173.2	-62.5	172.8	0	0	0	110.9	I138 E142 Q170	I138-I167 HydrophobicContact CG2-CG2 4.31Å; E142-I167 HydrophobicContact CB-CD1 3.98Å; E142-I167 HydrophobicContact CG-CD1 4.14Å; I167-Q170 PolarHBondContact O-N 3.14Å
168	I	93.8	Very high	94.1	Very high	2 Å²	2	56.8 Å²	56.8	1%	0.01	28%	0.281	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.6	-32.5	-177.7	-57.4	-61.9	0	0	0	112.4	I138 L145 L147 I162 S166 Q170 I171 I174	I138-I168 HydrophobicContact CD1-CD1 3.72Å; I138-I168 HydrophobicContact CG2-CD1 4.05Å; L145-I168 HydrophobicContact CB-CG1 3.99Å; L145-I168 VanDerWaalsContact O-CG1 3.29Å; L145-I168 WeakPolarHBondContact O-CG1 3.42Å; L147-I168 HydrophobicContact CD1-CG1 4.2Å; L147-I168 HydrophobicContact CD2-CB 4.23Å; L147-I168 HydrophobicContact CD2-CG1 4.28Å; L147-I168 HydrophobicContact CD2-CG2 3.85Å; L147-I168 HydrophobicContact CG-CB 4.44Å; L147-I168 HydrophobicContact CG-CG1 4Å; L147-I168 HydrophobicContact CG-CG2 4.48Å; I162-I168 HydrophobicContact CD1-CG2 4.39Å; I162-I168 HydrophobicContact CG2-CB 4.32Å; I162-I168 HydrophobicContact CG2-CG2 4.2Å; S166-I168 PolarHBondContact O-N 3.3Å; I168-Q170 PolarHBondContact O-N 2.95Å; I168-I171 HydrophobicContact CD1-CD1 4.18Å; I168-I171 PolarHBondContact O-N 3.36Å; I168-I174 HydrophobicContact CD1-CD1 4.1Å; I168-I174 HydrophobicContact CG2-CB 3.93Å; I168-I174 HydrophobicContact CG2-CD1 4.02Å; I168-I174 HydrophobicContact CG2-CG2 3.59Å
169	H	92.9	Very high	94.1	Very high	75 Å²	75	56.8 Å²	56.8	35%	0.347	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59	-28.8	174	-178.7	-105.7	0	0	0	112.9	I162 R163 G165 S166 I171 Q172	I162-H169 HydrophobicContact CG2-CB 4.05Å; R163-H169 WeakPolarHBondContact O-CB 3.28Å; G165-H169 PolarHBondContact N-ND1 2.85Å; S166-H169 WeakPolarHBondContact O-CB 3.24Å; S166-H169 PolarHBondContact O-N 3.05Å; S166-H169 VanDerWaalsContact O-N 3.16Å; S166-H169 PolarHBondContact OG-N 2.93Å; H169-I171 VanDerWaalsContact C-N 3.28Å; H169-I171 PolarHBondContact O-N 3.35Å; H169-Q172 PolarHBondContact O-NE2 3.14Å; H169-Q172 VanDerWaalsContact O-NE2 3.16Å
170	Q	90.7	Very high	94.1	Very high	140 Å²	140	56.8 Å²	56.8	65%	0.654	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.5	-18	175.5	-61.5	170.2	37.7	0	0	112.5	G165 S166 I167 I168 Q172	G165-Q170 PolarHBondContact O-NE2 2.75Å; S166-Q170 WeakPolarHBondContact O-CG 3.33Å; S166-Q170 PolarHBondContact O-N 3.05Å; I167-Q170 PolarHBondContact O-N 3.14Å; I168-Q170 PolarHBondContact O-N 2.95Å; Q170-Q172 PolarHBondContact O-N 2.67Å
171	I	91.4	Very high	94.2	Very high	41 Å²	41	58 Å²	58	21%	0.21	29%	0.287	C	S	.	.			trans	-97.2	84	-177.7	-54.1	174.8	0	0	0	110	I136 I138 I168 H169 V173 I174	I136-I171 HydrophobicContact CG2-CG2 4.23Å; I138-I171 HydrophobicContact CD1-CD1 4.24Å; I138-I171 HydrophobicContact CG1-CD1 4.06Å; I138-I171 HydrophobicContact CG2-CD1 3.95Å; I168-I171 HydrophobicContact CD1-CD1 4.18Å; I168-I171 PolarHBondContact O-N 3.36Å; H169-I171 VanDerWaalsContact C-N 3.28Å; H169-I171 PolarHBondContact O-N 3.35Å; I171-V173 HydrophobicContact CG2-CB 4.49Å; I171-V173 PolarHBondContact O-N 3.45Å; I171-I174 HydrophobicContact CB-CD1 4.17Å; I171-I174 HydrophobicContact CB-CG1 4.49Å; I171-I174 HydrophobicContact CD1-CD1 4.35Å; I171-I174 HydrophobicContact CG2-CD1 3.8Å; I171-I174 HydrophobicContact CG2-CG1 3.93Å; I171-I174 PolarHBondContact O-N 2.9Å
172	Q	88.4	Confident	94.3	Very high	156 Å²	156	54.1 Å²	54.1	73%	0.729	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.5	-8.4	-175.8	-60.7	-68.4	-67.1	0	0	116.3	H169 Q170	H169-Q172 PolarHBondContact O-NE2 3.14Å; H169-Q172 VanDerWaalsContact O-NE2 3.16Å; Q170-Q172 PolarHBondContact O-N 2.67Å
173	V	93.2	Very high	94.3	Very high	79 Å²	79	52.4 Å²	52.4	48%	0.479	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.7	-24.5	175.7	179.2	0	0	0	0	111.7	K134 I136 I171 N175	K134-V173 HydrophobicContact CD-CG1 3.95Å; K134-V173 PolarHBondContact NZ-O 2.88Å; I136-V173 HydrophobicContact CD1-CG1 4.46Å; I136-V173 HydrophobicContact CG1-CG1 4.18Å; I171-V173 HydrophobicContact CG2-CB 4.49Å; I171-V173 PolarHBondContact O-N 3.45Å; V173-N175 PolarHBondContact O-ND2 3.16Å
174	I	95.7	Very high	94.4	Very high	11 Å²	11	47.3 Å²	47.3	6%	0.056	25%	0.251	C	S	.	.			trans	-95	126.1	-177	-58.2	174.5	0	0	0	108.9	I136 I138 I159 I162 I168 I171 L213	I136-I174 HydrophobicContact CD1-CG1 4.23Å; I136-I174 HydrophobicContact CG1-CG1 4.41Å; I138-I174 HydrophobicContact CD1-CD1 3.59Å; I159-I174 HydrophobicContact CD1-CG2 3.47Å; I159-I174 VanDerWaalsContact CD1-CG2 3.47Å; I162-I174 HydrophobicContact CD1-CG2 4.36Å; I168-I174 HydrophobicContact CD1-CD1 4.1Å; I168-I174 HydrophobicContact CG2-CB 3.93Å; I168-I174 HydrophobicContact CG2-CD1 4.02Å; I168-I174 HydrophobicContact CG2-CG2 3.59Å; I171-I174 HydrophobicContact CB-CD1 4.17Å; I171-I174 HydrophobicContact CB-CG1 4.49Å; I171-I174 HydrophobicContact CD1-CD1 4.35Å; I171-I174 HydrophobicContact CG2-CD1 3.8Å; I171-I174 HydrophobicContact CG2-CG1 3.93Å; I171-I174 PolarHBondContact O-N 2.9Å; I174-L213 HydrophobicContact CB-CD1 4.29Å; I174-L213 HydrophobicContact CD1-CD1 4.46Å; I174-L213 HydrophobicContact CG1-CD1 3.84Å; I174-L213 HydrophobicContact CG2-CD1 3.89Å
175	N	95.8	Very high	94.4	Very high	56 Å²	56	42.2 Å²	42.2	30%	0.299	24%	0.243	S	C	.	.			trans	-128.1	153.1	-170	-77.9	-97.4	0	0	0	111.6	V173 G177 D178	V173-N175 PolarHBondContact O-ND2 3.16Å; N175-G177 PolarHBondContact O-N 3.43Å; N175-D178 PolarHBondContact N-OD2 2.99Å; N175-D178 VanDerWaalsContact O-CB 3.32Å; N175-D178 WeakPolarHBondContact O-CB 3.44Å; N175-D178 PolarHBondContact O-N 3.09Å; N175-D178 VanDerWaalsContact O-N 3.14Å
176	V	96.7	Very high	94.6	Very high	50 Å²	50	45.8 Å²	45.8	30%	0.303	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.8	135.7	165.3	172.7	0	0	0	0	109	V109 M111 K160 I162	V109-V176 HydrophobicContact CG1-CG1 4.44Å; V109-V176 WeakPolarHBondContact CG1-O 3.33Å; M111-V176 HydrophobicContact CE-CG1 3.8Å; M111-V176 HydrophobicContact CG-CG1 3.46Å; M111-V176 VanDerWaalsContact CG-CG1 3.46Å; K160-V176 WeakPolarHBondContact O-CG1 3.39Å; I162-V176 HydrophobicContact CD1-CG2 4.3Å; I162-V176 HydrophobicContact CG1-CG2 4.08Å
177	G	96.4	Very high	94.8	Very high	0 Å²	0	53.9 Å²	53.9	0%	0	27%	0.274	C	S	.	.	T	Hydrogen-bonded Turn	trans	90.1	-10.2	-173	0	0	0	0	0	115.8	M111 I159 N175 M179 P216	M111-G177 VanDerWaalsContact CE-CA 3.42Å; I159-G177 PolarHBondContact O-N 2.59Å; N175-G177 PolarHBondContact O-N 3.43Å; G177-M179 PolarHBondContact O-N 2.64Å; G177-P216 WeakPolarHBondContact O-CD 3.37Å
178	D	97.9	Very high	95	Very high	0 Å²	0	52.6 Å²	52.6	0%	0	27%	0.268	C	S	.	.			trans	-63.1	123.5	173.7	-76.1	-20.3	0	0	0	110.9	K134 F158 I159 N175 L213 E215	K134-D178 WeakPolarHBondContact CE-OD1 3.34Å; K134-D178 WeakPolarHBondContact CE-OD2 3.4Å; K134-D178 IonicContact NZ-OD1 3.97Å; K134-D178 PolarHBondContact NZ-OD1 2.99Å; K134-D178 IonicContact NZ-OD2 2.71Å; K134-D178 PolarHBondContact NZ-OD2 3Å; F158-D178 WeakPolarHBondContact CA-O 3.46Å; F158-D178 VanDerWaalsContact CB-O 3.27Å; F158-D178 WeakPolarHBondContact CB-O 3.43Å; I159-D178 HydrophobicContact CD1-CB 4.24Å; I159-D178 PolarHBondContact N-O 2.75Å; N175-D178 PolarHBondContact N-OD2 2.99Å; N175-D178 VanDerWaalsContact O-CB 3.32Å; N175-D178 WeakPolarHBondContact O-CB 3.44Å; N175-D178 PolarHBondContact O-N 3.09Å; N175-D178 VanDerWaalsContact O-N 3.14Å; D178-L213 HydrophobicContact CB-CB 4.28Å; D178-L213 HydrophobicContact CB-CD1 4.1Å; D178-L213 HydrophobicContact CB-CD2 4.41Å; D178-E215 WeakPolarHBondContact OD1-CA 3.3Å; D178-E215 WeakPolarHBondContact OD1-CB 3.42Å; D178-E215 WeakPolarHBondContact OD1-CG 3.42Å
179	M	97.5	Very high	95	Very high	1 Å²	1	54.7 Å²	54.7	1%	0.005	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	138.7	170.3	176.3	-163.1	-52.6	0	0	110.3	M100 K130 Y156 A157 F158 G177 I189 L213 V214	M100-M179 HydrophobicContact CB-CE 4.04Å; M100-M179 HydrophobicContact CE-CB 3.58Å; M100-M179 HydrophobicContact CE-CE 4.01Å; M100-M179 HydrophobicContact CG-CE 3.64Å; M100-M179 HydrophobicContact SD-CE 4.47Å; K130-M179 HydrophobicContact CG-CE 4.18Å; Y156-M179 HydrophobicContact CD1-CE 3.97Å; Y156-M179 HydrophobicContact CD1-SD 3.72Å; Y156-M179 HydrophobicContact CD2-CE 3.46Å; Y156-M179 VanDerWaalsContact CD2-CE 3.46Å; Y156-M179 HydrophobicContact CD2-SD 4.33Å; Y156-M179 HydrophobicContact CE1-CE 4.45Å; Y156-M179 HydrophobicContact CE1-SD 4.27Å; Y156-M179 HydrophobicContact CE2-CE 3.99Å; Y156-M179 HydrophobicContact CG-CE 3.46Å; Y156-M179 VanDerWaalsContact CG-CE 3.46Å; Y156-M179 HydrophobicContact CG-SD 3.78Å; A157-M179 WeakPolarHBondContact O-CA 3.49Å; A157-M179 WeakPolarHBondContact O-CG 3.24Å; F158-M179 HydrophobicContact CB-CB 4.45Å; G177-M179 PolarHBondContact O-N 2.64Å; M179-I189 HydrophobicContact SD-CD1 3.9Å; M179-L213 CarbonylContact O-C 3.59Å; M179-L213 WeakPolarHBondContact O-CA 3.5Å; M179-V214 HydrophobicContact CB-CB 4.35Å; M179-V214 PolarHBondContact N-O 3.2Å; M179-V214 PolarHBondContact O-N 2.85Å
180	I	97.7	Very high	95	Very high	1 Å²	1	53.7 Å²	53.7	1%	0.005	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	108	173.9	-55	176.1	0	0	0	109.2	I149 A157 I183 L188 V196 L200 I211 L213	I149-I180 HydrophobicContact CD1-CD1 3.73Å; A157-I180 PolarHBondContact O-N 3.35Å; I180-I183 HydrophobicContact CG2-CD1 4.45Å; I180-I183 HydrophobicContact CG2-CG1 4.16Å; I180-L188 HydrophobicContact CG2-CD1 3.76Å; I180-V196 HydrophobicContact CB-CG1 4.42Å; I180-V196 HydrophobicContact CD1-CG1 3.69Å; I180-V196 HydrophobicContact CG2-CG1 4.31Å; I180-L200 HydrophobicContact CD1-CD1 4.25Å; I180-I211 HydrophobicContact CD1-CD1 4.32Å; I180-I211 HydrophobicContact CG1-CD1 4.29Å; I180-I211 HydrophobicContact CG2-CD1 4.01Å; I180-I211 HydrophobicContact CG2-CG1 4.1Å; I180-L213 HydrophobicContact CB-CD2 4.31Å; I180-L213 HydrophobicContact CG1-CD2 3.76Å
181	E	97.1	Very high	95.1	Very high	40 Å²	40	48.3 Å²	48.3	19%	0.187	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	-37.6	-179.9	-178.8	169.6	-125.6	0	0	112.3	K133 L188 I189 K212 V214	K133-E181 IonicContact NZ-OE1 2.67Å; K133-E181 PolarHBondContact NZ-OE1 3.15Å; K133-E181 IonicContact NZ-OE2 2.69Å; K133-E181 PolarHBondContact NZ-OE2 2.74Å; E181-L188 PolarHBondContact O-N 3.04Å; E181-I189 HydrophobicContact CB-CD1 4.44Å; E181-I189 HydrophobicContact CG-CD1 4.2Å; E181-I189 HydrophobicContact CG-CG1 4.23Å; E181-K212 HydrophobicContact CB-CB 4.48Å; E181-K212 PolarHBondContact N-O 2.87Å; E181-V214 HydrophobicContact CB-CG2 4.28Å
182	S	97.3	Very high	95.1	Very high	8 Å²	8	49.5 Å²	49.5	6%	0.056	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.2	151.8	176.2	68.6	0	0	0	0	113.5	H186 K212	S182-H186 CarbonylContact C-O 3.55Å; S182-H186 WeakPolarHBondContact CA-O 3.36Å; S182-H186 WeakPolarHBondContact CB-O 3.03Å; S182-K212 PolarHBondContact N-O 2.95Å; S182-K212 PolarHBondContact O-N 3.17Å; S182-K212 WeakPolarHBondContact OG-CB 3.23Å; S182-K212 VanDerWaalsContact OG-CD 3.31Å; S182-K212 WeakPolarHBondContact OG-CD 3.34Å; S182-K212 VanDerWaalsContact OG-CG 3.31Å; S182-K212 WeakPolarHBondContact OG-CG 3.39Å
183	I	97.3	Very high	95.3	Very high	1 Å²	1	42 Å²	42	1%	0.005	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	129.3	167.7	-65	168.4	0	0	0	108.5	I180 G185 H186 L188 M199 L200 L203 F209 I210 I211	I180-I183 HydrophobicContact CG2-CD1 4.45Å; I180-I183 HydrophobicContact CG2-CG1 4.16Å; I183-G185 PolarHBondContact O-N 3.36Å; I183-H186 PolarHBondContact N-O 3.43Å; I183-H186 WeakPolarHBondContact O-CB 3.39Å; I183-H186 PolarHBondContact O-CD2 3.16Å; I183-H186 PolarHBondContact O-N 2.96Å; I183-L188 HydrophobicContact CB-CD1 4.16Å; I183-L188 HydrophobicContact CD1-CD1 3.63Å; I183-L188 HydrophobicContact CG1-CD1 3.65Å; I183-M199 HydrophobicContact CB-SD 4.05Å; I183-M199 HydrophobicContact CD1-CG 4.34Å; I183-M199 HydrophobicContact CD1-SD 4.23Å; I183-M199 HydrophobicContact CG2-SD 4.41Å; I183-L200 HydrophobicContact CD1-CD2 3.5Å; I183-L200 HydrophobicContact CD1-CG 3.68Å; I183-L200 HydrophobicContact CG1-CD2 4.43Å; I183-L203 HydrophobicContact CG2-CD1 4.17Å; I183-L203 HydrophobicContact CG2-CD2 4.06Å; I183-F209 HydrophobicContact CG2-CD2 4.3Å; I183-I210 CarbonylContact C-O 3.53Å; I183-I210 WeakPolarHBondContact CA-O 3.39Å; I183-I211 HydrophobicContact CG1-CD1 4.34Å; I183-I211 HydrophobicContact CG1-CG1 4.19Å
184	N	95.6	Very high	95.1	Very high	76 Å²	76	41 Å²	41	41%	0.406	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	49.5	31.1	-176.8	-67.5	-26.8	0	0	0	114.2	H186 L203 F209 I210	N184-H186 VanDerWaalsContact C-N 3.27Å; N184-H186 PolarHBondContact O-N 3.31Å; N184-L203 WeakPolarHBondContact ND2-CD2 3.44Å; N184-F209 VanDerWaalsContact OD1-CA 3.26Å; N184-F209 WeakPolarHBondContact OD1-CA 3.27Å; N184-F209 WeakPolarHBondContact OD1-CB 3.13Å; N184-I210 PolarHBondContact N-O 2.97Å; N184-I210 PolarHBondContact OD1-N 3.04Å
185	G	93.4	Very high	95	Very high	57 Å²	57	44.5 Å²	44.5	59%	0.588	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	82	-10.6	-175.3	0	0	0	0	0	115.3	I183 R187	I183-G185 PolarHBondContact O-N 3.36Å; G185-R187 PolarHBondContact O-N 3.21Å
186	H	95	Very high	94.9	Very high	126 Å²	126	41.9 Å²	41.9	58%	0.583	22%	0.223	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-70.3	113.2	169.5	-60.3	-88.2	0	0	0	109.2	S182 I183 N184	S182-H186 CarbonylContact C-O 3.55Å; S182-H186 WeakPolarHBondContact CA-O 3.36Å; S182-H186 WeakPolarHBondContact CB-O 3.03Å; I183-H186 PolarHBondContact N-O 3.43Å; I183-H186 WeakPolarHBondContact O-CB 3.39Å; I183-H186 PolarHBondContact O-CD2 3.16Å; I183-H186 PolarHBondContact O-N 2.96Å; N184-H186 VanDerWaalsContact C-N 3.27Å; N184-H186 PolarHBondContact O-N 3.31Å
187	R	95.9	Very high	94.7	Very high	181 Å²	181	40 Å²	40	68%	0.683	21%	0.213	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-71.2	130	-179.4	-176.9	178.3	-178.2	-178.9	-2.7	110.4	G185 I189	G185-R187 PolarHBondContact O-N 3.21Å; R187-I189 HydrophobicContact CG-CB 4.05Å; R187-I189 HydrophobicContact CG-CG1 4Å
188	L	94.9	Very high	94.5	Very high	4 Å²	4	45.8 Å²	45.8	2%	0.021	24%	0.238	C	C	.	.			trans	-109	4.3	-175.9	-63.5	170.8	0	0	0	113.5	I180 E181 I183 G190 C191 V196 M199	I180-L188 HydrophobicContact CG2-CD1 3.76Å; E181-L188 PolarHBondContact O-N 3.04Å; I183-L188 HydrophobicContact CB-CD1 4.16Å; I183-L188 HydrophobicContact CD1-CD1 3.63Å; I183-L188 HydrophobicContact CG1-CD1 3.65Å; L188-G190 PolarHBondContact O-N 3Å; L188-C191 WeakPolarHBondContact O-CB 3.4Å; L188-C191 PolarHBondContact O-N 3.39Å; L188-V196 HydrophobicContact CB-CG2 4.14Å; L188-V196 HydrophobicContact CD1-CG1 4.12Å; L188-V196 HydrophobicContact CD1-CG2 4.11Å; L188-V196 HydrophobicContact CD2-CG2 4.28Å; L188-V196 HydrophobicContact CG-CG2 4.4Å; L188-M199 HydrophobicContact CD1-SD 4.38Å; L188-M199 HydrophobicContact CD2-CE 3.85Å; L188-M199 HydrophobicContact CD2-SD 3.91Å
189	I	94.3	Very high	94.3	Very high	45 Å²	45	48.7 Å²	48.7	23%	0.231	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65	113.9	172.1	-56.2	-55.7	0	0	0	109.7	Y156 M179 E181 R187	Y156-I189 HydrophobicContact CD1-CD1 3.75Å; Y156-I189 HydrophobicContact CD1-CG2 4.24Å; Y156-I189 HydrophobicContact CE1-CD1 3.82Å; Y156-I189 HydrophobicContact CE1-CG2 3.69Å; M179-I189 HydrophobicContact SD-CD1 3.9Å; E181-I189 HydrophobicContact CB-CD1 4.44Å; E181-I189 HydrophobicContact CG-CD1 4.2Å; E181-I189 HydrophobicContact CG-CG1 4.23Å; R187-I189 HydrophobicContact CG-CB 4.05Å; R187-I189 HydrophobicContact CG-CG1 4Å
190	G	92.4	Very high	94.1	Very high	55 Å²	55	49.2 Å²	49.2	57%	0.567	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	112.2	-21.9	-173.8	0	0	0	0	0	113.5	G155 L188	G155-G190 PolarHBondContact O-N 2.79Å; L188-G190 PolarHBondContact O-N 3Å
191	C	92.7	Very high	93.8	Very high	27 Å²	27	55.9 Å²	55.9	18%	0.182	28%	0.284	C	S	.	.			trans	-74.1	152.9	178	-64.3	0	0	0	0	112.3	L188 E195 V196	L188-C191 WeakPolarHBondContact O-CB 3.4Å; L188-C191 PolarHBondContact O-N 3.39Å; C191-E195 WeakPolarHBondContact CA-OE2 3.41Å; C191-E195 HydrophobicContact CB-CB 4.22Å; C191-E195 WeakPolarHBondContact CB-OE2 3.43Å; C191-V196 HydrophobicContact CB-CG2 4.04Å
192	R	91.9	Very high	93.5	Very high	65 Å²	65	60.3 Å²	60.3	25%	0.245	31%	0.305	C	S	.	.			trans	-82.7	162.1	168.1	-59.1	-55.9	-49.3	-88.8	3.7	111.4	D151 Y194 E195 V196 D282	D151-R192 VanDerWaalsContact CG-NE 3.35Å; D151-R192 IonicContact OD1-CZ 2.82Å; D151-R192 IonicContact OD1-NE 3.31Å; D151-R192 PolarHBondContact OD1-NE 3.27Å; D151-R192 IonicContact OD1-NH2 3.8Å; D151-R192 PolarHBondContact OD1-NH2 2.7Å; D151-R192 WeakPolarHBondContact OD2-CA 3.34Å; D151-R192 IonicContact OD2-CZ 2.67Å; D151-R192 IonicContact OD2-NE 2.76Å; D151-R192 PolarHBondContact OD2-NE 2.81Å; D151-R192 IonicContact OD2-NH2 2.73Å; D151-R192 PolarHBondContact OD2-NH2 3.18Å; D151-R192 VanDerWaalsContact OD2-NH2 3.15Å; R192-Y194 VanDerWaalsContact C-N 3.3Å; R192-Y194 HydrophobicContact CB-CD1 3.6Å; R192-Y194 HydrophobicContact CB-CE1 3.24Å; R192-Y194 HydrophobicContact CB-CG 4.43Å; R192-Y194 HydrophobicContact CG-CD1 4.45Å; R192-Y194 HydrophobicContact CG-CE1 3.62Å; R192-Y194 PolarHBondContact O-N 2.58Å; R192-E195 PolarHBondContact N-OE2 3.37Å; R192-E195 PolarHBondContact O-N 2.64Å; R192-V196 PolarHBondContact O-N 3.24Å; R192-D282 IonicContact NH2-OD2 2.82Å; R192-D282 PolarHBondContact NH2-OD2 3.2Å
193	H	92.5	Very high	93.4	Very high	0 Å²	0	60.6 Å²	60.6	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-54.6	-39.9	-179.5	51.5	65.3	0	0	0	113.9	I149 D151 E195 V196 A197 I280 D282	I149-H193 HydrophobicContact CB-CB 4.41Å; I149-H193 HydrophobicContact CG2-CB 3.86Å; D151-H193 HydrophobicContact CB-CB 4.18Å; D151-H193 VanDerWaalsContact CG-CD2 3.5Å; D151-H193 IonicContact OD2-CD2 3.46Å; D151-H193 PolarHBondContact OD2-CD2 3.21Å; D151-H193 IonicContact OD2-CG 3.22Å; D151-H193 PolarHBondContact OD2-N 2.82Å; D151-H193 IonicContact OD2-NE2 3.18Å; H193-E195 PolarHBondContact O-N 3.14Å; H193-V196 PolarHBondContact O-N 3.46Å; H193-A197 WeakPolarHBondContact O-CB 3.16Å; H193-A197 PolarHBondContact O-N 3.09Å; H193-I280 HydrophobicContact CB-CG2 4.42Å; H193-D282 IonicContact CD2-OD2 2.86Å; H193-D282 IonicContact CE1-OD2 2.82Å; H193-D282 VanDerWaalsContact NE2-CB 3.34Å; H193-D282 WeakPolarHBondContact NE2-CB 3.27Å; H193-D282 IonicContact NE2-OD2 2.65Å; H193-D282 PolarHBondContact NE2-OD2 3.06Å
194	Y	89.8	Confident	93.2	Very high	58 Å²	58	63.7 Å²	63.7	23%	0.227	33%	0.326	C	S	.	.	H	α-helix	trans	-68.2	-33.9	-179.2	61.7	-94.2	0	0	0	113	R192 K198 F313	R192-Y194 VanDerWaalsContact C-N 3.3Å; R192-Y194 HydrophobicContact CB-CD1 3.6Å; R192-Y194 HydrophobicContact CB-CE1 3.24Å; R192-Y194 HydrophobicContact CB-CG 4.43Å; R192-Y194 HydrophobicContact CG-CD1 4.45Å; R192-Y194 HydrophobicContact CG-CE1 3.62Å; R192-Y194 PolarHBondContact O-N 2.58Å; Y194-K198 WeakPolarHBondContact O-CB 3.21Å; Y194-K198 PolarHBondContact O-N 3.09Å; Y194-F313 AromaticContact CD1-CD1 3.94Å; Y194-F313 HydrophobicContact CD1-CD1 3.94Å; Y194-F313 AromaticContact CD1-CE1 3.34Å; Y194-F313 HydrophobicContact CD1-CE1 3.34Å; Y194-F313 AromaticContact CD1-CZ 3.88Å; Y194-F313 HydrophobicContact CD1-CZ 3.88Å; Y194-F313 HydrophobicContact CE1-CD1 4.22Å; Y194-F313 AromaticContact CE1-CE1 3.58Å; Y194-F313 HydrophobicContact CE1-CE1 3.58Å; Y194-F313 HydrophobicContact CE1-CE2 4.29Å; Y194-F313 AromaticContact CE1-CZ 3.63Å; Y194-F313 HydrophobicContact CE1-CZ 3.63Å; Y194-F313 HydrophobicContact CG-CD1 4.2Å; Y194-F313 HydrophobicContact CG-CE1 4.04Å
195	E	92.3	Very high	93.2	Very high	84 Å²	84	65.3 Å²	65.3	39%	0.393	33%	0.329	S	S	.	.	H	α-helix	trans	-66.3	-40.9	173.9	-58	179.7	93.7	0	0	110.9	C191 R192 H193 M199	C191-E195 WeakPolarHBondContact CA-OE2 3.41Å; C191-E195 HydrophobicContact CB-CB 4.22Å; C191-E195 WeakPolarHBondContact CB-OE2 3.43Å; R192-E195 PolarHBondContact N-OE2 3.37Å; R192-E195 PolarHBondContact O-N 2.64Å; H193-E195 PolarHBondContact O-N 3.14Å; E195-M199 WeakPolarHBondContact O-CB 3.22Å; E195-M199 PolarHBondContact O-N 3.04Å
196	V	94.6	Very high	93.2	Very high	0 Å²	0	65 Å²	65	0%	0	33%	0.326	C	S	.	.	H	α-helix	trans	-70.4	-43.2	178.5	178.4	0	0	0	0	111.4	I149 A157 I180 L188 C191 R192 H193 M199 L200	I149-V196 HydrophobicContact CG2-CB 4.42Å; I149-V196 HydrophobicContact CG2-CG1 4.35Å; A157-V196 HydrophobicContact CB-CB 4.25Å; A157-V196 HydrophobicContact CB-CG1 4.5Å; A157-V196 HydrophobicContact CB-CG2 3.82Å; I180-V196 HydrophobicContact CB-CG1 4.42Å; I180-V196 HydrophobicContact CD1-CG1 3.69Å; I180-V196 HydrophobicContact CG2-CG1 4.31Å; L188-V196 HydrophobicContact CB-CG2 4.14Å; L188-V196 HydrophobicContact CD1-CG1 4.12Å; L188-V196 HydrophobicContact CD1-CG2 4.11Å; L188-V196 HydrophobicContact CD2-CG2 4.28Å; L188-V196 HydrophobicContact CG-CG2 4.4Å; C191-V196 HydrophobicContact CB-CG2 4.04Å; R192-V196 PolarHBondContact O-N 3.24Å; H193-V196 PolarHBondContact O-N 3.46Å; V196-M199 PolarHBondContact O-N 2.89Å; V196-L200 HydrophobicContact CG1-CD1 4.2Å; V196-L200 WeakPolarHBondContact O-CG 3.47Å; V196-L200 PolarHBondContact O-N 2.82Å
197	A	93.1	Very high	93.2	Very high	10 Å²	10	65.3 Å²	65.3	8%	0.083	33%	0.326	C	S	.	.	H	α-helix	trans	-63	-42.7	174.2	0	0	0	0	0	111.7	I149 H193 L200 K201 I280	I149-A197 HydrophobicContact CB-CB 4.48Å; I149-A197 HydrophobicContact CG1-CB 4.29Å; H193-A197 WeakPolarHBondContact O-CB 3.16Å; H193-A197 PolarHBondContact O-N 3.09Å; A197-L200 PolarHBondContact O-N 3.26Å; A197-K201 WeakPolarHBondContact O-CB 3.44Å; A197-K201 PolarHBondContact O-N 3.04Å; A197-I280 HydrophobicContact CB-CG2 3.56Å
198	K	91.4	Very high	93.2	Very high	123 Å²	123	60.9 Å²	60.9	54%	0.535	31%	0.314	S	S	.	.	H	α-helix	trans	-59.4	-48.4	173.1	-179.6	173.4	178.8	175.9	0	111.5	Y194 L200 K201 E202	Y194-K198 WeakPolarHBondContact O-CB 3.21Å; Y194-K198 PolarHBondContact O-N 3.09Å; K198-L200 VanDerWaalsContact C-N 3.34Å; K198-L200 PolarHBondContact O-N 3.05Å; K198-K201 WeakPolarHBondContact O-CB 3.41Å; K198-K201 PolarHBondContact O-N 3.33Å; K198-K201 VanDerWaalsContact O-N 3.11Å; K198-E202 WeakPolarHBondContact CE-OE1 3.22Å; K198-E202 HydrophobicContact CG-CG 4.3Å; K198-E202 IonicContact NZ-OE1 3.96Å; K198-E202 WeakPolarHBondContact O-CB 3.13Å; K198-E202 WeakPolarHBondContact O-CG 3.27Å; K198-E202 PolarHBondContact O-N 3.16Å
199	M	93.3	Very high	93.3	Very high	61 Å²	61	61 Å²	61	30%	0.3	31%	0.314	S	S	.	.	H	α-helix	trans	-59	-44	176.8	-173	175.6	-68.8	0	0	112	I183 L188 E195 V196 K201 E202 L203	I183-M199 HydrophobicContact CB-SD 4.05Å; I183-M199 HydrophobicContact CD1-CG 4.34Å; I183-M199 HydrophobicContact CD1-SD 4.23Å; I183-M199 HydrophobicContact CG2-SD 4.41Å; L188-M199 HydrophobicContact CD1-SD 4.38Å; L188-M199 HydrophobicContact CD2-CE 3.85Å; L188-M199 HydrophobicContact CD2-SD 3.91Å; E195-M199 WeakPolarHBondContact O-CB 3.22Å; E195-M199 PolarHBondContact O-N 3.04Å; V196-M199 PolarHBondContact O-N 2.89Å; M199-K201 VanDerWaalsContact C-N 3.34Å; M199-K201 PolarHBondContact O-N 3.28Å; M199-E202 PolarHBondContact O-N 3.24Å; M199-L203 WeakPolarHBondContact O-CG 3.3Å; M199-L203 PolarHBondContact O-N 2.99Å
200	L	93.4	Very high	93.4	Very high	11 Å²	11	61.9 Å²	61.9	6%	0.058	32%	0.319	C	S	.	.	H	α-helix	trans	-61.5	-39.3	175.1	-72	164.9	0	0	0	112.3	K140 L145 L147 I149 I180 I183 V196 A197 K198 L203 F209	K140-L200 PolarHBondContact NZ-O 3.16Å; L145-L200 HydrophobicContact CD1-CB 4.25Å; L145-L200 HydrophobicContact CD1-CD2 3.7Å; L147-L200 HydrophobicContact CD1-CD1 4.2Å; I149-L200 HydrophobicContact CD1-CD1 4.02Å; I149-L200 HydrophobicContact CG1-CD1 4.09Å; I180-L200 HydrophobicContact CD1-CD1 4.25Å; I183-L200 HydrophobicContact CD1-CD2 3.5Å; I183-L200 HydrophobicContact CD1-CG 3.68Å; I183-L200 HydrophobicContact CG1-CD2 4.43Å; V196-L200 HydrophobicContact CG1-CD1 4.2Å; V196-L200 WeakPolarHBondContact O-CG 3.47Å; V196-L200 PolarHBondContact O-N 2.82Å; A197-L200 PolarHBondContact O-N 3.26Å; K198-L200 VanDerWaalsContact C-N 3.34Å; K198-L200 PolarHBondContact O-N 3.05Å; L200-L203 HydrophobicContact CD2-CD1 4.16Å; L200-F209 HydrophobicContact CD2-CE2 4.33Å
201	K	90.7	Very high	93.7	Very high	141 Å²	141	59.4 Å²	59.4	61%	0.613	29%	0.293	S	S	*	.	H	α-helix	trans	-67	-40.3	176.3	-164.5	173.6	-174.5	172.6	0	111.8	K140 A197 K198 M199	K140-K201 PolarHBondContact NZ-O 3.33Å; A197-K201 WeakPolarHBondContact O-CB 3.44Å; A197-K201 PolarHBondContact O-N 3.04Å; K198-K201 WeakPolarHBondContact O-CB 3.41Å; K198-K201 PolarHBondContact O-N 3.33Å; K198-K201 VanDerWaalsContact O-N 3.11Å; M199-K201 VanDerWaalsContact C-N 3.34Å; M199-K201 PolarHBondContact O-N 3.28Å
202	E	92.1	Very high	93.9	Very high	133 Å²	133	61.1 Å²	61.1	62%	0.621	30%	0.297	S	S	*	.	H	α-helix	trans	-79.4	-14.2	-178.9	-70.8	176	168.2	0	0	114.7	K198 M199	K198-E202 WeakPolarHBondContact CE-OE1 3.22Å; K198-E202 HydrophobicContact CG-CG 4.3Å; K198-E202 IonicContact NZ-OE1 3.96Å; K198-E202 WeakPolarHBondContact O-CB 3.13Å; K198-E202 WeakPolarHBondContact O-CG 3.27Å; K198-E202 PolarHBondContact O-N 3.16Å; M199-E202 PolarHBondContact O-N 3.24Å
203	L	94.1	Very high	94.2	Very high	15 Å²	15	58 Å²	58	8%	0.079	29%	0.285	C	S	.	.	S	Bend	trans	-51.2	137.6	174.3	-80.6	171.2	0	0	0	112	K140 I183 N184 M199 L200 K205 F209	K140-L203 HydrophobicContact CD-CB 3.65Å; K140-L203 WeakPolarHBondContact CD-O 3.19Å; K140-L203 WeakPolarHBondContact CE-O 3.48Å; K140-L203 PolarHBondContact NZ-O 2.97Å; I183-L203 HydrophobicContact CG2-CD1 4.17Å; I183-L203 HydrophobicContact CG2-CD2 4.06Å; N184-L203 WeakPolarHBondContact ND2-CD2 3.44Å; M199-L203 WeakPolarHBondContact O-CG 3.3Å; M199-L203 PolarHBondContact O-N 2.99Å; L200-L203 HydrophobicContact CD2-CD1 4.16Å; L203-K205 PolarHBondContact O-N 3.2Å; L203-F209 HydrophobicContact CD1-CB 4.17Å; L203-F209 HydrophobicContact CD1-CD1 3.85Å; L203-F209 HydrophobicContact CD1-CD2 3.61Å; L203-F209 HydrophobicContact CD1-CE1 4.07Å; L203-F209 HydrophobicContact CD1-CE2 3.84Å; L203-F209 HydrophobicContact CD1-CG 3.61Å; L203-F209 HydrophobicContact CD1-CZ 4.07Å; L203-F209 HydrophobicContact CD2-CB 4.04Å; L203-F209 HydrophobicContact CD2-CG 4.4Å
204	P	93.7	Very high	94.5	Very high	66 Å²	66	58.1 Å²	58.1	43%	0.429	29%	0.286	S	S	.	.	P	Polyproline II helix	trans	-68.1	125.4	-177.4	26.8	-34.6	0	0	0	112.2	K207	P204-K207 HydrophobicContact CB-CD 4.08Å; P204-K207 HydrophobicContact CB-CG 4.45Å; P204-K207 HydrophobicContact CG-CB 4.33Å; P204-K207 HydrophobicContact CG-CD 3.85Å; P204-K207 HydrophobicContact CG-CG 4.41Å
205	K	94.7	Very high	94.8	Very high	110 Å²	110	57.2 Å²	57.2	48%	0.478	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.1	148.9	174.8	-59	165.2	78.3	171.8	0	110.8	K140 D143 L203 K207	K140-K205 CarbonylContact O-C 3.57Å; K140-K205 WeakPolarHBondContact O-CA 3.36Å; D143-K205 VanDerWaalsContact OD1-CD 3.29Å; D143-K205 WeakPolarHBondContact OD1-CD 3.48Å; D143-K205 VanDerWaalsContact OD1-CE 3.22Å; D143-K205 WeakPolarHBondContact OD1-CE 3.32Å; D143-K205 IonicContact OD1-NZ 2.64Å; D143-K205 PolarHBondContact OD1-NZ 2.61Å; D143-K205 WeakPolarHBondContact OD2-CE 3.45Å; D143-K205 IonicContact OD2-NZ 2.96Å; D143-K205 PolarHBondContact OD2-NZ 3.39Å; L203-K205 PolarHBondContact O-N 3.2Å; K205-K207 VanDerWaalsContact C-N 3.28Å; K205-K207 PolarHBondContact O-N 2.94Å
206	G	94.2	Very high	95	Very high	51 Å²	51	53.4 Å²	53.4	53%	0.526	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	72.7	16.5	-177.9	0	0	0	0	0	114.5	F139 K140	F139-G206 VanDerWaalsContact CE2-C 3.5Å; K140-G206 PolarHBondContact O-N 2.72Å
207	K	95.4	Very high	95	Very high	131 Å²	131	56.7 Å²	56.7	57%	0.57	28%	0.284	S	S	*	.	S	Bend	trans	-125.8	157.6	175.9	-64.3	-167	-178.1	179.8	0	111.8	K140 P204 K205	K140-K207 PolarHBondContact N-O 2.78Å; P204-K207 HydrophobicContact CB-CD 4.08Å; P204-K207 HydrophobicContact CB-CG 4.45Å; P204-K207 HydrophobicContact CG-CB 4.33Å; P204-K207 HydrophobicContact CG-CD 3.85Å; P204-K207 HydrophobicContact CG-CG 4.41Å; K205-K207 VanDerWaalsContact C-N 3.28Å; K205-K207 PolarHBondContact O-N 2.94Å
208	M	96.1	Very high	94.7	Very high	89 Å²	89	60.5 Å²	60.5	44%	0.438	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.6	149.7	164.7	-54.6	-55.8	-71.5	0	0	110.4	E137 I138 F139	E137-M208 HydrophobicContact CB-CE 4.25Å; E137-M208 HydrophobicContact CG-CB 3.97Å; E137-M208 HydrophobicContact CG-CE 3.67Å; E137-M208 HydrophobicContact CG-CG 4.48Å; E137-M208 WeakPolarHBondContact OE1-CB 3.47Å; E137-M208 WeakPolarHBondContact OE1-CG 3.47Å; I138-M208 CarbonylContact O-C 3.03Å; I138-M208 VanDerWaalsContact O-CA 3.3Å; I138-M208 WeakPolarHBondContact O-CA 3.49Å; F139-M208 HydrophobicContact CB-CE 4.33Å; F139-M208 HydrophobicContact CB-SD 3.64Å; F139-M208 HydrophobicContact CD2-SD 3.74Å; F139-M208 HydrophobicContact CG-SD 4.18Å
209	F	96.8	Very high	94.2	Very high	6 Å²	6	56.2 Å²	56.2	3%	0.026	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	150.9	163.9	69.8	-84.4	0	0	0	109.9	E137 I138 K140 L145 I183 N184 L200 L203 I211	E137-F209 CarbonylContact C-O 3.57Å; E137-F209 WeakPolarHBondContact CA-O 3.4Å; I138-F209 HydrophobicContact CB-CD1 4.15Å; I138-F209 HydrophobicContact CB-CE1 3.64Å; I138-F209 HydrophobicContact CB-CE2 4.19Å; I138-F209 HydrophobicContact CB-CZ 3.67Å; I138-F209 HydrophobicContact CD1-CE2 4.12Å; I138-F209 HydrophobicContact CD1-CZ 3.97Å; I138-F209 HydrophobicContact CG1-CZ 4.34Å; I138-F209 HydrophobicContact CG2-CD1 4.5Å; I138-F209 HydrophobicContact CG2-CE1 3.62Å; I138-F209 HydrophobicContact CG2-CZ 3.73Å; I138-F209 PolarHBondContact N-O 3.36Å; I138-F209 WeakPolarHBondContact O-CD1 3.39Å; I138-F209 PolarHBondContact O-N 2.8Å; K140-F209 HydrophobicContact CB-CD1 4.16Å; K140-F209 HydrophobicContact CB-CE1 4.1Å; L145-F209 HydrophobicContact CD1-CE1 4.17Å; L145-F209 HydrophobicContact CD1-CE2 4.47Å; L145-F209 HydrophobicContact CD1-CZ 3.63Å; L145-F209 HydrophobicContact CD2-CE1 4Å; L145-F209 HydrophobicContact CD2-CZ 4.11Å; I183-F209 HydrophobicContact CG2-CD2 4.3Å; N184-F209 VanDerWaalsContact OD1-CA 3.26Å; N184-F209 WeakPolarHBondContact OD1-CA 3.27Å; N184-F209 WeakPolarHBondContact OD1-CB 3.13Å; L200-F209 HydrophobicContact CD2-CE2 4.33Å; L203-F209 HydrophobicContact CD1-CB 4.17Å; L203-F209 HydrophobicContact CD1-CD1 3.85Å; L203-F209 HydrophobicContact CD1-CD2 3.61Å; L203-F209 HydrophobicContact CD1-CE1 4.07Å; L203-F209 HydrophobicContact CD1-CE2 3.84Å; L203-F209 HydrophobicContact CD1-CG 3.61Å; L203-F209 HydrophobicContact CD1-CZ 4.07Å; L203-F209 HydrophobicContact CD2-CB 4.04Å; L203-F209 HydrophobicContact CD2-CG 4.4Å; F209-I211 HydrophobicContact CE2-CB 4.27Å
210	I	97.1	Very high	92.9	Very high	63 Å²	63	61.8 Å²	61.8	32%	0.323	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	130.8	176.5	-63	170.3	0	0	0	108.8	E135 I136 E137 I183 N184	E135-I210 HydrophobicContact CG-CG2 3.81Å; I136-I210 WeakPolarHBondContact O-CA 3.45Å; E137-I210 HydrophobicContact CB-CG1 4.38Å; E137-I210 HydrophobicContact CG-CG1 4Å; I183-I210 CarbonylContact C-O 3.53Å; I183-I210 WeakPolarHBondContact CA-O 3.39Å; N184-I210 PolarHBondContact N-O 2.97Å; N184-I210 PolarHBondContact OD1-N 3.04Å
211	I	97.5	Very high	91	Very high	4 Å²	4	68.1 Å²	68.1	2%	0.021	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	133.6	170.1	-164.6	166.8	0	0	0	109.9	E135 I136 I138 I180 I183 F209 L213	E135-I211 WeakPolarHBondContact CA-O 3.33Å; I136-I211 HydrophobicContact CB-CG2 4.19Å; I136-I211 HydrophobicContact CD1-CG2 4.3Å; I136-I211 PolarHBondContact N-O 2.9Å; I136-I211 PolarHBondContact O-N 2.91Å; I138-I211 HydrophobicContact CD1-CG2 3.57Å; I138-I211 HydrophobicContact CG1-CG2 4.37Å; I180-I211 HydrophobicContact CD1-CD1 4.32Å; I180-I211 HydrophobicContact CG1-CD1 4.29Å; I180-I211 HydrophobicContact CG2-CD1 4.01Å; I180-I211 HydrophobicContact CG2-CG1 4.1Å; I183-I211 HydrophobicContact CG1-CD1 4.34Å; I183-I211 HydrophobicContact CG1-CG1 4.19Å; F209-I211 HydrophobicContact CE2-CB 4.27Å; I211-L213 HydrophobicContact CD1-CD2 3.81Å; I211-L213 HydrophobicContact CG1-CD2 3.83Å; I211-L213 HydrophobicContact CG1-CG 4.28Å; I211-L213 HydrophobicContact CG2-CG 4.4Å
212	K	97.9	Very high	88.7	Confident	62 Å²	62	70 Å²	70	27%	0.27	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	124.7	170.2	-57.1	-174.5	-161.3	-100.6	0	108.7	K134 E135 E181 S182	K134-K212 CarbonylContact O-C 3.59Å; K134-K212 WeakPolarHBondContact O-CA 3.19Å; E135-K212 HydrophobicContact CB-CG 4.42Å; E135-K212 HydrophobicContact CG-CG 4.04Å; E135-K212 WeakPolarHBondContact OE1-CE 3.38Å; E135-K212 IonicContact OE1-NZ 2.69Å; E135-K212 PolarHBondContact OE1-NZ 3.21Å; E135-K212 IonicContact OE2-NZ 2.68Å; E135-K212 PolarHBondContact OE2-NZ 2.88Å; E181-K212 HydrophobicContact CB-CB 4.48Å; E181-K212 PolarHBondContact N-O 2.87Å; S182-K212 PolarHBondContact N-O 2.95Å; S182-K212 PolarHBondContact O-N 3.17Å; S182-K212 WeakPolarHBondContact OG-CB 3.23Å; S182-K212 VanDerWaalsContact OG-CD 3.31Å; S182-K212 WeakPolarHBondContact OG-CD 3.34Å; S182-K212 VanDerWaalsContact OG-CG 3.31Å; S182-K212 WeakPolarHBondContact OG-CG 3.39Å
213	L	98	Very high	86.6	Confident	1 Å²	1	70.5 Å²	70.5	1%	0.005	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	154.2	-177.1	-60.4	179.3	0	0	0	111.1	K133 K134 I136 I174 D178 M179 I180 I211	K133-L213 WeakPolarHBondContact CA-O 3.48Å; K134-L213 HydrophobicContact CB-CB 4.36Å; K134-L213 PolarHBondContact N-O 2.72Å; K134-L213 PolarHBondContact O-N 2.98Å; I136-L213 HydrophobicContact CD1-CD1 3.87Å; I136-L213 HydrophobicContact CD1-CG 4.21Å; I174-L213 HydrophobicContact CB-CD1 4.29Å; I174-L213 HydrophobicContact CD1-CD1 4.46Å; I174-L213 HydrophobicContact CG1-CD1 3.84Å; I174-L213 HydrophobicContact CG2-CD1 3.89Å; D178-L213 HydrophobicContact CB-CB 4.28Å; D178-L213 HydrophobicContact CB-CD1 4.1Å; D178-L213 HydrophobicContact CB-CD2 4.41Å; M179-L213 CarbonylContact O-C 3.59Å; M179-L213 WeakPolarHBondContact O-CA 3.5Å; I180-L213 HydrophobicContact CB-CD2 4.31Å; I180-L213 HydrophobicContact CG1-CD2 3.76Å; I211-L213 HydrophobicContact CD1-CD2 3.81Å; I211-L213 HydrophobicContact CG1-CD2 3.83Å; I211-L213 HydrophobicContact CG1-CG 4.28Å; I211-L213 HydrophobicContact CG2-CG 4.4Å
214	V	97.8	Very high	84.1	Confident	1 Å²	1	72.6 Å²	72.6	1%	0.006	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	118.4	167.9	-169	0	0	0	0	108.6	M100 K130 K133 M179 E181	M100-V214 WeakPolarHBondContact CE-O 3.22Å; K130-V214 HydrophobicContact CB-CG1 3.9Å; K130-V214 HydrophobicContact CD-CG1 4.5Å; K130-V214 HydrophobicContact CG-CG1 4.01Å; K133-V214 HydrophobicContact CG-CG2 4.21Å; M179-V214 HydrophobicContact CB-CB 4.35Å; M179-V214 PolarHBondContact N-O 3.2Å; M179-V214 PolarHBondContact O-N 2.85Å; E181-V214 HydrophobicContact CB-CG2 4.28Å
215	E	96.4	Very high	81.7	Confident	40 Å²	40	77.9 Å²	77.9	19%	0.187	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	139.6	176.6	-167.7	167.1	158.3	0	0	110.2	G131 Q132 K134 D178 K218	G131-E215 CarbonylContact C-O 3.48Å; G131-E215 WeakPolarHBondContact CA-O 3.46Å; G131-E215 PolarHBondContact N-O 2.89Å; Q132-E215 PolarHBondContact O-N 3.39Å; K134-E215 WeakPolarHBondContact CE-OE2 3.24Å; K134-E215 IonicContact NZ-OE2 3.67Å; K134-E215 PolarHBondContact NZ-OE2 3.14Å; D178-E215 WeakPolarHBondContact OD1-CA 3.3Å; D178-E215 WeakPolarHBondContact OD1-CB 3.42Å; D178-E215 WeakPolarHBondContact OD1-CG 3.42Å; E215-K218 WeakPolarHBondContact OE1-CE 3.45Å; E215-K218 IonicContact OE1-NZ 3.36Å; E215-K218 PolarHBondContact OE1-NZ 3.27Å
216	P	96.6	Very high	79.2	Confident	4 Å²	4	84.7 Å²	84.7	3%	0.026	43%	0.428	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.3	142.9	172.1	27.4	-34.2	0	0	0	111.1	M100 F101 V109 H128 I129 G177 K218	M100-P216 HydrophobicContact CE-CB 4.19Å; M100-P216 WeakPolarHBondContact SD-CA 3.15Å; M100-P216 HydrophobicContact SD-CB 3.71Å; F101-P216 HydrophobicContact CE1-CB 4.37Å; F101-P216 HydrophobicContact CE1-CG 4.36Å; F101-P216 HydrophobicContact CZ-CB 4.36Å; F101-P216 HydrophobicContact CZ-CG 4.23Å; V109-P216 HydrophobicContact CG2-CG 3.81Å; H128-P216 HydrophobicContact CB-CB 4.07Å; I129-P216 WeakPolarHBondContact O-CA 3.48Å; G177-P216 WeakPolarHBondContact O-CD 3.37Å; P216-K218 PolarHBondContact O-N 2.85Å
217	L	94.7	Very high	76.9	Confident	69 Å²	69	86.3 Å²	86.3	36%	0.361	43%	0.431	S	S	.	.			trans	-62.6	111.5	168.7	-72.1	-178.7	0	0	0	109.4	H68 I129 G131	H68-L217 HydrophobicContact CB-CB 3.86Å; I129-L217 HydrophobicContact CD1-CD1 4.11Å; I129-L217 HydrophobicContact CG1-CB 4.41Å; I129-L217 HydrophobicContact CG1-CD1 3.98Å; I129-L217 HydrophobicContact CG1-CG 4.46Å; I129-L217 PolarHBondContact O-N 3.04Å; G131-L217 VanDerWaalsContact CA-CD2 3.45Å
218	K	86.7	Confident	74.4	Confident	89 Å²	89	85.5 Å²	85.5	39%	0.387	44%	0.442	S	S	.	.			trans	-86.1	149.8	172.8	-66.5	161.4	-177.1	170.1	0	109.6	V109 E215 P216	V109-K218 HydrophobicContact CG2-CG 4.41Å; E215-K218 WeakPolarHBondContact OE1-CE 3.45Å; E215-K218 IonicContact OE1-NZ 3.36Å; E215-K218 PolarHBondContact OE1-NZ 3.27Å; P216-K218 PolarHBondContact O-N 2.85Å
219	A	80	Confident	71.9	Confident	33 Å²	33	85.2 Å²	85.2	27%	0.273	46%	0.462	S	S	.	.			trans	-66.2	147.1	170.3	0	0	0	0	0	110.4	D221	A219-D221 PolarHBondContact O-N 3.03Å
220	F	66.6	Low	69.1	Low	179 Å²	179	90 Å²	90	79%	0.785	50%	0.496	S	S	*	.			trans	-74.2	110.9	169.9	-72.2	-86.1	0	0	0	109.8	M222 I223	F220-M222 PolarHBondContact O-N 3.32Å; F220-I223 PolarHBondContact O-N 2.94Å
221	D	54.9	Low	66.4	Low	143 Å²	143	98.7 Å²	98.7	77%	0.765	53%	0.525	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.2	-10.7	174.6	-72.4	-59.8	0	0	0	113.9	A219	A219-D221 PolarHBondContact O-N 3.03Å
222	M	42.1	Very low	63.5	Low	180 Å²	180	104 Å²	104	89%	0.887	56%	0.562	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.3	-6.6	-180	-66	-152.2	73	0	0	115.6	F220	F220-M222 PolarHBondContact O-N 3.32Å
223	I	47.2	Very low	60.5	Low	144 Å²	144	104.1 Å²	104.1	74%	0.738	58%	0.581	S	S	*	*	S	Bend	trans	-101	74.2	170.3	-50.5	-176.2	0	0	0	109.7	F220 Q225	F220-I223 PolarHBondContact O-N 2.94Å; I223-Q225 PolarHBondContact O-N 3.49Å
224	G	42.2	Very low	57.8	Low	59 Å²	59	109.7 Å²	109.7	61%	0.608	62%	0.62	S	S	*	*			trans	-55.6	124	169.3	0	0	0	0	0	110.5	R226	G224-R226 PolarHBondContact O-N 2.83Å
225	Q	43.5	Very low	54.7	Low	178 Å²	178	113.2 Å²	113.2	83%	0.832	66%	0.657	S	S	*	*			trans	-59.6	102.2	-169.8	-68	179.8	-74.7	0	0	112.2	I223 S227	I223-Q225 PolarHBondContact O-N 3.49Å; Q225-S227 PolarHBondContact O-N 3.42Å
226	R	42.3	Very low	51.7	Low	253 Å²	253	116.9 Å²	116.9	96%	0.955	68%	0.682	S	S	*	*			trans	-77.3	43.8	166.5	-71.4	-171.8	170.4	-160.4	-2	111.9	G224 S228	G224-R226 PolarHBondContact O-N 2.83Å; R226-S228 PolarHBondContact O-N 2.96Å
227	S	46.1	Very low	49.1	Very low	84 Å²	84	126.1 Å²	126.1	59%	0.587	73%	0.725	S	S	*	*			trans	-77.9	109.3	169	49.6	0	0	0	0	109.2	Q225 G229	Q225-S227 PolarHBondContact O-N 3.42Å; S227-G229 PolarHBondContact O-N 3.41Å
228	S	41.5	Very low	46.2	Very low	115 Å²	115	129.3 Å²	129.3	80%	0.804	74%	0.741	S	S	*	*			trans	-48.1	133.7	169.5	50.2	0	0	0	0	111.1	R226 S230	R226-S228 PolarHBondContact O-N 2.96Å; S228-S230 PolarHBondContact O-N 2.94Å
229	G	44.6	Very low	43.7	Very low	83 Å²	83	128.5 Å²	128.5	86%	0.856	76%	0.758	S	S	*	*			trans	-60.1	108	-165.4	0	0	0	0	0	115.1	S227	S227-G229 PolarHBondContact O-N 3.41Å
230	S	37.4	Very low	42	Very low	106 Å²	106	132.7 Å²	132.7	74%	0.741	78%	0.78	S	S	*	*			trans	-89.7	128.9	148.7	-174.1	0	0	0	0	108	S228 S232	S228-S230 PolarHBondContact O-N 2.94Å; S230-S232 PolarHBondContact O-N 2.84Å; S230-S232 VanDerWaalsContact O-N 3.13Å
231	R	40.7	Very low	41.2	Very low	245 Å²	245	127.6 Å²	127.6	93%	0.925	78%	0.778	S	S	*	*			trans	-82.1	90.2	175.4	-65.3	172.6	84.2	155.6	3.7	107.8	G233	R231-G233 PolarHBondContact O-N 3.13Å
232	S	36.9	Very low	42	Very low	116 Å²	116	126.7 Å²	126.7	81%	0.811	76%	0.764	S	S	*	*			trans	-54.8	108.3	164.7	-62.1	0	0	0	0	108.1	S230	S230-S232 PolarHBondContact O-N 2.84Å; S230-S232 VanDerWaalsContact O-N 3.13Å
233	G	34.9	Very low	43.7	Very low	65 Å²	65	119 Å²	119	67%	0.67	73%	0.731	S	S	*	*			trans	-61.6	145.1	177.2	0	0	0	0	0	109.9	R231 G235	R231-G233 PolarHBondContact O-N 3.13Å; G233-G235 PolarHBondContact O-N 3.43Å
234	S	40.2	Very low	45.5	Very low	117 Å²	117	112.2 Å²	112.2	82%	0.818	70%	0.696	S	S	*	*			trans	-60.9	100.9	171.6	50.3	0	0	0	0	109.2	V236	S234-V236 PolarHBondContact O-N 3.43Å
235	G	33.2	Very low	47.6	Very low	75 Å²	75	109.8 Å²	109.8	77%	0.773	67%	0.669	S	S	*	*			trans	-58.5	118.7	175.2	0	0	0	0	0	109.3	G233 Q237	G233-G235 PolarHBondContact O-N 3.43Å; G235-Q237 PolarHBondContact O-N 3.45Å
236	V	33.8	Very low	49.7	Very low	118 Å²	118	101.3 Å²	101.3	72%	0.715	63%	0.629	S	S	*	*			trans	-66.8	124.1	179.4	179.8	0	0	0	0	108.1	S234 L238	S234-V236 PolarHBondContact O-N 3.43Å; V236-L238 HydrophobicContact CB-CD1 4.37Å; V236-L238 HydrophobicContact CG1-CD1 3.93Å; V236-L238 HydrophobicContact CG1-CG 4.04Å; V236-L238 PolarHBondContact O-N 2.92Å
237	Q	42.5	Very low	51.7	Low	198 Å²	198	89.3 Å²	89.3	93%	0.925	58%	0.584	S	S	*	*			trans	-72.3	78.2	179	-171.9	172.8	-11.2	0	0	110.5	G235	G235-Q237 PolarHBondContact O-N 3.45Å
238	L	33	Very low	53.4	Low	136 Å²	136	88 Å²	88	71%	0.712	57%	0.567	S	S	*	*			trans	-95.7	89.1	175.1	-91.6	156.2	0	0	0	109.5	V236 T240	V236-L238 HydrophobicContact CB-CD1 4.37Å; V236-L238 HydrophobicContact CG1-CD1 3.93Å; V236-L238 HydrophobicContact CG1-CG 4.04Å; V236-L238 PolarHBondContact O-N 2.92Å; L238-T240 PolarHBondContact O-N 3.05Å
239	G	34.4	Very low	55	Low	71 Å²	71	86.1 Å²	86.1	73%	0.732	55%	0.553	S	S	*	*			trans	-81.4	92	178	0	0	0	0	0	112.8
240	T	43.8	Very low	56.3	Low	122 Å²	122	88.3 Å²	88.3	75%	0.748	54%	0.539	S	S	*	.	S	Bend	trans	-143	109.4	163.6	54.8	0	0	0	0	110	L238	L238-T240 PolarHBondContact O-N 3.05Å
241	G	51.1	Low	58	Low	72 Å²	72	85.6 Å²	85.6	74%	0.742	53%	0.528	S	S	*	.			trans	65.9	44.4	167.3	0	0	0	0	0	116.8	G243	G241-G243 PolarHBondContact O-N 2.71Å
242	R	70.7	Confident	59.6	Low	124 Å²	124	78.5 Å²	78.5	47%	0.468	51%	0.513	S	S	.	.			trans	-79.2	112.1	165.7	-70.4	172.9	74.3	86.3	-11	108.6	E122 L258	E122-R242 VanDerWaalsContact CD-NH2 3.25Å; E122-R242 IonicContact OE1-CZ 3.66Å; E122-R242 IonicContact OE1-NH1 2.85Å; E122-R242 PolarHBondContact OE1-NH1 2.73Å; E122-R242 IonicContact OE1-NH2 3.79Å; E122-R242 IonicContact OE2-CZ 3.24Å; E122-R242 VanDerWaalsContact OE2-CZ 3.24Å; E122-R242 IonicContact OE2-NH1 2.86Å; E122-R242 PolarHBondContact OE2-NH1 2.86Å; E122-R242 IonicContact OE2-NH2 2.72Å; E122-R242 PolarHBondContact OE2-NH2 3.2Å; R242-L258 HydrophobicContact CB-CD1 4.1Å; R242-L258 WeakPolarHBondContact O-CD1 3.22Å; R242-L258 WeakPolarHBondContact O-CG 3.5Å
243	G	77.2	Confident	61.8	Low	18 Å²	18	74.2 Å²	74.2	19%	0.186	49%	0.485	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.6	162.3	174.8	0	0	0	0	0	113	L121 G241 E256	L121-G243 WeakPolarHBondContact CG-O 3.12Å; L121-G243 PolarHBondContact N-O 3.4Å; G241-G243 PolarHBondContact O-N 2.71Å; G243-E256 WeakPolarHBondContact CA-O 3.25Å
244	T	84.6	Confident	64.2	Low	1 Å²	1	73.5 Å²	73.5	1%	0.006	47%	0.468	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	148.7	175.4	-170.1	0	0	0	0	110.6	I119 V255 E256 L258	I119-T244 PolarHBondContact O-OG1 2.89Å; T244-V255 WeakPolarHBondContact O-CA 3.46Å; T244-E256 HydrophobicContact CG2-CB 4.39Å; T244-E256 PolarHBondContact N-O 2.91Å; T244-E256 PolarHBondContact O-N 3.16Å; T244-L258 HydrophobicContact CG2-CD2 4.32Å
245	L	86.8	Confident	66.3	Low	8 Å²	8	72.2 Å²	72.2	4%	0.042	46%	0.455	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	104	169.4	179.7	62.8	0	0	0	108.4	L60 F62 F78 Q118 I119 L247 A253 V255	L60-L245 HydrophobicContact CD1-CD1 3.9Å; L60-L245 HydrophobicContact CD1-CD2 4.21Å; L60-L245 HydrophobicContact CD1-CG 4.44Å; F62-L245 HydrophobicContact CE2-CD2 3.67Å; F62-L245 HydrophobicContact CZ-CB 4.08Å; F62-L245 HydrophobicContact CZ-CD2 3.65Å; F78-L245 HydrophobicContact CD2-CD2 4.48Å; F78-L245 HydrophobicContact CE2-CD2 3.69Å; F78-L245 HydrophobicContact CZ-CD2 4.16Å; Q118-L245 WeakPolarHBondContact CA-O 3.45Å; I119-L245 HydrophobicContact CB-CB 4.48Å; I119-L245 PolarHBondContact N-O 2.81Å; I119-L245 PolarHBondContact O-N 2.78Å; L245-L247 HydrophobicContact CD2-CD2 4.15Å; L245-L247 HydrophobicContact CG-CD2 4.04Å; L245-L247 PolarHBondContact O-N 3.39Å; L245-A253 HydrophobicContact CD1-CB 3.85Å; L245-V255 HydrophobicContact CD1-CG2 4.39Å
246	R	87.6	Confident	68.7	Low	0 Å²	0	71.4 Å²	71.4	0%	0	43%	0.431	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	115.9	174.4	-173.4	79.3	174.3	77.5	5	108.5	G117 R248 A253 T254 E256 E284 E291	G117-R246 PolarHBondContact O-NH1 3.21Å; R246-R248 HydrophobicContact CG-CG 3.86Å; R246-A253 WeakPolarHBondContact O-CA 3.36Å; R246-A253 WeakPolarHBondContact O-CB 3.38Å; R246-T254 PolarHBondContact N-O 3.34Å; R246-T254 PolarHBondContact O-N 3.24Å; R246-T254 VanDerWaalsContact O-N 3.13Å; R246-E256 HydrophobicContact CB-CG 4.31Å; R246-E256 WeakPolarHBondContact CB-OE2 3.4Å; R246-E256 VanDerWaalsContact CG-OE2 3.31Å; R246-E256 WeakPolarHBondContact CG-OE2 3.27Å; R246-E284 IonicContact CZ-OE1 3.02Å; R246-E284 IonicContact NH1-OE1 2.76Å; R246-E284 PolarHBondContact NH1-OE1 3.04Å; R246-E284 VanDerWaalsContact NH1-OE1 3.16Å; R246-E284 IonicContact NH2-OE1 3.38Å; R246-E291 IonicContact CZ-OE1 2.75Å; R246-E291 VanDerWaalsContact CZ-OE1 3.32Å; R246-E291 IonicContact NE-OE1 2.81Å; R246-E291 PolarHBondContact NE-OE1 2.81Å; R246-E291 IonicContact NH2-OE1 3.73Å; R246-E291 PolarHBondContact NH2-OE1 2.95Å
247	L	84.2	Confident	70.9	Confident	1 Å²	1	73.6 Å²	73.6	1%	0.005	43%	0.433	C	S	.	.			trans	-96.6	115.9	170	-59.4	-174.7	0	0	0	107.8	F78 V81 L84 G117 I119 L245 A253	F78-L247 HydrophobicContact CD2-CD2 4.36Å; F78-L247 HydrophobicContact CE2-CD1 4.47Å; F78-L247 HydrophobicContact CE2-CD2 4.34Å; V81-L247 HydrophobicContact CG2-CB 4.27Å; V81-L247 HydrophobicContact CG2-CD1 3.85Å; L84-L247 HydrophobicContact CD2-CD1 4.27Å; G117-L247 PolarHBondContact O-N 2.73Å; G117-L247 VanDerWaalsContact O-O 3.1Å; I119-L247 HydrophobicContact CD1-CD1 3.87Å; I119-L247 HydrophobicContact CG1-CD1 4.42Å; L245-L247 HydrophobicContact CD2-CD2 4.15Å; L245-L247 HydrophobicContact CG-CD2 4.04Å; L245-L247 PolarHBondContact O-N 3.39Å; L247-A253 HydrophobicContact CD2-CB 3.64Å
248	R	82.8	Confident	72.6	Confident	58 Å²	58	68.1 Å²	68.1	22%	0.219	41%	0.41	C	S	.	.			trans	-100.8	143.2	-175.9	-64	176.4	173	-80.9	-2.9	110.6	R246 T254 E256 E284 E291	R246-R248 HydrophobicContact CG-CG 3.86Å; R248-T254 PolarHBondContact NE-OG1 2.87Å; R248-E256 IonicContact CZ-OE1 3.67Å; R248-E256 IonicContact NE-OE1 2.67Å; R248-E256 PolarHBondContact NE-OE1 3.35Å; R248-E256 IonicContact NH2-OE1 2.62Å; R248-E256 PolarHBondContact NH2-OE1 3.47Å; R248-E256 IonicContact NH2-OE2 3.68Å; R248-E256 PolarHBondContact NH2-OE2 3.13Å; R248-E284 WeakPolarHBondContact CA-OE1 3.38Å; R248-E291 IonicContact CZ-OE2 3.52Å; R248-E291 VanDerWaalsContact CZ-OE2 3.22Å; R248-E291 IonicContact NH1-OE1 3.82Å; R248-E291 IonicContact NH1-OE2 2.69Å; R248-E291 PolarHBondContact NH1-OE2 2.99Å; R248-E291 IonicContact NH2-OE1 2.79Å; R248-E291 IonicContact NH2-OE2 3.68Å; R248-E291 PolarHBondContact NH2-OE2 2.98Å
249	S	74.6	Confident	74.7	Confident	74 Å²	74	62.9 Å²	62.9	52%	0.517	38%	0.384	S	S	.	.	S	Bend	trans	-72.8	-32.5	173.2	53.4	0	0	0	0	112.8	E284	S249-E284 WeakPolarHBondContact CB-OE2 3.48Å; S249-E284 PolarHBondContact N-OE1 3.48Å; S249-E284 VanDerWaalsContact N-OE1 3.09Å; S249-E284 PolarHBondContact N-OE2 2.81Å; S249-E284 PolarHBondContact OG-OE2 3.33Å
250	K	72	Confident	77	Confident	129 Å²	129	61.8 Å²	61.8	56%	0.561	37%	0.365	S	S	*	.	S	Bend	trans	-118.8	104.1	170.7	-67	-177	177.7	-178	0	109.2	T309	K250-T309 PolarHBondContact NZ-O 3.34Å
251	G	72.9	Confident	78.7	Confident	49 Å²	49	59.5 Å²	59.5	51%	0.505	36%	0.359	S	S	.	.	S	Bend	trans	124	172.4	176.4	0	0	0	0	0	114.6
252	P	74.3	Confident	80.2	Confident	96 Å²	96	59.8 Å²	59.8	62%	0.623	34%	0.34	S	S	*	.			trans	-76.2	153.3	174.7	33.3	-35	0	0	0	111.5
253	A	82.7	Confident	80.8	Confident	27 Å²	27	55.9 Å²	55.9	22%	0.223	33%	0.327	C	S	.	.			trans	-63	140.6	171.9	0	0	0	0	0	113.2	S79 L245 R246 L247	S79-A253 VanDerWaalsContact O-CB 3.24Å; S79-A253 WeakPolarHBondContact O-CB 3.31Å; S79-A253 PolarHBondContact O-N 2.84Å; S79-A253 VanDerWaalsContact O-N 3.14Å; L245-A253 HydrophobicContact CD1-CB 3.85Å; R246-A253 WeakPolarHBondContact O-CA 3.36Å; R246-A253 WeakPolarHBondContact O-CB 3.38Å; L247-A253 HydrophobicContact CD2-CB 3.64Å
254	T	85.4	Confident	81.2	Confident	49 Å²	49	60 Å²	60	30%	0.301	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	147.3	-176.7	35.9	0	0	0	0	110.6	R246 R248 E256	R246-T254 PolarHBondContact N-O 3.34Å; R246-T254 PolarHBondContact O-N 3.24Å; R246-T254 VanDerWaalsContact O-N 3.13Å; R248-T254 PolarHBondContact NE-OG1 2.87Å; T254-E256 WeakPolarHBondContact CB-OE1 3.19Å; T254-E256 PolarHBondContact OG1-OE1 3.38Å
255	V	84.1	Confident	81.3	Confident	90 Å²	90	63.9 Å²	63.9	55%	0.545	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	116.8	167.4	-178.6	0	0	0	0	107.2	L60 T244 L245	L60-V255 HydrophobicContact CD1-CG2 3.74Å; T244-V255 WeakPolarHBondContact O-CA 3.46Å; L245-V255 HydrophobicContact CD1-CG2 4.39Å
256	E	83.6	Confident	81.4	Confident	58 Å²	58	63.5 Å²	63.5	27%	0.271	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	165	-174.2	-68.2	172.1	-169.8	0	0	108.9	G243 T244 R246 R248 T254	G243-E256 WeakPolarHBondContact CA-O 3.25Å; T244-E256 HydrophobicContact CG2-CB 4.39Å; T244-E256 PolarHBondContact N-O 2.91Å; T244-E256 PolarHBondContact O-N 3.16Å; R246-E256 HydrophobicContact CB-CG 4.31Å; R246-E256 WeakPolarHBondContact CB-OE2 3.4Å; R246-E256 VanDerWaalsContact CG-OE2 3.31Å; R246-E256 WeakPolarHBondContact CG-OE2 3.27Å; R248-E256 IonicContact CZ-OE1 3.67Å; R248-E256 IonicContact NE-OE1 2.67Å; R248-E256 PolarHBondContact NE-OE1 3.35Å; R248-E256 IonicContact NH2-OE1 2.62Å; R248-E256 PolarHBondContact NH2-OE1 3.47Å; R248-E256 IonicContact NH2-OE2 3.68Å; R248-E256 PolarHBondContact NH2-OE2 3.13Å; T254-E256 WeakPolarHBondContact CB-OE1 3.19Å; T254-E256 PolarHBondContact OG1-OE1 3.38Å
257	E	81.3	Confident	81.5	Confident	164 Å²	164	64.8 Å²	64.8	77%	0.766	36%	0.363	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70.8	155.4	163.9	-62.5	-163.8	153.2	0	0	109.3
258	L	76.6	Confident	81.8	Confident	84 Å²	84	70.7 Å²	70.7	44%	0.44	39%	0.39	S	S	.	.	P	Polyproline II helix	trans	-57.5	141.2	170.9	-78.6	163.9	0	0	0	109.6	R242 T244 S260	R242-L258 HydrophobicContact CB-CD1 4.1Å; R242-L258 WeakPolarHBondContact O-CD1 3.22Å; R242-L258 WeakPolarHBondContact O-CG 3.5Å; T244-L258 HydrophobicContact CG2-CD2 4.32Å; L258-S260 PolarHBondContact O-N 2.86Å
259	P	77.6	Confident	82.2	Confident	25 Å²	25	70.7 Å²	70.7	16%	0.162	39%	0.392	C	S	.	.	P	Polyproline II helix	trans	-51.1	143.5	172.7	-25.1	34	0	0	0	110.6	Q118 E263 E264	Q118-P259 VanDerWaalsContact OE1-CD 3.24Å; P259-E263 HydrophobicContact CB-CB 4.1Å; P259-E264 HydrophobicContact CB-CG 3.99Å
260	S	82.2	Confident	83	Confident	48 Å²	48	67.1 Å²	67.1	34%	0.336	37%	0.367	S	S	.	.	P	Polyproline II helix	trans	-61.3	147.6	168.9	61.4	0	0	0	0	109.4	L258 F262 E263 E264	L258-S260 PolarHBondContact O-N 2.86Å; S260-F262 CarbonylContact O-C 3.53Å; S260-F262 PolarHBondContact O-N 3.48Å; S260-F262 WeakPolarHBondContact OG-CB 3.33Å; S260-E263 WeakPolarHBondContact CB-OE2 3.29Å; S260-E263 PolarHBondContact N-OE2 3.34Å; S260-E263 WeakPolarHBondContact O-CA 3.39Å; S260-E263 PolarHBondContact O-N 2.97Å; S260-E263 VanDerWaalsContact OG-CD 3.27Å; S260-E263 WeakPolarHBondContact OG-CG 3.2Å; S260-E263 PolarHBondContact OG-N 2.9Å; S260-E263 PolarHBondContact OG-OE2 3.09Å; S260-E264 PolarHBondContact O-N 3.22Å
261	A	81.4	Confident	84	Confident	74 Å²	74	61.4 Å²	61.4	61%	0.612	34%	0.342	S	S	*	.	H	α-helix	trans	-56.3	-18.3	173.4	0	0	0	0	0	112.9	E264 K265	A261-E264 WeakPolarHBondContact CA-OE2 3.49Å; A261-K265 PolarHBondContact O-N 2.91Å
262	F	81.5	Confident	84.9	Confident	79 Å²	79	62.6 Å²	62.6	35%	0.346	34%	0.337	S	S	.	.	H	α-helix	trans	-63.2	-53.5	166.5	165.6	-107	0	0	0	112.4	S260 A266 A330 K331	S260-F262 CarbonylContact O-C 3.53Å; S260-F262 PolarHBondContact O-N 3.48Å; S260-F262 WeakPolarHBondContact OG-CB 3.33Å; F262-A266 PolarHBondContact O-N 2.65Å; F262-A330 HydrophobicContact CD2-CB 4.46Å; F262-A330 WeakPolarHBondContact CD2-O 3.37Å; F262-A330 HydrophobicContact CE2-CB 3.42Å; F262-A330 VanDerWaalsContact CE2-CB 3.42Å; F262-A330 WeakPolarHBondContact CE2-O 3.4Å; F262-A330 HydrophobicContact CZ-CB 4Å; F262-K331 HydrophobicContact CE1-CG 4.36Å; F262-K331 VanDerWaalsContact CE2-N 3.34Å; F262-K331 HydrophobicContact CZ-CB 4.41Å; F262-K331 HydrophobicContact CZ-CG 3.95Å
263	E	84.1	Confident	85.7	Confident	41 Å²	41	59.4 Å²	59.4	19%	0.192	32%	0.315	C	S	.	.	H	α-helix	trans	-70.6	-38.7	179.2	-68.2	155.3	128.2	0	0	112.4	P259 S260 K265 A266 I267 K294	P259-E263 HydrophobicContact CB-CB 4.1Å; S260-E263 WeakPolarHBondContact CB-OE2 3.29Å; S260-E263 PolarHBondContact N-OE2 3.34Å; S260-E263 WeakPolarHBondContact O-CA 3.39Å; S260-E263 PolarHBondContact O-N 2.97Å; S260-E263 VanDerWaalsContact OG-CD 3.27Å; S260-E263 WeakPolarHBondContact OG-CG 3.2Å; S260-E263 PolarHBondContact OG-N 2.9Å; S260-E263 PolarHBondContact OG-OE2 3.09Å; E263-K265 PolarHBondContact O-N 2.69Å; E263-A266 WeakPolarHBondContact O-CB 3.4Å; E263-A266 PolarHBondContact O-N 2.82Å; E263-A266 VanDerWaalsContact O-N 3.07Å; E263-I267 VanDerWaalsContact O-CG1 3.29Å; E263-I267 WeakPolarHBondContact O-CG1 3.28Å; E263-I267 PolarHBondContact O-N 3.02Å; E263-K294 WeakPolarHBondContact OE1-CE 3.12Å; E263-K294 IonicContact OE1-NZ 3.16Å; E263-K294 PolarHBondContact OE1-NZ 3.07Å
264	E	85.8	Confident	86.1	Confident	106 Å²	106	58.1 Å²	58.1	50%	0.495	30%	0.304	S	S	.	.	H	α-helix	trans	-52.3	-44.1	174.9	-65.2	-177.2	137.9	0	0	111.3	P259 S260 A261 I267 E268	P259-E264 HydrophobicContact CB-CG 3.99Å; S260-E264 PolarHBondContact O-N 3.22Å; A261-E264 WeakPolarHBondContact CA-OE2 3.49Å; E264-I267 WeakPolarHBondContact O-CB 3.45Å; E264-I267 PolarHBondContact O-N 3.38Å; E264-E268 PolarHBondContact O-N 3.38Å
265	K	86.7	Confident	86.4	Confident	81 Å²	81	58 Å²	58	35%	0.352	30%	0.3	S	S	.	.	H	α-helix	trans	-73.2	-27.7	-179.8	-161.7	170.2	-170.1	-179.3	0	113.7	A261 E263 K269 V335	A261-K265 PolarHBondContact O-N 2.91Å; E263-K265 PolarHBondContact O-N 2.69Å; K265-K269 PolarHBondContact O-N 2.99Å; K265-V335 HydrophobicContact CD-CB 4.29Å; K265-V335 HydrophobicContact CD-CG1 4.16Å; K265-V335 HydrophobicContact CG-CG1 4.46Å; K265-V335 PolarHBondContact NZ-O 3.16Å; K265-V335 PolarHBondContact NZ-OXT 3.33Å
266	A	88.9	Confident	86.6	Confident	0 Å²	0	57.8 Å²	57.8	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-70.4	-39.8	169.4	0	0	0	0	0	111	F262 E263 K269 V270 V290 A330	F262-A266 PolarHBondContact O-N 2.65Å; E263-A266 WeakPolarHBondContact O-CB 3.4Å; E263-A266 PolarHBondContact O-N 2.82Å; E263-A266 VanDerWaalsContact O-N 3.07Å; A266-K269 PolarHBondContact O-N 2.82Å; A266-V270 WeakPolarHBondContact O-CG2 3.34Å; A266-V270 PolarHBondContact O-N 3.06Å; A266-V270 VanDerWaalsContact O-N 3.07Å; A266-V290 HydrophobicContact CB-CG1 3.95Å; A266-V290 HydrophobicContact CB-CG2 3.92Å; A266-A330 HydrophobicContact CB-CB 4.16Å
267	I	89.8	Confident	86.8	Confident	28 Å²	28	58.3 Å²	58.3	14%	0.144	30%	0.303	C	S	.	.	H	α-helix	trans	-65.1	-43.1	177.4	-65.4	168.7	0	0	0	110.7	E263 E264 V270 D271 A286 A287 V290	E263-I267 VanDerWaalsContact O-CG1 3.29Å; E263-I267 WeakPolarHBondContact O-CG1 3.28Å; E263-I267 PolarHBondContact O-N 3.02Å; E264-I267 WeakPolarHBondContact O-CB 3.45Å; E264-I267 PolarHBondContact O-N 3.38Å; I267-V270 PolarHBondContact O-N 3.26Å; I267-D271 PolarHBondContact O-N 2.95Å; I267-A286 HydrophobicContact CG2-CB 3.98Å; I267-A287 HydrophobicContact CD1-CB 3.84Å; I267-A287 HydrophobicContact CG1-CB 4.32Å; I267-V290 HydrophobicContact CG1-CB 4.05Å; I267-V290 HydrophobicContact CG1-CG1 4.28Å; I267-V290 HydrophobicContact CG1-CG2 3.85Å
268	E	90.1	Very high	87	Confident	124 Å²	124	52.6 Å²	52.6	58%	0.579	28%	0.276	S	S	*	.	H	α-helix	trans	-58.4	-50.5	174.6	-173.9	176.4	-145.6	0	0	111.6	E264 V270 D271 D272	E264-E268 PolarHBondContact O-N 3.38Å; E268-V270 VanDerWaalsContact C-N 3.26Å; E268-V270 PolarHBondContact O-N 3.43Å; E268-D271 PolarHBondContact O-N 3.25Å; E268-D272 PolarHBondContact O-N 2.96Å
269	K	90.9	Very high	87.5	Confident	58 Å²	58	49.6 Å²	49.6	25%	0.252	27%	0.266	S	S	.	.	H	α-helix	trans	-54.7	-38.5	174.2	-87	-171.1	163.9	-171.7	0	113	K265 A266 L273 A326 D329	K265-K269 PolarHBondContact O-N 2.99Å; A266-K269 PolarHBondContact O-N 2.82Å; K269-L273 WeakPolarHBondContact O-CG 3.4Å; K269-L273 PolarHBondContact O-N 3.17Å; K269-L273 VanDerWaalsContact O-N 3.1Å; K269-A326 HydrophobicContact CB-CB 4.02Å; K269-A326 HydrophobicContact CD-CB 3.91Å; K269-D329 IonicContact NZ-OD2 3.32Å; K269-D329 PolarHBondContact NZ-OD2 3.45Å
270	V	92.1	Very high	88.1	Confident	0 Å²	0	48.4 Å²	48.4	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-76.9	-36.3	-179.3	175	0	0	0	0	111.9	A266 I267 E268 D272 L273 L274 A286 M289 V290 V323	A266-V270 WeakPolarHBondContact O-CG2 3.34Å; A266-V270 PolarHBondContact O-N 3.06Å; A266-V270 VanDerWaalsContact O-N 3.07Å; I267-V270 PolarHBondContact O-N 3.26Å; E268-V270 VanDerWaalsContact C-N 3.26Å; E268-V270 PolarHBondContact O-N 3.43Å; V270-D272 VanDerWaalsContact C-N 3.26Å; V270-D272 PolarHBondContact O-N 3.48Å; V270-L273 PolarHBondContact O-N 3.43Å; V270-L274 WeakPolarHBondContact O-CG 3.24Å; V270-L274 PolarHBondContact O-N 3.35Å; V270-A286 HydrophobicContact CB-CB 4.02Å; V270-A286 HydrophobicContact CG1-CB 3.76Å; V270-M289 HydrophobicContact CG1-CB 4.21Å; V270-M289 HydrophobicContact CG1-SD 3.57Å; V270-M289 VanDerWaalsContact CG1-SD 3.57Å; V270-V290 HydrophobicContact CG2-CG2 4.05Å; V270-V323 HydrophobicContact CG1-CG1 4.43Å; V270-V323 HydrophobicContact CG1-CG2 4.28Å; V270-V323 HydrophobicContact CG2-CG1 3.92Å; V270-V323 HydrophobicContact CG2-CG2 4.36Å
271	D	91.8	Very high	88.5	Confident	8 Å²	8	46.5 Å²	46.5	4%	0.043	24%	0.244	C	C	.	.	H	α-helix	trans	-64.4	-32	171.1	-160.1	54.9	0	0	0	111.4	K160 I267 E268 E275 R281 D282 A286	K160-D271 IonicContact NZ-OD1 3.1Å; K160-D271 IonicContact NZ-OD2 3.08Å; K160-D271 PolarHBondContact NZ-OD2 2.87Å; I267-D271 PolarHBondContact O-N 2.95Å; E268-D271 PolarHBondContact O-N 3.25Å; D271-E275 PolarHBondContact O-N 3.1Å; D271-E275 VanDerWaalsContact O-N 3.09Å; D271-R281 VanDerWaalsContact OD1-CA 3.22Å; D271-R281 WeakPolarHBondContact OD1-CA 3.31Å; D271-R281 VanDerWaalsContact OD1-CB 3.24Å; D271-R281 WeakPolarHBondContact OD1-CB 3.41Å; D271-R281 WeakPolarHBondContact OD2-CB 3.35Å; D271-R281 WeakPolarHBondContact OD2-CD 3.39Å; D271-R281 VanDerWaalsContact OD2-CG 3.28Å; D271-R281 WeakPolarHBondContact OD2-CG 3.39Å; D271-R281 IonicContact OD2-CZ 3.76Å; D271-R281 IonicContact OD2-NE 3.05Å; D271-R281 IonicContact OD2-NH1 3.82Å; D271-R281 PolarHBondContact OD2-NH1 3.42Å; D271-D282 PolarHBondContact OD1-N 3.32Å; D271-A286 HydrophobicContact CB-CB 4.4Å
272	D	92	Very high	88.8	Confident	75 Å²	75	43.7 Å²	43.7	40%	0.401	22%	0.218	S	C	.	.	H	α-helix	trans	-68.8	-39.3	172.5	-74.9	9.8	0	0	0	113	E268 V270 E275 S276 R281	E268-D272 PolarHBondContact O-N 2.96Å; V270-D272 VanDerWaalsContact C-N 3.26Å; V270-D272 PolarHBondContact O-N 3.48Å; D272-E275 PolarHBondContact O-N 2.86Å; D272-S276 PolarHBondContact O-N 3.38Å; D272-S276 PolarHBondContact O-OG 2.81Å; D272-R281 IonicContact OD1-CZ 2.72Å; D272-R281 IonicContact OD1-NH1 3.22Å; D272-R281 PolarHBondContact OD1-NH1 3.25Å; D272-R281 IonicContact OD1-NH2 3.51Å; D272-R281 PolarHBondContact OD1-NH2 3.22Å
273	L	92.3	Very high	89.1	Confident	28 Å²	28	41.7 Å²	41.7	15%	0.147	21%	0.214	C	C	.	.	H	α-helix	trans	-68.4	-37.3	174	-70.8	169.2	0	0	0	112.1	K269 V270 E275 S276 Y277 F319 D322 V323 A326	K269-L273 WeakPolarHBondContact O-CG 3.4Å; K269-L273 PolarHBondContact O-N 3.17Å; K269-L273 VanDerWaalsContact O-N 3.1Å; V270-L273 PolarHBondContact O-N 3.43Å; L273-E275 VanDerWaalsContact C-N 3.29Å; L273-E275 PolarHBondContact O-N 3.18Å; L273-S276 PolarHBondContact O-N 2.95Å; L273-S276 PolarHBondContact O-OG 3.41Å; L273-S276 VanDerWaalsContact O-OG 3.14Å; L273-Y277 HydrophobicContact CD2-CD2 4.39Å; L273-Y277 HydrophobicContact CD2-CE2 4.02Å; L273-Y277 WeakPolarHBondContact O-CD2 3.49Å; L273-Y277 PolarHBondContact O-N 2.86Å; L273-F319 HydrophobicContact CB-CD2 4.21Å; L273-F319 HydrophobicContact CB-CE2 3.84Å; L273-D322 HydrophobicContact CD1-CB 4Å; L273-D322 HydrophobicContact CD2-CB 3.92Å; L273-V323 HydrophobicContact CB-CG2 4.47Å; L273-V323 HydrophobicContact CD1-CB 4.46Å; L273-V323 HydrophobicContact CD1-CG2 3.74Å; L273-A326 HydrophobicContact CD1-CB 4.11Å
274	L	90.9	Very high	89.2	Confident	0 Å²	0	40.7 Å²	40.7	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-62.2	-38.1	172.4	-72	169.5	0	0	0	111.2	V270 M278 G279 I280 L285 A286 M289 F315 F319	V270-L274 WeakPolarHBondContact O-CG 3.24Å; V270-L274 PolarHBondContact O-N 3.35Å; L274-M278 HydrophobicContact CD2-SD 4.11Å; L274-M278 WeakPolarHBondContact O-CA 3.48Å; L274-M278 WeakPolarHBondContact O-CB 3.43Å; L274-M278 PolarHBondContact O-N 2.8Å; L274-M278 VanDerWaalsContact O-N 3.09Å; L274-G279 PolarHBondContact O-N 2.82Å; L274-I280 CarbonylContact C-O 3.49Å; L274-I280 HydrophobicContact CB-CG1 4.09Å; L274-I280 HydrophobicContact CD2-CD1 4.28Å; L274-I280 HydrophobicContact CD2-CG1 4.4Å; L274-I280 PolarHBondContact O-N 3.45Å; L274-L285 HydrophobicContact CD1-CD2 4.05Å; L274-L285 HydrophobicContact CD1-CG 4.37Å; L274-L285 HydrophobicContact CD2-CD2 4.11Å; L274-A286 HydrophobicContact CD1-CB 4.29Å; L274-M289 HydrophobicContact CD2-CE 4.28Å; L274-F315 HydrophobicContact CD2-CE1 4.31Å; L274-F319 HydrophobicContact CD2-CE2 3.97Å; L274-F319 HydrophobicContact CD2-CZ 3.62Å; L274-F319 HydrophobicContact CG-CE2 4.27Å; L274-F319 HydrophobicContact CG-CZ 4.14Å
275	E	91.1	Very high	89.3	Confident	47 Å²	47	35.9 Å²	35.9	22%	0.22	19%	0.187	C	C	.	.	H	α-helix	trans	-67.3	-43.3	176.3	-174.9	163.6	-108.5	0	0	111.8	T148 R161 D271 D272 L273 G279 I280 R281	T148-E275 VanDerWaalsContact CB-OE1 3.27Å; T148-E275 WeakPolarHBondContact CB-OE1 3.34Å; T148-E275 HydrophobicContact CG2-CB 4.47Å; T148-E275 HydrophobicContact CG2-CG 3.93Å; T148-E275 WeakPolarHBondContact CG2-OE1 3.3Å; T148-E275 PolarHBondContact OG1-OE1 3.19Å; R161-E275 WeakPolarHBondContact CD-OE1 3.18Å; R161-E275 IonicContact NH1-OE2 3.23Å; R161-E275 PolarHBondContact NH1-OE2 3.37Å; D271-E275 PolarHBondContact O-N 3.1Å; D271-E275 VanDerWaalsContact O-N 3.09Å; D272-E275 PolarHBondContact O-N 2.86Å; L273-E275 VanDerWaalsContact C-N 3.29Å; L273-E275 PolarHBondContact O-N 3.18Å; E275-G279 VanDerWaalsContact O-CA 3.32Å; E275-G279 WeakPolarHBondContact O-CA 3.25Å; E275-G279 PolarHBondContact O-N 2.87Å; E275-G279 VanDerWaalsContact O-N 3.09Å; E275-I280 VanDerWaalsContact CA-O 3.22Å; E275-I280 WeakPolarHBondContact CA-O 3.44Å; E275-I280 PolarHBondContact N-O 2.76Å; E275-R281 HydrophobicContact CB-CG 3.98Å; E275-R281 IonicContact OE1-NE 2.71Å; E275-R281 PolarHBondContact OE1-NE 2.91Å; E275-R281 IonicContact OE2-CZ 3.39Å; E275-R281 VanDerWaalsContact OE2-CZ 3.31Å; E275-R281 IonicContact OE2-NE 3.72Å; E275-R281 PolarHBondContact OE2-NE 3.24Å; E275-R281 IonicContact OE2-NH2 2.78Å; E275-R281 PolarHBondContact OE2-NH2 2.95Å
276	S	88.9	Confident	89.5	Confident	85 Å²	85	32 Å²	32	59%	0.594	17%	0.17	S	C	*	.	H	α-helix	trans	-73.4	-43.7	-175.3	68.4	0	0	0	0	113.7	D272 L273	D272-S276 PolarHBondContact O-N 3.38Å; D272-S276 PolarHBondContact O-OG 2.81Å; L273-S276 PolarHBondContact O-N 2.95Å; L273-S276 PolarHBondContact O-OG 3.41Å; L273-S276 VanDerWaalsContact O-OG 3.14Å
277	Y	86.8	Confident	89.5	Confident	70 Å²	70	32.2 Å²	32.2	28%	0.275	17%	0.171	S	C	.	.	H	α-helix	trans	-82.7	-40.1	-178.5	-78.9	-92	0	0	0	113	L273 E318 F319 D322	L273-Y277 HydrophobicContact CD2-CD2 4.39Å; L273-Y277 HydrophobicContact CD2-CE2 4.02Å; L273-Y277 WeakPolarHBondContact O-CD2 3.49Å; L273-Y277 PolarHBondContact O-N 2.86Å; Y277-E318 HydrophobicContact CE1-CB 4.37Å; Y277-F319 HydrophobicContact CD1-CB 4.16Å; Y277-F319 HydrophobicContact CD2-CB 4.34Å; Y277-F319 AromaticContact CD2-CD2 3.74Å; Y277-F319 HydrophobicContact CD2-CD2 3.74Å; Y277-F319 HydrophobicContact CE1-CB 4.26Å; Y277-F319 HydrophobicContact CE2-CB 4.41Å; Y277-F319 HydrophobicContact CE2-CD2 4.35Å; Y277-F319 HydrophobicContact CG-CB 4.2Å; Y277-F319 AromaticContact CG-CD2 3.95Å; Y277-F319 HydrophobicContact CG-CD2 3.95Å; Y277-D322 WeakPolarHBondContact CE2-OD2 3.28Å; Y277-D322 PolarHBondContact OH-OD2 2.93Å
278	M	85.8	Confident	89.5	Confident	44 Å²	44	31.8 Å²	31.8	22%	0.217	17%	0.17	C	C	.	.	H	α-helix	trans	-115.5	-15.6	-168.2	-57.8	-178.1	80.8	0	0	114.4	L274 I280 F313 F315	L274-M278 HydrophobicContact CD2-SD 4.11Å; L274-M278 WeakPolarHBondContact O-CA 3.48Å; L274-M278 WeakPolarHBondContact O-CB 3.43Å; L274-M278 PolarHBondContact O-N 2.8Å; L274-M278 VanDerWaalsContact O-N 3.09Å; M278-I280 VanDerWaalsContact C-N 3.28Å; M278-I280 HydrophobicContact CB-CD1 3.73Å; M278-I280 HydrophobicContact CB-CG1 3.85Å; M278-I280 HydrophobicContact CE-CD1 4.02Å; M278-I280 HydrophobicContact CG-CD1 4.39Å; M278-I280 HydrophobicContact SD-CD1 3.79Å; M278-F313 HydrophobicContact CE-CD1 4.43Å; M278-F315 HydrophobicContact CE-CE1 4.37Å; M278-F315 HydrophobicContact SD-CD1 3.92Å; M278-F315 HydrophobicContact SD-CE1 3.76Å
279	G	86.3	Confident	89.5	Confident	21 Å²	21	25.9 Å²	25.9	22%	0.216	14%	0.143	C	C	.	.	S	Bend	trans	72.2	22.8	-175.5	0	0	0	0	0	113.5	T148 I149 L274 E275	T148-G279 WeakPolarHBondContact CA-O 3.43Å; I149-G279 PolarHBondContact N-O 2.71Å; L274-G279 PolarHBondContact O-N 2.82Å; E275-G279 VanDerWaalsContact O-CA 3.32Å; E275-G279 WeakPolarHBondContact O-CA 3.25Å; E275-G279 PolarHBondContact O-N 2.87Å; E275-G279 VanDerWaalsContact O-N 3.09Å
280	I	90.2	Very high	89.5	Confident	0 Å²	0	23.3 Å²	23.3	0%	0	13%	0.132	C	C	.	.	B	Isolated β-bridge	trans	-121.7	160.4	179.7	68.8	-164.2	0	0	0	110.6	I149 H193 A197 L274 E275 M278	I149-I280 CarbonylContact O-C 3.31Å; I149-I280 WeakPolarHBondContact O-CA 3.49Å; H193-I280 HydrophobicContact CB-CG2 4.42Å; A197-I280 HydrophobicContact CB-CG2 3.56Å; L274-I280 CarbonylContact C-O 3.49Å; L274-I280 HydrophobicContact CB-CG1 4.09Å; L274-I280 HydrophobicContact CD2-CD1 4.28Å; L274-I280 HydrophobicContact CD2-CG1 4.4Å; L274-I280 PolarHBondContact O-N 3.45Å; E275-I280 VanDerWaalsContact CA-O 3.22Å; E275-I280 WeakPolarHBondContact CA-O 3.44Å; E275-I280 PolarHBondContact N-O 2.76Å; M278-I280 VanDerWaalsContact C-N 3.28Å; M278-I280 HydrophobicContact CB-CD1 3.73Å; M278-I280 HydrophobicContact CB-CG1 3.85Å; M278-I280 HydrophobicContact CE-CD1 4.02Å; M278-I280 HydrophobicContact CG-CD1 4.39Å; M278-I280 HydrophobicContact SD-CD1 3.79Å
281	R	90.5	Very high	89.3	Confident	8 Å²	8	25.5 Å²	25.5	3%	0.03	14%	0.142	C	C	.	.			trans	-138	131.7	166.4	-84.3	-175.9	177.9	-89.2	-4.2	109.4	T148 I149 T150 K160 D271 D272 E275	T148-R281 HydrophobicContact CG2-CB 4.06Å; T148-R281 HydrophobicContact CG2-CG 3.76Å; I149-R281 PolarHBondContact O-N 3.46Å; T150-R281 WeakPolarHBondContact CB-O 3.28Å; T150-R281 PolarHBondContact OG1-O 3Å; K160-R281 HydrophobicContact CD-CB 3.45Å; K160-R281 VanDerWaalsContact CD-CB 3.45Å; K160-R281 HydrophobicContact CD-CG 4.26Å; D271-R281 VanDerWaalsContact OD1-CA 3.22Å; D271-R281 WeakPolarHBondContact OD1-CA 3.31Å; D271-R281 VanDerWaalsContact OD1-CB 3.24Å; D271-R281 WeakPolarHBondContact OD1-CB 3.41Å; D271-R281 WeakPolarHBondContact OD2-CB 3.35Å; D271-R281 WeakPolarHBondContact OD2-CD 3.39Å; D271-R281 VanDerWaalsContact OD2-CG 3.28Å; D271-R281 WeakPolarHBondContact OD2-CG 3.39Å; D271-R281 IonicContact OD2-CZ 3.76Å; D271-R281 IonicContact OD2-NE 3.05Å; D271-R281 IonicContact OD2-NH1 3.82Å; D271-R281 PolarHBondContact OD2-NH1 3.42Å; D272-R281 IonicContact OD1-CZ 2.72Å; D272-R281 IonicContact OD1-NH1 3.22Å; D272-R281 PolarHBondContact OD1-NH1 3.25Å; D272-R281 IonicContact OD1-NH2 3.51Å; D272-R281 PolarHBondContact OD1-NH2 3.22Å; E275-R281 HydrophobicContact CB-CG 3.98Å; E275-R281 IonicContact OE1-NE 2.71Å; E275-R281 PolarHBondContact OE1-NE 2.91Å; E275-R281 IonicContact OE2-CZ 3.39Å; E275-R281 VanDerWaalsContact OE2-CZ 3.31Å; E275-R281 IonicContact OE2-NE 3.72Å; E275-R281 PolarHBondContact OE2-NE 3.24Å; E275-R281 IonicContact OE2-NH2 2.78Å; E275-R281 PolarHBondContact OE2-NH2 2.95Å
282	D	88.4	Confident	89.1	Confident	15 Å²	15	27.2 Å²	27.2	8%	0.08	15%	0.151	C	C	.	.			trans	-152	100.8	-179.7	-174.2	-23.3	0	0	0	108.6	R192 H193 D271 E284 L285 A286	R192-D282 IonicContact NH2-OD2 2.82Å; R192-D282 PolarHBondContact NH2-OD2 3.2Å; H193-D282 IonicContact CD2-OD2 2.86Å; H193-D282 IonicContact CE1-OD2 2.82Å; H193-D282 VanDerWaalsContact NE2-CB 3.34Å; H193-D282 WeakPolarHBondContact NE2-CB 3.27Å; H193-D282 IonicContact NE2-OD2 2.65Å; H193-D282 PolarHBondContact NE2-OD2 3.06Å; D271-D282 PolarHBondContact OD1-N 3.32Å; D282-E284 PolarHBondContact O-N 2.83Å; D282-E284 WeakPolarHBondContact OD1-CB 3.47Å; D282-E284 PolarHBondContact OD1-N 2.89Å; D282-L285 HydrophobicContact CB-CB 3.76Å; D282-L285 HydrophobicContact CB-CD2 4.35Å; D282-L285 VanDerWaalsContact CG-CB 3.49Å; D282-L285 PolarHBondContact O-N 3.01Å; D282-L285 PolarHBondContact OD1-N 2.88Å; D282-A286 WeakPolarHBondContact O-CB 3.14Å; D282-A286 PolarHBondContact O-N 2.85Å
283	S	87.9	Confident	88.8	Confident	36 Å²	36	23.7 Å²	23.7	25%	0.252	13%	0.132	S	C	.	.	H	α-helix	trans	-71.3	-18.3	-176.9	-49.8	0	0	0	0	112.8	A287	S283-A287 WeakPolarHBondContact O-CB 3.48Å; S283-A287 PolarHBondContact O-N 2.86Å
284	E	86.7	Confident	88.4	Confident	20 Å²	20	25.9 Å²	25.9	9%	0.093	14%	0.14	C	C	.	.	H	α-helix	trans	-80.8	-41	175.9	-159.2	-73.3	142.4	0	0	110.5	R246 R248 S249 D282 T288	R246-E284 IonicContact CZ-OE1 3.02Å; R246-E284 IonicContact NH1-OE1 2.76Å; R246-E284 PolarHBondContact NH1-OE1 3.04Å; R246-E284 VanDerWaalsContact NH1-OE1 3.16Å; R246-E284 IonicContact NH2-OE1 3.38Å; R248-E284 WeakPolarHBondContact CA-OE1 3.38Å; S249-E284 WeakPolarHBondContact CB-OE2 3.48Å; S249-E284 PolarHBondContact N-OE1 3.48Å; S249-E284 VanDerWaalsContact N-OE1 3.09Å; S249-E284 PolarHBondContact N-OE2 2.81Å; S249-E284 PolarHBondContact OG-OE2 3.33Å; D282-E284 PolarHBondContact O-N 2.83Å; D282-E284 WeakPolarHBondContact OD1-CB 3.47Å; D282-E284 PolarHBondContact OD1-N 2.89Å; E284-T288 WeakPolarHBondContact O-CB 3.4Å; E284-T288 PolarHBondContact O-N 3.24Å; E284-T288 PolarHBondContact O-OG1 2.71Å
285	L	87.9	Confident	88	Confident	6 Å²	6	32.9 Å²	32.9	3%	0.031	18%	0.178	C	C	.	.	H	α-helix	trans	-61.7	-48.6	169.1	-179.2	63.6	0	0	0	111.2	L274 D282 A287 T288 M289 L310 F313	L274-L285 HydrophobicContact CD1-CD2 4.05Å; L274-L285 HydrophobicContact CD1-CG 4.37Å; L274-L285 HydrophobicContact CD2-CD2 4.11Å; D282-L285 HydrophobicContact CB-CB 3.76Å; D282-L285 HydrophobicContact CB-CD2 4.35Å; D282-L285 VanDerWaalsContact CG-CB 3.49Å; D282-L285 PolarHBondContact O-N 3.01Å; D282-L285 PolarHBondContact OD1-N 2.88Å; L285-A287 PolarHBondContact O-N 3.46Å; L285-T288 WeakPolarHBondContact O-CB 3.44Å; L285-T288 PolarHBondContact O-N 3.49Å; L285-T288 VanDerWaalsContact O-N 3.13Å; L285-M289 HydrophobicContact CD1-CE 4.06Å; L285-M289 HydrophobicContact CD2-CE 4.26Å; L285-M289 HydrophobicContact CG-CE 3.94Å; L285-M289 WeakPolarHBondContact O-CG 3.11Å; L285-M289 PolarHBondContact O-N 3.23Å; L285-L310 HydrophobicContact CD1-CD1 3.65Å; L285-L310 HydrophobicContact CD1-CD2 3.61Å; L285-L310 HydrophobicContact CD1-CG 4.24Å; L285-F313 HydrophobicContact CD1-CE1 4.44Å; L285-F313 HydrophobicContact CD1-CE2 4.21Å; L285-F313 HydrophobicContact CD1-CZ 3.98Å; L285-F313 HydrophobicContact CD2-CD1 4.23Å; L285-F313 HydrophobicContact CD2-CE1 3.54Å; L285-F313 HydrophobicContact CD2-CZ 3.82Å
286	A	90.9	Very high	87.8	Confident	0 Å²	0	33.4 Å²	33.4	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-61.9	-42.4	177.9	0	0	0	0	0	112.2	I267 V270 D271 L274 D282 T288 M289 V290	I267-A286 HydrophobicContact CG2-CB 3.98Å; V270-A286 HydrophobicContact CB-CB 4.02Å; V270-A286 HydrophobicContact CG1-CB 3.76Å; D271-A286 HydrophobicContact CB-CB 4.4Å; L274-A286 HydrophobicContact CD1-CB 4.29Å; D282-A286 WeakPolarHBondContact O-CB 3.14Å; D282-A286 PolarHBondContact O-N 2.85Å; A286-T288 VanDerWaalsContact C-N 3.34Å; A286-T288 PolarHBondContact O-N 3.38Å; A286-M289 PolarHBondContact O-N 2.79Å; A286-V290 WeakPolarHBondContact O-CG2 3.21Å; A286-V290 PolarHBondContact O-N 2.56Å
287	A	89.3	Confident	87.7	Confident	3 Å²	3	37.6 Å²	37.6	3%	0.025	19%	0.187	C	C	.	.	H	α-helix	trans	-59.5	-42.8	171.3	0	0	0	0	0	112.3	I267 S283 L285 V290 E291	I267-A287 HydrophobicContact CD1-CB 3.84Å; I267-A287 HydrophobicContact CG1-CB 4.32Å; S283-A287 WeakPolarHBondContact O-CB 3.48Å; S283-A287 PolarHBondContact O-N 2.86Å; L285-A287 PolarHBondContact O-N 3.46Å; A287-V290 PolarHBondContact O-N 2.85Å; A287-E291 WeakPolarHBondContact O-CB 3.17Å; A287-E291 VanDerWaalsContact O-CG 3.28Å; A287-E291 WeakPolarHBondContact O-CG 3.47Å; A287-E291 PolarHBondContact O-N 2.94Å
288	T	88.5	Confident	87.6	Confident	20 Å²	20	36.6 Å²	36.6	12%	0.123	19%	0.186	C	C	.	.	H	α-helix	trans	-64.2	-41.6	177.2	-58	0	0	0	0	112	E284 L285 A286 E291 L292 T309	E284-T288 WeakPolarHBondContact O-CB 3.4Å; E284-T288 PolarHBondContact O-N 3.24Å; E284-T288 PolarHBondContact O-OG1 2.71Å; L285-T288 WeakPolarHBondContact O-CB 3.44Å; L285-T288 PolarHBondContact O-N 3.49Å; L285-T288 VanDerWaalsContact O-N 3.13Å; A286-T288 VanDerWaalsContact C-N 3.34Å; A286-T288 PolarHBondContact O-N 3.38Å; T288-E291 PolarHBondContact O-N 3.22Å; T288-L292 HydrophobicContact CG2-CD1 4.21Å; T288-L292 WeakPolarHBondContact O-CB 3.42Å; T288-L292 VanDerWaalsContact O-CG 3.29Å; T288-L292 WeakPolarHBondContact O-CG 3.35Å; T288-L292 PolarHBondContact O-N 3.05Å; T288-T309 HydrophobicContact CG2-CG2 4.5Å
289	M	90.1	Very high	87.7	Confident	0 Å²	0	35.9 Å²	35.9	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-61.8	-45.3	173.6	-69.3	177.5	172.5	0	0	112.2	V270 L274 L285 A286 L292 G293 L306 L310 F315 F319	V270-M289 HydrophobicContact CG1-CB 4.21Å; V270-M289 HydrophobicContact CG1-SD 3.57Å; V270-M289 VanDerWaalsContact CG1-SD 3.57Å; L274-M289 HydrophobicContact CD2-CE 4.28Å; L285-M289 HydrophobicContact CD1-CE 4.06Å; L285-M289 HydrophobicContact CD2-CE 4.26Å; L285-M289 HydrophobicContact CG-CE 3.94Å; L285-M289 WeakPolarHBondContact O-CG 3.11Å; L285-M289 PolarHBondContact O-N 3.23Å; A286-M289 PolarHBondContact O-N 2.79Å; M289-L292 PolarHBondContact O-N 2.62Å; M289-G293 PolarHBondContact O-N 3.2Å; M289-L306 HydrophobicContact CB-CD2 4.4Å; M289-L306 HydrophobicContact CG-CD2 3.87Å; M289-L310 HydrophobicContact CE-CD1 4.21Å; M289-L310 HydrophobicContact CG-CD1 4.05Å; M289-F315 HydrophobicContact CE-CD1 4.4Å; M289-F315 HydrophobicContact CE-CD2 4.5Å; M289-F315 HydrophobicContact CE-CE1 3.55Å; M289-F315 HydrophobicContact CE-CE2 3.67Å; M289-F315 HydrophobicContact CE-CZ 3.13Å; M289-F319 HydrophobicContact CE-CE1 3.96Å; M289-F319 HydrophobicContact CE-CZ 4.03Å; M289-F319 HydrophobicContact SD-CE1 4.31Å; M289-F319 HydrophobicContact SD-CZ 4.12Å
290	V	90.5	Very high	87.7	Confident	3 Å²	3	40.3 Å²	40.3	2%	0.018	20%	0.204	C	C	.	.	H	α-helix	trans	-63.7	-41.2	177.1	171.5	0	0	0	0	111	A266 I267 V270 A286 A287 G293 K294 I327	A266-V290 HydrophobicContact CB-CG1 3.95Å; A266-V290 HydrophobicContact CB-CG2 3.92Å; I267-V290 HydrophobicContact CG1-CB 4.05Å; I267-V290 HydrophobicContact CG1-CG1 4.28Å; I267-V290 HydrophobicContact CG1-CG2 3.85Å; V270-V290 HydrophobicContact CG2-CG2 4.05Å; A286-V290 WeakPolarHBondContact O-CG2 3.21Å; A286-V290 PolarHBondContact O-N 2.56Å; A287-V290 PolarHBondContact O-N 2.85Å; V290-G293 PolarHBondContact O-N 3.24Å; V290-K294 WeakPolarHBondContact O-CG 3.43Å; V290-K294 PolarHBondContact O-N 3.12Å; V290-I327 HydrophobicContact CG2-CD1 4.41Å; V290-I327 HydrophobicContact CG2-CG1 4.16Å
291	E	88.1	Confident	87.6	Confident	47 Å²	47	43.4 Å²	43.4	22%	0.22	22%	0.218	C	C	.	.	H	α-helix	trans	-61.2	-50.9	174.1	-74.5	173.5	-125.6	0	0	112.1	R246 R248 A287 T288 G293 K294	R246-E291 IonicContact CZ-OE1 2.75Å; R246-E291 VanDerWaalsContact CZ-OE1 3.32Å; R246-E291 IonicContact NE-OE1 2.81Å; R246-E291 PolarHBondContact NE-OE1 2.81Å; R246-E291 IonicContact NH2-OE1 3.73Å; R246-E291 PolarHBondContact NH2-OE1 2.95Å; R248-E291 IonicContact CZ-OE2 3.52Å; R248-E291 VanDerWaalsContact CZ-OE2 3.22Å; R248-E291 IonicContact NH1-OE1 3.82Å; R248-E291 IonicContact NH1-OE2 2.69Å; R248-E291 PolarHBondContact NH1-OE2 2.99Å; R248-E291 IonicContact NH2-OE1 2.79Å; R248-E291 IonicContact NH2-OE2 3.68Å; R248-E291 PolarHBondContact NH2-OE2 2.98Å; A287-E291 WeakPolarHBondContact O-CB 3.17Å; A287-E291 VanDerWaalsContact O-CG 3.28Å; A287-E291 WeakPolarHBondContact O-CG 3.47Å; A287-E291 PolarHBondContact O-N 2.94Å; T288-E291 PolarHBondContact O-N 3.22Å; E291-G293 PolarHBondContact O-N 2.92Å; E291-K294 WeakPolarHBondContact O-CB 3.38Å; E291-K294 PolarHBondContact O-N 3.38Å; E291-K294 VanDerWaalsContact O-N 3.12Å
292	L	88.1	Confident	87.6	Confident	44 Å²	44	43 Å²	43	23%	0.23	22%	0.217	C	C	.	.	H	α-helix	trans	-57.5	-35.9	176	-71.8	168.5	0	0	0	112.5	T288 M289 K294 K296 F302 L306 T309 L310	T288-L292 HydrophobicContact CG2-CD1 4.21Å; T288-L292 WeakPolarHBondContact O-CB 3.42Å; T288-L292 VanDerWaalsContact O-CG 3.29Å; T288-L292 WeakPolarHBondContact O-CG 3.35Å; T288-L292 PolarHBondContact O-N 3.05Å; M289-L292 PolarHBondContact O-N 2.62Å; L292-K294 VanDerWaalsContact C-N 3.33Å; L292-K294 PolarHBondContact O-N 2.95Å; L292-K296 WeakPolarHBondContact O-CG 3.31Å; L292-F302 HydrophobicContact CB-CE2 4.39Å; L292-L306 HydrophobicContact CD1-CD2 4.14Å; L292-T309 HydrophobicContact CD1-CG2 4.01Å; L292-L310 HydrophobicContact CD1-CD1 4.39Å
293	G	86.3	Confident	87.5	Confident	0 Å²	0	43.8 Å²	43.8	0%	0	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.4	-3.4	179.5	0	0	0	0	0	115.6	M289 V290 E291 K331	M289-G293 PolarHBondContact O-N 3.2Å; V290-G293 PolarHBondContact O-N 3.24Å; E291-G293 PolarHBondContact O-N 2.92Å; G293-K331 PolarHBondContact O-NZ 3.24Å
294	K	83.5	Confident	87.5	Confident	74 Å²	74	48.8 Å²	48.8	32%	0.322	25%	0.245	S	C	.	.	S	Bend	trans	-66.9	-49.8	-178.6	-75.6	170.5	-164	-179.2	0	112.7	E263 V290 E291 L292 K331	E263-K294 WeakPolarHBondContact OE1-CE 3.12Å; E263-K294 IonicContact OE1-NZ 3.16Å; E263-K294 PolarHBondContact OE1-NZ 3.07Å; V290-K294 WeakPolarHBondContact O-CG 3.43Å; V290-K294 PolarHBondContact O-N 3.12Å; E291-K294 WeakPolarHBondContact O-CB 3.38Å; E291-K294 PolarHBondContact O-N 3.38Å; E291-K294 VanDerWaalsContact O-N 3.12Å; L292-K294 VanDerWaalsContact C-N 3.33Å; L292-K294 PolarHBondContact O-N 2.95Å; K294-K331 PolarHBondContact O-NZ 3.32Å
295	D	83.1	Confident	87.6	Confident	147 Å²	147	48 Å²	48	79%	0.786	24%	0.242	S	C	*	.	S	Bend	trans	-95.2	-8.9	-167.6	-59.7	-41.3	0	0	0	114.7
296	K	87.1	Confident	87.6	Confident	59 Å²	59	47.8 Å²	47.8	26%	0.257	24%	0.241	S	C	.	.			trans	-76.1	157.9	177	-51.4	-52.4	-167.1	130.8	0	111.9	L292 E301 F302 W324	L292-K296 WeakPolarHBondContact O-CG 3.31Å; K296-E301 HydrophobicContact CB-CB 4.15Å; K296-E301 HydrophobicContact CD-CB 4.19Å; K296-E301 WeakPolarHBondContact CD-O 3.49Å; K296-E301 VanDerWaalsContact CE-O 3.25Å; K296-E301 WeakPolarHBondContact CE-O 3.43Å; K296-E301 HydrophobicContact CG-CB 4.46Å; K296-E301 PolarHBondContact NZ-O 3.43Å; K296-F302 HydrophobicContact CB-CB 4.35Å; K296-F302 HydrophobicContact CG-CB 4.38Å; K296-W324 HydrophobicContact CB-CH2 4.31Å; K296-W324 HydrophobicContact CB-CZ3 4Å; K296-W324 WeakPolarHBondContact O-CH2 3.29Å
297	K	85.1	Confident	87.3	Confident	172 Å²	172	52.6 Å²	52.6	75%	0.748	27%	0.266	S	S	*	.			trans	-117.4	-18.4	-174	-66.5	169.1	-174.2	163.7	0	114.7	E301	K297-E301 PolarHBondContact N-OE2 2.86Å
298	N	86.4	Confident	87.2	Confident	49 Å²	49	60.5 Å²	60.5	26%	0.262	30%	0.303	S	S	.	.	S	Bend	trans	-144.4	165.2	-179.7	54.2	67	0	0	0	110.6	D300 E301 F302	N298-D300 VanDerWaalsContact C-N 3.27Å; N298-D300 PolarHBondContact O-N 3.24Å; N298-D300 PolarHBondContact OD1-N 3.23Å; N298-E301 PolarHBondContact ND2-OE1 2.75Å; N298-E301 VanDerWaalsContact OD1-CB 3.27Å; N298-E301 WeakPolarHBondContact OD1-CB 3.45Å; N298-E301 VanDerWaalsContact OD1-CG 3.28Å; N298-E301 WeakPolarHBondContact OD1-CG 3.34Å; N298-E301 PolarHBondContact OD1-N 2.76Å; N298-F302 PolarHBondContact O-N 3.39Å
299	P	86.4	Confident	86.8	Confident	30 Å²	30	61.2 Å²	61.2	20%	0.195	31%	0.307	C	S	.	.	H	α-helix	trans	-61.4	-34.1	-179.6	-20.5	31.9	0	0	0	113.1	F302 A303 F321 W324	P299-F302 CarbonylContact O-C 3.54Å; P299-F302 WeakPolarHBondContact O-CB 3.35Å; P299-F302 PolarHBondContact O-N 3.46Å; P299-A303 PolarHBondContact O-N 3.28Å; P299-F321 HydrophobicContact CB-CD1 3.9Å; P299-F321 HydrophobicContact CB-CE1 3.53Å; P299-F321 HydrophobicContact CB-CZ 4.3Å; P299-F321 HydrophobicContact CG-CD1 4.09Å; P299-F321 HydrophobicContact CG-CE1 3.73Å; P299-W324 HydrophobicContact CB-CG 4.35Å; P299-W324 HydrophobicContact CG-CG 4.29Å
300	D	86.6	Confident	86.5	Confident	113 Å²	113	61.6 Å²	61.6	60%	0.604	31%	0.309	S	S	*	.	H	α-helix	trans	-70.1	-46.1	-174.3	-45.3	-60	0	0	0	111.2	N298 F302 A303 E304	N298-D300 VanDerWaalsContact C-N 3.27Å; N298-D300 PolarHBondContact O-N 3.24Å; N298-D300 PolarHBondContact OD1-N 3.23Å; D300-F302 PolarHBondContact O-N 2.98Å; D300-A303 PolarHBondContact O-N 2.79Å; D300-E304 PolarHBondContact O-N 2.85Å
301	E	88.5	Confident	85.7	Confident	65 Å²	65	63 Å²	63	30%	0.304	32%	0.324	S	S	.	.	H	α-helix	trans	-57.8	-24.6	170.4	-82.8	174.5	-155.6	0	0	113.5	K296 K297 N298	K296-E301 HydrophobicContact CB-CB 4.15Å; K296-E301 HydrophobicContact CD-CB 4.19Å; K296-E301 WeakPolarHBondContact CD-O 3.49Å; K296-E301 VanDerWaalsContact CE-O 3.25Å; K296-E301 WeakPolarHBondContact CE-O 3.43Å; K296-E301 HydrophobicContact CG-CB 4.46Å; K296-E301 PolarHBondContact NZ-O 3.43Å; K297-E301 PolarHBondContact N-OE2 2.86Å; N298-E301 PolarHBondContact ND2-OE1 2.75Å; N298-E301 VanDerWaalsContact OD1-CB 3.27Å; N298-E301 WeakPolarHBondContact OD1-CB 3.45Å; N298-E301 VanDerWaalsContact OD1-CG 3.28Å; N298-E301 WeakPolarHBondContact OD1-CG 3.34Å; N298-E301 PolarHBondContact OD1-N 2.76Å
302	F	89.5	Confident	85	Confident	0 Å²	0	66.9 Å²	66.9	0%	0	35%	0.346	C	S	.	.	H	α-helix	trans	-88	-42	178	176.7	-115.8	0	0	0	111.6	L292 K296 N298 P299 D300 A305 L306 V320 V323 W324 I327	L292-F302 HydrophobicContact CB-CE2 4.39Å; K296-F302 HydrophobicContact CB-CB 4.35Å; K296-F302 HydrophobicContact CG-CB 4.38Å; N298-F302 PolarHBondContact O-N 3.39Å; P299-F302 CarbonylContact O-C 3.54Å; P299-F302 WeakPolarHBondContact O-CB 3.35Å; P299-F302 PolarHBondContact O-N 3.46Å; D300-F302 PolarHBondContact O-N 2.98Å; F302-A305 PolarHBondContact O-N 3.21Å; F302-L306 HydrophobicContact CD1-CD1 4.08Å; F302-L306 HydrophobicContact CD2-CG 4.4Å; F302-L306 HydrophobicContact CE1-CD1 3.54Å; F302-L306 HydrophobicContact CE1-CG 4.13Å; F302-L306 HydrophobicContact CE2-CD1 4.29Å; F302-L306 HydrophobicContact CE2-CD2 4.06Å; F302-L306 HydrophobicContact CE2-CG 4Å; F302-L306 HydrophobicContact CZ-CD1 3.65Å; F302-L306 HydrophobicContact CZ-CD2 3.94Å; F302-L306 HydrophobicContact CZ-CG 3.86Å; F302-L306 WeakPolarHBondContact O-CG 3.37Å; F302-L306 PolarHBondContact O-N 3.35Å; F302-V320 HydrophobicContact CD1-CG1 4.03Å; F302-V320 HydrophobicContact CE1-CG1 4.31Å; F302-V323 HydrophobicContact CE1-CB 4.25Å; F302-V323 HydrophobicContact CE1-CG1 3.73Å; F302-V323 HydrophobicContact CZ-CG1 3.6Å; F302-W324 HydrophobicContact CB-CE3 3.79Å; F302-W324 HydrophobicContact CB-CZ3 4.15Å; F302-W324 HydrophobicContact CD1-CB 3.94Å; F302-W324 HydrophobicContact CD1-CE3 4.02Å; F302-W324 HydrophobicContact CD2-CE3 4.43Å; F302-W324 HydrophobicContact CE1-CB 4.24Å; F302-W324 AromaticContact CG-CE3 3.82Å; F302-W324 HydrophobicContact CG-CE3 3.82Å; F302-W324 HydrophobicContact CG-CZ3 4.43Å; F302-I327 HydrophobicContact CE2-CD1 4.21Å; F302-I327 HydrophobicContact CZ-CD1 3.91Å
303	A	87.6	Confident	84.3	Confident	31 Å²	31	66.1 Å²	66.1	26%	0.256	34%	0.341	S	S	.	.	H	α-helix	trans	-57.1	-48.4	172.3	0	0	0	0	0	111.4	P299 D300 A305 L306 D307 V320	P299-A303 PolarHBondContact O-N 3.28Å; D300-A303 PolarHBondContact O-N 2.79Å; A303-A305 VanDerWaalsContact C-N 3.28Å; A303-A305 PolarHBondContact O-N 3.49Å; A303-L306 PolarHBondContact O-N 2.91Å; A303-L306 VanDerWaalsContact O-N 3.16Å; A303-D307 PolarHBondContact O-N 2.91Å; A303-V320 HydrophobicContact CB-CG1 3.92Å
304	E	88.3	Confident	83.9	Confident	142 Å²	142	70 Å²	70	66%	0.664	37%	0.373	S	S	*	.	H	α-helix	trans	-57.1	-39.9	177.2	-174.6	177.6	-141.2	0	0	112.3	D300 D307 E308	D300-E304 PolarHBondContact O-N 2.85Å; E304-D307 PolarHBondContact O-N 2.91Å; E304-E308 WeakPolarHBondContact O-CB 3.41Å; E304-E308 PolarHBondContact O-N 2.78Å
305	A	87.8	Confident	83.9	Confident	4 Å²	4	67.3 Å²	67.3	3%	0.033	36%	0.362	C	S	.	.	H	α-helix	trans	-76.7	-31.3	178.5	0	0	0	0	0	113.9	F302 A303 T309	F302-A305 PolarHBondContact O-N 3.21Å; A303-A305 VanDerWaalsContact C-N 3.28Å; A303-A305 PolarHBondContact O-N 3.49Å; A305-T309 VanDerWaalsContact O-CB 3.3Å; A305-T309 WeakPolarHBondContact O-CB 3.41Å; A305-T309 PolarHBondContact O-N 2.76Å; A305-T309 VanDerWaalsContact O-N 3.12Å; A305-T309 PolarHBondContact O-OG1 2.77Å
306	L	87.2	Confident	84	Confident	1 Å²	1	63.3 Å²	63.3	1%	0.005	34%	0.344	C	S	.	.	H	α-helix	trans	-65.8	-44	169.5	-74.9	-177.9	0	0	0	110.4	M289 L292 F302 A303 T309 L310 G311 V320	M289-L306 HydrophobicContact CB-CD2 4.4Å; M289-L306 HydrophobicContact CG-CD2 3.87Å; L292-L306 HydrophobicContact CD1-CD2 4.14Å; F302-L306 HydrophobicContact CD1-CD1 4.08Å; F302-L306 HydrophobicContact CD2-CG 4.4Å; F302-L306 HydrophobicContact CE1-CD1 3.54Å; F302-L306 HydrophobicContact CE1-CG 4.13Å; F302-L306 HydrophobicContact CE2-CD1 4.29Å; F302-L306 HydrophobicContact CE2-CD2 4.06Å; F302-L306 HydrophobicContact CE2-CG 4Å; F302-L306 HydrophobicContact CZ-CD1 3.65Å; F302-L306 HydrophobicContact CZ-CD2 3.94Å; F302-L306 HydrophobicContact CZ-CG 3.86Å; F302-L306 WeakPolarHBondContact O-CG 3.37Å; F302-L306 PolarHBondContact O-N 3.35Å; A303-L306 PolarHBondContact O-N 2.91Å; A303-L306 VanDerWaalsContact O-N 3.16Å; L306-T309 PolarHBondContact O-N 2.87Å; L306-L310 HydrophobicContact CD2-CD1 4.01Å; L306-L310 CarbonylContact O-C 3.58Å; L306-L310 WeakPolarHBondContact O-CA 3.44Å; L306-L310 VanDerWaalsContact O-CB 3.27Å; L306-L310 WeakPolarHBondContact O-CB 3.47Å; L306-L310 PolarHBondContact O-N 3.26Å; L306-G311 PolarHBondContact O-N 2.9Å; L306-V320 HydrophobicContact CD1-CB 4.49Å; L306-V320 HydrophobicContact CD1-CG1 3.98Å; L306-V320 HydrophobicContact CD1-CG2 3.99Å
307	D	86.2	Confident	83.9	Confident	101 Å²	101	66.6 Å²	66.6	54%	0.54	36%	0.364	S	S	.	.	H	α-helix	trans	-68.1	-42.2	178.8	-81.9	-15.8	0	0	0	112.2	A303 E304 T309 G311	A303-D307 PolarHBondContact O-N 2.91Å; E304-D307 PolarHBondContact O-N 2.91Å; D307-T309 VanDerWaalsContact C-N 3.29Å; D307-T309 PolarHBondContact O-N 2.59Å; D307-G311 WeakPolarHBondContact O-CA 3.34Å; D307-G311 PolarHBondContact O-N 3.4Å
308	E	86.1	Confident	84	Confident	169 Å²	169	65 Å²	65	79%	0.79	36%	0.359	S	S	*	.	H	α-helix	trans	-58.3	-40.4	173.9	-175.4	179.8	-156.5	0	0	112.1	E304	E304-E308 WeakPolarHBondContact O-CB 3.41Å; E304-E308 PolarHBondContact O-N 2.78Å
309	T	81	Confident	84.1	Confident	34 Å²	34	62.6 Å²	62.6	21%	0.209	35%	0.346	C	S	.	.	H	α-helix	trans	-92.6	-30	-173.7	-48.1	0	0	0	0	113.4	K250 T288 L292 A305 L306 D307	K250-T309 PolarHBondContact NZ-O 3.34Å; T288-T309 HydrophobicContact CG2-CG2 4.5Å; L292-T309 HydrophobicContact CD1-CG2 4.01Å; A305-T309 VanDerWaalsContact O-CB 3.3Å; A305-T309 WeakPolarHBondContact O-CB 3.41Å; A305-T309 PolarHBondContact O-N 2.76Å; A305-T309 VanDerWaalsContact O-N 3.12Å; A305-T309 PolarHBondContact O-OG1 2.77Å; L306-T309 PolarHBondContact O-N 2.87Å; D307-T309 VanDerWaalsContact C-N 3.29Å; D307-T309 PolarHBondContact O-N 2.59Å
310	L	82.4	Confident	84.2	Confident	8 Å²	8	62 Å²	62	4%	0.042	34%	0.342	C	S	.	.	H	α-helix	trans	-144.5	13.6	-162.9	-58.3	169.8	0	0	0	113.6	L285 M289 L292 L306 D312 F313 F315	L285-L310 HydrophobicContact CD1-CD1 3.65Å; L285-L310 HydrophobicContact CD1-CD2 3.61Å; L285-L310 HydrophobicContact CD1-CG 4.24Å; M289-L310 HydrophobicContact CE-CD1 4.21Å; M289-L310 HydrophobicContact CG-CD1 4.05Å; L292-L310 HydrophobicContact CD1-CD1 4.39Å; L306-L310 HydrophobicContact CD2-CD1 4.01Å; L306-L310 CarbonylContact O-C 3.58Å; L306-L310 WeakPolarHBondContact O-CA 3.44Å; L306-L310 VanDerWaalsContact O-CB 3.27Å; L306-L310 WeakPolarHBondContact O-CB 3.47Å; L306-L310 PolarHBondContact O-N 3.26Å; L310-D312 PolarHBondContact O-N 3.07Å; L310-F313 HydrophobicContact CB-CD2 4.2Å; L310-F313 HydrophobicContact CD2-CD2 4.49Å; L310-F313 HydrophobicContact CD2-CE2 4.13Å; L310-F313 WeakPolarHBondContact O-CB 3.39Å; L310-F313 WeakPolarHBondContact O-CD2 3.38Å; L310-F313 PolarHBondContact O-N 3.33Å; L310-F315 HydrophobicContact CB-CE2 3.92Å; L310-F315 HydrophobicContact CD1-CE2 4.49Å
311	G	74.1	Confident	84.3	Confident	32 Å²	32	62 Å²	62	33%	0.33	34%	0.337	S	S	.	.	G	3₁₀ helix	trans	-55.3	-21.3	-178.4	0	0	0	0	0	115.4	L306 D307 F313 A314	L306-G311 PolarHBondContact O-N 2.9Å; D307-G311 WeakPolarHBondContact O-CA 3.34Å; D307-G311 PolarHBondContact O-N 3.4Å; G311-F313 PolarHBondContact O-N 3.49Å; G311-A314 PolarHBondContact O-N 2.98Å; G311-A314 VanDerWaalsContact O-N 3.08Å
312	D	74.8	Confident	84.4	Confident	130 Å²	130	62.4 Å²	62.4	70%	0.695	34%	0.341	S	S	*	.	G	3₁₀ helix	trans	-52.4	-24.8	170.3	-63.5	-50.5	0	0	0	113.8	L310	L310-D312 PolarHBondContact O-N 3.07Å
313	F	73.5	Confident	84.4	Confident	27 Å²	27	62.4 Å²	62.4	12%	0.118	34%	0.341	C	S	.	.	G	3₁₀ helix	trans	-85.1	-20.5	-179	-73.8	-104.3	0	0	0	113.9	Y194 M278 L285 L310 G311 F315	Y194-F313 AromaticContact CD1-CD1 3.94Å; Y194-F313 HydrophobicContact CD1-CD1 3.94Å; Y194-F313 AromaticContact CD1-CE1 3.34Å; Y194-F313 HydrophobicContact CD1-CE1 3.34Å; Y194-F313 AromaticContact CD1-CZ 3.88Å; Y194-F313 HydrophobicContact CD1-CZ 3.88Å; Y194-F313 HydrophobicContact CE1-CD1 4.22Å; Y194-F313 AromaticContact CE1-CE1 3.58Å; Y194-F313 HydrophobicContact CE1-CE1 3.58Å; Y194-F313 HydrophobicContact CE1-CE2 4.29Å; Y194-F313 AromaticContact CE1-CZ 3.63Å; Y194-F313 HydrophobicContact CE1-CZ 3.63Å; Y194-F313 HydrophobicContact CG-CD1 4.2Å; Y194-F313 HydrophobicContact CG-CE1 4.04Å; M278-F313 HydrophobicContact CE-CD1 4.43Å; L285-F313 HydrophobicContact CD1-CE1 4.44Å; L285-F313 HydrophobicContact CD1-CE2 4.21Å; L285-F313 HydrophobicContact CD1-CZ 3.98Å; L285-F313 HydrophobicContact CD2-CD1 4.23Å; L285-F313 HydrophobicContact CD2-CE1 3.54Å; L285-F313 HydrophobicContact CD2-CZ 3.82Å; L310-F313 HydrophobicContact CB-CD2 4.2Å; L310-F313 HydrophobicContact CD2-CD2 4.49Å; L310-F313 HydrophobicContact CD2-CE2 4.13Å; L310-F313 WeakPolarHBondContact O-CB 3.39Å; L310-F313 WeakPolarHBondContact O-CD2 3.38Å; L310-F313 PolarHBondContact O-N 3.33Å; G311-F313 PolarHBondContact O-N 3.49Å; F313-F315 HydrophobicContact CB-CD1 4.27Å; F313-F315 HydrophobicContact CB-CD2 4.1Å; F313-F315 HydrophobicContact CB-CE1 3.72Å; F313-F315 HydrophobicContact CB-CE2 3.52Å; F313-F315 HydrophobicContact CB-CG 4.44Å; F313-F315 HydrophobicContact CB-CZ 3.29Å; F313-F315 HydrophobicContact CD1-CE1 4.11Å; F313-F315 AromaticContact CD1-CZ 3.81Å; F313-F315 HydrophobicContact CD1-CZ 3.81Å; F313-F315 HydrophobicContact CD2-CZ 4.21Å; F313-F315 HydrophobicContact CG-CE1 4.14Å; F313-F315 HydrophobicContact CG-CE2 4.07Å; F313-F315 AromaticContact CG-CZ 3.53Å; F313-F315 HydrophobicContact CG-CZ 3.53Å
314	A	77.6	Confident	84.5	Confident	82 Å²	82	63.3 Å²	63.3	68%	0.678	34%	0.338	S	S	*	.			trans	46.7	63.5	-176.4	0	0	0	0	0	113.7	G311	G311-A314 PolarHBondContact O-N 2.98Å; G311-A314 VanDerWaalsContact O-N 3.08Å
315	F	82.9	Confident	84.4	Confident	18 Å²	18	58 Å²	58	8%	0.079	32%	0.322	C	S	.	.			trans	-66.3	142.6	-179.3	-60.7	-69.4	0	0	0	112.3	L274 M278 M289 L310 F313 F319 V320	L274-F315 HydrophobicContact CD2-CE1 4.31Å; M278-F315 HydrophobicContact CE-CE1 4.37Å; M278-F315 HydrophobicContact SD-CD1 3.92Å; M278-F315 HydrophobicContact SD-CE1 3.76Å; M289-F315 HydrophobicContact CE-CD1 4.4Å; M289-F315 HydrophobicContact CE-CD2 4.5Å; M289-F315 HydrophobicContact CE-CE1 3.55Å; M289-F315 HydrophobicContact CE-CE2 3.67Å; M289-F315 HydrophobicContact CE-CZ 3.13Å; L310-F315 HydrophobicContact CB-CE2 3.92Å; L310-F315 HydrophobicContact CD1-CE2 4.49Å; F313-F315 HydrophobicContact CB-CD1 4.27Å; F313-F315 HydrophobicContact CB-CD2 4.1Å; F313-F315 HydrophobicContact CB-CE1 3.72Å; F313-F315 HydrophobicContact CB-CE2 3.52Å; F313-F315 HydrophobicContact CB-CG 4.44Å; F313-F315 HydrophobicContact CB-CZ 3.29Å; F313-F315 HydrophobicContact CD1-CE1 4.11Å; F313-F315 AromaticContact CD1-CZ 3.81Å; F313-F315 HydrophobicContact CD1-CZ 3.81Å; F313-F315 HydrophobicContact CD2-CZ 4.21Å; F313-F315 HydrophobicContact CG-CE1 4.14Å; F313-F315 HydrophobicContact CG-CE2 4.07Å; F313-F315 AromaticContact CG-CZ 3.53Å; F313-F315 HydrophobicContact CG-CZ 3.53Å; F315-F319 HydrophobicContact CB-CD1 3.85Å; F315-F319 HydrophobicContact CB-CE1 4.3Å; F315-F319 AromaticContact CD1-CD1 3.71Å; F315-F319 HydrophobicContact CD1-CD1 3.71Å; F315-F319 AromaticContact CD1-CE1 3.42Å; F315-F319 HydrophobicContact CD1-CE1 3.42Å; F315-F319 VanDerWaalsContact CD1-CE1 3.42Å; F315-F319 HydrophobicContact CD1-CZ 4.12Å; F315-F319 AromaticContact CE1-CE1 3.86Å; F315-F319 HydrophobicContact CE1-CE1 3.86Å; F315-F319 HydrophobicContact CE1-CZ 4.23Å; F315-F319 AromaticContact CG-CD1 3.94Å; F315-F319 HydrophobicContact CG-CD1 3.94Å; F315-F319 AromaticContact CG-CE1 3.88Å; F315-F319 HydrophobicContact CG-CE1 3.88Å; F315-V320 HydrophobicContact CB-CG2 4.07Å
316	P	84.8	Confident	84.4	Confident	63 Å²	63	58.2 Å²	58.2	41%	0.409	32%	0.323	S	S	.	.			trans	-67.8	144.7	169.7	-18	31.1	0	0	0	112.2	E318 F319 V320	P316-E318 PolarHBondContact O-N 2.96Å; P316-F319 WeakPolarHBondContact O-CB 3.35Å; P316-F319 PolarHBondContact O-N 3.25Å; P316-V320 PolarHBondContact O-N 3.35Å; P316-V320 VanDerWaalsContact O-N 3.16Å
317	D	84.6	Confident	84.3	Confident	127 Å²	127	58.2 Å²	58.2	68%	0.679	32%	0.323	S	S	*	.	H	α-helix	trans	-50.4	-44.5	176.4	-51.5	-17.4	0	0	0	112.2	F319 V320 F321	D317-F319 VanDerWaalsContact C-N 3.3Å; D317-F319 PolarHBondContact O-N 3.26Å; D317-V320 WeakPolarHBondContact O-CB 3.41Å; D317-V320 PolarHBondContact O-N 3.05Å; D317-F321 VanDerWaalsContact O-CD2 3.23Å; D317-F321 WeakPolarHBondContact O-CD2 3.35Å; D317-F321 PolarHBondContact O-N 3.16Å
318	E	87.8	Confident	83.9	Confident	138 Å²	138	54.6 Å²	54.6	65%	0.645	31%	0.31	S	S	*	.	H	α-helix	trans	-56.8	-41	178.2	-63	-177.8	148.2	0	0	112.3	Y277 P316 F321 D322	Y277-E318 HydrophobicContact CE1-CB 4.37Å; P316-E318 PolarHBondContact O-N 2.96Å; E318-F321 PolarHBondContact O-N 3.38Å; E318-D322 WeakPolarHBondContact O-CB 3.38Å; E318-D322 PolarHBondContact O-N 2.95Å
319	F	89	Confident	83.4	Confident	0 Å²	0	50 Å²	50	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-67.8	-38.4	175.5	168.8	-86.1	0	0	0	111.6	L273 L274 Y277 M289 F315 P316 D317 D322 V323	L273-F319 HydrophobicContact CB-CD2 4.21Å; L273-F319 HydrophobicContact CB-CE2 3.84Å; L274-F319 HydrophobicContact CD2-CE2 3.97Å; L274-F319 HydrophobicContact CD2-CZ 3.62Å; L274-F319 HydrophobicContact CG-CE2 4.27Å; L274-F319 HydrophobicContact CG-CZ 4.14Å; Y277-F319 HydrophobicContact CD1-CB 4.16Å; Y277-F319 HydrophobicContact CD2-CB 4.34Å; Y277-F319 AromaticContact CD2-CD2 3.74Å; Y277-F319 HydrophobicContact CD2-CD2 3.74Å; Y277-F319 HydrophobicContact CE1-CB 4.26Å; Y277-F319 HydrophobicContact CE2-CB 4.41Å; Y277-F319 HydrophobicContact CE2-CD2 4.35Å; Y277-F319 HydrophobicContact CG-CB 4.2Å; Y277-F319 AromaticContact CG-CD2 3.95Å; Y277-F319 HydrophobicContact CG-CD2 3.95Å; M289-F319 HydrophobicContact CE-CE1 3.96Å; M289-F319 HydrophobicContact CE-CZ 4.03Å; M289-F319 HydrophobicContact SD-CE1 4.31Å; M289-F319 HydrophobicContact SD-CZ 4.12Å; F315-F319 HydrophobicContact CB-CD1 3.85Å; F315-F319 HydrophobicContact CB-CE1 4.3Å; F315-F319 AromaticContact CD1-CD1 3.71Å; F315-F319 HydrophobicContact CD1-CD1 3.71Å; F315-F319 AromaticContact CD1-CE1 3.42Å; F315-F319 HydrophobicContact CD1-CE1 3.42Å; F315-F319 VanDerWaalsContact CD1-CE1 3.42Å; F315-F319 HydrophobicContact CD1-CZ 4.12Å; F315-F319 AromaticContact CE1-CE1 3.86Å; F315-F319 HydrophobicContact CE1-CE1 3.86Å; F315-F319 HydrophobicContact CE1-CZ 4.23Å; F315-F319 AromaticContact CG-CD1 3.94Å; F315-F319 HydrophobicContact CG-CD1 3.94Å; F315-F319 AromaticContact CG-CE1 3.88Å; F315-F319 HydrophobicContact CG-CE1 3.88Å; P316-F319 WeakPolarHBondContact O-CB 3.35Å; P316-F319 PolarHBondContact O-N 3.25Å; D317-F319 VanDerWaalsContact C-N 3.3Å; D317-F319 PolarHBondContact O-N 3.26Å; F319-D322 PolarHBondContact O-N 3.38Å; F319-V323 HydrophobicContact CD1-CG2 4.11Å; F319-V323 HydrophobicContact CD2-CG2 4.27Å; F319-V323 HydrophobicContact CE1-CG2 3.68Å; F319-V323 HydrophobicContact CE2-CG2 3.86Å; F319-V323 HydrophobicContact CG-CG2 4.39Å; F319-V323 HydrophobicContact CZ-CG2 3.54Å; F319-V323 WeakPolarHBondContact O-CB 3.47Å; F319-V323 VanDerWaalsContact O-CG2 3.31Å; F319-V323 WeakPolarHBondContact O-CG2 3.03Å; F319-V323 PolarHBondContact O-N 2.72Å
320	V	88.1	Confident	82.9	Confident	16 Å²	16	48.7 Å²	48.7	10%	0.097	28%	0.283	C	S	.	.	H	α-helix	trans	-64.9	-41.4	176.8	177.4	0	0	0	0	111	F302 A303 L306 F315 P316 D317 W324	F302-V320 HydrophobicContact CD1-CG1 4.03Å; F302-V320 HydrophobicContact CE1-CG1 4.31Å; A303-V320 HydrophobicContact CB-CG1 3.92Å; L306-V320 HydrophobicContact CD1-CB 4.49Å; L306-V320 HydrophobicContact CD1-CG1 3.98Å; L306-V320 HydrophobicContact CD1-CG2 3.99Å; F315-V320 HydrophobicContact CB-CG2 4.07Å; P316-V320 PolarHBondContact O-N 3.35Å; P316-V320 VanDerWaalsContact O-N 3.16Å; D317-V320 WeakPolarHBondContact O-CB 3.41Å; D317-V320 PolarHBondContact O-N 3.05Å; V320-W324 WeakPolarHBondContact O-CB 3.45Å; V320-W324 PolarHBondContact O-N 3.43Å
321	F	88.4	Confident	82.1	Confident	114 Å²	114	52.5 Å²	52.5	50%	0.5	30%	0.299	S	S	.	.	H	α-helix	trans	-64.7	-42.8	172.9	-79.6	-72.5	0	0	0	112.6	P299 D317 E318 W324 G325	P299-F321 HydrophobicContact CB-CD1 3.9Å; P299-F321 HydrophobicContact CB-CE1 3.53Å; P299-F321 HydrophobicContact CB-CZ 4.3Å; P299-F321 HydrophobicContact CG-CD1 4.09Å; P299-F321 HydrophobicContact CG-CE1 3.73Å; D317-F321 VanDerWaalsContact O-CD2 3.23Å; D317-F321 WeakPolarHBondContact O-CD2 3.35Å; D317-F321 PolarHBondContact O-N 3.16Å; E318-F321 PolarHBondContact O-N 3.38Å; F321-W324 PolarHBondContact O-N 3.48Å; F321-G325 PolarHBondContact O-N 3.44Å
322	D	90.4	Very high	81.7	Confident	74 Å²	74	55.9 Å²	55.9	40%	0.396	31%	0.313	S	S	.	.	H	α-helix	trans	-64.4	-41.8	176.7	-85.2	-12.5	0	0	0	112.2	L273 Y277 E318 F319 G325 A326	L273-D322 HydrophobicContact CD1-CB 4Å; L273-D322 HydrophobicContact CD2-CB 3.92Å; Y277-D322 WeakPolarHBondContact CE2-OD2 3.28Å; Y277-D322 PolarHBondContact OH-OD2 2.93Å; E318-D322 WeakPolarHBondContact O-CB 3.38Å; E318-D322 PolarHBondContact O-N 2.95Å; F319-D322 PolarHBondContact O-N 3.38Å; D322-G325 PolarHBondContact O-N 2.86Å; D322-A326 WeakPolarHBondContact O-CB 3.46Å; D322-A326 PolarHBondContact O-N 2.85Å
323	V	89.8	Confident	80.9	Confident	0 Å²	0	52.7 Å²	52.7	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-66.1	-42.4	175.7	169.2	0	0	0	0	111.1	V270 L273 F302 F319 G325 A326 I327	V270-V323 HydrophobicContact CG1-CG1 4.43Å; V270-V323 HydrophobicContact CG1-CG2 4.28Å; V270-V323 HydrophobicContact CG2-CG1 3.92Å; V270-V323 HydrophobicContact CG2-CG2 4.36Å; L273-V323 HydrophobicContact CB-CG2 4.47Å; L273-V323 HydrophobicContact CD1-CB 4.46Å; L273-V323 HydrophobicContact CD1-CG2 3.74Å; F302-V323 HydrophobicContact CE1-CB 4.25Å; F302-V323 HydrophobicContact CE1-CG1 3.73Å; F302-V323 HydrophobicContact CZ-CG1 3.6Å; F319-V323 HydrophobicContact CD1-CG2 4.11Å; F319-V323 HydrophobicContact CD2-CG2 4.27Å; F319-V323 HydrophobicContact CE1-CG2 3.68Å; F319-V323 HydrophobicContact CE2-CG2 3.86Å; F319-V323 HydrophobicContact CG-CG2 4.39Å; F319-V323 HydrophobicContact CZ-CG2 3.54Å; F319-V323 WeakPolarHBondContact O-CB 3.47Å; F319-V323 VanDerWaalsContact O-CG2 3.31Å; F319-V323 WeakPolarHBondContact O-CG2 3.03Å; F319-V323 PolarHBondContact O-N 2.72Å; V323-G325 VanDerWaalsContact C-N 3.34Å; V323-G325 PolarHBondContact O-N 2.85Å; V323-A326 WeakPolarHBondContact O-CB 3.1Å; V323-A326 PolarHBondContact O-N 3.34Å; V323-I327 HydrophobicContact CG1-CD1 3.89Å; V323-I327 WeakPolarHBondContact O-CG1 3.38Å; V323-I327 PolarHBondContact O-N 3.03Å
324	W	89.1	Confident	80	Confident	49 Å²	49	60.6 Å²	60.6	19%	0.186	34%	0.34	C	S	.	.	H	α-helix	trans	-60.5	-43.9	173.3	175.5	-104.8	0	0	0	111.7	K296 P299 F302 V320 F321 I327 G328	K296-W324 HydrophobicContact CB-CH2 4.31Å; K296-W324 HydrophobicContact CB-CZ3 4Å; K296-W324 WeakPolarHBondContact O-CH2 3.29Å; P299-W324 HydrophobicContact CB-CG 4.35Å; P299-W324 HydrophobicContact CG-CG 4.29Å; F302-W324 HydrophobicContact CB-CE3 3.79Å; F302-W324 HydrophobicContact CB-CZ3 4.15Å; F302-W324 HydrophobicContact CD1-CB 3.94Å; F302-W324 HydrophobicContact CD1-CE3 4.02Å; F302-W324 HydrophobicContact CD2-CE3 4.43Å; F302-W324 HydrophobicContact CE1-CB 4.24Å; F302-W324 AromaticContact CG-CE3 3.82Å; F302-W324 HydrophobicContact CG-CE3 3.82Å; F302-W324 HydrophobicContact CG-CZ3 4.43Å; V320-W324 WeakPolarHBondContact O-CB 3.45Å; V320-W324 PolarHBondContact O-N 3.43Å; F321-W324 PolarHBondContact O-N 3.48Å; W324-I327 PolarHBondContact O-N 2.84Å; W324-G328 PolarHBondContact O-N 2.92Å
325	G	86.9	Confident	78.6	Confident	32 Å²	32	61 Å²	61	33%	0.33	33%	0.334	S	S	.	.	H	α-helix	trans	-61	-43.9	173.8	0	0	0	0	0	112.5	F321 D322 V323 I327 G328 D329	F321-G325 PolarHBondContact O-N 3.44Å; D322-G325 PolarHBondContact O-N 2.86Å; V323-G325 VanDerWaalsContact C-N 3.34Å; V323-G325 PolarHBondContact O-N 2.85Å; G325-I327 PolarHBondContact O-N 3.33Å; G325-G328 PolarHBondContact O-N 2.68Å; G325-D329 WeakPolarHBondContact O-CB 3.37Å; G325-D329 PolarHBondContact O-N 2.71Å
326	A	86.8	Confident	78.4	Confident	7 Å²	7	63.1 Å²	63.1	6%	0.058	35%	0.347	C	S	.	.	H	α-helix	trans	-58.4	-46	176.2	0	0	0	0	0	112.1	K269 L273 D322 V323 A330	K269-A326 HydrophobicContact CB-CB 4.02Å; K269-A326 HydrophobicContact CD-CB 3.91Å; L273-A326 HydrophobicContact CD1-CB 4.11Å; D322-A326 WeakPolarHBondContact O-CB 3.46Å; D322-A326 PolarHBondContact O-N 2.85Å; V323-A326 WeakPolarHBondContact O-CB 3.1Å; V323-A326 PolarHBondContact O-N 3.34Å; A326-A330 WeakPolarHBondContact O-CB 3.48Å; A326-A330 PolarHBondContact O-N 3.13Å
327	I	85.7	Confident	78	Confident	2 Å²	2	63.1 Å²	63.1	1%	0.01	34%	0.343	C	S	.	.	H	α-helix	trans	-68	-38.8	176.3	-65.1	164.7	0	0	0	111	V290 F302 V323 W324 G325 K331	V290-I327 HydrophobicContact CG2-CD1 4.41Å; V290-I327 HydrophobicContact CG2-CG1 4.16Å; F302-I327 HydrophobicContact CE2-CD1 4.21Å; F302-I327 HydrophobicContact CZ-CD1 3.91Å; V323-I327 HydrophobicContact CG1-CD1 3.89Å; V323-I327 WeakPolarHBondContact O-CG1 3.38Å; V323-I327 PolarHBondContact O-N 3.03Å; W324-I327 PolarHBondContact O-N 2.84Å; G325-I327 PolarHBondContact O-N 3.33Å; I327-K331 HydrophobicContact CG2-CD 4.4Å; I327-K331 WeakPolarHBondContact O-CG 3.38Å; I327-K331 PolarHBondContact O-N 2.9Å
328	G	78.9	Confident	77.7	Confident	25 Å²	25	59.6 Å²	59.6	26%	0.258	33%	0.325	S	S	.	.	H	α-helix	trans	-69.8	-52	-178.6	0	0	0	0	0	114.6	W324 G325 A330 K331 V332	W324-G328 PolarHBondContact O-N 2.92Å; G325-G328 PolarHBondContact O-N 2.68Å; G328-A330 PolarHBondContact O-N 3.39Å; G328-K331 PolarHBondContact O-N 3.26Å; G328-K331 VanDerWaalsContact O-N 3.16Å; G328-V332 WeakPolarHBondContact O-CG2 3.43Å; G328-V332 PolarHBondContact O-N 3.06Å
329	D	75.3	Confident	77.1	Confident	73 Å²	73	54.9 Å²	54.9	39%	0.39	31%	0.306	S	S	.	.	H	α-helix	trans	-50.8	-45.1	172.8	-96.1	-12.6	0	0	0	111.1	K269 G325 V332 G333 R334 V335	K269-D329 IonicContact NZ-OD2 3.32Å; K269-D329 PolarHBondContact NZ-OD2 3.45Å; G325-D329 WeakPolarHBondContact O-CB 3.37Å; G325-D329 PolarHBondContact O-N 2.71Å; D329-V332 PolarHBondContact O-N 2.95Å; D329-G333 PolarHBondContact O-N 3.3Å; D329-R334 PolarHBondContact O-N 3.49Å; D329-V335 HydrophobicContact CB-CG2 3.96Å
330	A	69.6	Low	76.3	Confident	5 Å²	5	58.4 Å²	58.4	4%	0.041	33%	0.325	C	S	.	.	H	α-helix	trans	-63.9	-51.8	-178.7	0	0	0	0	0	109	F262 A266 A326 G328 V332 G333 V335	F262-A330 HydrophobicContact CD2-CB 4.46Å; F262-A330 WeakPolarHBondContact CD2-O 3.37Å; F262-A330 HydrophobicContact CE2-CB 3.42Å; F262-A330 VanDerWaalsContact CE2-CB 3.42Å; F262-A330 WeakPolarHBondContact CE2-O 3.4Å; F262-A330 HydrophobicContact CZ-CB 4Å; A266-A330 HydrophobicContact CB-CB 4.16Å; A326-A330 WeakPolarHBondContact O-CB 3.48Å; A326-A330 PolarHBondContact O-N 3.13Å; G328-A330 PolarHBondContact O-N 3.39Å; A330-V332 PolarHBondContact O-N 3.19Å; A330-G333 PolarHBondContact O-N 2.82Å; A330-V335 HydrophobicContact CB-CG2 4.19Å
331	K	66.9	Low	75.5	Confident	89 Å²	89	61.2 Å²	61.2	39%	0.387	34%	0.34	S	S	.	.	H	α-helix	trans	-53.6	-27.6	178	-79.6	176.2	-174.6	177.9	0	113.7	F262 G293 K294 I327 G328	F262-K331 HydrophobicContact CE1-CG 4.36Å; F262-K331 VanDerWaalsContact CE2-N 3.34Å; F262-K331 HydrophobicContact CZ-CB 4.41Å; F262-K331 HydrophobicContact CZ-CG 3.95Å; G293-K331 PolarHBondContact O-NZ 3.24Å; K294-K331 PolarHBondContact O-NZ 3.32Å; I327-K331 HydrophobicContact CG2-CD 4.4Å; I327-K331 WeakPolarHBondContact O-CG 3.38Å; I327-K331 PolarHBondContact O-N 2.9Å; G328-K331 PolarHBondContact O-N 3.26Å; G328-K331 VanDerWaalsContact O-N 3.16Å
332	V	63.9	Low	74.6	Confident	102 Å²	102	57.4 Å²	57.4	62%	0.618	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92	-0.1	-180	-174.1	0	0	0	0	112.4	G328 D329 A330 R334	G328-V332 WeakPolarHBondContact O-CG2 3.43Å; G328-V332 PolarHBondContact O-N 3.06Å; D329-V332 PolarHBondContact O-N 2.95Å; A330-V332 PolarHBondContact O-N 3.19Å; V332-R334 VanDerWaalsContact C-N 3.34Å; V332-R334 HydrophobicContact CB-CG 4.24Å; V332-R334 HydrophobicContact CG1-CG 4Å
333	G	57.9	Low	73.4	Confident	64 Å²	64	56.2 Å²	56.2	66%	0.66	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.7	26	179.4	0	0	0	0	0	113.9	D329 A330 V335	D329-G333 PolarHBondContact O-N 3.3Å; A330-G333 PolarHBondContact O-N 2.82Å; G333-V335 VanDerWaalsContact C-N 3.29Å; G333-V335 PolarHBondContact O-N 3.3Å
334	R	56.3	Low	72	Confident	193 Å²	193	60.8 Å²	60.8	73%	0.728	35%	0.35	S	S	*	.			trans	-90.3	24	-176.3	-68	-176.7	169.2	-173.9	-2	114	D329 V332	D329-R334 PolarHBondContact O-N 3.49Å; V332-R334 VanDerWaalsContact C-N 3.34Å; V332-R334 HydrophobicContact CB-CG 4.24Å; V332-R334 HydrophobicContact CG1-CG 4Å
335	V	47.3	Very low	70.5	Confident	89 Å²	89	61.9 Å²	61.9	54%	0.539	37%	0.365	S	S	.	.			trans	-136.4	0	-169.7	-156.3	0	0	0	0	111.6	K265 D329 A330 G333	K265-V335 HydrophobicContact CD-CB 4.29Å; K265-V335 HydrophobicContact CD-CG1 4.16Å; K265-V335 HydrophobicContact CG-CG1 4.46Å; K265-V335 PolarHBondContact NZ-O 3.16Å; K265-V335 PolarHBondContact NZ-OXT 3.33Å; D329-V335 HydrophobicContact CB-CG2 3.96Å; A330-V335 HydrophobicContact CB-CG2 4.19Å; G333-V335 VanDerWaalsContact C-N 3.29Å; G333-V335 PolarHBondContact O-N 3.3Å

Retrieved 335 of 335 residues in 101 ms (Link to these results)

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