A0A087X0W9_HUMAN Loading...

ubiquitinyl hydrolase 1

AlphaFold DB , UniProt , Accession A0A087X0W9, Species HUMAN (Homo sapiens, Human), Gene OTUD6B, Length 323 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	43.9	Very low	35.6	Very low	249 Å²	249	182 Å²	182	100%	1.227	89%	0.885	S	S	*	*				0	95.6	0	-86.9	172.2	165.9	0	0	106.5
2	E	36.5	Very low	35.8	Very low	184 Å²	184	177.4 Å²	177.4	86%	0.86	88%	0.875	S	S	*	*			trans	-124.5	133.6	176.7	-73.7	-178.8	152.8	0	0	107.4
3	P	39.7	Very low	35.7	Very low	125 Å²	125	173.2 Å²	173.2	81%	0.812	87%	0.869	S	S	*	*			trans	-81.2	124	-179.2	29.5	-29.6	0	0	0	111.3	V5	P3-V5 PolarHBondContact O-N 3.48Å
4	R	36.8	Very low	36.1	Very low	248 Å²	248	169.7 Å²	169.7	94%	0.936	86%	0.862	S	S	*	*			trans	-76.7	109.6	175.3	-162.7	-179.3	-160.3	179.9	6.1	109
5	V	36.5	Very low	36.2	Very low	137 Å²	137	165.5 Å²	165.5	83%	0.83	85%	0.854	S	S	*	*			trans	-100.7	121.6	170.1	-176.2	0	0	0	0	109.3	P3	P3-V5 PolarHBondContact O-N 3.48Å
6	R	34.3	Very low	36.2	Very low	217 Å²	217	171.1 Å²	171.1	82%	0.819	86%	0.861	S	S	*	*			trans	-92.4	117.8	-174.2	-156.9	-175.1	-135.9	-148.1	4.4	108
7	V	35.8	Very low	36.3	Very low	146 Å²	146	167.9 Å²	167.9	89%	0.885	86%	0.857	S	S	*	*			trans	-81.5	113.9	168.7	-105	0	0	0	0	108.3
8	E	35.3	Very low	36.9	Very low	165 Å²	165	170.8 Å²	170.8	77%	0.771	86%	0.855	S	S	*	*			trans	-81.3	117	172.5	-68.9	-164.9	154.3	0	0	109.9
9	G	30.3	Very low	36.9	Very low	72 Å²	72	173.1 Å²	173.1	74%	0.742	86%	0.86	S	S	*	*			trans	-74.2	132.7	175.3	0	0	0	0	0	111.8	K11	G9-K11 PolarHBondContact O-N 2.95Å
10	W	30.9	Very low	37.2	Very low	254 Å²	254	172.4 Å²	172.4	96%	0.962	86%	0.858	S	S	*	*			trans	-79.7	108.7	165.1	-82	32.4	0	0	0	109.1
11	K	31.9	Very low	37.5	Very low	205 Å²	205	170.5 Å²	170.5	89%	0.891	85%	0.85	S	S	*	*	P	Polyproline II helix	trans	-78	126.4	166.8	-81.8	179.9	174.1	-179.4	0	109.2	G9	G9-K11 PolarHBondContact O-N 2.95Å
12	V	37.4	Very low	37.4	Very low	127 Å²	127	163.1 Å²	163.1	77%	0.77	83%	0.829	S	S	*	*	P	Polyproline II helix	trans	-85.9	129.5	164.5	-174.9	0	0	0	0	108
13	P	35.6	Very low	37.6	Very low	122 Å²	122	165.6 Å²	165.6	79%	0.792	83%	0.831	S	S	*	*	P	Polyproline II helix	trans	-83.9	119.5	174.1	30.3	-27.8	0	0	0	110.7
14	T	40.1	Very low	37.7	Very low	125 Å²	125	164 Å²	164	77%	0.767	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-79.1	154.6	160	40.5	0	0	0	0	110.8
15	S	38.6	Very low	38	Very low	107 Å²	107	157.2 Å²	157.2	75%	0.748	80%	0.8	S	S	*	*			trans	92.7	103.5	157.3	-33.7	0	0	0	0	117.8
16	R	36.1	Very low	38.3	Very low	254 Å²	254	153.5 Å²	153.5	96%	0.958	79%	0.789	S	S	*	*				177.4	95.7	121	-100	175.4	176.2	-158.3	-0.9	110.1
17	C	38	Very low	38.6	Very low	118 Å²	118	153.3 Å²	153.3	80%	0.797	79%	0.79	S	S	*	*			trans	-139.5	152.3	157.2	-158.6	0	0	0	0	107.8
18	R	46	Very low	38.7	Very low	220 Å²	220	150.5 Å²	150.5	83%	0.83	77%	0.77	S	S	*	*	S	Bend	trans	88.9	93.5	-172.4	-53.8	175	-176	-133	-0.7	113.2
19	F	38.1	Very low	39.1	Very low	214 Å²	214	147 Å²	147	94%	0.939	76%	0.759	S	S	*	*	S	Bend	trans	178.1	7.9	135.6	-100	-69.2	0	0	0	114.1
20	L	41.6	Very low	39.7	Very low	158 Å²	158	149.2 Å²	149.2	83%	0.827	76%	0.758	S	S	*	*	S	Bend	trans	-107	3.7	179.5	-81.2	162.7	0	0	0	115.8
21	L	44.3	Very low	40.1	Very low	133 Å²	133	143.7 Å²	143.7	70%	0.696	75%	0.745	S	S	*	*	S	Bend	trans	-83.7	-26.9	-171.3	-95.1	149.7	0	0	0	115.2	L25	L21-L25 WeakPolarHBondContact O-CD1 3.1Å
22	A	41.8	Very low	40.4	Very low	94 Å²	94	139.4 Å²	139.4	78%	0.777	73%	0.728	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.6	-12.6	-167.4	0	0	0	0	0	115.9
23	R	41.8	Very low	40.6	Very low	237 Å²	237	137 Å²	137	89%	0.894	72%	0.722	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.4	-10.9	-179.1	-89	-176.3	165.6	177.8	-3.9	115
24	V	41.6	Very low	40.9	Very low	90 Å²	90	137.1 Å²	137.1	55%	0.545	72%	0.719	S	S	.	*	T	Hydrogen-bonded Turn	trans	-84.3	-27.9	175.9	-178.9	0	0	0	0	111.4	G26 Y27 L28	V24-G26 VanDerWaalsContact C-N 3.31Å; V24-G26 PolarHBondContact O-N 2.81Å; V24-Y27 PolarHBondContact O-N 2.8Å; V24-L28 PolarHBondContact O-N 3.42Å
25	L	42.5	Very low	41.1	Very low	106 Å²	106	135.8 Å²	135.8	56%	0.555	71%	0.707	S	S	*	*	H	α-helix	trans	-65.9	-25	-178.9	-87.2	153.2	0	0	0	114.5	L21 V29	L21-L25 WeakPolarHBondContact O-CD1 3.1Å; L25-V29 VanDerWaalsContact O-CG2 3.27Å; L25-V29 WeakPolarHBondContact O-CG2 3.34Å
26	G	42.2	Very low	41.4	Very low	59 Å²	59	134.5 Å²	134.5	61%	0.608	70%	0.695	S	S	*	*	H	α-helix	trans	-78.5	-25.7	179.9	0	0	0	0	0	114.6	V24	V24-G26 VanDerWaalsContact C-N 3.31Å; V24-G26 PolarHBondContact O-N 2.81Å
27	Y	41.2	Very low	42	Very low	214 Å²	214	130.4 Å²	130.4	84%	0.839	69%	0.687	S	S	*	*	H	α-helix	trans	-97.2	-17.1	179.4	-101.5	-89.6	0	0	0	113.1	V24	V24-Y27 PolarHBondContact O-N 2.8Å
28	L	37.8	Very low	42.5	Very low	87 Å²	87	128.1 Å²	128.1	46%	0.455	66%	0.664	S	S	.	*	H	α-helix	trans	-79.1	-33.8	179.8	-152.3	72.1	0	0	0	112.7	V24 V30 M31 E32	V24-L28 PolarHBondContact O-N 3.42Å; L28-V30 VanDerWaalsContact C-N 3.26Å; L28-V30 PolarHBondContact O-N 3.37Å; L28-M31 PolarHBondContact O-N 3.15Å; L28-M31 VanDerWaalsContact O-N 3.15Å; L28-E32 PolarHBondContact O-N 2.97Å; L28-E32 VanDerWaalsContact O-N 3.14Å
29	V	42.7	Very low	42.8	Very low	90 Å²	90	122.9 Å²	122.9	55%	0.545	65%	0.652	S	S	.	*	H	α-helix	trans	-68.3	-22.5	-175	175.5	0	0	0	0	113.1	L25	L25-V29 VanDerWaalsContact O-CG2 3.27Å; L25-V29 WeakPolarHBondContact O-CG2 3.34Å
30	V	43.3	Very low	44	Very low	120 Å²	120	117.3 Å²	117.3	73%	0.727	63%	0.632	S	S	*	*	H	α-helix	trans	-90.3	-13.4	178.3	-167.6	0	0	0	0	112.3	L28	L28-V30 VanDerWaalsContact C-N 3.26Å; L28-V30 PolarHBondContact O-N 3.37Å
31	M	39.3	Very low	45.5	Very low	137 Å²	137	115 Å²	115	68%	0.675	62%	0.617	S	S	*	*	H	α-helix	trans	-96.9	-20.9	174.6	-117.3	172.4	68	0	0	113.1	L28	L28-M31 PolarHBondContact O-N 3.15Å; L28-M31 VanDerWaalsContact O-N 3.15Å
32	E	39.6	Very low	47	Very low	116 Å²	116	112.5 Å²	112.5	54%	0.542	60%	0.602	S	S	.	*	H	α-helix	trans	-71.8	-29.2	179.1	-107.3	174.5	157.6	0	0	113.6	L28 V34 T36	L28-E32 PolarHBondContact O-N 2.97Å; L28-E32 VanDerWaalsContact O-N 3.14Å; E32-V34 VanDerWaalsContact C-N 3.33Å; E32-V34 PolarHBondContact O-N 3.07Å; E32-T36 WeakPolarHBondContact O-CG2 3.22Å
33	A	40.4	Very low	48.6	Very low	77 Å²	77	112.2 Å²	112.2	64%	0.636	59%	0.585	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.1	-1.3	-169.6	0	0	0	0	0	115.8
34	V	42	Very low	50.3	Low	123 Å²	123	106.5 Å²	106.5	75%	0.745	57%	0.568	S	S	*	*	T	Hydrogen-bonded Turn	trans	-114.8	-5.5	180	-176.7	0	0	0	0	112.3	E32	E32-V34 VanDerWaalsContact C-N 3.33Å; E32-V34 PolarHBondContact O-N 3.07Å
35	L	44	Very low	52.4	Low	97 Å²	97	103.1 Å²	103.1	51%	0.508	55%	0.547	S	S	.	.	T	Hydrogen-bonded Turn	trans	-109.9	-4.6	-177.7	-89.2	158.3	0	0	0	114
36	T	44.7	Very low	54.2	Low	81 Å²	81	101.3 Å²	101.3	50%	0.497	54%	0.537	S	S	.	.	H	α-helix	trans	-81.3	-24.3	-174.1	41.2	0	0	0	0	114.1	E32	E32-T36 WeakPolarHBondContact O-CG2 3.22Å
37	E	48.5	Very low	56.1	Low	168 Å²	168	105.5 Å²	105.5	79%	0.785	54%	0.535	S	S	*	.	H	α-helix	trans	-81.4	-32.7	-180	-66.1	-176.5	168.1	0	0	112.8	L39	E37-L39 PolarHBondContact O-N 2.8Å
38	E	49.7	Very low	58.2	Low	69 Å²	69	101.8 Å²	101.8	32%	0.322	52%	0.519	S	S	.	.	H	α-helix	trans	-71.1	-29.8	-178.4	-63.9	-174	162.6	0	0	112.8	T104 K108	E38-T104 HydrophobicContact CG-CG2 4.04Å; E38-T104 WeakPolarHBondContact OE1-CG2 3.37Å; E38-K108 IonicContact OE1-NZ 3.45Å; E38-K108 PolarHBondContact OE1-NZ 2.84Å; E38-K108 IonicContact OE2-NZ 3.16Å; E38-K108 PolarHBondContact OE2-NZ 3.06Å
39	L	51.5	Low	60.8	Low	111 Å²	111	98.3 Å²	98.3	58%	0.581	50%	0.501	S	S	*	.	H	α-helix	trans	-75	-31.9	-179.6	-71.4	169.8	0	0	0	112.5	E37 E43	E37-L39 PolarHBondContact O-N 2.8Å; L39-E43 WeakPolarHBondContact O-CB 3.18Å; L39-E43 PolarHBondContact O-N 2.91Å
40	D	63.3	Low	62.9	Low	96 Å²	96	102 Å²	102	51%	0.513	51%	0.505	S	S	.	.	H	α-helix	trans	-72.4	-38.4	-176.4	-93.9	-19.8	0	0	0	112.7	Q44	D40-Q44 WeakPolarHBondContact O-CB 3.45Å; D40-Q44 WeakPolarHBondContact O-CG 3.49Å; D40-Q44 PolarHBondContact O-N 3.01Å
41	E	72.8	Confident	65.1	Low	109 Å²	109	103 Å²	103	51%	0.509	50%	0.499	S	S	.	.	H	α-helix	trans	-74	-42.1	179.9	-65.3	-170.3	160.9	0	0	112.7	Q44 L45 L100	E41-Q44 PolarHBondContact O-N 2.8Å; E41-L45 WeakPolarHBondContact O-CB 3.44Å; E41-L45 PolarHBondContact O-N 2.9Å; E41-L100 HydrophobicContact CB-CD1 4.46Å
42	E	75.4	Confident	67.4	Low	82 Å²	82	98.7 Å²	98.7	38%	0.383	48%	0.477	S	S	.	.	H	α-helix	trans	-64.8	-41.9	174.9	-174.1	173.7	-165.2	0	0	110.6	L45 L46 L100	E42-L45 PolarHBondContact O-N 3.29Å; E42-L46 HydrophobicContact CG-CD1 4.23Å; E42-L46 WeakPolarHBondContact O-CB 3.35Å; E42-L46 VanDerWaalsContact O-CG 3.28Å; E42-L46 WeakPolarHBondContact O-CG 3.34Å; E42-L46 PolarHBondContact O-N 3.09Å; E42-L100 HydrophobicContact CB-CD2 3.96Å; E42-L100 HydrophobicContact CG-CD2 4.36Å
43	E	76.6	Confident	69.8	Low	88 Å²	88	99 Å²	99	41%	0.411	48%	0.477	S	S	.	.	H	α-helix	trans	-65.3	-40.7	177.1	-170.9	176.5	168.4	0	0	112.1	L39 L46 R47	L39-E43 WeakPolarHBondContact O-CB 3.18Å; L39-E43 PolarHBondContact O-N 2.91Å; E43-L46 PolarHBondContact O-N 3.2Å; E43-R47 WeakPolarHBondContact O-CB 3.18Å; E43-R47 VanDerWaalsContact O-CG 3.24Å; E43-R47 WeakPolarHBondContact O-CG 3.3Å; E43-R47 PolarHBondContact O-N 3.08Å; E43-R47 IonicContact OE1-CZ 2.74Å; E43-R47 VanDerWaalsContact OE1-CZ 3.28Å; E43-R47 IonicContact OE1-NE 3.81Å; E43-R47 PolarHBondContact OE1-NE 2.74Å; E43-R47 IonicContact OE1-NH2 3.57Å; E43-R47 PolarHBondContact OE1-NH2 3.33Å
44	Q	77.7	Confident	72.2	Confident	116 Å²	116	102.9 Å²	102.9	54%	0.542	48%	0.48	S	S	.	.	H	α-helix	trans	-63.7	-40.5	174.5	-76.2	175.7	37.8	0	0	112.5	D40 E41 R47 R48	D40-Q44 WeakPolarHBondContact O-CB 3.45Å; D40-Q44 WeakPolarHBondContact O-CG 3.49Å; D40-Q44 PolarHBondContact O-N 3.01Å; E41-Q44 PolarHBondContact O-N 2.8Å; Q44-R47 PolarHBondContact O-N 3.24Å; Q44-R48 PolarHBondContact O-N 3.36Å
45	L	84.3	Confident	74.4	Confident	19 Å²	19	103.5 Å²	103.5	10%	0.099	47%	0.474	C	S	.	.	H	α-helix	trans	-64.6	-44.9	176.1	-173.6	63.9	0	0	0	111.1	E41 E42 R47 R48 H49 E96 L97 L100	E41-L45 WeakPolarHBondContact O-CB 3.44Å; E41-L45 PolarHBondContact O-N 2.9Å; E42-L45 PolarHBondContact O-N 3.29Å; L45-R47 VanDerWaalsContact C-N 3.34Å; L45-R47 PolarHBondContact O-N 3.26Å; L45-R48 WeakPolarHBondContact O-CA 3.42Å; L45-R48 WeakPolarHBondContact O-CB 3.28Å; L45-R48 PolarHBondContact O-N 3.5Å; L45-R48 VanDerWaalsContact O-N 3.08Å; L45-H49 PolarHBondContact O-CD2 2.95Å; L45-H49 PolarHBondContact O-N 3.03Å; L45-E96 HydrophobicContact CD1-CB 4.39Å; L45-E96 HydrophobicContact CD2-CB 4.29Å; L45-L97 HydrophobicContact CD2-CD2 4.09Å; L45-L100 HydrophobicContact CB-CD2 4.47Å; L45-L100 HydrophobicContact CD2-CB 4.15Å; L45-L100 HydrophobicContact CD2-CD2 3.81Å
46	L	81	Confident	76.7	Confident	68 Å²	68	100 Å²	100	36%	0.356	46%	0.456	S	S	.	.	H	α-helix	trans	-63.4	-37.8	176.2	-71.4	174.7	0	0	0	112.4	E42 E43 R48 H49 R50 L97	E42-L46 HydrophobicContact CG-CD1 4.23Å; E42-L46 WeakPolarHBondContact O-CB 3.35Å; E42-L46 VanDerWaalsContact O-CG 3.28Å; E42-L46 WeakPolarHBondContact O-CG 3.34Å; E42-L46 PolarHBondContact O-N 3.09Å; E43-L46 PolarHBondContact O-N 3.2Å; L46-R48 VanDerWaalsContact C-N 3.3Å; L46-R48 PolarHBondContact O-N 3.13Å; L46-H49 PolarHBondContact O-N 3.32Å; L46-R50 VanDerWaalsContact O-CG 3.32Å; L46-R50 WeakPolarHBondContact O-CG 3.17Å; L46-R50 PolarHBondContact O-N 2.98Å; L46-L97 HydrophobicContact CD2-CD2 4.3Å
47	R	81.9	Confident	78.8	Confident	147 Å²	147	101.7 Å²	101.7	56%	0.555	46%	0.458	S	S	*	.	H	α-helix	trans	-62.5	-37.5	172.8	-74.9	172.3	-178.9	-161.5	2.7	111.5	E43 Q44 L45 K51	E43-R47 WeakPolarHBondContact O-CB 3.18Å; E43-R47 VanDerWaalsContact O-CG 3.24Å; E43-R47 WeakPolarHBondContact O-CG 3.3Å; E43-R47 PolarHBondContact O-N 3.08Å; E43-R47 IonicContact OE1-CZ 2.74Å; E43-R47 VanDerWaalsContact OE1-CZ 3.28Å; E43-R47 IonicContact OE1-NE 3.81Å; E43-R47 PolarHBondContact OE1-NE 2.74Å; E43-R47 IonicContact OE1-NH2 3.57Å; E43-R47 PolarHBondContact OE1-NH2 3.33Å; Q44-R47 PolarHBondContact O-N 3.24Å; L45-R47 VanDerWaalsContact C-N 3.34Å; L45-R47 PolarHBondContact O-N 3.26Å; R47-K51 PolarHBondContact O-N 3.39Å
48	R	86.2	Confident	80.9	Confident	136 Å²	136	96.9 Å²	96.9	51%	0.513	45%	0.447	S	S	.	.	H	α-helix	trans	-66.7	-46.9	174.1	-167.5	-176	-59.1	165.5	3.6	111.5	Q44 L45 L46 R50 K51 E52	Q44-R48 PolarHBondContact O-N 3.36Å; L45-R48 WeakPolarHBondContact O-CA 3.42Å; L45-R48 WeakPolarHBondContact O-CB 3.28Å; L45-R48 PolarHBondContact O-N 3.5Å; L45-R48 VanDerWaalsContact O-N 3.08Å; L46-R48 VanDerWaalsContact C-N 3.3Å; L46-R48 PolarHBondContact O-N 3.13Å; R48-R50 VanDerWaalsContact C-N 3.27Å; R48-R50 PolarHBondContact O-N 2.89Å; R48-K51 WeakPolarHBondContact O-CB 3.44Å; R48-K51 PolarHBondContact O-N 3.17Å; R48-E52 PolarHBondContact O-N 3.36Å
49	H	91.8	Very high	82.8	Confident	15 Å²	15	99.5 Å²	99.5	7%	0.069	46%	0.458	C	S	.	.	H	α-helix	trans	-56.8	-40.5	176.5	-69.2	-178.8	0	0	0	112.3	L45 L46 K51 E52 K53 H93 E96	L45-H49 PolarHBondContact O-CD2 2.95Å; L45-H49 PolarHBondContact O-N 3.03Å; L46-H49 PolarHBondContact O-N 3.32Å; H49-K51 PolarHBondContact O-N 3.45Å; H49-E52 PolarHBondContact O-N 2.91Å; H49-K53 WeakPolarHBondContact O-CB 3.44Å; H49-K53 PolarHBondContact O-N 3.14Å; H49-H93 AromaticContact CD2-CD2 3.3Å; H49-H93 PolarHBondContact CD2-CD2 2.63Å; H49-H93 AromaticContact CD2-CE1 4Å; H49-H93 AromaticContact CD2-CG 3.67Å; H49-H93 AromaticContact CD2-NE2 3.54Å; H49-H93 AromaticContact CE1-CD2 3.98Å; H49-H93 AromaticContact CE1-CG 3.8Å; H49-H93 PolarHBondContact CE1-O 2.88Å; H49-H93 AromaticContact CG-CD2 3.72Å; H49-H93 AromaticContact CG-CE1 3.87Å; H49-H93 AromaticContact CG-CG 3.61Å; H49-H93 AromaticContact CG-ND1 3.73Å; H49-H93 AromaticContact CG-NE2 3.88Å; H49-H93 AromaticContact ND1-CG 3.71Å; H49-H93 AromaticContact NE2-CD2 3.49Å; H49-H93 PolarHBondContact NE2-CD2 3.01Å; H49-H93 AromaticContact NE2-CG 3.78Å; H49-E96 IonicContact CD2-OE2 3.79Å; H49-E96 PolarHBondContact CD2-OE2 3.19Å; H49-E96 IonicContact CE1-OE2 3.92Å; H49-E96 IonicContact NE2-OE2 3.16Å; H49-E96 PolarHBondContact NE2-OE2 2.92Å
50	R	87.5	Confident	84.7	Confident	168 Å²	168	94.6 Å²	94.6	63%	0.634	43%	0.432	S	S	*	.	H	α-helix	trans	-62.1	-40.4	175	-72.1	175.8	-171.9	-159.5	3.1	112.6	L46 R48 K54	L46-R50 VanDerWaalsContact O-CG 3.32Å; L46-R50 WeakPolarHBondContact O-CG 3.17Å; L46-R50 PolarHBondContact O-N 2.98Å; R48-R50 VanDerWaalsContact C-N 3.27Å; R48-R50 PolarHBondContact O-N 2.89Å; R50-K54 WeakPolarHBondContact O-CG 3.33Å; R50-K54 PolarHBondContact O-N 3.25Å
51	K	88	Confident	85.9	Confident	140 Å²	140	94.9 Å²	94.9	61%	0.609	43%	0.43	S	S	*	.	H	α-helix	trans	-67	-48.7	176.7	-71.1	179.2	-179.1	-178.6	0	111.3	R47 R48 H49 K53 K54 E55	R47-K51 PolarHBondContact O-N 3.39Å; R48-K51 WeakPolarHBondContact O-CB 3.44Å; R48-K51 PolarHBondContact O-N 3.17Å; H49-K51 PolarHBondContact O-N 3.45Å; K51-K53 VanDerWaalsContact C-N 3.25Å; K51-K53 PolarHBondContact O-N 3.33Å; K51-K54 WeakPolarHBondContact O-CB 3.13Å; K51-K54 PolarHBondContact O-N 3.12Å; K51-K54 VanDerWaalsContact O-N 3.08Å; K51-E55 WeakPolarHBondContact O-CG 3.28Å; K51-E55 PolarHBondContact O-N 3.35Å
52	E	88.8	Confident	86.7	Confident	46 Å²	46	91.6 Å²	91.6	22%	0.215	43%	0.425	C	S	.	.	H	α-helix	trans	-59.4	-37.3	178.2	-67.6	-177.9	179.8	0	0	111.8	R48 H49 E55 L56 M89 K92 H93	R48-E52 PolarHBondContact O-N 3.36Å; H49-E52 PolarHBondContact O-N 2.91Å; E52-E55 PolarHBondContact O-N 2.91Å; E52-L56 PolarHBondContact O-N 2.86Å; E52-M89 WeakPolarHBondContact O-CE 3.46Å; E52-K92 IonicContact OE1-NZ 2.54Å; E52-K92 IonicContact OE2-NZ 3.88Å; E52-H93 IonicContact OE2-CD2 3.99Å; E52-H93 IonicContact OE2-CE1 3.18Å; E52-H93 IonicContact OE2-NE2 3.78Å; E52-H93 PolarHBondContact OE2-NE2 2.93Å
53	K	89.9	Confident	87.3	Confident	123 Å²	123	90.1 Å²	90.1	54%	0.535	42%	0.419	S	S	.	.	H	α-helix	trans	-64.7	-41.8	174.9	-166.2	174.2	-177.8	176.6	0	113	H49 K51 L56 Q57 M89	H49-K53 WeakPolarHBondContact O-CB 3.44Å; H49-K53 PolarHBondContact O-N 3.14Å; K51-K53 VanDerWaalsContact C-N 3.25Å; K51-K53 PolarHBondContact O-N 3.33Å; K53-L56 PolarHBondContact O-N 3.02Å; K53-Q57 WeakPolarHBondContact O-CG 3.25Å; K53-Q57 PolarHBondContact O-N 2.7Å; K53-M89 HydrophobicContact CB-CE 4.28Å; K53-M89 HydrophobicContact CB-SD 4.27Å; K53-M89 HydrophobicContact CG-CE 4.49Å; K53-M89 HydrophobicContact CG-SD 4.4Å
54	K	89.6	Confident	87.9	Confident	158 Å²	158	90.1 Å²	90.1	69%	0.687	42%	0.418	S	S	*	.	H	α-helix	trans	-64.5	-42.5	175	-73	-179.2	179.1	-172.9	0	111.2	R50 K51 Q57 A58	R50-K54 WeakPolarHBondContact O-CG 3.33Å; R50-K54 PolarHBondContact O-N 3.25Å; K51-K54 WeakPolarHBondContact O-CB 3.13Å; K51-K54 PolarHBondContact O-N 3.12Å; K51-K54 VanDerWaalsContact O-N 3.08Å; K54-Q57 PolarHBondContact O-N 3.48Å; K54-A58 PolarHBondContact O-N 2.91Å
55	E	89.8	Confident	88.4	Confident	136 Å²	136	90.3 Å²	90.3	64%	0.636	42%	0.422	S	S	*	.	H	α-helix	trans	-64.3	-41.7	176.7	-71.3	174.4	-169.5	0	0	112.5	K51 E52 Q57 A58 K59	K51-E55 WeakPolarHBondContact O-CG 3.28Å; K51-E55 PolarHBondContact O-N 3.35Å; E52-E55 PolarHBondContact O-N 2.91Å; E55-Q57 VanDerWaalsContact C-N 3.34Å; E55-Q57 PolarHBondContact O-N 2.82Å; E55-A58 PolarHBondContact O-N 2.97Å; E55-K59 PolarHBondContact O-N 2.89Å
56	L	91.3	Very high	88.5	Confident	23 Å²	23	92.7 Å²	92.7	12%	0.12	45%	0.445	C	S	.	.	H	α-helix	trans	-63.1	-41.7	174.7	-175.6	69.7	0	0	0	111.3	E52 K53 A58 K59 I60 L85 E86 M89	E52-L56 PolarHBondContact O-N 2.86Å; K53-L56 PolarHBondContact O-N 3.02Å; L56-A58 VanDerWaalsContact C-N 3.34Å; L56-A58 PolarHBondContact O-N 2.93Å; L56-K59 CarbonylContact O-C 3.57Å; L56-K59 WeakPolarHBondContact O-CB 3.21Å; L56-K59 PolarHBondContact O-N 2.91Å; L56-K59 VanDerWaalsContact O-N 3.17Å; L56-I60 HydrophobicContact CD2-CD1 4.08Å; L56-I60 HydrophobicContact CG-CD1 3.85Å; L56-I60 HydrophobicContact CG-CG1 4.26Å; L56-I60 VanDerWaalsContact O-CG1 3.27Å; L56-I60 WeakPolarHBondContact O-CG1 3.39Å; L56-I60 PolarHBondContact O-N 3.06Å; L56-L85 HydrophobicContact CD1-CB 4.01Å; L56-E86 HydrophobicContact CD2-CG 3.93Å; L56-M89 HydrophobicContact CB-CE 3.12Å; L56-M89 HydrophobicContact CD2-CB 4.34Å; L56-M89 HydrophobicContact CD2-CE 3.19Å; L56-M89 HydrophobicContact CD2-SD 4.32Å; L56-M89 HydrophobicContact CG-CE 3.67Å
57	Q	89.4	Confident	88.8	Confident	117 Å²	117	90.1 Å²	90.1	55%	0.547	43%	0.432	S	S	.	.	H	α-helix	trans	-62.5	-40.9	177.2	-75.6	-175.1	-14.1	0	0	112.2	K53 K54 E55 K59 I60 Q61	K53-Q57 WeakPolarHBondContact O-CG 3.25Å; K53-Q57 PolarHBondContact O-N 2.7Å; K54-Q57 PolarHBondContact O-N 3.48Å; E55-Q57 VanDerWaalsContact C-N 3.34Å; E55-Q57 PolarHBondContact O-N 2.82Å; Q57-K59 VanDerWaalsContact C-N 3.33Å; Q57-K59 PolarHBondContact O-N 3.22Å; Q57-I60 PolarHBondContact O-N 2.97Å; Q57-Q61 WeakPolarHBondContact O-CB 3.28Å; Q57-Q61 PolarHBondContact O-N 3.05Å
58	A	91.5	Very high	88.8	Confident	67 Å²	67	86.8 Å²	86.8	55%	0.554	43%	0.429	S	S	*	.	H	α-helix	trans	-61.1	-42.2	172.9	0	0	0	0	0	111.7	K54 E55 L56 Q61 G62	K54-A58 PolarHBondContact O-N 2.91Å; E55-A58 PolarHBondContact O-N 2.97Å; L56-A58 VanDerWaalsContact C-N 3.34Å; L56-A58 PolarHBondContact O-N 2.93Å; A58-Q61 PolarHBondContact O-N 2.67Å; A58-G62 PolarHBondContact O-N 3.18Å
59	K	90.4	Very high	88.4	Confident	125 Å²	125	89.7 Å²	89.7	54%	0.543	45%	0.446	S	S	.	.	H	α-helix	trans	-63.9	-44.3	175.5	-170.7	175.8	-178.5	179.4	0	112.5	E55 L56 Q57 Q61 G62 M63	E55-K59 PolarHBondContact O-N 2.89Å; L56-K59 CarbonylContact O-C 3.57Å; L56-K59 WeakPolarHBondContact O-CB 3.21Å; L56-K59 PolarHBondContact O-N 2.91Å; L56-K59 VanDerWaalsContact O-N 3.17Å; Q57-K59 VanDerWaalsContact C-N 3.33Å; Q57-K59 PolarHBondContact O-N 3.22Å; K59-Q61 VanDerWaalsContact C-N 3.28Å; K59-Q61 PolarHBondContact O-N 3.48Å; K59-G62 PolarHBondContact O-N 2.88Å; K59-M63 HydrophobicContact CG-SD 4.47Å; K59-M63 WeakPolarHBondContact O-CG 3.41Å; K59-M63 PolarHBondContact O-N 2.73Å
60	I	91.3	Very high	87.9	Confident	8 Å²	8	96.7 Å²	96.7	4%	0.041	48%	0.484	C	S	.	.	H	α-helix	trans	-59.1	-42.6	175.1	-70.7	166.1	0	0	0	110.1	L56 Q57 M63 K64 V82 E86	L56-I60 HydrophobicContact CD2-CD1 4.08Å; L56-I60 HydrophobicContact CG-CD1 3.85Å; L56-I60 HydrophobicContact CG-CG1 4.26Å; L56-I60 VanDerWaalsContact O-CG1 3.27Å; L56-I60 WeakPolarHBondContact O-CG1 3.39Å; L56-I60 PolarHBondContact O-N 3.06Å; Q57-I60 PolarHBondContact O-N 2.97Å; I60-M63 PolarHBondContact O-N 2.76Å; I60-K64 HydrophobicContact CG2-CD 4.01Å; I60-K64 HydrophobicContact CG2-CG 4.43Å; I60-K64 WeakPolarHBondContact O-CB 3.46Å; I60-K64 WeakPolarHBondContact O-CG 3.26Å; I60-K64 PolarHBondContact O-N 3.33Å; I60-V82 HydrophobicContact CD1-CG1 3.93Å; I60-V82 HydrophobicContact CG1-CG1 4.11Å; I60-V82 HydrophobicContact CG1-CG2 4.22Å; I60-V82 HydrophobicContact CG2-CG1 4.07Å; I60-V82 HydrophobicContact CG2-CG2 3.97Å; I60-E86 HydrophobicContact CD1-CG 3.96Å
61	Q	89.2	Confident	87.7	Confident	102 Å²	102	91.4 Å²	91.4	48%	0.477	47%	0.468	S	S	.	.	H	α-helix	trans	-65.1	-41.7	177.8	-168.9	63.2	6.7	0	0	111.6	Q57 A58 K59 M63 K64 N65	Q57-Q61 WeakPolarHBondContact O-CB 3.28Å; Q57-Q61 PolarHBondContact O-N 3.05Å; A58-Q61 PolarHBondContact O-N 2.67Å; K59-Q61 VanDerWaalsContact C-N 3.28Å; K59-Q61 PolarHBondContact O-N 3.48Å; Q61-M63 PolarHBondContact O-N 3.48Å; Q61-K64 PolarHBondContact O-N 3.05Å; Q61-N65 VanDerWaalsContact O-CG 3.23Å; Q61-N65 PolarHBondContact O-N 2.8Å; Q61-N65 PolarHBondContact O-ND2 3.35Å
62	G	89.8	Confident	87.5	Confident	39 Å²	39	93.8 Å²	93.8	40%	0.402	48%	0.478	S	S	.	.	H	α-helix	trans	-57.8	-46.9	171.7	0	0	0	0	0	112.7	A58 K59 K64 N65 A66	A58-G62 PolarHBondContact O-N 3.18Å; K59-G62 PolarHBondContact O-N 2.88Å; G62-K64 VanDerWaalsContact C-N 3.34Å; G62-K64 PolarHBondContact O-N 3.12Å; G62-N65 PolarHBondContact O-N 2.61Å; G62-A66 PolarHBondContact O-N 2.9Å
63	M	87.8	Confident	87.5	Confident	52 Å²	52	100.2 Å²	100.2	26%	0.256	51%	0.506	S	S	.	.	H	α-helix	trans	-64.4	-36.4	177.5	-65.7	176.7	70.3	0	0	112.5	K59 I60 Q61 N65 A66 V67 L78 D81 L85	K59-M63 HydrophobicContact CG-SD 4.47Å; K59-M63 WeakPolarHBondContact O-CG 3.41Å; K59-M63 PolarHBondContact O-N 2.73Å; I60-M63 PolarHBondContact O-N 2.76Å; Q61-M63 PolarHBondContact O-N 3.48Å; M63-N65 VanDerWaalsContact C-N 3.32Å; M63-N65 PolarHBondContact O-N 3.39Å; M63-A66 PolarHBondContact O-N 3.42Å; M63-V67 PolarHBondContact O-N 3.18Å; M63-L78 HydrophobicContact CB-CD1 3.56Å; M63-L78 HydrophobicContact CE-CD1 4.02Å; M63-D81 HydrophobicContact CE-CB 4.25Å; M63-L85 HydrophobicContact CE-CD1 4.44Å; M63-L85 HydrophobicContact SD-CD1 3.98Å
64	K	88.3	Confident	87.3	Confident	87 Å²	87	100.7 Å²	100.7	38%	0.378	50%	0.504	S	S	.	.	H	α-helix	trans	-66.2	-32.1	174.4	-77.5	174.2	178.5	174.9	0	113.5	I60 Q61 G62 R75 L78	I60-K64 HydrophobicContact CG2-CD 4.01Å; I60-K64 HydrophobicContact CG2-CG 4.43Å; I60-K64 WeakPolarHBondContact O-CB 3.46Å; I60-K64 WeakPolarHBondContact O-CG 3.26Å; I60-K64 PolarHBondContact O-N 3.33Å; Q61-K64 PolarHBondContact O-N 3.05Å; G62-K64 VanDerWaalsContact C-N 3.34Å; G62-K64 PolarHBondContact O-N 3.12Å; K64-R75 PolarHBondContact O-NH2 3.31Å; K64-L78 HydrophobicContact CB-CD2 4.5Å; K64-L78 HydrophobicContact CG-CD2 4.06Å
65	N	89	Confident	87.1	Confident	120 Å²	120	96.6 Å²	96.6	64%	0.642	48%	0.484	S	S	*	.	H	α-helix	trans	-78.3	-33.2	177	-68.3	-14.8	0	0	0	112	Q61 G62 M63 V67	Q61-N65 VanDerWaalsContact O-CG 3.23Å; Q61-N65 PolarHBondContact O-N 2.8Å; Q61-N65 PolarHBondContact O-ND2 3.35Å; G62-N65 PolarHBondContact O-N 2.61Å; M63-N65 VanDerWaalsContact C-N 3.32Å; M63-N65 PolarHBondContact O-N 3.39Å; N65-V67 VanDerWaalsContact C-N 3.28Å; N65-V67 PolarHBondContact O-N 3.16Å
66	A	86.6	Confident	87.1	Confident	70 Å²	70	96.8 Å²	96.8	58%	0.579	48%	0.483	S	S	*	.	H	α-helix	trans	-71.5	-17.4	179.1	0	0	0	0	0	114.5	G62 M63	G62-A66 PolarHBondContact O-N 2.9Å; M63-A66 PolarHBondContact O-N 3.42Å
67	V	86.9	Confident	87	Confident	14 Å²	14	100.3 Å²	100.3	9%	0.085	50%	0.499	C	S	.	.	S	Bend	trans	-103.5	116.1	178.4	-178.3	0	0	0	0	110	M63 N65 R74 R75 L78	M63-V67 PolarHBondContact O-N 3.18Å; N65-V67 VanDerWaalsContact C-N 3.28Å; N65-V67 PolarHBondContact O-N 3.16Å; V67-R74 HydrophobicContact CG1-CB 3.73Å; V67-R75 HydrophobicContact CG1-CG 3.94Å; V67-R75 PolarHBondContact O-NE 3.05Å; V67-R75 PolarHBondContact O-NH2 2.99Å; V67-L78 HydrophobicContact CB-CD2 4.13Å; V67-L78 HydrophobicContact CG2-CB 4.44Å; V67-L78 HydrophobicContact CG2-CD2 4.05Å
68	P	82	Confident	87.1	Confident	76 Å²	76	95.3 Å²	95.3	49%	0.494	48%	0.476	S	S	.	.			trans	-56.9	148.8	176.3	-26.2	35.2	0	0	0	112.8	N70 D71 R75	P68-N70 PolarHBondContact O-N 3.04Å; P68-D71 PolarHBondContact O-N 3.26Å; P68-R75 PolarHBondContact O-NE 3.21Å
69	K	78.3	Confident	86.9	Confident	197 Å²	197	96.6 Å²	96.6	86%	0.857	48%	0.477	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.3	-21.9	-177.6	-67.2	-177.5	-179.4	177.7	0	113.5
70	N	80.3	Confident	86.9	Confident	162 Å²	162	95.2 Å²	95.2	87%	0.866	47%	0.473	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.7	-10.9	-173.5	-143.4	10.9	0	0	0	114.1	P68 K72	P68-N70 PolarHBondContact O-N 3.04Å; N70-K72 PolarHBondContact O-N 2.84Å
71	D	84.1	Confident	86.8	Confident	58 Å²	58	97.7 Å²	97.7	31%	0.31	49%	0.486	S	S	.	.			trans	-94.7	92.1	-178	-167.1	-30.9	0	0	0	111.6	P68 K73 R74 R75	P68-D71 PolarHBondContact O-N 3.26Å; D71-K73 VanDerWaalsContact C-N 3.31Å; D71-K73 PolarHBondContact O-N 3.43Å; D71-K73 PolarHBondContact OD1-N 2.9Å; D71-R74 HydrophobicContact CB-CB 4.28Å; D71-R74 PolarHBondContact O-N 3.48Å; D71-R74 PolarHBondContact OD1-N 2.89Å; D71-R74 VanDerWaalsContact OD1-N 3.09Å; D71-R74 WeakPolarHBondContact OD2-CD 3.22Å; D71-R74 WeakPolarHBondContact OD2-CG 3.23Å; D71-R75 WeakPolarHBondContact O-CB 3.3Å; D71-R75 VanDerWaalsContact O-CG 3.22Å; D71-R75 WeakPolarHBondContact O-CG 3.27Å; D71-R75 PolarHBondContact O-N 2.77Å
72	K	84.1	Confident	87	Confident	190 Å²	190	93.5 Å²	93.5	83%	0.826	47%	0.467	S	S	*	.	H	α-helix	trans	-62.1	-33.6	-176.6	-168.8	174.2	-177.5	177.3	0	113.3	N70 K76	N70-K72 PolarHBondContact O-N 2.84Å; K72-K76 PolarHBondContact O-N 3.29Å
73	K	88.5	Confident	87.1	Confident	180 Å²	180	94.2 Å²	94.2	78%	0.783	47%	0.469	S	S	*	.	H	α-helix	trans	-73.5	-47.2	-177.9	-172	178.8	178.9	-177.6	0	110.5	D71 R75 K76 Q77	D71-K73 VanDerWaalsContact C-N 3.31Å; D71-K73 PolarHBondContact O-N 3.43Å; D71-K73 PolarHBondContact OD1-N 2.9Å; K73-R75 VanDerWaalsContact C-N 3.32Å; K73-R75 PolarHBondContact O-N 2.88Å; K73-K76 PolarHBondContact O-N 3.45Å; K73-Q77 PolarHBondContact O-N 3.45Å; K73-Q77 VanDerWaalsContact O-N 3.17Å
74	R	84.2	Confident	87.4	Confident	133 Å²	133	97.9 Å²	97.9	50%	0.502	48%	0.484	S	S	.	.	H	α-helix	trans	-68.1	-30.8	177.2	-67.2	-179.3	69.7	-169	-2.3	112.7	V67 D71 L78	V67-R74 HydrophobicContact CG1-CB 3.73Å; D71-R74 HydrophobicContact CB-CB 4.28Å; D71-R74 PolarHBondContact O-N 3.48Å; D71-R74 PolarHBondContact OD1-N 2.89Å; D71-R74 VanDerWaalsContact OD1-N 3.09Å; D71-R74 WeakPolarHBondContact OD2-CD 3.22Å; D71-R74 WeakPolarHBondContact OD2-CG 3.23Å; R74-L78 VanDerWaalsContact O-CB 3.27Å; R74-L78 WeakPolarHBondContact O-CB 3.47Å; R74-L78 PolarHBondContact O-N 3.45Å
75	R	86.3	Confident	87.5	Confident	73 Å²	73	95.8 Å²	95.8	28%	0.275	48%	0.476	S	S	.	.	H	α-helix	trans	-66.8	-38.6	173.5	-77.6	-76.5	178.1	176.6	-6.2	112.9	K64 V67 P68 D71 K73 L78 T79	K64-R75 PolarHBondContact O-NH2 3.31Å; V67-R75 HydrophobicContact CG1-CG 3.94Å; V67-R75 PolarHBondContact O-NE 3.05Å; V67-R75 PolarHBondContact O-NH2 2.99Å; P68-R75 PolarHBondContact O-NE 3.21Å; D71-R75 WeakPolarHBondContact O-CB 3.3Å; D71-R75 VanDerWaalsContact O-CG 3.22Å; D71-R75 WeakPolarHBondContact O-CG 3.27Å; D71-R75 PolarHBondContact O-N 2.77Å; K73-R75 VanDerWaalsContact C-N 3.32Å; K73-R75 PolarHBondContact O-N 2.88Å; R75-L78 PolarHBondContact O-N 2.87Å; R75-T79 PolarHBondContact O-N 3.41Å; R75-T79 PolarHBondContact O-OG1 2.79Å
76	K	89.1	Confident	87.6	Confident	140 Å²	140	94.7 Å²	94.7	61%	0.609	47%	0.467	S	S	*	.	H	α-helix	trans	-64	-48.5	174.5	-170.9	179.5	177.1	-170.3	0	110.9	K72 K73 L78 T79 E80	K72-K76 PolarHBondContact O-N 3.29Å; K73-K76 PolarHBondContact O-N 3.45Å; K76-L78 VanDerWaalsContact C-N 3.35Å; K76-L78 PolarHBondContact O-N 2.9Å; K76-T79 WeakPolarHBondContact O-CB 3.39Å; K76-T79 PolarHBondContact O-N 2.99Å; K76-T79 VanDerWaalsContact O-N 3.09Å; K76-E80 VanDerWaalsContact CE-OE1 3.3Å; K76-E80 WeakPolarHBondContact CE-OE1 3.3Å; K76-E80 PolarHBondContact O-N 3.39Å; K76-E80 VanDerWaalsContact O-N 3.11Å
77	Q	89.7	Confident	87.9	Confident	97 Å²	97	98.2 Å²	98.2	45%	0.453	47%	0.47	S	S	.	.	H	α-helix	trans	-58.3	-45.5	175	-171.1	62.4	53.3	0	0	112	K73 T79 E80 D81	K73-Q77 PolarHBondContact O-N 3.45Å; K73-Q77 VanDerWaalsContact O-N 3.17Å; Q77-T79 PolarHBondContact O-N 2.85Å; Q77-E80 PolarHBondContact O-N 2.97Å; Q77-E80 VanDerWaalsContact O-N 3.16Å; Q77-D81 PolarHBondContact NE2-OD1 3.4Å; Q77-D81 PolarHBondContact O-N 2.91Å
78	L	90.8	Very high	88.1	Confident	11 Å²	11	102.2 Å²	102.2	6%	0.058	49%	0.487	C	S	.	.	H	α-helix	trans	-57.2	-37.5	176.2	174.5	66.1	0	0	0	112.3	M63 K64 V67 R74 R75 K76 V82	M63-L78 HydrophobicContact CB-CD1 3.56Å; M63-L78 HydrophobicContact CE-CD1 4.02Å; K64-L78 HydrophobicContact CB-CD2 4.5Å; K64-L78 HydrophobicContact CG-CD2 4.06Å; V67-L78 HydrophobicContact CB-CD2 4.13Å; V67-L78 HydrophobicContact CG2-CB 4.44Å; V67-L78 HydrophobicContact CG2-CD2 4.05Å; R74-L78 VanDerWaalsContact O-CB 3.27Å; R74-L78 WeakPolarHBondContact O-CB 3.47Å; R74-L78 PolarHBondContact O-N 3.45Å; R75-L78 PolarHBondContact O-N 2.87Å; K76-L78 VanDerWaalsContact C-N 3.35Å; K76-L78 PolarHBondContact O-N 2.9Å; L78-V82 HydrophobicContact CD1-CG2 4.12Å; L78-V82 HydrophobicContact CG-CG2 4.45Å; L78-V82 WeakPolarHBondContact O-CB 3.28Å; L78-V82 WeakPolarHBondContact O-CG2 3.23Å; L78-V82 PolarHBondContact O-N 2.83Å
79	T	87.5	Confident	88.6	Confident	95 Å²	95	100 Å²	100	58%	0.583	47%	0.471	S	S	*	.	H	α-helix	trans	-70.3	-40.6	-179.5	-53.7	0	0	0	0	110.9	R75 K76 Q77 A83	R75-T79 PolarHBondContact O-N 3.41Å; R75-T79 PolarHBondContact O-OG1 2.79Å; K76-T79 WeakPolarHBondContact O-CB 3.39Å; K76-T79 PolarHBondContact O-N 2.99Å; K76-T79 VanDerWaalsContact O-N 3.09Å; Q77-T79 PolarHBondContact O-N 2.85Å; T79-A83 WeakPolarHBondContact O-CB 3.41Å; T79-A83 PolarHBondContact O-N 2.95Å
80	E	92.2	Very high	89.1	Confident	96 Å²	96	96.1 Å²	96.1	45%	0.449	46%	0.456	S	S	.	.	H	α-helix	trans	-65.6	-42	175	-68.9	171.4	-164.8	0	0	111.3	K76 Q77 A83 K84	K76-E80 VanDerWaalsContact CE-OE1 3.3Å; K76-E80 WeakPolarHBondContact CE-OE1 3.3Å; K76-E80 PolarHBondContact O-N 3.39Å; K76-E80 VanDerWaalsContact O-N 3.11Å; Q77-E80 PolarHBondContact O-N 2.97Å; Q77-E80 VanDerWaalsContact O-N 3.16Å; E80-A83 PolarHBondContact O-N 3.18Å; E80-K84 WeakPolarHBondContact O-CB 3.3Å; E80-K84 PolarHBondContact O-N 3.09Å
81	D	89	Confident	89.6	Confident	59 Å²	59	93.1 Å²	93.1	32%	0.316	44%	0.436	S	S	.	.	H	α-helix	trans	-66	-41.1	177.7	-64.8	-16.8	0	0	0	111.9	M63 Q77 K84 L85	M63-D81 HydrophobicContact CE-CB 4.25Å; Q77-D81 PolarHBondContact NE2-OD1 3.4Å; Q77-D81 PolarHBondContact O-N 2.91Å; D81-K84 PolarHBondContact O-N 2.84Å; D81-L85 WeakPolarHBondContact O-CB 3.44Å; D81-L85 VanDerWaalsContact O-CG 3.3Å; D81-L85 WeakPolarHBondContact O-CG 3.16Å; D81-L85 PolarHBondContact O-N 3.05Å
82	V	91.9	Very high	90	Very high	15 Å²	15	94.8 Å²	94.8	9%	0.091	44%	0.441	C	S	.	.	H	α-helix	trans	-62.8	-46.8	174.7	168.6	0	0	0	0	110.6	I60 L78 K84 L85 E86	I60-V82 HydrophobicContact CD1-CG1 3.93Å; I60-V82 HydrophobicContact CG1-CG1 4.11Å; I60-V82 HydrophobicContact CG1-CG2 4.22Å; I60-V82 HydrophobicContact CG2-CG1 4.07Å; I60-V82 HydrophobicContact CG2-CG2 3.97Å; L78-V82 HydrophobicContact CD1-CG2 4.12Å; L78-V82 HydrophobicContact CG-CG2 4.45Å; L78-V82 WeakPolarHBondContact O-CB 3.28Å; L78-V82 WeakPolarHBondContact O-CG2 3.23Å; L78-V82 PolarHBondContact O-N 2.83Å; V82-K84 VanDerWaalsContact C-N 3.27Å; V82-K84 PolarHBondContact O-N 2.73Å; V82-L85 PolarHBondContact O-N 3.41Å; V82-E86 HydrophobicContact CG1-CG 4.4Å; V82-E86 WeakPolarHBondContact O-CG 3.21Å; V82-E86 PolarHBondContact O-N 3.19Å
83	A	92.5	Very high	90.5	Very high	54 Å²	54	86.9 Å²	86.9	45%	0.446	41%	0.407	S	S	.	.	H	α-helix	trans	-62.4	-36.3	178	0	0	0	0	0	112.2	T79 E80 K87	T79-A83 WeakPolarHBondContact O-CB 3.41Å; T79-A83 PolarHBondContact O-N 2.95Å; E80-A83 PolarHBondContact O-N 3.18Å; A83-K87 VanDerWaalsContact O-CB 3.28Å; A83-K87 WeakPolarHBondContact O-CB 3.35Å; A83-K87 PolarHBondContact O-N 3.38Å; A83-K87 VanDerWaalsContact O-N 3.1Å
84	K	93.3	Very high	90.5	Very high	129 Å²	129	84.6 Å²	84.6	56%	0.561	39%	0.393	S	S	*	.	H	α-helix	trans	-65.8	-48.3	175.1	-170.9	-177.5	178.5	-163.3	0	111.6	E80 D81 V82 E86 K87 E88	E80-K84 WeakPolarHBondContact O-CB 3.3Å; E80-K84 PolarHBondContact O-N 3.09Å; D81-K84 PolarHBondContact O-N 2.84Å; V82-K84 VanDerWaalsContact C-N 3.27Å; V82-K84 PolarHBondContact O-N 2.73Å; K84-E86 PolarHBondContact O-N 2.85Å; K84-K87 PolarHBondContact O-N 3.34Å; K84-E88 WeakPolarHBondContact CE-OE1 3.23Å; K84-E88 IonicContact NZ-OE1 3.87Å; K84-E88 WeakPolarHBondContact O-CB 3.47Å; K84-E88 WeakPolarHBondContact O-CG 3.44Å; K84-E88 PolarHBondContact O-N 3.31Å
85	L	91.1	Very high	90.7	Very high	42 Å²	42	82.2 Å²	82.2	22%	0.22	39%	0.388	C	S	.	.	H	α-helix	trans	-64	-40.3	179.9	-72.5	171.2	0	0	0	112.8	L56 M63 D81 V82 M89	L56-L85 HydrophobicContact CD1-CB 4.01Å; M63-L85 HydrophobicContact CE-CD1 4.44Å; M63-L85 HydrophobicContact SD-CD1 3.98Å; D81-L85 WeakPolarHBondContact O-CB 3.44Å; D81-L85 VanDerWaalsContact O-CG 3.3Å; D81-L85 WeakPolarHBondContact O-CG 3.16Å; D81-L85 PolarHBondContact O-N 3.05Å; V82-L85 PolarHBondContact O-N 3.41Å; L85-M89 PolarHBondContact O-N 3.36Å; L85-M89 VanDerWaalsContact O-N 3.09Å
86	E	90.5	Very high	90.9	Very high	97 Å²	97	80.4 Å²	80.4	45%	0.453	38%	0.383	S	S	.	.	H	α-helix	trans	-64.6	-42.6	175.6	-72.6	178.4	158.8	0	0	111.2	L56 I60 V82 K84 M89 E90	L56-E86 HydrophobicContact CD2-CG 3.93Å; I60-E86 HydrophobicContact CD1-CG 3.96Å; V82-E86 HydrophobicContact CG1-CG 4.4Å; V82-E86 WeakPolarHBondContact O-CG 3.21Å; V82-E86 PolarHBondContact O-N 3.19Å; K84-E86 PolarHBondContact O-N 2.85Å; E86-M89 PolarHBondContact O-N 2.9Å; E86-E90 WeakPolarHBondContact O-CB 3.49Å; E86-E90 PolarHBondContact O-N 2.97Å
87	K	93.1	Very high	90.7	Very high	145 Å²	145	75.7 Å²	75.7	63%	0.63	36%	0.364	S	S	*	.	H	α-helix	trans	-65.9	-43.2	177.9	-173.8	-178	177.6	-172.8	0	112.5	A83 K84 E90 Q91	A83-K87 VanDerWaalsContact O-CB 3.28Å; A83-K87 WeakPolarHBondContact O-CB 3.35Å; A83-K87 PolarHBondContact O-N 3.38Å; A83-K87 VanDerWaalsContact O-N 3.1Å; K84-K87 PolarHBondContact O-N 3.34Å; K87-E90 PolarHBondContact O-N 3.15Å; K87-Q91 WeakPolarHBondContact O-CB 3.44Å; K87-Q91 PolarHBondContact O-N 3.47Å
88	E	91.5	Very high	90.5	Very high	97 Å²	97	76.3 Å²	76.3	45%	0.453	37%	0.367	S	S	.	.	H	α-helix	trans	-62.6	-42.4	177.6	-76.5	175.3	176.4	0	0	111.5	K84 Q91 K92	K84-E88 WeakPolarHBondContact CE-OE1 3.23Å; K84-E88 IonicContact NZ-OE1 3.87Å; K84-E88 WeakPolarHBondContact O-CB 3.47Å; K84-E88 WeakPolarHBondContact O-CG 3.44Å; K84-E88 PolarHBondContact O-N 3.31Å; E88-Q91 PolarHBondContact O-N 3.49Å; E88-K92 WeakPolarHBondContact O-CB 3.3Å; E88-K92 PolarHBondContact O-N 3.12Å
89	M	92.3	Very high	90.2	Very high	30 Å²	30	81.5 Å²	81.5	15%	0.148	39%	0.391	C	S	.	.	H	α-helix	trans	-64.6	-47.1	175.3	-177.6	-141	-80.9	0	0	111.6	E52 K53 L56 L85 E86 Q91 K92 H93	E52-M89 WeakPolarHBondContact O-CE 3.46Å; K53-M89 HydrophobicContact CB-CE 4.28Å; K53-M89 HydrophobicContact CB-SD 4.27Å; K53-M89 HydrophobicContact CG-CE 4.49Å; K53-M89 HydrophobicContact CG-SD 4.4Å; L56-M89 HydrophobicContact CB-CE 3.12Å; L56-M89 HydrophobicContact CD2-CB 4.34Å; L56-M89 HydrophobicContact CD2-CE 3.19Å; L56-M89 HydrophobicContact CD2-SD 4.32Å; L56-M89 HydrophobicContact CG-CE 3.67Å; L85-M89 PolarHBondContact O-N 3.36Å; L85-M89 VanDerWaalsContact O-N 3.09Å; E86-M89 PolarHBondContact O-N 2.9Å; M89-Q91 VanDerWaalsContact C-N 3.26Å; M89-Q91 PolarHBondContact O-N 3.39Å; M89-K92 PolarHBondContact O-N 3.32Å; M89-H93 VanDerWaalsContact CG-CE1 3.49Å; M89-H93 WeakPolarHBondContact CG-CE1 3.46Å; M89-H93 PolarHBondContact O-N 3.45Å; M89-H93 PolarHBondContact SD-CE1 2.92Å
90	E	89.5	Confident	90	Very high	115 Å²	115	78.6 Å²	78.6	54%	0.537	37%	0.371	S	S	.	.	H	α-helix	trans	-62	-38.1	-180	-171.6	-176.9	167.9	0	0	111.6	E86 K87 R94	E86-E90 WeakPolarHBondContact O-CB 3.49Å; E86-E90 PolarHBondContact O-N 2.97Å; K87-E90 PolarHBondContact O-N 3.15Å; E90-R94 WeakPolarHBondContact O-CB 3.24Å; E90-R94 PolarHBondContact O-N 3.18Å; E90-R94 IonicContact OE1-NH2 2.84Å; E90-R94 PolarHBondContact OE1-NH2 3.45Å
91	Q	91.3	Very high	89.5	Confident	99 Å²	99	79.9 Å²	79.9	46%	0.463	38%	0.375	S	S	.	.	H	α-helix	trans	-64	-47.2	174.3	-180	170.5	-9.9	0	0	111.2	K87 E88 M89 H93 R94 E95	K87-Q91 WeakPolarHBondContact O-CB 3.44Å; K87-Q91 PolarHBondContact O-N 3.47Å; E88-Q91 PolarHBondContact O-N 3.49Å; M89-Q91 VanDerWaalsContact C-N 3.26Å; M89-Q91 PolarHBondContact O-N 3.39Å; Q91-H93 PolarHBondContact O-N 3.34Å; Q91-R94 WeakPolarHBondContact O-CB 3.32Å; Q91-R94 PolarHBondContact O-N 3.23Å; Q91-E95 HydrophobicContact CG-CG 4.45Å; Q91-E95 WeakPolarHBondContact CG-OE1 3.3Å; Q91-E95 PolarHBondContact NE2-OE1 2.86Å; Q91-E95 WeakPolarHBondContact O-CG 3.48Å; Q91-E95 PolarHBondContact O-N 2.97Å
92	K	92.5	Very high	89	Confident	94 Å²	94	81.8 Å²	81.8	41%	0.409	39%	0.385	S	S	.	.	H	α-helix	trans	-59.4	-45.8	177.4	-171.8	-173.4	177.7	-131	0	112.1	E52 E88 M89 R94 E95 E96	E52-K92 IonicContact OE1-NZ 2.54Å; E52-K92 IonicContact OE2-NZ 3.88Å; E88-K92 WeakPolarHBondContact O-CB 3.3Å; E88-K92 PolarHBondContact O-N 3.12Å; M89-K92 PolarHBondContact O-N 3.32Å; K92-R94 VanDerWaalsContact C-N 3.3Å; K92-R94 PolarHBondContact O-N 2.85Å; K92-E95 PolarHBondContact O-N 3.31Å; K92-E96 WeakPolarHBondContact CE-OE1 3.33Å; K92-E96 IonicContact NZ-OE1 3.05Å; K92-E96 PolarHBondContact NZ-OE1 3.04Å; K92-E96 VanDerWaalsContact NZ-OE1 3.16Å; K92-E96 WeakPolarHBondContact O-CB 3.5Å; K92-E96 WeakPolarHBondContact O-CG 3.39Å; K92-E96 PolarHBondContact O-N 3.43Å
93	H	92.9	Very high	88.1	Confident	23 Å²	23	83.9 Å²	83.9	11%	0.106	40%	0.398	C	S	.	.	H	α-helix	trans	-63.7	-37.4	178.3	-70.2	178.6	0	0	0	112.2	H49 E52 M89 Q91 L97	H49-H93 AromaticContact CD2-CD2 3.3Å; H49-H93 PolarHBondContact CD2-CD2 2.63Å; H49-H93 AromaticContact CD2-CE1 4Å; H49-H93 AromaticContact CD2-CG 3.67Å; H49-H93 AromaticContact CD2-NE2 3.54Å; H49-H93 AromaticContact CE1-CD2 3.98Å; H49-H93 AromaticContact CE1-CG 3.8Å; H49-H93 PolarHBondContact CE1-O 2.88Å; H49-H93 AromaticContact CG-CD2 3.72Å; H49-H93 AromaticContact CG-CE1 3.87Å; H49-H93 AromaticContact CG-CG 3.61Å; H49-H93 AromaticContact CG-ND1 3.73Å; H49-H93 AromaticContact CG-NE2 3.88Å; H49-H93 AromaticContact ND1-CG 3.71Å; H49-H93 AromaticContact NE2-CD2 3.49Å; H49-H93 PolarHBondContact NE2-CD2 3.01Å; H49-H93 AromaticContact NE2-CG 3.78Å; E52-H93 IonicContact OE2-CD2 3.99Å; E52-H93 IonicContact OE2-CE1 3.18Å; E52-H93 IonicContact OE2-NE2 3.78Å; E52-H93 PolarHBondContact OE2-NE2 2.93Å; M89-H93 VanDerWaalsContact CG-CE1 3.49Å; M89-H93 WeakPolarHBondContact CG-CE1 3.46Å; M89-H93 PolarHBondContact O-N 3.45Å; M89-H93 PolarHBondContact SD-CE1 2.92Å; Q91-H93 PolarHBondContact O-N 3.34Å; H93-L97 WeakPolarHBondContact O-CG 3.22Å; H93-L97 PolarHBondContact O-N 3.29Å
94	R	89.2	Confident	86.8	Confident	132 Å²	132	83.1 Å²	83.1	50%	0.498	39%	0.388	S	S	.	.	H	α-helix	trans	-64.9	-47	174.6	-174.6	-170.4	-51	-95.5	-7.5	111.6	E90 Q91 K92 L97 E98	E90-R94 WeakPolarHBondContact O-CB 3.24Å; E90-R94 PolarHBondContact O-N 3.18Å; E90-R94 IonicContact OE1-NH2 2.84Å; E90-R94 PolarHBondContact OE1-NH2 3.45Å; Q91-R94 WeakPolarHBondContact O-CB 3.32Å; Q91-R94 PolarHBondContact O-N 3.23Å; K92-R94 VanDerWaalsContact C-N 3.3Å; K92-R94 PolarHBondContact O-N 2.85Å; R94-L97 PolarHBondContact O-N 3.41Å; R94-E98 WeakPolarHBondContact O-CB 3.38Å; R94-E98 WeakPolarHBondContact O-CG 3.3Å; R94-E98 PolarHBondContact O-N 3Å
95	E	89.1	Confident	85.4	Confident	83 Å²	83	83.5 Å²	83.5	39%	0.388	39%	0.39	S	S	.	.	H	α-helix	trans	-62.7	-41.6	177.9	-72.3	170.2	-171.3	0	0	111.4	Q91 K92 L97 E98 Q99	Q91-E95 HydrophobicContact CG-CG 4.45Å; Q91-E95 WeakPolarHBondContact CG-OE1 3.3Å; Q91-E95 PolarHBondContact NE2-OE1 2.86Å; Q91-E95 WeakPolarHBondContact O-CG 3.48Å; Q91-E95 PolarHBondContact O-N 2.97Å; K92-E95 PolarHBondContact O-N 3.31Å; E95-L97 PolarHBondContact O-N 3.39Å; E95-E98 PolarHBondContact O-N 2.99Å; E95-Q99 WeakPolarHBondContact O-CB 3.44Å; E95-Q99 VanDerWaalsContact O-CG 3.26Å; E95-Q99 WeakPolarHBondContact O-CG 3.48Å; E95-Q99 PolarHBondContact O-N 2.88Å
96	E	89.4	Confident	83.7	Confident	36 Å²	36	87.3 Å²	87.3	17%	0.168	41%	0.406	C	S	.	.	H	α-helix	trans	-63.9	-39.2	175.9	-73.6	175.4	-178	0	0	112.2	L45 H49 K92 L100	L45-E96 HydrophobicContact CD1-CB 4.39Å; L45-E96 HydrophobicContact CD2-CB 4.29Å; H49-E96 IonicContact CD2-OE2 3.79Å; H49-E96 PolarHBondContact CD2-OE2 3.19Å; H49-E96 IonicContact CE1-OE2 3.92Å; H49-E96 IonicContact NE2-OE2 3.16Å; H49-E96 PolarHBondContact NE2-OE2 2.92Å; K92-E96 WeakPolarHBondContact CE-OE1 3.33Å; K92-E96 IonicContact NZ-OE1 3.05Å; K92-E96 PolarHBondContact NZ-OE1 3.04Å; K92-E96 VanDerWaalsContact NZ-OE1 3.16Å; K92-E96 WeakPolarHBondContact O-CB 3.5Å; K92-E96 WeakPolarHBondContact O-CG 3.39Å; K92-E96 PolarHBondContact O-N 3.43Å; E96-L100 WeakPolarHBondContact O-CB 3.48Å; E96-L100 PolarHBondContact O-N 3.37Å
97	L	85.8	Confident	81.9	Confident	41 Å²	41	88.2 Å²	88.2	22%	0.215	41%	0.414	C	S	.	.	H	α-helix	trans	-69	-36.2	174.3	-75.2	167.2	0	0	0	112.5	L45 L46 H93 R94 E95 K101	L45-L97 HydrophobicContact CD2-CD2 4.09Å; L46-L97 HydrophobicContact CD2-CD2 4.3Å; H93-L97 WeakPolarHBondContact O-CG 3.22Å; H93-L97 PolarHBondContact O-N 3.29Å; R94-L97 PolarHBondContact O-N 3.41Å; E95-L97 PolarHBondContact O-N 3.39Å; L97-K101 WeakPolarHBondContact O-CB 3.38Å; L97-K101 WeakPolarHBondContact O-CD 3.42Å; L97-K101 VanDerWaalsContact O-CG 3.23Å; L97-K101 WeakPolarHBondContact O-CG 3.46Å; L97-K101 PolarHBondContact O-N 3.46Å; L97-K101 VanDerWaalsContact O-N 3.11Å
98	E	84.5	Confident	79.9	Confident	110 Å²	110	87.7 Å²	87.7	51%	0.514	41%	0.412	S	S	.	.	H	α-helix	trans	-69.4	-40.7	175.4	-76.3	177.3	-173.5	0	0	111.4	R94 E95 K101 L102	R94-E98 WeakPolarHBondContact O-CB 3.38Å; R94-E98 WeakPolarHBondContact O-CG 3.3Å; R94-E98 PolarHBondContact O-N 3Å; E95-E98 PolarHBondContact O-N 2.99Å; E98-K101 PolarHBondContact O-N 3.2Å; E98-L102 WeakPolarHBondContact O-CG 3.43Å; E98-L102 PolarHBondContact O-N 3.24Å
99	Q	85.9	Confident	77.8	Confident	120 Å²	120	88.7 Å²	88.7	56%	0.561	42%	0.419	S	S	*	.	H	α-helix	trans	-62.9	-46.4	174	-75.2	174.6	16.1	0	0	111.4	E95 K101 L102 T103	E95-Q99 WeakPolarHBondContact O-CB 3.44Å; E95-Q99 VanDerWaalsContact O-CG 3.26Å; E95-Q99 WeakPolarHBondContact O-CG 3.48Å; E95-Q99 PolarHBondContact O-N 2.88Å; Q99-K101 VanDerWaalsContact C-N 3.28Å; Q99-K101 PolarHBondContact O-N 3.45Å; Q99-L102 PolarHBondContact O-N 2.99Å; Q99-T103 PolarHBondContact O-N 3.41Å; Q99-T103 PolarHBondContact O-OG1 3.24Å
100	L	82.7	Confident	75.4	Confident	33 Å²	33	94.6 Å²	94.6	17%	0.173	45%	0.451	C	S	.	.	H	α-helix	trans	-58.2	-43.2	176.4	-168.9	71.1	0	0	0	110.9	E41 E42 L45 E96 L102 T103 T104	E41-L100 HydrophobicContact CB-CD1 4.46Å; E42-L100 HydrophobicContact CB-CD2 3.96Å; E42-L100 HydrophobicContact CG-CD2 4.36Å; L45-L100 HydrophobicContact CB-CD2 4.47Å; L45-L100 HydrophobicContact CD2-CB 4.15Å; L45-L100 HydrophobicContact CD2-CD2 3.81Å; E96-L100 WeakPolarHBondContact O-CB 3.48Å; E96-L100 PolarHBondContact O-N 3.37Å; L100-L102 VanDerWaalsContact C-N 3.28Å; L100-L102 PolarHBondContact O-N 3.04Å; L100-T103 WeakPolarHBondContact CA-OG1 3.27Å; L100-T103 PolarHBondContact O-N 3.48Å; L100-T103 PolarHBondContact O-OG1 3.35Å; L100-T104 PolarHBondContact O-N 3.46Å; L100-T104 PolarHBondContact O-OG1 3.24Å
101	K	80.8	Confident	73.2	Confident	123 Å²	123	93.9 Å²	93.9	54%	0.535	46%	0.459	S	S	.	.	H	α-helix	trans	-64.2	-29.6	175.8	-74.7	170.8	-176	176.3	0	113.9	L97 E98 Q99 K105	L97-K101 WeakPolarHBondContact O-CB 3.38Å; L97-K101 WeakPolarHBondContact O-CD 3.42Å; L97-K101 VanDerWaalsContact O-CG 3.23Å; L97-K101 WeakPolarHBondContact O-CG 3.46Å; L97-K101 PolarHBondContact O-N 3.46Å; L97-K101 VanDerWaalsContact O-N 3.11Å; E98-K101 PolarHBondContact O-N 3.2Å; Q99-K101 VanDerWaalsContact C-N 3.28Å; Q99-K101 PolarHBondContact O-N 3.45Å; K101-K105 VanDerWaalsContact O-CG 3.29Å; K101-K105 WeakPolarHBondContact O-CG 3.41Å; K101-K105 PolarHBondContact O-N 3.44Å
102	L	78.8	Confident	70.5	Confident	99 Å²	99	94.8 Å²	94.8	52%	0.518	47%	0.471	S	S	.	.	H	α-helix	trans	-78	-43.4	176	-71.4	169.1	0	0	0	110.8	E98 Q99 L100 T104 K105 E106	E98-L102 WeakPolarHBondContact O-CG 3.43Å; E98-L102 PolarHBondContact O-N 3.24Å; Q99-L102 PolarHBondContact O-N 2.99Å; L100-L102 VanDerWaalsContact C-N 3.28Å; L100-L102 PolarHBondContact O-N 3.04Å; L102-T104 PolarHBondContact O-N 3.33Å; L102-K105 CarbonylContact O-C 3.6Å; L102-K105 WeakPolarHBondContact O-CA 3.33Å; L102-K105 WeakPolarHBondContact O-CB 3.36Å; L102-K105 PolarHBondContact O-N 2.87Å; L102-E106 PolarHBondContact O-N 2.91Å
103	T	72.8	Confident	68	Low	59 Å²	59	94.8 Å²	94.8	36%	0.362	49%	0.489	S	S	.	.	H	α-helix	trans	-65	-37.3	177.1	52.6	0	0	0	0	112.1	Q99 L100 K105 E106 N107	Q99-T103 PolarHBondContact O-N 3.41Å; Q99-T103 PolarHBondContact O-OG1 3.24Å; L100-T103 WeakPolarHBondContact CA-OG1 3.27Å; L100-T103 PolarHBondContact O-N 3.48Å; L100-T103 PolarHBondContact O-OG1 3.35Å; T103-K105 VanDerWaalsContact C-N 3.27Å; T103-K105 PolarHBondContact O-N 3.49Å; T103-E106 PolarHBondContact O-N 3.02Å; T103-N107 WeakPolarHBondContact O-CB 3.48Å; T103-N107 PolarHBondContact O-N 2.96Å; T103-N107 PolarHBondContact O-ND2 2.84Å
104	T	66.7	Low	65.3	Low	39 Å²	39	99.7 Å²	99.7	24%	0.239	52%	0.52	C	S	.	.	H	α-helix	trans	-66.1	-30	172.8	-44.6	0	0	0	0	112.2	E38 L100 L102 K108	E38-T104 HydrophobicContact CG-CG2 4.04Å; E38-T104 WeakPolarHBondContact OE1-CG2 3.37Å; L100-T104 PolarHBondContact O-N 3.46Å; L100-T104 PolarHBondContact O-OG1 3.24Å; L102-T104 PolarHBondContact O-N 3.33Å; T104-K108 PolarHBondContact O-N 2.83Å
105	K	63.1	Low	62.9	Low	137 Å²	137	100.3 Å²	100.3	60%	0.596	53%	0.534	S	S	*	.	H	α-helix	trans	-76.4	-39.9	174.3	-76.9	175.7	-178.7	-179.3	0	112.1	K101 L102 T103 K108 I109	K101-K105 VanDerWaalsContact O-CG 3.29Å; K101-K105 WeakPolarHBondContact O-CG 3.41Å; K101-K105 PolarHBondContact O-N 3.44Å; L102-K105 CarbonylContact O-C 3.6Å; L102-K105 WeakPolarHBondContact O-CA 3.33Å; L102-K105 WeakPolarHBondContact O-CB 3.36Å; L102-K105 PolarHBondContact O-N 2.87Å; T103-K105 VanDerWaalsContact C-N 3.27Å; T103-K105 PolarHBondContact O-N 3.49Å; K105-K108 WeakPolarHBondContact O-CB 3.33Å; K105-K108 PolarHBondContact O-N 3.26Å; K105-I109 WeakPolarHBondContact O-CD1 3.26Å; K105-I109 VanDerWaalsContact O-CG1 3.24Å; K105-I109 WeakPolarHBondContact O-CG1 3.42Å; K105-I109 PolarHBondContact O-N 3.37Å
106	E	56.2	Low	60.5	Low	121 Å²	121	103.7 Å²	103.7	57%	0.565	55%	0.553	S	S	*	*	H	α-helix	trans	-67.7	-40.5	176.4	-73	177.2	162.5	0	0	112	L102 T103 K108 I109 D110	L102-E106 PolarHBondContact O-N 2.91Å; T103-E106 PolarHBondContact O-N 3.02Å; E106-K108 PolarHBondContact O-N 3.46Å; E106-I109 WeakPolarHBondContact O-CA 3.33Å; E106-I109 WeakPolarHBondContact O-CB 3.37Å; E106-I109 PolarHBondContact O-N 3.1Å; E106-D110 PolarHBondContact O-N 3.07Å
107	N	52.3	Low	57.8	Low	117 Å²	117	107 Å²	107	63%	0.626	58%	0.58	S	S	*	*	H	α-helix	trans	-62.9	-25.1	173.6	-70.7	-14.8	0	0	0	113	T103	T103-N107 WeakPolarHBondContact O-CB 3.48Å; T103-N107 PolarHBondContact O-N 2.96Å; T103-N107 PolarHBondContact O-ND2 2.84Å
108	K	50.6	Low	55.9	Low	133 Å²	133	112.4 Å²	112.4	58%	0.578	61%	0.609	S	S	*	*	H	α-helix	trans	-78.8	-19.7	170.8	-96.8	169.6	170.5	142.3	0	113.3	E38 T104 K105 E106	E38-K108 IonicContact OE1-NZ 3.45Å; E38-K108 PolarHBondContact OE1-NZ 2.84Å; E38-K108 IonicContact OE2-NZ 3.16Å; E38-K108 PolarHBondContact OE2-NZ 3.06Å; T104-K108 PolarHBondContact O-N 2.83Å; K105-K108 WeakPolarHBondContact O-CB 3.33Å; K105-K108 PolarHBondContact O-N 3.26Å; E106-K108 PolarHBondContact O-N 3.46Å
109	I	47.9	Very low	53.5	Low	119 Å²	119	114.4 Å²	114.4	61%	0.61	62%	0.622	S	S	*	*	H	α-helix	trans	-87.5	-24.6	-176.9	-69	163.1	0	0	0	111.9	K105 E106 S111	K105-I109 WeakPolarHBondContact O-CD1 3.26Å; K105-I109 VanDerWaalsContact O-CG1 3.24Å; K105-I109 WeakPolarHBondContact O-CG1 3.42Å; K105-I109 PolarHBondContact O-N 3.37Å; E106-I109 WeakPolarHBondContact O-CA 3.33Å; E106-I109 WeakPolarHBondContact O-CB 3.37Å; E106-I109 PolarHBondContact O-N 3.1Å; I109-S111 PolarHBondContact O-N 3.46Å
110	D	41.5	Very low	51.5	Low	153 Å²	153	115 Å²	115	82%	0.818	63%	0.633	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.3	-5.9	175.6	-86.1	-16.3	0	0	0	114.8	E106	E106-D110 PolarHBondContact O-N 3.07Å
111	S	42.6	Very low	49.5	Very low	100 Å²	100	120.1 Å²	120.1	70%	0.699	66%	0.661	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.2	-16.9	178.9	-175.7	0	0	0	0	114.3	I109	I109-S111 PolarHBondContact O-N 3.46Å
112	V	35.6	Very low	47.4	Very low	118 Å²	118	122 Å²	122	72%	0.715	67%	0.671	S	S	*	*			trans	-147.6	89.4	-179.9	-168.7	0	0	0	0	111.8
113	A	39.1	Very low	45.7	Very low	95 Å²	95	125.3 Å²	125.3	79%	0.785	69%	0.689	S	S	*	*			trans	-78.7	116.6	154.3	0	0	0	0	0	109.1
114	V	36.8	Very low	44.3	Very low	125 Å²	125	129.7 Å²	129.7	76%	0.758	71%	0.706	S	S	*	*				169.4	109.8	127.6	162.4	0	0	0	0	109.2
115	N	39.7	Very low	43.3	Very low	146 Å²	146	133.2 Å²	133.2	78%	0.781	73%	0.729	S	S	*	*			trans	57.6	109.2	146.2	-88.6	1.2	0	0	0	121.5
116	I	37.4	Very low	43	Very low	154 Å²	154	132.1 Å²	132.1	79%	0.79	74%	0.736	S	S	*	*				175.9	124.3	99.1	-89.1	156.6	0	0	0	112.2
117	S	33.7	Very low	43.1	Very low	105 Å²	105	138.2 Å²	138.2	73%	0.734	75%	0.754	S	S	*	*			trans	51.6	112.1	146.1	-59.4	0	0	0	0	123.1
118	N	44.4	Very low	43.4	Very low	154 Å²	154	137.2 Å²	137.2	82%	0.824	75%	0.748	S	S	*	*				25.5	101.7	125	-96	-2.7	0	0	0	117.6
119	L	35	Very low	44.5	Very low	152 Å²	152	134 Å²	134	80%	0.796	74%	0.742	S	S	*	*			trans	-139.8	94	141.9	-99.5	156.4	0	0	0	107.7	L121	L119-L121 VanDerWaalsContact C-N 3.33Å; L119-L121 PolarHBondContact O-N 2.97Å
120	V	43.2	Very low	45.7	Very low	132 Å²	132	137 Å²	137	80%	0.8	75%	0.75	S	S	*	*			trans	-61.9	99.5	158.7	171.6	0	0	0	0	106.3
121	L	41.5	Very low	47.5	Very low	142 Å²	142	132.3 Å²	132.3	74%	0.743	73%	0.733	S	S	*	*			trans	-103.6	113.5	167.1	-98.2	158.6	0	0	0	107.5	L119 N123	L119-L121 VanDerWaalsContact C-N 3.33Å; L119-L121 PolarHBondContact O-N 2.97Å; L121-N123 PolarHBondContact O-N 3.32Å
122	E	37.7	Very low	49.3	Very low	163 Å²	163	132.2 Å²	132.2	76%	0.762	72%	0.721	S	S	*	*			trans	-50.1	117.7	177.8	-65.8	177.7	142.3	0	0	111.2	Q124	E122-Q124 VanDerWaalsContact C-N 3.31Å; E122-Q124 PolarHBondContact O-N 3.29Å
123	N	42	Very low	51.5	Low	167 Å²	167	133.7 Å²	133.7	89%	0.893	72%	0.718	S	S	*	*			trans	-70.5	84.3	168.5	-81.7	-40.8	0	0	0	109.9	L121	L121-N123 PolarHBondContact O-N 3.32Å
124	Q	43.8	Very low	53.5	Low	151 Å²	151	138.7 Å²	138.7	71%	0.706	72%	0.717	S	S	*	*	P	Polyproline II helix	trans	-94.9	123.5	154.1	-71.2	-167	25.6	0	0	108.8	E122	E122-Q124 VanDerWaalsContact C-N 3.31Å; E122-Q124 PolarHBondContact O-N 3.29Å
125	P	44.2	Very low	55.8	Low	113 Å²	113	142 Å²	142	73%	0.734	72%	0.716	S	S	*	*	P	Polyproline II helix	trans	-61.4	130.1	176.3	24.1	-31	0	0	0	108.9	R127	P125-R127 PolarHBondContact O-N 3.2Å
126	P	57.3	Low	58	Low	115 Å²	115	139.1 Å²	139.1	75%	0.747	70%	0.698	S	S	*	*	P	Polyproline II helix	trans	-56.7	130.6	179.5	21.1	-30.8	0	0	0	109.2	I128	P126-I128 VanDerWaalsContact C-N 3.34Å; P126-I128 PolarHBondContact O-N 3.46Å
127	R	58.3	Low	60.4	Low	248 Å²	248	138.9 Å²	138.9	94%	0.936	69%	0.691	S	S	*	*			trans	-64.1	95.8	178	-73.7	-176.4	173.8	-178.7	-0.8	108.9	P125 S129	P125-R127 PolarHBondContact O-N 3.2Å; R127-S129 PolarHBondContact O-N 2.91Å
128	I	60.1	Low	63.1	Low	97 Å²	97	140.9 Å²	140.9	50%	0.497	69%	0.686	S	S	.	*			trans	-54.8	121.8	177.8	-54.2	173	0	0	0	108.3	P126 Q132 K133	P126-I128 VanDerWaalsContact C-N 3.34Å; P126-I128 PolarHBondContact O-N 3.46Å; I128-Q132 HydrophobicContact CG2-CB 3.8Å; I128-Q132 HydrophobicContact CG2-CG 3.73Å; I128-K133 HydrophobicContact CG2-CB 4.43Å
129	S	72.4	Confident	65.3	Low	64 Å²	64	136.2 Å²	136.2	45%	0.448	67%	0.669	S	S	.	*			trans	-60.7	147	179.5	170.4	0	0	0	0	110.9	R127 A131 Q132 K133	R127-S129 PolarHBondContact O-N 2.91Å; S129-A131 PolarHBondContact O-N 3.49Å; S129-A131 VanDerWaalsContact O-N 3.1Å; S129-A131 PolarHBondContact OG-N 3.44Å; S129-Q132 WeakPolarHBondContact O-CA 3.42Å; S129-Q132 WeakPolarHBondContact O-CB 3.44Å; S129-Q132 PolarHBondContact O-N 2.82Å; S129-K133 PolarHBondContact O-N 2.96Å
130	K	74.4	Confident	67.8	Low	183 Å²	183	131.8 Å²	131.8	80%	0.796	65%	0.654	S	S	*	*	H	α-helix	trans	-53.6	-31.3	172.3	-72.1	-177	178.6	176.3	0	112.2	R134	K130-R134 WeakPolarHBondContact O-CG 3.3Å; K130-R134 PolarHBondContact O-N 3.1Å
131	A	78.2	Confident	69.9	Low	54 Å²	54	130.2 Å²	130.2	45%	0.446	64%	0.641	S	S	.	*	H	α-helix	trans	-72.2	-39.2	175.7	0	0	0	0	0	112.3	S129 R134 R135	S129-A131 PolarHBondContact O-N 3.49Å; S129-A131 VanDerWaalsContact O-N 3.1Å; S129-A131 PolarHBondContact OG-N 3.44Å; A131-R134 PolarHBondContact O-N 2.98Å; A131-R135 WeakPolarHBondContact O-CG 3.45Å; A131-R135 PolarHBondContact O-N 3.18Å; A131-R135 VanDerWaalsContact O-N 3.15Å
132	Q	79.9	Confident	72.1	Confident	98 Å²	98	128.5 Å²	128.5	46%	0.458	63%	0.629	S	S	.	*	H	α-helix	trans	-67.8	-43.8	177.8	-175.8	175.1	-12.6	0	0	111.1	I128 S129 R134 R135 E136	I128-Q132 HydrophobicContact CG2-CB 3.8Å; I128-Q132 HydrophobicContact CG2-CG 3.73Å; S129-Q132 WeakPolarHBondContact O-CA 3.42Å; S129-Q132 WeakPolarHBondContact O-CB 3.44Å; S129-Q132 PolarHBondContact O-N 2.82Å; Q132-R134 VanDerWaalsContact C-N 3.26Å; Q132-R134 PolarHBondContact O-N 3.06Å; Q132-R135 PolarHBondContact O-N 3.16Å; Q132-R135 VanDerWaalsContact O-N 3.08Å; Q132-E136 HydrophobicContact CG-CG 4.46Å; Q132-E136 VanDerWaalsContact CG-OE1 3.24Å; Q132-E136 WeakPolarHBondContact CG-OE1 3.47Å; Q132-E136 PolarHBondContact NE2-OE1 3.16Å; Q132-E136 WeakPolarHBondContact O-CG 3.26Å; Q132-E136 PolarHBondContact O-N 3.17Å
133	K	82	Confident	74.5	Confident	150 Å²	150	126.8 Å²	126.8	65%	0.652	62%	0.619	S	S	*	*	H	α-helix	trans	-59.3	-32.9	173.8	-170.7	172.1	-176.1	172	0	113.4	I128 S129 K137	I128-K133 HydrophobicContact CG2-CB 4.43Å; S129-K133 PolarHBondContact O-N 2.96Å; K133-K137 WeakPolarHBondContact O-CB 3.25Å; K133-K137 PolarHBondContact O-N 3.27Å; K133-K137 VanDerWaalsContact O-N 3.08Å
134	R	80.5	Confident	76.8	Confident	200 Å²	200	123.3 Å²	123.3	76%	0.755	60%	0.597	S	S	*	*	H	α-helix	trans	-71.4	-40.1	174.6	-75.7	177.2	-179.8	-173	-0.1	112.2	K130 A131 Q132 K138	K130-R134 WeakPolarHBondContact O-CG 3.3Å; K130-R134 PolarHBondContact O-N 3.1Å; A131-R134 PolarHBondContact O-N 2.98Å; Q132-R134 VanDerWaalsContact C-N 3.26Å; Q132-R134 PolarHBondContact O-N 3.06Å; R134-K138 PolarHBondContact O-N 3.3Å; R134-K138 VanDerWaalsContact O-N 3.09Å
135	R	86.4	Confident	78.8	Confident	195 Å²	195	124.1 Å²	124.1	74%	0.736	59%	0.594	S	S	*	*	H	α-helix	trans	-66.2	-45.6	176.1	-70.2	177.9	-176.5	177.8	0.5	111.2	A131 Q132 K137 K138 A139	A131-R135 WeakPolarHBondContact O-CG 3.45Å; A131-R135 PolarHBondContact O-N 3.18Å; A131-R135 VanDerWaalsContact O-N 3.15Å; Q132-R135 PolarHBondContact O-N 3.16Å; Q132-R135 VanDerWaalsContact O-N 3.08Å; R135-K137 PolarHBondContact O-N 2.94Å; R135-K138 PolarHBondContact O-N 3.45Å; R135-A139 WeakPolarHBondContact O-CB 3.4Å; R135-A139 PolarHBondContact O-N 3.23Å
136	E	86.1	Confident	80.8	Confident	85 Å²	85	124.1 Å²	124.1	40%	0.397	58%	0.584	S	S	.	*	H	α-helix	trans	-61.4	-42	176.7	-70.9	166.7	-177.7	0	0	111.7	Q132 K138 A139 A140	Q132-E136 HydrophobicContact CG-CG 4.46Å; Q132-E136 VanDerWaalsContact CG-OE1 3.24Å; Q132-E136 WeakPolarHBondContact CG-OE1 3.47Å; Q132-E136 PolarHBondContact NE2-OE1 3.16Å; Q132-E136 WeakPolarHBondContact O-CG 3.26Å; Q132-E136 PolarHBondContact O-N 3.17Å; E136-K138 PolarHBondContact O-N 3.26Å; E136-A139 PolarHBondContact O-N 3.46Å; E136-A140 VanDerWaalsContact O-CB 3.32Å; E136-A140 WeakPolarHBondContact O-CB 3.26Å; E136-A140 PolarHBondContact O-N 3.15Å
137	K	88.3	Confident	82.1	Confident	148 Å²	148	122.7 Å²	122.7	64%	0.643	57%	0.568	S	S	*	*	H	α-helix	trans	-63.3	-39.6	174.2	-172.9	178.1	-179.4	-177.7	0	112.7	K133 R135 L141	K133-K137 WeakPolarHBondContact O-CB 3.25Å; K133-K137 PolarHBondContact O-N 3.27Å; K133-K137 VanDerWaalsContact O-N 3.08Å; R135-K137 PolarHBondContact O-N 2.94Å; K137-L141 HydrophobicContact CG-CD1 4.36Å; K137-L141 WeakPolarHBondContact O-CG 3.26Å; K137-L141 PolarHBondContact O-N 3.22Å; K137-L141 VanDerWaalsContact O-N 3.13Å
138	K	90.4	Very high	83.4	Confident	147 Å²	147	118.6 Å²	118.6	64%	0.639	55%	0.552	S	S	*	*	H	α-helix	trans	-66.5	-45.9	176.4	-173.7	-177.2	175.5	-170.3	0	111	R134 R135 E136 A140 L141 E142	R134-K138 PolarHBondContact O-N 3.3Å; R134-K138 VanDerWaalsContact O-N 3.09Å; R135-K138 PolarHBondContact O-N 3.45Å; E136-K138 PolarHBondContact O-N 3.26Å; K138-A140 VanDerWaalsContact C-N 3.33Å; K138-A140 PolarHBondContact O-N 3.11Å; K138-L141 PolarHBondContact O-N 2.78Å; K138-E142 WeakPolarHBondContact O-CB 3.32Å; K138-E142 PolarHBondContact O-N 2.86Å
139	A	88.9	Confident	84.2	Confident	56 Å²	56	117.2 Å²	117.2	46%	0.463	55%	0.545	S	S	.	.	H	α-helix	trans	-62.7	-39	177.8	0	0	0	0	0	112	R135 E136 E142 K143	R135-A139 WeakPolarHBondContact O-CB 3.4Å; R135-A139 PolarHBondContact O-N 3.23Å; E136-A139 PolarHBondContact O-N 3.46Å; A139-E142 PolarHBondContact O-N 2.54Å; A139-K143 WeakPolarHBondContact O-CB 3.49Å; A139-K143 PolarHBondContact O-N 2.84Å
140	A	87.8	Confident	84.4	Confident	59 Å²	59	116.2 Å²	116.2	49%	0.488	54%	0.541	S	S	.	.	H	α-helix	trans	-64.6	-41.1	175.2	0	0	0	0	0	112.6	E136 K138 E144	E136-A140 VanDerWaalsContact O-CB 3.32Å; E136-A140 WeakPolarHBondContact O-CB 3.26Å; E136-A140 PolarHBondContact O-N 3.15Å; K138-A140 VanDerWaalsContact C-N 3.33Å; K138-A140 PolarHBondContact O-N 3.11Å; A140-E144 WeakPolarHBondContact O-CB 3.32Å; A140-E144 PolarHBondContact O-N 3.02Å
141	L	88.2	Confident	84.6	Confident	99 Å²	99	113.5 Å²	113.5	52%	0.518	53%	0.531	S	S	.	.	H	α-helix	trans	-68.1	-37.3	176.3	-73.9	167.3	0	0	0	112.6	K137 K138 R145	K137-L141 HydrophobicContact CG-CD1 4.36Å; K137-L141 WeakPolarHBondContact O-CG 3.26Å; K137-L141 PolarHBondContact O-N 3.22Å; K137-L141 VanDerWaalsContact O-N 3.13Å; K138-L141 PolarHBondContact O-N 2.78Å; L141-R145 WeakPolarHBondContact O-CB 3.48Å; L141-R145 PolarHBondContact O-N 3.34Å
142	E	87.3	Confident	84.4	Confident	107 Å²	107	112.9 Å²	112.9	50%	0.5	53%	0.526	S	S	.	.	H	α-helix	trans	-67.2	-44.9	175.9	-171.5	160.1	-144.8	0	0	110.8	K138 A139 R145 E146	K138-E142 WeakPolarHBondContact O-CB 3.32Å; K138-E142 PolarHBondContact O-N 2.86Å; A139-E142 PolarHBondContact O-N 2.54Å; E142-R145 WeakPolarHBondContact O-CB 3.27Å; E142-R145 PolarHBondContact O-N 3.32Å; E142-E146 WeakPolarHBondContact O-CG 3.39Å; E142-E146 PolarHBondContact O-N 3.24Å
143	K	88.2	Confident	84.1	Confident	126 Å²	126	114 Å²	114	55%	0.548	53%	0.531	S	S	.	.	H	α-helix	trans	-61.7	-44.5	173.6	-169.2	-177.6	-175.9	-162.4	0	112.4	A139 R145 E146 E147	A139-K143 WeakPolarHBondContact O-CB 3.49Å; A139-K143 PolarHBondContact O-N 2.84Å; K143-R145 VanDerWaalsContact C-N 3.27Å; K143-R145 PolarHBondContact O-N 3.26Å; K143-E146 PolarHBondContact O-N 3.04Å; K143-E147 WeakPolarHBondContact CE-OE1 3.22Å; K143-E147 HydrophobicContact CG-CG 4.39Å; K143-E147 IonicContact NZ-OE1 2.73Å; K143-E147 WeakPolarHBondContact O-CB 3.45Å; K143-E147 WeakPolarHBondContact O-CG 3.35Å; K143-E147 PolarHBondContact O-N 2.99Å
144	E	89.6	Confident	83.6	Confident	94 Å²	94	112.2 Å²	112.2	44%	0.439	53%	0.528	S	S	.	.	H	α-helix	trans	-61.1	-38.5	175.5	-170.6	-163.4	147.9	0	0	111.3	A140 R148	A140-E144 WeakPolarHBondContact O-CB 3.32Å; A140-E144 PolarHBondContact O-N 3.02Å; E144-R148 WeakPolarHBondContact O-CB 3.33Å; E144-R148 PolarHBondContact O-N 3.14Å; E144-R148 IonicContact OE1-NH2 2.95Å; E144-R148 PolarHBondContact OE1-NH2 3.14Å
145	R	86.5	Confident	83.1	Confident	169 Å²	169	109.6 Å²	109.6	64%	0.638	52%	0.524	S	S	*	.	H	α-helix	trans	-65.8	-44.3	175.9	-176.6	178.5	-179.1	-81.7	-3.9	111.3	L141 E142 K143 R148 I149	L141-R145 WeakPolarHBondContact O-CB 3.48Å; L141-R145 PolarHBondContact O-N 3.34Å; E142-R145 WeakPolarHBondContact O-CB 3.27Å; E142-R145 PolarHBondContact O-N 3.32Å; K143-R145 VanDerWaalsContact C-N 3.27Å; K143-R145 PolarHBondContact O-N 3.26Å; R145-R148 PolarHBondContact O-N 2.64Å; R145-I149 HydrophobicContact CG-CD1 4.04Å; R145-I149 WeakPolarHBondContact O-CD1 3.49Å; R145-I149 WeakPolarHBondContact O-CG1 3.26Å; R145-I149 PolarHBondContact O-N 3.15Å
146	E	85.9	Confident	82.5	Confident	112 Å²	112	105.4 Å²	105.4	52%	0.523	52%	0.516	S	S	.	.	H	α-helix	trans	-64.3	-44.1	176.5	-73.2	173.9	178.6	0	0	111.8	E142 K143 R148 I149 A150	E142-E146 WeakPolarHBondContact O-CG 3.39Å; E142-E146 PolarHBondContact O-N 3.24Å; K143-E146 PolarHBondContact O-N 3.04Å; E146-R148 VanDerWaalsContact C-N 3.34Å; E146-R148 PolarHBondContact O-N 2.97Å; E146-I149 PolarHBondContact O-N 3.19Å; E146-A150 WeakPolarHBondContact O-CB 3.21Å; E146-A150 PolarHBondContact O-N 3.38Å
147	E	85.7	Confident	81.7	Confident	86 Å²	86	106 Å²	106	40%	0.402	52%	0.522	S	S	.	.	H	α-helix	trans	-59.9	-43.9	175.5	-74.9	175.2	178.1	0	0	111	K143 I149 A150 E151	K143-E147 WeakPolarHBondContact CE-OE1 3.22Å; K143-E147 HydrophobicContact CG-CG 4.39Å; K143-E147 IonicContact NZ-OE1 2.73Å; K143-E147 WeakPolarHBondContact O-CB 3.45Å; K143-E147 WeakPolarHBondContact O-CG 3.35Å; K143-E147 PolarHBondContact O-N 2.99Å; E147-I149 VanDerWaalsContact C-N 3.33Å; E147-I149 PolarHBondContact O-N 3.15Å; E147-A150 PolarHBondContact O-N 2.95Å; E147-E151 WeakPolarHBondContact O-CG 3.22Å; E147-E151 PolarHBondContact O-N 2.9Å
148	R	84.6	Confident	81.1	Confident	162 Å²	162	104.6 Å²	104.6	61%	0.611	53%	0.525	S	S	*	.	H	α-helix	trans	-64.2	-36.9	175.8	-169	-174.4	-58.9	-175.6	2.5	112.8	E144 R145 E146 A152	E144-R148 WeakPolarHBondContact O-CB 3.33Å; E144-R148 PolarHBondContact O-N 3.14Å; E144-R148 IonicContact OE1-NH2 2.95Å; E144-R148 PolarHBondContact OE1-NH2 3.14Å; R145-R148 PolarHBondContact O-N 2.64Å; E146-R148 VanDerWaalsContact C-N 3.34Å; E146-R148 PolarHBondContact O-N 2.97Å; R148-A152 WeakPolarHBondContact O-CB 3.39Å; R148-A152 PolarHBondContact O-N 3.26Å; R148-A152 VanDerWaalsContact O-N 3.11Å
149	I	77.2	Confident	80.8	Confident	67 Å²	67	98.6 Å²	98.6	34%	0.344	51%	0.506	S	S	.	.	H	α-helix	trans	-66.5	-46.3	175.4	-70.2	163.5	0	0	0	109.6	R145 E146 E147 E151 A152 E153	R145-I149 HydrophobicContact CG-CD1 4.04Å; R145-I149 WeakPolarHBondContact O-CD1 3.49Å; R145-I149 WeakPolarHBondContact O-CG1 3.26Å; R145-I149 PolarHBondContact O-N 3.15Å; E146-I149 PolarHBondContact O-N 3.19Å; E147-I149 VanDerWaalsContact C-N 3.33Å; E147-I149 PolarHBondContact O-N 3.15Å; I149-E151 PolarHBondContact O-N 2.71Å; I149-A152 PolarHBondContact O-N 2.74Å; I149-E153 HydrophobicContact CG2-CG 4.4Å; I149-E153 WeakPolarHBondContact O-CG 3.34Å; I149-E153 PolarHBondContact O-N 2.9Å
150	A	76.6	Confident	80.7	Confident	44 Å²	44	98.6 Å²	98.6	36%	0.364	51%	0.505	S	S	.	.	H	α-helix	trans	-62.5	-42.3	178.9	0	0	0	0	0	112.2	E146 E147 E153 I154	E146-A150 WeakPolarHBondContact O-CB 3.21Å; E146-A150 PolarHBondContact O-N 3.38Å; E147-A150 PolarHBondContact O-N 2.95Å; A150-E153 PolarHBondContact O-N 3.1Å; A150-I154 VanDerWaalsContact O-CG1 3.27Å; A150-I154 WeakPolarHBondContact O-CG1 3.21Å; A150-I154 PolarHBondContact O-N 3.04Å
151	E	77.9	Confident	80.8	Confident	126 Å²	126	101.8 Å²	101.8	59%	0.589	51%	0.505	S	S	*	.	H	α-helix	trans	-60.5	-45.6	174.2	-74.7	179.3	172.2	0	0	111.5	E147 I149 E153 I154 E155	E147-E151 WeakPolarHBondContact O-CG 3.22Å; E147-E151 PolarHBondContact O-N 2.9Å; I149-E151 PolarHBondContact O-N 2.71Å; E151-E153 VanDerWaalsContact C-N 3.34Å; E151-E153 PolarHBondContact O-N 2.78Å; E151-I154 PolarHBondContact O-N 3.28Å; E151-E155 PolarHBondContact O-N 2.84Å
152	A	73.6	Confident	80.8	Confident	41 Å²	41	100.7 Å²	100.7	34%	0.339	50%	0.497	S	S	.	.	H	α-helix	trans	-64.9	-36.2	176.8	0	0	0	0	0	112.4	R148 I149 N156	R148-A152 WeakPolarHBondContact O-CB 3.39Å; R148-A152 PolarHBondContact O-N 3.26Å; R148-A152 VanDerWaalsContact O-N 3.11Å; I149-A152 PolarHBondContact O-N 2.74Å; A152-N156 VanDerWaalsContact O-CB 3.3Å; A152-N156 WeakPolarHBondContact O-CB 3.45Å; A152-N156 PolarHBondContact O-N 2.83Å; A152-N156 PolarHBondContact O-ND2 2.85Å
153	E	74.9	Confident	81	Confident	121 Å²	121	99.7 Å²	99.7	57%	0.565	49%	0.493	S	S	*	.	H	α-helix	trans	-64.3	-42.4	174.2	-76.4	176.1	-178.8	0	0	111.5	I149 A150 E151 N156 L157	I149-E153 HydrophobicContact CG2-CG 4.4Å; I149-E153 WeakPolarHBondContact O-CG 3.34Å; I149-E153 PolarHBondContact O-N 2.9Å; A150-E153 PolarHBondContact O-N 3.1Å; E151-E153 VanDerWaalsContact C-N 3.34Å; E151-E153 PolarHBondContact O-N 2.78Å; E153-N156 WeakPolarHBondContact O-CB 3.43Å; E153-N156 PolarHBondContact O-N 3.44Å; E153-L157 WeakPolarHBondContact O-CG 3.49Å; E153-L157 PolarHBondContact O-N 3.33Å
154	I	70.4	Confident	81.3	Confident	113 Å²	113	94 Å²	94	58%	0.579	47%	0.468	S	S	*	.	H	α-helix	trans	-62.8	-45.3	176.1	-66.6	162.7	0	0	0	111	A150 E151 N156 L157	A150-I154 VanDerWaalsContact O-CG1 3.27Å; A150-I154 WeakPolarHBondContact O-CG1 3.21Å; A150-I154 PolarHBondContact O-N 3.04Å; E151-I154 PolarHBondContact O-N 3.28Å; I154-N156 VanDerWaalsContact C-N 3.3Å; I154-N156 PolarHBondContact O-N 2.81Å; I154-L157 WeakPolarHBondContact O-CB 3.25Å; I154-L157 PolarHBondContact O-N 3.05Å
155	E	71	Confident	81.5	Confident	145 Å²	145	91.3 Å²	91.3	68%	0.678	46%	0.46	S	S	*	.	H	α-helix	trans	-61.4	-41	175.3	-72.3	-176.2	173	0	0	111.4	E151 L157 T158 G159	E151-E155 PolarHBondContact O-N 2.84Å; E155-L157 VanDerWaalsContact C-N 3.3Å; E155-L157 PolarHBondContact O-N 3.05Å; E155-T158 PolarHBondContact O-N 2.51Å; E155-T158 PolarHBondContact O-OG1 3.05Å; E155-G159 PolarHBondContact O-N 3.37Å
156	N	73.1	Confident	81.8	Confident	106 Å²	106	87.6 Å²	87.6	57%	0.567	45%	0.45	S	S	*	.	H	α-helix	trans	-63.6	-30.9	178	-80.8	-48.5	0	0	0	113.3	A152 E153 I154 T158 G159 H162	A152-N156 VanDerWaalsContact O-CB 3.3Å; A152-N156 WeakPolarHBondContact O-CB 3.45Å; A152-N156 PolarHBondContact O-N 2.83Å; A152-N156 PolarHBondContact O-ND2 2.85Å; E153-N156 WeakPolarHBondContact O-CB 3.43Å; E153-N156 PolarHBondContact O-N 3.44Å; I154-N156 VanDerWaalsContact C-N 3.3Å; I154-N156 PolarHBondContact O-N 2.81Å; N156-T158 VanDerWaalsContact C-N 3.26Å; N156-T158 PolarHBondContact O-N 3.16Å; N156-G159 PolarHBondContact O-N 2.99Å; N156-H162 WeakPolarHBondContact O-CB 3.39Å
157	L	68.9	Low	82.3	Confident	99 Å²	99	86.1 Å²	86.1	52%	0.518	44%	0.442	S	S	.	.	H	α-helix	trans	-60.6	-36.7	175.4	-70.5	173.2	0	0	0	112	E153 I154 E155 G159 H162	E153-L157 WeakPolarHBondContact O-CG 3.49Å; E153-L157 PolarHBondContact O-N 3.33Å; I154-L157 WeakPolarHBondContact O-CB 3.25Å; I154-L157 PolarHBondContact O-N 3.05Å; E155-L157 VanDerWaalsContact C-N 3.3Å; E155-L157 PolarHBondContact O-N 3.05Å; L157-G159 VanDerWaalsContact C-N 3.32Å; L157-H162 PolarHBondContact O-CD2 3.15Å
158	T	76.3	Confident	82.8	Confident	117 Å²	117	82 Å²	82	72%	0.718	42%	0.423	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.8	-1.1	175.3	59.2	0	0	0	0	113.3	E155 N156	E155-T158 PolarHBondContact O-N 2.51Å; E155-T158 PolarHBondContact O-OG1 3.05Å; N156-T158 VanDerWaalsContact C-N 3.26Å; N156-T158 PolarHBondContact O-N 3.16Å
159	G	84.4	Confident	83.4	Confident	22 Å²	22	76.9 Å²	76.9	23%	0.227	42%	0.415	C	S	.	.	S	Bend	trans	-68.5	149.1	-176.8	0	0	0	0	0	112.4	E155 N156 L157 R161 H162 M163	E155-G159 PolarHBondContact O-N 3.37Å; N156-G159 PolarHBondContact O-N 2.99Å; L157-G159 VanDerWaalsContact C-N 3.32Å; G159-R161 PolarHBondContact O-N 3.41Å; G159-R161 VanDerWaalsContact O-N 3.1Å; G159-H162 PolarHBondContact O-N 3.28Å; G159-M163 PolarHBondContact O-N 3.26Å; G159-M163 VanDerWaalsContact O-N 3.14Å
160	A	87.4	Confident	84.3	Confident	55 Å²	55	79.5 Å²	79.5	46%	0.455	43%	0.426	S	S	.	.	H	α-helix	trans	-52.1	-36.4	178.4	0	0	0	0	0	112.7	E164 H300	A160-E164 VanDerWaalsContact O-CB 3.22Å; A160-E164 WeakPolarHBondContact O-CB 3.47Å; A160-E164 PolarHBondContact O-N 3.47Å; A160-H300 HydrophobicContact CB-CB 4.37Å
161	R	89.1	Confident	85.2	Confident	126 Å²	126	80 Å²	80	48%	0.475	42%	0.422	S	S	.	.	H	α-helix	trans	-60.8	-46	175.1	-179.4	177.3	175.7	-178.9	6	113.3	G159 S165 H300 A301	G159-R161 PolarHBondContact O-N 3.41Å; G159-R161 VanDerWaalsContact O-N 3.1Å; R161-S165 WeakPolarHBondContact O-CB 3.32Å; R161-S165 PolarHBondContact O-N 2.66Å; R161-S165 PolarHBondContact O-OG 2.92Å; R161-H300 HydrophobicContact CB-CB 4.32Å; R161-H300 VanDerWaalsContact CB-O 3.23Å; R161-H300 WeakPolarHBondContact CB-O 3.3Å; R161-H300 WeakPolarHBondContact CG-O 3.49Å; R161-A301 WeakPolarHBondContact CD-O 3.3Å; R161-A301 PolarHBondContact NE-O 3.31Å; R161-A301 PolarHBondContact NH2-O 3.4Å
162	H	89	Confident	86.2	Confident	77 Å²	77	74 Å²	74	36%	0.356	39%	0.393	S	S	.	.	H	α-helix	trans	-67.9	-47.4	-178.1	-175.9	79	0	0	0	110.1	N156 L157 G159 E164 S165 E166	N156-H162 WeakPolarHBondContact O-CB 3.39Å; L157-H162 PolarHBondContact O-CD2 3.15Å; G159-H162 PolarHBondContact O-N 3.28Å; H162-E164 VanDerWaalsContact C-N 3.33Å; H162-E164 PolarHBondContact O-N 3.03Å; H162-S165 PolarHBondContact O-N 3.44Å; H162-S165 VanDerWaalsContact O-N 3.15Å; H162-E166 WeakPolarHBondContact O-CB 3.46Å; H162-E166 PolarHBondContact O-N 2.83Å
163	M	91.5	Very high	87.3	Confident	85 Å²	85	74.2 Å²	74.2	42%	0.419	40%	0.395	S	S	.	.	H	α-helix	trans	-56.9	-44.5	175.3	-63.3	-60.4	-60	0	0	112.2	G159 K167	G159-M163 PolarHBondContact O-N 3.26Å; G159-M163 VanDerWaalsContact O-N 3.14Å; M163-K167 WeakPolarHBondContact O-CG 3.36Å; M163-K167 PolarHBondContact O-N 2.91Å; M163-K167 VanDerWaalsContact O-N 3.1Å
164	E	94.1	Very high	88.3	Confident	6 Å²	6	72 Å²	72	3%	0.028	40%	0.398	C	S	.	.	H	α-helix	trans	-63	-45	176	-176.7	177.4	-123.2	0	0	111.7	A160 H162 E166 K167 L168 A277 M298 R299 H300	A160-E164 VanDerWaalsContact O-CB 3.22Å; A160-E164 WeakPolarHBondContact O-CB 3.47Å; A160-E164 PolarHBondContact O-N 3.47Å; H162-E164 VanDerWaalsContact C-N 3.33Å; H162-E164 PolarHBondContact O-N 3.03Å; E164-E166 PolarHBondContact O-N 2.92Å; E164-K167 PolarHBondContact O-N 3.28Å; E164-L168 HydrophobicContact CG-CD1 4.01Å; E164-L168 WeakPolarHBondContact O-CB 3.46Å; E164-L168 WeakPolarHBondContact O-CG 3.43Å; E164-L168 PolarHBondContact O-N 3.27Å; E164-A277 HydrophobicContact CB-CB 4.45Å; E164-A277 HydrophobicContact CG-CB 3.71Å; E164-M298 HydrophobicContact CG-CE 4.46Å; E164-R299 WeakPolarHBondContact OE1-CB 3.23Å; E164-R299 PolarHBondContact OE1-N 2.85Å; E164-R299 PolarHBondContact OE2-N 3.44Å; E164-H300 WeakPolarHBondContact OE2-CA 3.38Å; E164-H300 WeakPolarHBondContact OE2-CB 3.25Å; E164-H300 PolarHBondContact OE2-N 2.92Å
165	S	93.1	Very high	89.5	Confident	39 Å²	39	71.1 Å²	71.1	27%	0.273	39%	0.388	S	S	.	.	H	α-helix	trans	-64.2	-40.8	179.8	-57.4	0	0	0	0	111.9	R161 H162 A169 M298	R161-S165 WeakPolarHBondContact O-CB 3.32Å; R161-S165 PolarHBondContact O-N 2.66Å; R161-S165 PolarHBondContact O-OG 2.92Å; H162-S165 PolarHBondContact O-N 3.44Å; H162-S165 VanDerWaalsContact O-N 3.15Å; S165-A169 WeakPolarHBondContact O-CB 3.38Å; S165-A169 PolarHBondContact O-N 3.08Å; S165-M298 WeakPolarHBondContact OG-CE 3.48Å
166	E	93.9	Very high	90.7	Very high	91 Å²	91	70 Å²	70	43%	0.425	38%	0.382	S	S	.	.	H	α-helix	trans	-65.9	-46.5	178.3	-172.2	-179.1	-155.5	0	0	111.4	H162 E164 L168 A169 Q170	H162-E166 WeakPolarHBondContact O-CB 3.46Å; H162-E166 PolarHBondContact O-N 2.83Å; E164-E166 PolarHBondContact O-N 2.92Å; E166-L168 PolarHBondContact O-N 2.92Å; E166-A169 PolarHBondContact O-N 3.22Å; E166-Q170 WeakPolarHBondContact O-CG 3.44Å; E166-Q170 PolarHBondContact O-N 2.96Å
167	K	95.8	Very high	91.9	Very high	80 Å²	80	66.1 Å²	66.1	35%	0.348	36%	0.361	S	S	.	.	H	α-helix	trans	-57.4	-48	175	-75.1	173.9	176.5	177.1	0	111.7	M163 E164 A169 Q170 I171 A277 D278	M163-K167 WeakPolarHBondContact O-CG 3.36Å; M163-K167 PolarHBondContact O-N 2.91Å; M163-K167 VanDerWaalsContact O-N 3.1Å; E164-K167 PolarHBondContact O-N 3.28Å; K167-A169 VanDerWaalsContact C-N 3.35Å; K167-A169 PolarHBondContact O-N 3.2Å; K167-Q170 PolarHBondContact O-N 3.38Å; K167-I171 WeakPolarHBondContact O-CG1 3.49Å; K167-I171 PolarHBondContact O-N 3.27Å; K167-A277 HydrophobicContact CB-CB 4.05Å; K167-A277 HydrophobicContact CD-CB 4.18Å; K167-D278 IonicContact NZ-OD1 3.55Å; K167-D278 PolarHBondContact NZ-OD1 3.44Å
168	L	96.7	Very high	93.2	Very high	0 Å²	0	65.3 Å²	65.3	0%	0	36%	0.355	C	S	.	.	H	α-helix	trans	-63.2	-41.2	178.4	-75	168.2	0	0	0	111.9	E164 E166 Q170 I171 L172 I179 I275 A277 V296 M298	E164-L168 HydrophobicContact CG-CD1 4.01Å; E164-L168 WeakPolarHBondContact O-CB 3.46Å; E164-L168 WeakPolarHBondContact O-CG 3.43Å; E164-L168 PolarHBondContact O-N 3.27Å; E166-L168 PolarHBondContact O-N 2.92Å; L168-Q170 VanDerWaalsContact C-N 3.3Å; L168-Q170 PolarHBondContact O-N 3.1Å; L168-I171 PolarHBondContact O-N 2.97Å; L168-L172 WeakPolarHBondContact O-CB 3.48Å; L168-L172 WeakPolarHBondContact O-CD1 3.5Å; L168-L172 WeakPolarHBondContact O-CG 3.44Å; L168-L172 PolarHBondContact O-N 3.46Å; L168-I179 HydrophobicContact CB-CD1 4.09Å; L168-I179 HydrophobicContact CD1-CD1 4.46Å; L168-I275 HydrophobicContact CD2-CG2 3.95Å; L168-A277 HydrophobicContact CD2-CB 4.38Å; L168-A277 HydrophobicContact CG-CB 4.02Å; L168-V296 HydrophobicContact CD1-CG1 3.71Å; L168-V296 HydrophobicContact CD2-CG1 3.93Å; L168-V296 HydrophobicContact CG-CG1 4.32Å; L168-M298 HydrophobicContact CD1-CE 4.23Å; L168-M298 HydrophobicContact CD1-CG 3.56Å; L168-M298 HydrophobicContact CD1-SD 4.26Å
169	A	95.7	Very high	94.2	Very high	54 Å²	54	61.7 Å²	61.7	45%	0.446	33%	0.331	S	S	.	.	H	α-helix	trans	-59.3	-42.1	175.5	0	0	0	0	0	111.5	S165 E166 K167 A173	S165-A169 WeakPolarHBondContact O-CB 3.38Å; S165-A169 PolarHBondContact O-N 3.08Å; E166-A169 PolarHBondContact O-N 3.22Å; K167-A169 VanDerWaalsContact C-N 3.35Å; K167-A169 PolarHBondContact O-N 3.2Å; A169-A173 WeakPolarHBondContact O-CB 3.47Å; A169-A173 PolarHBondContact O-N 3.3Å
170	Q	96.2	Very high	94.7	Very high	122 Å²	122	64 Å²	64	57%	0.57	34%	0.335	S	S	*	.	H	α-helix	trans	-64.5	-46.3	175.9	-67.8	172.6	9.7	0	0	112.2	E166 K167 L168 L172 A173 A174	E166-Q170 WeakPolarHBondContact O-CG 3.44Å; E166-Q170 PolarHBondContact O-N 2.96Å; K167-Q170 PolarHBondContact O-N 3.38Å; L168-Q170 VanDerWaalsContact C-N 3.3Å; L168-Q170 PolarHBondContact O-N 3.1Å; Q170-L172 VanDerWaalsContact C-N 3.34Å; Q170-L172 PolarHBondContact O-N 3.18Å; Q170-A173 PolarHBondContact O-N 3.03Å; Q170-A174 PolarHBondContact O-N 3.03Å; Q170-A174 VanDerWaalsContact O-N 3.17Å
171	I	97.2	Very high	95.1	Very high	54 Å²	54	66.9 Å²	66.9	28%	0.277	34%	0.339	S	S	.	.	H	α-helix	trans	-60	-44.3	178.1	-67.1	164.2	0	0	0	111	K167 L168 I275	K167-I171 WeakPolarHBondContact O-CG1 3.49Å; K167-I171 PolarHBondContact O-N 3.27Å; L168-I171 PolarHBondContact O-N 2.97Å; I171-I275 HydrophobicContact CG2-CG2 3.73Å
172	L	97.4	Very high	95.4	Very high	0 Å²	0	61.5 Å²	61.5	0%	0	32%	0.319	C	S	.	.	H	α-helix	trans	-73.1	-39.8	-178.5	-67.5	167.6	0	0	0	112	L168 Q170 A174 R175 Q176 L177 I179 I275 V296 V311	L168-L172 WeakPolarHBondContact O-CB 3.48Å; L168-L172 WeakPolarHBondContact O-CD1 3.5Å; L168-L172 WeakPolarHBondContact O-CG 3.44Å; L168-L172 PolarHBondContact O-N 3.46Å; Q170-L172 VanDerWaalsContact C-N 3.34Å; Q170-L172 PolarHBondContact O-N 3.18Å; L172-A174 VanDerWaalsContact C-N 3.29Å; L172-A174 PolarHBondContact O-N 3.23Å; L172-R175 CarbonylContact O-C 3.6Å; L172-R175 WeakPolarHBondContact O-CA 3.48Å; L172-R175 WeakPolarHBondContact O-CB 3.4Å; L172-R175 PolarHBondContact O-N 3.34Å; L172-Q176 PolarHBondContact O-N 3.42Å; L172-Q176 VanDerWaalsContact O-N 3.14Å; L172-L177 CarbonylContact C-O 3.46Å; L172-L177 HydrophobicContact CB-CB 4.15Å; L172-L177 WeakPolarHBondContact CB-O 3.3Å; L172-L177 HydrophobicContact CD2-CB 4.05Å; L172-L177 HydrophobicContact CD2-CD1 4.4Å; L172-L177 PolarHBondContact O-N 2.96Å; L172-I179 HydrophobicContact CD1-CB 4.44Å; L172-I179 HydrophobicContact CD1-CD1 4.18Å; L172-I179 HydrophobicContact CD1-CG1 3.3Å; L172-I275 HydrophobicContact CD2-CD1 3.64Å; L172-V296 HydrophobicContact CD1-CG2 3.81Å; L172-V296 HydrophobicContact CD2-CG2 4.06Å; L172-V296 HydrophobicContact CG-CG2 4.49Å; L172-V311 HydrophobicContact CD2-CG1 3.86Å
173	A	96.4	Very high	95.7	Very high	46 Å²	46	61.4 Å²	61.4	38%	0.38	33%	0.326	S	S	.	.	H	α-helix	trans	-60.6	-39	177.6	0	0	0	0	0	112	A169 Q170 R175 Q176 L177	A169-A173 WeakPolarHBondContact O-CB 3.47Å; A169-A173 PolarHBondContact O-N 3.3Å; Q170-A173 PolarHBondContact O-N 3.03Å; A173-R175 PolarHBondContact O-N 3.16Å; A173-R175 VanDerWaalsContact O-N 3.13Å; A173-Q176 PolarHBondContact O-N 2.85Å; A173-L177 PolarHBondContact N-O 3.4Å
174	A	96.3	Very high	95.6	Very high	76 Å²	76	61 Å²	61	63%	0.628	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.3	-23.3	173.4	0	0	0	0	0	113	Q170 L172 Q176	Q170-A174 PolarHBondContact O-N 3.03Å; Q170-A174 VanDerWaalsContact O-N 3.17Å; L172-A174 VanDerWaalsContact C-N 3.29Å; L172-A174 PolarHBondContact O-N 3.23Å; A174-Q176 PolarHBondContact O-NE2 3.14Å
175	R	96.3	Very high	95.4	Very high	93 Å²	93	64.1 Å²	64.1	35%	0.351	35%	0.348	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.1	7.9	177.5	-58.4	177.1	178.7	-148.1	-0.9	113.5	L172 A173 L177 E273	L172-R175 CarbonylContact O-C 3.6Å; L172-R175 WeakPolarHBondContact O-CA 3.48Å; L172-R175 WeakPolarHBondContact O-CB 3.4Å; L172-R175 PolarHBondContact O-N 3.34Å; A173-R175 PolarHBondContact O-N 3.16Å; A173-R175 VanDerWaalsContact O-N 3.13Å; R175-L177 HydrophobicContact CB-CD1 4.08Å; R175-L177 HydrophobicContact CB-CG 4.26Å; R175-L177 PolarHBondContact O-N 2.87Å; R175-E273 IonicContact CZ-OE1 3.05Å; R175-E273 VanDerWaalsContact NH1-CD 3.3Å; R175-E273 IonicContact NH1-OE1 3.33Å; R175-E273 PolarHBondContact NH1-OE1 2.84Å; R175-E273 IonicContact NH1-OE2 3.74Å; R175-E273 PolarHBondContact NH1-OE2 3.09Å; R175-E273 IonicContact NH2-OE1 2.8Å; R175-E273 PolarHBondContact NH2-OE1 3.49Å
176	Q	96.8	Very high	95.3	Very high	121 Å²	121	62.9 Å²	62.9	57%	0.565	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.6	36.5	-175	-58.5	71.9	61.2	0	0	112.5	L172 A173 A174 L314	L172-Q176 PolarHBondContact O-N 3.42Å; L172-Q176 VanDerWaalsContact O-N 3.14Å; A173-Q176 PolarHBondContact O-N 2.85Å; A174-Q176 PolarHBondContact O-NE2 3.14Å; Q176-L314 PolarHBondContact O-N 2.91Å
177	L	96.8	Very high	95.4	Very high	25 Å²	25	60.7 Å²	60.7	13%	0.131	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	160.1	177.1	-64.1	172	0	0	0	110.4	L172 A173 R175 I294 V311 T312	L172-L177 CarbonylContact C-O 3.46Å; L172-L177 HydrophobicContact CB-CB 4.15Å; L172-L177 WeakPolarHBondContact CB-O 3.3Å; L172-L177 HydrophobicContact CD2-CB 4.05Å; L172-L177 HydrophobicContact CD2-CD1 4.4Å; L172-L177 PolarHBondContact O-N 2.96Å; A173-L177 PolarHBondContact N-O 3.4Å; R175-L177 HydrophobicContact CB-CD1 4.08Å; R175-L177 HydrophobicContact CB-CG 4.26Å; R175-L177 PolarHBondContact O-N 2.87Å; L177-I294 HydrophobicContact CD1-CD1 3.87Å; L177-I294 HydrophobicContact CD1-CG2 4.48Å; L177-V311 HydrophobicContact CD1-CG2 4.25Å; L177-V311 HydrophobicContact CD2-CB 4.5Å; L177-V311 HydrophobicContact CD2-CG2 4.2Å; L177-T312 CarbonylContact C-O 3.36Å; L177-T312 VanDerWaalsContact CA-O 3.28Å; L177-T312 WeakPolarHBondContact CA-O 3.05Å
178	E	96.5	Very high	95.4	Very high	82 Å²	82	57.6 Å²	57.6	38%	0.383	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	159.2	168	65.1	-179	179.3	0	0	111.1	K180 V311 T312 L314	E178-K180 PolarHBondContact O-N 3.36Å; E178-V311 VanDerWaalsContact O-CA 3.3Å; E178-V311 WeakPolarHBondContact O-CA 3.23Å; E178-T312 HydrophobicContact CG-CG2 3.65Å; E178-T312 PolarHBondContact N-O 3.46Å; E178-T312 PolarHBondContact O-N 3.02Å; E178-L314 HydrophobicContact CB-CD1 4.03Å; E178-L314 HydrophobicContact CG-CD1 4.46Å
179	I	96.7	Very high	95.5	Very high	41 Å²	41	57.7 Å²	57.7	21%	0.21	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.2	125.9	178.1	-57.8	-179.9	0	0	0	109.1	L168 L172 V296 M298 N309	L168-I179 HydrophobicContact CB-CD1 4.09Å; L168-I179 HydrophobicContact CD1-CD1 4.46Å; L172-I179 HydrophobicContact CD1-CB 4.44Å; L172-I179 HydrophobicContact CD1-CD1 4.18Å; L172-I179 HydrophobicContact CD1-CG1 3.3Å; I179-V296 HydrophobicContact CD1-CG1 4.16Å; I179-V296 HydrophobicContact CG1-CG1 4.36Å; I179-V296 HydrophobicContact CG1-CG2 4.41Å; I179-M298 HydrophobicContact CD1-SD 4.36Å; I179-N309 HydrophobicContact CG2-CB 3.62Å
180	K	96.5	Very high	95.6	Very high	71 Å²	71	55.1 Å²	55.1	31%	0.309	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	109	166.6	-178.4	169.6	168.3	-164.5	0	109.3	E178 I182 D195 S310 T312	E178-K180 PolarHBondContact O-N 3.36Å; K180-I182 PolarHBondContact O-N 2.89Å; K180-D195 VanDerWaalsContact CD-OD2 3.3Å; K180-D195 WeakPolarHBondContact CD-OD2 3.11Å; K180-D195 VanDerWaalsContact CE-OD1 3.22Å; K180-D195 WeakPolarHBondContact CE-OD1 3.4Å; K180-D195 VanDerWaalsContact CE-OD2 3.23Å; K180-D195 WeakPolarHBondContact CE-OD2 3.41Å; K180-D195 IonicContact NZ-OD1 3.98Å; K180-D195 PolarHBondContact NZ-OD1 3.28Å; K180-D195 IonicContact NZ-OD2 2.7Å; K180-D195 PolarHBondContact NZ-OD2 3.2Å; K180-S310 PolarHBondContact N-O 3.47Å; K180-S310 PolarHBondContact O-N 3.11Å; K180-T312 HydrophobicContact CB-CG2 4.41Å
181	Q	95.6	Very high	95.7	Very high	116 Å²	116	51.6 Å²	51.6	54%	0.542	28%	0.281	S	S	.	.			trans	-64.2	129.2	-173.4	-62.4	-71.1	51.6	0	0	112.1	N309	Q181-N309 WeakPolarHBondContact CA-OD1 3.4Å; Q181-N309 VanDerWaalsContact OE1-CG 3.28Å; Q181-N309 PolarHBondContact OE1-ND2 3.01Å; Q181-N309 PolarHBondContact OE1-OD1 3.46Å
182	I	95.9	Very high	95.7	Very high	12 Å²	12	49 Å²	49	6%	0.062	27%	0.268	C	S	.	.			trans	-106.4	140.2	176.2	-61.8	-61.4	0	0	0	109.3	K180 C188 K191 A192 D195 H307 N309	K180-I182 PolarHBondContact O-N 2.89Å; I182-C188 HydrophobicContact CG2-CB 4.12Å; I182-K191 HydrophobicContact CG2-CB 3.53Å; I182-K191 HydrophobicContact CG2-CD 4.18Å; I182-A192 HydrophobicContact CG1-CB 4.08Å; I182-D195 HydrophobicContact CD1-CB 4.25Å; I182-H307 PolarHBondContact O-CE1 3.35Å; I182-H307 PolarHBondContact O-NE2 2.74Å; I182-N309 PolarHBondContact N-OD1 2.8Å
183	P	93.7	Very high	95.7	Very high	76 Å²	76	49 Å²	49	49%	0.494	27%	0.268	S	S	.	.			trans	-57.7	141.4	177.3	-25.6	34.8	0	0	0	113.5	D185	P183-D185 PolarHBondContact O-N 2.67Å
184	S	89.4	Confident	95.8	Very high	76 Å²	76	48.5 Å²	48.5	53%	0.531	26%	0.258	S	S	.	.			trans	-88	61.7	-179.4	64.7	0	0	0	0	112.5
185	D	90.8	Very high	95.8	Very high	71 Å²	71	45.8 Å²	45.8	38%	0.38	23%	0.233	S	C	.	.	S	Bend	trans	-113.3	25.3	-176.6	70.5	-26.5	0	0	0	114	P183 H187 K191	P183-D185 PolarHBondContact O-N 2.67Å; D185-H187 PolarHBondContact O-CD2 3.47Å; D185-H187 PolarHBondContact O-N 3.49Å; D185-H187 VanDerWaalsContact O-N 3.16Å; D185-H187 IonicContact OD1-CD2 3.46Å; D185-H187 IonicContact OD2-CD2 3.81Å; D185-K191 IonicContact OD1-NZ 2.77Å; D185-K191 PolarHBondContact OD1-NZ 3.48Å; D185-K191 IonicContact OD2-NZ 2.61Å; D185-K191 PolarHBondContact OD2-NZ 2.89Å
186	G	90.6	Very high	95.8	Very high	13 Å²	13	41.9 Å²	41.9	13%	0.134	22%	0.218	C	C	.	.	S	Bend	trans	76	-7.8	-179	0	0	0	0	0	114.6	R210	G186-R210 PolarHBondContact O-NH2 2.9Å
187	H	95.8	Very high	95.8	Very high	46 Å²	46	36.5 Å²	36.5	21%	0.213	19%	0.193	C	C	.	.			trans	-101.4	10.6	174.7	-56.2	-78.3	0	0	0	113.1	D185 M189 Y190 K191 V206 R210	D185-H187 PolarHBondContact O-CD2 3.47Å; D185-H187 PolarHBondContact O-N 3.49Å; D185-H187 VanDerWaalsContact O-N 3.16Å; D185-H187 IonicContact OD1-CD2 3.46Å; D185-H187 IonicContact OD2-CD2 3.81Å; H187-M189 PolarHBondContact O-N 3.02Å; H187-Y190 PolarHBondContact O-N 3.36Å; H187-Y190 VanDerWaalsContact O-N 3.16Å; H187-K191 HydrophobicContact CB-CD 4.23Å; H187-K191 HydrophobicContact CB-CG 4.23Å; H187-K191 WeakPolarHBondContact O-CB 3.49Å; H187-K191 WeakPolarHBondContact O-CG 3.31Å; H187-K191 PolarHBondContact O-N 3.23Å; H187-V206 HydrophobicContact CB-CG1 4.27Å; H187-R210 PolarHBondContact ND1-NE 3.21Å; H187-R210 VanDerWaalsContact ND1-NE 3.11Å; H187-R210 PolarHBondContact ND1-NH2 2.67Å; H187-R210 VanDerWaalsContact ND1-NH2 3.15Å
188	C	96.7	Very high	95.6	Very high	14 Å²	14	40.7 Å²	40.7	10%	0.095	21%	0.211	C	C	.	.	H	α-helix	trans	-56.3	-43.7	-167.8	58	0	0	0	0	113.8	I182 K191 A192 H307	I182-C188 HydrophobicContact CG2-CB 4.12Å; C188-K191 PolarHBondContact O-N 3.11Å; C188-A192 VanDerWaalsContact O-CB 3.32Å; C188-A192 WeakPolarHBondContact O-CB 3.27Å; C188-A192 PolarHBondContact O-N 2.93Å; C188-H307 WeakPolarHBondContact CB-CE1 3.22Å; C188-H307 WeakPolarHBondContact CB-ND1 3.38Å
189	M	97.8	Very high	95	Very high	2 Å²	2	41.8 Å²	41.8	1%	0.01	22%	0.216	C	C	.	.	H	α-helix	trans	-58.7	-51.9	176.7	-173.6	-163.7	77.3	0	0	112	H187 K191 A192 I193 E260 L261 L264 Y308	H187-M189 PolarHBondContact O-N 3.02Å; M189-K191 VanDerWaalsContact C-N 3.35Å; M189-K191 PolarHBondContact O-N 2.99Å; M189-A192 PolarHBondContact O-N 2.81Å; M189-I193 WeakPolarHBondContact O-CG1 3.12Å; M189-I193 PolarHBondContact O-N 3.24Å; M189-I193 VanDerWaalsContact O-N 3.12Å; M189-E260 HydrophobicContact CE-CB 3.52Å; M189-E260 HydrophobicContact CE-CG 4.32Å; M189-E260 HydrophobicContact SD-CB 4.28Å; M189-L261 HydrophobicContact CG-CD2 3.87Å; M189-L261 HydrophobicContact CG-CG 4.36Å; M189-L261 HydrophobicContact SD-CD1 4.42Å; M189-L261 HydrophobicContact SD-CD2 3.77Å; M189-L261 HydrophobicContact SD-CG 3.72Å; M189-L264 HydrophobicContact CE-CD1 4.12Å; M189-Y308 HydrophobicContact CB-CD2 3.71Å; M189-Y308 HydrophobicContact CB-CE2 4.19Å; M189-Y308 HydrophobicContact CB-CG 4.06Å; M189-Y308 HydrophobicContact CG-CD2 4.09Å; M189-Y308 HydrophobicContact CG-CE2 4.23Å; M189-Y308 HydrophobicContact CG-CG 4.23Å
190	Y	98.3	Very high	94.4	Very high	1 Å²	1	43.6 Å²	43.6	0%	0.004	22%	0.222	C	C	.	.	H	α-helix	trans	-64.9	-37.8	179.1	-65.6	-81.5	0	0	0	112.4	H187 I193 E194 L209 R210 I249 E260 L264	H187-Y190 PolarHBondContact O-N 3.36Å; H187-Y190 VanDerWaalsContact O-N 3.16Å; Y190-I193 PolarHBondContact O-N 3.38Å; Y190-E194 WeakPolarHBondContact O-CB 3.44Å; Y190-E194 PolarHBondContact O-N 2.81Å; Y190-L209 HydrophobicContact CD1-CB 3.85Å; Y190-L209 HydrophobicContact CE1-CB 4.5Å; Y190-R210 HydrophobicContact CD1-CG 3.86Å; Y190-R210 HydrophobicContact CD2-CG 3.97Å; Y190-R210 HydrophobicContact CE1-CB 4.48Å; Y190-R210 HydrophobicContact CE1-CG 3.71Å; Y190-R210 HydrophobicContact CE2-CG 3.84Å; Y190-R210 HydrophobicContact CG-CG 3.98Å; Y190-I249 WeakPolarHBondContact OH-CG2 3.5Å; Y190-E260 VanDerWaalsContact OH-CG 3.26Å; Y190-E260 WeakPolarHBondContact OH-CG 3.34Å; Y190-L264 HydrophobicContact CD1-CD1 4.1Å; Y190-L264 HydrophobicContact CE1-CD1 3.94Å
191	K	97.7	Very high	93.7	Very high	47 Å²	47	48 Å²	48	20%	0.204	25%	0.249	C	C	.	.	H	α-helix	trans	-67.9	-37.2	176.4	-77.8	-178.7	175.8	177.8	0	112.6	I182 D185 H187 C188 M189 I193 E194 D195 V206	I182-K191 HydrophobicContact CG2-CB 3.53Å; I182-K191 HydrophobicContact CG2-CD 4.18Å; D185-K191 IonicContact OD1-NZ 2.77Å; D185-K191 PolarHBondContact OD1-NZ 3.48Å; D185-K191 IonicContact OD2-NZ 2.61Å; D185-K191 PolarHBondContact OD2-NZ 2.89Å; H187-K191 HydrophobicContact CB-CD 4.23Å; H187-K191 HydrophobicContact CB-CG 4.23Å; H187-K191 WeakPolarHBondContact O-CB 3.49Å; H187-K191 WeakPolarHBondContact O-CG 3.31Å; H187-K191 PolarHBondContact O-N 3.23Å; C188-K191 PolarHBondContact O-N 3.11Å; M189-K191 VanDerWaalsContact C-N 3.35Å; M189-K191 PolarHBondContact O-N 2.99Å; K191-I193 VanDerWaalsContact C-N 3.32Å; K191-E194 PolarHBondContact O-N 3.29Å; K191-D195 VanDerWaalsContact O-CB 3.27Å; K191-D195 WeakPolarHBondContact O-CB 3.4Å; K191-D195 PolarHBondContact O-N 3.44Å; K191-V206 HydrophobicContact CB-CG2 4.4Å; K191-V206 HydrophobicContact CG-CG2 3.54Å
192	A	97.9	Very high	93.2	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-65.2	-39.5	175.4	0	0	0	0	0	110.9	I182 C188 M189 D195 Q196 L295	I182-A192 HydrophobicContact CG1-CB 4.08Å; C188-A192 VanDerWaalsContact O-CB 3.32Å; C188-A192 WeakPolarHBondContact O-CB 3.27Å; C188-A192 PolarHBondContact O-N 2.93Å; M189-A192 PolarHBondContact O-N 2.81Å; A192-D195 PolarHBondContact O-N 2.98Å; A192-Q196 WeakPolarHBondContact O-CG 3.41Å; A192-Q196 PolarHBondContact O-N 3.17Å; A192-L295 HydrophobicContact CB-CD2 3.69Å
193	I	98.1	Very high	92.7	Very high	0 Å²	0	48.8 Å²	48.8	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-66.9	-49	173.5	-68.2	171.5	0	0	0	111.6	M189 Y190 K191 D195 Q196 L197 L209 L261 L264 L268 I272 L293 L295	M189-I193 WeakPolarHBondContact O-CG1 3.12Å; M189-I193 PolarHBondContact O-N 3.24Å; M189-I193 VanDerWaalsContact O-N 3.12Å; Y190-I193 PolarHBondContact O-N 3.38Å; K191-I193 VanDerWaalsContact C-N 3.32Å; I193-D195 PolarHBondContact O-N 3.45Å; I193-Q196 PolarHBondContact O-N 3.02Å; I193-Q196 VanDerWaalsContact O-N 3.16Å; I193-L197 HydrophobicContact CG2-CD1 3.83Å; I193-L197 HydrophobicContact CG2-CG 4.24Å; I193-L197 WeakPolarHBondContact O-CB 3.32Å; I193-L197 VanDerWaalsContact O-CG 3.3Å; I193-L197 WeakPolarHBondContact O-CG 3.47Å; I193-L197 PolarHBondContact O-N 2.78Å; I193-L209 HydrophobicContact CB-CD1 4.36Å; I193-L209 HydrophobicContact CG2-CD1 3.96Å; I193-L209 HydrophobicContact CG2-CD2 4.29Å; I193-L261 HydrophobicContact CD1-CD2 3.72Å; I193-L264 HydrophobicContact CD1-CD1 3.44Å; I193-L264 VanDerWaalsContact CD1-CD1 3.44Å; I193-L268 HydrophobicContact CG2-CD1 4.1Å; I193-I272 HydrophobicContact CD1-CD1 4.26Å; I193-L293 HydrophobicContact CG2-CD1 4.18Å; I193-L295 HydrophobicContact CD1-CD1 4.32Å; I193-L295 HydrophobicContact CG1-CD1 3.92Å; I193-L295 HydrophobicContact CG1-CD2 4.16Å
194	E	97.5	Very high	92.7	Very high	36 Å²	36	47.2 Å²	47.2	17%	0.168	26%	0.261	C	S	.	.	H	α-helix	trans	-52.4	-43	174.4	174.9	-173.4	-89.1	0	0	110.7	Y190 K191 L197 K198 L204 T205 V206 L209	Y190-E194 WeakPolarHBondContact O-CB 3.44Å; Y190-E194 PolarHBondContact O-N 2.81Å; K191-E194 PolarHBondContact O-N 3.29Å; E194-L197 PolarHBondContact O-N 3.37Å; E194-K198 WeakPolarHBondContact O-CG 3.33Å; E194-K198 PolarHBondContact O-N 3.11Å; E194-K198 VanDerWaalsContact O-N 3.09Å; E194-K198 IonicContact OE2-NZ 3.99Å; E194-K198 PolarHBondContact OE2-NZ 3.42Å; E194-L204 WeakPolarHBondContact CG-O 3.41Å; E194-T205 VanDerWaalsContact OE1-CA 3.23Å; E194-T205 WeakPolarHBondContact OE1-CA 3.18Å; E194-V206 HydrophobicContact CB-CG2 4.37Å; E194-V206 PolarHBondContact OE1-N 2.86Å; E194-L209 HydrophobicContact CB-CD1 4.11Å
195	D	97.1	Very high	93.1	Very high	19 Å²	19	47 Å²	47	10%	0.102	26%	0.257	C	S	.	.	H	α-helix	trans	-64.4	-45.9	178.3	-168.7	72.6	0	0	0	113	K180 I182 K191 A192 I193 L197 K198 S310	K180-D195 VanDerWaalsContact CD-OD2 3.3Å; K180-D195 WeakPolarHBondContact CD-OD2 3.11Å; K180-D195 VanDerWaalsContact CE-OD1 3.22Å; K180-D195 WeakPolarHBondContact CE-OD1 3.4Å; K180-D195 VanDerWaalsContact CE-OD2 3.23Å; K180-D195 WeakPolarHBondContact CE-OD2 3.41Å; K180-D195 IonicContact NZ-OD1 3.98Å; K180-D195 PolarHBondContact NZ-OD1 3.28Å; K180-D195 IonicContact NZ-OD2 2.7Å; K180-D195 PolarHBondContact NZ-OD2 3.2Å; I182-D195 HydrophobicContact CD1-CB 4.25Å; K191-D195 VanDerWaalsContact O-CB 3.27Å; K191-D195 WeakPolarHBondContact O-CB 3.4Å; K191-D195 PolarHBondContact O-N 3.44Å; A192-D195 PolarHBondContact O-N 2.98Å; I193-D195 PolarHBondContact O-N 3.45Å; D195-L197 VanDerWaalsContact C-N 3.28Å; D195-L197 PolarHBondContact O-N 3.44Å; D195-K198 PolarHBondContact O-N 2.81Å; D195-S310 VanDerWaalsContact OD2-CB 3.24Å; D195-S310 WeakPolarHBondContact OD2-CB 3.39Å; D195-S310 PolarHBondContact OD2-OG 3.47Å
196	Q	96.7	Very high	93.4	Very high	10 Å²	10	44.6 Å²	44.6	5%	0.047	24%	0.244	C	C	.	.	H	α-helix	trans	-63.9	-31.2	175	-72	-70.1	-71.6	0	0	112.9	A192 I193 L293 I294 L295 S310 V311	A192-Q196 WeakPolarHBondContact O-CG 3.41Å; A192-Q196 PolarHBondContact O-N 3.17Å; I193-Q196 PolarHBondContact O-N 3.02Å; I193-Q196 VanDerWaalsContact O-N 3.16Å; Q196-L293 HydrophobicContact CB-CB 4.28Å; Q196-L293 HydrophobicContact CB-CD2 3.68Å; Q196-L293 HydrophobicContact CB-CG 4.48Å; Q196-I294 VanDerWaalsContact CD-O 3.31Å; Q196-I294 VanDerWaalsContact OE1-N 3.13Å; Q196-I294 PolarHBondContact OE1-O 3.36Å; Q196-L295 HydrophobicContact CG-CD2 4.18Å; Q196-S310 PolarHBondContact NE2-OG 2.88Å; Q196-V311 PolarHBondContact NE2-O 3.17Å
197	L	95.8	Very high	93.7	Very high	8 Å²	8	49.1 Å²	49.1	4%	0.042	27%	0.269	C	S	.	.	H	α-helix	trans	-73.9	-32.6	177.9	-73.2	175.2	0	0	0	112.7	I193 E194 D195 E199 K200 D201 C202 L204 L209 L268 L293	I193-L197 HydrophobicContact CG2-CD1 3.83Å; I193-L197 HydrophobicContact CG2-CG 4.24Å; I193-L197 WeakPolarHBondContact O-CB 3.32Å; I193-L197 VanDerWaalsContact O-CG 3.3Å; I193-L197 WeakPolarHBondContact O-CG 3.47Å; I193-L197 PolarHBondContact O-N 2.78Å; E194-L197 PolarHBondContact O-N 3.37Å; D195-L197 VanDerWaalsContact C-N 3.28Å; D195-L197 PolarHBondContact O-N 3.44Å; L197-E199 VanDerWaalsContact C-N 3.26Å; L197-E199 PolarHBondContact O-N 2.9Å; L197-K200 CarbonylContact O-C 3.58Å; L197-K200 WeakPolarHBondContact O-CA 3.3Å; L197-K200 PolarHBondContact O-N 3.43Å; L197-D201 PolarHBondContact O-N 3.18Å; L197-C202 CarbonylContact C-O 3.55Å; L197-C202 HydrophobicContact CB-CB 4.14Å; L197-C202 HydrophobicContact CD2-CB 4.15Å; L197-C202 PolarHBondContact O-N 3Å; L197-L204 HydrophobicContact CD1-CB 4.11Å; L197-L204 HydrophobicContact CD1-CD1 4.15Å; L197-L209 HydrophobicContact CD1-CD2 4.1Å; L197-L268 HydrophobicContact CD1-CD1 4.21Å; L197-L268 HydrophobicContact CD1-CD2 4.08Å; L197-L268 HydrophobicContact CD2-CD1 4.34Å; L197-L268 HydrophobicContact CD2-CD2 4.31Å; L197-L293 HydrophobicContact CD2-CD1 4.14Å; L197-L293 HydrophobicContact CD2-CD2 4.06Å; L197-L293 HydrophobicContact CG-CD1 4.42Å; L197-L293 HydrophobicContact CG-CD2 4.5Å
198	K	92.4	Very high	93.8	Very high	114 Å²	114	48.3 Å²	48.3	50%	0.496	27%	0.27	S	S	.	.	H	α-helix	trans	-59.5	-36.7	174	-73.9	167.3	-173	157.4	0	112.1	E194 D195 K200 D201	E194-K198 WeakPolarHBondContact O-CG 3.33Å; E194-K198 PolarHBondContact O-N 3.11Å; E194-K198 VanDerWaalsContact O-N 3.09Å; E194-K198 IonicContact OE2-NZ 3.99Å; E194-K198 PolarHBondContact OE2-NZ 3.42Å; D195-K198 PolarHBondContact O-N 2.81Å; K198-K200 PolarHBondContact O-N 3.21Å; K198-D201 PolarHBondContact O-N 2.95Å
199	E	83.6	Confident	93.8	Very high	104 Å²	104	47.6 Å²	47.6	49%	0.486	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.4	-14.4	175.2	-63.3	-168.8	171.8	0	0	113.4	L197	L197-E199 VanDerWaalsContact C-N 3.26Å; L197-E199 PolarHBondContact O-N 2.9Å
200	K	85	Confident	93.9	Very high	80 Å²	80	47.9 Å²	47.9	35%	0.348	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.2	18.9	179.2	-61.8	-175.1	-178.3	176.9	0	112.7	L197 K198 C202 K291 P292 L293	L197-K200 CarbonylContact O-C 3.58Å; L197-K200 WeakPolarHBondContact O-CA 3.3Å; L197-K200 PolarHBondContact O-N 3.43Å; K198-K200 PolarHBondContact O-N 3.21Å; K200-C202 PolarHBondContact O-N 2.87Å; K200-C202 VanDerWaalsContact O-N 3.15Å; K200-K291 PolarHBondContact NZ-O 3.28Å; K200-P292 PolarHBondContact NZ-O 3.1Å; K200-L293 HydrophobicContact CD-CD2 3.86Å
201	D	82.2	Confident	93.9	Very high	163 Å²	163	50.1 Å²	50.1	87%	0.872	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.7	28.2	-176.6	-65	-44.1	0	0	0	114	L197 K198	L197-D201 PolarHBondContact O-N 3.18Å; K198-D201 PolarHBondContact O-N 2.95Å
202	C	84.4	Confident	93.9	Very high	45 Å²	45	50.7 Å²	50.7	30%	0.304	29%	0.286	S	S	.	.			trans	-108.2	110.9	176.6	-172.1	0	0	0	0	110	L197 K200 L204	L197-C202 CarbonylContact C-O 3.55Å; L197-C202 HydrophobicContact CB-CB 4.14Å; L197-C202 HydrophobicContact CD2-CB 4.15Å; L197-C202 PolarHBondContact O-N 3Å; K200-C202 PolarHBondContact O-N 2.87Å; K200-C202 VanDerWaalsContact O-N 3.15Å; C202-L204 PolarHBondContact O-N 2.89Å
203	A	85	Confident	93.9	Very high	99 Å²	99	50.7 Å²	50.7	82%	0.818	29%	0.286	S	S	*	.			trans	-94	52.2	-174	0	0	0	0	0	113
204	L	94.4	Very high	93.9	Very high	43 Å²	43	50.8 Å²	50.8	23%	0.225	29%	0.286	C	S	.	.			trans	-82	131.2	171.4	-70.5	177.4	0	0	0	110.4	E194 L197 C202 A208 L209 L268	E194-L204 WeakPolarHBondContact CG-O 3.41Å; L197-L204 HydrophobicContact CD1-CB 4.11Å; L197-L204 HydrophobicContact CD1-CD1 4.15Å; C202-L204 PolarHBondContact O-N 2.89Å; L204-A208 HydrophobicContact CD2-CB 4.42Å; L204-L209 HydrophobicContact CB-CD2 4.11Å; L204-L209 HydrophobicContact CB-CG 4.25Å; L204-L209 HydrophobicContact CD1-CD2 3.98Å; L204-L268 HydrophobicContact CD1-CD2 3.57Å
205	T	96.4	Very high	94	Very high	73 Å²	73	55.5 Å²	55.5	45%	0.448	31%	0.309	S	S	.	.			trans	-87.5	159.2	177.6	63.6	0	0	0	0	111.7	E194 V207 A208 L209	E194-T205 VanDerWaalsContact OE1-CA 3.23Å; E194-T205 WeakPolarHBondContact OE1-CA 3.18Å; T205-V207 PolarHBondContact O-N 3.25Å; T205-A208 PolarHBondContact O-N 3.31Å; T205-A208 PolarHBondContact OG1-N 3.31Å; T205-L209 WeakPolarHBondContact O-CG 3.33Å; T205-L209 PolarHBondContact O-N 3.04Å
206	V	97.1	Very high	94.1	Very high	19 Å²	19	56.6 Å²	56.6	12%	0.115	31%	0.312	C	S	.	.	H	α-helix	trans	-49.4	-41.9	170.8	171.8	0	0	0	0	112.4	H187 K191 E194 L209 R210	H187-V206 HydrophobicContact CB-CG1 4.27Å; K191-V206 HydrophobicContact CB-CG2 4.4Å; K191-V206 HydrophobicContact CG-CG2 3.54Å; E194-V206 HydrophobicContact CB-CG2 4.37Å; E194-V206 PolarHBondContact OE1-N 2.86Å; V206-L209 PolarHBondContact O-N 2.99Å; V206-R210 WeakPolarHBondContact O-CG 3.44Å; V206-R210 PolarHBondContact O-N 2.91Å
207	V	97.3	Very high	94.2	Very high	108 Å²	108	56.1 Å²	56.1	66%	0.655	31%	0.309	S	S	*	.	H	α-helix	trans	-62.6	-48.7	178.4	178.7	0	0	0	0	110.2	T205 L209 R210 S211	T205-V207 PolarHBondContact O-N 3.25Å; V207-L209 VanDerWaalsContact C-N 3.33Å; V207-L209 PolarHBondContact O-N 3.42Å; V207-R210 PolarHBondContact O-N 3.42Å; V207-S211 PolarHBondContact O-N 3.13Å; V207-S211 PolarHBondContact O-OG 3.47Å
208	A	97.7	Very high	94.2	Very high	29 Å²	29	60.2 Å²	60.2	24%	0.24	33%	0.328	C	S	.	.	H	α-helix	trans	-63.7	-38	178.4	0	0	0	0	0	112.4	L204 T205 Q212	L204-A208 HydrophobicContact CD2-CB 4.42Å; T205-A208 PolarHBondContact O-N 3.31Å; T205-A208 PolarHBondContact OG1-N 3.31Å; A208-Q212 WeakPolarHBondContact O-CB 3.44Å; A208-Q212 VanDerWaalsContact O-CG 3.3Å; A208-Q212 WeakPolarHBondContact O-CG 3.41Å; A208-Q212 PolarHBondContact O-N 2.96Å; A208-Q212 PolarHBondContact O-NE2 3.02Å
209	L	98.1	Very high	94.5	Very high	0 Å²	0	58.6 Å²	58.6	0%	0	33%	0.331	C	S	.	.	H	α-helix	trans	-64.6	-44.9	176.6	-68.6	169.2	0	0	0	110.9	Y190 I193 E194 L197 L204 T205 V206 V207 T213 L264	Y190-L209 HydrophobicContact CD1-CB 3.85Å; Y190-L209 HydrophobicContact CE1-CB 4.5Å; I193-L209 HydrophobicContact CB-CD1 4.36Å; I193-L209 HydrophobicContact CG2-CD1 3.96Å; I193-L209 HydrophobicContact CG2-CD2 4.29Å; E194-L209 HydrophobicContact CB-CD1 4.11Å; L197-L209 HydrophobicContact CD1-CD2 4.1Å; L204-L209 HydrophobicContact CB-CD2 4.11Å; L204-L209 HydrophobicContact CB-CG 4.25Å; L204-L209 HydrophobicContact CD1-CD2 3.98Å; T205-L209 WeakPolarHBondContact O-CG 3.33Å; T205-L209 PolarHBondContact O-N 3.04Å; V206-L209 PolarHBondContact O-N 2.99Å; V207-L209 VanDerWaalsContact C-N 3.33Å; V207-L209 PolarHBondContact O-N 3.42Å; L209-T213 VanDerWaalsContact O-CB 3.32Å; L209-T213 WeakPolarHBondContact O-CB 3.22Å; L209-T213 PolarHBondContact O-N 2.9Å; L209-T213 PolarHBondContact O-OG1 2.88Å; L209-L264 HydrophobicContact CB-CD2 4.26Å; L209-L264 HydrophobicContact CD2-CD2 3.83Å
210	R	98.3	Very high	95.2	Very high	7 Å²	7	56.8 Å²	56.8	3%	0.026	32%	0.323	C	S	.	.	H	α-helix	trans	-62.3	-48	176.9	-78.1	179.1	171.8	-89.2	4.2	112.1	G186 H187 Y190 V206 V207 T213 A214 I249 T252 A254	G186-R210 PolarHBondContact O-NH2 2.9Å; H187-R210 PolarHBondContact ND1-NE 3.21Å; H187-R210 VanDerWaalsContact ND1-NE 3.11Å; H187-R210 PolarHBondContact ND1-NH2 2.67Å; H187-R210 VanDerWaalsContact ND1-NH2 3.15Å; Y190-R210 HydrophobicContact CD1-CG 3.86Å; Y190-R210 HydrophobicContact CD2-CG 3.97Å; Y190-R210 HydrophobicContact CE1-CB 4.48Å; Y190-R210 HydrophobicContact CE1-CG 3.71Å; Y190-R210 HydrophobicContact CE2-CG 3.84Å; Y190-R210 HydrophobicContact CG-CG 3.98Å; V206-R210 WeakPolarHBondContact O-CG 3.44Å; V206-R210 PolarHBondContact O-N 2.91Å; V207-R210 PolarHBondContact O-N 3.42Å; R210-T213 PolarHBondContact O-N 2.94Å; R210-A214 PolarHBondContact O-N 2.91Å; R210-I249 HydrophobicContact CB-CG2 4.34Å; R210-I249 VanDerWaalsContact CD-O 3.32Å; R210-I249 WeakPolarHBondContact CD-O 3.28Å; R210-I249 PolarHBondContact NH1-O 3.36Å; R210-T252 PolarHBondContact NH1-O 2.87Å; R210-A254 PolarHBondContact NH1-O 3.46Å; R210-A254 PolarHBondContact NH2-O 3.26Å
211	S	98.3	Very high	95.8	Very high	48 Å²	48	55.1 Å²	55.1	34%	0.336	32%	0.319	S	S	.	.	H	α-helix	trans	-59.3	-49	177.5	-62.7	0	0	0	0	112.2	V207 T213 A214 E215	V207-S211 PolarHBondContact O-N 3.13Å; V207-S211 PolarHBondContact O-OG 3.47Å; S211-T213 VanDerWaalsContact C-N 3.31Å; S211-T213 PolarHBondContact O-N 3.08Å; S211-A214 PolarHBondContact O-N 3Å; S211-E215 WeakPolarHBondContact O-CB 3.5Å; S211-E215 PolarHBondContact O-N 3.19Å
212	Q	98.5	Very high	96.4	Very high	60 Å²	60	54.6 Å²	54.6	28%	0.28	31%	0.311	S	S	.	.	H	α-helix	trans	-64.8	-36.1	178.7	-73.9	172.5	82.3	0	0	112.2	A208 E215 Y216 I267	A208-Q212 WeakPolarHBondContact O-CB 3.44Å; A208-Q212 VanDerWaalsContact O-CG 3.3Å; A208-Q212 WeakPolarHBondContact O-CG 3.41Å; A208-Q212 PolarHBondContact O-N 2.96Å; A208-Q212 PolarHBondContact O-NE2 3.02Å; Q212-E215 PolarHBondContact O-N 3.09Å; Q212-Y216 VanDerWaalsContact O-CB 3.3Å; Q212-Y216 WeakPolarHBondContact O-CB 3.13Å; Q212-Y216 PolarHBondContact O-N 2.94Å; Q212-I267 HydrophobicContact CB-CD1 3.99Å; Q212-I267 HydrophobicContact CB-CG2 4.2Å; Q212-I267 WeakPolarHBondContact O-CD1 3.33Å
213	T	98.6	Very high	97	Very high	0 Å²	0	57.1 Å²	57.1	0%	0	32%	0.322	C	S	.	.	H	α-helix	trans	-60.9	-51.4	176.3	-58.2	0	0	0	0	110.7	L209 R210 S211 E215 Y216 M217 I249 E260 A263 L264	L209-T213 VanDerWaalsContact O-CB 3.32Å; L209-T213 WeakPolarHBondContact O-CB 3.22Å; L209-T213 PolarHBondContact O-N 2.9Å; L209-T213 PolarHBondContact O-OG1 2.88Å; R210-T213 PolarHBondContact O-N 2.94Å; S211-T213 VanDerWaalsContact C-N 3.31Å; S211-T213 PolarHBondContact O-N 3.08Å; T213-E215 PolarHBondContact O-N 3.23Å; T213-Y216 PolarHBondContact O-N 3.4Å; T213-M217 HydrophobicContact CG2-SD 4.01Å; T213-M217 VanDerWaalsContact O-CG 3.27Å; T213-M217 WeakPolarHBondContact O-CG 3.4Å; T213-M217 PolarHBondContact O-N 3.35Å; T213-I249 HydrophobicContact CG2-CG2 4.48Å; T213-E260 HydrophobicContact CG2-CB 3.86Å; T213-E260 HydrophobicContact CG2-CG 3.83Å; T213-A263 HydrophobicContact CG2-CB 4.04Å; T213-L264 WeakPolarHBondContact OG1-CD2 3.36Å; T213-L264 WeakPolarHBondContact OG1-CG 3.49Å
214	A	98.4	Very high	97.6	Very high	1 Å²	1	52.6 Å²	52.6	1%	0.008	28%	0.284	C	S	.	.	H	α-helix	trans	-63.8	-38.5	178.8	0	0	0	0	0	112.7	R210 S211 Q218 C246 I249 V250	R210-A214 PolarHBondContact O-N 2.91Å; S211-A214 PolarHBondContact O-N 3Å; A214-Q218 WeakPolarHBondContact O-CB 3.48Å; A214-Q218 VanDerWaalsContact O-CG 3.26Å; A214-Q218 WeakPolarHBondContact O-CG 3.47Å; A214-Q218 PolarHBondContact O-N 3.48Å; A214-Q218 PolarHBondContact O-NE2 3.31Å; A214-C246 HydrophobicContact CB-CB 4.14Å; A214-C246 WeakPolarHBondContact CB-O 3.35Å; A214-I249 HydrophobicContact CB-CB 4.38Å; A214-I249 HydrophobicContact CB-CG2 4.13Å; A214-V250 HydrophobicContact CB-CG2 3.41Å; A214-V250 VanDerWaalsContact CB-CG2 3.41Å
215	E	98.6	Very high	97.6	Very high	136 Å²	136	51.6 Å²	51.6	64%	0.636	28%	0.279	S	S	*	.	H	α-helix	trans	-65.7	-42.1	175.8	-176.2	176.5	-164.8	0	0	111.8	S211 Q212 T213 Q218 S219	S211-E215 WeakPolarHBondContact O-CB 3.5Å; S211-E215 PolarHBondContact O-N 3.19Å; Q212-E215 PolarHBondContact O-N 3.09Å; T213-E215 PolarHBondContact O-N 3.23Å; E215-Q218 PolarHBondContact O-N 3.47Å; E215-S219 PolarHBondContact O-N 3.08Å; E215-S219 PolarHBondContact O-OG 2.89Å
216	Y	98.7	Very high	97.5	Very high	42 Å²	42	51.1 Å²	51.1	17%	0.165	28%	0.277	C	S	.	.	H	α-helix	trans	-64.2	-46	176.6	-171.8	-84.6	0	0	0	111.3	Q212 T213 Q218 S219 H220 F224 A263 H266 I267	Q212-Y216 VanDerWaalsContact O-CB 3.3Å; Q212-Y216 WeakPolarHBondContact O-CB 3.13Å; Q212-Y216 PolarHBondContact O-N 2.94Å; T213-Y216 PolarHBondContact O-N 3.4Å; Y216-Q218 VanDerWaalsContact C-N 3.34Å; Y216-Q218 PolarHBondContact O-N 3.25Å; Y216-S219 WeakPolarHBondContact CA-OG 3.36Å; Y216-S219 PolarHBondContact O-N 3.1Å; Y216-S219 PolarHBondContact O-OG 2.87Å; Y216-H220 HydrophobicContact CE1-CB 4.36Å; Y216-H220 AromaticContact CE1-ND1 3.88Å; Y216-H220 AromaticContact CE2-CE1 3.67Å; Y216-H220 AromaticContact CE2-ND1 3.94Å; Y216-H220 AromaticContact CZ-CE1 3.77Å; Y216-H220 AromaticContact CZ-ND1 3.79Å; Y216-H220 PolarHBondContact O-N 3.15Å; Y216-H220 PolarHBondContact O-ND1 3.4Å; Y216-F224 AromaticContact CD1-CE2 3.82Å; Y216-F224 HydrophobicContact CD1-CE2 3.82Å; Y216-F224 AromaticContact CD1-CZ 3.83Å; Y216-F224 HydrophobicContact CD1-CZ 3.83Å; Y216-F224 AromaticContact CE1-CE2 3.82Å; Y216-F224 HydrophobicContact CE1-CE2 3.82Å; Y216-F224 AromaticContact CE1-CZ 3.8Å; Y216-F224 HydrophobicContact CE1-CZ 3.8Å; Y216-A263 HydrophobicContact CD1-CB 3.76Å; Y216-A263 HydrophobicContact CG-CB 4.38Å; Y216-H266 HydrophobicContact CD2-CB 4.45Å; Y216-H266 HydrophobicContact CE1-CB 3.94Å; Y216-H266 AromaticContact CE1-CD2 3.99Å; Y216-H266 HydrophobicContact CE2-CB 3.62Å; Y216-H266 AromaticContact CZ-CD2 3.94Å; Y216-H266 AromaticContact CZ-CG 3.67Å; Y216-H266 VanDerWaalsContact OH-CB 3.26Å; Y216-H266 WeakPolarHBondContact OH-CB 3.39Å; Y216-H266 PolarHBondContact OH-CD2 3.48Å; Y216-H266 PolarHBondContact OH-ND1 2.98Å; Y216-I267 HydrophobicContact CD2-CG1 3.83Å; Y216-I267 HydrophobicContact CG-CD1 4.24Å; Y216-I267 HydrophobicContact CG-CG1 3.98Å
217	M	98.5	Very high	97.4	Very high	0 Å²	0	57.2 Å²	57.2	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-62.9	-41	178.9	-68.3	-179.7	74.8	0	0	111.8	T213 S219 H220 V221 F224 F242 Y245 I249 L259 A263	T213-M217 HydrophobicContact CG2-SD 4.01Å; T213-M217 VanDerWaalsContact O-CG 3.27Å; T213-M217 WeakPolarHBondContact O-CG 3.4Å; T213-M217 PolarHBondContact O-N 3.35Å; M217-S219 VanDerWaalsContact C-N 3.34Å; M217-S219 PolarHBondContact O-N 3.33Å; M217-H220 CarbonylContact O-C 3.49Å; M217-H220 PolarHBondContact O-N 3.22Å; M217-V221 PolarHBondContact O-N 3.36Å; M217-F224 HydrophobicContact CB-CD2 4.09Å; M217-F224 HydrophobicContact CB-CE2 4.32Å; M217-F224 HydrophobicContact CB-CG 4.4Å; M217-F224 HydrophobicContact CE-CB 3.98Å; M217-F224 HydrophobicContact CE-CD1 3.69Å; M217-F224 HydrophobicContact CE-CE1 4.35Å; M217-F224 HydrophobicContact CE-CG 3.86Å; M217-F224 HydrophobicContact CG-CD1 4.1Å; M217-F224 HydrophobicContact CG-CD2 4Å; M217-F224 HydrophobicContact CG-CE1 4.04Å; M217-F224 HydrophobicContact CG-CE2 3.96Å; M217-F224 HydrophobicContact CG-CG 4.09Å; M217-F224 HydrophobicContact CG-CZ 3.98Å; M217-F242 HydrophobicContact CB-CZ 4.1Å; M217-F242 WeakPolarHBondContact O-CZ 3.49Å; M217-Y245 HydrophobicContact CE-CD1 4.22Å; M217-Y245 HydrophobicContact CE-CE1 3.56Å; M217-Y245 HydrophobicContact SD-CE1 4.26Å; M217-I249 HydrophobicContact SD-CD1 3.72Å; M217-L259 HydrophobicContact CE-CB 4.15Å; M217-A263 HydrophobicContact CG-CB 3.95Å
218	Q	97.7	Very high	97.3	Very high	94 Å²	94	52.7 Å²	52.7	44%	0.439	27%	0.274	S	S	.	.	H	α-helix	trans	-66.1	-31.7	175.7	-75.8	173.9	92.4	0	0	113.9	A214 E215 Y216 H220 V221 C246	A214-Q218 WeakPolarHBondContact O-CB 3.48Å; A214-Q218 VanDerWaalsContact O-CG 3.26Å; A214-Q218 WeakPolarHBondContact O-CG 3.47Å; A214-Q218 PolarHBondContact O-N 3.48Å; A214-Q218 PolarHBondContact O-NE2 3.31Å; E215-Q218 PolarHBondContact O-N 3.47Å; Y216-Q218 VanDerWaalsContact C-N 3.34Å; Y216-Q218 PolarHBondContact O-N 3.25Å; Q218-H220 VanDerWaalsContact C-N 3.29Å; Q218-V221 WeakPolarHBondContact O-CG2 3.43Å; Q218-C246 HydrophobicContact CG-CB 3.8Å
219	S	97.9	Very high	97.1	Very high	79 Å²	79	54.9 Å²	54.9	55%	0.552	28%	0.284	S	S	*	.	H	α-helix	trans	-80.2	-10.8	176.2	49.9	0	0	0	0	113.6	E215 Y216 M217	E215-S219 PolarHBondContact O-N 3.08Å; E215-S219 PolarHBondContact O-OG 2.89Å; Y216-S219 WeakPolarHBondContact CA-OG 3.36Å; Y216-S219 PolarHBondContact O-N 3.1Å; Y216-S219 PolarHBondContact O-OG 2.87Å; M217-S219 VanDerWaalsContact C-N 3.34Å; M217-S219 PolarHBondContact O-N 3.33Å
220	H	97.9	Very high	96.7	Very high	67 Å²	67	56.1 Å²	56.1	31%	0.31	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-132.5	42.4	-176	-62	79	0	0	0	111.5	Y216 M217 Q218 E222 D223 F224	Y216-H220 HydrophobicContact CE1-CB 4.36Å; Y216-H220 AromaticContact CE1-ND1 3.88Å; Y216-H220 AromaticContact CE2-CE1 3.67Å; Y216-H220 AromaticContact CE2-ND1 3.94Å; Y216-H220 AromaticContact CZ-CE1 3.77Å; Y216-H220 AromaticContact CZ-ND1 3.79Å; Y216-H220 PolarHBondContact O-N 3.15Å; Y216-H220 PolarHBondContact O-ND1 3.4Å; M217-H220 CarbonylContact O-C 3.49Å; M217-H220 PolarHBondContact O-N 3.22Å; Q218-H220 VanDerWaalsContact C-N 3.29Å; H220-E222 PolarHBondContact O-N 2.85Å; H220-E222 VanDerWaalsContact O-N 3.1Å; H220-D223 HydrophobicContact CB-CB 4.45Å; H220-D223 IonicContact CD2-OD2 2.7Å; H220-D223 WeakPolarHBondContact O-CB 3.24Å; H220-D223 PolarHBondContact O-N 3.39Å; H220-F224 HydrophobicContact CB-CD2 4.22Å; H220-F224 HydrophobicContact CB-CE2 3.89Å; H220-F224 VanDerWaalsContact O-CD2 3.26Å; H220-F224 WeakPolarHBondContact O-CD2 3.33Å
221	V	97.1	Very high	96.2	Very high	44 Å²	44	61.2 Å²	61.2	27%	0.267	33%	0.325	S	S	.	.	H	α-helix	trans	-48.8	-44.8	-172	-176.2	0	0	0	0	112.9	M217 Q218 D223 F224 L225 F242	M217-V221 PolarHBondContact O-N 3.36Å; Q218-V221 WeakPolarHBondContact O-CG2 3.43Å; V221-D223 PolarHBondContact O-N 3.05Å; V221-D223 VanDerWaalsContact O-N 3.16Å; V221-F224 PolarHBondContact O-N 3.45Å; V221-L225 HydrophobicContact CG1-CB 3.94Å; V221-L225 HydrophobicContact CG1-CD2 4.05Å; V221-L225 HydrophobicContact CG1-CG 4.44Å; V221-L225 VanDerWaalsContact O-CB 3.25Å; V221-L225 WeakPolarHBondContact O-CB 3.12Å; V221-L225 PolarHBondContact O-N 3.45Å; V221-F242 HydrophobicContact CB-CE1 4.27Å; V221-F242 HydrophobicContact CG1-CD1 4.05Å; V221-F242 HydrophobicContact CG1-CE1 4Å; V221-F242 HydrophobicContact CG1-CG 4.48Å; V221-F242 HydrophobicContact CG1-CZ 4.38Å; V221-F242 HydrophobicContact CG2-CD1 4.35Å; V221-F242 HydrophobicContact CG2-CE1 3.85Å
222	E	96.4	Very high	95.8	Very high	152 Å²	152	66.2 Å²	66.2	71%	0.71	35%	0.348	S	S	*	.	H	α-helix	trans	-61.2	-25.1	-177.2	-56.3	-58.2	158.6	0	0	113.7	H220 P226	H220-E222 PolarHBondContact O-N 2.85Å; H220-E222 VanDerWaalsContact O-N 3.1Å; E222-P226 VanDerWaalsContact O-CD 3.23Å; E222-P226 WeakPolarHBondContact O-CD 3.37Å; E222-P226 WeakPolarHBondContact O-CG 3.4Å
223	D	96.6	Very high	95.5	Very high	98 Å²	98	67.3 Å²	67.3	52%	0.524	36%	0.359	S	S	.	.	H	α-helix	trans	-82.1	-19.3	179.5	-64.6	-23.8	0	0	0	112.5	H220 V221 F227	H220-D223 HydrophobicContact CB-CB 4.45Å; H220-D223 IonicContact CD2-OD2 2.7Å; H220-D223 WeakPolarHBondContact O-CB 3.24Å; H220-D223 PolarHBondContact O-N 3.39Å; V221-D223 PolarHBondContact O-N 3.05Å; V221-D223 VanDerWaalsContact O-N 3.16Å; D223-F227 WeakPolarHBondContact O-CD2 3.2Å; D223-F227 WeakPolarHBondContact O-CE2 3.32Å
224	F	97.1	Very high	95.1	Very high	4 Å²	4	69.8 Å²	69.8	2%	0.018	39%	0.385	C	S	.	.	H	α-helix	trans	-116.1	-40.5	-172.3	-64.8	-77.3	0	0	0	113.5	Y216 M217 H220 V221 P226 F227 F242 L259 R262 A263	Y216-F224 AromaticContact CD1-CE2 3.82Å; Y216-F224 HydrophobicContact CD1-CE2 3.82Å; Y216-F224 AromaticContact CD1-CZ 3.83Å; Y216-F224 HydrophobicContact CD1-CZ 3.83Å; Y216-F224 AromaticContact CE1-CE2 3.82Å; Y216-F224 HydrophobicContact CE1-CE2 3.82Å; Y216-F224 AromaticContact CE1-CZ 3.8Å; Y216-F224 HydrophobicContact CE1-CZ 3.8Å; M217-F224 HydrophobicContact CB-CD2 4.09Å; M217-F224 HydrophobicContact CB-CE2 4.32Å; M217-F224 HydrophobicContact CB-CG 4.4Å; M217-F224 HydrophobicContact CE-CB 3.98Å; M217-F224 HydrophobicContact CE-CD1 3.69Å; M217-F224 HydrophobicContact CE-CE1 4.35Å; M217-F224 HydrophobicContact CE-CG 3.86Å; M217-F224 HydrophobicContact CG-CD1 4.1Å; M217-F224 HydrophobicContact CG-CD2 4Å; M217-F224 HydrophobicContact CG-CE1 4.04Å; M217-F224 HydrophobicContact CG-CE2 3.96Å; M217-F224 HydrophobicContact CG-CG 4.09Å; M217-F224 HydrophobicContact CG-CZ 3.98Å; H220-F224 HydrophobicContact CB-CD2 4.22Å; H220-F224 HydrophobicContact CB-CE2 3.89Å; H220-F224 VanDerWaalsContact O-CD2 3.26Å; H220-F224 WeakPolarHBondContact O-CD2 3.33Å; V221-F224 PolarHBondContact O-N 3.45Å; F224-P226 VanDerWaalsContact C-N 3.34Å; F224-F227 PolarHBondContact O-N 2.95Å; F224-F242 HydrophobicContact CB-CE2 3.86Å; F224-F242 HydrophobicContact CB-CZ 4.13Å; F224-L259 HydrophobicContact CD1-CB 4.21Å; F224-L259 HydrophobicContact CD1-CD2 4.35Å; F224-L259 WeakPolarHBondContact CE1-O 3.35Å; F224-R262 HydrophobicContact CE1-CB 4.41Å; F224-R262 HydrophobicContact CE1-CG 4.38Å; F224-A263 HydrophobicContact CE1-CB 4.08Å; F224-A263 HydrophobicContact CZ-CB 3.79Å
225	L	94.8	Very high	94.9	Very high	23 Å²	23	74.7 Å²	74.7	12%	0.12	41%	0.411	C	S	.	.	G	3₁₀ helix	trans	-54.4	-39.9	-176.3	-169.9	70.4	0	0	0	113.6	V221 F227 L228 Y237 F242	V221-L225 HydrophobicContact CG1-CB 3.94Å; V221-L225 HydrophobicContact CG1-CD2 4.05Å; V221-L225 HydrophobicContact CG1-CG 4.44Å; V221-L225 VanDerWaalsContact O-CB 3.25Å; V221-L225 WeakPolarHBondContact O-CB 3.12Å; V221-L225 PolarHBondContact O-N 3.45Å; L225-F227 PolarHBondContact O-N 2.87Å; L225-L228 PolarHBondContact O-N 3.35Å; L225-L228 VanDerWaalsContact O-N 3.14Å; L225-Y237 WeakPolarHBondContact CD1-O 3.24Å; L225-F242 HydrophobicContact CB-CD2 4.43Å; L225-F242 HydrophobicContact CD1-CB 3.57Å; L225-F242 HydrophobicContact CD1-CD2 3.63Å; L225-F242 HydrophobicContact CD1-CG 3.77Å
226	P	94.9	Very high	94.6	Very high	63 Å²	63	73.1 Å²	73.1	41%	0.409	41%	0.405	S	S	.	.	G	3₁₀ helix	trans	-59.2	-18.7	177.6	-26.5	37.4	0	0	0	115.6	E222 F224 M236	E222-P226 VanDerWaalsContact O-CD 3.23Å; E222-P226 WeakPolarHBondContact O-CD 3.37Å; E222-P226 WeakPolarHBondContact O-CG 3.4Å; F224-P226 VanDerWaalsContact C-N 3.34Å; P226-M236 HydrophobicContact CB-CE 4.38Å
227	F	94.8	Very high	94.5	Very high	147 Å²	147	73.5 Å²	73.5	65%	0.645	41%	0.406	S	S	*	.	G	3₁₀ helix	trans	-102.4	0.2	-177	-56.5	-75.2	0	0	0	113.4	D223 F224 L225 L259	D223-F227 WeakPolarHBondContact O-CD2 3.2Å; D223-F227 WeakPolarHBondContact O-CE2 3.32Å; F224-F227 PolarHBondContact O-N 2.95Å; L225-F227 PolarHBondContact O-N 2.87Å; F227-L259 HydrophobicContact CB-CD1 4.19Å; F227-L259 HydrophobicContact CB-CD2 3.78Å; F227-L259 HydrophobicContact CD2-CD2 4.25Å; F227-L259 HydrophobicContact CG-CD2 4.2Å
228	L	94.1	Very high	94.3	Very high	12 Å²	12	76.4 Å²	76.4	6%	0.063	42%	0.424	C	S	.	.			trans	-107.1	119.4	-179.8	-71.9	167	0	0	0	110.3	L225 M236 Y237 F242 Y245 L259	L225-L228 PolarHBondContact O-N 3.35Å; L225-L228 VanDerWaalsContact O-N 3.14Å; L228-M236 WeakPolarHBondContact O-CA 3.41Å; L228-Y237 HydrophobicContact CB-CD1 4.27Å; L228-Y237 HydrophobicContact CB-CD2 3.7Å; L228-Y237 HydrophobicContact CB-CE2 4.09Å; L228-Y237 HydrophobicContact CB-CG 3.79Å; L228-Y237 HydrophobicContact CD1-CD2 4.2Å; L228-Y237 HydrophobicContact CD2-CE2 4.28Å; L228-Y237 HydrophobicContact CG-CD2 4.4Å; L228-Y237 PolarHBondContact O-N 2.79Å; L228-F242 HydrophobicContact CD1-CD2 3.45Å; L228-F242 VanDerWaalsContact CD1-CD2 3.45Å; L228-F242 HydrophobicContact CD1-CE2 3.56Å; L228-Y245 HydrophobicContact CD1-CD1 3.94Å; L228-Y245 HydrophobicContact CD1-CE1 4.1Å; L228-Y245 HydrophobicContact CD1-CG 4.31Å; L228-Y245 HydrophobicContact CD2-CD2 4.21Å; L228-Y245 HydrophobicContact CD2-CE1 4.19Å; L228-Y245 HydrophobicContact CD2-CE2 3.86Å; L228-L259 HydrophobicContact CD1-CD1 4.36Å; L228-L259 HydrophobicContact CD2-CD1 3.63Å; L228-L259 HydrophobicContact CG-CD1 3.74Å
229	T	93.8	Very high	94.1	Very high	75 Å²	75	76.1 Å²	76.1	46%	0.46	43%	0.43	S	S	.	.	B	Isolated β-bridge	trans	-127.1	141	-177.5	57.4	0	0	0	0	111.9	P231 D235 Y237	T229-P231 WeakPolarHBondContact O-CD 3.24Å; T229-D235 CarbonylContact C-O 3.58Å; T229-D235 WeakPolarHBondContact CA-O 3.47Å; T229-Y237 VanDerWaalsContact O-CE1 3.3Å; T229-Y237 WeakPolarHBondContact O-CE1 3.47Å
230	N	89.7	Confident	94	Very high	27 Å²	27	78.5 Å²	78.5	14%	0.144	43%	0.432	C	S	.	.			trans	-68.2	122.1	176.3	-170.6	-51.6	0	0	0	109.9	N232 T233 G234 D235 Y237 E241	N230-N232 PolarHBondContact O-N 2.9Å; N230-N232 VanDerWaalsContact O-N 3.11Å; N230-N232 WeakPolarHBondContact OD1-CB 3.49Å; N230-N232 PolarHBondContact OD1-N 3.33Å; N230-T233 WeakPolarHBondContact CB-OG1 3.39Å; N230-T233 PolarHBondContact O-N 3.18Å; N230-G234 WeakPolarHBondContact O-CA 3.34Å; N230-G234 PolarHBondContact O-N 3.34Å; N230-D235 PolarHBondContact N-O 3.47Å; N230-Y237 HydrophobicContact CB-CD1 4.47Å; N230-Y237 HydrophobicContact CB-CE1 4.34Å; N230-E241 PolarHBondContact ND2-OE1 2.97Å
231	P	87.9	Confident	93.9	Very high	114 Å²	114	78.1 Å²	78.1	74%	0.74	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.9	-24.8	-177.2	-24.7	33.8	0	0	0	114.3	T229	T229-P231 WeakPolarHBondContact O-CD 3.24Å
232	N	90.1	Very high	93.9	Very high	152 Å²	152	76.3 Å²	76.3	81%	0.813	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.8	-36.9	-176.7	-58.9	-57.9	0	0	0	112.5	N230	N230-N232 PolarHBondContact O-N 2.9Å; N230-N232 VanDerWaalsContact O-N 3.11Å; N230-N232 WeakPolarHBondContact OD1-CB 3.49Å; N230-N232 PolarHBondContact OD1-N 3.33Å
233	T	91.9	Very high	93.9	Very high	84 Å²	84	73.8 Å²	73.8	52%	0.515	41%	0.407	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101	-25.5	-176.3	73.8	0	0	0	0	112.8	N230 D235	N230-T233 WeakPolarHBondContact CB-OG1 3.39Å; N230-T233 PolarHBondContact O-N 3.18Å; T233-D235 WeakPolarHBondContact CB-OD2 3.46Å; T233-D235 PolarHBondContact O-N 3.39Å; T233-D235 WeakPolarHBondContact OG1-CB 3.39Å; T233-D235 PolarHBondContact OG1-N 3.04Å; T233-D235 PolarHBondContact OG1-OD2 3.08Å
234	G	91.3	Very high	93.9	Very high	52 Å²	52	75.2 Å²	75.2	54%	0.536	41%	0.409	S	S	.	.			trans	77.1	-2.1	-172.4	0	0	0	0	0	113.9	N230	N230-G234 WeakPolarHBondContact O-CA 3.34Å; N230-G234 PolarHBondContact O-N 3.34Å
235	D	93.1	Very high	93.9	Very high	104 Å²	104	77.2 Å²	77.2	56%	0.556	42%	0.417	S	S	*	.	P	Polyproline II helix	trans	-76.2	156.4	179.1	-57.1	-51.8	0	0	0	111.2	T229 N230 T233	T229-D235 CarbonylContact C-O 3.58Å; T229-D235 WeakPolarHBondContact CA-O 3.47Å; N230-D235 PolarHBondContact N-O 3.47Å; T233-D235 WeakPolarHBondContact CB-OD2 3.46Å; T233-D235 PolarHBondContact O-N 3.39Å; T233-D235 WeakPolarHBondContact OG1-CB 3.39Å; T233-D235 PolarHBondContact OG1-N 3.04Å; T233-D235 PolarHBondContact OG1-OD2 3.08Å
236	M	93.5	Very high	94.1	Very high	103 Å²	103	76.2 Å²	76.2	51%	0.507	41%	0.411	S	S	.	.	B	Isolated β-bridge	trans	-59.6	147.5	169.2	-70.8	177.4	53.4	0	0	110.8	P226 L228	P226-M236 HydrophobicContact CB-CE 4.38Å; L228-M236 WeakPolarHBondContact O-CA 3.41Å
237	Y	95.1	Very high	94.2	Very high	50 Å²	50	77.3 Å²	77.3	20%	0.196	41%	0.411	C	S	.	.	P	Polyproline II helix	trans	-57.1	141.5	174.7	-83.3	15.6	0	0	0	111.6	L225 L228 T229 N230 E241 Y245	L225-Y237 WeakPolarHBondContact CD1-O 3.24Å; L228-Y237 HydrophobicContact CB-CD1 4.27Å; L228-Y237 HydrophobicContact CB-CD2 3.7Å; L228-Y237 HydrophobicContact CB-CE2 4.09Å; L228-Y237 HydrophobicContact CB-CG 3.79Å; L228-Y237 HydrophobicContact CD1-CD2 4.2Å; L228-Y237 HydrophobicContact CD2-CE2 4.28Å; L228-Y237 HydrophobicContact CG-CD2 4.4Å; L228-Y237 PolarHBondContact O-N 2.79Å; T229-Y237 VanDerWaalsContact O-CE1 3.3Å; T229-Y237 WeakPolarHBondContact O-CE1 3.47Å; N230-Y237 HydrophobicContact CB-CD1 4.47Å; N230-Y237 HydrophobicContact CB-CE1 4.34Å; Y237-E241 WeakPolarHBondContact CA-OE2 3.47Å; Y237-E241 HydrophobicContact CD1-CB 4.43Å; Y237-E241 HydrophobicContact CD2-CB 4.02Å; Y237-E241 HydrophobicContact CG-CB 3.9Å; Y237-Y245 HydrophobicContact CE2-CD2 4.05Å; Y237-Y245 HydrophobicContact CE2-CG 4.22Å
238	T	95.1	Very high	94.3	Very high	60 Å²	60	73.4 Å²	73.4	37%	0.368	40%	0.397	S	S	.	.	P	Polyproline II helix	trans	-73.3	162.7	164.2	82.4	0	0	0	0	110.4	E240 E241 F242	T238-E240 VanDerWaalsContact CB-OE2 3.31Å; T238-E240 WeakPolarHBondContact CB-OE2 3.48Å; T238-E240 PolarHBondContact O-N 3.02Å; T238-E240 PolarHBondContact OG1-N 3.33Å; T238-E240 PolarHBondContact OG1-OE2 3.11Å; T238-E241 PolarHBondContact N-OE2 3.26Å; T238-E241 PolarHBondContact O-N 3.42Å; T238-E241 VanDerWaalsContact O-N 3.11Å; T238-E241 PolarHBondContact OG1-N 2.92Å; T238-F242 WeakPolarHBondContact O-CB 3.42Å; T238-F242 PolarHBondContact O-N 3.49Å
239	P	93.8	Very high	94.5	Very high	88 Å²	88	73 Å²	73	57%	0.571	40%	0.395	S	S	*	.	H	α-helix	trans	-53.5	-36.2	173.3	-27.7	36.8	0	0	0	113.3	F242 Q243	P239-F242 PolarHBondContact O-N 2.92Å; P239-Q243 WeakPolarHBondContact O-CB 3.34Å; P239-Q243 PolarHBondContact O-N 3.03Å
240	E	94.5	Very high	94.7	Very high	129 Å²	129	72 Å²	72	60%	0.603	39%	0.389	S	S	*	.	H	α-helix	trans	-70	-40.9	177.4	-57.8	73.8	-159.4	0	0	112.1	T238 F242 Q243 K244	T238-E240 VanDerWaalsContact CB-OE2 3.31Å; T238-E240 WeakPolarHBondContact CB-OE2 3.48Å; T238-E240 PolarHBondContact O-N 3.02Å; T238-E240 PolarHBondContact OG1-N 3.33Å; T238-E240 PolarHBondContact OG1-OE2 3.11Å; E240-F242 VanDerWaalsContact C-N 3.34Å; E240-Q243 PolarHBondContact O-N 3.18Å; E240-K244 PolarHBondContact O-N 3.25Å
241	E	96	Very high	95	Very high	60 Å²	60	76.7 Å²	76.7	28%	0.28	41%	0.414	S	S	.	.	H	α-helix	trans	-65.9	-38.1	174.3	-69.6	179.2	134.3	0	0	111.5	N230 Y237 T238 K244 Y245	N230-E241 PolarHBondContact ND2-OE1 2.97Å; Y237-E241 WeakPolarHBondContact CA-OE2 3.47Å; Y237-E241 HydrophobicContact CD1-CB 4.43Å; Y237-E241 HydrophobicContact CD2-CB 4.02Å; Y237-E241 HydrophobicContact CG-CB 3.9Å; T238-E241 PolarHBondContact N-OE2 3.26Å; T238-E241 PolarHBondContact O-N 3.42Å; T238-E241 VanDerWaalsContact O-N 3.11Å; T238-E241 PolarHBondContact OG1-N 2.92Å; E241-K244 PolarHBondContact O-N 2.82Å; E241-Y245 WeakPolarHBondContact O-CB 3.37Å; E241-Y245 PolarHBondContact O-N 2.93Å
242	F	97.1	Very high	95.4	Very high	6 Å²	6	74 Å²	74	3%	0.026	40%	0.395	C	S	.	.	H	α-helix	trans	-65.6	-42.4	174.7	-176.9	-95.8	0	0	0	112.7	M217 V221 F224 L225 L228 T238 P239 E240 K244 Y245 C246	M217-F242 HydrophobicContact CB-CZ 4.1Å; M217-F242 WeakPolarHBondContact O-CZ 3.49Å; V221-F242 HydrophobicContact CB-CE1 4.27Å; V221-F242 HydrophobicContact CG1-CD1 4.05Å; V221-F242 HydrophobicContact CG1-CE1 4Å; V221-F242 HydrophobicContact CG1-CG 4.48Å; V221-F242 HydrophobicContact CG1-CZ 4.38Å; V221-F242 HydrophobicContact CG2-CD1 4.35Å; V221-F242 HydrophobicContact CG2-CE1 3.85Å; F224-F242 HydrophobicContact CB-CE2 3.86Å; F224-F242 HydrophobicContact CB-CZ 4.13Å; L225-F242 HydrophobicContact CB-CD2 4.43Å; L225-F242 HydrophobicContact CD1-CB 3.57Å; L225-F242 HydrophobicContact CD1-CD2 3.63Å; L225-F242 HydrophobicContact CD1-CG 3.77Å; L228-F242 HydrophobicContact CD1-CD2 3.45Å; L228-F242 VanDerWaalsContact CD1-CD2 3.45Å; L228-F242 HydrophobicContact CD1-CE2 3.56Å; T238-F242 WeakPolarHBondContact O-CB 3.42Å; T238-F242 PolarHBondContact O-N 3.49Å; P239-F242 PolarHBondContact O-N 2.92Å; E240-F242 VanDerWaalsContact C-N 3.34Å; F242-K244 VanDerWaalsContact C-N 3.31Å; F242-K244 PolarHBondContact O-N 3.01Å; F242-Y245 WeakPolarHBondContact O-CB 3.41Å; F242-Y245 PolarHBondContact O-N 3.37Å; F242-C246 PolarHBondContact O-N 2.7Å; F242-C246 PolarHBondContact O-SG 3.28Å
243	Q	96.8	Very high	95.6	Very high	98 Å²	98	69 Å²	69	46%	0.458	38%	0.375	S	S	.	.	H	α-helix	trans	-59.5	-46.7	173.7	-175.7	-175.3	-26.5	0	0	110.3	P239 E240 Y245 C246 E247	P239-Q243 WeakPolarHBondContact O-CB 3.34Å; P239-Q243 PolarHBondContact O-N 3.03Å; E240-Q243 PolarHBondContact O-N 3.18Å; Q243-Y245 VanDerWaalsContact C-N 3.31Å; Q243-Y245 PolarHBondContact O-N 3.34Å; Q243-C246 WeakPolarHBondContact O-CB 3.45Å; Q243-C246 PolarHBondContact O-N 3.46Å; Q243-C246 VanDerWaalsContact O-N 3.15Å; Q243-E247 PolarHBondContact NE2-OE1 3.49Å; Q243-E247 WeakPolarHBondContact O-CG 3.29Å; Q243-E247 PolarHBondContact O-N 2.81Å
244	K	97	Very high	95.7	Very high	128 Å²	128	66.7 Å²	66.7	56%	0.557	37%	0.365	S	S	*	.	H	α-helix	trans	-60.5	-40.3	176.7	-176.5	172.8	178.1	-178.8	0	112.4	E240 E241 F242 C246 E247 D248	E240-K244 PolarHBondContact O-N 3.25Å; E241-K244 PolarHBondContact O-N 2.82Å; F242-K244 VanDerWaalsContact C-N 3.31Å; F242-K244 PolarHBondContact O-N 3.01Å; K244-C246 VanDerWaalsContact C-N 3.32Å; K244-C246 PolarHBondContact O-N 2.97Å; K244-E247 WeakPolarHBondContact O-CB 3.49Å; K244-E247 PolarHBondContact O-N 3.27Å; K244-D248 WeakPolarHBondContact O-CB 3.23Å; K244-D248 PolarHBondContact O-N 3.05Å
245	Y	97.4	Very high	95.8	Very high	47 Å²	47	70.8 Å²	70.8	18%	0.184	36%	0.364	C	S	.	.	H	α-helix	trans	-57.3	-45.4	173.9	178	-96.2	0	0	0	112.1	M217 L228 Y237 E241 F242 Q243 D248 I249 E260	M217-Y245 HydrophobicContact CE-CD1 4.22Å; M217-Y245 HydrophobicContact CE-CE1 3.56Å; M217-Y245 HydrophobicContact SD-CE1 4.26Å; L228-Y245 HydrophobicContact CD1-CD1 3.94Å; L228-Y245 HydrophobicContact CD1-CE1 4.1Å; L228-Y245 HydrophobicContact CD1-CG 4.31Å; L228-Y245 HydrophobicContact CD2-CD2 4.21Å; L228-Y245 HydrophobicContact CD2-CE1 4.19Å; L228-Y245 HydrophobicContact CD2-CE2 3.86Å; Y237-Y245 HydrophobicContact CE2-CD2 4.05Å; Y237-Y245 HydrophobicContact CE2-CG 4.22Å; E241-Y245 WeakPolarHBondContact O-CB 3.37Å; E241-Y245 PolarHBondContact O-N 2.93Å; F242-Y245 WeakPolarHBondContact O-CB 3.41Å; F242-Y245 PolarHBondContact O-N 3.37Å; Q243-Y245 VanDerWaalsContact C-N 3.31Å; Q243-Y245 PolarHBondContact O-N 3.34Å; Y245-D248 PolarHBondContact O-N 3.03Å; Y245-I249 HydrophobicContact CD1-CD1 3.87Å; Y245-I249 HydrophobicContact CE1-CD1 3.38Å; Y245-I249 HydrophobicContact CE1-CG1 4.22Å; Y245-I249 WeakPolarHBondContact O-CG1 3.46Å; Y245-I249 PolarHBondContact O-N 3.31Å; Y245-E260 VanDerWaalsContact OH-CD 3.24Å; Y245-E260 PolarHBondContact OH-OE1 3.07Å
246	C	97.9	Very high	95.9	Very high	1 Å²	1	66.5 Å²	66.5	1%	0.007	34%	0.344	C	S	.	.	H	α-helix	trans	-66	-38.6	176.5	-64.1	0	0	0	0	112.2	A214 Q218 F242 Q243 K244 I249 V250	A214-C246 HydrophobicContact CB-CB 4.14Å; A214-C246 WeakPolarHBondContact CB-O 3.35Å; Q218-C246 HydrophobicContact CG-CB 3.8Å; F242-C246 PolarHBondContact O-N 2.7Å; F242-C246 PolarHBondContact O-SG 3.28Å; Q243-C246 WeakPolarHBondContact O-CB 3.45Å; Q243-C246 PolarHBondContact O-N 3.46Å; Q243-C246 VanDerWaalsContact O-N 3.15Å; K244-C246 VanDerWaalsContact C-N 3.32Å; K244-C246 PolarHBondContact O-N 2.97Å; C246-I249 WeakPolarHBondContact O-CB 3.49Å; C246-I249 PolarHBondContact O-N 2.89Å; C246-V250 PolarHBondContact O-N 3.02Å
247	E	97.9	Very high	96	Very high	87 Å²	87	62.5 Å²	62.5	41%	0.407	33%	0.329	S	S	.	.	H	α-helix	trans	-63	-41.3	172.9	-70.9	172.5	-171.7	0	0	111.7	Q243 K244 V250 N251	Q243-E247 PolarHBondContact NE2-OE1 3.49Å; Q243-E247 WeakPolarHBondContact O-CG 3.29Å; Q243-E247 PolarHBondContact O-N 2.81Å; K244-E247 WeakPolarHBondContact O-CB 3.49Å; K244-E247 PolarHBondContact O-N 3.27Å; E247-V250 PolarHBondContact O-N 2.74Å; E247-N251 WeakPolarHBondContact O-CB 3.32Å; E247-N251 PolarHBondContact O-N 3.49Å; E247-N251 PolarHBondContact O-ND2 2.91Å
248	D	97.7	Very high	96.1	Very high	64 Å²	64	64.8 Å²	64.8	34%	0.342	34%	0.342	S	S	.	.	H	α-helix	trans	-66.1	-36.5	178.2	-76.4	-21.1	0	0	0	111.6	K244 Y245 V250 T252	K244-D248 WeakPolarHBondContact O-CB 3.23Å; K244-D248 PolarHBondContact O-N 3.05Å; Y245-D248 PolarHBondContact O-N 3.03Å; D248-V250 VanDerWaalsContact C-N 3.26Å; D248-V250 PolarHBondContact O-N 3.48Å; D248-T252 HydrophobicContact CB-CG2 4.48Å; D248-T252 WeakPolarHBondContact O-CB 3.38Å; D248-T252 PolarHBondContact O-N 3.3Å; D248-T252 VanDerWaalsContact O-N 3.08Å; D248-T252 PolarHBondContact O-OG1 2.95Å
249	I	97.8	Very high	96.2	Very high	4 Å²	4	63.5 Å²	63.5	2%	0.021	33%	0.333	C	S	.	.	H	α-helix	trans	-54.9	-43	171.7	-75.6	169.9	0	0	0	111	Y190 R210 T213 A214 M217 Y245 C246 E260	Y190-I249 WeakPolarHBondContact OH-CG2 3.5Å; R210-I249 HydrophobicContact CB-CG2 4.34Å; R210-I249 VanDerWaalsContact CD-O 3.32Å; R210-I249 WeakPolarHBondContact CD-O 3.28Å; R210-I249 PolarHBondContact NH1-O 3.36Å; T213-I249 HydrophobicContact CG2-CG2 4.48Å; A214-I249 HydrophobicContact CB-CB 4.38Å; A214-I249 HydrophobicContact CB-CG2 4.13Å; M217-I249 HydrophobicContact SD-CD1 3.72Å; Y245-I249 HydrophobicContact CD1-CD1 3.87Å; Y245-I249 HydrophobicContact CE1-CD1 3.38Å; Y245-I249 HydrophobicContact CE1-CG1 4.22Å; Y245-I249 WeakPolarHBondContact O-CG1 3.46Å; Y245-I249 PolarHBondContact O-N 3.31Å; C246-I249 WeakPolarHBondContact O-CB 3.49Å; C246-I249 PolarHBondContact O-N 2.89Å; I249-E260 HydrophobicContact CD1-CG 4.09Å
250	V	97.7	Very high	96.5	Very high	55 Å²	55	59.5 Å²	59.5	33%	0.333	31%	0.306	S	S	.	.	H	α-helix	trans	-78.8	-45.6	-176.3	-179.2	0	0	0	0	111.7	A214 C246 E247 D248	A214-V250 HydrophobicContact CB-CG2 3.41Å; A214-V250 VanDerWaalsContact CB-CG2 3.41Å; C246-V250 PolarHBondContact O-N 3.02Å; E247-V250 PolarHBondContact O-N 2.74Å; D248-V250 VanDerWaalsContact C-N 3.26Å; D248-V250 PolarHBondContact O-N 3.48Å
251	N	96.6	Very high	96.6	Very high	125 Å²	125	53.3 Å²	53.3	67%	0.668	28%	0.278	S	S	*	.	H	α-helix	trans	-96.3	-7.8	-163.3	-63.4	-54.4	0	0	0	114.2	E247	E247-N251 WeakPolarHBondContact O-CB 3.32Å; E247-N251 PolarHBondContact O-N 3.49Å; E247-N251 PolarHBondContact O-ND2 2.91Å
252	T	96.1	Very high	96.8	Very high	56 Å²	56	54.7 Å²	54.7	34%	0.344	28%	0.28	S	S	.	.	S	Bend	trans	-131.3	175.1	-173.8	79.8	0	0	0	0	113.1	R210 D248 A254	R210-T252 PolarHBondContact NH1-O 2.87Å; D248-T252 HydrophobicContact CB-CG2 4.48Å; D248-T252 WeakPolarHBondContact O-CB 3.38Å; D248-T252 PolarHBondContact O-N 3.3Å; D248-T252 VanDerWaalsContact O-N 3.08Å; D248-T252 PolarHBondContact O-OG1 2.95Å; T252-A254 PolarHBondContact O-N 3.28Å; T252-A254 VanDerWaalsContact OG1-CB 3.32Å; T252-A254 WeakPolarHBondContact OG1-CB 3.38Å; T252-A254 PolarHBondContact OG1-N 3.47Å
253	A	94.1	Very high	96.8	Very high	48 Å²	48	54.4 Å²	54.4	40%	0.397	28%	0.279	S	S	.	.			trans	-86.9	29	169.1	0	0	0	0	0	112.6	W255	A253-W255 PolarHBondContact O-N 3.48Å
254	A	93.7	Very high	96.9	Very high	36 Å²	36	49.8 Å²	49.8	30%	0.298	26%	0.257	S	S	.	.	P	Polyproline II helix	trans	-51.8	131.9	172.6	0	0	0	0	0	110.1	R210 T252	R210-A254 PolarHBondContact NH1-O 3.46Å; R210-A254 PolarHBondContact NH2-O 3.26Å; T252-A254 PolarHBondContact O-N 3.28Å; T252-A254 VanDerWaalsContact OG1-CB 3.32Å; T252-A254 WeakPolarHBondContact OG1-CB 3.38Å; T252-A254 PolarHBondContact OG1-N 3.47Å
255	W	94	Very high	97	Very high	137 Å²	137	43.7 Å²	43.7	52%	0.519	23%	0.231	S	C	.	.	P	Polyproline II helix	trans	-68.9	133.8	-179.3	-65.4	5.6	0	0	0	109	A253 L304	A253-W255 PolarHBondContact O-N 3.48Å; W255-L304 HydrophobicContact CH2-CB 3.98Å; W255-L304 HydrophobicContact CZ2-CB 4.27Å; W255-L304 HydrophobicContact CZ2-CD1 4.33Å
256	G	95.3	Very high	97	Very high	14 Å²	14	42.8 Å²	42.8	14%	0.144	23%	0.228	C	C	.	.	P	Polyproline II helix	trans	-89.3	155.6	172.5	0	0	0	0	0	111.4
257	G	95.7	Very high	97	Very high	19 Å²	19	44.7 Å²	44.7	20%	0.196	24%	0.238	C	C	.	.			trans	-147.5	-145.2	175.9	0	0	0	0	0	112.4	L259 E260 L261	G257-L259 VanDerWaalsContact C-N 3.32Å; G257-L259 PolarHBondContact O-N 3.2Å; G257-E260 PolarHBondContact N-OE2 3.08Å; G257-E260 PolarHBondContact O-N 2.95Å; G257-L261 VanDerWaalsContact O-CG 3.26Å; G257-L261 WeakPolarHBondContact O-CG 3.49Å; G257-L261 PolarHBondContact O-N 3.23Å
258	Q	96.4	Very high	96.9	Very high	99 Å²	99	41.4 Å²	41.4	46%	0.463	22%	0.223	S	C	.	.	H	α-helix	trans	-58.6	-39.5	-171.3	-175.4	68	11.7	0	0	113.5	L261 R262	Q258-L261 PolarHBondContact O-N 3.21Å; Q258-R262 WeakPolarHBondContact O-CB 3.48Å; Q258-R262 PolarHBondContact O-N 3.16Å
259	L	97.7	Very high	96.9	Very high	32 Å²	32	42.9 Å²	42.9	17%	0.168	23%	0.228	C	C	.	.	H	α-helix	trans	-67.7	-44.8	-177.9	-61	-178.5	0	0	0	111.2	M217 F224 F227 L228 G257 L261 R262 A263	M217-L259 HydrophobicContact CE-CB 4.15Å; F224-L259 HydrophobicContact CD1-CB 4.21Å; F224-L259 HydrophobicContact CD1-CD2 4.35Å; F224-L259 WeakPolarHBondContact CE1-O 3.35Å; F227-L259 HydrophobicContact CB-CD1 4.19Å; F227-L259 HydrophobicContact CB-CD2 3.78Å; F227-L259 HydrophobicContact CD2-CD2 4.25Å; F227-L259 HydrophobicContact CG-CD2 4.2Å; L228-L259 HydrophobicContact CD1-CD1 4.36Å; L228-L259 HydrophobicContact CD2-CD1 3.63Å; L228-L259 HydrophobicContact CG-CD1 3.74Å; G257-L259 VanDerWaalsContact C-N 3.32Å; G257-L259 PolarHBondContact O-N 3.2Å; L259-L261 VanDerWaalsContact C-N 3.35Å; L259-L261 PolarHBondContact O-N 2.94Å; L259-R262 WeakPolarHBondContact O-CB 3.34Å; L259-R262 PolarHBondContact O-N 3.29Å; L259-A263 PolarHBondContact O-N 3.45Å
260	E	98.4	Very high	96.9	Very high	4 Å²	4	43.2 Å²	43.2	2%	0.019	23%	0.23	C	C	.	.	H	α-helix	trans	-66.9	-38.9	177.1	-66.5	63.3	-119.6	0	0	110.6	M189 Y190 T213 Y245 I249 G257 R262 A263 L264	M189-E260 HydrophobicContact CE-CB 3.52Å; M189-E260 HydrophobicContact CE-CG 4.32Å; M189-E260 HydrophobicContact SD-CB 4.28Å; Y190-E260 VanDerWaalsContact OH-CG 3.26Å; Y190-E260 WeakPolarHBondContact OH-CG 3.34Å; T213-E260 HydrophobicContact CG2-CB 3.86Å; T213-E260 HydrophobicContact CG2-CG 3.83Å; Y245-E260 VanDerWaalsContact OH-CD 3.24Å; Y245-E260 PolarHBondContact OH-OE1 3.07Å; I249-E260 HydrophobicContact CD1-CG 4.09Å; G257-E260 PolarHBondContact N-OE2 3.08Å; G257-E260 PolarHBondContact O-N 2.95Å; E260-R262 VanDerWaalsContact C-N 3.31Å; E260-R262 PolarHBondContact O-N 2.91Å; E260-A263 PolarHBondContact O-N 2.89Å; E260-L264 VanDerWaalsContact O-CB 3.3Å; E260-L264 WeakPolarHBondContact O-CB 3.47Å; E260-L264 VanDerWaalsContact O-CG 3.25Å; E260-L264 WeakPolarHBondContact O-CG 3.32Å; E260-L264 PolarHBondContact O-N 3.04Å
261	L	98.6	Very high	96.9	Very high	0 Å²	0	41 Å²	41	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-61.8	-39	173.5	-69.5	174.7	0	0	0	111.9	M189 I193 G257 Q258 L259 S265 I272 I274 L295 Y308	M189-L261 HydrophobicContact CG-CD2 3.87Å; M189-L261 HydrophobicContact CG-CG 4.36Å; M189-L261 HydrophobicContact SD-CD1 4.42Å; M189-L261 HydrophobicContact SD-CD2 3.77Å; M189-L261 HydrophobicContact SD-CG 3.72Å; I193-L261 HydrophobicContact CD1-CD2 3.72Å; G257-L261 VanDerWaalsContact O-CG 3.26Å; G257-L261 WeakPolarHBondContact O-CG 3.49Å; G257-L261 PolarHBondContact O-N 3.23Å; Q258-L261 PolarHBondContact O-N 3.21Å; L259-L261 VanDerWaalsContact C-N 3.35Å; L259-L261 PolarHBondContact O-N 2.94Å; L261-S265 VanDerWaalsContact O-CB 3.3Å; L261-S265 WeakPolarHBondContact O-CB 3.45Å; L261-S265 PolarHBondContact O-N 3.31Å; L261-I272 HydrophobicContact CD2-CD1 4.06Å; L261-I272 HydrophobicContact CD2-CG2 4.31Å; L261-I274 HydrophobicContact CD1-CD1 3.97Å; L261-I274 HydrophobicContact CD1-CG1 4.03Å; L261-L295 HydrophobicContact CD2-CD1 3.89Å; L261-Y308 HydrophobicContact CD1-CE1 4.17Å
262	R	98.4	Very high	97	Very high	89 Å²	89	35.1 Å²	35.1	34%	0.336	19%	0.185	S	C	.	.	H	α-helix	trans	-62.8	-50.1	174.9	-179.7	64.1	177.7	171.5	11.1	110.8	F224 Q258 L259 E260 L264 S265 H266 V284 E287	F224-R262 HydrophobicContact CE1-CB 4.41Å; F224-R262 HydrophobicContact CE1-CG 4.38Å; Q258-R262 WeakPolarHBondContact O-CB 3.48Å; Q258-R262 PolarHBondContact O-N 3.16Å; L259-R262 WeakPolarHBondContact O-CB 3.34Å; L259-R262 PolarHBondContact O-N 3.29Å; E260-R262 VanDerWaalsContact C-N 3.31Å; E260-R262 PolarHBondContact O-N 2.91Å; R262-L264 PolarHBondContact O-N 3.41Å; R262-S265 WeakPolarHBondContact O-CB 3.5Å; R262-S265 PolarHBondContact O-N 3.39Å; R262-H266 PolarHBondContact NE-NE2 2.97Å; R262-H266 PolarHBondContact NH2-CE1 3.18Å; R262-H266 VanDerWaalsContact NH2-CE1 3.34Å; R262-H266 PolarHBondContact NH2-NE2 2.9Å; R262-H266 PolarHBondContact O-CD2 2.93Å; R262-H266 PolarHBondContact O-N 3.46Å; R262-V284 HydrophobicContact CB-CG1 4.13Å; R262-E287 IonicContact CZ-OE1 3.49Å; R262-E287 IonicContact CZ-OE2 3.97Å; R262-E287 IonicContact NH1-OE1 3.21Å; R262-E287 PolarHBondContact NH1-OE1 3.49Å; R262-E287 IonicContact NH1-OE2 2.67Å; R262-E287 PolarHBondContact NH1-OE2 3.19Å; R262-E287 IonicContact NH2-OE1 3.28Å; R262-E287 PolarHBondContact NH2-OE1 3.4Å; R262-E287 IonicContact NH2-OE2 2.64Å
263	A	98.6	Very high	97.1	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-58.4	-47.9	175.9	0	0	0	0	0	111.9	T213 Y216 M217 F224 L259 E260 S265 H266 I267	T213-A263 HydrophobicContact CG2-CB 4.04Å; Y216-A263 HydrophobicContact CD1-CB 3.76Å; Y216-A263 HydrophobicContact CG-CB 4.38Å; M217-A263 HydrophobicContact CG-CB 3.95Å; F224-A263 HydrophobicContact CE1-CB 4.08Å; F224-A263 HydrophobicContact CZ-CB 3.79Å; L259-A263 PolarHBondContact O-N 3.45Å; E260-A263 PolarHBondContact O-N 2.89Å; A263-S265 VanDerWaalsContact C-N 3.32Å; A263-S265 PolarHBondContact O-N 3.48Å; A263-H266 WeakPolarHBondContact O-CB 3.41Å; A263-H266 PolarHBondContact O-N 3.31Å; A263-H266 VanDerWaalsContact O-N 3.12Å; A263-I267 WeakPolarHBondContact O-CD1 3.05Å; A263-I267 VanDerWaalsContact O-CG1 3.28Å; A263-I267 WeakPolarHBondContact O-CG1 3.26Å; A263-I267 PolarHBondContact O-N 3.41Å
264	L	98.5	Very high	97.3	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-62.4	-37.3	178.8	-75.6	170.7	0	0	0	112.9	M189 Y190 I193 L209 T213 E260 R262 H266 I267 L268 I272	M189-L264 HydrophobicContact CE-CD1 4.12Å; Y190-L264 HydrophobicContact CD1-CD1 4.1Å; Y190-L264 HydrophobicContact CE1-CD1 3.94Å; I193-L264 HydrophobicContact CD1-CD1 3.44Å; I193-L264 VanDerWaalsContact CD1-CD1 3.44Å; L209-L264 HydrophobicContact CB-CD2 4.26Å; L209-L264 HydrophobicContact CD2-CD2 3.83Å; T213-L264 WeakPolarHBondContact OG1-CD2 3.36Å; T213-L264 WeakPolarHBondContact OG1-CG 3.49Å; E260-L264 VanDerWaalsContact O-CB 3.3Å; E260-L264 WeakPolarHBondContact O-CB 3.47Å; E260-L264 VanDerWaalsContact O-CG 3.25Å; E260-L264 WeakPolarHBondContact O-CG 3.32Å; E260-L264 PolarHBondContact O-N 3.04Å; R262-L264 PolarHBondContact O-N 3.41Å; L264-H266 VanDerWaalsContact C-N 3.32Å; L264-H266 PolarHBondContact O-N 3.48Å; L264-I267 HydrophobicContact CD2-CD1 4.23Å; L264-I267 PolarHBondContact O-N 3.47Å; L264-L268 VanDerWaalsContact O-CB 3.28Å; L264-L268 WeakPolarHBondContact O-CB 3.5Å; L264-L268 WeakPolarHBondContact O-CG 3.47Å; L264-L268 PolarHBondContact O-N 2.95Å; L264-I272 HydrophobicContact CB-CD1 4.26Å
265	S	98.4	Very high	97.6	Very high	0 Å²	0	30 Å²	30	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-61.2	-42.1	174.3	-173.5	0	0	0	0	111.6	L261 R262 A263 Q269 T270 V284 G285 Y288	L261-S265 VanDerWaalsContact O-CB 3.3Å; L261-S265 WeakPolarHBondContact O-CB 3.45Å; L261-S265 PolarHBondContact O-N 3.31Å; R262-S265 WeakPolarHBondContact O-CB 3.5Å; R262-S265 PolarHBondContact O-N 3.39Å; A263-S265 VanDerWaalsContact C-N 3.32Å; A263-S265 PolarHBondContact O-N 3.48Å; S265-Q269 VanDerWaalsContact O-CA 3.3Å; S265-Q269 WeakPolarHBondContact O-CA 3.36Å; S265-Q269 PolarHBondContact O-N 2.8Å; S265-T270 PolarHBondContact O-N 3.05Å; S265-T270 PolarHBondContact OG-O 3.17Å; S265-V284 PolarHBondContact OG-O 3.02Å; S265-V284 VanDerWaalsContact OG-O 3.06Å; S265-G285 VanDerWaalsContact OG-CA 3.25Å; S265-G285 WeakPolarHBondContact OG-CA 3.21Å; S265-Y288 VanDerWaalsContact O-CE2 3.28Å; S265-Y288 WeakPolarHBondContact O-CE2 3.5Å
266	H	98.3	Very high	97.7	Very high	28 Å²	28	24.9 Å²	24.9	13%	0.13	13%	0.125	C	C	.	.	H	α-helix	trans	-65	-46.6	172.3	-71.2	-74.6	0	0	0	112.9	Y216 R262 A263 L264 L268 Q269 E287 Y288	Y216-H266 HydrophobicContact CD2-CB 4.45Å; Y216-H266 HydrophobicContact CE1-CB 3.94Å; Y216-H266 AromaticContact CE1-CD2 3.99Å; Y216-H266 HydrophobicContact CE2-CB 3.62Å; Y216-H266 AromaticContact CZ-CD2 3.94Å; Y216-H266 AromaticContact CZ-CG 3.67Å; Y216-H266 VanDerWaalsContact OH-CB 3.26Å; Y216-H266 WeakPolarHBondContact OH-CB 3.39Å; Y216-H266 PolarHBondContact OH-CD2 3.48Å; Y216-H266 PolarHBondContact OH-ND1 2.98Å; R262-H266 PolarHBondContact NE-NE2 2.97Å; R262-H266 PolarHBondContact NH2-CE1 3.18Å; R262-H266 VanDerWaalsContact NH2-CE1 3.34Å; R262-H266 PolarHBondContact NH2-NE2 2.9Å; R262-H266 PolarHBondContact O-CD2 2.93Å; R262-H266 PolarHBondContact O-N 3.46Å; A263-H266 WeakPolarHBondContact O-CB 3.41Å; A263-H266 PolarHBondContact O-N 3.31Å; A263-H266 VanDerWaalsContact O-N 3.12Å; L264-H266 VanDerWaalsContact C-N 3.32Å; L264-H266 PolarHBondContact O-N 3.48Å; H266-L268 VanDerWaalsContact C-N 3.34Å; H266-L268 PolarHBondContact O-N 3.36Å; H266-Q269 WeakPolarHBondContact O-CG 3.43Å; H266-Q269 PolarHBondContact O-N 2.94Å; H266-Q269 PolarHBondContact O-NE2 3.36Å; H266-E287 IonicContact CE1-OE1 3.63Å; H266-E287 PolarHBondContact CE1-OE1 2.89Å; H266-E287 IonicContact ND1-OE1 3Å; H266-E287 IonicContact NE2-OE1 2.67Å; H266-Y288 WeakPolarHBondContact CA-OH 3.5Å; H266-Y288 AromaticContact ND1-CZ 3.84Å; H266-Y288 PolarHBondContact ND1-OH 3.42Å
267	I	97.4	Very high	97.7	Very high	42 Å²	42	24.9 Å²	24.9	22%	0.215	12%	0.124	C	C	.	.	H	α-helix	trans	-59.7	-45.8	179.8	-66.5	156.1	0	0	0	111.1	Q212 Y216 A263 L264 Q269	Q212-I267 HydrophobicContact CB-CD1 3.99Å; Q212-I267 HydrophobicContact CB-CG2 4.2Å; Q212-I267 WeakPolarHBondContact O-CD1 3.33Å; Y216-I267 HydrophobicContact CD2-CG1 3.83Å; Y216-I267 HydrophobicContact CG-CD1 4.24Å; Y216-I267 HydrophobicContact CG-CG1 3.98Å; A263-I267 WeakPolarHBondContact O-CD1 3.05Å; A263-I267 VanDerWaalsContact O-CG1 3.28Å; A263-I267 WeakPolarHBondContact O-CG1 3.26Å; A263-I267 PolarHBondContact O-N 3.41Å; L264-I267 HydrophobicContact CD2-CD1 4.23Å; L264-I267 PolarHBondContact O-N 3.47Å; I267-Q269 VanDerWaalsContact C-N 3.31Å
268	L	96.8	Very high	97.4	Very high	18 Å²	18	28.8 Å²	28.8	9%	0.094	14%	0.141	C	C	.	.	H	α-helix	trans	-82.5	-11.4	-177.6	-59.6	172.4	0	0	0	112.6	I193 L197 L204 L264 H266 T270 K290 L293	I193-L268 HydrophobicContact CG2-CD1 4.1Å; L197-L268 HydrophobicContact CD1-CD1 4.21Å; L197-L268 HydrophobicContact CD1-CD2 4.08Å; L197-L268 HydrophobicContact CD2-CD1 4.34Å; L197-L268 HydrophobicContact CD2-CD2 4.31Å; L204-L268 HydrophobicContact CD1-CD2 3.57Å; L264-L268 VanDerWaalsContact O-CB 3.28Å; L264-L268 WeakPolarHBondContact O-CB 3.5Å; L264-L268 WeakPolarHBondContact O-CG 3.47Å; L264-L268 PolarHBondContact O-N 2.95Å; H266-L268 VanDerWaalsContact C-N 3.34Å; H266-L268 PolarHBondContact O-N 3.36Å; L268-T270 PolarHBondContact O-N 3.47Å; L268-T270 PolarHBondContact O-OG1 2.83Å; L268-K290 PolarHBondContact O-NZ 3.2Å; L268-L293 HydrophobicContact CD1-CD1 3.81Å
269	Q	97.3	Very high	97.3	Very high	95 Å²	95	27 Å²	27	44%	0.444	14%	0.139	S	C	.	.	T	Hydrogen-bonded Turn	trans	49	44.2	-172.6	-62.3	-78.1	-62.8	0	0	110.6	S265 H266 I267 Y288 K290	S265-Q269 VanDerWaalsContact O-CA 3.3Å; S265-Q269 WeakPolarHBondContact O-CA 3.36Å; S265-Q269 PolarHBondContact O-N 2.8Å; H266-Q269 WeakPolarHBondContact O-CG 3.43Å; H266-Q269 PolarHBondContact O-N 2.94Å; H266-Q269 PolarHBondContact O-NE2 3.36Å; I267-Q269 VanDerWaalsContact C-N 3.31Å; Q269-Y288 HydrophobicContact CB-CD1 4.13Å; Q269-Y288 HydrophobicContact CB-CE1 4.14Å; Q269-Y288 HydrophobicContact CG-CE1 4.34Å; Q269-Y288 PolarHBondContact NE2-OH 3.03Å; Q269-K290 WeakPolarHBondContact O-CD 3.45Å; Q269-K290 WeakPolarHBondContact O-CE 3.28Å; Q269-K290 PolarHBondContact O-NZ 3.49Å
270	T	97.1	Very high	97.2	Very high	11 Å²	11	30.5 Å²	30.5	7%	0.067	16%	0.163	C	C	.	.	S	Bend	trans	-144.5	131.6	-170.2	-55.1	0	0	0	0	109.7	S265 L268 K290 K291 L293	S265-T270 PolarHBondContact O-N 3.05Å; S265-T270 PolarHBondContact OG-O 3.17Å; L268-T270 PolarHBondContact O-N 3.47Å; L268-T270 PolarHBondContact O-OG1 2.83Å; T270-K290 HydrophobicContact CG2-CB 4.08Å; T270-K290 WeakPolarHBondContact OG1-CD 3.35Å; T270-K291 WeakPolarHBondContact CG2-O 3.39Å; T270-L293 HydrophobicContact CG2-CG 4.19Å
271	P	98.3	Very high	97.1	Very high	9 Å²	9	32.5 Å²	32.5	6%	0.058	18%	0.177	C	C	.	.			trans	-63.4	149.3	175.6	-16.6	30.3	0	0	0	111.7	I283 V284 Y288 K290 P292 L293	P271-I283 HydrophobicContact CB-CG2 4.29Å; P271-V284 CarbonylContact C-O 3.46Å; P271-V284 WeakPolarHBondContact CA-O 3.44Å; P271-Y288 WeakPolarHBondContact CG-O 3.33Å; P271-K290 WeakPolarHBondContact CD-O 3.33Å; P271-P292 HydrophobicContact CB-CB 4.19Å; P271-P292 CarbonylContact O-C 3.35Å; P271-P292 WeakPolarHBondContact O-CA 3.41Å; P271-L293 PolarHBondContact O-N 3.37Å
272	I	98.6	Very high	97.1	Very high	0 Å²	0	36 Å²	36	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	117.1	173	-52.5	178.7	0	0	0	107.6	I193 L261 L264 I274 I283 V284 L293 L295	I193-I272 HydrophobicContact CD1-CD1 4.26Å; L261-I272 HydrophobicContact CD2-CD1 4.06Å; L261-I272 HydrophobicContact CD2-CG2 4.31Å; L264-I272 HydrophobicContact CB-CD1 4.26Å; I272-I274 HydrophobicContact CG2-CD1 4.28Å; I272-I274 HydrophobicContact CG2-CG1 4.41Å; I272-I283 WeakPolarHBondContact O-CA 3.46Å; I272-V284 PolarHBondContact N-O 3.31Å; I272-V284 PolarHBondContact O-N 2.96Å; I272-L293 CarbonylContact C-O 3.14Å; I272-L293 WeakPolarHBondContact CA-O 3.15Å; I272-L293 HydrophobicContact CG1-CD1 4.44Å; I272-L295 HydrophobicContact CG2-CD1 3.76Å; I272-L295 HydrophobicContact CG2-CG 3.97Å
273	E	98.4	Very high	97.1	Very high	26 Å²	26	35.3 Å²	35.3	12%	0.121	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	124.1	174.4	-175.6	-178.6	-167.1	0	0	109.4	R175 I275 P281 I282 I283 P292 L293 I294 L295	R175-E273 IonicContact CZ-OE1 3.05Å; R175-E273 VanDerWaalsContact NH1-CD 3.3Å; R175-E273 IonicContact NH1-OE1 3.33Å; R175-E273 PolarHBondContact NH1-OE1 2.84Å; R175-E273 IonicContact NH1-OE2 3.74Å; R175-E273 PolarHBondContact NH1-OE2 3.09Å; R175-E273 IonicContact NH2-OE1 2.8Å; R175-E273 PolarHBondContact NH2-OE1 3.49Å; E273-I275 HydrophobicContact CG-CG1 4.49Å; E273-P281 HydrophobicContact CG-CB 3.89Å; E273-P281 WeakPolarHBondContact OE1-CB 3.45Å; E273-I282 CarbonylContact C-O 3.35Å; E273-I282 WeakPolarHBondContact CA-O 3.27Å; E273-I283 HydrophobicContact CG-CG1 4.26Å; E273-P292 HydrophobicContact CB-CB 4.28Å; E273-L293 PolarHBondContact N-O 3.02Å; E273-I294 WeakPolarHBondContact O-CA 3.4Å; E273-L295 PolarHBondContact O-N 3.36Å
274	I	98.4	Very high	97	Very high	6 Å²	6	35.5 Å²	35.5	3%	0.031	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	111.5	178.1	-54.5	98	0	0	0	109	L261 I272 P281 I282 V284 Y308	L261-I274 HydrophobicContact CD1-CD1 3.97Å; L261-I274 HydrophobicContact CD1-CG1 4.03Å; I272-I274 HydrophobicContact CG2-CD1 4.28Å; I272-I274 HydrophobicContact CG2-CG1 4.41Å; I274-P281 CarbonylContact O-C 3.55Å; I274-P281 VanDerWaalsContact O-CA 3.23Å; I274-P281 WeakPolarHBondContact O-CA 3.33Å; I274-I282 HydrophobicContact CB-CB 4.5Å; I274-I282 HydrophobicContact CD1-CB 4.42Å; I274-I282 HydrophobicContact CD1-CG2 4.36Å; I274-I282 PolarHBondContact N-O 3.27Å; I274-I282 PolarHBondContact O-N 2.91Å; I274-V284 HydrophobicContact CD1-CG2 3.72Å; I274-Y308 HydrophobicContact CG2-CE1 4.13Å
275	I	98.3	Very high	97	Very high	1 Å²	1	35.6 Å²	35.6	1%	0.005	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	132.7	176.9	-60	174	0	0	0	109.2	L168 I171 L172 E273 P281 I294 L295 V296 Y297	L168-I275 HydrophobicContact CD2-CG2 3.95Å; I171-I275 HydrophobicContact CG2-CG2 3.73Å; L172-I275 HydrophobicContact CD2-CD1 3.64Å; E273-I275 HydrophobicContact CG-CG1 4.49Å; I275-P281 HydrophobicContact CG1-CB 4.41Å; I275-P281 HydrophobicContact CG1-CG 4.46Å; I275-I294 HydrophobicContact CD1-CG2 3.62Å; I275-I294 HydrophobicContact CG1-CG2 4.23Å; I275-L295 PolarHBondContact N-O 3.5Å; I275-V296 CarbonylContact O-C 3.09Å; I275-V296 WeakPolarHBondContact O-CA 3.09Å; I275-Y297 PolarHBondContact O-N 3.42Å
276	Q	96.5	Very high	96.9	Very high	29 Å²	29	42.4 Å²	42.4	14%	0.136	23%	0.231	C	C	.	.			trans	-136	159.1	179.1	59	-174.4	-52.3	0	0	110.2	S279 P280 I282 Y297	Q276-S279 WeakPolarHBondContact CG-O 3.44Å; Q276-P280 PolarHBondContact NE2-O 2.94Å; Q276-I282 VanDerWaalsContact NE2-CD1 3.28Å; Q276-Y297 HydrophobicContact CB-CD1 4.37Å
277	A	95	Very high	96.9	Very high	15 Å²	15	45.8 Å²	45.8	12%	0.124	25%	0.247	C	C	.	.	S	Bend	trans	-72.6	-40.2	-169.6	0	0	0	0	0	114.4	E164 K167 L168	E164-A277 HydrophobicContact CB-CB 4.45Å; E164-A277 HydrophobicContact CG-CB 3.71Å; K167-A277 HydrophobicContact CB-CB 4.05Å; K167-A277 HydrophobicContact CD-CB 4.18Å; L168-A277 HydrophobicContact CD2-CB 4.38Å; L168-A277 HydrophobicContact CG-CB 4.02Å
278	D	91.1	Very high	96.9	Very high	101 Å²	101	45.6 Å²	45.6	54%	0.54	24%	0.243	S	C	.	.	S	Bend	trans	-108.2	-1.5	-166.1	-64.3	-47.4	0	0	0	114.2	K167	K167-D278 IonicContact NZ-OD1 3.55Å; K167-D278 PolarHBondContact NZ-OD1 3.44Å
279	S	93.3	Very high	96.8	Very high	61 Å²	61	50.7 Å²	50.7	43%	0.427	28%	0.281	S	S	.	.	S	Bend	trans	-138.4	159	-179.2	-55.5	0	0	0	0	110.9	Q276	Q276-S279 WeakPolarHBondContact CG-O 3.44Å
280	P	95.6	Very high	96.7	Very high	105 Å²	105	51.5 Å²	51.5	68%	0.682	28%	0.283	S	S	*	.	P	Polyproline II helix	trans	-53.3	152.7	170.8	-25.6	35.1	0	0	0	112.4	Q276 I282	Q276-P280 PolarHBondContact NE2-O 2.94Å; P280-I282 PolarHBondContact O-N 2.95Å
281	P	96.8	Very high	96.6	Very high	46 Å²	46	58.1 Å²	58.1	30%	0.299	31%	0.311	S	S	.	.	P	Polyproline II helix	trans	-56.7	138.3	172.8	-20.3	30	0	0	0	111.2	E273 I274 I275	E273-P281 HydrophobicContact CG-CB 3.89Å; E273-P281 WeakPolarHBondContact OE1-CB 3.45Å; I274-P281 CarbonylContact O-C 3.55Å; I274-P281 VanDerWaalsContact O-CA 3.23Å; I274-P281 WeakPolarHBondContact O-CA 3.33Å; I275-P281 HydrophobicContact CG1-CB 4.41Å; I275-P281 HydrophobicContact CG1-CG 4.46Å
282	I	97.5	Very high	96.5	Very high	73 Å²	73	59.7 Å²	59.7	37%	0.374	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	133	173.5	-64.3	169	0	0	0	107.5	E273 I274 Q276 P280 V284	E273-I282 CarbonylContact C-O 3.35Å; E273-I282 WeakPolarHBondContact CA-O 3.27Å; I274-I282 HydrophobicContact CB-CB 4.5Å; I274-I282 HydrophobicContact CD1-CB 4.42Å; I274-I282 HydrophobicContact CD1-CG2 4.36Å; I274-I282 PolarHBondContact N-O 3.27Å; I274-I282 PolarHBondContact O-N 2.91Å; Q276-I282 VanDerWaalsContact NE2-CD1 3.28Å; P280-I282 PolarHBondContact O-N 2.95Å; I282-V284 HydrophobicContact CG2-CG2 4.22Å
283	I	98.1	Very high	96.5	Very high	75 Å²	75	59.7 Å²	59.7	39%	0.385	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	125.1	176	-54.2	176	0	0	0	108.5	P271 I272 E273 E286	P271-I283 HydrophobicContact CB-CG2 4.29Å; I272-I283 WeakPolarHBondContact O-CA 3.46Å; E273-I283 HydrophobicContact CG-CG1 4.26Å; I283-E286 HydrophobicContact CB-CG 3.97Å; I283-E286 HydrophobicContact CG2-CG 3.67Å
284	V	98.3	Very high	96.5	Very high	4 Å²	4	59.5 Å²	59.5	2%	0.024	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	123.2	177.8	-177.3	0	0	0	0	109.2	R262 S265 P271 I272 I274 I282	R262-V284 HydrophobicContact CB-CG1 4.13Å; S265-V284 PolarHBondContact OG-O 3.02Å; S265-V284 VanDerWaalsContact OG-O 3.06Å; P271-V284 CarbonylContact C-O 3.46Å; P271-V284 WeakPolarHBondContact CA-O 3.44Å; I272-V284 PolarHBondContact N-O 3.31Å; I272-V284 PolarHBondContact O-N 2.96Å; I274-V284 HydrophobicContact CD1-CG2 3.72Å; I282-V284 HydrophobicContact CG2-CG2 4.22Å
285	G	97.5	Very high	96.5	Very high	2 Å²	2	59.2 Å²	59.2	2%	0.021	32%	0.319	C	S	.	.			trans	86.8	42.2	-177.8	0	0	0	0	0	113.6	S265 E287 Y288	S265-G285 VanDerWaalsContact OG-CA 3.25Å; S265-G285 WeakPolarHBondContact OG-CA 3.21Å; G285-E287 WeakPolarHBondContact CA-OE2 3.45Å; G285-E287 PolarHBondContact O-N 2.91Å; G285-E287 VanDerWaalsContact O-N 3.12Å; G285-Y288 WeakPolarHBondContact O-CD2 3.38Å; G285-Y288 PolarHBondContact O-N 3.29Å
286	E	97	Very high	96.4	Very high	144 Å²	144	59.1 Å²	59.1	67%	0.673	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59	-18.5	176.8	-65.5	-175.9	-177.1	0	0	112.6	I283 Y288	I283-E286 HydrophobicContact CB-CG 3.97Å; I283-E286 HydrophobicContact CG2-CG 3.67Å; E286-Y288 PolarHBondContact O-N 3.32Å
287	E	97.2	Very high	96.5	Very high	98 Å²	98	59.2 Å²	59.2	46%	0.458	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-15.9	172	60.2	-99.3	-127.7	0	0	114.3	R262 H266 G285	R262-E287 IonicContact CZ-OE1 3.49Å; R262-E287 IonicContact CZ-OE2 3.97Å; R262-E287 IonicContact NH1-OE1 3.21Å; R262-E287 PolarHBondContact NH1-OE1 3.49Å; R262-E287 IonicContact NH1-OE2 2.67Å; R262-E287 PolarHBondContact NH1-OE2 3.19Å; R262-E287 IonicContact NH2-OE1 3.28Å; R262-E287 PolarHBondContact NH2-OE1 3.4Å; R262-E287 IonicContact NH2-OE2 2.64Å; H266-E287 IonicContact CE1-OE1 3.63Å; H266-E287 PolarHBondContact CE1-OE1 2.89Å; H266-E287 IonicContact ND1-OE1 3Å; H266-E287 IonicContact NE2-OE1 2.67Å; G285-E287 WeakPolarHBondContact CA-OE2 3.45Å; G285-E287 PolarHBondContact O-N 2.91Å; G285-E287 VanDerWaalsContact O-N 3.12Å
288	Y	97.5	Very high	96.5	Very high	38 Å²	38	58.7 Å²	58.7	15%	0.149	31%	0.313	C	S	.	.			trans	-98.6	143	179.9	-57.4	-60.2	0	0	0	112.2	S265 H266 Q269 P271 G285 E286	S265-Y288 VanDerWaalsContact O-CE2 3.28Å; S265-Y288 WeakPolarHBondContact O-CE2 3.5Å; H266-Y288 WeakPolarHBondContact CA-OH 3.5Å; H266-Y288 AromaticContact ND1-CZ 3.84Å; H266-Y288 PolarHBondContact ND1-OH 3.42Å; Q269-Y288 HydrophobicContact CB-CD1 4.13Å; Q269-Y288 HydrophobicContact CB-CE1 4.14Å; Q269-Y288 HydrophobicContact CG-CE1 4.34Å; Q269-Y288 PolarHBondContact NE2-OH 3.03Å; P271-Y288 WeakPolarHBondContact CG-O 3.33Å; G285-Y288 WeakPolarHBondContact O-CD2 3.38Å; G285-Y288 PolarHBondContact O-N 3.29Å; E286-Y288 PolarHBondContact O-N 3.32Å
289	S	95.1	Very high	96.6	Very high	126 Å²	126	60.3 Å²	60.3	88%	0.881	31%	0.312	S	S	*	.			trans	-101.6	-3.1	-176.2	57.6	0	0	0	0	114.6
290	K	95.1	Very high	96.4	Very high	111 Å²	111	61.3 Å²	61.3	48%	0.483	31%	0.309	S	S	.	.	S	Bend	trans	-65.7	156.2	177.3	-64.5	-172.6	-162.3	162.7	0	110.5	L268 Q269 T270 P271	L268-K290 PolarHBondContact O-NZ 3.2Å; Q269-K290 WeakPolarHBondContact O-CD 3.45Å; Q269-K290 WeakPolarHBondContact O-CE 3.28Å; Q269-K290 PolarHBondContact O-NZ 3.49Å; T270-K290 HydrophobicContact CG2-CB 4.08Å; T270-K290 WeakPolarHBondContact OG1-CD 3.35Å; P271-K290 WeakPolarHBondContact CD-O 3.33Å
291	K	94.5	Very high	95.7	Very high	150 Å²	150	56.5 Å²	56.5	65%	0.652	28%	0.278	S	S	*	.	P	Polyproline II helix	trans	-56.5	128.7	172.9	-175.5	-178.9	179.2	-176.1	0	109.6	K200 T270	K200-K291 PolarHBondContact NZ-O 3.28Å; T270-K291 WeakPolarHBondContact CG2-O 3.39Å
292	P	96.9	Very high	94.9	Very high	42 Å²	42	57.9 Å²	57.9	27%	0.273	28%	0.278	S	S	.	.	P	Polyproline II helix	trans	-61.4	155	-175.5	22.1	-32.7	0	0	0	112.7	K200 P271 E273	K200-P292 PolarHBondContact NZ-O 3.1Å; P271-P292 HydrophobicContact CB-CB 4.19Å; P271-P292 CarbonylContact O-C 3.35Å; P271-P292 WeakPolarHBondContact O-CA 3.41Å; E273-P292 HydrophobicContact CB-CB 4.28Å
293	L	97.8	Very high	93.6	Very high	0 Å²	0	58.8 Å²	58.8	0%	0	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	136.7	156.6	-58.2	172.8	0	0	0	107.4	I193 Q196 L197 K200 L268 T270 P271 I272 E273	I193-L293 HydrophobicContact CG2-CD1 4.18Å; Q196-L293 HydrophobicContact CB-CB 4.28Å; Q196-L293 HydrophobicContact CB-CD2 3.68Å; Q196-L293 HydrophobicContact CB-CG 4.48Å; L197-L293 HydrophobicContact CD2-CD1 4.14Å; L197-L293 HydrophobicContact CD2-CD2 4.06Å; L197-L293 HydrophobicContact CG-CD1 4.42Å; L197-L293 HydrophobicContact CG-CD2 4.5Å; K200-L293 HydrophobicContact CD-CD2 3.86Å; L268-L293 HydrophobicContact CD1-CD1 3.81Å; T270-L293 HydrophobicContact CG2-CG 4.19Å; P271-L293 PolarHBondContact O-N 3.37Å; I272-L293 CarbonylContact C-O 3.14Å; I272-L293 WeakPolarHBondContact CA-O 3.15Å; I272-L293 HydrophobicContact CG1-CD1 4.44Å; E273-L293 PolarHBondContact N-O 3.02Å
294	I	98.3	Very high	92.2	Very high	22 Å²	22	62 Å²	62	11%	0.113	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	121.8	-176.5	-56.5	174.5	0	0	0	108.7	L177 Q196 E273 I275 V311	L177-I294 HydrophobicContact CD1-CD1 3.87Å; L177-I294 HydrophobicContact CD1-CG2 4.48Å; Q196-I294 VanDerWaalsContact CD-O 3.31Å; Q196-I294 VanDerWaalsContact OE1-N 3.13Å; Q196-I294 PolarHBondContact OE1-O 3.36Å; E273-I294 WeakPolarHBondContact O-CA 3.4Å; I275-I294 HydrophobicContact CD1-CG2 3.62Å; I275-I294 HydrophobicContact CG1-CG2 4.23Å; I294-V311 HydrophobicContact CB-CG2 3.69Å; I294-V311 HydrophobicContact CG2-CG1 3.95Å; I294-V311 HydrophobicContact CG2-CG2 3.86Å
295	L	98.4	Very high	91.5	Very high	0 Å²	0	62.6 Å²	62.6	0%	0	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	153.5	176.4	-53.8	-176.6	0	0	0	109.7	A192 I193 Q196 L261 I272 E273 I275 Y308	A192-L295 HydrophobicContact CB-CD2 3.69Å; I193-L295 HydrophobicContact CD1-CD1 4.32Å; I193-L295 HydrophobicContact CG1-CD1 3.92Å; I193-L295 HydrophobicContact CG1-CD2 4.16Å; Q196-L295 HydrophobicContact CG-CD2 4.18Å; L261-L295 HydrophobicContact CD2-CD1 3.89Å; I272-L295 HydrophobicContact CG2-CD1 3.76Å; I272-L295 HydrophobicContact CG2-CG 3.97Å; E273-L295 PolarHBondContact O-N 3.36Å; I275-L295 PolarHBondContact N-O 3.5Å; L295-Y308 HydrophobicContact CB-CD1 4.39Å; L295-Y308 HydrophobicContact CD1-CD1 4.29Å
296	V	98.1	Very high	91.3	Very high	0 Å²	0	67 Å²	67	0%	0	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	123.1	171.7	175.8	0	0	0	0	108.3	L168 L172 I179 I275 M298 Y308 N309 V311	L168-V296 HydrophobicContact CD1-CG1 3.71Å; L168-V296 HydrophobicContact CD2-CG1 3.93Å; L168-V296 HydrophobicContact CG-CG1 4.32Å; L172-V296 HydrophobicContact CD1-CG2 3.81Å; L172-V296 HydrophobicContact CD2-CG2 4.06Å; L172-V296 HydrophobicContact CG-CG2 4.49Å; I179-V296 HydrophobicContact CD1-CG1 4.16Å; I179-V296 HydrophobicContact CG1-CG1 4.36Å; I179-V296 HydrophobicContact CG1-CG2 4.41Å; I275-V296 CarbonylContact O-C 3.09Å; I275-V296 WeakPolarHBondContact O-CA 3.09Å; V296-M298 HydrophobicContact CG1-CG 4.11Å; V296-Y308 CarbonylContact O-C 3.59Å; V296-Y308 WeakPolarHBondContact O-CA 3.3Å; V296-N309 HydrophobicContact CB-CB 4.32Å; V296-N309 PolarHBondContact N-O 3.43Å; V296-N309 PolarHBondContact O-N 3.48Å; V296-V311 HydrophobicContact CG2-CG1 3.51Å
297	Y	97.4	Very high	91.2	Very high	30 Å²	30	60.4 Å²	60.4	12%	0.118	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	127.3	175.5	176	-102	0	0	0	110	I275 Q276 R299 E306 Y308	I275-Y297 PolarHBondContact O-N 3.42Å; Q276-Y297 HydrophobicContact CB-CD1 4.37Å; Y297-R299 HydrophobicContact CD1-CG 4.32Å; Y297-R299 HydrophobicContact CE1-CG 3.61Å; Y297-E306 HydrophobicContact CE2-CB 3.99Å; Y297-E306 HydrophobicContact CE2-CG 4.38Å; Y297-E306 VanDerWaalsContact OH-CG 3.3Å; Y297-E306 WeakPolarHBondContact OH-CG 3.41Å; Y297-E306 PolarHBondContact OH-OE1 3.38Å; Y297-E306 VanDerWaalsContact OH-OE1 3.1Å; Y297-E306 PolarHBondContact OH-OE2 3.01Å; Y297-Y308 HydrophobicContact CD2-CD1 4.19Å; Y297-Y308 HydrophobicContact CD2-CD2 4.25Å; Y297-Y308 AromaticContact CD2-CE1 3.74Å; Y297-Y308 HydrophobicContact CD2-CE1 3.74Å; Y297-Y308 AromaticContact CD2-CE2 3.81Å; Y297-Y308 HydrophobicContact CD2-CE2 3.81Å; Y297-Y308 HydrophobicContact CD2-CG 4.44Å; Y297-Y308 AromaticContact CD2-CZ 3.52Å; Y297-Y308 HydrophobicContact CE2-CE2 4.1Å; Y297-Y308 HydrophobicContact CG-CE1 4.3Å
298	M	95.2	Very high	91.2	Very high	5 Å²	5	57 Å²	57	3%	0.025	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	125.7	-179.1	-64.2	-173.8	73.2	0	0	109.3	E164 S165 L168 I179 V296 A301 E306 H307	E164-M298 HydrophobicContact CG-CE 4.46Å; S165-M298 WeakPolarHBondContact OG-CE 3.48Å; L168-M298 HydrophobicContact CD1-CE 4.23Å; L168-M298 HydrophobicContact CD1-CG 3.56Å; L168-M298 HydrophobicContact CD1-SD 4.26Å; I179-M298 HydrophobicContact CD1-SD 4.36Å; V296-M298 HydrophobicContact CG1-CG 4.11Å; M298-A301 HydrophobicContact CB-CB 3.62Å; M298-A301 HydrophobicContact CE-CB 4.2Å; M298-A301 HydrophobicContact CG-CB 4.41Å; M298-A301 HydrophobicContact SD-CB 4.01Å; M298-E306 CarbonylContact O-C 3.51Å; M298-E306 VanDerWaalsContact O-CA 3.25Å; M298-E306 WeakPolarHBondContact O-CA 3.27Å; M298-H307 PolarHBondContact N-O 2.92Å; M298-H307 PolarHBondContact O-N 2.95Å
299	R	92.5	Very high	91.2	Very high	135 Å²	135	55.2 Å²	55.2	51%	0.509	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	-22.6	178.5	-60.1	-175.4	71.4	157.1	4.4	112.8	E164 Y297 G305	E164-R299 WeakPolarHBondContact OE1-CB 3.23Å; E164-R299 PolarHBondContact OE1-N 2.85Å; E164-R299 PolarHBondContact OE2-N 3.44Å; Y297-R299 HydrophobicContact CD1-CG 4.32Å; Y297-R299 HydrophobicContact CE1-CG 3.61Å; R299-G305 CarbonylContact C-O 3.45Å; R299-G305 CarbonylContact O-C 3.56Å; R299-G305 WeakPolarHBondContact O-CA 3.45Å
300	H	89.6	Confident	91.4	Very high	82 Å²	82	49.2 Å²	49.2	38%	0.38	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	19	-172.5	-56.1	-57.6	0	0	0	112.5	A160 R161 E164 Y302	A160-H300 HydrophobicContact CB-CB 4.37Å; R161-H300 HydrophobicContact CB-CB 4.32Å; R161-H300 VanDerWaalsContact CB-O 3.23Å; R161-H300 WeakPolarHBondContact CB-O 3.3Å; R161-H300 WeakPolarHBondContact CG-O 3.49Å; E164-H300 WeakPolarHBondContact OE2-CA 3.38Å; E164-H300 WeakPolarHBondContact OE2-CB 3.25Å; E164-H300 PolarHBondContact OE2-N 2.92Å; H300-Y302 VanDerWaalsContact C-N 3.31Å; H300-Y302 PolarHBondContact O-N 3.16Å
301	A	80.6	Confident	91.5	Very high	3 Å²	3	44.1 Å²	44.1	3%	0.025	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-60.7	-38.2	-177.1	0	0	0	0	0	113.2	R161 M298 G305 H307	R161-A301 WeakPolarHBondContact CD-O 3.3Å; R161-A301 PolarHBondContact NE-O 3.31Å; R161-A301 PolarHBondContact NH2-O 3.4Å; M298-A301 HydrophobicContact CB-CB 3.62Å; M298-A301 HydrophobicContact CE-CB 4.2Å; M298-A301 HydrophobicContact CG-CB 4.41Å; M298-A301 HydrophobicContact SD-CB 4.01Å; A301-G305 PolarHBondContact N-O 3.11Å; A301-H307 HydrophobicContact CB-CB 3.73Å
302	Y	80	Confident	91.5	Very high	75 Å²	75	38.8 Å²	38.8	29%	0.294	21%	0.211	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	173	-176.4	-60.9	-74.8	0	0	0	111.8	H300 L304 G305 H307	H300-Y302 VanDerWaalsContact C-N 3.31Å; H300-Y302 PolarHBondContact O-N 3.16Å; Y302-L304 PolarHBondContact O-N 3.09Å; Y302-L304 VanDerWaalsContact O-N 3.16Å; Y302-G305 PolarHBondContact N-O 3.24Å; Y302-G305 WeakPolarHBondContact O-CA 3.36Å; Y302-G305 PolarHBondContact O-N 3.06Å; Y302-H307 HydrophobicContact CD2-CB 3.94Å; Y302-H307 AromaticContact CD2-CG 3.88Å; Y302-H307 HydrophobicContact CE2-CB 4.04Å; Y302-H307 AromaticContact CE2-CD2 3.64Å; Y302-H307 AromaticContact CE2-CE1 3.77Å; Y302-H307 AromaticContact CE2-CG 3.52Å; Y302-H307 AromaticContact CE2-ND1 3.64Å; Y302-H307 AromaticContact CE2-NE2 3.78Å
303	G	70.1	Confident	91.4	Very high	92 Å²	92	45.5 Å²	45.5	95%	0.948	23%	0.231	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.5	-23.7	178.2	0	0	0	0	0	114.2	G305	G303-G305 VanDerWaalsContact C-N 3.31Å
304	L	69.8	Low	91.1	Very high	143 Å²	143	48.3 Å²	48.3	75%	0.749	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88	1.9	173	-64.1	174.6	0	0	0	113.2	W255 Y302 E306	W255-L304 HydrophobicContact CH2-CB 3.98Å; W255-L304 HydrophobicContact CZ2-CB 4.27Å; W255-L304 HydrophobicContact CZ2-CD1 4.33Å; Y302-L304 PolarHBondContact O-N 3.09Å; Y302-L304 VanDerWaalsContact O-N 3.16Å; L304-E306 PolarHBondContact O-N 2.69Å
305	G	83.4	Confident	90.3	Very high	17 Å²	17	52.3 Å²	52.3	18%	0.175	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	88.5	-99	175.4	0	0	0	0	0	113.5	R299 A301 Y302 G303	R299-G305 CarbonylContact C-O 3.45Å; R299-G305 CarbonylContact O-C 3.56Å; R299-G305 WeakPolarHBondContact O-CA 3.45Å; A301-G305 PolarHBondContact N-O 3.11Å; Y302-G305 PolarHBondContact N-O 3.24Å; Y302-G305 WeakPolarHBondContact O-CA 3.36Å; Y302-G305 PolarHBondContact O-N 3.06Å; G303-G305 VanDerWaalsContact C-N 3.31Å
306	E	91.9	Very high	88.7	Confident	94 Å²	94	58 Å²	58	44%	0.439	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	137.7	-161	-55.7	-174.2	179.1	0	0	113.6	Y297 M298 L304	Y297-E306 HydrophobicContact CE2-CB 3.99Å; Y297-E306 HydrophobicContact CE2-CG 4.38Å; Y297-E306 VanDerWaalsContact OH-CG 3.3Å; Y297-E306 WeakPolarHBondContact OH-CG 3.41Å; Y297-E306 PolarHBondContact OH-OE1 3.38Å; Y297-E306 VanDerWaalsContact OH-OE1 3.1Å; Y297-E306 PolarHBondContact OH-OE2 3.01Å; M298-E306 CarbonylContact O-C 3.51Å; M298-E306 VanDerWaalsContact O-CA 3.25Å; M298-E306 WeakPolarHBondContact O-CA 3.27Å; L304-E306 PolarHBondContact O-N 2.69Å
307	H	95.9	Very high	86.6	Confident	5 Å²	5	64.9 Å²	64.9	2%	0.023	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.7	145.4	-178.7	-173	79.1	0	0	0	112.7	I182 C188 M298 A301 Y302 N309	I182-H307 PolarHBondContact O-CE1 3.35Å; I182-H307 PolarHBondContact O-NE2 2.74Å; C188-H307 WeakPolarHBondContact CB-CE1 3.22Å; C188-H307 WeakPolarHBondContact CB-ND1 3.38Å; M298-H307 PolarHBondContact N-O 2.92Å; M298-H307 PolarHBondContact O-N 2.95Å; A301-H307 HydrophobicContact CB-CB 3.73Å; Y302-H307 HydrophobicContact CD2-CB 3.94Å; Y302-H307 AromaticContact CD2-CG 3.88Å; Y302-H307 HydrophobicContact CE2-CB 4.04Å; Y302-H307 AromaticContact CE2-CD2 3.64Å; Y302-H307 AromaticContact CE2-CE1 3.77Å; Y302-H307 AromaticContact CE2-CG 3.52Å; Y302-H307 AromaticContact CE2-ND1 3.64Å; Y302-H307 AromaticContact CE2-NE2 3.78Å; H307-N309 PolarHBondContact CD2-ND2 3.5Å; H307-N309 PolarHBondContact CD2-OD1 2.88Å; H307-N309 PolarHBondContact NE2-OD1 3.42Å
308	Y	97.6	Very high	84.2	Confident	26 Å²	26	68.6 Å²	68.6	10%	0.102	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	133.7	173.2	-70.2	-91.2	0	0	0	111.1	M189 L261 I274 L295 V296 Y297	M189-Y308 HydrophobicContact CB-CD2 3.71Å; M189-Y308 HydrophobicContact CB-CE2 4.19Å; M189-Y308 HydrophobicContact CB-CG 4.06Å; M189-Y308 HydrophobicContact CG-CD2 4.09Å; M189-Y308 HydrophobicContact CG-CE2 4.23Å; M189-Y308 HydrophobicContact CG-CG 4.23Å; L261-Y308 HydrophobicContact CD1-CE1 4.17Å; I274-Y308 HydrophobicContact CG2-CE1 4.13Å; L295-Y308 HydrophobicContact CB-CD1 4.39Å; L295-Y308 HydrophobicContact CD1-CD1 4.29Å; V296-Y308 CarbonylContact O-C 3.59Å; V296-Y308 WeakPolarHBondContact O-CA 3.3Å; Y297-Y308 HydrophobicContact CD2-CD1 4.19Å; Y297-Y308 HydrophobicContact CD2-CD2 4.25Å; Y297-Y308 AromaticContact CD2-CE1 3.74Å; Y297-Y308 HydrophobicContact CD2-CE1 3.74Å; Y297-Y308 AromaticContact CD2-CE2 3.81Å; Y297-Y308 HydrophobicContact CD2-CE2 3.81Å; Y297-Y308 HydrophobicContact CD2-CG 4.44Å; Y297-Y308 AromaticContact CD2-CZ 3.52Å; Y297-Y308 HydrophobicContact CE2-CE2 4.1Å; Y297-Y308 HydrophobicContact CG-CE1 4.3Å
309	N	97.8	Very high	81.8	Confident	1 Å²	1	73.7 Å²	73.7	1%	0.005	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	159.2	170.1	-72.6	-54.1	0	0	0	111	I179 Q181 I182 V296 H307	I179-N309 HydrophobicContact CG2-CB 3.62Å; Q181-N309 WeakPolarHBondContact CA-OD1 3.4Å; Q181-N309 VanDerWaalsContact OE1-CG 3.28Å; Q181-N309 PolarHBondContact OE1-ND2 3.01Å; Q181-N309 PolarHBondContact OE1-OD1 3.46Å; I182-N309 PolarHBondContact N-OD1 2.8Å; V296-N309 HydrophobicContact CB-CB 4.32Å; V296-N309 PolarHBondContact N-O 3.43Å; V296-N309 PolarHBondContact O-N 3.48Å; H307-N309 PolarHBondContact CD2-ND2 3.5Å; H307-N309 PolarHBondContact CD2-OD1 2.88Å; H307-N309 PolarHBondContact NE2-OD1 3.42Å
310	S	97.7	Very high	79.4	Confident	0 Å²	0	75.2 Å²	75.2	0%	0	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	172.5	168.9	-175.6	0	0	0	0	109.3	K180 D195 Q196	K180-S310 PolarHBondContact N-O 3.47Å; K180-S310 PolarHBondContact O-N 3.11Å; D195-S310 VanDerWaalsContact OD2-CB 3.24Å; D195-S310 WeakPolarHBondContact OD2-CB 3.39Å; D195-S310 PolarHBondContact OD2-OG 3.47Å; Q196-S310 PolarHBondContact NE2-OG 2.88Å
311	V	97.4	Very high	77	Confident	4 Å²	4	78.4 Å²	78.4	2%	0.024	43%	0.427	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	156.3	168.6	-60.1	0	0	0	0	110.2	L172 L177 E178 Q196 I294 V296	L172-V311 HydrophobicContact CD2-CG1 3.86Å; L177-V311 HydrophobicContact CD1-CG2 4.25Å; L177-V311 HydrophobicContact CD2-CB 4.5Å; L177-V311 HydrophobicContact CD2-CG2 4.2Å; E178-V311 VanDerWaalsContact O-CA 3.3Å; E178-V311 WeakPolarHBondContact O-CA 3.23Å; Q196-V311 PolarHBondContact NE2-O 3.17Å; I294-V311 HydrophobicContact CB-CG2 3.69Å; I294-V311 HydrophobicContact CG2-CG1 3.95Å; I294-V311 HydrophobicContact CG2-CG2 3.86Å; V296-V311 HydrophobicContact CG2-CG1 3.51Å
312	T	95.8	Very high	75.1	Confident	39 Å²	39	83.3 Å²	83.3	24%	0.239	46%	0.46	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	169.6	165.7	-162.5	0	0	0	0	110.1	L177 E178 K180 L314	L177-T312 CarbonylContact C-O 3.36Å; L177-T312 VanDerWaalsContact CA-O 3.28Å; L177-T312 WeakPolarHBondContact CA-O 3.05Å; E178-T312 HydrophobicContact CG-CG2 3.65Å; E178-T312 PolarHBondContact N-O 3.46Å; E178-T312 PolarHBondContact O-N 3.02Å; K180-T312 HydrophobicContact CB-CG2 4.41Å; T312-L314 PolarHBondContact O-N 3.02Å
313	R	94.4	Very high	73.1	Confident	183 Å²	183	88.6 Å²	88.6	69%	0.691	51%	0.508	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-68.1	132.7	178.4	-69.4	-173.9	-180	169.7	2.3	109.8	V315	R313-V315 PolarHBondContact O-N 3.09Å; R313-V315 VanDerWaalsContact O-N 3.08Å
314	L	90.3	Very high	73.3	Confident	58 Å²	58	88.5 Å²	88.5	30%	0.304	49%	0.486	S	S	.	.			trans	-65.1	110.2	172.2	-174.2	69.8	0	0	0	108.8	Q176 E178 T312 N316	Q176-L314 PolarHBondContact O-N 2.91Å; E178-L314 HydrophobicContact CB-CD1 4.03Å; E178-L314 HydrophobicContact CG-CD1 4.46Å; T312-L314 PolarHBondContact O-N 3.02Å; L314-N316 PolarHBondContact O-N 3.5Å
315	V	81.9	Confident	73.4	Confident	107 Å²	107	85.6 Å²	85.6	65%	0.648	47%	0.472	S	S	*	.			trans	-81	99.4	174.9	-175	0	0	0	0	107.9	R313 I317	R313-V315 PolarHBondContact O-N 3.09Å; R313-V315 VanDerWaalsContact O-N 3.08Å; V315-I317 VanDerWaalsContact C-N 3.33Å; V315-I317 HydrophobicContact CG1-CG1 4.18Å; V315-I317 PolarHBondContact O-N 3.48Å
316	N	64.9	Low	72.9	Confident	118 Å²	118	89.4 Å²	89.4	63%	0.631	49%	0.489	S	S	*	.			trans	-66.8	95.3	167.7	-70.8	-27.1	0	0	0	108.1	L314 V318	L314-N316 PolarHBondContact O-N 3.5Å; N316-V318 HydrophobicContact CB-CG2 4.29Å; N316-V318 PolarHBondContact O-N 3.23Å
317	I	53.4	Low	71.8	Confident	145 Å²	145	89.1 Å²	89.1	74%	0.744	49%	0.491	S	S	*	.			trans	-71.8	78.7	164.5	-56	171	0	0	0	106	V315 T319	V315-I317 VanDerWaalsContact C-N 3.33Å; V315-I317 HydrophobicContact CG1-CG1 4.18Å; V315-I317 PolarHBondContact O-N 3.48Å; I317-T319 PolarHBondContact O-N 3.31Å
318	V	47.7	Very low	70.3	Confident	109 Å²	109	94.4 Å²	94.4	66%	0.661	52%	0.521	S	S	*	.			trans	-62.3	110.7	161	-177.5	0	0	0	0	104.3	N316 E320	N316-V318 HydrophobicContact CB-CG2 4.29Å; N316-V318 PolarHBondContact O-N 3.23Å; V318-E320 HydrophobicContact CG1-CG 4.3Å; V318-E320 PolarHBondContact O-N 3.19Å
319	T	45.1	Very low	68.4	Low	112 Å²	112	98.9 Å²	98.9	69%	0.687	55%	0.549	S	S	*	.			trans	-66.6	84.8	165.3	32.7	0	0	0	0	106.7	I317 N321	I317-T319 PolarHBondContact O-N 3.31Å; T319-N321 PolarHBondContact O-N 3.4Å
320	E	42.1	Very low	66.3	Low	166 Å²	166	105.9 Å²	105.9	78%	0.776	59%	0.587	S	S	*	*			trans	-63.3	78.8	159.9	-75.4	-175.8	162.1	0	0	107.4	V318 C322	V318-E320 HydrophobicContact CG1-CG 4.3Å; V318-E320 PolarHBondContact O-N 3.19Å; E320-C322 PolarHBondContact O-N 3.36Å
321	N	39	Very low	63.9	Low	150 Å²	150	114.1 Å²	114.1	80%	0.802	63%	0.633	S	S	*	*			trans	-73.1	78.6	152.8	-74.5	-22.5	0	0	0	106	T319 S323	T319-N321 PolarHBondContact O-N 3.4Å; N321-S323 PolarHBondContact O-N 3.24Å
322	C	41	Very low	61.2	Low	105 Å²	105	123.3 Å²	123.3	71%	0.709	68%	0.683	S	S	*	*			trans	-72.7	120.7	173.9	-158.4	0	0	0	0	108.8	E320	E320-C322 PolarHBondContact O-N 3.36Å
323	S	38.3	Very low	58	Low	187 Å²	187	130.9 Å²	130.9	100%	1.308	72%	0.724	S	S	*	*			trans	47.5	0	151.2	-47.1	0	0	0	0	120.1	N321	N321-S323 PolarHBondContact O-N 3.24Å

Retrieved 323 of 323 residues in 237.5 ms (Link to these results)

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