A0A061III2_CRIGR Loading...

FERM domain-containing protein 3

Putative tumor suppressor gene that may be implicated in the origin and progression of lung cancer.

AlphaFold DB , UniProt , Accession A0A061III2, Species CRIGR (Cricetulus griseus, Chinese hamster), Gene Frmd3, Length 595 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	34.7	Very low	31.1	Very low	247 Å²	247	149.4 Å²	149.4	100%	1.217	87%	0.869	S	S	*	*				0	127.2	0	-84.7	173.3	171.3	0	0	107.9
2	F	39.1	Very low	31	Very low	215 Å²	215	157.6 Å²	157.6	94%	0.943	88%	0.875	S	S	*	*			trans	-83.6	146	-173.8	-74.4	-93.7	0	0	0	112.9
3	A	30.1	Very low	31	Very low	98 Å²	98	164.8 Å²	164.8	81%	0.81	88%	0.88	S	S	*	*			trans	-171.6	118.3	147.6	0	0	0	0	0	106.6
4	S	26.9	Very low	31	Very low	127 Å²	127	159.9 Å²	159.9	89%	0.888	88%	0.875	S	S	*	*			cis	86.8	139.7	39.3	-148.8	0	0	0	0	115.9
5	C	28	Very low	30.8	Very low	104 Å²	104	161.7 Å²	161.7	70%	0.703	88%	0.878	S	S	*	*			trans	-83.3	167.6	-156.3	-73.6	0	0	0	0	117.8
6	H	27.4	Very low	30.9	Very low	174 Å²	174	164.4 Å²	164.4	81%	0.806	88%	0.878	S	S	*	*			trans	96.6	135.7	134	-86	10.7	0	0	0	124
7	C	26.3	Very low	30.6	Very low	121 Å²	121	164.8 Å²	164.8	82%	0.818	88%	0.877	S	S	*	*			trans	83.1	130.8	143.1	-69.6	0	0	0	0	122.7
8	A	34.5	Very low	30.8	Very low	95 Å²	95	163.6 Å²	163.6	79%	0.785	87%	0.869	S	S	*	*			trans	-75.5	168.2	175.8	0	0	0	0	0	114
9	P	30.9	Very low	30.8	Very low	130 Å²	130	163.2 Å²	163.2	84%	0.844	86%	0.861	S	S	*	*				-143.6	154.9	121.9	33.1	-16.1	0	0	0	116.4
10	R	34.8	Very low	30.9	Very low	256 Å²	256	164.3 Å²	164.3	97%	0.966	86%	0.858	S	S	*	*			trans	-59	138.6	170.1	-76.2	170.5	166	170.2	-4.6	112.8
11	G	29.4	Very low	31.1	Very low	76 Å²	76	167.3 Å²	167.3	78%	0.784	86%	0.858	S	S	*	*			trans	-125.9	107	169.8	0	0	0	0	0	113.2
12	R	29.8	Very low	31.3	Very low	248 Å²	248	160.7 Å²	160.7	94%	0.936	84%	0.836	S	S	*	*			trans	31.5	106.3	154.2	-61.5	-179.9	-174.5	-175.7	1.3	119.3	A14	R12-A14 PolarHBondContact O-N 3.42Å
13	R	31.6	Very low	31	Very low	251 Å²	251	154.9 Å²	154.9	95%	0.947	82%	0.822	S	S	*	*	P	Polyproline II helix	trans	-65.6	119.8	153.1	-80.8	179.8	177.8	171.3	-1.5	108.9	M15	R13-M15 PolarHBondContact O-N 3.39Å
14	A	30.6	Very low	31.6	Very low	97 Å²	97	153.5 Å²	153.5	80%	0.802	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-65.5	123.5	167.7	0	0	0	0	0	109.5	R12 K16	R12-A14 PolarHBondContact O-N 3.42Å; A14-K16 PolarHBondContact O-N 3.2Å
15	M	28	Very low	32.7	Very low	186 Å²	186	154 Å²	154	92%	0.916	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-60.6	116.1	164.9	-87.3	175.3	166.8	0	0	108	R13 M17	R13-M15 PolarHBondContact O-N 3.39Å; M15-M17 PolarHBondContact O-N 2.99Å
16	K	32.5	Very low	33.6	Very low	205 Å²	205	157.3 Å²	157.3	89%	0.891	80%	0.801	S	S	*	*			trans	-62.6	103.7	159.3	-91.7	-179.3	174.9	177.5	0	106.5	A14 I18	A14-K16 PolarHBondContact O-N 3.2Å; K16-I18 PolarHBondContact O-N 3.01Å
17	M	26.3	Very low	34.7	Very low	172 Å²	172	151.1 Å²	151.1	85%	0.847	78%	0.777	S	S	*	*			trans	-63.2	104.2	170.1	-146.5	-174.1	-64	0	0	106.3	M15 H19	M15-M17 PolarHBondContact O-N 2.99Å; M17-H19 VanDerWaalsContact C-N 3.32Å; M17-H19 PolarHBondContact O-N 3.43Å
18	I	33.6	Very low	35.8	Very low	143 Å²	143	149.3 Å²	149.3	73%	0.733	76%	0.759	S	S	*	*			trans	-66	102.3	169.9	-46.1	171.9	0	0	0	104.1	K16 F20	K16-I18 PolarHBondContact O-N 3.01Å; I18-F20 VanDerWaalsContact C-N 3.29Å; I18-F20 PolarHBondContact O-N 3.34Å
19	H	30.9	Very low	36.8	Very low	156 Å²	156	150.1 Å²	150.1	72%	0.722	75%	0.75	S	S	*	*			trans	-67.6	96.2	175.9	-151.8	68.5	0	0	0	105.9	M17 R21	M17-H19 VanDerWaalsContact C-N 3.32Å; M17-H19 PolarHBondContact O-N 3.43Å; H19-R21 PolarHBondContact O-N 3.08Å
20	F	32.8	Very low	38.7	Very low	184 Å²	184	149.2 Å²	149.2	81%	0.807	73%	0.734	S	S	*	*			trans	-56.6	102.1	159.6	-85.7	-88.2	0	0	0	105.1	I18 S22	I18-F20 VanDerWaalsContact C-N 3.29Å; I18-F20 PolarHBondContact O-N 3.34Å; F20-S22 PolarHBondContact O-N 3.11Å
21	R	35.4	Very low	41.2	Very low	228 Å²	228	142.7 Å²	142.7	86%	0.86	72%	0.715	S	S	*	*			trans	-61.9	89.9	162.4	-78.8	-175.4	171.2	-177.5	-1.4	105.2	H19 S23	H19-R21 PolarHBondContact O-N 3.08Å; R21-S23 PolarHBondContact O-N 3.11Å; R21-S23 VanDerWaalsContact O-N 3.16Å
22	S	37.4	Very low	44.1	Very low	108 Å²	108	139.4 Å²	139.4	76%	0.755	68%	0.679	S	S	*	*			trans	-48.8	121.3	155.6	176.5	0	0	0	0	105.5	F20 S24	F20-S22 PolarHBondContact O-N 3.11Å; S22-S24 PolarHBondContact O-N 3.22Å
23	S	34.1	Very low	47	Very low	93 Å²	93	132.5 Å²	132.5	65%	0.65	66%	0.656	S	S	*	*			trans	-45.9	109.1	173.8	-48.3	0	0	0	0	107.2	R21 I25	R21-S23 PolarHBondContact O-N 3.11Å; R21-S23 VanDerWaalsContact O-N 3.16Å; S23-I25 PolarHBondContact O-N 2.95Å
24	S	42.3	Very low	50	Low	70 Å²	70	120.6 Å²	120.6	49%	0.49	61%	0.611	S	S	.	*			trans	-54.1	136.8	-178.7	179.4	0	0	0	0	107.7	S22 K26 S27	S22-S24 PolarHBondContact O-N 3.22Å; S24-K26 PolarHBondContact O-N 3.49Å; S24-S27 PolarHBondContact O-N 3.38Å; S24-S27 PolarHBondContact O-OG 3.25Å
25	I	50.8	Low	53.1	Low	136 Å²	136	116.6 Å²	116.6	70%	0.697	58%	0.577	S	S	*	*	G	3₁₀ helix	trans	-48	-22	173.7	-67.4	165.4	0	0	0	111.9	S23 S27 L28	S23-I25 PolarHBondContact O-N 2.95Å; I25-S27 VanDerWaalsContact C-N 3.32Å; I25-S27 PolarHBondContact O-N 2.96Å; I25-L28 PolarHBondContact O-N 3.39Å
26	K	46.8	Very low	56.3	Low	174 Å²	174	107.7 Å²	107.7	76%	0.757	53%	0.533	S	S	*	.	G	3₁₀ helix	trans	-62.7	-25.3	171.6	-66.4	-175.1	176.1	-175.9	0	115.2	S24	S24-K26 PolarHBondContact O-N 3.49Å
27	S	50.1	Low	59.3	Low	45 Å²	45	100 Å²	100	32%	0.315	50%	0.498	S	S	.	.	G	3₁₀ helix	trans	-83.1	-14.8	178.7	77.8	0	0	0	0	114.1	S24 I25 N29	S24-S27 PolarHBondContact O-N 3.38Å; S24-S27 PolarHBondContact O-OG 3.25Å; I25-S27 VanDerWaalsContact C-N 3.32Å; I25-S27 PolarHBondContact O-N 2.96Å; S27-N29 VanDerWaalsContact C-N 3.28Å
28	L	50.2	Low	62.6	Low	83 Å²	83	91.8 Å²	91.8	44%	0.435	46%	0.458	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77	-16.1	172.7	-74.8	159.7	0	0	0	112.2	I25	I25-L28 PolarHBondContact O-N 3.39Å
29	N	54.9	Low	65.4	Low	112 Å²	112	85.1 Å²	85.1	60%	0.599	42%	0.424	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.2	9.8	-177.2	-69.8	-20.6	0	0	0	113.9	S27 E31	S27-N29 VanDerWaalsContact C-N 3.28Å; N29-E31 VanDerWaalsContact C-N 3.31Å; N29-E31 PolarHBondContact O-N 2.93Å
30	Q	71.1	Confident	68.2	Low	110 Å²	110	79.8 Å²	79.8	51%	0.514	40%	0.4	S	S	.	.			trans	-78.1	89	176.7	-165.7	171.7	23.4	0	0	109.3
31	E	86.3	Confident	70.8	Confident	119 Å²	119	73.3 Å²	73.3	56%	0.556	38%	0.375	S	S	*	.			trans	-65.6	131.1	170.4	-70.5	-174.6	-179.3	0	0	110	N29 H47 I48	N29-E31 VanDerWaalsContact C-N 3.31Å; N29-E31 PolarHBondContact O-N 2.93Å; E31-H47 HydrophobicContact CB-CB 4.27Å; E31-H47 IonicContact OE2-CD2 2.63Å; E31-H47 IonicContact OE2-CG 3.09Å; E31-I48 WeakPolarHBondContact CA-O 3.49Å
32	M	90.2	Very high	73.5	Confident	8 Å²	8	64.5 Å²	64.5	4%	0.039	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	128.3	178.5	-63.7	166.7	-76.2	0	0	108.3	C34 H47 I48 Q49 R50 F94 P101 Y103	M32-C34 PolarHBondContact O-N 3.12Å; M32-H47 WeakPolarHBondContact O-CA 3.17Å; M32-I48 HydrophobicContact CB-CG1 4.12Å; M32-I48 HydrophobicContact CE-CG1 4.45Å; M32-I48 PolarHBondContact N-O 3.48Å; M32-I48 WeakPolarHBondContact O-CG1 3.45Å; M32-I48 PolarHBondContact O-N 3.46Å; M32-Q49 VanDerWaalsContact CE-C 3.5Å; M32-R50 HydrophobicContact CE-CB 4.28Å; M32-R50 HydrophobicContact CE-CG 3.68Å; M32-F94 HydrophobicContact CE-CB 4.45Å; M32-F94 HydrophobicContact CE-CD2 4.06Å; M32-F94 HydrophobicContact SD-CD2 3.63Å; M32-F94 HydrophobicContact SD-CE2 4.16Å; M32-P101 HydrophobicContact CB-CB 4.18Å; M32-P101 HydrophobicContact CB-CG 4.15Å; M32-P101 HydrophobicContact CG-CB 4.21Å; M32-P101 HydrophobicContact CG-CG 3.74Å; M32-P101 HydrophobicContact SD-CG 3.75Å; M32-Y103 HydrophobicContact CB-CE2 4.44Å; M32-Y103 HydrophobicContact SD-CE2 4.03Å
33	K	91.8	Very high	76.2	Confident	103 Å²	103	65.1 Å²	65.1	45%	0.448	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	129.4	173.8	-173.6	179.7	177.6	-175.8	0	109.6	P102 Y103	K33-P102 HydrophobicContact CB-CB 4.32Å; K33-P102 WeakPolarHBondContact O-CA 3.43Å; K33-Y103 PolarHBondContact O-N 3.09Å
34	C	94.1	Very high	79.1	Confident	0 Å²	0	61.5 Å²	61.5	0%	0	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	130.6	172	-175.3	0	0	0	0	109.3	M32 S45 C46 I48 Y103	M32-C34 PolarHBondContact O-N 3.12Å; C34-S45 CarbonylContact O-C 3.55Å; C34-S45 VanDerWaalsContact O-CA 3.3Å; C34-S45 WeakPolarHBondContact O-CA 3.2Å; C34-C46 PolarHBondContact N-O 2.87Å; C34-C46 PolarHBondContact O-N 2.79Å; C34-I48 HydrophobicContact CB-CD1 4.32Å; C34-I48 HydrophobicContact CB-CG1 4.43Å; C34-I48 HydrophobicContact CB-CG2 4.47Å; C34-Y103 CarbonylContact C-O 3.57Å; C34-Y103 WeakPolarHBondContact CA-O 3.34Å
35	T	95.3	Very high	81.6	Confident	13 Å²	13	61 Å²	61	8%	0.08	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	123.3	177.2	-62.2	0	0	0	0	109	E43 S45 Y103 T104 M105	T35-E43 HydrophobicContact CG2-CB 4.02Å; T35-E43 HydrophobicContact CG2-CG 4.21Å; T35-S45 PolarHBondContact OG1-OG 2.87Å; T35-Y103 PolarHBondContact N-O 3.46Å; T35-T104 WeakPolarHBondContact O-CA 3.41Å; T35-M105 PolarHBondContact O-N 3.17Å
36	I	96.1	Very high	83.6	Confident	0 Å²	0	55.3 Å²	55.3	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	115.5	177	-55.3	95.1	0	0	0	108.2	L38 V44 L57 I61 F107	I36-L38 HydrophobicContact CG2-CD2 4.28Å; I36-V44 PolarHBondContact N-O 3.44Å; I36-V44 PolarHBondContact O-N 2.83Å; I36-L57 HydrophobicContact CD1-CD2 4.12Å; I36-I61 HydrophobicContact CB-CD1 4.12Å; I36-I61 HydrophobicContact CD1-CD1 4.31Å; I36-I61 HydrophobicContact CG1-CD1 4.42Å; I36-I61 HydrophobicContact CG2-CD1 4.18Å; I36-I61 HydrophobicContact CG2-CG1 4.21Å; I36-F107 HydrophobicContact CG2-CB 3.94Å
37	R	95.5	Very high	85.8	Confident	43 Å²	43	52.5 Å²	52.5	16%	0.162	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	124.9	170.9	-175.9	169.7	167.4	165.4	0.8	110	D41 S42 E43 M105 C106 F107 R108	R37-D41 IonicContact CZ-OD1 3.69Å; R37-D41 IonicContact NE-OD1 3.53Å; R37-D41 PolarHBondContact NE-OD1 3.12Å; R37-D41 IonicContact NH2-OD1 2.74Å; R37-D41 PolarHBondContact NH2-OD1 3.39Å; R37-D41 IonicContact NH2-OD2 3.52Å; R37-D41 PolarHBondContact NH2-OD2 2.88Å; R37-S42 WeakPolarHBondContact CA-O 3.33Å; R37-E43 HydrophobicContact CB-CG 4.5Å; R37-M105 PolarHBondContact N-O 2.85Å; R37-C106 CarbonylContact O-C 3.41Å; R37-C106 WeakPolarHBondContact O-CA 3.45Å; R37-F107 PolarHBondContact O-N 2.86Å; R37-R108 PolarHBondContact O-NH1 3.48Å
38	L	94.9	Very high	87.9	Confident	0 Å²	0	50.5 Å²	50.5	0%	0	26%	0.256	C	S	.	.			trans	-82.1	-174.8	-176.6	-57.6	-166.8	0	0	0	112	I36 D40 D41 S42 V44 I61 Y64 Y65 F107 R108	I36-L38 HydrophobicContact CG2-CD2 4.28Å; L38-D40 WeakPolarHBondContact CB-OD1 3.41Å; L38-D41 PolarHBondContact O-N 3.49Å; L38-S42 WeakPolarHBondContact CD1-OG 3.33Å; L38-S42 PolarHBondContact N-O 3.46Å; L38-V44 HydrophobicContact CD1-CG2 3.81Å; L38-V44 HydrophobicContact CD2-CG2 4.23Å; L38-V44 HydrophobicContact CG-CG2 4.18Å; L38-I61 HydrophobicContact CD2-CD1 4.06Å; L38-I61 HydrophobicContact CD2-CG2 4.09Å; L38-Y64 HydrophobicContact CD1-CD1 4.08Å; L38-Y64 HydrophobicContact CD1-CE1 3.55Å; L38-Y65 WeakPolarHBondContact CB-OH 3.34Å; L38-Y65 HydrophobicContact CD1-CE2 3.92Å; L38-Y65 WeakPolarHBondContact CD1-OH 3.42Å; L38-Y65 HydrophobicContact CD2-CE2 4.24Å; L38-F107 HydrophobicContact CD2-CB 4.16Å; L38-R108 PolarHBondContact O-NH1 2.97Å
39	L	92.9	Very high	89.9	Confident	2 Å²	2	50.6 Å²	50.6	1%	0.01	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.7	-21.9	-177.6	-81	163.4	0	0	0	113.2	D41 F73 F107 L127 L130 Q131 R134	L39-D41 VanDerWaalsContact C-N 3.32Å; L39-F73 HydrophobicContact CD1-CD1 4.18Å; L39-F73 HydrophobicContact CD1-CE1 3.99Å; L39-F107 HydrophobicContact CD1-CD1 4.02Å; L39-F107 HydrophobicContact CD1-CE1 4.03Å; L39-F107 HydrophobicContact CG-CD1 4.26Å; L39-L127 HydrophobicContact CB-CD2 4.41Å; L39-L127 HydrophobicContact CD1-CB 3.81Å; L39-L127 HydrophobicContact CD1-CD2 4.02Å; L39-L127 HydrophobicContact CD1-CG 4.42Å; L39-L127 WeakPolarHBondContact CD1-O 3.4Å; L39-L130 HydrophobicContact CB-CB 3.99Å; L39-L130 HydrophobicContact CB-CD1 4.01Å; L39-Q131 HydrophobicContact CD2-CB 3.91Å; L39-Q131 VanDerWaalsContact CD2-OE1 3.31Å; L39-R134 VanDerWaalsContact O-CZ 3.27Å; L39-R134 PolarHBondContact O-NH1 3.49Å; L39-R134 PolarHBondContact O-NH2 2.94Å
40	D	89.2	Confident	91.6	Very high	44 Å²	44	49.2 Å²	49.2	24%	0.235	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.6	8.8	172.4	60.1	1.1	0	0	0	112.5	L38 S42 L130	L38-D40 WeakPolarHBondContact CB-OD1 3.41Å; D40-S42 PolarHBondContact O-N 2.97Å; D40-S42 VanDerWaalsContact OD1-CB 3.32Å; D40-S42 WeakPolarHBondContact OD1-CB 3.21Å; D40-S42 PolarHBondContact OD1-N 3.46Å; D40-S42 PolarHBondContact OD1-OG 2.9Å; D40-S42 PolarHBondContact OD2-OG 3.46Å; D40-L130 HydrophobicContact CB-CD1 3.99Å
41	D	88.2	Confident	92.6	Very high	49 Å²	49	48.8 Å²	48.8	26%	0.262	24%	0.239	S	C	.	.	S	Bend	trans	66.7	6	-176	-62	-48.3	0	0	0	116.3	R37 L38 L39 R134	R37-D41 IonicContact CZ-OD1 3.69Å; R37-D41 IonicContact NE-OD1 3.53Å; R37-D41 PolarHBondContact NE-OD1 3.12Å; R37-D41 IonicContact NH2-OD1 2.74Å; R37-D41 PolarHBondContact NH2-OD1 3.39Å; R37-D41 IonicContact NH2-OD2 3.52Å; R37-D41 PolarHBondContact NH2-OD2 2.88Å; L38-D41 PolarHBondContact O-N 3.49Å; L39-D41 VanDerWaalsContact C-N 3.32Å; D41-R134 IonicContact OD1-CZ 3.7Å; D41-R134 IonicContact OD1-NH2 2.95Å; D41-R134 PolarHBondContact OD1-NH2 3.42Å; D41-R134 IonicContact OD2-NH2 2.78Å; D41-R134 PolarHBondContact OD2-NH2 3.4Å
42	S	91.9	Very high	93	Very high	42 Å²	42	44.4 Å²	44.4	29%	0.294	22%	0.22	S	C	.	.			trans	-66.4	161.7	164.3	71	0	0	0	0	111.2	R37 L38 D40	R37-S42 WeakPolarHBondContact CA-O 3.33Å; L38-S42 WeakPolarHBondContact CD1-OG 3.33Å; L38-S42 PolarHBondContact N-O 3.46Å; D40-S42 PolarHBondContact O-N 2.97Å; D40-S42 VanDerWaalsContact OD1-CB 3.32Å; D40-S42 WeakPolarHBondContact OD1-CB 3.21Å; D40-S42 PolarHBondContact OD1-N 3.46Å; D40-S42 PolarHBondContact OD1-OG 2.9Å; D40-S42 PolarHBondContact OD2-OG 3.46Å
43	E	93.8	Very high	93.2	Very high	121 Å²	121	49.7 Å²	49.7	57%	0.565	24%	0.243	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-122.9	130.9	-177.2	-65.1	-170.7	164.6	0	0	111.7	T35 R37	T35-E43 HydrophobicContact CG2-CB 4.02Å; T35-E43 HydrophobicContact CG2-CG 4.21Å; R37-E43 HydrophobicContact CB-CG 4.5Å
44	V	94.2	Very high	93.4	Very high	17 Å²	17	44.8 Å²	44.8	10%	0.103	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	124.6	170.1	176.3	0	0	0	0	108	I36 L38 I61 Y64	I36-V44 PolarHBondContact N-O 3.44Å; I36-V44 PolarHBondContact O-N 2.83Å; L38-V44 HydrophobicContact CD1-CG2 3.81Å; L38-V44 HydrophobicContact CD2-CG2 4.23Å; L38-V44 HydrophobicContact CG-CG2 4.18Å; V44-I61 HydrophobicContact CB-CD1 3.97Å; V44-I61 HydrophobicContact CG1-CD1 3.97Å; V44-I61 HydrophobicContact CG2-CD1 4.38Å; V44-Y64 HydrophobicContact CG2-CD1 4.47Å; V44-Y64 HydrophobicContact CG2-CD2 4.24Å; V44-Y64 HydrophobicContact CG2-CE1 4.34Å; V44-Y64 HydrophobicContact CG2-CE2 4.09Å; V44-Y64 HydrophobicContact CG2-CG 4.43Å
45	S	94.5	Very high	93.5	Very high	60 Å²	60	47.7 Å²	47.7	42%	0.42	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	139.4	178.3	-67.3	0	0	0	0	111.2	C34 T35	C34-S45 CarbonylContact O-C 3.55Å; C34-S45 VanDerWaalsContact O-CA 3.3Å; C34-S45 WeakPolarHBondContact O-CA 3.2Å; T35-S45 PolarHBondContact OG1-OG 2.87Å
46	C	93.5	Very high	93.5	Very high	16 Å²	16	51.5 Å²	51.5	11%	0.108	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	166.8	174.4	65	0	0	0	0	111	C34 L57	C34-C46 PolarHBondContact N-O 2.87Å; C34-C46 PolarHBondContact O-N 2.79Å; C46-L57 WeakPolarHBondContact SG-CD2 3.32Å
47	H	93.6	Very high	93.5	Very high	115 Å²	115	51.5 Å²	51.5	53%	0.532	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	136.2	173.7	-68.3	85.3	0	0	0	109.5	E31 M32	E31-H47 HydrophobicContact CB-CB 4.27Å; E31-H47 IonicContact OE2-CD2 2.63Å; E31-H47 IonicContact OE2-CG 3.09Å; M32-H47 WeakPolarHBondContact O-CA 3.17Å
48	I	93.9	Very high	93.5	Very high	3 Å²	3	50.8 Å²	50.8	2%	0.015	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	154.3	179.5	63.9	169.3	0	0	0	111	E31 M32 C34 T52 F56 L57 I93 Y103	E31-I48 WeakPolarHBondContact CA-O 3.49Å; M32-I48 HydrophobicContact CB-CG1 4.12Å; M32-I48 HydrophobicContact CE-CG1 4.45Å; M32-I48 PolarHBondContact N-O 3.48Å; M32-I48 WeakPolarHBondContact O-CG1 3.45Å; M32-I48 PolarHBondContact O-N 3.46Å; C34-I48 HydrophobicContact CB-CD1 4.32Å; C34-I48 HydrophobicContact CB-CG1 4.43Å; C34-I48 HydrophobicContact CB-CG2 4.47Å; I48-T52 HydrophobicContact CB-CG2 4.15Å; I48-T52 HydrophobicContact CG2-CG2 4.1Å; I48-F56 HydrophobicContact CG2-CD1 4.39Å; I48-F56 HydrophobicContact CG2-CE1 4.3Å; I48-L57 HydrophobicContact CG2-CD2 3.96Å; I48-I93 HydrophobicContact CD1-CB 3.88Å; I48-I93 HydrophobicContact CD1-CD1 3.76Å; I48-I93 HydrophobicContact CD1-CG1 4.43Å; I48-I93 HydrophobicContact CD1-CG2 3.57Å; I48-I93 HydrophobicContact CG2-CD1 4.36Å; I48-Y103 HydrophobicContact CD1-CD2 3.98Å; I48-Y103 HydrophobicContact CD1-CE2 4.17Å
49	Q	92.6	Very high	93.5	Very high	86 Å²	86	54.6 Å²	54.6	40%	0.402	27%	0.268	S	S	.	.			trans	-96.8	169.1	172.5	-65.5	177.6	-14.3	0	0	110.2	M32 E51 T52	M32-Q49 VanDerWaalsContact CE-C 3.5Å; Q49-E51 PolarHBondContact O-N 2.74Å; Q49-T52 PolarHBondContact N-OG1 2.76Å; Q49-T52 WeakPolarHBondContact O-CB 3.48Å; Q49-T52 PolarHBondContact O-N 2.92Å; Q49-T52 PolarHBondContact O-OG1 2.68Å
50	R	90.7	Very high	93.7	Very high	83 Å²	83	57.8 Å²	57.8	31%	0.313	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63	-31.7	-177.1	-71.1	-177.2	174.6	-168	-0.4	112.6	M32 S92 F94	M32-R50 HydrophobicContact CE-CB 4.28Å; M32-R50 HydrophobicContact CE-CG 3.68Å; R50-S92 WeakPolarHBondContact O-CB 3.26Å; R50-F94 HydrophobicContact CB-CB 4.44Å; R50-F94 HydrophobicContact CB-CG 4.38Å; R50-F94 HydrophobicContact CG-CD2 4.25Å; R50-F94 HydrophobicContact CG-CG 4.25Å; R50-F94 WeakPolarHBondContact O-CB 3.49Å
51	E	90.9	Very high	94	Very high	101 Å²	101	55.7 Å²	55.7	47%	0.472	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.8	-10.7	-176.8	-59.1	68.3	-149.4	0	0	112.1	Q49 K53	Q49-E51 PolarHBondContact O-N 2.74Å; E51-K53 PolarHBondContact O-N 3.47Å
52	T	94.7	Very high	94.4	Very high	26 Å²	26	53.5 Å²	53.5	16%	0.16	26%	0.26	C	S	.	.			trans	-59.7	121.7	-178.8	-56	0	0	0	0	110.3	I48 Q49 F56 S92 I93	I48-T52 HydrophobicContact CB-CG2 4.15Å; I48-T52 HydrophobicContact CG2-CG2 4.1Å; Q49-T52 PolarHBondContact N-OG1 2.76Å; Q49-T52 WeakPolarHBondContact O-CB 3.48Å; Q49-T52 PolarHBondContact O-N 2.92Å; Q49-T52 PolarHBondContact O-OG1 2.68Å; T52-F56 HydrophobicContact CG2-CB 3.71Å; T52-F56 HydrophobicContact CG2-CD1 3.58Å; T52-F56 HydrophobicContact CG2-CE1 4.41Å; T52-F56 HydrophobicContact CG2-CG 3.75Å; T52-S92 CarbonylContact O-C 3.55Å; T52-S92 WeakPolarHBondContact O-CA 2.98Å; T52-I93 HydrophobicContact CG2-CD1 3.88Å; T52-I93 PolarHBondContact O-N 2.78Å
53	K	95.9	Very high	94.5	Very high	120 Å²	120	57.5 Å²	57.5	52%	0.522	28%	0.278	S	S	.	.	B	Isolated β-bridge	trans	-79.2	154.1	-179.9	-65.2	-175.3	179.7	-179.5	0	111.9	E51 Q55 F56 K91	E51-K53 PolarHBondContact O-N 3.47Å; K53-Q55 PolarHBondContact O-N 3.4Å; K53-Q55 VanDerWaalsContact O-N 3.14Å; K53-F56 WeakPolarHBondContact O-CB 3.2Å; K53-F56 PolarHBondContact O-N 3.1Å; K53-K91 CarbonylContact C-O 3.6Å; K53-K91 WeakPolarHBondContact CA-O 3.15Å
54	G	95.2	Very high	94.5	Very high	0 Å²	0	58.2 Å²	58.2	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-56.1	-31.4	177.4	0	0	0	0	0	113.5	F56 L57 I58 P89 K91	G54-F56 PolarHBondContact O-N 3.41Å; G54-L57 PolarHBondContact O-N 2.89Å; G54-I58 PolarHBondContact O-N 2.87Å; G54-P89 PolarHBondContact N-O 3.37Å; G54-K91 PolarHBondContact N-O 3.33Å
55	Q	95.2	Very high	94.4	Very high	60 Å²	60	59 Å²	59	28%	0.28	28%	0.278	S	S	.	.	H	α-helix	trans	-54.3	-37.2	176.2	-174.6	63.2	18.9	0	0	112.7	K53 L57 I58 E59 P89	K53-Q55 PolarHBondContact O-N 3.4Å; K53-Q55 VanDerWaalsContact O-N 3.14Å; Q55-L57 PolarHBondContact O-N 3.41Å; Q55-I58 PolarHBondContact O-N 3.39Å; Q55-E59 HydrophobicContact CG-CG 4.3Å; Q55-E59 WeakPolarHBondContact CG-OE1 3.36Å; Q55-E59 PolarHBondContact NE2-OE1 3.34Å; Q55-E59 WeakPolarHBondContact O-CB 3.38Å; Q55-E59 WeakPolarHBondContact O-CG 3.3Å; Q55-E59 PolarHBondContact O-N 2.92Å; Q55-P89 HydrophobicContact CB-CB 4.11Å; Q55-P89 WeakPolarHBondContact CB-O 3.13Å; Q55-P89 PolarHBondContact N-O 3.19Å
56	F	96.2	Very high	94.4	Very high	94 Å²	94	58.9 Å²	58.9	41%	0.412	28%	0.277	S	S	.	.	H	α-helix	trans	-59.6	-46.9	179.6	172.8	-97	0	0	0	111.7	I48 T52 K53 G54 E59 H60	I48-F56 HydrophobicContact CG2-CD1 4.39Å; I48-F56 HydrophobicContact CG2-CE1 4.3Å; T52-F56 HydrophobicContact CG2-CB 3.71Å; T52-F56 HydrophobicContact CG2-CD1 3.58Å; T52-F56 HydrophobicContact CG2-CE1 4.41Å; T52-F56 HydrophobicContact CG2-CG 3.75Å; K53-F56 WeakPolarHBondContact O-CB 3.2Å; K53-F56 PolarHBondContact O-N 3.1Å; G54-F56 PolarHBondContact O-N 3.41Å; F56-E59 PolarHBondContact O-N 3.18Å; F56-H60 VanDerWaalsContact O-CB 3.24Å; F56-H60 WeakPolarHBondContact O-CB 3.47Å; F56-H60 PolarHBondContact O-N 3.39Å
57	L	96.1	Very high	94.5	Very high	0 Å²	0	58.5 Å²	58.5	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-67.8	-39.1	179.2	-67.8	-176.5	0	0	0	111.8	I36 C46 I48 G54 Q55 H60 I61 I75 L87 I93 M105	I36-L57 HydrophobicContact CD1-CD2 4.12Å; C46-L57 WeakPolarHBondContact SG-CD2 3.32Å; I48-L57 HydrophobicContact CG2-CD2 3.96Å; G54-L57 PolarHBondContact O-N 2.89Å; Q55-L57 PolarHBondContact O-N 3.41Å; L57-H60 PolarHBondContact O-N 2.88Å; L57-I61 WeakPolarHBondContact O-CG1 3.5Å; L57-I61 PolarHBondContact O-N 3.48Å; L57-I75 HydrophobicContact CB-CD1 3.61Å; L57-L87 HydrophobicContact CB-CD2 4.32Å; L57-L87 HydrophobicContact CD1-CD2 4.16Å; L57-I93 HydrophobicContact CD1-CD1 3.53Å; L57-I93 HydrophobicContact CD1-CG1 4.21Å; L57-I93 HydrophobicContact CG-CD1 3.63Å; L57-M105 HydrophobicContact CD1-CE 4.43Å; L57-M105 HydrophobicContact CD1-SD 3.92Å
58	I	95.3	Very high	94.6	Very high	28 Å²	28	57 Å²	57	14%	0.144	27%	0.269	C	S	.	.	H	α-helix	trans	-60.8	-48.6	177	-65.3	168.2	0	0	0	109.8	G54 Q55 I61 C62 I75 P89	G54-I58 PolarHBondContact O-N 2.87Å; Q55-I58 PolarHBondContact O-N 3.39Å; I58-I61 PolarHBondContact O-N 3.16Å; I58-C62 WeakPolarHBondContact O-CB 3.38Å; I58-C62 PolarHBondContact O-N 3.36Å; I58-C62 PolarHBondContact O-SG 3.31Å; I58-I75 HydrophobicContact CG1-CD1 4.06Å; I58-I75 HydrophobicContact CG1-CG1 4.31Å; I58-P89 HydrophobicContact CD1-CB 4.13Å
59	E	96	Very high	94.6	Very high	80 Å²	80	57.1 Å²	57.1	37%	0.374	27%	0.27	S	S	.	.	H	α-helix	trans	-65.3	-39.8	177.4	-72.7	176.3	178.3	0	0	112.4	Q55 F56 I61 C62 N63	Q55-E59 HydrophobicContact CG-CG 4.3Å; Q55-E59 WeakPolarHBondContact CG-OE1 3.36Å; Q55-E59 PolarHBondContact NE2-OE1 3.34Å; Q55-E59 WeakPolarHBondContact O-CB 3.38Å; Q55-E59 WeakPolarHBondContact O-CG 3.3Å; Q55-E59 PolarHBondContact O-N 2.92Å; F56-E59 PolarHBondContact O-N 3.18Å; E59-I61 VanDerWaalsContact C-N 3.35Å; E59-I61 PolarHBondContact O-N 2.74Å; E59-C62 PolarHBondContact O-N 3.49Å; E59-N63 VanDerWaalsContact O-CB 3.3Å; E59-N63 WeakPolarHBondContact O-CB 3.14Å; E59-N63 PolarHBondContact O-N 3.44Å; E59-N63 PolarHBondContact O-ND2 2.75Å
60	H	96.2	Very high	94.7	Very high	68 Å²	68	56.9 Å²	56.9	32%	0.315	27%	0.267	S	S	.	.	H	α-helix	trans	-56.7	-47.6	177	-175.5	73.6	0	0	0	111.7	F56 L57 N63 Y64	F56-H60 VanDerWaalsContact O-CB 3.24Å; F56-H60 WeakPolarHBondContact O-CB 3.47Å; F56-H60 PolarHBondContact O-N 3.39Å; L57-H60 PolarHBondContact O-N 2.88Å; H60-N63 PolarHBondContact O-N 2.78Å; H60-Y64 PolarHBondContact O-N 3.26Å
61	I	96.2	Very high	95	Very high	0 Å²	0	54.3 Å²	54.3	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-71.6	-38.5	178	-59.7	-57.1	0	0	0	112.2	I36 L38 V44 L57 I58 E59 N63 Y64 Y65 I75 F107	I36-I61 HydrophobicContact CB-CD1 4.12Å; I36-I61 HydrophobicContact CD1-CD1 4.31Å; I36-I61 HydrophobicContact CG1-CD1 4.42Å; I36-I61 HydrophobicContact CG2-CD1 4.18Å; I36-I61 HydrophobicContact CG2-CG1 4.21Å; L38-I61 HydrophobicContact CD2-CD1 4.06Å; L38-I61 HydrophobicContact CD2-CG2 4.09Å; V44-I61 HydrophobicContact CB-CD1 3.97Å; V44-I61 HydrophobicContact CG1-CD1 3.97Å; V44-I61 HydrophobicContact CG2-CD1 4.38Å; L57-I61 WeakPolarHBondContact O-CG1 3.5Å; L57-I61 PolarHBondContact O-N 3.48Å; I58-I61 PolarHBondContact O-N 3.16Å; E59-I61 VanDerWaalsContact C-N 3.35Å; E59-I61 PolarHBondContact O-N 2.74Å; I61-N63 VanDerWaalsContact C-N 3.29Å; I61-N63 PolarHBondContact O-N 2.73Å; I61-Y64 WeakPolarHBondContact O-CB 3.41Å; I61-Y64 PolarHBondContact O-N 2.83Å; I61-Y65 HydrophobicContact CG2-CD2 4Å; I61-Y65 HydrophobicContact CG2-CE2 4.09Å; I61-Y65 PolarHBondContact O-N 2.79Å; I61-Y65 VanDerWaalsContact O-N 3.16Å; I61-I75 HydrophobicContact CG1-CD1 4.32Å; I61-F107 HydrophobicContact CB-CD2 4.41Å; I61-F107 HydrophobicContact CG2-CB 4.33Å; I61-F107 HydrophobicContact CG2-CD1 4.13Å; I61-F107 HydrophobicContact CG2-CD2 3.66Å; I61-F107 HydrophobicContact CG2-CE1 4.32Å; I61-F107 HydrophobicContact CG2-CE2 3.87Å; I61-F107 HydrophobicContact CG2-CG 3.78Å; I61-F107 HydrophobicContact CG2-CZ 4.19Å
62	C	95.1	Very high	95.3	Very high	4 Å²	4	49.7 Å²	49.7	3%	0.027	24%	0.238	C	C	.	.	H	α-helix	trans	-62.7	-39.4	175.7	-65.7	0	0	0	0	111.5	I58 E59 Y65 S66 L67 K70	I58-C62 WeakPolarHBondContact O-CB 3.38Å; I58-C62 PolarHBondContact O-N 3.36Å; I58-C62 PolarHBondContact O-SG 3.31Å; E59-C62 PolarHBondContact O-N 3.49Å; C62-Y65 PolarHBondContact O-N 3.31Å; C62-S66 CarbonylContact O-C 3.56Å; C62-S66 WeakPolarHBondContact O-CA 3.4Å; C62-S66 PolarHBondContact O-N 3Å; C62-L67 HydrophobicContact CB-CB 4.45Å; C62-L67 PolarHBondContact O-N 2.74Å; C62-K70 HydrophobicContact CB-CB 4.41Å; C62-K70 WeakPolarHBondContact SG-CB 3.15Å
63	N	94.8	Very high	95.4	Very high	126 Å²	126	49 Å²	49	67%	0.674	23%	0.233	S	C	*	.	H	α-helix	trans	-69.2	-39.6	176.6	-69	-18.4	0	0	0	111.6	E59 H60 I61 Y65 S66	E59-N63 VanDerWaalsContact O-CB 3.3Å; E59-N63 WeakPolarHBondContact O-CB 3.14Å; E59-N63 PolarHBondContact O-N 3.44Å; E59-N63 PolarHBondContact O-ND2 2.75Å; H60-N63 PolarHBondContact O-N 2.78Å; I61-N63 VanDerWaalsContact C-N 3.29Å; I61-N63 PolarHBondContact O-N 2.73Å; N63-Y65 VanDerWaalsContact C-N 3.28Å; N63-Y65 PolarHBondContact O-N 2.72Å; N63-S66 PolarHBondContact O-N 3.16Å
64	Y	93.4	Very high	95.4	Very high	136 Å²	136	43.6 Å²	43.6	53%	0.533	21%	0.211	S	C	.	.	H	α-helix	trans	-53.6	-45.5	174	172.8	-93.2	0	0	0	111.9	L38 V44 H60 I61	L38-Y64 HydrophobicContact CD1-CD1 4.08Å; L38-Y64 HydrophobicContact CD1-CE1 3.55Å; V44-Y64 HydrophobicContact CG2-CD1 4.47Å; V44-Y64 HydrophobicContact CG2-CD2 4.24Å; V44-Y64 HydrophobicContact CG2-CE1 4.34Å; V44-Y64 HydrophobicContact CG2-CE2 4.09Å; V44-Y64 HydrophobicContact CG2-CG 4.43Å; H60-Y64 PolarHBondContact O-N 3.26Å; I61-Y64 WeakPolarHBondContact O-CB 3.41Å; I61-Y64 PolarHBondContact O-N 2.83Å
65	Y	93.1	Very high	95.5	Very high	32 Å²	32	43.7 Å²	43.7	13%	0.125	21%	0.212	C	C	.	.	H	α-helix	trans	-82.1	-11.4	176.5	-79.5	-62.7	0	0	0	114.4	L38 I61 C62 N63 L67 F107 L123 L127	L38-Y65 WeakPolarHBondContact CB-OH 3.34Å; L38-Y65 HydrophobicContact CD1-CE2 3.92Å; L38-Y65 WeakPolarHBondContact CD1-OH 3.42Å; L38-Y65 HydrophobicContact CD2-CE2 4.24Å; I61-Y65 HydrophobicContact CG2-CD2 4Å; I61-Y65 HydrophobicContact CG2-CE2 4.09Å; I61-Y65 PolarHBondContact O-N 2.79Å; I61-Y65 VanDerWaalsContact O-N 3.16Å; C62-Y65 PolarHBondContact O-N 3.31Å; N63-Y65 VanDerWaalsContact C-N 3.28Å; N63-Y65 PolarHBondContact O-N 2.72Å; Y65-L67 VanDerWaalsContact C-N 3.28Å; Y65-L67 PolarHBondContact O-N 3.46Å; Y65-F107 HydrophobicContact CD2-CE1 4.39Å; Y65-F107 HydrophobicContact CE2-CD1 4.21Å; Y65-F107 HydrophobicContact CE2-CE1 4.09Å; Y65-L123 HydrophobicContact CD1-CD1 4.24Å; Y65-L123 WeakPolarHBondContact O-CD2 3.13Å; Y65-L127 HydrophobicContact CD1-CD2 4.48Å; Y65-L127 HydrophobicContact CE1-CD2 3.95Å; Y65-L127 HydrophobicContact CE2-CD2 4.34Å
66	S	94.3	Very high	95.4	Very high	58 Å²	58	42.6 Å²	42.6	41%	0.406	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.4	43.2	-162.8	-174.8	0	0	0	0	112.7	C62 N63 R350	C62-S66 CarbonylContact O-C 3.56Å; C62-S66 WeakPolarHBondContact O-CA 3.4Å; C62-S66 PolarHBondContact O-N 3Å; N63-S66 PolarHBondContact O-N 3.16Å; S66-R350 PolarHBondContact O-NH2 2.96Å; S66-R350 PolarHBondContact OG-NH1 3.1Å
67	L	95.1	Very high	95.1	Very high	9 Å²	9	39.2 Å²	39.2	5%	0.047	19%	0.19	C	C	.	.			trans	-84.5	119.9	-173.5	-177.2	66.2	0	0	0	112.8	C62 Y65 K70 F73 F107 L123 L127	C62-L67 HydrophobicContact CB-CB 4.45Å; C62-L67 PolarHBondContact O-N 2.74Å; Y65-L67 VanDerWaalsContact C-N 3.28Å; Y65-L67 PolarHBondContact O-N 3.46Å; L67-K70 HydrophobicContact CD2-CB 4.41Å; L67-F73 HydrophobicContact CD1-CE2 4.06Å; L67-F73 HydrophobicContact CD2-CD2 3.56Å; L67-F73 HydrophobicContact CD2-CE2 3.76Å; L67-F73 HydrophobicContact CD2-CG 4.21Å; L67-F73 HydrophobicContact CG-CE2 4.43Å; L67-F107 HydrophobicContact CD2-CZ 4.08Å; L67-L123 HydrophobicContact CD1-CD2 4.29Å; L67-L123 HydrophobicContact CD1-CG 4.47Å; L67-L127 HydrophobicContact CD1-CD1 4.09Å; L67-L127 HydrophobicContact CD2-CD1 4.31Å
68	L	94.6	Very high	94.7	Very high	83 Å²	83	41.4 Å²	41.4	44%	0.435	20%	0.203	S	C	.	.	S	Bend	trans	-90.1	-36.6	177.1	-61.7	-176.8	0	0	0	113.2	K70 E121 I348 R350	L68-K70 PolarHBondContact O-N 2.72Å; L68-E121 WeakPolarHBondContact CB-OE2 3.27Å; L68-E121 PolarHBondContact N-OE2 3.36Å; L68-I348 HydrophobicContact CB-CD1 3.99Å; L68-I348 HydrophobicContact CD1-CB 4.46Å; L68-I348 HydrophobicContact CD1-CD1 4.07Å; L68-I348 HydrophobicContact CD1-CG1 4Å; L68-I348 HydrophobicContact CD1-CG2 3.69Å; L68-R350 HydrophobicContact CD1-CG 4.25Å; L68-R350 VanDerWaalsContact CD1-NE 3.3Å
69	E	95.1	Very high	94.1	Very high	5 Å²	5	40.7 Å²	40.7	2%	0.023	20%	0.199	C	C	.	.			trans	-83.6	42.7	-179.7	-60.1	170.7	107.6	0	0	111.8	D71 Y72 I119 K120 E121 T124 S345 I348	E69-D71 PolarHBondContact O-N 3.25Å; E69-D71 VanDerWaalsContact O-N 3.16Å; E69-Y72 HydrophobicContact CB-CD2 4.09Å; E69-Y72 HydrophobicContact CB-CE2 4.27Å; E69-Y72 PolarHBondContact O-N 2.73Å; E69-I119 WeakPolarHBondContact OE2-CG2 3.48Å; E69-K120 PolarHBondContact OE1-N 2.69Å; E69-E121 VanDerWaalsContact OE2-CB 3.3Å; E69-E121 WeakPolarHBondContact OE2-CB 3.48Å; E69-E121 WeakPolarHBondContact OE2-CG 3.29Å; E69-E121 PolarHBondContact OE2-N 3.39Å; E69-T124 HydrophobicContact CB-CG2 3.94Å; E69-T124 WeakPolarHBondContact OE2-CB 3.31Å; E69-T124 PolarHBondContact OE2-OG1 2.78Å; E69-S345 VanDerWaalsContact OE1-CB 3.25Å; E69-S345 WeakPolarHBondContact OE1-CB 3.38Å; E69-S345 PolarHBondContact OE1-OG 3.11Å; E69-I348 HydrophobicContact CG-CD1 3.97Å
70	K	95.3	Very high	93.4	Very high	81 Å²	81	40.2 Å²	40.2	35%	0.352	20%	0.203	S	C	.	.	G	3₁₀ helix	trans	-61.4	-24.8	-172.1	63.6	-178.4	-178.9	-177.5	0	115	C62 L67 L68 Y72 F73	C62-K70 HydrophobicContact CB-CB 4.41Å; C62-K70 WeakPolarHBondContact SG-CB 3.15Å; L67-K70 HydrophobicContact CD2-CB 4.41Å; L68-K70 PolarHBondContact O-N 2.72Å; K70-Y72 PolarHBondContact O-N 2.77Å; K70-Y72 VanDerWaalsContact O-N 3.11Å; K70-F73 PolarHBondContact O-N 3.1Å
71	D	95.7	Very high	92.5	Very high	29 Å²	29	42.2 Å²	42.2	16%	0.155	21%	0.213	C	C	.	.	G	3₁₀ helix	trans	-62.6	-17.7	-176.3	-64.9	-82	0	0	0	113	E69 F73 F111 K336 V341	E69-D71 PolarHBondContact O-N 3.25Å; E69-D71 VanDerWaalsContact O-N 3.16Å; D71-F73 VanDerWaalsContact C-N 3.32Å; D71-F111 VanDerWaalsContact O-CD2 3.31Å; D71-F111 WeakPolarHBondContact O-CD2 3.48Å; D71-K336 PolarHBondContact OD1-N 3.46Å; D71-K336 IonicContact OD2-NZ 2.84Å; D71-V341 HydrophobicContact CB-CG1 4.23Å; D71-V341 HydrophobicContact CB-CG2 3.41Å; D71-V341 VanDerWaalsContact CB-CG2 3.41Å
72	Y	96.9	Very high	91.6	Very high	5 Å²	5	47.2 Å²	47.2	2%	0.02	23%	0.234	C	C	.	.	G	3₁₀ helix	trans	-77.2	-15.6	174.1	-67.2	-60.2	0	0	0	114.2	E69 K70 K110 F111 P113 I119 T124 F307 V341	E69-Y72 HydrophobicContact CB-CD2 4.09Å; E69-Y72 HydrophobicContact CB-CE2 4.27Å; E69-Y72 PolarHBondContact O-N 2.73Å; K70-Y72 PolarHBondContact O-N 2.77Å; K70-Y72 VanDerWaalsContact O-N 3.11Å; Y72-K110 PolarHBondContact O-N 2.75Å; Y72-F111 HydrophobicContact CD1-CB 4.48Å; Y72-F111 VanDerWaalsContact CD1-O 3.27Å; Y72-F111 WeakPolarHBondContact CD1-O 3.41Å; Y72-F111 PolarHBondContact O-N 3.29Å; Y72-P113 HydrophobicContact CE1-CB 4.07Å; Y72-I119 HydrophobicContact CE2-CD1 4.38Å; Y72-I119 HydrophobicContact CE2-CG1 4.23Å; Y72-T124 HydrophobicContact CD2-CG2 4.17Å; Y72-F307 HydrophobicContact CD1-CZ 4.1Å; Y72-F307 HydrophobicContact CE1-CZ 4.01Å; Y72-V341 HydrophobicContact CD2-CG1 4.19Å; Y72-V341 HydrophobicContact CE1-CG1 4.17Å; Y72-V341 HydrophobicContact CE2-CG1 3.55Å
73	F	97.6	Very high	90.9	Very high	12 Å²	12	49.7 Å²	49.7	5%	0.053	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	162.3	-169.2	-55.4	-91.2	0	0	0	112.2	L39 L67 K70 D71 F107 R108 V109 T124 L127	L39-F73 HydrophobicContact CD1-CD1 4.18Å; L39-F73 HydrophobicContact CD1-CE1 3.99Å; L67-F73 HydrophobicContact CD1-CE2 4.06Å; L67-F73 HydrophobicContact CD2-CD2 3.56Å; L67-F73 HydrophobicContact CD2-CE2 3.76Å; L67-F73 HydrophobicContact CD2-CG 4.21Å; L67-F73 HydrophobicContact CG-CE2 4.43Å; K70-F73 PolarHBondContact O-N 3.1Å; D71-F73 VanDerWaalsContact C-N 3.32Å; F73-F107 HydrophobicContact CB-CD2 4.48Å; F73-F107 HydrophobicContact CB-CE1 4.2Å; F73-F107 HydrophobicContact CB-CE2 3.47Å; F73-F107 VanDerWaalsContact CB-CE2 3.47Å; F73-F107 HydrophobicContact CB-CZ 3.3Å; F73-F107 AromaticContact CD1-CE1 3.78Å; F73-F107 HydrophobicContact CD1-CE1 3.78Å; F73-F107 AromaticContact CD1-CZ 3.71Å; F73-F107 HydrophobicContact CD1-CZ 3.71Å; F73-F107 HydrophobicContact CD2-CZ 4.33Å; F73-F107 HydrophobicContact CE1-CE1 4.45Å; F73-F107 HydrophobicContact CG-CE1 4.1Å; F73-F107 HydrophobicContact CG-CE2 4.22Å; F73-F107 AromaticContact CG-CZ 3.52Å; F73-F107 HydrophobicContact CG-CZ 3.52Å; F73-R108 WeakPolarHBondContact CA-O 3.45Å; F73-V109 HydrophobicContact CD1-CG2 4.05Å; F73-V109 HydrophobicContact CE1-CG2 3.82Å; F73-T124 HydrophobicContact CE2-CG2 3.99Å; F73-T124 HydrophobicContact CZ-CG2 4.1Å; F73-L127 HydrophobicContact CE1-CB 3.6Å; F73-L127 HydrophobicContact CE1-CD1 4.13Å; F73-L127 HydrophobicContact CZ-CB 3.69Å; F73-L127 HydrophobicContact CZ-CD1 3.95Å
74	G	96.5	Very high	90.4	Very high	6 Å²	6	46.5 Å²	46.5	6%	0.062	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.7	170.9	175.1	0	0	0	0	0	111.9	F107 R108	G74-F107 WeakPolarHBondContact O-CA 3.31Å; G74-R108 PolarHBondContact N-O 3.3Å; G74-R108 PolarHBondContact O-N 3.2Å
75	I	96.5	Very high	90.2	Very high	1 Å²	1	41.9 Å²	41.9	1%	0.005	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	129.4	171.9	-62.5	175.1	0	0	0	107.6	L57 I58 I61 L87 M105 C106 F107	L57-I75 HydrophobicContact CB-CD1 3.61Å; I58-I75 HydrophobicContact CG1-CD1 4.06Å; I58-I75 HydrophobicContact CG1-CG1 4.31Å; I61-I75 HydrophobicContact CG1-CD1 4.32Å; I75-L87 HydrophobicContact CB-CB 4.14Å; I75-L87 HydrophobicContact CB-CD2 4.15Å; I75-L87 HydrophobicContact CD1-CD2 4.41Å; I75-L87 HydrophobicContact CG2-CB 4.37Å; I75-L87 HydrophobicContact CG2-CD2 4.17Å; I75-L87 WeakPolarHBondContact O-CB 3.1Å; I75-L87 PolarHBondContact O-N 3.05Å; I75-M105 HydrophobicContact CG2-CB 3.57Å; I75-M105 HydrophobicContact CG2-CG 4.19Å; I75-M105 HydrophobicContact CG2-SD 3.63Å; I75-C106 CarbonylContact C-O 3.52Å; I75-C106 WeakPolarHBondContact CA-O 3.32Å; I75-F107 HydrophobicContact CG1-CD2 4.23Å
76	R	93.6	Very high	90.2	Very high	37 Å²	37	42.7 Å²	42.7	14%	0.14	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115	150	175.9	70.6	176.2	-166.8	-172	-0.4	111.5	H85 W86 M105 C106 R108	R76-H85 CarbonylContact C-O 3.58Å; R76-H85 WeakPolarHBondContact CA-O 3.05Å; R76-H85 WeakPolarHBondContact CB-O 3.46Å; R76-W86 HydrophobicContact CB-CD2 4.39Å; R76-W86 HydrophobicContact CB-CE3 3.93Å; R76-W86 HydrophobicContact CB-CZ3 4.01Å; R76-M105 CarbonylContact O-C 3.58Å; R76-M105 WeakPolarHBondContact O-CA 3.44Å; R76-C106 HydrophobicContact CG-CB 3.85Å; R76-C106 PolarHBondContact N-O 3.07Å; R76-C106 PolarHBondContact O-N 3.49Å; R76-R108 HydrophobicContact CG-CG 4.04Å
77	Y	90.7	Very high	90.2	Very high	24 Å²	24	40.1 Å²	40.1	9%	0.094	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	165	171.4	64.9	-85.7	0	0	0	110	R84 H85 L87 Q96 M97	Y77-R84 WeakPolarHBondContact O-CA 3.46Å; Y77-H85 HydrophobicContact CD1-CB 4.23Å; Y77-H85 HydrophobicContact CD2-CB 4.35Å; Y77-H85 HydrophobicContact CE1-CB 3.68Å; Y77-H85 HydrophobicContact CE2-CB 3.82Å; Y77-H85 AromaticContact CE2-CD2 3.95Å; Y77-H85 VanDerWaalsContact CZ-CB 3.45Å; Y77-H85 PolarHBondContact N-O 3.3Å; Y77-H85 PolarHBondContact O-N 2.89Å; Y77-L87 HydrophobicContact CE1-CD1 4.41Å; Y77-Q96 PolarHBondContact OH-O 2.67Å; Y77-M97 HydrophobicContact CD1-SD 4.08Å; Y77-M97 HydrophobicContact CD2-CE 4.24Å; Y77-M97 HydrophobicContact CD2-SD 3.72Å; Y77-M97 HydrophobicContact CE1-SD 4.43Å; Y77-M97 HydrophobicContact CE2-SD 4.1Å; Y77-M97 HydrophobicContact CG-CE 4.32Å; Y77-M97 HydrophobicContact CG-SD 3.71Å
78	V	86.4	Confident	90.1	Very high	46 Å²	46	42.5 Å²	42.5	28%	0.279	20%	0.203	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	129.3	176.2	-175.9	0	0	0	0	107.3	Q83 R84 L373	V78-Q83 WeakPolarHBondContact CA-O 3.18Å; V78-R84 HydrophobicContact CG2-CG 4.25Å; V78-L373 HydrophobicContact CG1-CD2 4.27Å
79	D	82.6	Confident	90	Very high	13 Å²	13	40 Å²	40	7%	0.07	19%	0.192	C	C	.	.			trans	-80.9	171.7	176.1	72.3	7.8	0	0	0	111.7	E81 K82 Q83 H85 K98	D79-E81 PolarHBondContact O-N 3.41Å; D79-E81 VanDerWaalsContact OD1-C 3.25Å; D79-E81 WeakPolarHBondContact OD1-CA 3.12Å; D79-E81 WeakPolarHBondContact OD1-CB 3.09Å; D79-E81 PolarHBondContact OD1-N 3.31Å; D79-E81 VanDerWaalsContact OD1-N 3.1Å; D79-K82 PolarHBondContact O-N 2.9Å; D79-K82 PolarHBondContact OD1-N 3.12Å; D79-Q83 PolarHBondContact N-O 3.24Å; D79-Q83 WeakPolarHBondContact OD1-CA 3.47Å; D79-Q83 WeakPolarHBondContact OD1-CB 3.11Å; D79-Q83 PolarHBondContact OD1-N 2.9Å; D79-Q83 WeakPolarHBondContact OD2-CB 2.99Å; D79-H85 IonicContact OD2-CD2 3.95Å; D79-H85 IonicContact OD2-CE1 2.66Å; D79-H85 IonicContact OD2-NE2 3.62Å; D79-H85 PolarHBondContact OD2-NE2 3.25Å; D79-K98 HydrophobicContact CB-CD 4.38Å
80	P	82.3	Confident	89.8	Confident	70 Å²	70	44.8 Å²	44.8	46%	0.455	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.5	-29.3	177.4	-24.8	35.8	0	0	0	113.3	K82 K98	P80-K82 PolarHBondContact O-N 3.3Å; P80-K98 HydrophobicContact CG-CB 4.09Å
81	E	77.6	Confident	89.7	Confident	109 Å²	109	45.3 Å²	45.3	51%	0.509	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.5	7.7	176.1	-58.1	76.9	-124.7	0	0	113.6	D79 Q83 K98	D79-E81 PolarHBondContact O-N 3.41Å; D79-E81 VanDerWaalsContact OD1-C 3.25Å; D79-E81 WeakPolarHBondContact OD1-CA 3.12Å; D79-E81 WeakPolarHBondContact OD1-CB 3.09Å; D79-E81 PolarHBondContact OD1-N 3.31Å; D79-E81 VanDerWaalsContact OD1-N 3.1Å; E81-Q83 PolarHBondContact O-N 2.91Å; E81-K98 IonicContact OE2-NZ 2.73Å; E81-K98 PolarHBondContact OE2-NZ 3.32Å
82	K	76.9	Confident	89.6	Confident	106 Å²	106	44.8 Å²	44.8	46%	0.461	22%	0.218	S	C	.	.	S	Bend	trans	64.9	14.5	-179.5	-50.3	-60.3	-178.1	-178.3	0	114.6	D79 P80 L373	D79-K82 PolarHBondContact O-N 2.9Å; D79-K82 PolarHBondContact OD1-N 3.12Å; P80-K82 PolarHBondContact O-N 3.3Å; K82-L373 HydrophobicContact CD-CD2 4.44Å
83	Q	79.6	Confident	89.5	Confident	56 Å²	56	44.5 Å²	44.5	26%	0.262	22%	0.217	S	C	.	.			trans	-81.5	136.4	172.3	-174.2	63.8	32.2	0	0	110	V78 D79 E81 H85 H296	V78-Q83 WeakPolarHBondContact CA-O 3.18Å; D79-Q83 PolarHBondContact N-O 3.24Å; D79-Q83 WeakPolarHBondContact OD1-CA 3.47Å; D79-Q83 WeakPolarHBondContact OD1-CB 3.11Å; D79-Q83 PolarHBondContact OD1-N 2.9Å; D79-Q83 WeakPolarHBondContact OD2-CB 2.99Å; E81-Q83 PolarHBondContact O-N 2.91Å; Q83-H85 PolarHBondContact O-CD2 3.01Å; Q83-H296 PolarHBondContact NE2-CD2 3.44Å; Q83-H296 PolarHBondContact NE2-NE2 3.32Å
84	R	85.2	Confident	89.2	Confident	58 Å²	58	47.6 Å²	47.6	22%	0.219	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	134.7	176.7	-64.3	170.1	-174.4	161.7	4.7	109.4	Y77 V78 D223 H296 I374	Y77-R84 WeakPolarHBondContact O-CA 3.46Å; V78-R84 HydrophobicContact CG2-CG 4.25Å; R84-D223 IonicContact NH1-OD1 3.51Å; R84-H296 PolarHBondContact O-CE1 3.06Å; R84-H296 PolarHBondContact O-NE2 3.04Å; R84-I374 VanDerWaalsContact NH2-C 3.27Å; R84-I374 PolarHBondContact NH2-O 3.11Å
85	H	87.9	Confident	88.9	Confident	39 Å²	39	55.3 Å²	55.3	18%	0.181	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	145.1	177.2	-62.2	-79.2	0	0	0	111.1	R76 Y77 D79 Q83 H296	R76-H85 CarbonylContact C-O 3.58Å; R76-H85 WeakPolarHBondContact CA-O 3.05Å; R76-H85 WeakPolarHBondContact CB-O 3.46Å; Y77-H85 HydrophobicContact CD1-CB 4.23Å; Y77-H85 HydrophobicContact CD2-CB 4.35Å; Y77-H85 HydrophobicContact CE1-CB 3.68Å; Y77-H85 HydrophobicContact CE2-CB 3.82Å; Y77-H85 AromaticContact CE2-CD2 3.95Å; Y77-H85 VanDerWaalsContact CZ-CB 3.45Å; Y77-H85 PolarHBondContact N-O 3.3Å; Y77-H85 PolarHBondContact O-N 2.89Å; D79-H85 IonicContact OD2-CD2 3.95Å; D79-H85 IonicContact OD2-CE1 2.66Å; D79-H85 IonicContact OD2-NE2 3.62Å; D79-H85 PolarHBondContact OD2-NE2 3.25Å; Q83-H85 PolarHBondContact O-CD2 3.01Å; H85-H296 AromaticContact CE1-ND1 3.79Å; H85-H296 AromaticContact ND1-CE1 3.88Å; H85-H296 AromaticContact ND1-ND1 3.29Å; H85-H296 PolarHBondContact ND1-ND1 3Å
86	W	93	Very high	88.7	Confident	49 Å²	49	56 Å²	56	19%	0.186	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	134.8	167.1	-67.1	104.8	0	0	0	109.5	R76 E88 R108 V109 K110	R76-W86 HydrophobicContact CB-CD2 4.39Å; R76-W86 HydrophobicContact CB-CE3 3.93Å; R76-W86 HydrophobicContact CB-CZ3 4.01Å; W86-E88 PolarHBondContact O-N 2.84Å; W86-R108 HydrophobicContact CH2-CB 3.97Å; W86-R108 HydrophobicContact CZ3-CB 4.25Å; W86-V109 WeakPolarHBondContact CH2-O 3.44Å; W86-K110 HydrophobicContact CD2-CB 4.49Å; W86-K110 HydrophobicContact CD2-CD 3.91Å; W86-K110 HydrophobicContact CD2-CG 3.95Å; W86-K110 HydrophobicContact CE3-CB 4.25Å; W86-K110 HydrophobicContact CE3-CD 4.02Å; W86-K110 HydrophobicContact CE3-CG 4.15Å; W86-K110 HydrophobicContact CG-CD 4.24Å; W86-K110 HydrophobicContact CH2-CB 3.7Å; W86-K110 HydrophobicContact CH2-CG 4.1Å; W86-K110 HydrophobicContact CZ2-CB 3.97Å; W86-K110 HydrophobicContact CZ2-CG 3.9Å; W86-K110 HydrophobicContact CZ3-CB 3.86Å; W86-K110 HydrophobicContact CZ3-CD 4.47Å; W86-K110 HydrophobicContact CZ3-CG 4.22Å
87	L	94.3	Very high	88.5	Confident	5 Å²	5	55 Å²	55	3%	0.026	26%	0.263	C	S	.	.	P	Polyproline II helix	trans	-64.9	120.9	174.4	-171.9	69.4	0	0	0	109.5	L57 I75 Y77 I93 M105	L57-L87 HydrophobicContact CB-CD2 4.32Å; L57-L87 HydrophobicContact CD1-CD2 4.16Å; I75-L87 HydrophobicContact CB-CB 4.14Å; I75-L87 HydrophobicContact CB-CD2 4.15Å; I75-L87 HydrophobicContact CD1-CD2 4.41Å; I75-L87 HydrophobicContact CG2-CB 4.37Å; I75-L87 HydrophobicContact CG2-CD2 4.17Å; I75-L87 WeakPolarHBondContact O-CB 3.1Å; I75-L87 PolarHBondContact O-N 3.05Å; Y77-L87 HydrophobicContact CE1-CD1 4.41Å; L87-I93 HydrophobicContact CD1-CG1 4.24Å; L87-I93 HydrophobicContact CD2-CG1 4.47Å; L87-M105 HydrophobicContact CD1-CE 4.21Å; L87-M105 HydrophobicContact CD2-SD 4.27Å
88	E	92.9	Very high	88.1	Confident	59 Å²	59	59.4 Å²	59.4	28%	0.276	28%	0.282	S	S	.	.	P	Polyproline II helix	trans	-78.3	125.3	177.6	-61.1	-172.5	-132.8	0	0	109.5	W86 N90 K91 Q96 K299	W86-E88 PolarHBondContact O-N 2.84Å; E88-N90 VanDerWaalsContact C-N 3.35Å; E88-N90 PolarHBondContact O-N 3.22Å; E88-K91 HydrophobicContact CB-CB 4.29Å; E88-K91 HydrophobicContact CB-CD 4.14Å; E88-K91 HydrophobicContact CB-CG 4.29Å; E88-K91 HydrophobicContact CG-CD 4.43Å; E88-K91 PolarHBondContact O-N 2.68Å; E88-K91 IonicContact OE1-NZ 3.79Å; E88-K91 PolarHBondContact OE1-NZ 3.3Å; E88-K91 WeakPolarHBondContact OE2-CD 3.15Å; E88-K91 WeakPolarHBondContact OE2-CE 3.49Å; E88-K91 IonicContact OE2-NZ 2.71Å; E88-K91 PolarHBondContact OE2-NZ 3.15Å; E88-Q96 VanDerWaalsContact CB-OE1 3.32Å; E88-Q96 PolarHBondContact O-NE2 2.82Å; E88-K299 IonicContact OE1-NZ 2.58Å
89	P	93	Very high	87.9	Confident	31 Å²	31	59.3 Å²	59.3	20%	0.201	28%	0.284	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.2	-35.7	-172.4	22.4	-32.5	0	0	0	113.1	G54 Q55 I58	G54-P89 PolarHBondContact N-O 3.37Å; Q55-P89 HydrophobicContact CB-CB 4.11Å; Q55-P89 WeakPolarHBondContact CB-O 3.13Å; Q55-P89 PolarHBondContact N-O 3.19Å; I58-P89 HydrophobicContact CD1-CB 4.13Å
90	N	91.1	Very high	87.9	Confident	104 Å²	104	66.8 Å²	66.8	56%	0.556	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.6	-5.5	-172.5	-63.9	-47.7	0	0	0	114.1	E88 S334	E88-N90 VanDerWaalsContact C-N 3.35Å; E88-N90 PolarHBondContact O-N 3.22Å; N90-S334 PolarHBondContact ND2-OG 2.66Å
91	K	92.4	Very high	88	Confident	92 Å²	92	66 Å²	66	40%	0.4	31%	0.313	S	S	.	.	S	Bend	trans	-104.5	147.7	-179.4	-68.2	-177.3	-178.5	169.5	0	110.7	K53 G54 E88 Q96	K53-K91 CarbonylContact C-O 3.6Å; K53-K91 WeakPolarHBondContact CA-O 3.15Å; G54-K91 PolarHBondContact N-O 3.33Å; E88-K91 HydrophobicContact CB-CB 4.29Å; E88-K91 HydrophobicContact CB-CD 4.14Å; E88-K91 HydrophobicContact CB-CG 4.29Å; E88-K91 HydrophobicContact CG-CD 4.43Å; E88-K91 PolarHBondContact O-N 2.68Å; E88-K91 IonicContact OE1-NZ 3.79Å; E88-K91 PolarHBondContact OE1-NZ 3.3Å; E88-K91 WeakPolarHBondContact OE2-CD 3.15Å; E88-K91 WeakPolarHBondContact OE2-CE 3.49Å; E88-K91 IonicContact OE2-NZ 2.71Å; E88-K91 PolarHBondContact OE2-NZ 3.15Å; K91-Q96 HydrophobicContact CB-CG 3.97Å; K91-Q96 HydrophobicContact CD-CG 4.43Å; K91-Q96 PolarHBondContact O-NE2 2.84Å
92	S	94.4	Very high	88.5	Confident	18 Å²	18	65.1 Å²	65.1	13%	0.126	32%	0.316	C	S	.	.	B	Isolated β-bridge	trans	-59.3	137.9	171.2	55.5	0	0	0	0	110.3	R50 T52 F94 K95 Q96	R50-S92 WeakPolarHBondContact O-CB 3.26Å; T52-S92 CarbonylContact O-C 3.55Å; T52-S92 WeakPolarHBondContact O-CA 2.98Å; S92-F94 VanDerWaalsContact C-N 3.31Å; S92-F94 PolarHBondContact O-N 2.82Å; S92-K95 PolarHBondContact O-N 3.04Å; S92-K95 VanDerWaalsContact OG-CB 3.22Å; S92-K95 WeakPolarHBondContact OG-CB 3.4Å; S92-K95 VanDerWaalsContact OG-CD 3.29Å; S92-K95 WeakPolarHBondContact OG-CD 3.19Å; S92-K95 WeakPolarHBondContact OG-CG 3.24Å; S92-Q96 WeakPolarHBondContact O-CG 3.46Å; S92-Q96 PolarHBondContact O-N 3.43Å; S92-Q96 PolarHBondContact O-NE2 2.58Å
93	I	94.2	Very high	89.2	Confident	0 Å²	0	60.1 Å²	60.1	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-60.8	-44.2	179.4	-65	152.4	0	0	0	110.2	I48 T52 L57 L87 K95 Q96 M97 Y103 M105	I48-I93 HydrophobicContact CD1-CB 3.88Å; I48-I93 HydrophobicContact CD1-CD1 3.76Å; I48-I93 HydrophobicContact CD1-CG1 4.43Å; I48-I93 HydrophobicContact CD1-CG2 3.57Å; I48-I93 HydrophobicContact CG2-CD1 4.36Å; T52-I93 HydrophobicContact CG2-CD1 3.88Å; T52-I93 PolarHBondContact O-N 2.78Å; L57-I93 HydrophobicContact CD1-CD1 3.53Å; L57-I93 HydrophobicContact CD1-CG1 4.21Å; L57-I93 HydrophobicContact CG-CD1 3.63Å; L87-I93 HydrophobicContact CD1-CG1 4.24Å; L87-I93 HydrophobicContact CD2-CG1 4.47Å; I93-K95 VanDerWaalsContact C-N 3.34Å; I93-K95 PolarHBondContact O-N 3.43Å; I93-Q96 WeakPolarHBondContact O-CB 3.47Å; I93-Q96 PolarHBondContact O-N 2.74Å; I93-M97 HydrophobicContact CG2-CG 3.9Å; I93-M97 WeakPolarHBondContact O-CG 3.13Å; I93-M97 PolarHBondContact O-N 2.62Å; I93-Y103 HydrophobicContact CG2-CD2 4.23Å; I93-Y103 HydrophobicContact CG2-CE2 4.31Å; I93-M105 HydrophobicContact CG2-CE 3.69Å
94	F	91.9	Very high	89.7	Confident	77 Å²	77	61.8 Å²	61.8	34%	0.338	31%	0.309	S	S	.	.	H	α-helix	trans	-55.1	-44.7	179.4	-177.7	-99.4	0	0	0	113.1	M32 R50 S92 Q96 M97 Y103	M32-F94 HydrophobicContact CE-CB 4.45Å; M32-F94 HydrophobicContact CE-CD2 4.06Å; M32-F94 HydrophobicContact SD-CD2 3.63Å; M32-F94 HydrophobicContact SD-CE2 4.16Å; R50-F94 HydrophobicContact CB-CB 4.44Å; R50-F94 HydrophobicContact CB-CG 4.38Å; R50-F94 HydrophobicContact CG-CD2 4.25Å; R50-F94 HydrophobicContact CG-CG 4.25Å; R50-F94 WeakPolarHBondContact O-CB 3.49Å; S92-F94 VanDerWaalsContact C-N 3.31Å; S92-F94 PolarHBondContact O-N 2.82Å; F94-Q96 PolarHBondContact O-N 3.38Å; F94-M97 PolarHBondContact O-N 3.38Å; F94-Y103 WeakPolarHBondContact CD2-OH 3.38Å
95	K	91.3	Very high	90.1	Very high	167 Å²	167	59.1 Å²	59.1	73%	0.726	30%	0.299	S	S	*	.	H	α-helix	trans	-70.2	-16.7	177.6	-65.4	-178.7	-176.4	-175.1	0	114	S92 I93	S92-K95 PolarHBondContact O-N 3.04Å; S92-K95 VanDerWaalsContact OG-CB 3.22Å; S92-K95 WeakPolarHBondContact OG-CB 3.4Å; S92-K95 VanDerWaalsContact OG-CD 3.29Å; S92-K95 WeakPolarHBondContact OG-CD 3.19Å; S92-K95 WeakPolarHBondContact OG-CG 3.24Å; I93-K95 VanDerWaalsContact C-N 3.34Å; I93-K95 PolarHBondContact O-N 3.43Å
96	Q	91.8	Very high	90.5	Very high	17 Å²	17	58.6 Å²	58.6	8%	0.079	30%	0.299	C	S	.	.	H	α-helix	trans	-91.9	-32.1	178.5	-66.2	-179.1	75.1	0	0	111.9	Y77 E88 K91 S92 I93 F94 K98	Y77-Q96 PolarHBondContact OH-O 2.67Å; E88-Q96 VanDerWaalsContact CB-OE1 3.32Å; E88-Q96 PolarHBondContact O-NE2 2.82Å; K91-Q96 HydrophobicContact CB-CG 3.97Å; K91-Q96 HydrophobicContact CD-CG 4.43Å; K91-Q96 PolarHBondContact O-NE2 2.84Å; S92-Q96 WeakPolarHBondContact O-CG 3.46Å; S92-Q96 PolarHBondContact O-N 3.43Å; S92-Q96 PolarHBondContact O-NE2 2.58Å; I93-Q96 WeakPolarHBondContact O-CB 3.47Å; I93-Q96 PolarHBondContact O-N 2.74Å; F94-Q96 PolarHBondContact O-N 3.38Å; Q96-K98 PolarHBondContact O-N 2.97Å
97	M	89	Confident	90.7	Very high	15 Å²	15	56.3 Å²	56.3	7%	0.074	29%	0.291	C	S	.	.			trans	-80.4	114.3	-178.7	-63.7	-55.9	-72.1	0	0	110.4	Y77 I93 F94 Y103 M105	Y77-M97 HydrophobicContact CD1-SD 4.08Å; Y77-M97 HydrophobicContact CD2-CE 4.24Å; Y77-M97 HydrophobicContact CD2-SD 3.72Å; Y77-M97 HydrophobicContact CE1-SD 4.43Å; Y77-M97 HydrophobicContact CE2-SD 4.1Å; Y77-M97 HydrophobicContact CG-CE 4.32Å; Y77-M97 HydrophobicContact CG-SD 3.71Å; I93-M97 HydrophobicContact CG2-CG 3.9Å; I93-M97 WeakPolarHBondContact O-CG 3.13Å; I93-M97 PolarHBondContact O-N 2.62Å; F94-M97 PolarHBondContact O-N 3.38Å; M97-Y103 HydrophobicContact CB-CD1 3.95Å; M97-Y103 HydrophobicContact CB-CE1 3.43Å; M97-Y103 VanDerWaalsContact CB-CE1 3.43Å; M97-Y103 HydrophobicContact CB-CE2 4.32Å; M97-Y103 HydrophobicContact CE-CD1 3.6Å; M97-Y103 HydrophobicContact CE-CE1 4.28Å; M97-Y103 HydrophobicContact CE-CG 3.97Å; M97-Y103 HydrophobicContact CG-CD1 3.87Å; M97-Y103 HydrophobicContact CG-CD2 4.17Å; M97-Y103 HydrophobicContact CG-CE1 3.8Å; M97-Y103 HydrophobicContact CG-CE2 4.1Å; M97-Y103 HydrophobicContact CG-CG 4.05Å; M97-M105 HydrophobicContact CE-CE 3.99Å; M97-M105 HydrophobicContact CG-CE 3.98Å; M97-M105 HydrophobicContact SD-CE 3.39Å; M97-M105 WeakPolarHBondContact SD-CE 3.33Å
98	K	82.8	Confident	90.8	Very high	116 Å²	116	56.5 Å²	56.5	50%	0.504	29%	0.291	S	S	.	.			trans	-77.4	-27	171.5	-63.2	-170.8	-177.9	-175	0	113	D79 P80 E81 Q96	D79-K98 HydrophobicContact CB-CD 4.38Å; P80-K98 HydrophobicContact CG-CB 4.09Å; E81-K98 IonicContact OE2-NZ 2.73Å; E81-K98 PolarHBondContact OE2-NZ 3.32Å; Q96-K98 PolarHBondContact O-N 2.97Å
99	S	81.7	Confident	91	Very high	44 Å²	44	53.9 Å²	53.9	31%	0.308	28%	0.279	S	S	.	.	S	Bend	trans	-75.9	157.2	178.2	52	0	0	0	0	111.6	Y103	S99-Y103 VanDerWaalsContact O-CE1 3.32Å; S99-Y103 WeakPolarHBondContact O-CE1 3.48Å
100	H	83.1	Confident	91.2	Very high	171 Å²	171	54.1 Å²	54.1	79%	0.792	28%	0.277	S	S	*	.	P	Polyproline II helix	trans	-76.7	147.5	169.5	-71	-58.5	0	0	0	111
101	P	84.3	Confident	91.5	Very high	53 Å²	53	49.6 Å²	49.6	34%	0.344	25%	0.252	S	S	.	.	S	Bend	trans	-56.7	153.2	172.3	-20.9	29.7	0	0	0	112.6	M32 Y103	M32-P101 HydrophobicContact CB-CB 4.18Å; M32-P101 HydrophobicContact CB-CG 4.15Å; M32-P101 HydrophobicContact CG-CB 4.21Å; M32-P101 HydrophobicContact CG-CG 3.74Å; M32-P101 HydrophobicContact SD-CG 3.75Å; P101-Y103 HydrophobicContact CB-CE1 4.36Å; P101-Y103 HydrophobicContact CG-CE1 3.89Å; P101-Y103 HydrophobicContact CG-CE2 4.17Å
102	P	87.7	Confident	91.7	Very high	90 Å²	90	46 Å²	46	58%	0.584	24%	0.236	S	C	*	.	S	Bend	cis	-73.9	146.8	5.1	30.9	-35.7	0	0	0	113.1	K33	K33-P102 HydrophobicContact CB-CB 4.32Å; K33-P102 WeakPolarHBondContact O-CA 3.43Å
103	Y	91.3	Very high	91.7	Very high	2 Å²	2	45.3 Å²	45.3	1%	0.008	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	130.6	-180	-61	-41.3	0	0	0	111.4	M32 K33 C34 T35 I48 I93 F94 M97 S99 P101	M32-Y103 HydrophobicContact CB-CE2 4.44Å; M32-Y103 HydrophobicContact SD-CE2 4.03Å; K33-Y103 PolarHBondContact O-N 3.09Å; C34-Y103 CarbonylContact C-O 3.57Å; C34-Y103 WeakPolarHBondContact CA-O 3.34Å; T35-Y103 PolarHBondContact N-O 3.46Å; I48-Y103 HydrophobicContact CD1-CD2 3.98Å; I48-Y103 HydrophobicContact CD1-CE2 4.17Å; I93-Y103 HydrophobicContact CG2-CD2 4.23Å; I93-Y103 HydrophobicContact CG2-CE2 4.31Å; F94-Y103 WeakPolarHBondContact CD2-OH 3.38Å; M97-Y103 HydrophobicContact CB-CD1 3.95Å; M97-Y103 HydrophobicContact CB-CE1 3.43Å; M97-Y103 VanDerWaalsContact CB-CE1 3.43Å; M97-Y103 HydrophobicContact CB-CE2 4.32Å; M97-Y103 HydrophobicContact CE-CD1 3.6Å; M97-Y103 HydrophobicContact CE-CE1 4.28Å; M97-Y103 HydrophobicContact CE-CG 3.97Å; M97-Y103 HydrophobicContact CG-CD1 3.87Å; M97-Y103 HydrophobicContact CG-CD2 4.17Å; M97-Y103 HydrophobicContact CG-CE1 3.8Å; M97-Y103 HydrophobicContact CG-CE2 4.1Å; M97-Y103 HydrophobicContact CG-CG 4.05Å; S99-Y103 VanDerWaalsContact O-CE1 3.32Å; S99-Y103 WeakPolarHBondContact O-CE1 3.48Å; P101-Y103 HydrophobicContact CB-CE1 4.36Å; P101-Y103 HydrophobicContact CG-CE1 3.89Å; P101-Y103 HydrophobicContact CG-CE2 4.17Å
104	T	90.8	Very high	91.5	Very high	91 Å²	91	50.7 Å²	50.7	56%	0.558	26%	0.256	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-113.4	127.2	171.3	-54.7	0	0	0	0	110	T35	T35-T104 WeakPolarHBondContact O-CA 3.41Å
105	M	94.1	Very high	91.3	Very high	1 Å²	1	50.3 Å²	50.3	1%	0.005	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	170.8	-178.8	-55.2	-178.3	174.1	0	0	110.4	T35 R37 L57 I75 R76 L87 I93 M97	T35-M105 PolarHBondContact O-N 3.17Å; R37-M105 PolarHBondContact N-O 2.85Å; L57-M105 HydrophobicContact CD1-CE 4.43Å; L57-M105 HydrophobicContact CD1-SD 3.92Å; I75-M105 HydrophobicContact CG2-CB 3.57Å; I75-M105 HydrophobicContact CG2-CG 4.19Å; I75-M105 HydrophobicContact CG2-SD 3.63Å; R76-M105 CarbonylContact O-C 3.58Å; R76-M105 WeakPolarHBondContact O-CA 3.44Å; L87-M105 HydrophobicContact CD1-CE 4.21Å; L87-M105 HydrophobicContact CD2-SD 4.27Å; I93-M105 HydrophobicContact CG2-CE 3.69Å; M97-M105 HydrophobicContact CE-CE 3.99Å; M97-M105 HydrophobicContact CG-CE 3.98Å; M97-M105 HydrophobicContact SD-CE 3.39Å; M97-M105 WeakPolarHBondContact SD-CE 3.33Å
106	C	95.5	Very high	91.2	Very high	28 Å²	28	42.4 Å²	42.4	19%	0.189	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	128.9	179	-65.4	0	0	0	0	110.8	R37 I75 R76 R108	R37-C106 CarbonylContact O-C 3.41Å; R37-C106 WeakPolarHBondContact O-CA 3.45Å; I75-C106 CarbonylContact C-O 3.52Å; I75-C106 WeakPolarHBondContact CA-O 3.32Å; R76-C106 HydrophobicContact CG-CB 3.85Å; R76-C106 PolarHBondContact N-O 3.07Å; R76-C106 PolarHBondContact O-N 3.49Å; C106-R108 HydrophobicContact CB-CG 4.06Å
107	F	97.4	Very high	91.1	Very high	2 Å²	2	46.7 Å²	46.7	1%	0.009	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	123.6	167.5	-178.9	-108.3	0	0	0	109.5	I36 R37 L38 L39 I61 Y65 L67 F73 G74 I75 L127	I36-F107 HydrophobicContact CG2-CB 3.94Å; R37-F107 PolarHBondContact O-N 2.86Å; L38-F107 HydrophobicContact CD2-CB 4.16Å; L39-F107 HydrophobicContact CD1-CD1 4.02Å; L39-F107 HydrophobicContact CD1-CE1 4.03Å; L39-F107 HydrophobicContact CG-CD1 4.26Å; I61-F107 HydrophobicContact CB-CD2 4.41Å; I61-F107 HydrophobicContact CG2-CB 4.33Å; I61-F107 HydrophobicContact CG2-CD1 4.13Å; I61-F107 HydrophobicContact CG2-CD2 3.66Å; I61-F107 HydrophobicContact CG2-CE1 4.32Å; I61-F107 HydrophobicContact CG2-CE2 3.87Å; I61-F107 HydrophobicContact CG2-CG 3.78Å; I61-F107 HydrophobicContact CG2-CZ 4.19Å; Y65-F107 HydrophobicContact CD2-CE1 4.39Å; Y65-F107 HydrophobicContact CE2-CD1 4.21Å; Y65-F107 HydrophobicContact CE2-CE1 4.09Å; L67-F107 HydrophobicContact CD2-CZ 4.08Å; F73-F107 HydrophobicContact CB-CD2 4.48Å; F73-F107 HydrophobicContact CB-CE1 4.2Å; F73-F107 HydrophobicContact CB-CE2 3.47Å; F73-F107 VanDerWaalsContact CB-CE2 3.47Å; F73-F107 HydrophobicContact CB-CZ 3.3Å; F73-F107 AromaticContact CD1-CE1 3.78Å; F73-F107 HydrophobicContact CD1-CE1 3.78Å; F73-F107 AromaticContact CD1-CZ 3.71Å; F73-F107 HydrophobicContact CD1-CZ 3.71Å; F73-F107 HydrophobicContact CD2-CZ 4.33Å; F73-F107 HydrophobicContact CE1-CE1 4.45Å; F73-F107 HydrophobicContact CG-CE1 4.1Å; F73-F107 HydrophobicContact CG-CE2 4.22Å; F73-F107 AromaticContact CG-CZ 3.52Å; F73-F107 HydrophobicContact CG-CZ 3.52Å; G74-F107 WeakPolarHBondContact O-CA 3.31Å; I75-F107 HydrophobicContact CG1-CD2 4.23Å; F107-L127 HydrophobicContact CE1-CD1 4.45Å
108	R	96.9	Very high	91.2	Very high	8 Å²	8	50.6 Å²	50.6	3%	0.03	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144	163.9	-172.4	-65	-64.5	179.6	-101.6	11.3	111.5	R37 L38 F73 G74 R76 W86 C106 K110 Q131	R37-R108 PolarHBondContact O-NH1 3.48Å; L38-R108 PolarHBondContact O-NH1 2.97Å; F73-R108 WeakPolarHBondContact CA-O 3.45Å; G74-R108 PolarHBondContact N-O 3.3Å; G74-R108 PolarHBondContact O-N 3.2Å; R76-R108 HydrophobicContact CG-CG 4.04Å; W86-R108 HydrophobicContact CH2-CB 3.97Å; W86-R108 HydrophobicContact CZ3-CB 4.25Å; C106-R108 HydrophobicContact CB-CG 4.06Å; R108-K110 PolarHBondContact O-N 3.36Å; R108-Q131 VanDerWaalsContact CD-OE1 3.24Å
109	V	97.1	Very high	91.7	Very high	5 Å²	5	45.2 Å²	45.2	3%	0.03	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	124.5	168.8	-179.2	0	0	0	0	108.1	F73 W86 Y112 L128 Q131	F73-V109 HydrophobicContact CD1-CG2 4.05Å; F73-V109 HydrophobicContact CE1-CG2 3.82Å; W86-V109 WeakPolarHBondContact CH2-O 3.44Å; V109-Y112 HydrophobicContact CB-CE2 4.26Å; V109-Y112 HydrophobicContact CG1-CD1 4.18Å; V109-Y112 HydrophobicContact CG1-CD2 3.85Å; V109-Y112 HydrophobicContact CG1-CE1 4.25Å; V109-Y112 HydrophobicContact CG1-CE2 3.89Å; V109-Y112 HydrophobicContact CG1-CG 4Å; V109-L128 HydrophobicContact CB-CD2 4.38Å; V109-L128 HydrophobicContact CG1-CD2 3.7Å; V109-L128 HydrophobicContact CG2-CD2 3.73Å; V109-Q131 HydrophobicContact CB-CB 4.25Å; V109-Q131 HydrophobicContact CB-CG 3.83Å; V109-Q131 HydrophobicContact CG2-CB 3.46Å; V109-Q131 VanDerWaalsContact CG2-CB 3.46Å; V109-Q131 HydrophobicContact CG2-CG 3.62Å
110	K	96.1	Very high	92.3	Very high	35 Å²	35	47.8 Å²	47.8	15%	0.152	24%	0.243	C	C	.	.	S	Bend	trans	-98.4	-42.8	179	-177.4	173.9	-178.2	-179.4	0	111.4	Y72 W86 R108 E303	Y72-K110 PolarHBondContact O-N 2.75Å; W86-K110 HydrophobicContact CD2-CB 4.49Å; W86-K110 HydrophobicContact CD2-CD 3.91Å; W86-K110 HydrophobicContact CD2-CG 3.95Å; W86-K110 HydrophobicContact CE3-CB 4.25Å; W86-K110 HydrophobicContact CE3-CD 4.02Å; W86-K110 HydrophobicContact CE3-CG 4.15Å; W86-K110 HydrophobicContact CG-CD 4.24Å; W86-K110 HydrophobicContact CH2-CB 3.7Å; W86-K110 HydrophobicContact CH2-CG 4.1Å; W86-K110 HydrophobicContact CZ2-CB 3.97Å; W86-K110 HydrophobicContact CZ2-CG 3.9Å; W86-K110 HydrophobicContact CZ3-CB 3.86Å; W86-K110 HydrophobicContact CZ3-CD 4.47Å; W86-K110 HydrophobicContact CZ3-CG 4.22Å; R108-K110 PolarHBondContact O-N 3.36Å; K110-E303 VanDerWaalsContact CE-CD 3.44Å; K110-E303 WeakPolarHBondContact CE-OE2 3Å; K110-E303 IonicContact NZ-OE1 2.8Å; K110-E303 PolarHBondContact NZ-OE1 2.74Å; K110-E303 IonicContact NZ-OE2 2.87Å; K110-E303 PolarHBondContact NZ-OE2 3.24Å
111	F	96.9	Very high	92.8	Very high	10 Å²	10	39.9 Å²	39.9	4%	0.044	21%	0.207	C	C	.	.	S	Bend	trans	-121.7	117.8	176.2	-55.6	-71.4	0	0	0	109.1	D71 Y72 E303 F307 Y308	D71-F111 VanDerWaalsContact O-CD2 3.31Å; D71-F111 WeakPolarHBondContact O-CD2 3.48Å; Y72-F111 HydrophobicContact CD1-CB 4.48Å; Y72-F111 VanDerWaalsContact CD1-O 3.27Å; Y72-F111 WeakPolarHBondContact CD1-O 3.41Å; Y72-F111 PolarHBondContact O-N 3.29Å; F111-E303 HydrophobicContact CE1-CG 4.24Å; F111-E303 HydrophobicContact CZ-CG 3.82Å; F111-F307 HydrophobicContact CB-CD1 3.79Å; F111-F307 HydrophobicContact CB-CD2 4.43Å; F111-F307 HydrophobicContact CB-CE1 3.45Å; F111-F307 VanDerWaalsContact CB-CE1 3.45Å; F111-F307 HydrophobicContact CB-CE2 4.15Å; F111-F307 HydrophobicContact CB-CG 4.29Å; F111-F307 HydrophobicContact CB-CZ 3.65Å; F111-F307 HydrophobicContact CD1-CB 3.91Å; F111-F307 AromaticContact CD1-CD1 3.74Å; F111-F307 HydrophobicContact CD1-CD1 3.74Å; F111-F307 HydrophobicContact CD1-CD2 4.2Å; F111-F307 HydrophobicContact CD1-CE1 4.31Å; F111-F307 AromaticContact CD1-CG 3.69Å; F111-F307 HydrophobicContact CD1-CG 3.69Å; F111-F307 HydrophobicContact CD2-CD1 4.38Å; F111-F307 AromaticContact CD2-CD2 3.68Å; F111-F307 HydrophobicContact CD2-CD2 3.68Å; F111-F307 HydrophobicContact CD2-CE1 4.44Å; F111-F307 AromaticContact CD2-CE2 3.74Å; F111-F307 HydrophobicContact CD2-CE2 3.74Å; F111-F307 HydrophobicContact CD2-CG 4.03Å; F111-F307 HydrophobicContact CD2-CZ 4.13Å; F111-F307 HydrophobicContact CE1-CB 3.71Å; F111-F307 HydrophobicContact CE1-CD1 4.41Å; F111-F307 HydrophobicContact CE1-CD2 4.36Å; F111-F307 AromaticContact CE1-CG 3.93Å; F111-F307 HydrophobicContact CE1-CG 3.93Å; F111-F307 AromaticContact CE2-CD2 3.84Å; F111-F307 HydrophobicContact CE2-CD2 3.84Å; F111-F307 HydrophobicContact CE2-CE2 4.28Å; F111-F307 HydrophobicContact CE2-CG 4.24Å; F111-F307 HydrophobicContact CG-CB 4.42Å; F111-F307 AromaticContact CG-CD1 3.72Å; F111-F307 HydrophobicContact CG-CD1 3.72Å; F111-F307 AromaticContact CG-CD2 3.85Å; F111-F307 HydrophobicContact CG-CD2 3.85Å; F111-F307 AromaticContact CG-CE1 3.84Å; F111-F307 HydrophobicContact CG-CE1 3.84Å; F111-F307 AromaticContact CG-CE2 3.97Å; F111-F307 HydrophobicContact CG-CE2 3.97Å; F111-F307 AromaticContact CG-CG 3.74Å; F111-F307 HydrophobicContact CG-CG 3.74Å; F111-F307 AromaticContact CG-CZ 3.97Å; F111-F307 HydrophobicContact CG-CZ 3.97Å; F111-F307 HydrophobicContact CZ-CB 4.04Å; F111-F307 HydrophobicContact CZ-CD2 4.18Å; F111-F307 HydrophobicContact CZ-CG 4.18Å; F111-Y308 WeakPolarHBondContact CA-OH 3.46Å; F111-Y308 HydrophobicContact CD1-CE2 4.22Å
112	Y	97	Very high	93.3	Very high	15 Å²	15	39.9 Å²	39.9	6%	0.059	20%	0.202	C	C	.	.			trans	-77.9	133.8	176	-70.8	-107.2	0	0	0	109.3	V109 Q131 I132 D135 Y220 G221 Y308	V109-Y112 HydrophobicContact CB-CE2 4.26Å; V109-Y112 HydrophobicContact CG1-CD1 4.18Å; V109-Y112 HydrophobicContact CG1-CD2 3.85Å; V109-Y112 HydrophobicContact CG1-CE1 4.25Å; V109-Y112 HydrophobicContact CG1-CE2 3.89Å; V109-Y112 HydrophobicContact CG1-CG 4Å; Y112-Q131 HydrophobicContact CE1-CG 4.09Å; Y112-Q131 VanDerWaalsContact OH-CG 3.23Å; Y112-Q131 WeakPolarHBondContact OH-CG 3.41Å; Y112-I132 HydrophobicContact CD1-CD1 4.05Å; Y112-I132 HydrophobicContact CE1-CD1 3.62Å; Y112-D135 PolarHBondContact OH-OD2 3.45Å; Y112-Y220 HydrophobicContact CD1-CD2 4.48Å; Y112-Y220 AromaticContact CD1-CE2 3.92Å; Y112-Y220 HydrophobicContact CD1-CE2 3.92Å; Y112-Y220 AromaticContact CD1-CZ 3.94Å; Y112-G221 VanDerWaalsContact CG-CA 3.41Å; Y112-Y308 PolarHBondContact N-OH 3.49Å; Y112-Y308 WeakPolarHBondContact O-CE1 3.27Å; Y112-Y308 PolarHBondContact O-OH 3.11Å
113	P	95	Very high	93.6	Very high	4 Å²	4	36 Å²	36	3%	0.026	18%	0.177	C	C	.	.			trans	-65	141.9	176.8	30.4	-38.4	0	0	0	110	Y72 E115 P116 I119 L128 Y220	Y72-P113 HydrophobicContact CE1-CB 4.07Å; P113-E115 VanDerWaalsContact C-N 3.31Å; P113-P116 HydrophobicContact CG-CG 4.48Å; P113-I119 HydrophobicContact CB-CD1 3.82Å; P113-I119 HydrophobicContact CB-CG1 4.4Å; P113-I119 HydrophobicContact CG-CD1 3.62Å; P113-L128 HydrophobicContact CG-CD1 3.8Å; P113-L128 HydrophobicContact CG-CD2 4.33Å; P113-Y220 WeakPolarHBondContact CD-OH 3.39Å; P113-Y220 WeakPolarHBondContact CG-OH 3.33Å; P113-Y220 WeakPolarHBondContact O-CE1 3.22Å; P113-Y220 PolarHBondContact O-OH 3.39Å
114	H	89.9	Confident	93.9	Very high	113 Å²	113	36 Å²	36	52%	0.523	18%	0.176	S	C	.	.	S	Bend	trans	-65.1	-38.8	174.4	-170.7	60.2	0	0	0	111.8	A241	H114-A241 HydrophobicContact CB-CB 3.95Å
115	E	87.8	Confident	94.1	Very high	70 Å²	70	34.3 Å²	34.3	33%	0.327	16%	0.16	S	C	.	.			trans	-133.4	104.4	-179.4	-71.7	161	78.5	0	0	108.3	P113 L117 K118	P113-E115 VanDerWaalsContact C-N 3.31Å; E115-L117 PolarHBondContact O-N 3.31Å; E115-L117 VanDerWaalsContact O-N 3.13Å; E115-K118 HydrophobicContact CB-CD 4.07Å; E115-K118 HydrophobicContact CB-CG 4.07Å; E115-K118 VanDerWaalsContact CD-CE 3.46Å; E115-K118 VanDerWaalsContact CD-NZ 3.25Å; E115-K118 PolarHBondContact O-N 2.7Å; E115-K118 WeakPolarHBondContact OE1-CE 3.24Å; E115-K118 IonicContact OE1-NZ 2.58Å; E115-K118 PolarHBondContact OE1-NZ 3.36Å; E115-K118 VanDerWaalsContact OE2-CE 3.3Å; E115-K118 WeakPolarHBondContact OE2-CE 3.23Å; E115-K118 IonicContact OE2-NZ 3.77Å; E115-K118 PolarHBondContact OE2-NZ 2.8Å
116	P	88.6	Confident	94.3	Very high	1 Å²	1	34.8 Å²	34.8	1%	0.006	16%	0.162	C	C	.	.	G	3₁₀ helix	trans	-56.8	-26	178.1	-27.1	35.9	0	0	0	113.9	P113 K118 I119 L211 H215	P113-P116 HydrophobicContact CG-CG 4.48Å; P116-K118 PolarHBondContact O-N 3.36Å; P116-I119 WeakPolarHBondContact O-CB 3.36Å; P116-I119 PolarHBondContact O-N 2.81Å; P116-I119 VanDerWaalsContact O-N 3.17Å; P116-L211 HydrophobicContact CB-CB 3.97Å; P116-L211 HydrophobicContact CB-CD1 4.49Å; P116-L211 HydrophobicContact CG-CB 4.18Å; P116-H215 HydrophobicContact CG-CB 4.01Å
117	L	90.6	Very high	94.3	Very high	107 Å²	107	33.5 Å²	33.5	56%	0.56	15%	0.153	S	C	*	.	G	3₁₀ helix	trans	-60.9	-23.5	175.5	-66.1	129.5	0	0	0	114	E115 I119 F208 L212	E115-L117 PolarHBondContact O-N 3.31Å; E115-L117 VanDerWaalsContact O-N 3.13Å; L117-I119 VanDerWaalsContact C-N 3.26Å; L117-F208 HydrophobicContact CB-CZ 4.4Å; L117-F208 HydrophobicContact CD2-CE1 4.12Å; L117-F208 HydrophobicContact CD2-CZ 3.63Å; L117-F208 HydrophobicContact CG-CZ 3.8Å; L117-L212 HydrophobicContact CD1-CD2 3.5Å; L117-L212 VanDerWaalsContact CD1-CD2 3.5Å; L117-L212 HydrophobicContact CD2-CD2 3.96Å; L117-L212 HydrophobicContact CG-CD2 3.55Å
118	K	91.4	Very high	94.3	Very high	97 Å²	97	33.4 Å²	33.4	42%	0.422	15%	0.153	S	C	.	.	G	3₁₀ helix	trans	-81.7	-8.4	-179.5	-68.6	-177	174.3	167.8	0	113.1	E115 P116 V342	E115-K118 HydrophobicContact CB-CD 4.07Å; E115-K118 HydrophobicContact CB-CG 4.07Å; E115-K118 VanDerWaalsContact CD-CE 3.46Å; E115-K118 VanDerWaalsContact CD-NZ 3.25Å; E115-K118 PolarHBondContact O-N 2.7Å; E115-K118 WeakPolarHBondContact OE1-CE 3.24Å; E115-K118 IonicContact OE1-NZ 2.58Å; E115-K118 PolarHBondContact OE1-NZ 3.36Å; E115-K118 VanDerWaalsContact OE2-CE 3.3Å; E115-K118 WeakPolarHBondContact OE2-CE 3.23Å; E115-K118 IonicContact OE2-NZ 3.77Å; E115-K118 PolarHBondContact OE2-NZ 2.8Å; P116-K118 PolarHBondContact O-N 3.36Å; K118-V342 HydrophobicContact CB-CG1 4.33Å; K118-V342 HydrophobicContact CD-CG1 4.18Å
119	I	93.2	Very high	94.4	Very high	3 Å²	3	33.1 Å²	33.1	2%	0.015	15%	0.151	C	C	.	.			trans	-80.5	124	176.6	-68.2	175	0	0	0	108.4	E69 Y72 P113 P116 L117 T124 R125 L128	E69-I119 WeakPolarHBondContact OE2-CG2 3.48Å; Y72-I119 HydrophobicContact CE2-CD1 4.38Å; Y72-I119 HydrophobicContact CE2-CG1 4.23Å; P113-I119 HydrophobicContact CB-CD1 3.82Å; P113-I119 HydrophobicContact CB-CG1 4.4Å; P113-I119 HydrophobicContact CG-CD1 3.62Å; P116-I119 WeakPolarHBondContact O-CB 3.36Å; P116-I119 PolarHBondContact O-N 2.81Å; P116-I119 VanDerWaalsContact O-N 3.17Å; L117-I119 VanDerWaalsContact C-N 3.26Å; I119-T124 HydrophobicContact CD1-CG2 4.13Å; I119-T124 HydrophobicContact CG2-CG2 3.57Å; I119-R125 HydrophobicContact CB-CG 4.06Å; I119-R125 HydrophobicContact CG2-CG 3.62Å; I119-R125 PolarHBondContact O-NH1 2.75Å; I119-L128 HydrophobicContact CD1-CD1 3.09Å
120	K	92.9	Very high	94.4	Very high	97 Å²	97	33.3 Å²	33.3	42%	0.422	15%	0.152	S	C	.	.			trans	-83.7	-43	-175	-168.6	165.2	-177.7	178.2	0	112.2	E69 R125 S345 S346 I348	E69-K120 PolarHBondContact OE1-N 2.69Å; K120-R125 VanDerWaalsContact C-NH1 3.28Å; K120-R125 PolarHBondContact O-NH1 3.48Å; K120-S345 WeakPolarHBondContact CB-OG 3.34Å; K120-S345 WeakPolarHBondContact CD-O 3.46Å; K120-S345 PolarHBondContact N-OG 2.93Å; K120-S346 PolarHBondContact NZ-O 2.74Å; K120-I348 HydrophobicContact CD-CB 4.16Å; K120-I348 VanDerWaalsContact CE-O 3.29Å; K120-I348 WeakPolarHBondContact CE-O 3.27Å; K120-I348 PolarHBondContact NZ-O 3.05Å
121	E	93.9	Very high	94.4	Very high	5 Å²	5	31.9 Å²	31.9	2%	0.023	15%	0.146	C	C	.	.			trans	-82.5	134.4	-174.7	-51.7	-159.6	115.8	0	0	112.1	L68 E69 L123 T124 R125 I348 R350	L68-E121 WeakPolarHBondContact CB-OE2 3.27Å; L68-E121 PolarHBondContact N-OE2 3.36Å; E69-E121 VanDerWaalsContact OE2-CB 3.3Å; E69-E121 WeakPolarHBondContact OE2-CB 3.48Å; E69-E121 WeakPolarHBondContact OE2-CG 3.29Å; E69-E121 PolarHBondContact OE2-N 3.39Å; E121-L123 VanDerWaalsContact C-N 3.31Å; E121-L123 PolarHBondContact O-N 3.37Å; E121-T124 PolarHBondContact O-N 3.41Å; E121-R125 PolarHBondContact O-N 3.45Å; E121-I348 HydrophobicContact CG-CD1 3.84Å; E121-R350 VanDerWaalsContact CD-NH2 3.27Å; E121-R350 IonicContact OE1-CZ 2.76Å; E121-R350 IonicContact OE1-NE 3.79Å; E121-R350 PolarHBondContact OE1-NE 2.86Å; E121-R350 IonicContact OE1-NH2 3.19Å; E121-R350 PolarHBondContact OE1-NH2 2.65Å; E121-R350 IonicContact OE2-NH2 2.9Å; E121-R350 PolarHBondContact OE2-NH2 2.96Å
122	E	94.4	Very high	94.4	Very high	54 Å²	54	31.5 Å²	31.5	25%	0.252	14%	0.144	S	C	.	.	H	α-helix	trans	-61.2	-41.3	173.8	-173.6	-178.1	143	0	0	111.7	T124 R125 Y126 V355 R357	E122-T124 VanDerWaalsContact C-N 3.29Å; E122-T124 PolarHBondContact O-N 3.31Å; E122-R125 VanDerWaalsContact CA-NH2 3.31Å; E122-R125 CarbonylContact O-C 3.55Å; E122-R125 WeakPolarHBondContact O-CA 3.38Å; E122-R125 WeakPolarHBondContact O-CB 3.41Å; E122-R125 PolarHBondContact O-N 2.72Å; E122-Y126 PolarHBondContact O-N 3.4Å; E122-V355 HydrophobicContact CB-CG2 4.37Å; E122-V355 HydrophobicContact CG-CG2 4.08Å; E122-R357 IonicContact OE1-CZ 2.77Å; E122-R357 IonicContact OE1-NH1 3.71Å; E122-R357 IonicContact OE1-NH2 2.66Å; E122-R357 PolarHBondContact OE1-NH2 3.21Å
123	L	95.4	Very high	94.3	Very high	9 Å²	9	32 Å²	32	5%	0.047	15%	0.147	C	C	.	.	H	α-helix	trans	-52.8	-45.9	176.4	174.8	65.7	0	0	0	112.4	Y65 L67 E121 R125 Y126 L127 P353 V355	Y65-L123 HydrophobicContact CD1-CD1 4.24Å; Y65-L123 WeakPolarHBondContact O-CD2 3.13Å; L67-L123 HydrophobicContact CD1-CD2 4.29Å; L67-L123 HydrophobicContact CD1-CG 4.47Å; E121-L123 VanDerWaalsContact C-N 3.31Å; E121-L123 PolarHBondContact O-N 3.37Å; L123-R125 VanDerWaalsContact C-N 3.33Å; L123-R125 PolarHBondContact O-N 3.47Å; L123-Y126 PolarHBondContact O-N 3.32Å; L123-L127 HydrophobicContact CD1-CD1 4.35Å; L123-L127 HydrophobicContact CD1-CG 4.31Å; L123-L127 HydrophobicContact CG-CD1 4.32Å; L123-L127 VanDerWaalsContact O-CG 3.31Å; L123-L127 WeakPolarHBondContact O-CG 3.32Å; L123-L127 PolarHBondContact O-N 2.86Å; L123-P353 HydrophobicContact CB-CG 3.93Å; L123-P353 HydrophobicContact CD2-CG 3.69Å; L123-P353 HydrophobicContact CG-CG 4.44Å; L123-V355 HydrophobicContact CB-CG2 4.17Å; L123-V355 HydrophobicContact CD1-CG2 4.48Å
124	T	96.4	Very high	94.2	Very high	0 Å²	0	33 Å²	33	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-63.2	-41.3	177.7	-55.2	0	0	0	0	111.3	E69 Y72 F73 I119 E121 E122 L127 L128	E69-T124 HydrophobicContact CB-CG2 3.94Å; E69-T124 WeakPolarHBondContact OE2-CB 3.31Å; E69-T124 PolarHBondContact OE2-OG1 2.78Å; Y72-T124 HydrophobicContact CD2-CG2 4.17Å; F73-T124 HydrophobicContact CE2-CG2 3.99Å; F73-T124 HydrophobicContact CZ-CG2 4.1Å; I119-T124 HydrophobicContact CD1-CG2 4.13Å; I119-T124 HydrophobicContact CG2-CG2 3.57Å; E121-T124 PolarHBondContact O-N 3.41Å; E122-T124 VanDerWaalsContact C-N 3.29Å; E122-T124 PolarHBondContact O-N 3.31Å; T124-L127 PolarHBondContact O-N 2.85Å; T124-L128 HydrophobicContact CG2-CD1 4.29Å; T124-L128 WeakPolarHBondContact O-CG 3.39Å; T124-L128 PolarHBondContact O-N 2.86Å
125	R	96.3	Very high	94.3	Very high	56 Å²	56	28 Å²	28	21%	0.211	13%	0.128	C	C	.	.	H	α-helix	trans	-63.2	-43.6	174.9	-64	-172.2	-67.2	-91.1	-0.4	111.2	I119 K120 E121 E122 L123 L127 L128 Y129 L211	I119-R125 HydrophobicContact CB-CG 4.06Å; I119-R125 HydrophobicContact CG2-CG 3.62Å; I119-R125 PolarHBondContact O-NH1 2.75Å; K120-R125 VanDerWaalsContact C-NH1 3.28Å; K120-R125 PolarHBondContact O-NH1 3.48Å; E121-R125 PolarHBondContact O-N 3.45Å; E122-R125 VanDerWaalsContact CA-NH2 3.31Å; E122-R125 CarbonylContact O-C 3.55Å; E122-R125 WeakPolarHBondContact O-CA 3.38Å; E122-R125 WeakPolarHBondContact O-CB 3.41Å; E122-R125 PolarHBondContact O-N 2.72Å; L123-R125 VanDerWaalsContact C-N 3.33Å; L123-R125 PolarHBondContact O-N 3.47Å; R125-L127 PolarHBondContact O-N 3.37Å; R125-L128 WeakPolarHBondContact O-CB 3.34Å; R125-L128 PolarHBondContact O-N 3.03Å; R125-Y129 PolarHBondContact O-N 3.01Å; R125-L211 HydrophobicContact CB-CD1 3.96Å; R125-L211 HydrophobicContact CG-CD1 4.48Å; R125-L211 WeakPolarHBondContact O-CD1 3.24Å
126	Y	96.9	Very high	94.6	Very high	11 Å²	11	24.8 Å²	24.8	4%	0.043	11%	0.113	C	C	.	.	H	α-helix	trans	-61	-45.9	176.9	177.9	-113.2	0	0	0	112.3	E122 L123 L128 Y129 L130 V355 R357	E122-Y126 PolarHBondContact O-N 3.4Å; L123-Y126 PolarHBondContact O-N 3.32Å; Y126-L128 VanDerWaalsContact C-N 3.31Å; Y126-L128 PolarHBondContact O-N 3.19Å; Y126-Y129 HydrophobicContact CD2-CD1 4.18Å; Y126-Y129 HydrophobicContact CE2-CD1 4.2Å; Y126-Y129 HydrophobicContact CE2-CE1 4.47Å; Y126-Y129 WeakPolarHBondContact O-CB 3.26Å; Y126-Y129 PolarHBondContact O-N 3.1Å; Y126-Y129 VanDerWaalsContact O-N 3.11Å; Y126-L130 HydrophobicContact CD1-CD1 4.13Å; Y126-L130 HydrophobicContact CE1-CD1 3.6Å; Y126-L130 HydrophobicContact CE1-CG 4.15Å; Y126-L130 HydrophobicContact CE2-CD2 4.23Å; Y126-L130 HydrophobicContact CE2-CG 4.25Å; Y126-L130 WeakPolarHBondContact O-CG 3.42Å; Y126-L130 PolarHBondContact O-N 3.24Å; Y126-V355 HydrophobicContact CD1-CG1 3.31Å; Y126-V355 HydrophobicContact CD2-CG1 3.97Å; Y126-V355 HydrophobicContact CE1-CG1 3.79Å; Y126-V355 HydrophobicContact CE2-CG1 4.4Å; Y126-V355 HydrophobicContact CG-CG1 3.4Å; Y126-R357 HydrophobicContact CE2-CG 3.91Å
127	L	97	Very high	94.7	Very high	1 Å²	1	27.9 Å²	27.9	1%	0.005	13%	0.126	C	C	.	.	H	α-helix	trans	-62.9	-37.4	176.6	-66.8	176.6	0	0	0	112.1	L39 Y65 L67 F73 F107 L123 T124 R125 L130 Q131	L39-L127 HydrophobicContact CB-CD2 4.41Å; L39-L127 HydrophobicContact CD1-CB 3.81Å; L39-L127 HydrophobicContact CD1-CD2 4.02Å; L39-L127 HydrophobicContact CD1-CG 4.42Å; L39-L127 WeakPolarHBondContact CD1-O 3.4Å; Y65-L127 HydrophobicContact CD1-CD2 4.48Å; Y65-L127 HydrophobicContact CE1-CD2 3.95Å; Y65-L127 HydrophobicContact CE2-CD2 4.34Å; L67-L127 HydrophobicContact CD1-CD1 4.09Å; L67-L127 HydrophobicContact CD2-CD1 4.31Å; F73-L127 HydrophobicContact CE1-CB 3.6Å; F73-L127 HydrophobicContact CE1-CD1 4.13Å; F73-L127 HydrophobicContact CZ-CB 3.69Å; F73-L127 HydrophobicContact CZ-CD1 3.95Å; F107-L127 HydrophobicContact CE1-CD1 4.45Å; L123-L127 HydrophobicContact CD1-CD1 4.35Å; L123-L127 HydrophobicContact CD1-CG 4.31Å; L123-L127 HydrophobicContact CG-CD1 4.32Å; L123-L127 VanDerWaalsContact O-CG 3.31Å; L123-L127 WeakPolarHBondContact O-CG 3.32Å; L123-L127 PolarHBondContact O-N 2.86Å; T124-L127 PolarHBondContact O-N 2.85Å; R125-L127 PolarHBondContact O-N 3.37Å; L127-L130 HydrophobicContact CD2-CD1 4.42Å; L127-L130 PolarHBondContact O-N 2.76Å; L127-Q131 PolarHBondContact O-N 3.33Å; L127-Q131 VanDerWaalsContact O-N 3.16Å
128	L	97.4	Very high	94.5	Very high	1 Å²	1	24.9 Å²	24.9	1%	0.005	11%	0.109	C	C	.	.	H	α-helix	trans	-64.9	-42.3	171.7	-73.7	163.7	0	0	0	111.8	V109 P113 I119 T124 R125 Y126 L130 Q131 I132 L211	V109-L128 HydrophobicContact CB-CD2 4.38Å; V109-L128 HydrophobicContact CG1-CD2 3.7Å; V109-L128 HydrophobicContact CG2-CD2 3.73Å; P113-L128 HydrophobicContact CG-CD1 3.8Å; P113-L128 HydrophobicContact CG-CD2 4.33Å; I119-L128 HydrophobicContact CD1-CD1 3.09Å; T124-L128 HydrophobicContact CG2-CD1 4.29Å; T124-L128 WeakPolarHBondContact O-CG 3.39Å; T124-L128 PolarHBondContact O-N 2.86Å; R125-L128 WeakPolarHBondContact O-CB 3.34Å; R125-L128 PolarHBondContact O-N 3.03Å; Y126-L128 VanDerWaalsContact C-N 3.31Å; Y126-L128 PolarHBondContact O-N 3.19Å; L128-L130 VanDerWaalsContact C-N 3.33Å; L128-L130 PolarHBondContact O-N 2.98Å; L128-Q131 WeakPolarHBondContact O-CB 3.36Å; L128-Q131 PolarHBondContact O-N 3.27Å; L128-Q131 VanDerWaalsContact O-N 3.16Å; L128-I132 WeakPolarHBondContact O-CG1 3.29Å; L128-I132 PolarHBondContact O-N 3.22Å; L128-L211 HydrophobicContact CB-CD1 4.29Å; L128-L211 HydrophobicContact CB-CD2 3.99Å
129	Y	97.8	Very high	94.3	Very high	1 Å²	1	21 Å²	21	0%	0.004	10%	0.097	C	C	.	.	H	α-helix	trans	-57.1	-46.9	175.2	159	-90.6	0	0	0	110.7	R125 Y126 Q131 I132 K133 I155 E207 L210	R125-Y129 PolarHBondContact O-N 3.01Å; Y126-Y129 HydrophobicContact CD2-CD1 4.18Å; Y126-Y129 HydrophobicContact CE2-CD1 4.2Å; Y126-Y129 HydrophobicContact CE2-CE1 4.47Å; Y126-Y129 WeakPolarHBondContact O-CB 3.26Å; Y126-Y129 PolarHBondContact O-N 3.1Å; Y126-Y129 VanDerWaalsContact O-N 3.11Å; Y129-Q131 VanDerWaalsContact C-N 3.28Å; Y129-Q131 PolarHBondContact O-N 3.13Å; Y129-I132 PolarHBondContact O-N 2.98Å; Y129-I132 VanDerWaalsContact O-N 3.13Å; Y129-K133 HydrophobicContact CE1-CD 4.14Å; Y129-K133 WeakPolarHBondContact O-CB 3.09Å; Y129-K133 PolarHBondContact O-N 3.4Å; Y129-I155 HydrophobicContact CE2-CG1 4.31Å; Y129-E207 HydrophobicContact CD1-CG 3.89Å; Y129-E207 HydrophobicContact CD2-CB 3.83Å; Y129-E207 HydrophobicContact CD2-CG 3.76Å; Y129-E207 HydrophobicContact CE1-CG 4.07Å; Y129-E207 HydrophobicContact CE2-CB 4.35Å; Y129-E207 HydrophobicContact CE2-CG 3.89Å; Y129-E207 HydrophobicContact CG-CB 3.95Å; Y129-E207 HydrophobicContact CG-CG 3.75Å; Y129-L210 HydrophobicContact CD2-CB 4.36Å; Y129-L210 HydrophobicContact CD2-CD1 4.16Å; Y129-L210 HydrophobicContact CD2-CD2 4.05Å; Y129-L210 HydrophobicContact CD2-CG 4.41Å; Y129-L210 HydrophobicContact CE2-CD1 3.9Å
130	L	96.9	Very high	94.1	Very high	10 Å²	10	23.3 Å²	23.3	5%	0.052	11%	0.105	C	C	.	.	H	α-helix	trans	-60.4	-37	177.3	-69.2	178.6	0	0	0	112.7	L39 D40 Y126 L127 L128 R134	L39-L130 HydrophobicContact CB-CB 3.99Å; L39-L130 HydrophobicContact CB-CD1 4.01Å; D40-L130 HydrophobicContact CB-CD1 3.99Å; Y126-L130 HydrophobicContact CD1-CD1 4.13Å; Y126-L130 HydrophobicContact CE1-CD1 3.6Å; Y126-L130 HydrophobicContact CE1-CG 4.15Å; Y126-L130 HydrophobicContact CE2-CD2 4.23Å; Y126-L130 HydrophobicContact CE2-CG 4.25Å; Y126-L130 WeakPolarHBondContact O-CG 3.42Å; Y126-L130 PolarHBondContact O-N 3.24Å; L127-L130 HydrophobicContact CD2-CD1 4.42Å; L127-L130 PolarHBondContact O-N 2.76Å; L128-L130 VanDerWaalsContact C-N 3.33Å; L128-L130 PolarHBondContact O-N 2.98Å; L130-R134 WeakPolarHBondContact O-CB 3.22Å; L130-R134 PolarHBondContact O-N 2.71Å; L130-R134 VanDerWaalsContact O-N 3.12Å
131	Q	96.8	Very high	94	Very high	5 Å²	5	19 Å²	19	2%	0.023	9%	0.087	C	C	.	.	H	α-helix	trans	-66.7	-46.5	174	-179.4	68.6	56.8	0	0	111.6	L39 R108 V109 Y112 L127 L128 Y129 R134 D135	L39-Q131 HydrophobicContact CD2-CB 3.91Å; L39-Q131 VanDerWaalsContact CD2-OE1 3.31Å; R108-Q131 VanDerWaalsContact CD-OE1 3.24Å; V109-Q131 HydrophobicContact CB-CB 4.25Å; V109-Q131 HydrophobicContact CB-CG 3.83Å; V109-Q131 HydrophobicContact CG2-CB 3.46Å; V109-Q131 VanDerWaalsContact CG2-CB 3.46Å; V109-Q131 HydrophobicContact CG2-CG 3.62Å; Y112-Q131 HydrophobicContact CE1-CG 4.09Å; Y112-Q131 VanDerWaalsContact OH-CG 3.23Å; Y112-Q131 WeakPolarHBondContact OH-CG 3.41Å; L127-Q131 PolarHBondContact O-N 3.33Å; L127-Q131 VanDerWaalsContact O-N 3.16Å; L128-Q131 WeakPolarHBondContact O-CB 3.36Å; L128-Q131 PolarHBondContact O-N 3.27Å; L128-Q131 VanDerWaalsContact O-N 3.16Å; Y129-Q131 VanDerWaalsContact C-N 3.28Å; Y129-Q131 PolarHBondContact O-N 3.13Å; Q131-R134 WeakPolarHBondContact O-CB 3.22Å; Q131-R134 PolarHBondContact O-N 3.43Å; Q131-D135 PolarHBondContact NE2-OD1 2.92Å; Q131-D135 PolarHBondContact O-N 2.83Å
132	I	96.6	Very high	93.7	Very high	1 Å²	1	20.8 Å²	20.8	1%	0.005	10%	0.096	C	C	.	.	H	α-helix	trans	-67	-41.1	-179.1	-63.4	-66	0	0	0	111	Y112 L128 Y129 R134 D135 I136 L141 L210 L211 A214 Y220	Y112-I132 HydrophobicContact CD1-CD1 4.05Å; Y112-I132 HydrophobicContact CE1-CD1 3.62Å; L128-I132 WeakPolarHBondContact O-CG1 3.29Å; L128-I132 PolarHBondContact O-N 3.22Å; Y129-I132 PolarHBondContact O-N 2.98Å; Y129-I132 VanDerWaalsContact O-N 3.13Å; I132-R134 VanDerWaalsContact C-N 3.26Å; I132-R134 PolarHBondContact O-N 3.33Å; I132-D135 CarbonylContact O-C 3.56Å; I132-D135 PolarHBondContact O-N 3.45Å; I132-I136 HydrophobicContact CG2-CD1 3.99Å; I132-I136 HydrophobicContact CG2-CG1 4.39Å; I132-I136 WeakPolarHBondContact O-CG1 3.32Å; I132-I136 PolarHBondContact O-N 3.47Å; I132-L141 HydrophobicContact CG2-CD2 4.01Å; I132-L210 HydrophobicContact CB-CD2 4.05Å; I132-L210 HydrophobicContact CG2-CD2 3.55Å; I132-L211 HydrophobicContact CG1-CD2 3.99Å; I132-A214 HydrophobicContact CG2-CB 3.75Å; I132-Y220 HydrophobicContact CD1-CD2 3.78Å; I132-Y220 HydrophobicContact CD1-CE2 3.65Å; I132-Y220 HydrophobicContact CG1-CE2 4.44Å
133	K	95.4	Very high	93.5	Very high	26 Å²	26	18.7 Å²	18.7	11%	0.113	9%	0.088	C	C	.	.	H	α-helix	trans	-54.6	-44.5	171.7	-178.3	179.5	179.9	179.5	0	110.9	Y129 I136 F137 I155 E159	Y129-K133 HydrophobicContact CE1-CD 4.14Å; Y129-K133 WeakPolarHBondContact O-CB 3.09Å; Y129-K133 PolarHBondContact O-N 3.4Å; K133-I136 PolarHBondContact O-N 2.82Å; K133-F137 WeakPolarHBondContact O-CB 3.12Å; K133-F137 PolarHBondContact O-N 2.99Å; K133-I155 HydrophobicContact CD-CG2 4.25Å; K133-I155 HydrophobicContact CG-CD1 4.17Å; K133-E159 VanDerWaalsContact NZ-CD 3.27Å; K133-E159 IonicContact NZ-OE1 3.22Å; K133-E159 PolarHBondContact NZ-OE1 3.01Å; K133-E159 IonicContact NZ-OE2 2.63Å
134	R	92.9	Very high	93.4	Very high	25 Å²	25	20 Å²	20	9%	0.094	10%	0.097	C	C	.	.	H	α-helix	trans	-65.1	-39.9	174	179.3	179.2	-71	102.4	-2.4	112.7	L39 D41 L130 Q131 I132 I136 F137 H138	L39-R134 VanDerWaalsContact O-CZ 3.27Å; L39-R134 PolarHBondContact O-NH1 3.49Å; L39-R134 PolarHBondContact O-NH2 2.94Å; D41-R134 IonicContact OD1-CZ 3.7Å; D41-R134 IonicContact OD1-NH2 2.95Å; D41-R134 PolarHBondContact OD1-NH2 3.42Å; D41-R134 IonicContact OD2-NH2 2.78Å; D41-R134 PolarHBondContact OD2-NH2 3.4Å; L130-R134 WeakPolarHBondContact O-CB 3.22Å; L130-R134 PolarHBondContact O-N 2.71Å; L130-R134 VanDerWaalsContact O-N 3.12Å; Q131-R134 WeakPolarHBondContact O-CB 3.22Å; Q131-R134 PolarHBondContact O-N 3.43Å; I132-R134 VanDerWaalsContact C-N 3.26Å; I132-R134 PolarHBondContact O-N 3.33Å; R134-I136 VanDerWaalsContact C-N 3.32Å; R134-F137 PolarHBondContact O-N 2.88Å; R134-H138 PolarHBondContact O-CD2 3.37Å; R134-H138 VanDerWaalsContact O-CD2 3.24Å; R134-H138 PolarHBondContact O-N 3.35Å
135	D	92.1	Very high	93.3	Very high	9 Å²	9	22.4 Å²	22.4	5%	0.048	11%	0.108	C	C	.	.	H	α-helix	trans	-65.9	-35.5	176.8	-70.1	-31.3	0	0	0	111.6	Y112 Q131 I132 G139 R140 L141	Y112-D135 PolarHBondContact OH-OD2 3.45Å; Q131-D135 PolarHBondContact NE2-OD1 2.92Å; Q131-D135 PolarHBondContact O-N 2.83Å; I132-D135 CarbonylContact O-C 3.56Å; I132-D135 PolarHBondContact O-N 3.45Å; D135-G139 PolarHBondContact O-N 2.88Å; D135-R140 HydrophobicContact CB-CB 4.08Å; D135-R140 WeakPolarHBondContact O-CB 3.28Å; D135-R140 PolarHBondContact O-N 3.41Å; D135-R140 WeakPolarHBondContact OD1-CD 3.29Å; D135-R140 IonicContact OD1-NE 3.52Å; D135-R140 PolarHBondContact OD1-NE 3.33Å; D135-L141 PolarHBondContact O-N 3.23Å
136	I	93.5	Very high	93.4	Very high	2 Å²	2	23.5 Å²	23.5	1%	0.01	12%	0.124	C	C	.	.	H	α-helix	trans	-64.7	-52.1	171.9	-71.2	166.2	0	0	0	110.5	I132 K133 R134 H138 G139 L141 L151 I155 I178 F179 L210	I132-I136 HydrophobicContact CG2-CD1 3.99Å; I132-I136 HydrophobicContact CG2-CG1 4.39Å; I132-I136 WeakPolarHBondContact O-CG1 3.32Å; I132-I136 PolarHBondContact O-N 3.47Å; K133-I136 PolarHBondContact O-N 2.82Å; R134-I136 VanDerWaalsContact C-N 3.32Å; I136-H138 PolarHBondContact O-N 2.87Å; I136-G139 PolarHBondContact O-N 3.3Å; I136-L141 HydrophobicContact CD1-CD2 4.1Å; I136-L141 HydrophobicContact CG1-CB 4.1Å; I136-L141 HydrophobicContact CG1-CD2 3.69Å; I136-L151 HydrophobicContact CD1-CB 4.21Å; I136-L151 HydrophobicContact CD1-CD1 4.17Å; I136-L151 HydrophobicContact CD1-CD2 4.47Å; I136-I155 HydrophobicContact CD1-CD1 4.14Å; I136-I178 HydrophobicContact CG2-CG2 4.31Å; I136-F179 HydrophobicContact CG2-CD1 3.51Å; I136-F179 HydrophobicContact CG2-CE1 3.26Å; I136-F179 HydrophobicContact CG2-CG 4.26Å; I136-F179 HydrophobicContact CG2-CZ 3.8Å; I136-L210 HydrophobicContact CD1-CD1 4.34Å
137	F	90.6	Very high	93.4	Very high	65 Å²	65	24.2 Å²	24.2	29%	0.285	13%	0.129	S	C	.	.	H	α-helix	trans	-58.5	-32.1	179.9	178.7	-99.8	0	0	0	113	K133 R134 E177 I178 P180	K133-F137 WeakPolarHBondContact O-CB 3.12Å; K133-F137 PolarHBondContact O-N 2.99Å; R134-F137 PolarHBondContact O-N 2.88Å; F137-E177 WeakPolarHBondContact CD2-O 3.49Å; F137-E177 HydrophobicContact CE2-CB 4Å; F137-I178 WeakPolarHBondContact CA-O 3.29Å; F137-P180 VanDerWaalsContact O-CD 3.27Å; F137-P180 WeakPolarHBondContact O-CD 3.25Å; F137-P180 WeakPolarHBondContact O-CG 3.21Å
138	H	85.9	Confident	93.4	Very high	44 Å²	44	24.2 Å²	24.2	20%	0.204	13%	0.129	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.7	5.3	176.1	-70.1	-50.9	0	0	0	114.3	R134 I136 R140 I375	R134-H138 PolarHBondContact O-CD2 3.37Å; R134-H138 VanDerWaalsContact O-CD2 3.24Å; R134-H138 PolarHBondContact O-N 3.35Å; I136-H138 PolarHBondContact O-N 2.87Å; H138-R140 VanDerWaalsContact C-N 3.28Å; H138-R140 HydrophobicContact CB-CG 4.38Å; H138-R140 PolarHBondContact O-N 2.91Å; H138-I375 HydrophobicContact CB-CD1 4.19Å
139	G	87.6	Confident	93.4	Very high	16 Å²	16	24.1 Å²	24.1	17%	0.165	13%	0.128	C	C	.	.	T	Hydrogen-bonded Turn	trans	68.9	20.3	178.6	0	0	0	0	0	114.9	D135 I136	D135-G139 PolarHBondContact O-N 2.88Å; I136-G139 PolarHBondContact O-N 3.3Å
140	R	88.9	Confident	93.4	Very high	52 Å²	52	26.9 Å²	26.9	20%	0.196	14%	0.139	C	C	.	.			trans	-78.9	-27	177.4	-67.9	168.9	56.3	96.3	-3.7	112.3	D135 H138 T219 V222 D223	D135-R140 HydrophobicContact CB-CB 4.08Å; D135-R140 WeakPolarHBondContact O-CB 3.28Å; D135-R140 PolarHBondContact O-N 3.41Å; D135-R140 WeakPolarHBondContact OD1-CD 3.29Å; D135-R140 IonicContact OD1-NE 3.52Å; D135-R140 PolarHBondContact OD1-NE 3.33Å; H138-R140 VanDerWaalsContact C-N 3.28Å; H138-R140 HydrophobicContact CB-CG 4.38Å; H138-R140 PolarHBondContact O-N 2.91Å; R140-T219 WeakPolarHBondContact O-CB 3.5Å; R140-T219 PolarHBondContact O-OG1 3.46Å; R140-V222 PolarHBondContact NH2-O 2.89Å; R140-D223 IonicContact CZ-OD1 3.58Å; R140-D223 IonicContact NH1-OD1 3.69Å; R140-D223 PolarHBondContact NH1-OD1 2.93Å; R140-D223 IonicContact NH2-OD1 2.75Å; R140-D223 PolarHBondContact NH2-OD1 3.43Å
141	L	90.9	Very high	93.5	Very high	6 Å²	6	26.4 Å²	26.4	3%	0.031	14%	0.137	C	C	.	.	S	Bend	trans	-94.1	100.1	176.8	-164.7	72.7	0	0	0	110.3	I132 D135 I136 L151 A214 L217 T219	I132-L141 HydrophobicContact CG2-CD2 4.01Å; D135-L141 PolarHBondContact O-N 3.23Å; I136-L141 HydrophobicContact CD1-CD2 4.1Å; I136-L141 HydrophobicContact CG1-CB 4.1Å; I136-L141 HydrophobicContact CG1-CD2 3.69Å; L141-L151 HydrophobicContact CD2-CD1 4.12Å; L141-A214 HydrophobicContact CD2-CB 4.07Å; L141-L217 HydrophobicContact CD1-CB 4.17Å; L141-L217 HydrophobicContact CD1-CD1 4.09Å; L141-L217 HydrophobicContact CD2-CD1 3.68Å; L141-L217 HydrophobicContact CG-CD1 3.69Å; L141-T219 WeakPolarHBondContact CA-OG1 3.41Å
142	L	88.3	Confident	93.5	Very high	42 Å²	42	26.1 Å²	26.1	22%	0.22	14%	0.135	C	C	.	.			trans	-74	129.8	176.5	-61	-177.4	0	0	0	109.1	T219 N250 P447	L142-T219 HydrophobicContact CB-CG2 3.98Å; L142-T219 HydrophobicContact CD1-CG2 3.69Å; L142-T219 HydrophobicContact CG-CG2 3.75Å; L142-T219 PolarHBondContact N-OG1 2.75Å; L142-N250 HydrophobicContact CD1-CB 4.09Å; L142-P447 HydrophobicContact CD2-CG 4.22Å
143	C	90.3	Very high	93.6	Very high	11 Å²	11	26.1 Å²	26.1	7%	0.074	14%	0.135	C	C	.	.			trans	-146.1	152	-173.8	47.2	0	0	0	0	110.3	D147 L151 L217	C143-D147 HydrophobicContact CB-CB 3.8Å; C143-L151 HydrophobicContact CB-CD1 4.33Å; C143-L217 HydrophobicContact CB-CD1 3.89Å; C143-L217 HydrophobicContact CB-CD2 4.45Å
144	S	93.1	Very high	93.8	Very high	36 Å²	36	24.9 Å²	24.9	25%	0.252	13%	0.13	S	C	.	.			trans	-68.9	169.1	170.1	70.3	0	0	0	0	110.7	S146 D147 A148	S144-S146 VanDerWaalsContact C-N 3.28Å; S144-S146 PolarHBondContact O-N 3.37Å; S144-D147 WeakPolarHBondContact CB-OD2 3.47Å; S144-D147 PolarHBondContact N-OD2 2.89Å; S144-D147 PolarHBondContact O-N 3Å; S144-D147 PolarHBondContact OG-N 3.28Å; S144-D147 PolarHBondContact OG-OD2 3.39Å; S144-A148 WeakPolarHBondContact O-CB 3.47Å; S144-A148 PolarHBondContact O-N 2.92Å
145	F	94.8	Very high	94	Very high	50 Å²	50	23.7 Å²	23.7	22%	0.219	13%	0.126	C	C	.	.	H	α-helix	trans	-58	-42.6	176.1	178.6	-91.5	0	0	0	112.1	A148 A149 K185 L186 K189	F145-A148 PolarHBondContact O-N 2.86Å; F145-A149 WeakPolarHBondContact O-CB 3.46Å; F145-A149 PolarHBondContact O-N 2.76Å; F145-K185 HydrophobicContact CE2-CD 4.47Å; F145-K185 HydrophobicContact CE2-CG 4.22Å; F145-K185 HydrophobicContact CZ-CD 4.42Å; F145-K185 HydrophobicContact CZ-CG 3.95Å; F145-L186 HydrophobicContact CD2-CD1 4.35Å; F145-L186 HydrophobicContact CE2-CB 3.97Å; F145-L186 HydrophobicContact CE2-CD1 4.01Å; F145-L186 HydrophobicContact CZ-CD1 4.35Å; F145-K189 HydrophobicContact CE1-CB 4.14Å; F145-K189 HydrophobicContact CE1-CG 4.09Å; F145-K189 HydrophobicContact CZ-CB 4.12Å
146	S	96.7	Very high	94.2	Very high	80 Å²	80	23.3 Å²	23.3	56%	0.559	12%	0.123	S	C	*	.	H	α-helix	trans	-64.2	-44.5	177.8	-177.5	0	0	0	0	111.6	S144 A148 A149 Y150	S144-S146 VanDerWaalsContact C-N 3.28Å; S144-S146 PolarHBondContact O-N 3.37Å; S146-A148 PolarHBondContact O-N 2.8Å; S146-A149 PolarHBondContact O-N 2.88Å; S146-Y150 PolarHBondContact O-N 2.92Å
147	D	97.3	Very high	94.4	Very high	26 Å²	26	23.2 Å²	23.2	14%	0.139	12%	0.123	C	C	.	.	H	α-helix	trans	-64.4	-42.1	177.5	-58.4	-34.8	0	0	0	111.3	C143 S144 Y150 L151 K213 L217	C143-D147 HydrophobicContact CB-CB 3.8Å; S144-D147 WeakPolarHBondContact CB-OD2 3.47Å; S144-D147 PolarHBondContact N-OD2 2.89Å; S144-D147 PolarHBondContact O-N 3Å; S144-D147 PolarHBondContact OG-N 3.28Å; S144-D147 PolarHBondContact OG-OD2 3.39Å; D147-Y150 PolarHBondContact O-N 3.35Å; D147-L151 WeakPolarHBondContact O-CB 3.31Å; D147-L151 WeakPolarHBondContact O-CG 3.26Å; D147-L151 PolarHBondContact O-N 3.4Å; D147-K213 WeakPolarHBondContact OD1-CE 3.46Å; D147-K213 IonicContact OD1-NZ 2.8Å; D147-K213 PolarHBondContact OD1-NZ 3.29Å; D147-L217 HydrophobicContact CB-CD2 4.42Å
148	A	96.6	Very high	94.7	Very high	0 Å²	0	20.5 Å²	20.5	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-61	-44.2	176.1	0	0	0	0	0	111.3	S144 F145 S146 L151 G152 F179 L186 Y445	S144-A148 WeakPolarHBondContact O-CB 3.47Å; S144-A148 PolarHBondContact O-N 2.92Å; F145-A148 PolarHBondContact O-N 2.86Å; S146-A148 PolarHBondContact O-N 2.8Å; A148-L151 PolarHBondContact O-N 3.5Å; A148-G152 PolarHBondContact O-N 3.46Å; A148-F179 HydrophobicContact CB-CE1 3.95Å; A148-F179 HydrophobicContact CB-CZ 3.88Å; A148-F179 WeakPolarHBondContact O-CZ 3.34Å; A148-L186 HydrophobicContact CB-CD1 4.09Å; A148-Y445 HydrophobicContact CB-CD1 3.72Å; A148-Y445 HydrophobicContact CB-CE1 4.05Å; A148-Y445 HydrophobicContact CB-CG 4.34Å
149	A	98	Very high	95	Very high	0 Å²	0	19.9 Å²	19.9	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-63	-44.3	178	0	0	0	0	0	111.9	F145 S146 G152 A153 L186 K189 I190 I193	F145-A149 WeakPolarHBondContact O-CB 3.46Å; F145-A149 PolarHBondContact O-N 2.76Å; S146-A149 PolarHBondContact O-N 2.88Å; A149-G152 PolarHBondContact O-N 2.89Å; A149-A153 WeakPolarHBondContact O-CB 3.38Å; A149-A153 PolarHBondContact O-N 3.29Å; A149-L186 HydrophobicContact CB-CD1 3.89Å; A149-K189 HydrophobicContact CB-CB 3.97Å; A149-K189 HydrophobicContact CB-CG 3.56Å; A149-I190 HydrophobicContact CB-CG1 4.42Å; A149-I190 WeakPolarHBondContact O-CG1 3.44Å; A149-I193 HydrophobicContact CB-CD1 3.79Å
150	Y	98.6	Very high	95.3	Very high	58 Å²	58	22.6 Å²	22.6	23%	0.227	12%	0.117	C	C	.	.	H	α-helix	trans	-64.6	-47.4	176.8	-177.8	-94.7	0	0	0	112.4	S146 D147 G152 A153 C154 I193 L198 K213	S146-Y150 PolarHBondContact O-N 2.92Å; D147-Y150 PolarHBondContact O-N 3.35Å; Y150-G152 VanDerWaalsContact C-N 3.31Å; Y150-G152 PolarHBondContact O-N 3.32Å; Y150-A153 PolarHBondContact O-N 2.81Å; Y150-C154 VanDerWaalsContact CE1-SG 3.56Å; Y150-C154 PolarHBondContact O-N 3.24Å; Y150-C154 PolarHBondContact O-SG 3.09Å; Y150-C154 VanDerWaalsContact O-SG 3.4Å; Y150-I193 HydrophobicContact CD2-CG2 4.28Å; Y150-L198 HydrophobicContact CE2-CD2 4.35Å; Y150-K213 HydrophobicContact CD1-CB 4.06Å; Y150-K213 HydrophobicContact CD1-CD 4.4Å; Y150-K213 HydrophobicContact CD1-CG 3.9Å; Y150-K213 HydrophobicContact CE1-CB 3.96Å; Y150-K213 HydrophobicContact CE1-CG 4.28Å
151	L	98.4	Very high	95.5	Very high	0 Å²	0	21.3 Å²	21.3	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-59.9	-43	177	-69.6	169.2	0	0	0	111.2	I136 L141 C143 D147 A148 C154 I155 L210 K213 A214 L217	I136-L151 HydrophobicContact CD1-CB 4.21Å; I136-L151 HydrophobicContact CD1-CD1 4.17Å; I136-L151 HydrophobicContact CD1-CD2 4.47Å; L141-L151 HydrophobicContact CD2-CD1 4.12Å; C143-L151 HydrophobicContact CB-CD1 4.33Å; D147-L151 WeakPolarHBondContact O-CB 3.31Å; D147-L151 WeakPolarHBondContact O-CG 3.26Å; D147-L151 PolarHBondContact O-N 3.4Å; A148-L151 PolarHBondContact O-N 3.5Å; L151-C154 PolarHBondContact O-N 2.92Å; L151-I155 WeakPolarHBondContact O-CG1 3.13Å; L151-I155 PolarHBondContact O-N 2.85Å; L151-I155 VanDerWaalsContact O-N 3.07Å; L151-L210 HydrophobicContact CD2-CD1 4.32Å; L151-L210 HydrophobicContact CD2-CD2 4.48Å; L151-L210 HydrophobicContact CD2-CG 3.75Å; L151-K213 HydrophobicContact CD2-CB 3.93Å; L151-K213 HydrophobicContact CD2-CG 3.91Å; L151-K213 HydrophobicContact CG-CG 4.26Å; L151-A214 HydrophobicContact CD2-CB 4.49Å; L151-L217 HydrophobicContact CD1-CD1 4.01Å
152	G	97.8	Very high	95.7	Very high	0 Å²	0	22.7 Å²	22.7	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-61	-44.7	175	0	0	0	0	0	112	A148 A149 Y150 C154 I155 V156	A148-G152 PolarHBondContact O-N 3.46Å; A149-G152 PolarHBondContact O-N 2.89Å; Y150-G152 VanDerWaalsContact C-N 3.31Å; Y150-G152 PolarHBondContact O-N 3.32Å; G152-C154 PolarHBondContact O-N 3.37Å; G152-I155 PolarHBondContact O-N 2.77Å; G152-I155 VanDerWaalsContact O-N 3.12Å; G152-V156 WeakPolarHBondContact O-CG2 3.45Å; G152-V156 PolarHBondContact O-N 2.7Å
153	A	98.3	Very high	95.9	Very high	0 Å²	0	22.8 Å²	22.8	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-62.4	-40.7	177.1	0	0	0	0	0	112.1	A149 Y150 I155 V156 Q157 I190 I193 L198	A149-A153 WeakPolarHBondContact O-CB 3.38Å; A149-A153 PolarHBondContact O-N 3.29Å; Y150-A153 PolarHBondContact O-N 2.81Å; A153-I155 VanDerWaalsContact C-N 3.32Å; A153-I155 PolarHBondContact O-N 2.9Å; A153-V156 PolarHBondContact O-N 3.2Å; A153-Q157 WeakPolarHBondContact O-CB 3.4Å; A153-Q157 PolarHBondContact O-N 3.16Å; A153-I190 HydrophobicContact CB-CG2 4.33Å; A153-I193 HydrophobicContact CB-CB 3.74Å; A153-I193 HydrophobicContact CB-CG2 3.49Å; A153-I193 VanDerWaalsContact CB-CG2 3.49Å; A153-L198 HydrophobicContact CB-CD1 3.58Å; A153-L198 VanDerWaalsContact O-CD1 3.29Å; A153-L198 WeakPolarHBondContact O-CD1 3.33Å
154	C	98.6	Very high	96	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-62.2	-37.8	173.3	-66.4	0	0	0	0	112.6	Y150 L151 G152 A158 L210	Y150-C154 VanDerWaalsContact CE1-SG 3.56Å; Y150-C154 PolarHBondContact O-N 3.24Å; Y150-C154 PolarHBondContact O-SG 3.09Å; Y150-C154 VanDerWaalsContact O-SG 3.4Å; L151-C154 PolarHBondContact O-N 2.92Å; G152-C154 PolarHBondContact O-N 3.37Å; C154-A158 WeakPolarHBondContact O-CB 3.43Å; C154-A158 PolarHBondContact O-N 2.83Å; C154-L210 HydrophobicContact CB-CB 3.88Å; C154-L210 HydrophobicContact CB-CD1 4.23Å
155	I	97.6	Very high	95.8	Very high	1 Å²	1	29.9 Å²	29.9	1%	0.005	16%	0.158	C	C	.	.	H	α-helix	trans	-66.3	-43.6	175.5	-65.7	166	0	0	0	110.2	Y129 K133 I136 L151 G152 A153 A158 E159 F176 I178 L210	Y129-I155 HydrophobicContact CE2-CG1 4.31Å; K133-I155 HydrophobicContact CD-CG2 4.25Å; K133-I155 HydrophobicContact CG-CD1 4.17Å; I136-I155 HydrophobicContact CD1-CD1 4.14Å; L151-I155 WeakPolarHBondContact O-CG1 3.13Å; L151-I155 PolarHBondContact O-N 2.85Å; L151-I155 VanDerWaalsContact O-N 3.07Å; G152-I155 PolarHBondContact O-N 2.77Å; G152-I155 VanDerWaalsContact O-N 3.12Å; A153-I155 VanDerWaalsContact C-N 3.32Å; A153-I155 PolarHBondContact O-N 2.9Å; I155-A158 PolarHBondContact O-N 2.86Å; I155-E159 HydrophobicContact CG2-CG 4.37Å; I155-E159 VanDerWaalsContact O-CG 3.31Å; I155-E159 WeakPolarHBondContact O-CG 3.22Å; I155-E159 PolarHBondContact O-N 3.23Å; I155-E159 VanDerWaalsContact O-N 3.08Å; I155-F176 HydrophobicContact CG2-CE1 3.78Å; I155-F176 HydrophobicContact CG2-CZ 3.78Å; I155-I178 HydrophobicContact CD1-CG2 3.58Å; I155-L210 HydrophobicContact CD1-CD1 3.9Å; I155-L210 HydrophobicContact CG1-CD1 3.41Å; I155-L210 VanDerWaalsContact CG1-CD1 3.41Å
156	V	96.8	Very high	95.5	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-61.9	-49.8	177.7	173.6	0	0	0	0	110.8	G152 A153 A158 E159 F160 Y172 I173 F176 I178 I190 H194	G152-V156 WeakPolarHBondContact O-CG2 3.45Å; G152-V156 PolarHBondContact O-N 2.7Å; A153-V156 PolarHBondContact O-N 3.2Å; V156-A158 PolarHBondContact O-N 3.48Å; V156-E159 PolarHBondContact O-N 2.94Å; V156-E159 VanDerWaalsContact O-N 3.12Å; V156-F160 HydrophobicContact CB-CD2 4.39Å; V156-F160 HydrophobicContact CG1-CB 4.44Å; V156-F160 HydrophobicContact CG1-CD2 3.82Å; V156-F160 HydrophobicContact CG1-CG 4.45Å; V156-F160 WeakPolarHBondContact O-CB 3.34Å; V156-F160 WeakPolarHBondContact O-CD2 3.4Å; V156-F160 PolarHBondContact O-N 2.91Å; V156-Y172 HydrophobicContact CG1-CE2 3.78Å; V156-I173 HydrophobicContact CG1-CG2 4.2Å; V156-I173 HydrophobicContact CG2-CG2 3.91Å; V156-F176 HydrophobicContact CG2-CD1 4.33Å; V156-F176 HydrophobicContact CG2-CE1 4.31Å; V156-I178 HydrophobicContact CG2-CD1 3.76Å; V156-I190 HydrophobicContact CG2-CG2 3.79Å; V156-H194 HydrophobicContact CG1-CB 4.48Å; V156-H194 WeakPolarHBondContact CG1-ND1 3.34Å
157	Q	97.2	Very high	95	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-57.2	-38.7	176.7	-178.1	69.9	33.1	0	0	112	A153 G161 D162 H194 L198 Q201 A206	A153-Q157 WeakPolarHBondContact O-CB 3.4Å; A153-Q157 PolarHBondContact O-N 3.16Å; Q157-G161 WeakPolarHBondContact O-CA 3.5Å; Q157-G161 PolarHBondContact O-N 3.48Å; Q157-G161 VanDerWaalsContact O-N 3.09Å; Q157-G161 PolarHBondContact OE1-O 2.85Å; Q157-D162 PolarHBondContact NE2-OD1 3.19Å; Q157-H194 PolarHBondContact OE1-CD2 2.82Å; Q157-H194 PolarHBondContact OE1-NE2 3.05Å; Q157-L198 HydrophobicContact CB-CB 4.23Å; Q157-L198 HydrophobicContact CB-CD1 4.06Å; Q157-L198 HydrophobicContact CG-CB 4.11Å; Q157-L198 PolarHBondContact NE2-O 2.86Å; Q157-L198 PolarHBondContact OE1-O 3.16Å; Q157-Q201 HydrophobicContact CG-CB 4.28Å; Q157-Q201 PolarHBondContact NE2-O 3Å; Q157-A206 HydrophobicContact CB-CB 3.96Å; Q157-A206 HydrophobicContact CG-CB 3.76Å
158	A	96.2	Very high	94.6	Very high	9 Å²	9	37.4 Å²	37.4	7%	0.074	19%	0.189	C	C	.	.	H	α-helix	trans	-70.3	-31.3	179.3	0	0	0	0	0	113.6	C154 I155 V156 A206 E207	C154-A158 WeakPolarHBondContact O-CB 3.43Å; C154-A158 PolarHBondContact O-N 2.83Å; I155-A158 PolarHBondContact O-N 2.86Å; V156-A158 PolarHBondContact O-N 3.48Å; A158-A206 HydrophobicContact CB-CB 4.29Å; A158-E207 HydrophobicContact CB-CG 4.05Å
159	E	93.8	Very high	94.1	Very high	31 Å²	31	41 Å²	41	15%	0.145	21%	0.213	C	C	.	.	H	α-helix	trans	-95.9	-36.3	-175.9	-65.4	-76.9	160.4	0	0	113.5	K133 I155 V156 F176 I360	K133-E159 VanDerWaalsContact NZ-CD 3.27Å; K133-E159 IonicContact NZ-OE1 3.22Å; K133-E159 PolarHBondContact NZ-OE1 3.01Å; K133-E159 IonicContact NZ-OE2 2.63Å; I155-E159 HydrophobicContact CG2-CG 4.37Å; I155-E159 VanDerWaalsContact O-CG 3.31Å; I155-E159 WeakPolarHBondContact O-CG 3.22Å; I155-E159 PolarHBondContact O-N 3.23Å; I155-E159 VanDerWaalsContact O-N 3.08Å; V156-E159 PolarHBondContact O-N 2.94Å; V156-E159 VanDerWaalsContact O-N 3.12Å; E159-F176 HydrophobicContact CB-CZ 4.46Å; E159-F176 HydrophobicContact CG-CZ 4Å; E159-I360 PolarHBondContact OE2-N 3.18Å
160	F	93.2	Very high	93.3	Very high	73 Å²	73	49.7 Å²	49.7	32%	0.32	25%	0.253	S	S	.	.	H	α-helix	trans	-103.7	-16.3	-175.1	-65.3	-87.4	0	0	0	113.3	V156 F176	V156-F160 HydrophobicContact CB-CD2 4.39Å; V156-F160 HydrophobicContact CG1-CB 4.44Å; V156-F160 HydrophobicContact CG1-CD2 3.82Å; V156-F160 HydrophobicContact CG1-CG 4.45Å; V156-F160 WeakPolarHBondContact O-CB 3.34Å; V156-F160 WeakPolarHBondContact O-CD2 3.4Å; V156-F160 PolarHBondContact O-N 2.91Å; F160-F176 AromaticContact CE2-CD1 3.71Å; F160-F176 HydrophobicContact CE2-CD1 3.71Å; F160-F176 HydrophobicContact CE2-CD2 4.46Å; F160-F176 AromaticContact CE2-CE1 3.94Å; F160-F176 HydrophobicContact CE2-CE1 3.94Å; F160-F176 AromaticContact CE2-CG 4Å; F160-F176 HydrophobicContact CE2-CG 4Å; F160-F176 HydrophobicContact CE2-CZ 4.43Å; F160-F176 HydrophobicContact CZ-CB 4.38Å; F160-F176 HydrophobicContact CZ-CD1 4.36Å; F160-F176 HydrophobicContact CZ-CG 4.19Å
161	G	93.8	Very high	92.8	Very high	25 Å²	25	51.7 Å²	51.7	26%	0.258	27%	0.268	S	S	.	.			trans	76.4	-155.9	-172.2	0	0	0	0	0	111.7	Q157 H194	Q157-G161 WeakPolarHBondContact O-CA 3.5Å; Q157-G161 PolarHBondContact O-N 3.48Å; Q157-G161 VanDerWaalsContact O-N 3.09Å; Q157-G161 PolarHBondContact OE1-O 2.85Å; G161-H194 PolarHBondContact O-CE1 2.95Å; G161-H194 PolarHBondContact O-NE2 3.01Å
162	D	94.6	Very high	92.4	Very high	35 Å²	35	53.3 Å²	53.3	19%	0.187	27%	0.274	C	S	.	.	S	Bend	trans	-67.4	145	-177.6	-80.3	-9.2	0	0	0	112.8	Q157 Y164 H168 G200	Q157-D162 PolarHBondContact NE2-OD1 3.19Å; D162-Y164 HydrophobicContact CB-CE2 3.82Å; D162-Y164 WeakPolarHBondContact O-CD2 3.41Å; D162-Y164 WeakPolarHBondContact O-CE2 3.32Å; D162-Y164 PolarHBondContact O-N 3.2Å; D162-H168 PolarHBondContact O-CE1 3.44Å; D162-G200 VanDerWaalsContact CG-N 3.32Å; D162-G200 PolarHBondContact OD1-N 3.19Å; D162-G200 PolarHBondContact OD2-N 3.28Å
163	Y	93	Very high	92.2	Very high	44 Å²	44	53.3 Å²	53.3	17%	0.173	27%	0.274	C	S	.	.			trans	-65.7	128.3	170	179.5	-93.6	0	0	0	112.1	P165 H168 Y172 N195	Y163-P165 HydrophobicContact CE1-CG 3.95Å; Y163-H168 HydrophobicContact CD2-CB 3.57Å; Y163-H168 AromaticContact CD2-CG 3.9Å; Y163-H168 HydrophobicContact CE2-CB 3.38Å; Y163-Y172 HydrophobicContact CD2-CE1 4.2Å; Y163-Y172 HydrophobicContact CE2-CE1 4.09Å; Y163-N195 HydrophobicContact CD1-CB 3.87Å; Y163-N195 VanDerWaalsContact CD1-CG 3.5Å; Y163-N195 VanDerWaalsContact CD1-OD1 3.24Å; Y163-N195 WeakPolarHBondContact CD1-OD1 3.24Å; Y163-N195 HydrophobicContact CD2-CB 4.47Å; Y163-N195 HydrophobicContact CE1-CB 4.3Å; Y163-N195 HydrophobicContact CG-CB 3.95Å
164	Y	91.9	Very high	91.8	Very high	101 Å²	101	55.4 Å²	55.4	40%	0.396	29%	0.289	S	S	.	.			trans	-128.6	123.9	171.4	-62.1	-74.9	0	0	0	110	D162 D166 E167 H168	D162-Y164 HydrophobicContact CB-CE2 3.82Å; D162-Y164 WeakPolarHBondContact O-CD2 3.41Å; D162-Y164 WeakPolarHBondContact O-CE2 3.32Å; D162-Y164 PolarHBondContact O-N 3.2Å; Y164-D166 PolarHBondContact O-N 3.1Å; Y164-D166 VanDerWaalsContact O-N 3.13Å; Y164-E167 PolarHBondContact O-N 3.46Å; Y164-H168 PolarHBondContact N-ND1 2.99Å; Y164-H168 WeakPolarHBondContact O-CB 3.44Å; Y164-H168 PolarHBondContact O-N 3.33Å; Y164-H168 PolarHBondContact O-ND1 3.5Å; Y164-H168 VanDerWaalsContact O-ND1 3.1Å
165	P	89.3	Confident	91.2	Very high	94 Å²	94	63.4 Å²	63.4	61%	0.61	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.2	-32	-178.6	-26.4	33.1	0	0	0	114.7	Y163	Y163-P165 HydrophobicContact CE1-CG 3.95Å
166	D	87.8	Confident	90.9	Very high	165 Å²	165	64.9 Å²	64.9	88%	0.882	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.4	-22.2	-178.5	-59.1	-36.2	0	0	0	112.9	Y164	Y164-D166 PolarHBondContact O-N 3.1Å; Y164-D166 VanDerWaalsContact O-N 3.13Å
167	E	86.4	Confident	90.5	Very high	139 Å²	139	70.4 Å²	70.4	65%	0.65	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.6	-23	-177.5	-60.8	-176.5	174.5	0	0	112.7	Y164 P169	Y164-E167 PolarHBondContact O-N 3.46Å; E167-P169 VanDerWaalsContact O-CD 3.28Å; E167-P169 WeakPolarHBondContact O-CD 3.2Å
168	H	88.5	Confident	90.3	Very high	11 Å²	11	70.8 Å²	70.8	5%	0.051	37%	0.366	C	S	.	.			trans	-118.5	85.3	-170.7	-62.1	90	0	0	0	111.3	D162 Y163 Y164 Y172	D162-H168 PolarHBondContact O-CE1 3.44Å; Y163-H168 HydrophobicContact CD2-CB 3.57Å; Y163-H168 AromaticContact CD2-CG 3.9Å; Y163-H168 HydrophobicContact CE2-CB 3.38Å; Y164-H168 PolarHBondContact N-ND1 2.99Å; Y164-H168 WeakPolarHBondContact O-CB 3.44Å; Y164-H168 PolarHBondContact O-N 3.33Å; Y164-H168 PolarHBondContact O-ND1 3.5Å; Y164-H168 VanDerWaalsContact O-ND1 3.1Å; H168-Y172 HydrophobicContact CB-CD1 3.77Å; H168-Y172 HydrophobicContact CB-CD2 4.45Å; H168-Y172 HydrophobicContact CB-CE1 4Å; H168-Y172 HydrophobicContact CB-CG 4.01Å; H168-Y172 AromaticContact CD2-CD2 3.44Å; H168-Y172 VanDerWaalsContact CD2-CD2 3.44Å; H168-Y172 WeakPolarHBondContact CD2-CD2 3.27Å; H168-Y172 AromaticContact CD2-CE2 3.48Å; H168-Y172 VanDerWaalsContact CD2-CE2 3.48Å; H168-Y172 WeakPolarHBondContact CD2-CE2 3.34Å; H168-Y172 AromaticContact CD2-CG 3.87Å; H168-Y172 AromaticContact CD2-CZ 3.99Å
169	P	86.2	Confident	90	Very high	75 Å²	75	70.8 Å²	70.8	49%	0.487	36%	0.364	S	S	.	.			trans	-64.5	163.2	175.1	28.5	-37.1	0	0	0	111.8	E167 N171 Y172	E167-P169 VanDerWaalsContact O-CD 3.28Å; E167-P169 WeakPolarHBondContact O-CD 3.2Å; P169-N171 PolarHBondContact O-N 2.96Å; P169-Y172 WeakPolarHBondContact O-CB 3.33Å; P169-Y172 WeakPolarHBondContact O-CD1 3.39Å; P169-Y172 PolarHBondContact O-N 3.01Å
170	E	82.1	Confident	89.6	Confident	183 Å²	183	72.5 Å²	72.5	86%	0.855	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.3	-13.6	-172	-67.7	-172.5	169.5	0	0	117.2	M191	E170-M191 WeakPolarHBondContact O-CE 3.43Å; E170-M191 VanDerWaalsContact O-SD 3.34Å
171	N	88.1	Confident	89	Confident	100 Å²	100	73.2 Å²	73.2	54%	0.535	38%	0.381	S	S	.	.	T	Hydrogen-bonded Turn	trans	-128.2	24	-177.9	66.8	-44.2	0	0	0	113.4	P169 I173 S174	P169-N171 PolarHBondContact O-N 2.96Å; N171-I173 PolarHBondContact O-N 3.41Å; N171-S174 WeakPolarHBondContact O-CB 3.34Å; N171-S174 PolarHBondContact O-N 3.41Å; N171-S174 PolarHBondContact O-OG 2.94Å
172	Y	90.6	Very high	88.7	Confident	34 Å²	34	73.8 Å²	73.8	13%	0.133	38%	0.377	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-17.5	-173	73.6	-85.8	0	0	0	115.1	V156 Y163 H168 P169 M191 H194	V156-Y172 HydrophobicContact CG1-CE2 3.78Å; Y163-Y172 HydrophobicContact CD2-CE1 4.2Å; Y163-Y172 HydrophobicContact CE2-CE1 4.09Å; H168-Y172 HydrophobicContact CB-CD1 3.77Å; H168-Y172 HydrophobicContact CB-CD2 4.45Å; H168-Y172 HydrophobicContact CB-CE1 4Å; H168-Y172 HydrophobicContact CB-CG 4.01Å; H168-Y172 AromaticContact CD2-CD2 3.44Å; H168-Y172 VanDerWaalsContact CD2-CD2 3.44Å; H168-Y172 WeakPolarHBondContact CD2-CD2 3.27Å; H168-Y172 AromaticContact CD2-CE2 3.48Å; H168-Y172 VanDerWaalsContact CD2-CE2 3.48Å; H168-Y172 WeakPolarHBondContact CD2-CE2 3.34Å; H168-Y172 AromaticContact CD2-CG 3.87Å; H168-Y172 AromaticContact CD2-CZ 3.99Å; P169-Y172 WeakPolarHBondContact O-CB 3.33Å; P169-Y172 WeakPolarHBondContact O-CD1 3.39Å; P169-Y172 PolarHBondContact O-N 3.01Å; Y172-M191 HydrophobicContact CD1-CG 4.26Å; Y172-M191 HydrophobicContact CD1-SD 3.62Å; Y172-M191 HydrophobicContact CE1-CB 4.11Å; Y172-M191 HydrophobicContact CE1-CG 3.47Å; Y172-M191 VanDerWaalsContact CE1-CG 3.47Å; Y172-M191 HydrophobicContact CE1-SD 3.41Å; Y172-M191 WeakPolarHBondContact CE1-SD 3.38Å; Y172-H194 AromaticContact CZ-ND1 3.69Å; Y172-H194 PolarHBondContact OH-ND1 3.02Å
173	I	92.8	Very high	88.6	Confident	0 Å²	0	74.5 Å²	74.5	0%	0	39%	0.385	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101.1	0.3	177.2	67.7	172.9	0	0	0	114.3	V156 N171 D175 F176 Q182 E187 I190 M191	V156-I173 HydrophobicContact CG1-CG2 4.2Å; V156-I173 HydrophobicContact CG2-CG2 3.91Å; N171-I173 PolarHBondContact O-N 3.41Å; I173-D175 PolarHBondContact O-N 3.36Å; I173-F176 HydrophobicContact CB-CB 4.49Å; I173-F176 WeakPolarHBondContact O-CA 3.38Å; I173-F176 WeakPolarHBondContact O-CB 3.35Å; I173-F176 PolarHBondContact O-N 3.41Å; I173-Q182 PolarHBondContact O-NE2 3.44Å; I173-E187 HydrophobicContact CD1-CB 3.91Å; I173-E187 HydrophobicContact CD1-CG 4.1Å; I173-E187 HydrophobicContact CG1-CB 4.15Å; I173-E187 HydrophobicContact CG1-CG 4.19Å; I173-I190 HydrophobicContact CD1-CB 3.9Å; I173-I190 HydrophobicContact CD1-CG2 3.62Å; I173-M191 HydrophobicContact CD1-CG 3.63Å; I173-M191 HydrophobicContact CD1-SD 4.3Å; I173-M191 HydrophobicContact CG1-CG 3.91Å; I173-M191 HydrophobicContact CG1-SD 3.95Å; I173-M191 HydrophobicContact CG2-CG 4.44Å
174	S	89.3	Confident	88.7	Confident	44 Å²	44	79.4 Å²	79.4	31%	0.308	41%	0.409	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.1	-26.5	-174.6	-62.3	0	0	0	0	113.3	N171 E187	N171-S174 WeakPolarHBondContact O-CB 3.34Å; N171-S174 PolarHBondContact O-N 3.41Å; N171-S174 PolarHBondContact O-OG 2.94Å; S174-E187 PolarHBondContact OG-OE2 3Å
175	D	87.3	Confident	88.8	Confident	167 Å²	167	79.5 Å²	79.5	89%	0.893	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.2	-1.4	172.9	-67.7	-30.5	0	0	0	113	I173	I173-D175 PolarHBondContact O-N 3.36Å
176	F	90.1	Very high	89.1	Confident	32 Å²	32	75 Å²	75	14%	0.14	38%	0.383	C	S	.	.	S	Bend	trans	-101.5	92.7	179.9	-174.7	-125.9	0	0	0	109.9	I155 V156 E159 F160 I173 I178 Q182	I155-F176 HydrophobicContact CG2-CE1 3.78Å; I155-F176 HydrophobicContact CG2-CZ 3.78Å; V156-F176 HydrophobicContact CG2-CD1 4.33Å; V156-F176 HydrophobicContact CG2-CE1 4.31Å; E159-F176 HydrophobicContact CB-CZ 4.46Å; E159-F176 HydrophobicContact CG-CZ 4Å; F160-F176 AromaticContact CE2-CD1 3.71Å; F160-F176 HydrophobicContact CE2-CD1 3.71Å; F160-F176 HydrophobicContact CE2-CD2 4.46Å; F160-F176 AromaticContact CE2-CE1 3.94Å; F160-F176 HydrophobicContact CE2-CE1 3.94Å; F160-F176 AromaticContact CE2-CG 4Å; F160-F176 HydrophobicContact CE2-CG 4Å; F160-F176 HydrophobicContact CE2-CZ 4.43Å; F160-F176 HydrophobicContact CZ-CB 4.38Å; F160-F176 HydrophobicContact CZ-CD1 4.36Å; F160-F176 HydrophobicContact CZ-CG 4.19Å; I173-F176 HydrophobicContact CB-CB 4.49Å; I173-F176 WeakPolarHBondContact O-CA 3.38Å; I173-F176 WeakPolarHBondContact O-CB 3.35Å; I173-F176 PolarHBondContact O-N 3.41Å; F176-I178 HydrophobicContact CD1-CD1 3.7Å; F176-I178 HydrophobicContact CD1-CG1 3.49Å; F176-I178 VanDerWaalsContact CD1-CG1 3.49Å; F176-I178 HydrophobicContact CE1-CD1 3.73Å; F176-I178 HydrophobicContact CE1-CG1 3.47Å; F176-I178 VanDerWaalsContact CE1-CG1 3.47Å; F176-I178 HydrophobicContact CG-CG1 4.34Å; F176-I178 HydrophobicContact CZ-CG1 4.28Å; F176-I178 PolarHBondContact O-N 2.92Å; F176-Q182 PolarHBondContact O-NE2 3.15Å; F176-Q182 VanDerWaalsContact O-NE2 3.08Å; F176-Q182 PolarHBondContact O-OE1 3.01Å
177	E	88.6	Confident	89.5	Confident	117 Å²	117	68 Å²	68	55%	0.547	35%	0.345	S	S	.	.			trans	-71.8	97.8	-179.2	-64.7	-175.4	161.9	0	0	111.5	F137	F137-E177 WeakPolarHBondContact CD2-O 3.49Å; F137-E177 HydrophobicContact CE2-CB 4Å
178	I	92.1	Very high	90	Very high	8 Å²	8	68.9 Å²	68.9	4%	0.041	34%	0.342	C	S	.	.			trans	-88.7	-38	176.2	-57.6	170.7	0	0	0	110.8	I136 F137 I155 V156 F176 I190	I136-I178 HydrophobicContact CG2-CG2 4.31Å; F137-I178 WeakPolarHBondContact CA-O 3.29Å; I155-I178 HydrophobicContact CD1-CG2 3.58Å; V156-I178 HydrophobicContact CG2-CD1 3.76Å; F176-I178 HydrophobicContact CD1-CD1 3.7Å; F176-I178 HydrophobicContact CD1-CG1 3.49Å; F176-I178 VanDerWaalsContact CD1-CG1 3.49Å; F176-I178 HydrophobicContact CE1-CD1 3.73Å; F176-I178 HydrophobicContact CE1-CG1 3.47Å; F176-I178 VanDerWaalsContact CE1-CG1 3.47Å; F176-I178 HydrophobicContact CG-CG1 4.34Å; F176-I178 HydrophobicContact CZ-CG1 4.28Å; F176-I178 PolarHBondContact O-N 2.92Å; I178-I190 HydrophobicContact CD1-CD1 4.32Å
179	F	91.1	Very high	90.4	Very high	8 Å²	8	71.5 Å²	71.5	4%	0.035	35%	0.353	C	S	.	.	S	Bend	trans	-124.9	150.8	-175.7	-62.5	-90.2	0	0	0	111.7	I136 A148 K181 Q182 L186 I190 Y445	I136-F179 HydrophobicContact CG2-CD1 3.51Å; I136-F179 HydrophobicContact CG2-CE1 3.26Å; I136-F179 HydrophobicContact CG2-CG 4.26Å; I136-F179 HydrophobicContact CG2-CZ 3.8Å; A148-F179 HydrophobicContact CB-CE1 3.95Å; A148-F179 HydrophobicContact CB-CZ 3.88Å; A148-F179 WeakPolarHBondContact O-CZ 3.34Å; F179-K181 PolarHBondContact O-N 3.45Å; F179-K181 VanDerWaalsContact O-N 3.09Å; F179-Q182 HydrophobicContact CB-CB 4.46Å; F179-Q182 PolarHBondContact O-N 2.84Å; F179-L186 HydrophobicContact CD2-CD2 3.78Å; F179-L186 HydrophobicContact CE2-CD2 4.1Å; F179-L186 HydrophobicContact CG-CD2 4.26Å; F179-I190 HydrophobicContact CE2-CD1 4.16Å; F179-Y445 VanDerWaalsContact CB-OH 3.29Å; F179-Y445 WeakPolarHBondContact CB-OH 3.35Å; F179-Y445 AromaticContact CD1-CE1 3.95Å; F179-Y445 HydrophobicContact CD1-CE1 3.95Å; F179-Y445 HydrophobicContact CE1-CE1 4.38Å; F179-Y445 HydrophobicContact CG-CE1 4.45Å
180	P	84.2	Confident	91	Very high	68 Å²	68	68 Å²	68	44%	0.442	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.5	-27.5	176	-19.7	24.1	0	0	0	115	F137 P447	F137-P180 VanDerWaalsContact O-CD 3.27Å; F137-P180 WeakPolarHBondContact O-CD 3.25Å; F137-P180 WeakPolarHBondContact O-CG 3.21Å; P180-P447 HydrophobicContact CG-CB 4.38Å
181	K	81.7	Confident	91.7	Very high	88 Å²	88	60.2 Å²	60.2	38%	0.383	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	-131.8	55.6	-178.3	-66.1	-170.2	-177.2	174.9	0	110.7	F179 S183 Y445 P447 A449	F179-K181 PolarHBondContact O-N 3.45Å; F179-K181 VanDerWaalsContact O-N 3.09Å; K181-S183 PolarHBondContact O-N 2.89Å; K181-S183 VanDerWaalsContact O-N 3.12Å; K181-Y445 PolarHBondContact O-OH 3.29Å; K181-P447 WeakPolarHBondContact CD-O 3.47Å; K181-P447 WeakPolarHBondContact CE-O 3.46Å; K181-P447 WeakPolarHBondContact CG-O 3.16Å; K181-A449 PolarHBondContact NZ-O 3.27Å
182	Q	87.1	Confident	92.1	Very high	37 Å²	37	59.9 Å²	59.9	17%	0.173	29%	0.289	C	S	.	.			trans	-66.7	109	176.9	-171.9	166.2	-59.6	0	0	110	I173 F176 F179 E187	I173-Q182 PolarHBondContact O-NE2 3.44Å; F176-Q182 PolarHBondContact O-NE2 3.15Å; F176-Q182 VanDerWaalsContact O-NE2 3.08Å; F176-Q182 PolarHBondContact O-OE1 3.01Å; F179-Q182 HydrophobicContact CB-CB 4.46Å; F179-Q182 PolarHBondContact O-N 2.84Å; Q182-E187 HydrophobicContact CG-CG 3.63Å; Q182-E187 WeakPolarHBondContact CG-OE1 3.5Å; Q182-E187 PolarHBondContact NE2-OE1 3.44Å
183	S	92.9	Very high	92.4	Very high	50 Å²	50	58.6 Å²	58.6	35%	0.35	29%	0.285	S	S	.	.			trans	-92.8	152.7	177.7	69.6	0	0	0	0	110.8	K181 K185 L186 E187	K181-S183 PolarHBondContact O-N 2.89Å; K181-S183 VanDerWaalsContact O-N 3.12Å; S183-K185 PolarHBondContact O-N 3.39Å; S183-K185 VanDerWaalsContact O-N 3.14Å; S183-L186 WeakPolarHBondContact O-CA 3.45Å; S183-L186 WeakPolarHBondContact O-CB 3.49Å; S183-L186 PolarHBondContact O-N 3.06Å; S183-L186 WeakPolarHBondContact OG-CB 3.46Å; S183-L186 PolarHBondContact OG-N 3.19Å; S183-E187 PolarHBondContact O-N 2.8Å
184	Q	94.2	Very high	92.6	Very high	146 Å²	146	58.6 Å²	58.6	68%	0.682	29%	0.285	S	S	*	.	H	α-helix	trans	-60	-27.2	176.1	-161.8	178.6	27.3	0	0	113.1	R188	Q184-R188 WeakPolarHBondContact O-CG 3.32Å; Q184-R188 PolarHBondContact O-N 2.84Å; Q184-R188 VanDerWaalsContact O-N 3.1Å; Q184-R188 PolarHBondContact O-NE 2.81Å
185	K	95.4	Very high	92.9	Very high	104 Å²	104	59.6 Å²	59.6	45%	0.452	29%	0.287	S	S	.	.	H	α-helix	trans	-66.4	-43.1	171.8	-174.6	-179.8	178	177	0	111	F145 S183 K189 E442	F145-K185 HydrophobicContact CE2-CD 4.47Å; F145-K185 HydrophobicContact CE2-CG 4.22Å; F145-K185 HydrophobicContact CZ-CD 4.42Å; F145-K185 HydrophobicContact CZ-CG 3.95Å; S183-K185 PolarHBondContact O-N 3.39Å; S183-K185 VanDerWaalsContact O-N 3.14Å; K185-K189 PolarHBondContact O-N 3.35Å; K185-E442 IonicContact NZ-OE1 3.35Å
186	L	95.6	Very high	93.3	Very high	0 Å²	0	56 Å²	56	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-66.6	-43.6	176.1	-179.6	60.2	0	0	0	111	F145 A148 A149 F179 S183 R188 K189 I190 Y445	F145-L186 HydrophobicContact CD2-CD1 4.35Å; F145-L186 HydrophobicContact CE2-CB 3.97Å; F145-L186 HydrophobicContact CE2-CD1 4.01Å; F145-L186 HydrophobicContact CZ-CD1 4.35Å; A148-L186 HydrophobicContact CB-CD1 4.09Å; A149-L186 HydrophobicContact CB-CD1 3.89Å; F179-L186 HydrophobicContact CD2-CD2 3.78Å; F179-L186 HydrophobicContact CE2-CD2 4.1Å; F179-L186 HydrophobicContact CG-CD2 4.26Å; S183-L186 WeakPolarHBondContact O-CA 3.45Å; S183-L186 WeakPolarHBondContact O-CB 3.49Å; S183-L186 PolarHBondContact O-N 3.06Å; S183-L186 WeakPolarHBondContact OG-CB 3.46Å; S183-L186 PolarHBondContact OG-N 3.19Å; L186-R188 PolarHBondContact O-N 2.86Å; L186-K189 PolarHBondContact O-N 3.29Å; L186-K189 VanDerWaalsContact O-N 3.15Å; L186-I190 HydrophobicContact CD1-CD1 4.21Å; L186-I190 HydrophobicContact CD1-CG1 4.3Å; L186-I190 HydrophobicContact CD2-CD1 4.5Å; L186-I190 HydrophobicContact CG-CD1 3.84Å; L186-I190 HydrophobicContact CG-CG1 4.39Å; L186-I190 WeakPolarHBondContact O-CG1 3.45Å; L186-I190 PolarHBondContact O-N 2.87Å; L186-Y445 HydrophobicContact CD2-CE2 4.16Å
187	E	96	Very high	93.6	Very high	18 Å²	18	59.8 Å²	59.8	8%	0.084	29%	0.289	C	S	.	.	H	α-helix	trans	-57.4	-50	177.4	-70.2	-178.3	-179.3	0	0	112	I173 S174 Q182 S183 K189 I190 M191	I173-E187 HydrophobicContact CD1-CB 3.91Å; I173-E187 HydrophobicContact CD1-CG 4.1Å; I173-E187 HydrophobicContact CG1-CB 4.15Å; I173-E187 HydrophobicContact CG1-CG 4.19Å; S174-E187 PolarHBondContact OG-OE2 3Å; Q182-E187 HydrophobicContact CG-CG 3.63Å; Q182-E187 WeakPolarHBondContact CG-OE1 3.5Å; Q182-E187 PolarHBondContact NE2-OE1 3.44Å; S183-E187 PolarHBondContact O-N 2.8Å; E187-K189 VanDerWaalsContact C-N 3.25Å; E187-K189 PolarHBondContact O-N 3.21Å; E187-I190 WeakPolarHBondContact O-CB 3.35Å; E187-I190 PolarHBondContact O-N 3.26Å; E187-I190 VanDerWaalsContact O-N 3.14Å; E187-M191 HydrophobicContact CB-CE 4.36Å; E187-M191 WeakPolarHBondContact O-CG 2.99Å; E187-M191 PolarHBondContact O-N 3.27Å
188	R	96	Very high	93.9	Very high	156 Å²	156	54.3 Å²	54.3	59%	0.589	26%	0.264	S	S	*	.	H	α-helix	trans	-55.7	-42.4	176.5	-76.1	-175.2	-70.6	157.6	-6.6	111.9	Q184 L186 M191 E192	Q184-R188 WeakPolarHBondContact O-CG 3.32Å; Q184-R188 PolarHBondContact O-N 2.84Å; Q184-R188 VanDerWaalsContact O-N 3.1Å; Q184-R188 PolarHBondContact O-NE 2.81Å; L186-R188 PolarHBondContact O-N 2.86Å; R188-M191 HydrophobicContact CG-CE 4.34Å; R188-M191 PolarHBondContact O-N 3.06Å; R188-E192 WeakPolarHBondContact O-CB 3.32Å; R188-E192 PolarHBondContact O-N 2.84Å
189	K	97.7	Very high	94.1	Very high	67 Å²	67	61.6 Å²	61.6	29%	0.291	29%	0.291	S	S	.	.	H	α-helix	trans	-69.8	-37.1	179.1	-167.6	59.3	-179	176.8	0	112.8	F145 A149 K185 L186 E187 E192 I193	F145-K189 HydrophobicContact CE1-CB 4.14Å; F145-K189 HydrophobicContact CE1-CG 4.09Å; F145-K189 HydrophobicContact CZ-CB 4.12Å; A149-K189 HydrophobicContact CB-CB 3.97Å; A149-K189 HydrophobicContact CB-CG 3.56Å; K185-K189 PolarHBondContact O-N 3.35Å; L186-K189 PolarHBondContact O-N 3.29Å; L186-K189 VanDerWaalsContact O-N 3.15Å; E187-K189 VanDerWaalsContact C-N 3.25Å; E187-K189 PolarHBondContact O-N 3.21Å; K189-E192 WeakPolarHBondContact CD-OE2 3.48Å; K189-E192 IonicContact NZ-OE1 2.76Å; K189-E192 PolarHBondContact NZ-OE1 3.4Å; K189-E192 IonicContact NZ-OE2 2.92Å; K189-E192 PolarHBondContact NZ-OE2 3.42Å; K189-E192 PolarHBondContact O-N 3.44Å; K189-I193 HydrophobicContact CG-CD1 4.19Å; K189-I193 WeakPolarHBondContact O-CG1 3.35Å; K189-I193 PolarHBondContact O-N 2.94Å; K189-I193 VanDerWaalsContact O-N 3.09Å
190	I	97.7	Very high	94.2	Very high	0 Å²	0	64.1 Å²	64.1	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-59.8	-49	173.2	-72.5	167.6	0	0	0	110.1	A149 A153 V156 I173 I178 F179 L186 E187 E192 I193 H194	A149-I190 HydrophobicContact CB-CG1 4.42Å; A149-I190 WeakPolarHBondContact O-CG1 3.44Å; A153-I190 HydrophobicContact CB-CG2 4.33Å; V156-I190 HydrophobicContact CG2-CG2 3.79Å; I173-I190 HydrophobicContact CD1-CB 3.9Å; I173-I190 HydrophobicContact CD1-CG2 3.62Å; I178-I190 HydrophobicContact CD1-CD1 4.32Å; F179-I190 HydrophobicContact CE2-CD1 4.16Å; L186-I190 HydrophobicContact CD1-CD1 4.21Å; L186-I190 HydrophobicContact CD1-CG1 4.3Å; L186-I190 HydrophobicContact CD2-CD1 4.5Å; L186-I190 HydrophobicContact CG-CD1 3.84Å; L186-I190 HydrophobicContact CG-CG1 4.39Å; L186-I190 WeakPolarHBondContact O-CG1 3.45Å; L186-I190 PolarHBondContact O-N 2.87Å; E187-I190 WeakPolarHBondContact O-CB 3.35Å; E187-I190 PolarHBondContact O-N 3.26Å; E187-I190 VanDerWaalsContact O-N 3.14Å; I190-E192 VanDerWaalsContact C-N 3.34Å; I190-E192 PolarHBondContact O-N 3.06Å; I190-I193 PolarHBondContact O-N 2.96Å; I190-H194 WeakPolarHBondContact O-CB 3.43Å; I190-H194 PolarHBondContact O-N 3.29Å
191	M	96.6	Very high	94.8	Very high	21 Å²	21	62.8 Å²	62.8	10%	0.103	31%	0.306	C	S	.	.	H	α-helix	trans	-65.8	-37.3	-179.2	-66.1	-175.1	-71.9	0	0	112.4	E170 Y172 I173 E187 R188 H194 N195	E170-M191 WeakPolarHBondContact O-CE 3.43Å; E170-M191 VanDerWaalsContact O-SD 3.34Å; Y172-M191 HydrophobicContact CD1-CG 4.26Å; Y172-M191 HydrophobicContact CD1-SD 3.62Å; Y172-M191 HydrophobicContact CE1-CB 4.11Å; Y172-M191 HydrophobicContact CE1-CG 3.47Å; Y172-M191 VanDerWaalsContact CE1-CG 3.47Å; Y172-M191 HydrophobicContact CE1-SD 3.41Å; Y172-M191 WeakPolarHBondContact CE1-SD 3.38Å; I173-M191 HydrophobicContact CD1-CG 3.63Å; I173-M191 HydrophobicContact CD1-SD 4.3Å; I173-M191 HydrophobicContact CG1-CG 3.91Å; I173-M191 HydrophobicContact CG1-SD 3.95Å; I173-M191 HydrophobicContact CG2-CG 4.44Å; E187-M191 HydrophobicContact CB-CE 4.36Å; E187-M191 WeakPolarHBondContact O-CG 2.99Å; E187-M191 PolarHBondContact O-N 3.27Å; R188-M191 HydrophobicContact CG-CE 4.34Å; R188-M191 PolarHBondContact O-N 3.06Å; M191-H194 PolarHBondContact O-N 2.86Å; M191-N195 WeakPolarHBondContact O-CB 3.35Å; M191-N195 PolarHBondContact O-N 3.49Å
192	E	96.4	Very high	95.5	Very high	92 Å²	92	61.1 Å²	61.1	43%	0.43	31%	0.306	S	S	.	.	H	α-helix	trans	-58.3	-53.2	173.3	-172.2	-164.1	144.3	0	0	110.9	R188 K189 I190 H194 N195 T196	R188-E192 WeakPolarHBondContact O-CB 3.32Å; R188-E192 PolarHBondContact O-N 2.84Å; K189-E192 WeakPolarHBondContact CD-OE2 3.48Å; K189-E192 IonicContact NZ-OE1 2.76Å; K189-E192 PolarHBondContact NZ-OE1 3.4Å; K189-E192 IonicContact NZ-OE2 2.92Å; K189-E192 PolarHBondContact NZ-OE2 3.42Å; K189-E192 PolarHBondContact O-N 3.44Å; I190-E192 VanDerWaalsContact C-N 3.34Å; I190-E192 PolarHBondContact O-N 3.06Å; E192-H194 VanDerWaalsContact C-N 3.35Å; E192-H194 PolarHBondContact O-N 2.91Å; E192-N195 PolarHBondContact O-N 2.97Å; E192-T196 WeakPolarHBondContact O-CG2 3.34Å; E192-T196 PolarHBondContact O-N 2.91Å; E192-T196 PolarHBondContact O-OG1 2.92Å
193	I	98.1	Very high	95.9	Very high	7 Å²	7	61.4 Å²	61.4	4%	0.036	31%	0.311	C	S	.	.	H	α-helix	trans	-63.8	-40.6	179.8	-64.8	168.1	0	0	0	111	A149 Y150 A153 K189 I190 N195 T196 E197 L198	A149-I193 HydrophobicContact CB-CD1 3.79Å; Y150-I193 HydrophobicContact CD2-CG2 4.28Å; A153-I193 HydrophobicContact CB-CB 3.74Å; A153-I193 HydrophobicContact CB-CG2 3.49Å; A153-I193 VanDerWaalsContact CB-CG2 3.49Å; K189-I193 HydrophobicContact CG-CD1 4.19Å; K189-I193 WeakPolarHBondContact O-CG1 3.35Å; K189-I193 PolarHBondContact O-N 2.94Å; K189-I193 VanDerWaalsContact O-N 3.09Å; I190-I193 PolarHBondContact O-N 2.96Å; I193-N195 VanDerWaalsContact C-N 3.3Å; I193-N195 PolarHBondContact O-N 3.31Å; I193-T196 PolarHBondContact O-N 3.14Å; I193-E197 HydrophobicContact CG2-CB 4.09Å; I193-E197 HydrophobicContact CG2-CG 4.4Å; I193-E197 PolarHBondContact O-N 2.88Å; I193-L198 HydrophobicContact CG2-CD1 4.4Å; I193-L198 HydrophobicContact CG2-CG 4.27Å; I193-L198 PolarHBondContact O-N 3.3Å
194	H	97.3	Very high	96	Very high	0 Å²	0	60.3 Å²	60.3	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-56.8	-45.4	176.9	179.9	-142.8	0	0	0	111.4	V156 Q157 G161 Y172 I190 M191 E192	V156-H194 HydrophobicContact CG1-CB 4.48Å; V156-H194 WeakPolarHBondContact CG1-ND1 3.34Å; Q157-H194 PolarHBondContact OE1-CD2 2.82Å; Q157-H194 PolarHBondContact OE1-NE2 3.05Å; G161-H194 PolarHBondContact O-CE1 2.95Å; G161-H194 PolarHBondContact O-NE2 3.01Å; Y172-H194 AromaticContact CZ-ND1 3.69Å; Y172-H194 PolarHBondContact OH-ND1 3.02Å; I190-H194 WeakPolarHBondContact O-CB 3.43Å; I190-H194 PolarHBondContact O-N 3.29Å; M191-H194 PolarHBondContact O-N 2.86Å; E192-H194 VanDerWaalsContact C-N 3.35Å; E192-H194 PolarHBondContact O-N 2.91Å
195	N	94.8	Very high	96.1	Very high	65 Å²	65	57.3 Å²	57.3	35%	0.348	29%	0.293	S	S	.	.	H	α-helix	trans	-71.5	-44.4	178.9	-179.9	22.5	0	0	0	113	Y163 M191 E192 I193	Y163-N195 HydrophobicContact CD1-CB 3.87Å; Y163-N195 VanDerWaalsContact CD1-CG 3.5Å; Y163-N195 VanDerWaalsContact CD1-OD1 3.24Å; Y163-N195 WeakPolarHBondContact CD1-OD1 3.24Å; Y163-N195 HydrophobicContact CD2-CB 4.47Å; Y163-N195 HydrophobicContact CE1-CB 4.3Å; Y163-N195 HydrophobicContact CG-CB 3.95Å; M191-N195 WeakPolarHBondContact O-CB 3.35Å; M191-N195 PolarHBondContact O-N 3.49Å; E192-N195 PolarHBondContact O-N 2.97Å; I193-N195 VanDerWaalsContact C-N 3.3Å; I193-N195 PolarHBondContact O-N 3.31Å
196	T	95.2	Very high	96.2	Very high	91 Å²	91	52.4 Å²	52.4	56%	0.558	27%	0.271	S	S	*	.	H	α-helix	trans	-91.6	-33.9	-167.7	59.3	0	0	0	0	114.5	E192 I193	E192-T196 WeakPolarHBondContact O-CG2 3.34Å; E192-T196 PolarHBondContact O-N 2.91Å; E192-T196 PolarHBondContact O-OG1 2.92Å; I193-T196 PolarHBondContact O-N 3.14Å
197	E	96.5	Very high	96.3	Very high	113 Å²	113	52.7 Å²	52.7	53%	0.528	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-111.3	-27.5	-169.1	-63.9	-177.6	-149.6	0	0	114.1	I193	I193-E197 HydrophobicContact CG2-CB 4.09Å; I193-E197 HydrophobicContact CG2-CG 4.4Å; I193-E197 PolarHBondContact O-N 2.88Å
198	L	96.6	Very high	96.4	Very high	2 Å²	2	54.2 Å²	54.2	1%	0.01	28%	0.279	C	S	.	.	S	Bend	trans	-105.1	-7.3	-169	-58.1	-172.9	0	0	0	115.1	Y150 A153 Q157 I193 G200 Q201	Y150-L198 HydrophobicContact CE2-CD2 4.35Å; A153-L198 HydrophobicContact CB-CD1 3.58Å; A153-L198 VanDerWaalsContact O-CD1 3.29Å; A153-L198 WeakPolarHBondContact O-CD1 3.33Å; Q157-L198 HydrophobicContact CB-CB 4.23Å; Q157-L198 HydrophobicContact CB-CD1 4.06Å; Q157-L198 HydrophobicContact CG-CB 4.11Å; Q157-L198 PolarHBondContact NE2-O 2.86Å; Q157-L198 PolarHBondContact OE1-O 3.16Å; I193-L198 HydrophobicContact CG2-CD1 4.4Å; I193-L198 HydrophobicContact CG2-CG 4.27Å; I193-L198 PolarHBondContact O-N 3.3Å; L198-G200 PolarHBondContact O-N 3.44Å; L198-Q201 VanDerWaalsContact O-CB 3.26Å; L198-Q201 WeakPolarHBondContact O-CB 3.47Å; L198-Q201 VanDerWaalsContact O-CG 3.26Å; L198-Q201 WeakPolarHBondContact O-CG 3.43Å; L198-Q201 PolarHBondContact O-N 2.76Å; L198-Q201 VanDerWaalsContact O-N 3.13Å
199	R	94.5	Very high	96.4	Very high	161 Å²	161	48.4 Å²	48.4	61%	0.608	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.2	134.7	-179.7	-169.7	177.6	-177.1	-175.6	2.9	112.6	Q201	R199-Q201 VanDerWaalsContact C-N 3.3Å
200	G	94.8	Very high	96.5	Very high	60 Å²	60	45.2 Å²	45.2	62%	0.619	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	83.5	-1.3	-178.7	0	0	0	0	0	114.1	D162 L198	D162-G200 VanDerWaalsContact CG-N 3.32Å; D162-G200 PolarHBondContact OD1-N 3.19Å; D162-G200 PolarHBondContact OD2-N 3.28Å; L198-G200 PolarHBondContact O-N 3.44Å
201	Q	97.1	Very high	96.5	Very high	40 Å²	40	45.2 Å²	45.2	19%	0.187	25%	0.246	C	C	.	.			trans	-80.2	129.9	174.5	-64.8	-176.5	29.3	0	0	110.4	Q157 L198 R199 I205 N209	Q157-Q201 HydrophobicContact CG-CB 4.28Å; Q157-Q201 PolarHBondContact NE2-O 3Å; L198-Q201 VanDerWaalsContact O-CB 3.26Å; L198-Q201 WeakPolarHBondContact O-CB 3.47Å; L198-Q201 VanDerWaalsContact O-CG 3.26Å; L198-Q201 WeakPolarHBondContact O-CG 3.43Å; L198-Q201 PolarHBondContact O-N 2.76Å; L198-Q201 VanDerWaalsContact O-N 3.13Å; R199-Q201 VanDerWaalsContact C-N 3.3Å; Q201-I205 HydrophobicContact CB-CB 4.35Å; Q201-I205 HydrophobicContact CB-CG2 4.14Å; Q201-I205 HydrophobicContact CG-CG2 4.06Å; Q201-N209 PolarHBondContact OE1-ND2 3.29Å
202	S	95.8	Very high	96.5	Very high	54 Å²	54	46.4 Å²	46.4	38%	0.378	25%	0.253	S	S	.	.			trans	-68.2	158.6	169.6	68.8	0	0	0	0	110.8	A204 I205 A206	S202-A204 PolarHBondContact O-N 2.97Å; S202-I205 PolarHBondContact O-N 3.48Å; S202-I205 WeakPolarHBondContact OG-CG1 3.39Å; S202-A206 PolarHBondContact O-N 2.83Å
203	P	95.8	Very high	96.6	Very high	43 Å²	43	45 Å²	45	28%	0.279	25%	0.245	S	C	.	.	H	α-helix	trans	-51.7	-42.8	175.4	-30.8	37	0	0	0	113	I205 A206 E207	P203-I205 VanDerWaalsContact C-N 3.27Å; P203-I205 PolarHBondContact O-N 3.24Å; P203-A206 PolarHBondContact O-N 2.89Å; P203-E207 VanDerWaalsContact O-CB 3.28Å; P203-E207 WeakPolarHBondContact O-CB 3.34Å; P203-E207 VanDerWaalsContact O-CD 3.22Å; P203-E207 WeakPolarHBondContact O-CG 3.47Å; P203-E207 PolarHBondContact O-N 2.92Å
204	A	95	Very high	96.5	Very high	27 Å²	27	44.7 Å²	44.7	22%	0.223	24%	0.243	C	C	.	.	H	α-helix	trans	-57.6	-37.3	176.9	0	0	0	0	0	113.5	S202 E207 F208	S202-A204 PolarHBondContact O-N 2.97Å; A204-E207 WeakPolarHBondContact CA-OE2 3.45Å; A204-F208 VanDerWaalsContact O-CB 3.29Å; A204-F208 WeakPolarHBondContact O-CB 3.41Å; A204-F208 PolarHBondContact O-N 3.03Å; A204-F208 VanDerWaalsContact O-N 3.12Å
205	I	96.2	Very high	96.4	Very high	83 Å²	83	47.3 Å²	47.3	43%	0.426	26%	0.256	S	S	.	.	H	α-helix	trans	-75.2	-44.6	178.7	-66.2	170.8	0	0	0	110.2	Q201 S202 P203 F208 N209	Q201-I205 HydrophobicContact CB-CB 4.35Å; Q201-I205 HydrophobicContact CB-CG2 4.14Å; Q201-I205 HydrophobicContact CG-CG2 4.06Å; S202-I205 PolarHBondContact O-N 3.48Å; S202-I205 WeakPolarHBondContact OG-CG1 3.39Å; P203-I205 VanDerWaalsContact C-N 3.27Å; P203-I205 PolarHBondContact O-N 3.24Å; I205-F208 PolarHBondContact O-N 3.09Å; I205-N209 WeakPolarHBondContact O-CB 3.43Å; I205-N209 VanDerWaalsContact O-CG 3.3Å; I205-N209 PolarHBondContact O-N 3.37Å; I205-N209 PolarHBondContact O-ND2 3.24Å
206	A	97.8	Very high	96.4	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-62.1	-44.2	177.4	0	0	0	0	0	111.9	Q157 A158 S202 P203 F208 N209 L210	Q157-A206 HydrophobicContact CB-CB 3.96Å; Q157-A206 HydrophobicContact CG-CB 3.76Å; A158-A206 HydrophobicContact CB-CB 4.29Å; S202-A206 PolarHBondContact O-N 2.83Å; P203-A206 PolarHBondContact O-N 2.89Å; A206-F208 VanDerWaalsContact C-N 3.31Å; A206-F208 PolarHBondContact O-N 3.25Å; A206-N209 PolarHBondContact O-N 3.28Å; A206-L210 PolarHBondContact O-N 3.45Å
207	E	97.3	Very high	96.3	Very high	7 Å²	7	45.1 Å²	45.1	3%	0.033	24%	0.243	C	C	.	.	H	α-helix	trans	-57	-45.1	172.7	-70.4	159	-174.7	0	0	111.2	Y129 A158 P203 A204 L210 L211 R357	Y129-E207 HydrophobicContact CD1-CG 3.89Å; Y129-E207 HydrophobicContact CD2-CB 3.83Å; Y129-E207 HydrophobicContact CD2-CG 3.76Å; Y129-E207 HydrophobicContact CE1-CG 4.07Å; Y129-E207 HydrophobicContact CE2-CB 4.35Å; Y129-E207 HydrophobicContact CE2-CG 3.89Å; Y129-E207 HydrophobicContact CG-CB 3.95Å; Y129-E207 HydrophobicContact CG-CG 3.75Å; A158-E207 HydrophobicContact CB-CG 4.05Å; P203-E207 VanDerWaalsContact O-CB 3.28Å; P203-E207 WeakPolarHBondContact O-CB 3.34Å; P203-E207 VanDerWaalsContact O-CD 3.22Å; P203-E207 WeakPolarHBondContact O-CG 3.47Å; P203-E207 PolarHBondContact O-N 2.92Å; A204-E207 WeakPolarHBondContact CA-OE2 3.45Å; E207-L210 WeakPolarHBondContact O-CB 3.29Å; E207-L210 PolarHBondContact O-N 3.38Å; E207-L211 WeakPolarHBondContact O-CG 3.42Å; E207-L211 PolarHBondContact O-N 2.99Å; E207-L211 VanDerWaalsContact O-N 3.12Å; E207-R357 WeakPolarHBondContact OE1-CD 3.49Å; E207-R357 IonicContact OE1-CZ 2.89Å; E207-R357 IonicContact OE1-NE 3.48Å; E207-R357 PolarHBondContact OE1-NE 3.13Å; E207-R357 IonicContact OE1-NH2 3.31Å; E207-R357 IonicContact OE2-CZ 3.49Å; E207-R357 IonicContact OE2-NE 3.3Å; E207-R357 IonicContact OE2-NH2 3.07Å; E207-R357 PolarHBondContact OE2-NH2 3.12Å
208	F	96.6	Very high	96.1	Very high	50 Å²	50	44.2 Å²	44.2	22%	0.219	24%	0.239	C	C	.	.	H	α-helix	trans	-67	-42.1	178.9	-175.3	-120.3	0	0	0	112.7	L117 A204 I205 A206 L210 L211 L212	L117-F208 HydrophobicContact CB-CZ 4.4Å; L117-F208 HydrophobicContact CD2-CE1 4.12Å; L117-F208 HydrophobicContact CD2-CZ 3.63Å; L117-F208 HydrophobicContact CG-CZ 3.8Å; A204-F208 VanDerWaalsContact O-CB 3.29Å; A204-F208 WeakPolarHBondContact O-CB 3.41Å; A204-F208 PolarHBondContact O-N 3.03Å; A204-F208 VanDerWaalsContact O-N 3.12Å; I205-F208 PolarHBondContact O-N 3.09Å; A206-F208 VanDerWaalsContact C-N 3.31Å; A206-F208 PolarHBondContact O-N 3.25Å; F208-L210 VanDerWaalsContact C-N 3.29Å; F208-L210 PolarHBondContact O-N 3.16Å; F208-L211 WeakPolarHBondContact O-CB 3.25Å; F208-L211 PolarHBondContact O-N 3.39Å; F208-L211 VanDerWaalsContact O-N 3.09Å; F208-L212 HydrophobicContact CD1-CD1 4.05Å; F208-L212 HydrophobicContact CD1-CG 4.38Å; F208-L212 HydrophobicContact CE1-CD1 3.79Å; F208-L212 HydrophobicContact CE1-CD2 4.39Å; F208-L212 HydrophobicContact CE1-CG 4.15Å; F208-L212 HydrophobicContact CZ-CD1 4.36Å; F208-L212 HydrophobicContact CZ-CD2 4.13Å; F208-L212 HydrophobicContact CZ-CG 4.28Å; F208-L212 WeakPolarHBondContact O-CG 3.47Å; F208-L212 PolarHBondContact O-N 3.5Å
209	N	97.6	Very high	95.9	Very high	33 Å²	33	44.7 Å²	44.7	18%	0.176	24%	0.242	C	C	.	.	H	α-helix	trans	-61.4	-38.3	175.2	-74.8	-19.9	0	0	0	111.8	Q201 I205 A206 L211 L212 K213	Q201-N209 PolarHBondContact OE1-ND2 3.29Å; I205-N209 WeakPolarHBondContact O-CB 3.43Å; I205-N209 VanDerWaalsContact O-CG 3.3Å; I205-N209 PolarHBondContact O-N 3.37Å; I205-N209 PolarHBondContact O-ND2 3.24Å; A206-N209 PolarHBondContact O-N 3.28Å; N209-L211 VanDerWaalsContact C-N 3.35Å; N209-L211 PolarHBondContact O-N 3.18Å; N209-L212 WeakPolarHBondContact O-CB 3.46Å; N209-L212 PolarHBondContact O-N 2.93Å; N209-K213 PolarHBondContact O-N 2.98Å
210	L	98.3	Very high	95.9	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-59.4	-45.3	171.4	-176.5	147.7	0	0	0	111.5	Y129 I132 I136 L151 C154 I155 A206 E207 F208 K213 A214	Y129-L210 HydrophobicContact CD2-CB 4.36Å; Y129-L210 HydrophobicContact CD2-CD1 4.16Å; Y129-L210 HydrophobicContact CD2-CD2 4.05Å; Y129-L210 HydrophobicContact CD2-CG 4.41Å; Y129-L210 HydrophobicContact CE2-CD1 3.9Å; I132-L210 HydrophobicContact CB-CD2 4.05Å; I132-L210 HydrophobicContact CG2-CD2 3.55Å; I136-L210 HydrophobicContact CD1-CD1 4.34Å; L151-L210 HydrophobicContact CD2-CD1 4.32Å; L151-L210 HydrophobicContact CD2-CD2 4.48Å; L151-L210 HydrophobicContact CD2-CG 3.75Å; C154-L210 HydrophobicContact CB-CB 3.88Å; C154-L210 HydrophobicContact CB-CD1 4.23Å; I155-L210 HydrophobicContact CD1-CD1 3.9Å; I155-L210 HydrophobicContact CG1-CD1 3.41Å; I155-L210 VanDerWaalsContact CG1-CD1 3.41Å; A206-L210 PolarHBondContact O-N 3.45Å; E207-L210 WeakPolarHBondContact O-CB 3.29Å; E207-L210 PolarHBondContact O-N 3.38Å; F208-L210 VanDerWaalsContact C-N 3.29Å; F208-L210 PolarHBondContact O-N 3.16Å; L210-K213 PolarHBondContact O-N 2.92Å; L210-A214 VanDerWaalsContact O-CB 3.24Å; L210-A214 WeakPolarHBondContact O-CB 3.25Å; L210-A214 PolarHBondContact O-N 3.49Å
211	L	98	Very high	95.8	Very high	1 Å²	1	35.4 Å²	35.4	1%	0.005	19%	0.191	C	C	.	.	H	α-helix	trans	-63.3	-42	177.1	-65.7	176.5	0	0	0	112.1	P116 R125 L128 I132 E207 F208 N209 K213 A214 H215	P116-L211 HydrophobicContact CB-CB 3.97Å; P116-L211 HydrophobicContact CB-CD1 4.49Å; P116-L211 HydrophobicContact CG-CB 4.18Å; R125-L211 HydrophobicContact CB-CD1 3.96Å; R125-L211 HydrophobicContact CG-CD1 4.48Å; R125-L211 WeakPolarHBondContact O-CD1 3.24Å; L128-L211 HydrophobicContact CB-CD1 4.29Å; L128-L211 HydrophobicContact CB-CD2 3.99Å; I132-L211 HydrophobicContact CG1-CD2 3.99Å; E207-L211 WeakPolarHBondContact O-CG 3.42Å; E207-L211 PolarHBondContact O-N 2.99Å; E207-L211 VanDerWaalsContact O-N 3.12Å; F208-L211 WeakPolarHBondContact O-CB 3.25Å; F208-L211 PolarHBondContact O-N 3.39Å; F208-L211 VanDerWaalsContact O-N 3.09Å; N209-L211 VanDerWaalsContact C-N 3.35Å; N209-L211 PolarHBondContact O-N 3.18Å; L211-K213 VanDerWaalsContact C-N 3.3Å; L211-K213 PolarHBondContact O-N 2.85Å; L211-A214 PolarHBondContact O-N 3.46Å; L211-H215 PolarHBondContact O-CD2 2.93Å; L211-H215 VanDerWaalsContact O-CD2 3.3Å; L211-H215 PolarHBondContact O-N 2.99Å; L211-H215 VanDerWaalsContact O-N 3.07Å
212	L	97.2	Very high	95.6	Very high	46 Å²	46	34 Å²	34	24%	0.241	19%	0.186	C	C	.	.	H	α-helix	trans	-57.1	-43.5	174.4	-71.7	-178	0	0	0	111.5	L117 F208 N209 H215	L117-L212 HydrophobicContact CD1-CD2 3.5Å; L117-L212 VanDerWaalsContact CD1-CD2 3.5Å; L117-L212 HydrophobicContact CD2-CD2 3.96Å; L117-L212 HydrophobicContact CG-CD2 3.55Å; F208-L212 HydrophobicContact CD1-CD1 4.05Å; F208-L212 HydrophobicContact CD1-CG 4.38Å; F208-L212 HydrophobicContact CE1-CD1 3.79Å; F208-L212 HydrophobicContact CE1-CD2 4.39Å; F208-L212 HydrophobicContact CE1-CG 4.15Å; F208-L212 HydrophobicContact CZ-CD1 4.36Å; F208-L212 HydrophobicContact CZ-CD2 4.13Å; F208-L212 HydrophobicContact CZ-CG 4.28Å; F208-L212 WeakPolarHBondContact O-CG 3.47Å; F208-L212 PolarHBondContact O-N 3.5Å; N209-L212 WeakPolarHBondContact O-CB 3.46Å; N209-L212 PolarHBondContact O-N 2.93Å; L212-H215 VanDerWaalsContact CA-CD2 3.47Å; L212-H215 WeakPolarHBondContact CA-CD2 3.33Å; L212-H215 PolarHBondContact O-CD2 2.81Å; L212-H215 PolarHBondContact O-NE2 3.11Å; L212-H215 VanDerWaalsContact O-NE2 3.1Å
213	K	97.4	Very high	95.2	Very high	62 Å²	62	33.4 Å²	33.4	27%	0.27	18%	0.178	S	C	.	.	H	α-helix	trans	-70.3	-48.1	176.5	-173.7	62.3	172.6	178.9	0	111.9	D147 Y150 L151 N209 L210 L211 H215 T216	D147-K213 WeakPolarHBondContact OD1-CE 3.46Å; D147-K213 IonicContact OD1-NZ 2.8Å; D147-K213 PolarHBondContact OD1-NZ 3.29Å; Y150-K213 HydrophobicContact CD1-CB 4.06Å; Y150-K213 HydrophobicContact CD1-CD 4.4Å; Y150-K213 HydrophobicContact CD1-CG 3.9Å; Y150-K213 HydrophobicContact CE1-CB 3.96Å; Y150-K213 HydrophobicContact CE1-CG 4.28Å; L151-K213 HydrophobicContact CD2-CB 3.93Å; L151-K213 HydrophobicContact CD2-CG 3.91Å; L151-K213 HydrophobicContact CG-CG 4.26Å; N209-K213 PolarHBondContact O-N 2.98Å; L210-K213 PolarHBondContact O-N 2.92Å; L211-K213 VanDerWaalsContact C-N 3.3Å; L211-K213 PolarHBondContact O-N 2.85Å; K213-H215 VanDerWaalsContact C-N 3.33Å; K213-H215 PolarHBondContact O-N 3.1Å; K213-T216 PolarHBondContact O-N 2.89Å; K213-T216 VanDerWaalsContact O-N 3.13Å; K213-T216 PolarHBondContact O-OG1 2.83Å
214	A	96.8	Very high	94.9	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-60.4	-39.7	-173.4	0	0	0	0	0	112.5	I132 L141 L151 L210 L211 T216 L217 Y220	I132-A214 HydrophobicContact CG2-CB 3.75Å; L141-A214 HydrophobicContact CD2-CB 4.07Å; L151-A214 HydrophobicContact CD2-CB 4.49Å; L210-A214 VanDerWaalsContact O-CB 3.24Å; L210-A214 WeakPolarHBondContact O-CB 3.25Å; L210-A214 PolarHBondContact O-N 3.49Å; L211-A214 PolarHBondContact O-N 3.46Å; A214-T216 PolarHBondContact O-N 3.02Å; A214-T216 VanDerWaalsContact O-N 3.1Å; A214-L217 WeakPolarHBondContact O-CB 3.37Å; A214-L217 PolarHBondContact O-N 2.89Å; A214-L217 VanDerWaalsContact O-N 3.08Å; A214-Y220 HydrophobicContact CB-CD2 4.29Å; A214-Y220 WeakPolarHBondContact O-CB 3.32Å
215	H	95.7	Very high	94.7	Very high	56 Å²	56	33.5 Å²	33.5	26%	0.259	17%	0.174	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.1	-12.1	-178.8	83.2	75.4	0	0	0	114.5	P116 L211 L212 K213 Y220	P116-H215 HydrophobicContact CG-CB 4.01Å; L211-H215 PolarHBondContact O-CD2 2.93Å; L211-H215 VanDerWaalsContact O-CD2 3.3Å; L211-H215 PolarHBondContact O-N 2.99Å; L211-H215 VanDerWaalsContact O-N 3.07Å; L212-H215 VanDerWaalsContact CA-CD2 3.47Å; L212-H215 WeakPolarHBondContact CA-CD2 3.33Å; L212-H215 PolarHBondContact O-CD2 2.81Å; L212-H215 PolarHBondContact O-NE2 3.11Å; L212-H215 VanDerWaalsContact O-NE2 3.1Å; K213-H215 VanDerWaalsContact C-N 3.33Å; K213-H215 PolarHBondContact O-N 3.1Å; H215-Y220 HydrophobicContact CB-CD1 4.2Å; H215-Y220 HydrophobicContact CB-CD2 4.35Å; H215-Y220 HydrophobicContact CB-CE1 3.98Å; H215-Y220 HydrophobicContact CB-CE2 4.14Å; H215-Y220 HydrophobicContact CB-CG 4.37Å
216	T	95.1	Very high	94.4	Very high	88 Å²	88	33.7 Å²	33.7	54%	0.54	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.3	-15.3	176	70.1	0	0	0	0	112.9	K213 A214	K213-T216 PolarHBondContact O-N 2.89Å; K213-T216 VanDerWaalsContact O-N 3.13Å; K213-T216 PolarHBondContact O-OG1 2.83Å; A214-T216 PolarHBondContact O-N 3.02Å; A214-T216 VanDerWaalsContact O-N 3.1Å
217	L	93.3	Very high	94.2	Very high	21 Å²	21	34.1 Å²	34.1	11%	0.11	18%	0.184	C	C	.	.	S	Bend	trans	-81.4	147.5	-175.7	-60.3	177.4	0	0	0	112.1	L141 C143 D147 L151 A214 T219 Y220	L141-L217 HydrophobicContact CD1-CB 4.17Å; L141-L217 HydrophobicContact CD1-CD1 4.09Å; L141-L217 HydrophobicContact CD2-CD1 3.68Å; L141-L217 HydrophobicContact CG-CD1 3.69Å; C143-L217 HydrophobicContact CB-CD1 3.89Å; C143-L217 HydrophobicContact CB-CD2 4.45Å; D147-L217 HydrophobicContact CB-CD2 4.42Å; L151-L217 HydrophobicContact CD1-CD1 4.01Å; A214-L217 WeakPolarHBondContact O-CB 3.37Å; A214-L217 PolarHBondContact O-N 2.89Å; A214-L217 VanDerWaalsContact O-N 3.08Å; L217-T219 VanDerWaalsContact C-N 3.31Å; L217-T219 PolarHBondContact O-N 3.45Å; L217-Y220 VanDerWaalsContact O-CB 3.3Å; L217-Y220 WeakPolarHBondContact O-CB 3.49Å; L217-Y220 PolarHBondContact O-N 3.06Å
218	E	90.4	Very high	94	Very high	95 Å²	95	38.3 Å²	38.3	44%	0.444	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.6	-29.5	-171.8	-61.1	-160.3	142.3	0	0	114.4	R252	E218-R252 IonicContact OE1-CZ 3.99Å; E218-R252 VanDerWaalsContact OE1-CZ 3.3Å; E218-R252 IonicContact OE1-NE 3.86Å; E218-R252 PolarHBondContact OE1-NE 3.3Å; E218-R252 IonicContact OE1-NH2 3.82Å; E218-R252 PolarHBondContact OE1-NH2 2.98Å; E218-R252 IonicContact OE2-NE 2.68Å
219	T	93.3	Very high	93.8	Very high	11 Å²	11	36.8 Å²	36.8	7%	0.067	20%	0.196	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.3	11.3	179.5	69.9	0	0	0	0	113.6	R140 L141 L142 L217 G221 V222 F247	R140-T219 WeakPolarHBondContact O-CB 3.5Å; R140-T219 PolarHBondContact O-OG1 3.46Å; L141-T219 WeakPolarHBondContact CA-OG1 3.41Å; L142-T219 HydrophobicContact CB-CG2 3.98Å; L142-T219 HydrophobicContact CD1-CG2 3.69Å; L142-T219 HydrophobicContact CG-CG2 3.75Å; L142-T219 PolarHBondContact N-OG1 2.75Å; L217-T219 VanDerWaalsContact C-N 3.31Å; L217-T219 PolarHBondContact O-N 3.45Å; T219-G221 PolarHBondContact O-N 2.9Å; T219-V222 WeakPolarHBondContact O-CB 3.11Å; T219-V222 PolarHBondContact O-N 3.05Å; T219-F247 HydrophobicContact CG2-CE1 3.71Å; T219-F247 HydrophobicContact CG2-CE2 4.48Å; T219-F247 HydrophobicContact CG2-CZ 3.7Å
220	Y	95.1	Very high	93.4	Very high	18 Å²	18	39.9 Å²	39.9	7%	0.071	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.7	121.6	173.7	173.7	-103.6	0	0	0	111.5	Y112 P113 I132 A214 H215 L217 V222	Y112-Y220 HydrophobicContact CD1-CD2 4.48Å; Y112-Y220 AromaticContact CD1-CE2 3.92Å; Y112-Y220 HydrophobicContact CD1-CE2 3.92Å; Y112-Y220 AromaticContact CD1-CZ 3.94Å; P113-Y220 WeakPolarHBondContact CD-OH 3.39Å; P113-Y220 WeakPolarHBondContact CG-OH 3.33Å; P113-Y220 WeakPolarHBondContact O-CE1 3.22Å; P113-Y220 PolarHBondContact O-OH 3.39Å; I132-Y220 HydrophobicContact CD1-CD2 3.78Å; I132-Y220 HydrophobicContact CD1-CE2 3.65Å; I132-Y220 HydrophobicContact CG1-CE2 4.44Å; A214-Y220 HydrophobicContact CB-CD2 4.29Å; A214-Y220 WeakPolarHBondContact O-CB 3.32Å; H215-Y220 HydrophobicContact CB-CD1 4.2Å; H215-Y220 HydrophobicContact CB-CD2 4.35Å; H215-Y220 HydrophobicContact CB-CE1 3.98Å; H215-Y220 HydrophobicContact CB-CE2 4.14Å; H215-Y220 HydrophobicContact CB-CG 4.37Å; L217-Y220 VanDerWaalsContact O-CB 3.3Å; L217-Y220 WeakPolarHBondContact O-CB 3.49Å; L217-Y220 PolarHBondContact O-N 3.06Å; Y220-V222 PolarHBondContact O-N 3.14Å
221	G	93.2	Very high	93	Very high	8 Å²	8	49.8 Å²	49.8	8%	0.082	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	68.4	15	-179.1	0	0	0	0	0	115.2	Y112 T219 D223	Y112-G221 VanDerWaalsContact CG-CA 3.41Å; T219-G221 PolarHBondContact O-N 2.9Å; G221-D223 PolarHBondContact O-N 3.07Å
222	V	91.8	Very high	92.6	Very high	12 Å²	12	51.8 Å²	51.8	7%	0.073	28%	0.278	C	S	.	.			trans	-78.3	118.1	175	175.6	0	0	0	0	109.8	R140 T219 Y220 P224 T240 V245 F247	R140-V222 PolarHBondContact NH2-O 2.89Å; T219-V222 WeakPolarHBondContact O-CB 3.11Å; T219-V222 PolarHBondContact O-N 3.05Å; Y220-V222 PolarHBondContact O-N 3.14Å; V222-P224 HydrophobicContact CG1-CB 4.44Å; V222-T240 HydrophobicContact CB-CG2 4.48Å; V222-T240 HydrophobicContact CG2-CG2 3.48Å; V222-T240 VanDerWaalsContact CG2-CG2 3.48Å; V222-V245 HydrophobicContact CG2-CG2 4.03Å; V222-F247 HydrophobicContact CG1-CE2 4.47Å; V222-F247 HydrophobicContact CG2-CE2 4.09Å
223	D	88.3	Confident	92.3	Very high	40 Å²	40	51.4 Å²	51.4	21%	0.214	28%	0.282	C	S	.	.			trans	-102	102.8	160	-161.2	24.9	0	0	0	109.4	R84 R140 G221 H225	R84-D223 IonicContact NH1-OD1 3.51Å; R140-D223 IonicContact CZ-OD1 3.58Å; R140-D223 IonicContact NH1-OD1 3.69Å; R140-D223 PolarHBondContact NH1-OD1 2.93Å; R140-D223 IonicContact NH2-OD1 2.75Å; R140-D223 PolarHBondContact NH2-OD1 3.43Å; G221-D223 PolarHBondContact O-N 3.07Å; D223-H225 PolarHBondContact O-CD2 3.39Å
224	P	89.3	Confident	92	Very high	50 Å²	50	51.6 Å²	51.6	33%	0.325	29%	0.289	S	S	.	.	P	Polyproline II helix	trans	-74.5	130.1	-168.6	28.5	-33.5	0	0	0	111.8	V222 F236 L237	V222-P224 HydrophobicContact CG1-CB 4.44Å; P224-F236 HydrophobicContact CB-CB 3.95Å; P224-F236 HydrophobicContact CB-CD1 4.08Å; P224-F236 HydrophobicContact CB-CG 4.32Å; P224-L237 CarbonylContact C-O 3.52Å; P224-L237 WeakPolarHBondContact CA-O 3.18Å
225	H	90.1	Very high	91.8	Very high	22 Å²	22	51.6 Å²	51.6	10%	0.102	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	116.7	169.4	-64.3	-88.4	0	0	0	109.8	D223 F236 L237 H296 L297	D223-H225 PolarHBondContact O-CD2 3.39Å; H225-F236 WeakPolarHBondContact O-CA 3.24Å; H225-L237 HydrophobicContact CB-CB 4.36Å; H225-L237 PolarHBondContact N-O 3.12Å; H225-L237 PolarHBondContact O-N 2.83Å; H225-H296 AromaticContact CE1-CD2 3.75Å; H225-H296 AromaticContact CE1-NE2 3.54Å; H225-L297 HydrophobicContact CB-CD1 3.67Å
226	P	89.9	Confident	91.7	Very high	87 Å²	87	50.7 Å²	50.7	57%	0.565	28%	0.284	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-69.9	135.5	179.2	28	-33.5	0	0	0	111.5	F236	P226-F236 HydrophobicContact CB-CD1 4.24Å; P226-F236 HydrophobicContact CB-CE1 4.02Å
227	C	93.2	Very high	91.7	Very high	9 Å²	9	46.5 Å²	46.5	6%	0.061	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.5	176.7	176.8	73	0	0	0	0	111.2	A235 L237 F286 H287	C227-A235 PolarHBondContact N-O 2.91Å; C227-A235 PolarHBondContact O-N 2.82Å; C227-A235 PolarHBondContact SG-O 2.9Å; C227-L237 HydrophobicContact CB-CD1 4.31Å; C227-L237 HydrophobicContact CB-CG 4.41Å; C227-L237 WeakPolarHBondContact SG-CG 3.41Å; C227-F286 HydrophobicContact CB-CB 4.29Å; C227-H287 CarbonylContact C-O 3.54Å; C227-H287 WeakPolarHBondContact CA-O 3.29Å; C227-H287 WeakPolarHBondContact CB-O 3.47Å
228	K	94	Very high	91.8	Very high	96 Å²	96	45.5 Å²	45.5	42%	0.417	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	140.3	166.7	-64	-175.7	177.4	-173.4	0	110.1	A233 F286 H287	K228-A233 CarbonylContact C-O 3.58Å; K228-A233 WeakPolarHBondContact CA-O 3.3Å; K228-F286 CarbonylContact O-C 3.58Å; K228-F286 WeakPolarHBondContact O-CA 3.45Å; K228-H287 HydrophobicContact CB-CB 4.45Å; K228-H287 PolarHBondContact N-O 3.21Å; K228-H287 PolarHBondContact O-N 2.91Å
229	D	92.5	Very high	92.1	Very high	17 Å²	17	41.6 Å²	41.6	9%	0.091	23%	0.234	C	C	.	.			trans	-73.2	-176.3	170.8	74.4	2.8	0	0	0	111.7	R231 G232 A233 Q248 F286	D229-R231 PolarHBondContact O-N 3.3Å; D229-R231 VanDerWaalsContact OD1-CA 3.29Å; D229-R231 WeakPolarHBondContact OD1-CA 3.34Å; D229-R231 WeakPolarHBondContact OD1-CB 3.47Å; D229-R231 PolarHBondContact OD1-N 2.8Å; D229-G232 PolarHBondContact O-N 3.47Å; D229-G232 VanDerWaalsContact O-N 3.16Å; D229-G232 PolarHBondContact OD1-N 3.36Å; D229-A233 PolarHBondContact N-O 2.68Å; D229-A233 PolarHBondContact OD1-N 3.36Å; D229-Q248 PolarHBondContact OD2-NE2 2.9Å; D229-F286 HydrophobicContact CB-CD1 4.38Å; D229-F286 HydrophobicContact CB-CE1 4.38Å
230	S	88.1	Confident	92.2	Very high	98 Å²	98	41.5 Å²	41.5	69%	0.685	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.2	-14.8	177.1	57.1	0	0	0	0	114.1
231	R	90.3	Very high	92.2	Very high	208 Å²	208	41.4 Å²	41.4	79%	0.785	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	-96.5	0.1	177.5	-59.4	166.4	59.8	-159.7	-1.3	112	D229 A233	D229-R231 PolarHBondContact O-N 3.3Å; D229-R231 VanDerWaalsContact OD1-CA 3.29Å; D229-R231 WeakPolarHBondContact OD1-CA 3.34Å; D229-R231 WeakPolarHBondContact OD1-CB 3.47Å; D229-R231 PolarHBondContact OD1-N 2.8Å; R231-A233 VanDerWaalsContact C-N 3.3Å
232	G	88.7	Confident	92.2	Very high	43 Å²	43	43 Å²	43	44%	0.443	25%	0.25	S	C	.	.	S	Bend	trans	82.5	1.6	-176.7	0	0	0	0	0	114.5	D229	D229-G232 PolarHBondContact O-N 3.47Å; D229-G232 VanDerWaalsContact O-N 3.16Å; D229-G232 PolarHBondContact OD1-N 3.36Å
233	A	91.6	Very high	92.4	Very high	38 Å²	38	42.5 Å²	42.5	31%	0.314	25%	0.246	S	C	.	.			trans	-75.7	138	-180	0	0	0	0	0	111	K228 D229 R231 A235	K228-A233 CarbonylContact C-O 3.58Å; K228-A233 WeakPolarHBondContact CA-O 3.3Å; D229-A233 PolarHBondContact N-O 2.68Å; D229-A233 PolarHBondContact OD1-N 3.36Å; R231-A233 VanDerWaalsContact C-N 3.3Å; A233-A235 PolarHBondContact O-N 2.84Å
234	T	92.1	Very high	92.8	Very high	67 Å²	67	40.6 Å²	40.6	41%	0.411	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.3	128.4	177.1	-57.2	0	0	0	0	110.6	F236	T234-F236 HydrophobicContact CG2-CE2 4.32Å; T234-F236 HydrophobicContact CG2-CZ 4.2Å
235	A	92.4	Very high	93.1	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	151.3	178	0	0	0	0	0	110.8	C227 A233 V246 F247 Q248	C227-A235 PolarHBondContact N-O 2.91Å; C227-A235 PolarHBondContact O-N 2.82Å; C227-A235 PolarHBondContact SG-O 2.9Å; A233-A235 PolarHBondContact O-N 2.84Å; A235-V246 HydrophobicContact CB-CG1 4.08Å; A235-F247 CarbonylContact C-O 3.51Å; A235-F247 VanDerWaalsContact CA-O 3.32Å; A235-F247 WeakPolarHBondContact CA-O 3.44Å; A235-Q248 HydrophobicContact CB-CG 4.1Å
236	F	93.6	Very high	93.3	Very high	37 Å²	37	37.2 Å²	37.2	16%	0.162	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	122.3	174.5	-59.8	-81.3	0	0	0	109.8	P224 H225 P226 T234 V246 F247 M377	P224-F236 HydrophobicContact CB-CB 3.95Å; P224-F236 HydrophobicContact CB-CD1 4.08Å; P224-F236 HydrophobicContact CB-CG 4.32Å; H225-F236 WeakPolarHBondContact O-CA 3.24Å; P226-F236 HydrophobicContact CB-CD1 4.24Å; P226-F236 HydrophobicContact CB-CE1 4.02Å; T234-F236 HydrophobicContact CG2-CE2 4.32Å; T234-F236 HydrophobicContact CG2-CZ 4.2Å; F236-V246 WeakPolarHBondContact O-CA 3.42Å; F236-F247 HydrophobicContact CB-CB 4.36Å; F236-F247 PolarHBondContact N-O 3.48Å; F236-F247 PolarHBondContact O-N 2.89Å; F236-M377 HydrophobicContact CE1-CE 3.39Å; F236-M377 HydrophobicContact CE1-SD 3.92Å; F236-M377 HydrophobicContact CE2-SD 4.4Å; F236-M377 HydrophobicContact CZ-CE 3.35Å; F236-M377 HydrophobicContact CZ-SD 3.55Å; F236-M377 VanDerWaalsContact CZ-SD 3.55Å
237	L	95.1	Very high	93.4	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	141.3	178	-49	-175.9	0	0	0	109.7	P224 H225 C227 F244 V245 V246 F271 F286 L297	P224-L237 CarbonylContact C-O 3.52Å; P224-L237 WeakPolarHBondContact CA-O 3.18Å; H225-L237 HydrophobicContact CB-CB 4.36Å; H225-L237 PolarHBondContact N-O 3.12Å; H225-L237 PolarHBondContact O-N 2.83Å; C227-L237 HydrophobicContact CB-CD1 4.31Å; C227-L237 HydrophobicContact CB-CG 4.41Å; C227-L237 WeakPolarHBondContact SG-CG 3.41Å; L237-F244 HydrophobicContact CB-CE2 4.04Å; L237-F244 HydrophobicContact CD1-CE2 4.31Å; L237-F244 HydrophobicContact CD1-CZ 4.4Å; L237-F244 HydrophobicContact CD2-CE2 4.24Å; L237-F244 HydrophobicContact CD2-CZ 3.89Å; L237-F244 HydrophobicContact CG-CE2 4.42Å; L237-V245 WeakPolarHBondContact CA-O 3.34Å; L237-V246 HydrophobicContact CD2-CB 4.31Å; L237-V246 HydrophobicContact CD2-CG1 3.87Å; L237-V246 HydrophobicContact CD2-CG2 3.83Å; L237-F271 HydrophobicContact CD1-CD1 4.09Å; L237-F286 HydrophobicContact CD1-CB 3.93Å; L237-F286 HydrophobicContact CD1-CD2 4.02Å; L237-F286 HydrophobicContact CD1-CG 3.89Å; L237-F286 HydrophobicContact CD2-CD1 3.79Å; L237-F286 HydrophobicContact CD2-CD2 4.11Å; L237-F286 HydrophobicContact CD2-CE1 3.85Å; L237-F286 HydrophobicContact CD2-CE2 4.16Å; L237-F286 HydrophobicContact CD2-CG 3.93Å; L237-F286 HydrophobicContact CD2-CZ 4.05Å; L237-L297 HydrophobicContact CB-CD1 4.3Å; L237-L297 HydrophobicContact CD1-CD1 4.16Å; L237-L297 HydrophobicContact CD1-CD2 3.63Å; L237-L297 HydrophobicContact CD1-CG 4.5Å
238	G	94.9	Very high	93.3	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	156.1	174.3	0	0	0	0	0	111.8	V245	G238-V245 PolarHBondContact N-O 2.92Å; G238-V245 WeakPolarHBondContact O-CG2 3.38Å; G238-V245 PolarHBondContact O-N 2.81Å
239	F	96	Very high	92.8	Very high	12 Å²	12	33.5 Å²	33.5	5%	0.053	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	117.8	172.2	-50.7	-75.7	0	0	0	108	F244 W258 F271 L297 C300 N304	F239-F244 HydrophobicContact CD1-CB 4.49Å; F239-F244 AromaticContact CD1-CD2 3.83Å; F239-F244 HydrophobicContact CD1-CD2 3.83Å; F239-F244 AromaticContact CE1-CD2 3.53Å; F239-F244 HydrophobicContact CE1-CD2 3.53Å; F239-F244 HydrophobicContact CE1-CE2 4.07Å; F239-F244 HydrophobicContact CZ-CD2 4.41Å; F239-W258 HydrophobicContact CB-CH2 4.14Å; F239-W258 HydrophobicContact CB-CZ2 4.21Å; F239-W258 AromaticContact CD1-CH2 3.87Å; F239-W258 HydrophobicContact CD1-CH2 3.87Å; F239-W258 HydrophobicContact CG-CH2 4.43Å; F239-F271 HydrophobicContact CE1-CZ 4.33Å; F239-F271 HydrophobicContact CZ-CE1 4.39Å; F239-F271 HydrophobicContact CZ-CZ 4.14Å; F239-L297 HydrophobicContact CE2-CD1 3.62Å; F239-L297 HydrophobicContact CZ-CD1 3.66Å; F239-L297 HydrophobicContact CZ-CG 4.35Å; F239-C300 HydrophobicContact CD2-CB 4.13Å; F239-C300 HydrophobicContact CE2-CB 3.91Å; F239-N304 HydrophobicContact CB-CB 3.68Å; F239-N304 HydrophobicContact CG-CB 4.33Å
240	T	95.8	Very high	92.3	Very high	10 Å²	10	36.2 Å²	36.2	6%	0.061	22%	0.22	C	C	.	.			trans	-125	174.2	-176.8	71.5	0	0	0	0	110.6	V222 A242 G243 V245 W258	V222-T240 HydrophobicContact CB-CG2 4.48Å; V222-T240 HydrophobicContact CG2-CG2 3.48Å; V222-T240 VanDerWaalsContact CG2-CG2 3.48Å; T240-A242 PolarHBondContact O-N 3.4Å; T240-A242 PolarHBondContact OG1-N 3.2Å; T240-G243 PolarHBondContact N-O 2.97Å; T240-G243 PolarHBondContact O-N 2.83Å; T240-G243 VanDerWaalsContact O-N 3.16Å; T240-G243 PolarHBondContact OG1-N 3.41Å; T240-G243 PolarHBondContact OG1-O 3.48Å; T240-V245 HydrophobicContact CG2-CG2 4.05Å; T240-W258 WeakPolarHBondContact O-CZ2 3.23Å; T240-W258 PolarHBondContact O-NE1 2.95Å
241	A	95	Very high	92.2	Very high	16 Å²	16	39.5 Å²	39.5	13%	0.132	22%	0.222	C	C	.	.	S	Bend	trans	-56.8	-30.2	172.4	0	0	0	0	0	113.1	H114 Y308	H114-A241 HydrophobicContact CB-CB 3.95Å; A241-Y308 HydrophobicContact CB-CD1 3.97Å; A241-Y308 HydrophobicContact CB-CE1 3.5Å
242	A	93.7	Very high	92.3	Very high	42 Å²	42	33.5 Å²	33.5	35%	0.347	20%	0.199	S	C	.	.	S	Bend	trans	-76.9	-33	178.8	0	0	0	0	0	113	T240 L255 K257	T240-A242 PolarHBondContact O-N 3.4Å; T240-A242 PolarHBondContact OG1-N 3.2Å; A242-L255 HydrophobicContact CB-CD1 4.25Å; A242-K257 WeakPolarHBondContact O-CA 3.46Å
243	G	95.5	Very high	92.5	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	157.4	-166.4	-175.8	0	0	0	0	0	114.5	T240 R256	T240-G243 PolarHBondContact N-O 2.97Å; T240-G243 PolarHBondContact O-N 2.83Å; T240-G243 VanDerWaalsContact O-N 3.16Å; T240-G243 PolarHBondContact OG1-N 3.41Å; T240-G243 PolarHBondContact OG1-O 3.48Å; G243-R256 CarbonylContact C-O 3.59Å; G243-R256 VanDerWaalsContact CA-O 3.22Å; G243-R256 WeakPolarHBondContact CA-O 3.39Å
244	F	96.9	Very high	92.6	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	128.7	167.4	168	-102.8	0	0	0	109.8	L237 F239 V246 L255 R256 V261 F271 V273 L284 F286	L237-F244 HydrophobicContact CB-CE2 4.04Å; L237-F244 HydrophobicContact CD1-CE2 4.31Å; L237-F244 HydrophobicContact CD1-CZ 4.4Å; L237-F244 HydrophobicContact CD2-CE2 4.24Å; L237-F244 HydrophobicContact CD2-CZ 3.89Å; L237-F244 HydrophobicContact CG-CE2 4.42Å; F239-F244 HydrophobicContact CD1-CB 4.49Å; F239-F244 AromaticContact CD1-CD2 3.83Å; F239-F244 HydrophobicContact CD1-CD2 3.83Å; F239-F244 AromaticContact CE1-CD2 3.53Å; F239-F244 HydrophobicContact CE1-CD2 3.53Å; F239-F244 HydrophobicContact CE1-CE2 4.07Å; F239-F244 HydrophobicContact CZ-CD2 4.41Å; F244-V246 HydrophobicContact CD1-CG2 4.24Å; F244-V246 HydrophobicContact CE1-CG2 3.37Å; F244-V246 HydrophobicContact CE2-CG2 4.48Å; F244-V246 HydrophobicContact CZ-CG2 3.54Å; F244-L255 WeakPolarHBondContact O-CA 3.35Å; F244-R256 HydrophobicContact CB-CB 4.23Å; F244-R256 HydrophobicContact CD1-CB 4.18Å; F244-R256 HydrophobicContact CD1-CG 4.1Å; F244-R256 PolarHBondContact N-O 2.85Å; F244-R256 PolarHBondContact O-N 2.99Å; F244-V261 HydrophobicContact CB-CG2 4.44Å; F244-F271 HydrophobicContact CE2-CE1 4.12Å; F244-V273 HydrophobicContact CD1-CG1 4.07Å; F244-V273 HydrophobicContact CD1-CG2 4.14Å; F244-V273 HydrophobicContact CD2-CG2 4.39Å; F244-V273 HydrophobicContact CE1-CB 4.3Å; F244-V273 HydrophobicContact CE1-CG1 4.32Å; F244-V273 HydrophobicContact CE1-CG2 3.74Å; F244-V273 HydrophobicContact CE2-CG2 4Å; F244-V273 HydrophobicContact CG-CG2 4.43Å; F244-V273 HydrophobicContact CZ-CG2 3.65Å; F244-L284 HydrophobicContact CE1-CD1 4.18Å; F244-F286 AromaticContact CE1-CE2 3.97Å; F244-F286 HydrophobicContact CE1-CE2 3.97Å; F244-F286 HydrophobicContact CE1-CZ 4.42Å; F244-F286 HydrophobicContact CZ-CD2 4.22Å; F244-F286 AromaticContact CZ-CE2 3.63Å; F244-F286 HydrophobicContact CZ-CE2 3.63Å; F244-F286 HydrophobicContact CZ-CZ 4.25Å
245	V	95.8	Very high	92.7	Very high	1 Å²	1	35.5 Å²	35.5	1%	0.006	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	148	-177.6	-67.8	0	0	0	0	111.2	V222 L237 G238 T240 F247 H254 L255	V222-V245 HydrophobicContact CG2-CG2 4.03Å; L237-V245 WeakPolarHBondContact CA-O 3.34Å; G238-V245 PolarHBondContact N-O 2.92Å; G238-V245 WeakPolarHBondContact O-CG2 3.38Å; G238-V245 PolarHBondContact O-N 2.81Å; T240-V245 HydrophobicContact CG2-CG2 4.05Å; V245-F247 HydrophobicContact CB-CD2 4.47Å; V245-F247 HydrophobicContact CB-CE2 3.89Å; V245-F247 HydrophobicContact CG2-CD2 4.32Å; V245-F247 HydrophobicContact CG2-CE2 3.72Å; V245-H254 WeakPolarHBondContact CA-O 3.46Å; V245-L255 HydrophobicContact CG1-CD1 3.55Å
246	V	94.8	Very high	92.8	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	127.6	176.4	-172.7	0	0	0	0	108.6	A235 F236 L237 F244 R252 I253 H254 F286	A235-V246 HydrophobicContact CB-CG1 4.08Å; F236-V246 WeakPolarHBondContact O-CA 3.42Å; L237-V246 HydrophobicContact CD2-CB 4.31Å; L237-V246 HydrophobicContact CD2-CG1 3.87Å; L237-V246 HydrophobicContact CD2-CG2 3.83Å; F244-V246 HydrophobicContact CD1-CG2 4.24Å; F244-V246 HydrophobicContact CE1-CG2 3.37Å; F244-V246 HydrophobicContact CE2-CG2 4.48Å; F244-V246 HydrophobicContact CZ-CG2 3.54Å; V246-R252 CarbonylContact O-C 3.52Å; V246-R252 WeakPolarHBondContact O-CA 3.34Å; V246-I253 HydrophobicContact CB-CD1 4.24Å; V246-I253 HydrophobicContact CB-CG1 3.88Å; V246-I253 HydrophobicContact CG1-CD1 3.59Å; V246-I253 HydrophobicContact CG1-CG1 3.69Å; V246-I253 VanDerWaalsContact O-CG1 3.28Å; V246-I253 WeakPolarHBondContact O-CG1 3.42Å; V246-I253 PolarHBondContact O-N 3.46Å; V246-H254 HydrophobicContact CB-CB 3.93Å; V246-H254 HydrophobicContact CG2-CB 3.88Å; V246-H254 PolarHBondContact N-O 2.86Å; V246-H254 PolarHBondContact O-N 3.43Å; V246-F286 HydrophobicContact CG1-CE1 3.98Å; V246-F286 HydrophobicContact CG1-CZ 4.2Å; V246-F286 HydrophobicContact CG2-CE1 4.33Å; V246-F286 HydrophobicContact CG2-CE2 4.36Å; V246-F286 HydrophobicContact CG2-CZ 3.73Å
247	F	92.1	Very high	92.9	Very high	9 Å²	9	40.4 Å²	40.4	4%	0.039	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	138.3	176	-69.4	-96.2	0	0	0	110.4	T219 V222 A235 F236 V245 K251 R252	T219-F247 HydrophobicContact CG2-CE1 3.71Å; T219-F247 HydrophobicContact CG2-CE2 4.48Å; T219-F247 HydrophobicContact CG2-CZ 3.7Å; V222-F247 HydrophobicContact CG1-CE2 4.47Å; V222-F247 HydrophobicContact CG2-CE2 4.09Å; A235-F247 CarbonylContact C-O 3.51Å; A235-F247 VanDerWaalsContact CA-O 3.32Å; A235-F247 WeakPolarHBondContact CA-O 3.44Å; F236-F247 HydrophobicContact CB-CB 4.36Å; F236-F247 PolarHBondContact N-O 3.48Å; F236-F247 PolarHBondContact O-N 2.89Å; V245-F247 HydrophobicContact CB-CD2 4.47Å; V245-F247 HydrophobicContact CB-CE2 3.89Å; V245-F247 HydrophobicContact CG2-CD2 4.32Å; V245-F247 HydrophobicContact CG2-CE2 3.72Å; F247-K251 WeakPolarHBondContact CA-O 3.15Å; F247-R252 HydrophobicContact CD1-CB 3.92Å; F247-R252 HydrophobicContact CE1-CB 3.53Å; F247-R252 HydrophobicContact CE1-CG 4.11Å; F247-R252 HydrophobicContact CE2-CG 4.37Å; F247-R252 HydrophobicContact CZ-CB 3.92Å; F247-R252 HydrophobicContact CZ-CG 3.99Å
248	Q	90	Very high	92.9	Very high	55 Å²	55	40.7 Å²	40.7	26%	0.257	21%	0.211	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	116.4	165.5	-76.5	-177.4	-14.7	0	0	107.3	D229 A235 N250 K251 I253	D229-Q248 PolarHBondContact OD2-NE2 2.9Å; A235-Q248 HydrophobicContact CB-CG 4.1Å; Q248-N250 PolarHBondContact O-N 3.05Å; Q248-K251 PolarHBondContact N-O 3.3Å; Q248-K251 PolarHBondContact O-N 2.8Å; Q248-K251 VanDerWaalsContact O-N 3.14Å; Q248-I253 HydrophobicContact CB-CD1 4.46Å; Q248-I253 HydrophobicContact CB-CG2 4.12Å; Q248-I253 VanDerWaalsContact CD-CD1 3.47Å; Q248-I253 HydrophobicContact CG-CD1 3.61Å; Q248-I253 HydrophobicContact CG-CG1 4.2Å; Q248-I253 HydrophobicContact CG-CG2 4.41Å
249	G	84.9	Confident	92.9	Very high	51 Å²	51	45.5 Å²	45.5	53%	0.526	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.9	-127.2	-162.1	0	0	0	0	0	110.5
250	N	81.1	Confident	92.8	Very high	74 Å²	74	47.9 Å²	47.9	40%	0.396	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.7	7.7	-179.6	-68.1	2.7	0	0	0	114	L142 Q248 N446	L142-N250 HydrophobicContact CD1-CB 4.09Å; Q248-N250 PolarHBondContact O-N 3.05Å; N250-N446 PolarHBondContact ND2-ND2 2.98Å; N250-N446 PolarHBondContact ND2-OD1 3.48Å
251	K	85.7	Confident	92.8	Very high	166 Å²	166	47.4 Å²	47.4	72%	0.722	25%	0.252	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-106.4	127.8	-177.4	-67	-176.6	-179.7	178.7	0	110.4	F247 Q248 I253	F247-K251 WeakPolarHBondContact CA-O 3.15Å; Q248-K251 PolarHBondContact N-O 3.3Å; Q248-K251 PolarHBondContact O-N 2.8Å; Q248-K251 VanDerWaalsContact O-N 3.14Å; K251-I253 PolarHBondContact O-N 3.44Å
252	R	91.8	Very high	92.7	Very high	82 Å²	82	49.9 Å²	49.9	31%	0.309	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	109.1	170.2	-171.5	171.7	57.7	176	-0.8	109.5	E218 V246 F247	E218-R252 IonicContact OE1-CZ 3.99Å; E218-R252 VanDerWaalsContact OE1-CZ 3.3Å; E218-R252 IonicContact OE1-NE 3.86Å; E218-R252 PolarHBondContact OE1-NE 3.3Å; E218-R252 IonicContact OE1-NH2 3.82Å; E218-R252 PolarHBondContact OE1-NH2 2.98Å; E218-R252 IonicContact OE2-NE 2.68Å; V246-R252 CarbonylContact O-C 3.52Å; V246-R252 WeakPolarHBondContact O-CA 3.34Å; F247-R252 HydrophobicContact CD1-CB 3.92Å; F247-R252 HydrophobicContact CE1-CB 3.53Å; F247-R252 HydrophobicContact CE1-CG 4.11Å; F247-R252 HydrophobicContact CE2-CG 4.37Å; F247-R252 HydrophobicContact CZ-CB 3.92Å; F247-R252 HydrophobicContact CZ-CG 3.99Å
253	I	93.6	Very high	92.6	Very high	61 Å²	61	51.5 Å²	51.5	31%	0.313	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	-29.4	-179.9	54.6	157.2	0	0	0	112.6	V246 Q248 K251	V246-I253 HydrophobicContact CB-CD1 4.24Å; V246-I253 HydrophobicContact CB-CG1 3.88Å; V246-I253 HydrophobicContact CG1-CD1 3.59Å; V246-I253 HydrophobicContact CG1-CG1 3.69Å; V246-I253 VanDerWaalsContact O-CG1 3.28Å; V246-I253 WeakPolarHBondContact O-CG1 3.42Å; V246-I253 PolarHBondContact O-N 3.46Å; Q248-I253 HydrophobicContact CB-CD1 4.46Å; Q248-I253 HydrophobicContact CB-CG2 4.12Å; Q248-I253 VanDerWaalsContact CD-CD1 3.47Å; Q248-I253 HydrophobicContact CG-CD1 3.61Å; Q248-I253 HydrophobicContact CG-CG1 4.2Å; Q248-I253 HydrophobicContact CG-CG2 4.41Å; K251-I253 PolarHBondContact O-N 3.44Å
254	H	93.1	Very high	92.5	Very high	66 Å²	66	51.6 Å²	51.6	31%	0.306	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	141.2	177.5	-60.7	-51.4	0	0	0	112.1	V245 V246	V245-H254 WeakPolarHBondContact CA-O 3.46Å; V246-H254 HydrophobicContact CB-CB 3.93Å; V246-H254 HydrophobicContact CG2-CB 3.88Å; V246-H254 PolarHBondContact N-O 2.86Å; V246-H254 PolarHBondContact O-N 3.43Å
255	L	94.8	Very high	92.3	Very high	64 Å²	64	54.2 Å²	54.2	34%	0.335	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	114.5	163.7	170.4	62.8	0	0	0	107.9	A242 F244 V245	A242-L255 HydrophobicContact CB-CD1 4.25Å; F244-L255 WeakPolarHBondContact O-CA 3.35Å; V245-L255 HydrophobicContact CG1-CD1 3.55Å
256	R	94.8	Very high	92.2	Very high	15 Å²	15	55.5 Å²	55.5	6%	0.057	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	105.6	173.8	-65.2	-65.4	-172.8	-177.6	-3.4	108.6	G243 F244 V261 T276 Q277 S282 L284	G243-R256 CarbonylContact C-O 3.59Å; G243-R256 VanDerWaalsContact CA-O 3.22Å; G243-R256 WeakPolarHBondContact CA-O 3.39Å; F244-R256 HydrophobicContact CB-CB 4.23Å; F244-R256 HydrophobicContact CD1-CB 4.18Å; F244-R256 HydrophobicContact CD1-CG 4.1Å; F244-R256 PolarHBondContact N-O 2.85Å; F244-R256 PolarHBondContact O-N 2.99Å; R256-V261 HydrophobicContact CB-CG2 3.81Å; R256-T276 PolarHBondContact NH1-O 3.31Å; R256-Q277 VanDerWaalsContact NH1-CD 3.3Å; R256-S282 PolarHBondContact NH2-OG 2.88Å; R256-L284 HydrophobicContact CG-CD1 4.33Å
257	K	95.4	Very high	92	Very high	124 Å²	124	62.3 Å²	62.3	54%	0.539	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.1	147.9	178.5	-63.1	-175.7	178.4	-179.4	0	110	A242 P259 D260 V261	A242-K257 WeakPolarHBondContact O-CA 3.46Å; K257-P259 VanDerWaalsContact C-CD 3.41Å; K257-P259 VanDerWaalsContact C-N 3.33Å; K257-D260 WeakPolarHBondContact O-CA 3.42Å; K257-D260 WeakPolarHBondContact O-CB 3.42Å; K257-D260 PolarHBondContact O-N 2.9Å; K257-V261 PolarHBondContact O-N 3.06Å
258	W	95.5	Very high	91.9	Very high	7 Å²	7	64 Å²	64	3%	0.027	34%	0.336	C	S	.	.	G	3₁₀ helix	trans	-54.5	-36.7	-176.9	-67	120.6	0	0	0	115.9	F239 T240 D260 V261 N304 Q305 Y308 K309	F239-W258 HydrophobicContact CB-CH2 4.14Å; F239-W258 HydrophobicContact CB-CZ2 4.21Å; F239-W258 AromaticContact CD1-CH2 3.87Å; F239-W258 HydrophobicContact CD1-CH2 3.87Å; F239-W258 HydrophobicContact CG-CH2 4.43Å; T240-W258 WeakPolarHBondContact O-CZ2 3.23Å; T240-W258 PolarHBondContact O-NE1 2.95Å; W258-D260 PolarHBondContact O-N 2.98Å; W258-V261 HydrophobicContact CE3-CB 4.33Å; W258-V261 HydrophobicContact CE3-CG2 4.27Å; W258-V261 PolarHBondContact O-N 3.42Å; W258-N304 HydrophobicContact CH2-CB 3.9Å; W258-N304 HydrophobicContact CZ2-CB 3.89Å; W258-Q305 HydrophobicContact CE3-CB 3.93Å; W258-Q305 HydrophobicContact CE3-CG 3.93Å; W258-Q305 HydrophobicContact CH2-CB 4.35Å; W258-Q305 HydrophobicContact CZ3-CB 3.66Å; W258-Q305 HydrophobicContact CZ3-CG 4.11Å; W258-Y308 VanDerWaalsContact CD1-CB 3.42Å; W258-Y308 HydrophobicContact CZ2-CD2 4.21Å; W258-Y308 AromaticContact NE1-CD2 3.66Å; W258-Y308 AromaticContact NE1-CG 3.76Å; W258-K309 HydrophobicContact CB-CB 4.03Å; W258-K309 HydrophobicContact CB-CG 4.24Å; W258-K309 WeakPolarHBondContact O-CD 3.27Å; W258-K309 WeakPolarHBondContact O-CE 3.3Å
259	P	93.8	Very high	92.1	Very high	100 Å²	100	66.4 Å²	66.4	65%	0.649	35%	0.346	S	S	*	.	G	3₁₀ helix	trans	-58.8	-34.9	172.3	-26.6	37.2	0	0	0	113.4	K257	K257-P259 VanDerWaalsContact C-CD 3.41Å; K257-P259 VanDerWaalsContact C-N 3.33Å
260	D	94.5	Very high	92.6	Very high	62 Å²	62	65 Å²	65	33%	0.332	33%	0.326	S	S	.	.	G	3₁₀ helix	trans	-83.9	-13.5	-178.2	-54.3	-32.8	0	0	0	112.6	K257 W258 C262 G275 T276	K257-D260 WeakPolarHBondContact O-CA 3.42Å; K257-D260 WeakPolarHBondContact O-CB 3.42Å; K257-D260 PolarHBondContact O-N 2.9Å; W258-D260 PolarHBondContact O-N 2.98Å; D260-C262 PolarHBondContact O-N 2.72Å; D260-G275 CarbonylContact O-C 3.57Å; D260-G275 WeakPolarHBondContact O-CA 3.34Å; D260-T276 PolarHBondContact O-N 2.85Å
261	V	95.3	Very high	93.3	Very high	1 Å²	1	61.4 Å²	61.4	1%	0.006	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	104.8	174.9	-178.2	0	0	0	0	108.8	F244 R256 K257 W258 L264 V273 Q305 K309	F244-V261 HydrophobicContact CB-CG2 4.44Å; R256-V261 HydrophobicContact CB-CG2 3.81Å; K257-V261 PolarHBondContact O-N 3.06Å; W258-V261 HydrophobicContact CE3-CB 4.33Å; W258-V261 HydrophobicContact CE3-CG2 4.27Å; W258-V261 PolarHBondContact O-N 3.42Å; V261-L264 HydrophobicContact CG1-CD2 3.78Å; V261-L264 HydrophobicContact CG1-CG 4.16Å; V261-V273 HydrophobicContact CG1-CG1 4.26Å; V261-Q305 PolarHBondContact O-NE2 3.26Å; V261-K309 PolarHBondContact O-NZ 3.21Å
262	C	92.6	Very high	93.8	Very high	68 Å²	68	56.6 Å²	56.6	46%	0.459	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	-49.2	-179.1	-59.1	0	0	0	0	111.9	D260 I274	D260-C262 PolarHBondContact O-N 2.72Å; C262-I274 WeakPolarHBondContact CA-O 3.49Å; C262-I274 WeakPolarHBondContact CB-O 3.42Å; C262-I274 PolarHBondContact N-O 3.38Å
263	K	92.1	Very high	94	Very high	76 Å²	76	52.9 Å²	52.9	33%	0.33	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.4	139.6	-175.2	-172	165	-179.9	170.6	0	112.3	K265 I274	K263-K265 HydrophobicContact CD-CD 4.4Å; K263-K265 VanDerWaalsContact CD-CE 3.43Å; K263-K265 HydrophobicContact CD-CG 4.16Å; K263-K265 HydrophobicContact CG-CG 3.99Å; K263-I274 HydrophobicContact CB-CB 4.37Å; K263-I274 HydrophobicContact CB-CD1 4.5Å; K263-I274 PolarHBondContact N-O 2.81Å; K263-I274 WeakPolarHBondContact O-CB 3.5Å; K263-I274 PolarHBondContact O-N 3.36Å
264	L	94.7	Very high	94	Very high	1 Å²	1	52 Å²	52	1%	0.005	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	132.1	170.2	-58.2	177.8	0	0	0	109.3	V261 F271 V273 W298 G301 V302	V261-L264 HydrophobicContact CG1-CD2 3.78Å; V261-L264 HydrophobicContact CG1-CG 4.16Å; L264-F271 HydrophobicContact CB-CE2 4.27Å; L264-F271 HydrophobicContact CB-CZ 4.32Å; L264-F271 HydrophobicContact CD1-CZ 4.45Å; L264-F271 HydrophobicContact CD2-CZ 3.89Å; L264-F271 HydrophobicContact CG-CZ 4.45Å; L264-V273 HydrophobicContact CD2-CB 4.19Å; L264-V273 HydrophobicContact CD2-CG1 3.9Å; L264-V273 HydrophobicContact CD2-CG2 3.87Å; L264-W298 PolarHBondContact O-NE1 2.96Å; L264-W298 VanDerWaalsContact O-NE1 3.14Å; L264-G301 WeakPolarHBondContact CD1-O 3.35Å; L264-V302 HydrophobicContact CB-CG1 4.14Å; L264-V302 HydrophobicContact CD1-CG1 4.38Å
265	K	92.3	Very high	93.9	Very high	56 Å²	56	49 Å²	49	24%	0.243	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138	162.7	177.6	-59.8	-175.7	-172.8	167.6	0	110.4	K263 F271 Y272 I274	K263-K265 HydrophobicContact CD-CD 4.4Å; K263-K265 VanDerWaalsContact CD-CE 3.43Å; K263-K265 HydrophobicContact CD-CG 4.16Å; K263-K265 HydrophobicContact CG-CG 3.99Å; K265-F271 VanDerWaalsContact O-CD2 3.29Å; K265-F271 WeakPolarHBondContact O-CD2 3.44Å; K265-Y272 PolarHBondContact N-O 3.15Å; K265-Y272 PolarHBondContact O-N 3.49Å; K265-I274 HydrophobicContact CD-CD1 4.03Å; K265-I274 HydrophobicContact CG-CD1 4.42Å
266	F	92.8	Very high	93.6	Very high	28 Å²	28	48.2 Å²	48.2	12%	0.123	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	151.9	164.2	75.7	-81.2	0	0	0	110.3	T270 F271 C294 K295 W298	F266-T270 CarbonylContact C-O 3.56Å; F266-T270 WeakPolarHBondContact CA-O 3.39Å; F266-F271 HydrophobicContact CB-CD2 4.48Å; F266-C294 HydrophobicContact CD2-CB 4.46Å; F266-K295 HydrophobicContact CE1-CB 4.42Å; F266-K295 HydrophobicContact CE1-CG 4.34Å; F266-K295 HydrophobicContact CE2-CB 3.98Å; F266-K295 HydrophobicContact CE2-CG 4.45Å; F266-K295 HydrophobicContact CZ-CB 3.87Å; F266-K295 HydrophobicContact CZ-CD 4.48Å; F266-K295 HydrophobicContact CZ-CG 3.87Å; F266-W298 HydrophobicContact CB-CB 4.28Å; F266-W298 HydrophobicContact CD1-CB 3.57Å; F266-W298 AromaticContact CD1-CD1 3.95Å; F266-W298 AromaticContact CD1-CD2 3.65Å; F266-W298 HydrophobicContact CD1-CD2 3.65Å; F266-W298 HydrophobicContact CD1-CE3 4.04Å; F266-W298 AromaticContact CD1-CG 3.43Å; F266-W298 HydrophobicContact CD1-CG 3.43Å; F266-W298 VanDerWaalsContact CD1-CG 3.43Å; F266-W298 HydrophobicContact CE1-CB 4.27Å; F266-W298 AromaticContact CE1-CD2 3.72Å; F266-W298 HydrophobicContact CE1-CD2 3.72Å; F266-W298 AromaticContact CE1-CE3 3.65Å; F266-W298 HydrophobicContact CE1-CE3 3.65Å; F266-W298 HydrophobicContact CE1-CG 4.01Å; F266-W298 HydrophobicContact CE1-CZ3 4.23Å; F266-W298 HydrophobicContact CG-CB 4.2Å; F266-W298 HydrophobicContact CG-CG 4.42Å
267	E	90.9	Very high	92.9	Very high	142 Å²	142	52.1 Å²	52.1	66%	0.664	27%	0.271	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-142.1	117.6	173.8	-175.4	169.1	-167.4	0	0	108.3	K269 T270 Y272	E267-K269 PolarHBondContact O-N 2.94Å; E267-K269 VanDerWaalsContact O-N 3.12Å; E267-T270 PolarHBondContact N-O 2.9Å; E267-T270 PolarHBondContact O-N 3.14Å; E267-Y272 HydrophobicContact CB-CE2 4.1Å
268	G	90.1	Very high	92	Very high	44 Å²	44	55.6 Å²	55.6	45%	0.454	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	55.5	-117.8	-171.9	0	0	0	0	0	111.7	P291	G268-P291 WeakPolarHBondContact O-CA 3.39Å
269	K	93.6	Very high	91.1	Very high	107 Å²	107	64.7 Å²	64.7	47%	0.465	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92	-2.9	178.2	-60.3	-172.8	-178	-166.6	0	113.7	E267 T288 S289 P291 C294	E267-K269 PolarHBondContact O-N 2.94Å; E267-K269 VanDerWaalsContact O-N 3.12Å; K269-T288 PolarHBondContact O-N 2.76Å; K269-T288 PolarHBondContact O-OG1 2.77Å; K269-S289 WeakPolarHBondContact CD-O 3.33Å; K269-S289 WeakPolarHBondContact CE-O 3.48Å; K269-S289 PolarHBondContact NZ-O 3.49Å; K269-P291 HydrophobicContact CG-CG 3.92Å; K269-C294 VanDerWaalsContact C-SG 3.52Å; K269-C294 PolarHBondContact O-SG 2.79Å
270	T	95.5	Very high	90.5	Very high	20 Å²	20	67.6 Å²	67.6	12%	0.123	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	123.8	-171.2	-49.8	0	0	0	0	111.4	F266 E267 Y272 A285 F286 H287	F266-T270 CarbonylContact C-O 3.56Å; F266-T270 WeakPolarHBondContact CA-O 3.39Å; E267-T270 PolarHBondContact N-O 2.9Å; E267-T270 PolarHBondContact O-N 3.14Å; T270-Y272 HydrophobicContact CG2-CD2 4.34Å; T270-Y272 HydrophobicContact CG2-CE1 3.93Å; T270-Y272 HydrophobicContact CG2-CE2 3.67Å; T270-Y272 VanDerWaalsContact CG2-CZ 3.43Å; T270-Y272 WeakPolarHBondContact CG2-OH 3.11Å; T270-A285 HydrophobicContact CG2-CB 4.22Å; T270-F286 CarbonylContact C-O 3.54Å; T270-F286 WeakPolarHBondContact CA-O 3.47Å; T270-H287 PolarHBondContact OG1-CD2 2.83Å; T270-H287 PolarHBondContact OG1-NE2 2.8Å
271	F	96.6	Very high	90.1	Very high	0 Å²	0	71.6 Å²	71.6	0%	0	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	131.2	175.4	-179.9	-113	0	0	0	110.3	L237 F239 F244 L264 K265 F266 V273 A285 F286 C294 L297 W298	L237-F271 HydrophobicContact CD1-CD1 4.09Å; F239-F271 HydrophobicContact CE1-CZ 4.33Å; F239-F271 HydrophobicContact CZ-CE1 4.39Å; F239-F271 HydrophobicContact CZ-CZ 4.14Å; F244-F271 HydrophobicContact CE2-CE1 4.12Å; L264-F271 HydrophobicContact CB-CE2 4.27Å; L264-F271 HydrophobicContact CB-CZ 4.32Å; L264-F271 HydrophobicContact CD1-CZ 4.45Å; L264-F271 HydrophobicContact CD2-CZ 3.89Å; L264-F271 HydrophobicContact CG-CZ 4.45Å; K265-F271 VanDerWaalsContact O-CD2 3.29Å; K265-F271 WeakPolarHBondContact O-CD2 3.44Å; F266-F271 HydrophobicContact CB-CD2 4.48Å; F271-V273 HydrophobicContact CD1-CG2 3.98Å; F271-V273 HydrophobicContact CE1-CG2 3.36Å; F271-V273 HydrophobicContact CZ-CG2 4.03Å; F271-A285 CarbonylContact O-C 3.57Å; F271-A285 WeakPolarHBondContact O-CA 3.43Å; F271-F286 HydrophobicContact CD1-CD2 4.37Å; F271-F286 PolarHBondContact N-O 2.82Å; F271-F286 PolarHBondContact O-N 3.17Å; F271-C294 PolarHBondContact N-SG 2.92Å; F271-L297 HydrophobicContact CB-CD2 3.71Å; F271-L297 HydrophobicContact CD1-CD2 3.66Å; F271-L297 HydrophobicContact CD1-CG 4.21Å; F271-L297 HydrophobicContact CD2-CD2 4.13Å; F271-L297 HydrophobicContact CD2-CG 4.26Å; F271-L297 HydrophobicContact CE1-CD2 4.26Å; F271-L297 HydrophobicContact CE1-CG 4.35Å; F271-L297 HydrophobicContact CE2-CG 4.43Å; F271-L297 HydrophobicContact CG-CD2 3.56Å; F271-L297 HydrophobicContact CG-CG 4.14Å; F271-L297 HydrophobicContact CZ-CG 4.45Å; F271-W298 HydrophobicContact CD2-CB 4.19Å; F271-W298 HydrophobicContact CE2-CB 4.02Å
272	Y	95.3	Very high	89.9	Confident	65 Å²	65	72.6 Å²	72.6	26%	0.255	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	128.6	-178.5	-60.9	-87.8	0	0	0	111.3	K265 E267 T270 V283 L284 A285	K265-Y272 PolarHBondContact N-O 3.15Å; K265-Y272 PolarHBondContact O-N 3.49Å; E267-Y272 HydrophobicContact CB-CE2 4.1Å; T270-Y272 HydrophobicContact CG2-CD2 4.34Å; T270-Y272 HydrophobicContact CG2-CE1 3.93Å; T270-Y272 HydrophobicContact CG2-CE2 3.67Å; T270-Y272 VanDerWaalsContact CG2-CZ 3.43Å; T270-Y272 WeakPolarHBondContact CG2-OH 3.11Å; Y272-V283 HydrophobicContact CD1-CG1 4.1Å; Y272-L284 CarbonylContact C-O 3.56Å; Y272-L284 WeakPolarHBondContact CA-O 3.45Å; Y272-A285 HydrophobicContact CD1-CB 3.9Å; Y272-A285 HydrophobicContact CE1-CB 3.84Å
273	V	95.8	Very high	89.9	Confident	4 Å²	4	73.6 Å²	73.6	2%	0.024	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	108.1	169.8	-174.9	0	0	0	0	108.2	F244 V261 L264 F271 V283 L284	F244-V273 HydrophobicContact CD1-CG1 4.07Å; F244-V273 HydrophobicContact CD1-CG2 4.14Å; F244-V273 HydrophobicContact CD2-CG2 4.39Å; F244-V273 HydrophobicContact CE1-CB 4.3Å; F244-V273 HydrophobicContact CE1-CG1 4.32Å; F244-V273 HydrophobicContact CE1-CG2 3.74Å; F244-V273 HydrophobicContact CE2-CG2 4Å; F244-V273 HydrophobicContact CG-CG2 4.43Å; F244-V273 HydrophobicContact CZ-CG2 3.65Å; V261-V273 HydrophobicContact CG1-CG1 4.26Å; L264-V273 HydrophobicContact CD2-CB 4.19Å; L264-V273 HydrophobicContact CD2-CG1 3.9Å; L264-V273 HydrophobicContact CD2-CG2 3.87Å; F271-V273 HydrophobicContact CD1-CG2 3.98Å; F271-V273 HydrophobicContact CE1-CG2 3.36Å; F271-V273 HydrophobicContact CZ-CG2 4.03Å; V273-V283 WeakPolarHBondContact O-CA 3.28Å; V273-L284 HydrophobicContact CB-CB 4.3Å; V273-L284 PolarHBondContact N-O 3.46Å; V273-L284 PolarHBondContact O-N 3.24Å
274	I	94.2	Very high	90.1	Very high	42 Å²	42	71.2 Å²	71.2	22%	0.215	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	122.9	178.8	-55.3	166.9	0	0	0	107.3	C262 K263 K265 V283	C262-I274 WeakPolarHBondContact CA-O 3.49Å; C262-I274 WeakPolarHBondContact CB-O 3.42Å; C262-I274 PolarHBondContact N-O 3.38Å; K263-I274 HydrophobicContact CB-CB 4.37Å; K263-I274 HydrophobicContact CB-CD1 4.5Å; K263-I274 PolarHBondContact N-O 2.81Å; K263-I274 WeakPolarHBondContact O-CB 3.5Å; K263-I274 PolarHBondContact O-N 3.36Å; K265-I274 HydrophobicContact CD-CD1 4.03Å; K265-I274 HydrophobicContact CG-CD1 4.42Å; I274-V283 HydrophobicContact CG1-CG1 4.33Å; I274-V283 HydrophobicContact CG1-CG2 4.32Å; I274-V283 HydrophobicContact CG2-CG2 4.43Å
275	G	91.4	Very high	90.1	Very high	4 Å²	4	72.5 Å²	72.5	4%	0.041	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.5	-171.7	-178.7	0	0	0	0	0	113	D260 S282	D260-G275 CarbonylContact O-C 3.57Å; D260-G275 WeakPolarHBondContact O-CA 3.34Å; G275-S282 PolarHBondContact N-O 3.3Å; G275-S282 PolarHBondContact O-N 2.93Å; G275-S282 VanDerWaalsContact O-O 3.1Å
276	T	88.1	Confident	90.4	Very high	46 Å²	46	70.1 Å²	70.1	28%	0.282	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	142.2	174.9	48.7	0	0	0	0	110.3	R256 D260 K280	R256-T276 PolarHBondContact NH1-O 3.31Å; D260-T276 PolarHBondContact O-N 2.85Å; T276-K280 CarbonylContact C-O 3.52Å; T276-K280 WeakPolarHBondContact CA-O 3.49Å
277	Q	79.7	Confident	90.5	Very high	98 Å²	98	72.4 Å²	72.4	46%	0.458	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	121.9	170.1	-157.7	172.1	21.8	0	0	109.3	R256 E279 K280	R256-Q277 VanDerWaalsContact NH1-CD 3.3Å; Q277-E279 PolarHBondContact O-N 3.44Å; Q277-E279 VanDerWaalsContact O-N 3.17Å; Q277-K280 PolarHBondContact N-O 3.06Å; Q277-K280 PolarHBondContact O-N 2.8Å
278	K	77.6	Confident	90.6	Very high	197 Å²	197	66.2 Å²	66.2	86%	0.857	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	47.3	46.7	179.9	-58.6	-179.3	178.1	-175.9	0	111.2	K280	K278-K280 PolarHBondContact O-N 2.88Å; K278-K280 VanDerWaalsContact O-N 3.11Å
279	E	76.6	Confident	90.6	Very high	197 Å²	197	68.4 Å²	68.4	92%	0.921	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.8	8.1	-179.5	-55.7	175.2	175.5	0	0	116.5	Q277	Q277-E279 PolarHBondContact O-N 3.44Å; Q277-E279 VanDerWaalsContact O-N 3.17Å
280	K	80.9	Confident	90.4	Very high	162 Å²	162	66.3 Å²	66.3	70%	0.704	34%	0.342	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-105.2	145.4	172.4	-64.6	-177.7	-179.2	-178.9	0	111.4	T276 Q277 K278 S282	T276-K280 CarbonylContact C-O 3.52Å; T276-K280 WeakPolarHBondContact CA-O 3.49Å; Q277-K280 PolarHBondContact N-O 3.06Å; Q277-K280 PolarHBondContact O-N 2.8Å; K278-K280 PolarHBondContact O-N 2.88Å; K278-K280 VanDerWaalsContact O-N 3.11Å; K280-S282 PolarHBondContact O-N 3.35Å
281	N	85.9	Confident	90.1	Very high	146 Å²	146	68.6 Å²	68.6	78%	0.781	36%	0.358	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-62.7	127.7	169.9	-71.7	-26.9	0	0	0	109.4
282	S	91.2	Very high	89.6	Confident	22 Å²	22	72 Å²	72	15%	0.154	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	134	178.5	-176.2	0	0	0	0	109.5	R256 G275 K280	R256-S282 PolarHBondContact NH2-OG 2.88Å; G275-S282 PolarHBondContact N-O 3.3Å; G275-S282 PolarHBondContact O-N 2.93Å; G275-S282 VanDerWaalsContact O-O 3.1Å; K280-S282 PolarHBondContact O-N 3.35Å
283	V	93.6	Very high	89.2	Confident	88 Å²	88	69.5 Å²	69.5	53%	0.533	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	120.6	177.2	-176.3	0	0	0	0	107.7	Y272 V273 I274	Y272-V283 HydrophobicContact CD1-CG1 4.1Å; V273-V283 WeakPolarHBondContact O-CA 3.28Å; I274-V283 HydrophobicContact CG1-CG1 4.33Å; I274-V283 HydrophobicContact CG1-CG2 4.32Å; I274-V283 HydrophobicContact CG2-CG2 4.43Å
284	L	94.8	Very high	89.1	Confident	27 Å²	27	69.3 Å²	69.3	14%	0.141	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	138.6	169.6	-57.2	175.5	0	0	0	108.7	F244 R256 Y272 V273 F286	F244-L284 HydrophobicContact CE1-CD1 4.18Å; R256-L284 HydrophobicContact CG-CD1 4.33Å; Y272-L284 CarbonylContact C-O 3.56Å; Y272-L284 WeakPolarHBondContact CA-O 3.45Å; V273-L284 HydrophobicContact CB-CB 4.3Å; V273-L284 PolarHBondContact N-O 3.46Å; V273-L284 PolarHBondContact O-N 3.24Å; L284-F286 HydrophobicContact CB-CE2 3.6Å; L284-F286 HydrophobicContact CB-CZ 4.02Å; L284-F286 HydrophobicContact CD1-CE2 4.39Å; L284-F286 HydrophobicContact CD1-CZ 4.38Å
285	A	96	Very high	88.9	Confident	28 Å²	28	70.4 Å²	70.4	23%	0.231	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	133.8	179.6	0	0	0	0	0	110.2	T270 F271 Y272	T270-A285 HydrophobicContact CG2-CB 4.22Å; F271-A285 CarbonylContact O-C 3.57Å; F271-A285 WeakPolarHBondContact O-CA 3.43Å; Y272-A285 HydrophobicContact CD1-CB 3.9Å; Y272-A285 HydrophobicContact CE1-CB 3.84Å
286	F	97.3	Very high	88.8	Confident	5 Å²	5	71.1 Å²	71.1	2%	0.022	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	139.7	-178.8	-59.5	-79.6	0	0	0	110.4	C227 K228 D229 L237 F244 V246 T270 F271 L284	C227-F286 HydrophobicContact CB-CB 4.29Å; K228-F286 CarbonylContact O-C 3.58Å; K228-F286 WeakPolarHBondContact O-CA 3.45Å; D229-F286 HydrophobicContact CB-CD1 4.38Å; D229-F286 HydrophobicContact CB-CE1 4.38Å; L237-F286 HydrophobicContact CD1-CB 3.93Å; L237-F286 HydrophobicContact CD1-CD2 4.02Å; L237-F286 HydrophobicContact CD1-CG 3.89Å; L237-F286 HydrophobicContact CD2-CD1 3.79Å; L237-F286 HydrophobicContact CD2-CD2 4.11Å; L237-F286 HydrophobicContact CD2-CE1 3.85Å; L237-F286 HydrophobicContact CD2-CE2 4.16Å; L237-F286 HydrophobicContact CD2-CG 3.93Å; L237-F286 HydrophobicContact CD2-CZ 4.05Å; F244-F286 AromaticContact CE1-CE2 3.97Å; F244-F286 HydrophobicContact CE1-CE2 3.97Å; F244-F286 HydrophobicContact CE1-CZ 4.42Å; F244-F286 HydrophobicContact CZ-CD2 4.22Å; F244-F286 AromaticContact CZ-CE2 3.63Å; F244-F286 HydrophobicContact CZ-CE2 3.63Å; F244-F286 HydrophobicContact CZ-CZ 4.25Å; V246-F286 HydrophobicContact CG1-CE1 3.98Å; V246-F286 HydrophobicContact CG1-CZ 4.2Å; V246-F286 HydrophobicContact CG2-CE1 4.33Å; V246-F286 HydrophobicContact CG2-CE2 4.36Å; V246-F286 HydrophobicContact CG2-CZ 3.73Å; T270-F286 CarbonylContact C-O 3.54Å; T270-F286 WeakPolarHBondContact CA-O 3.47Å; F271-F286 HydrophobicContact CD1-CD2 4.37Å; F271-F286 PolarHBondContact N-O 2.82Å; F271-F286 PolarHBondContact O-N 3.17Å; L284-F286 HydrophobicContact CB-CE2 3.6Å; L284-F286 HydrophobicContact CB-CZ 4.02Å; L284-F286 HydrophobicContact CD1-CE2 4.39Å; L284-F286 HydrophobicContact CD1-CZ 4.38Å
287	H	96.5	Very high	89	Confident	76 Å²	76	69 Å²	69	35%	0.352	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	124.8	-177.5	-58.4	92	0	0	0	110.1	C227 K228 T270	C227-H287 CarbonylContact C-O 3.54Å; C227-H287 WeakPolarHBondContact CA-O 3.29Å; C227-H287 WeakPolarHBondContact CB-O 3.47Å; K228-H287 HydrophobicContact CB-CB 4.45Å; K228-H287 PolarHBondContact N-O 3.21Å; K228-H287 PolarHBondContact O-N 2.91Å; T270-H287 PolarHBondContact OG1-CD2 2.83Å; T270-H287 PolarHBondContact OG1-NE2 2.8Å
288	T	92.8	Very high	89.8	Confident	13 Å²	13	64.3 Å²	64.3	8%	0.08	35%	0.348	C	S	.	.			trans	-95.9	166.5	174.4	59.4	0	0	0	0	110.7	K269 T290 C294 L297	K269-T288 PolarHBondContact O-N 2.76Å; K269-T288 PolarHBondContact O-OG1 2.77Å; T288-T290 PolarHBondContact OG1-O 2.86Å; T288-T290 VanDerWaalsContact OG1-O 3.05Å; T288-C294 HydrophobicContact CG2-CB 4.26Å; T288-C294 WeakPolarHBondContact OG1-CB 3.49Å; T288-C294 PolarHBondContact OG1-N 3.07Å; T288-L297 HydrophobicContact CG2-CD2 3.94Å
289	S	88.9	Confident	90.5	Very high	90 Å²	90	57.6 Å²	57.6	63%	0.629	32%	0.319	S	S	*	.	S	Bend	trans	-66	-38.3	179.3	51.8	0	0	0	0	112.8	K269	K269-S289 WeakPolarHBondContact CD-O 3.33Å; K269-S289 WeakPolarHBondContact CE-O 3.48Å; K269-S289 PolarHBondContact NZ-O 3.49Å
290	T	89	Confident	91.3	Very high	63 Å²	63	48.7 Å²	48.7	39%	0.387	28%	0.278	S	S	.	.	S	Bend	trans	-136.5	154	-175.9	70.4	0	0	0	0	112.3	T288 A292 A293 C294	T288-T290 PolarHBondContact OG1-O 2.86Å; T288-T290 VanDerWaalsContact OG1-O 3.05Å; T290-A292 PolarHBondContact O-N 3.34Å; T290-A293 PolarHBondContact O-N 2.88Å; T290-A293 WeakPolarHBondContact OG1-CB 2.91Å; T290-A293 PolarHBondContact OG1-N 2.89Å; T290-A293 VanDerWaalsContact OG1-N 3.1Å; T290-C294 PolarHBondContact O-N 2.87Å; T290-C294 VanDerWaalsContact O-N 3.07Å
291	P	89.8	Confident	92	Very high	68 Å²	68	41 Å²	41	44%	0.442	24%	0.244	S	C	.	.	H	α-helix	trans	-61.5	-31.9	175	-22.1	34.8	0	0	0	112.6	G268 K269 C294 K295	G268-P291 WeakPolarHBondContact O-CA 3.39Å; K269-P291 HydrophobicContact CG-CG 3.92Å; P291-C294 WeakPolarHBondContact O-CB 3.4Å; P291-C294 PolarHBondContact O-N 3.34Å; P291-K295 WeakPolarHBondContact O-CB 3.42Å; P291-K295 PolarHBondContact O-N 3.21Å
292	A	86.4	Confident	92.5	Very high	70 Å²	70	34.2 Å²	34.2	58%	0.579	21%	0.208	S	C	*	.	H	α-helix	trans	-63.3	-45.2	175.2	0	0	0	0	0	111.8	T290 C294 K295 H296	T290-A292 PolarHBondContact O-N 3.34Å; A292-C294 VanDerWaalsContact C-N 3.31Å; A292-C294 PolarHBondContact O-N 2.66Å; A292-K295 PolarHBondContact O-N 3.24Å; A292-H296 WeakPolarHBondContact O-CB 3.24Å; A292-H296 PolarHBondContact O-N 3.03Å
293	A	87.8	Confident	92.7	Very high	14 Å²	14	34.5 Å²	34.5	12%	0.116	21%	0.207	C	C	.	.	H	α-helix	trans	-61.3	-40.4	173.8	0	0	0	0	0	111.4	T290 H296 L297	T290-A293 PolarHBondContact O-N 2.88Å; T290-A293 WeakPolarHBondContact OG1-CB 2.91Å; T290-A293 PolarHBondContact OG1-N 2.89Å; T290-A293 VanDerWaalsContact OG1-N 3.1Å; A293-H296 PolarHBondContact O-N 3.2Å; A293-L297 WeakPolarHBondContact O-CB 3.35Å; A293-L297 PolarHBondContact O-N 3.27Å
294	C	92.5	Very high	92.8	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-63.2	-45.3	175.6	-153.6	0	0	0	0	113.1	F266 K269 F271 T288 T290 P291 A292 H296 L297 W298	F266-C294 HydrophobicContact CD2-CB 4.46Å; K269-C294 VanDerWaalsContact C-SG 3.52Å; K269-C294 PolarHBondContact O-SG 2.79Å; F271-C294 PolarHBondContact N-SG 2.92Å; T288-C294 HydrophobicContact CG2-CB 4.26Å; T288-C294 WeakPolarHBondContact OG1-CB 3.49Å; T288-C294 PolarHBondContact OG1-N 3.07Å; T290-C294 PolarHBondContact O-N 2.87Å; T290-C294 VanDerWaalsContact O-N 3.07Å; P291-C294 WeakPolarHBondContact O-CB 3.4Å; P291-C294 PolarHBondContact O-N 3.34Å; A292-C294 VanDerWaalsContact C-N 3.31Å; A292-C294 PolarHBondContact O-N 2.66Å; C294-H296 VanDerWaalsContact C-N 3.32Å; C294-L297 PolarHBondContact O-N 3.46Å; C294-W298 WeakPolarHBondContact O-CB 3.48Å; C294-W298 PolarHBondContact O-N 2.89Å
295	K	91	Very high	92.9	Very high	64 Å²	64	30.5 Å²	30.5	28%	0.278	18%	0.182	S	C	.	.	H	α-helix	trans	-61.6	-42.1	176	-179.7	179.6	177.9	-178.3	0	110.6	F266 P291 A292 W298 K299 S329 D487	F266-K295 HydrophobicContact CE1-CB 4.42Å; F266-K295 HydrophobicContact CE1-CG 4.34Å; F266-K295 HydrophobicContact CE2-CB 3.98Å; F266-K295 HydrophobicContact CE2-CG 4.45Å; F266-K295 HydrophobicContact CZ-CB 3.87Å; F266-K295 HydrophobicContact CZ-CD 4.48Å; F266-K295 HydrophobicContact CZ-CG 3.87Å; P291-K295 WeakPolarHBondContact O-CB 3.42Å; P291-K295 PolarHBondContact O-N 3.21Å; A292-K295 PolarHBondContact O-N 3.24Å; K295-W298 PolarHBondContact O-N 2.95Å; K295-K299 WeakPolarHBondContact O-CG 3.49Å; K295-K299 PolarHBondContact O-N 3.4Å; K295-S329 WeakPolarHBondContact CE-OG 3.33Å; K295-D487 IonicContact NZ-OD2 3.7Å
296	H	89.1	Confident	92.9	Very high	19 Å²	19	29.3 Å²	29.3	9%	0.088	17%	0.173	C	C	.	.	H	α-helix	trans	-62.7	-51.6	175.7	173.1	85.8	0	0	0	111.7	Q83 R84 H85 H225 A292 A293 C294 W298 K299 C300	Q83-H296 PolarHBondContact NE2-CD2 3.44Å; Q83-H296 PolarHBondContact NE2-NE2 3.32Å; R84-H296 PolarHBondContact O-CE1 3.06Å; R84-H296 PolarHBondContact O-NE2 3.04Å; H85-H296 AromaticContact CE1-ND1 3.79Å; H85-H296 AromaticContact ND1-CE1 3.88Å; H85-H296 AromaticContact ND1-ND1 3.29Å; H85-H296 PolarHBondContact ND1-ND1 3Å; H225-H296 AromaticContact CE1-CD2 3.75Å; H225-H296 AromaticContact CE1-NE2 3.54Å; A292-H296 WeakPolarHBondContact O-CB 3.24Å; A292-H296 PolarHBondContact O-N 3.03Å; A293-H296 PolarHBondContact O-N 3.2Å; C294-H296 VanDerWaalsContact C-N 3.32Å; H296-W298 VanDerWaalsContact C-N 3.25Å; H296-W298 PolarHBondContact O-N 3.32Å; H296-K299 WeakPolarHBondContact O-CB 3.46Å; H296-K299 PolarHBondContact O-N 2.87Å; H296-C300 PolarHBondContact NE2-SG 3.46Å; H296-C300 VanDerWaalsContact NE2-SG 3.44Å; H296-C300 PolarHBondContact O-N 2.82Å; H296-C300 PolarHBondContact O-SG 3.35Å
297	L	92.8	Very high	92.9	Very high	2 Å²	2	29.1 Å²	29.1	1%	0.01	17%	0.172	C	C	.	.	H	α-helix	trans	-53.6	-44.2	175.1	172.3	69	0	0	0	111.5	H225 L237 F239 F271 T288 A293 C294 C300 G301	H225-L297 HydrophobicContact CB-CD1 3.67Å; L237-L297 HydrophobicContact CB-CD1 4.3Å; L237-L297 HydrophobicContact CD1-CD1 4.16Å; L237-L297 HydrophobicContact CD1-CD2 3.63Å; L237-L297 HydrophobicContact CD1-CG 4.5Å; F239-L297 HydrophobicContact CE2-CD1 3.62Å; F239-L297 HydrophobicContact CZ-CD1 3.66Å; F239-L297 HydrophobicContact CZ-CG 4.35Å; F271-L297 HydrophobicContact CB-CD2 3.71Å; F271-L297 HydrophobicContact CD1-CD2 3.66Å; F271-L297 HydrophobicContact CD1-CG 4.21Å; F271-L297 HydrophobicContact CD2-CD2 4.13Å; F271-L297 HydrophobicContact CD2-CG 4.26Å; F271-L297 HydrophobicContact CE1-CD2 4.26Å; F271-L297 HydrophobicContact CE1-CG 4.35Å; F271-L297 HydrophobicContact CE2-CG 4.43Å; F271-L297 HydrophobicContact CG-CD2 3.56Å; F271-L297 HydrophobicContact CG-CG 4.14Å; F271-L297 HydrophobicContact CZ-CG 4.45Å; T288-L297 HydrophobicContact CG2-CD2 3.94Å; A293-L297 WeakPolarHBondContact O-CB 3.35Å; A293-L297 PolarHBondContact O-N 3.27Å; C294-L297 PolarHBondContact O-N 3.46Å; L297-C300 PolarHBondContact O-N 3.29Å; L297-G301 PolarHBondContact O-N 2.91Å
298	W	94.9	Very high	92.9	Very high	0 Å²	0	26.9 Å²	26.9	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-61.8	-46.1	175.8	171.1	81	0	0	0	112.4	L264 F266 F271 C294 K295 H296 C300 G301 V302 V319 S329 F331	L264-W298 PolarHBondContact O-NE1 2.96Å; L264-W298 VanDerWaalsContact O-NE1 3.14Å; F266-W298 HydrophobicContact CB-CB 4.28Å; F266-W298 HydrophobicContact CD1-CB 3.57Å; F266-W298 AromaticContact CD1-CD1 3.95Å; F266-W298 AromaticContact CD1-CD2 3.65Å; F266-W298 HydrophobicContact CD1-CD2 3.65Å; F266-W298 HydrophobicContact CD1-CE3 4.04Å; F266-W298 AromaticContact CD1-CG 3.43Å; F266-W298 HydrophobicContact CD1-CG 3.43Å; F266-W298 VanDerWaalsContact CD1-CG 3.43Å; F266-W298 HydrophobicContact CE1-CB 4.27Å; F266-W298 AromaticContact CE1-CD2 3.72Å; F266-W298 HydrophobicContact CE1-CD2 3.72Å; F266-W298 AromaticContact CE1-CE3 3.65Å; F266-W298 HydrophobicContact CE1-CE3 3.65Å; F266-W298 HydrophobicContact CE1-CG 4.01Å; F266-W298 HydrophobicContact CE1-CZ3 4.23Å; F266-W298 HydrophobicContact CG-CB 4.2Å; F266-W298 HydrophobicContact CG-CG 4.42Å; F271-W298 HydrophobicContact CD2-CB 4.19Å; F271-W298 HydrophobicContact CE2-CB 4.02Å; C294-W298 WeakPolarHBondContact O-CB 3.48Å; C294-W298 PolarHBondContact O-N 2.89Å; K295-W298 PolarHBondContact O-N 2.95Å; H296-W298 VanDerWaalsContact C-N 3.25Å; H296-W298 PolarHBondContact O-N 3.32Å; W298-C300 PolarHBondContact O-N 2.91Å; W298-G301 PolarHBondContact O-N 2.89Å; W298-V302 HydrophobicContact CD2-CG1 4.3Å; W298-V302 HydrophobicContact CG-CG1 4.45Å; W298-V302 HydrophobicContact CZ2-CG1 4.15Å; W298-V302 WeakPolarHBondContact O-CG2 3.27Å; W298-V302 PolarHBondContact O-N 2.89Å; W298-V319 HydrophobicContact CZ2-CB 4.34Å; W298-V319 HydrophobicContact CZ2-CG1 3.95Å; W298-S329 WeakPolarHBondContact CH2-O 3.47Å; W298-F331 HydrophobicContact CH2-CB 3.64Å; W298-F331 HydrophobicContact CZ2-CB 4.44Å; W298-F331 HydrophobicContact CZ3-CB 3.95Å
299	K	92.9	Very high	93	Very high	56 Å²	56	29.4 Å²	29.4	24%	0.243	17%	0.17	C	C	.	.	H	α-helix	trans	-56.4	-48.9	175	-75.9	-177.2	178.2	-174.9	0	111.3	E88 K295 H296 G301 V302 E303 F331	E88-K299 IonicContact OE1-NZ 2.58Å; K295-K299 WeakPolarHBondContact O-CG 3.49Å; K295-K299 PolarHBondContact O-N 3.4Å; H296-K299 WeakPolarHBondContact O-CB 3.46Å; H296-K299 PolarHBondContact O-N 2.87Å; K299-G301 VanDerWaalsContact C-N 3.31Å; K299-G301 PolarHBondContact O-N 2.92Å; K299-V302 VanDerWaalsContact O-CG2 3.23Å; K299-V302 WeakPolarHBondContact O-CG2 3.2Å; K299-V302 PolarHBondContact O-N 2.96Å; K299-E303 VanDerWaalsContact O-CB 3.23Å; K299-E303 WeakPolarHBondContact O-CB 3.49Å; K299-E303 PolarHBondContact O-N 2.97Å; K299-F331 HydrophobicContact CB-CD2 4.5Å; K299-F331 HydrophobicContact CG-CD2 4.15Å
300	C	93.7	Very high	93.3	Very high	9 Å²	9	28.5 Å²	28.5	6%	0.061	15%	0.154	C	C	.	.	H	α-helix	trans	-58.1	-43.9	176.5	-69.2	0	0	0	0	111.6	F239 H296 L297 W298 N304	F239-C300 HydrophobicContact CD2-CB 4.13Å; F239-C300 HydrophobicContact CE2-CB 3.91Å; H296-C300 PolarHBondContact NE2-SG 3.46Å; H296-C300 VanDerWaalsContact NE2-SG 3.44Å; H296-C300 PolarHBondContact O-N 2.82Å; H296-C300 PolarHBondContact O-SG 3.35Å; L297-C300 PolarHBondContact O-N 3.29Å; W298-C300 PolarHBondContact O-N 2.91Å; C300-N304 WeakPolarHBondContact O-CB 3.4Å; C300-N304 PolarHBondContact O-N 3.34Å; C300-N304 PolarHBondContact O-ND2 2.92Å
301	G	95.8	Very high	93.5	Very high	0 Å²	0	27.4 Å²	27.4	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-65.7	-46.9	179.3	0	0	0	0	0	113.7	L264 L297 W298 K299 E303 N304 Q305	L264-G301 WeakPolarHBondContact CD1-O 3.35Å; L297-G301 PolarHBondContact O-N 2.91Å; W298-G301 PolarHBondContact O-N 2.89Å; K299-G301 VanDerWaalsContact C-N 3.31Å; K299-G301 PolarHBondContact O-N 2.92Å; G301-E303 VanDerWaalsContact C-N 3.3Å; G301-E303 PolarHBondContact O-N 2.8Å; G301-N304 PolarHBondContact O-N 3.4Å; G301-Q305 VanDerWaalsContact O-CB 3.3Å; G301-Q305 WeakPolarHBondContact O-CB 3.41Å; G301-Q305 PolarHBondContact O-N 3.22Å
302	V	95.3	Very high	93.7	Very high	4 Å²	4	29.8 Å²	29.8	2%	0.024	15%	0.154	C	C	.	.	H	α-helix	trans	-67	-34.2	178.9	-63.3	0	0	0	0	111.8	L264 W298 K299 A306 V319 F331	L264-V302 HydrophobicContact CB-CG1 4.14Å; L264-V302 HydrophobicContact CD1-CG1 4.38Å; W298-V302 HydrophobicContact CD2-CG1 4.3Å; W298-V302 HydrophobicContact CG-CG1 4.45Å; W298-V302 HydrophobicContact CZ2-CG1 4.15Å; W298-V302 WeakPolarHBondContact O-CG2 3.27Å; W298-V302 PolarHBondContact O-N 2.89Å; K299-V302 VanDerWaalsContact O-CG2 3.23Å; K299-V302 WeakPolarHBondContact O-CG2 3.2Å; K299-V302 PolarHBondContact O-N 2.96Å; V302-A306 VanDerWaalsContact O-CB 3.27Å; V302-A306 WeakPolarHBondContact O-CB 3.45Å; V302-A306 PolarHBondContact O-N 2.92Å; V302-V319 HydrophobicContact CG1-CB 4.49Å; V302-V319 HydrophobicContact CG1-CG1 4.08Å; V302-F331 HydrophobicContact CB-CD1 4.44Å; V302-F331 HydrophobicContact CG2-CB 4Å; V302-F331 HydrophobicContact CG2-CD1 3.49Å; V302-F331 VanDerWaalsContact CG2-CD1 3.49Å; V302-F331 HydrophobicContact CG2-CD2 4.31Å; V302-F331 HydrophobicContact CG2-CE1 4.01Å; V302-F331 HydrophobicContact CG2-CG 3.66Å
303	E	95.3	Very high	94	Very high	29 Å²	29	28.5 Å²	28.5	14%	0.136	14%	0.141	C	C	.	.	H	α-helix	trans	-69.3	-44.8	177	-174.4	172.6	-134.6	0	0	112	K110 F111 K299 G301 A306 F307 F331 Y333	K110-E303 VanDerWaalsContact CE-CD 3.44Å; K110-E303 WeakPolarHBondContact CE-OE2 3Å; K110-E303 IonicContact NZ-OE1 2.8Å; K110-E303 PolarHBondContact NZ-OE1 2.74Å; K110-E303 IonicContact NZ-OE2 2.87Å; K110-E303 PolarHBondContact NZ-OE2 3.24Å; F111-E303 HydrophobicContact CE1-CG 4.24Å; F111-E303 HydrophobicContact CZ-CG 3.82Å; K299-E303 VanDerWaalsContact O-CB 3.23Å; K299-E303 WeakPolarHBondContact O-CB 3.49Å; K299-E303 PolarHBondContact O-N 2.97Å; G301-E303 VanDerWaalsContact C-N 3.3Å; G301-E303 PolarHBondContact O-N 2.8Å; E303-A306 WeakPolarHBondContact O-CB 3.4Å; E303-A306 PolarHBondContact O-N 2.85Å; E303-F307 PolarHBondContact O-N 2.87Å; E303-F331 HydrophobicContact CB-CE1 4.09Å; E303-F331 HydrophobicContact CB-CZ 3.82Å; E303-F331 HydrophobicContact CG-CZ 4.1Å; E303-Y333 HydrophobicContact CG-CD2 4.22Å; E303-Y333 HydrophobicContact CG-CE2 4.12Å
304	N	96.8	Very high	94.2	Very high	18 Å²	18	32.7 Å²	32.7	10%	0.096	17%	0.169	C	C	.	.	H	α-helix	trans	-65.7	-40.4	174.6	-83.5	-86.2	0	0	0	112	F239 W258 C300 G301 A306 F307 Y308	F239-N304 HydrophobicContact CB-CB 3.68Å; F239-N304 HydrophobicContact CG-CB 4.33Å; W258-N304 HydrophobicContact CH2-CB 3.9Å; W258-N304 HydrophobicContact CZ2-CB 3.89Å; C300-N304 WeakPolarHBondContact O-CB 3.4Å; C300-N304 PolarHBondContact O-N 3.34Å; C300-N304 PolarHBondContact O-ND2 2.92Å; G301-N304 PolarHBondContact O-N 3.4Å; N304-A306 VanDerWaalsContact C-N 3.31Å; N304-A306 PolarHBondContact O-N 2.92Å; N304-F307 PolarHBondContact O-N 2.76Å; N304-Y308 HydrophobicContact CB-CD2 4.35Å; N304-Y308 HydrophobicContact CB-CE2 4.49Å; N304-Y308 VanDerWaalsContact O-CD2 3.27Å; N304-Y308 WeakPolarHBondContact O-CD2 3.23Å; N304-Y308 PolarHBondContact O-N 3.26Å; N304-Y308 WeakPolarHBondContact OD1-CE2 3.48Å
305	Q	96	Very high	94.1	Very high	12 Å²	12	37.4 Å²	37.4	6%	0.056	19%	0.192	C	C	.	.	H	α-helix	trans	-59.7	-45.2	173.7	-172.6	-177.1	37.2	0	0	110.7	W258 V261 G301 K309	W258-Q305 HydrophobicContact CE3-CB 3.93Å; W258-Q305 HydrophobicContact CE3-CG 3.93Å; W258-Q305 HydrophobicContact CH2-CB 4.35Å; W258-Q305 HydrophobicContact CZ3-CB 3.66Å; W258-Q305 HydrophobicContact CZ3-CG 4.11Å; V261-Q305 PolarHBondContact O-NE2 3.26Å; G301-Q305 VanDerWaalsContact O-CB 3.3Å; G301-Q305 WeakPolarHBondContact O-CB 3.41Å; G301-Q305 PolarHBondContact O-N 3.22Å; Q305-K309 HydrophobicContact CG-CB 4.18Å; Q305-K309 HydrophobicContact CG-CD 3.88Å; Q305-K309 WeakPolarHBondContact O-CB 3.47Å; Q305-K309 PolarHBondContact O-N 3.27Å
306	A	96.3	Very high	94	Very high	3 Å²	3	35.9 Å²	35.9	3%	0.025	19%	0.186	C	C	.	.	H	α-helix	trans	-56.9	-50.7	175.6	0	0	0	0	0	111.9	V302 E303 N304 I316 Y333 V337	V302-A306 VanDerWaalsContact O-CB 3.27Å; V302-A306 WeakPolarHBondContact O-CB 3.45Å; V302-A306 PolarHBondContact O-N 2.92Å; E303-A306 WeakPolarHBondContact O-CB 3.4Å; E303-A306 PolarHBondContact O-N 2.85Å; N304-A306 VanDerWaalsContact C-N 3.31Å; N304-A306 PolarHBondContact O-N 2.92Å; A306-I316 HydrophobicContact CB-CD1 3.75Å; A306-I316 HydrophobicContact CB-CG1 4.48Å; A306-I316 HydrophobicContact CB-CG2 4.3Å; A306-Y333 HydrophobicContact CB-CD1 4.26Å; A306-Y333 HydrophobicContact CB-CD2 3.33Å; A306-Y333 HydrophobicContact CB-CE2 3.73Å; A306-Y333 HydrophobicContact CB-CG 3.61Å; A306-V337 WeakPolarHBondContact O-CG1 3.42Å
307	F	96.9	Very high	93.9	Very high	1 Å²	1	43.4 Å²	43.4	0%	0.004	22%	0.219	C	C	.	.	H	α-helix	trans	-63.4	-48.2	-178.1	-175.6	-94.3	0	0	0	112.8	Y72 F111 E303 N304 Y333 K336 A338 V341	Y72-F307 HydrophobicContact CD1-CZ 4.1Å; Y72-F307 HydrophobicContact CE1-CZ 4.01Å; F111-F307 HydrophobicContact CB-CD1 3.79Å; F111-F307 HydrophobicContact CB-CD2 4.43Å; F111-F307 HydrophobicContact CB-CE1 3.45Å; F111-F307 VanDerWaalsContact CB-CE1 3.45Å; F111-F307 HydrophobicContact CB-CE2 4.15Å; F111-F307 HydrophobicContact CB-CG 4.29Å; F111-F307 HydrophobicContact CB-CZ 3.65Å; F111-F307 HydrophobicContact CD1-CB 3.91Å; F111-F307 AromaticContact CD1-CD1 3.74Å; F111-F307 HydrophobicContact CD1-CD1 3.74Å; F111-F307 HydrophobicContact CD1-CD2 4.2Å; F111-F307 HydrophobicContact CD1-CE1 4.31Å; F111-F307 AromaticContact CD1-CG 3.69Å; F111-F307 HydrophobicContact CD1-CG 3.69Å; F111-F307 HydrophobicContact CD2-CD1 4.38Å; F111-F307 AromaticContact CD2-CD2 3.68Å; F111-F307 HydrophobicContact CD2-CD2 3.68Å; F111-F307 HydrophobicContact CD2-CE1 4.44Å; F111-F307 AromaticContact CD2-CE2 3.74Å; F111-F307 HydrophobicContact CD2-CE2 3.74Å; F111-F307 HydrophobicContact CD2-CG 4.03Å; F111-F307 HydrophobicContact CD2-CZ 4.13Å; F111-F307 HydrophobicContact CE1-CB 3.71Å; F111-F307 HydrophobicContact CE1-CD1 4.41Å; F111-F307 HydrophobicContact CE1-CD2 4.36Å; F111-F307 AromaticContact CE1-CG 3.93Å; F111-F307 HydrophobicContact CE1-CG 3.93Å; F111-F307 AromaticContact CE2-CD2 3.84Å; F111-F307 HydrophobicContact CE2-CD2 3.84Å; F111-F307 HydrophobicContact CE2-CE2 4.28Å; F111-F307 HydrophobicContact CE2-CG 4.24Å; F111-F307 HydrophobicContact CG-CB 4.42Å; F111-F307 AromaticContact CG-CD1 3.72Å; F111-F307 HydrophobicContact CG-CD1 3.72Å; F111-F307 AromaticContact CG-CD2 3.85Å; F111-F307 HydrophobicContact CG-CD2 3.85Å; F111-F307 AromaticContact CG-CE1 3.84Å; F111-F307 HydrophobicContact CG-CE1 3.84Å; F111-F307 AromaticContact CG-CE2 3.97Å; F111-F307 HydrophobicContact CG-CE2 3.97Å; F111-F307 AromaticContact CG-CG 3.74Å; F111-F307 HydrophobicContact CG-CG 3.74Å; F111-F307 AromaticContact CG-CZ 3.97Å; F111-F307 HydrophobicContact CG-CZ 3.97Å; F111-F307 HydrophobicContact CZ-CB 4.04Å; F111-F307 HydrophobicContact CZ-CD2 4.18Å; F111-F307 HydrophobicContact CZ-CG 4.18Å; E303-F307 PolarHBondContact O-N 2.87Å; N304-F307 PolarHBondContact O-N 2.76Å; F307-Y333 HydrophobicContact CB-CE2 4.47Å; F307-Y333 WeakPolarHBondContact CD2-OH 3.32Å; F307-K336 WeakPolarHBondContact CD2-O 3.47Å; F307-A338 HydrophobicContact CD1-CB 3.86Å; F307-A338 HydrophobicContact CE1-CB 3.55Å; F307-A338 HydrophobicContact CZ-CB 3.99Å; F307-A338 VanDerWaalsContact O-CB 3.28Å; F307-A338 WeakPolarHBondContact O-CB 3.39Å; F307-A338 PolarHBondContact O-N 3.16Å; F307-V341 HydrophobicContact CE2-CG2 4.03Å; F307-V341 HydrophobicContact CZ-CG2 4.37Å
308	Y	96.8	Very high	93.6	Very high	30 Å²	30	47.1 Å²	47.1	12%	0.118	24%	0.242	C	C	.	.	H	α-helix	trans	-91.8	-29.3	-171.2	-66.6	-64.1	0	0	0	115.1	F111 Y112 A241 W258 N304 A338	F111-Y308 WeakPolarHBondContact CA-OH 3.46Å; F111-Y308 HydrophobicContact CD1-CE2 4.22Å; Y112-Y308 PolarHBondContact N-OH 3.49Å; Y112-Y308 WeakPolarHBondContact O-CE1 3.27Å; Y112-Y308 PolarHBondContact O-OH 3.11Å; A241-Y308 HydrophobicContact CB-CD1 3.97Å; A241-Y308 HydrophobicContact CB-CE1 3.5Å; W258-Y308 VanDerWaalsContact CD1-CB 3.42Å; W258-Y308 HydrophobicContact CZ2-CD2 4.21Å; W258-Y308 AromaticContact NE1-CD2 3.66Å; W258-Y308 AromaticContact NE1-CG 3.76Å; N304-Y308 HydrophobicContact CB-CD2 4.35Å; N304-Y308 HydrophobicContact CB-CE2 4.49Å; N304-Y308 VanDerWaalsContact O-CD2 3.27Å; N304-Y308 WeakPolarHBondContact O-CD2 3.23Å; N304-Y308 PolarHBondContact O-N 3.26Å; N304-Y308 WeakPolarHBondContact OD1-CE2 3.48Å; Y308-A338 HydrophobicContact CD1-CB 4.2Å
309	K	95.1	Very high	93.2	Very high	66 Å²	66	49 Å²	49	29%	0.287	25%	0.253	S	S	.	.	H	α-helix	trans	-81.6	-41.9	-173	-170.9	179.1	177	172.1	0	113.1	W258 V261 Q305	W258-K309 HydrophobicContact CB-CB 4.03Å; W258-K309 HydrophobicContact CB-CG 4.24Å; W258-K309 WeakPolarHBondContact O-CD 3.27Å; W258-K309 WeakPolarHBondContact O-CE 3.3Å; V261-K309 PolarHBondContact O-NZ 3.21Å; Q305-K309 HydrophobicContact CG-CB 4.18Å; Q305-K309 HydrophobicContact CG-CD 3.88Å; Q305-K309 WeakPolarHBondContact O-CB 3.47Å; Q305-K309 PolarHBondContact O-N 3.27Å
310	Y	94.3	Very high	92.6	Very high	70 Å²	70	48 Å²	48	28%	0.275	25%	0.253	S	S	.	.			trans	-86.3	152.7	-166	-69.7	-90.7	0	0	0	112.4	Q315 I316	Y310-Q315 HydrophobicContact CD1-CB 3.93Å; Y310-I316 HydrophobicContact CD1-CG1 4.18Å; Y310-I316 HydrophobicContact CD2-CD1 4.36Å; Y310-I316 HydrophobicContact CD2-CG1 3.82Å; Y310-I316 HydrophobicContact CE2-CG1 4.27Å; Y310-I316 HydrophobicContact CG-CD1 4.46Å; Y310-I316 HydrophobicContact CG-CG1 3.75Å
311	A	93.9	Very high	91.6	Very high	40 Å²	40	48.2 Å²	48.2	33%	0.331	25%	0.254	S	S	.	.	S	Bend	trans	-84.2	-32.3	177.8	0	0	0	0	0	112.5	K339	A311-K339 HydrophobicContact CB-CD 4.29Å
312	K	94.3	Very high	90.1	Very high	118 Å²	118	50.1 Å²	50.1	51%	0.513	27%	0.268	S	S	.	.			trans	-137.9	146.2	176.6	-63.6	-173.3	178.2	-175.6	0	110.6	S314 Q315 E340	K312-S314 PolarHBondContact O-N 3.35Å; K312-Q315 HydrophobicContact CB-CG 4.27Å; K312-Q315 WeakPolarHBondContact O-CB 3.34Å; K312-Q315 PolarHBondContact O-N 3.17Å; K312-Q315 VanDerWaalsContact O-N 3.14Å; K312-E340 VanDerWaalsContact CA-OE1 3.26Å; K312-E340 WeakPolarHBondContact CA-OE1 3.38Å; K312-E340 WeakPolarHBondContact CB-OE1 3.31Å
313	S	92.8	Very high	88.3	Confident	43 Å²	43	58.5 Å²	58.5	30%	0.301	30%	0.304	S	S	.	.	G	3₁₀ helix	trans	-61.4	-30.9	176.5	50	0	0	0	0	112.5	Q315 I316 G335 E340	S313-Q315 PolarHBondContact O-N 3.07Å; S313-I316 WeakPolarHBondContact O-CB 3.41Å; S313-I316 PolarHBondContact O-N 2.97Å; S313-I316 VanDerWaalsContact O-N 3.13Å; S313-G335 WeakPolarHBondContact CB-O 3.32Å; S313-E340 VanDerWaalsContact CB-OE2 3.29Å; S313-E340 WeakPolarHBondContact CB-OE2 3.16Å; S313-E340 PolarHBondContact N-OE1 2.99Å; S313-E340 PolarHBondContact N-OE2 3.48Å; S313-E340 PolarHBondContact OG-OE1 2.86Å; S313-E340 VanDerWaalsContact OG-OE1 3.13Å; S313-E340 PolarHBondContact OG-OE2 2.63Å
314	S	91.2	Very high	86.2	Confident	102 Å²	102	63.3 Å²	63.3	71%	0.713	33%	0.329	S	S	*	.	G	3₁₀ helix	trans	-64.9	-17.8	176.6	61.2	0	0	0	0	114.9	K312 I316	K312-S314 PolarHBondContact O-N 3.35Å; S314-I316 VanDerWaalsContact C-N 3.29Å
315	Q	90	Very high	83.8	Confident	100 Å²	100	69.7 Å²	69.7	47%	0.467	36%	0.356	S	S	.	.	G	3₁₀ helix	trans	-79.6	-14.6	176.7	-64.3	173.2	-23.7	0	0	112.4	Y310 K312 S313 K317	Y310-Q315 HydrophobicContact CD1-CB 3.93Å; K312-Q315 HydrophobicContact CB-CG 4.27Å; K312-Q315 WeakPolarHBondContact O-CB 3.34Å; K312-Q315 PolarHBondContact O-N 3.17Å; K312-Q315 VanDerWaalsContact O-N 3.14Å; S313-Q315 PolarHBondContact O-N 3.07Å; Q315-K317 PolarHBondContact O-N 3Å
316	I	90.1	Very high	81.6	Confident	31 Å²	31	76.6 Å²	76.6	16%	0.159	39%	0.386	C	S	.	.	P	Polyproline II helix	trans	-82.6	116.7	-172.8	-56.9	166.2	0	0	0	109.1	A306 Y310 S313 S314 Y333 V337	A306-I316 HydrophobicContact CB-CD1 3.75Å; A306-I316 HydrophobicContact CB-CG1 4.48Å; A306-I316 HydrophobicContact CB-CG2 4.3Å; Y310-I316 HydrophobicContact CD1-CG1 4.18Å; Y310-I316 HydrophobicContact CD2-CD1 4.36Å; Y310-I316 HydrophobicContact CD2-CG1 3.82Å; Y310-I316 HydrophobicContact CE2-CG1 4.27Å; Y310-I316 HydrophobicContact CG-CD1 4.46Å; Y310-I316 HydrophobicContact CG-CG1 3.75Å; S313-I316 WeakPolarHBondContact O-CB 3.41Å; S313-I316 PolarHBondContact O-N 2.97Å; S313-I316 VanDerWaalsContact O-N 3.13Å; S314-I316 VanDerWaalsContact C-N 3.29Å; I316-Y333 HydrophobicContact CD1-CD1 3.36Å; I316-Y333 HydrophobicContact CD1-CE1 3.82Å; I316-Y333 HydrophobicContact CD1-CG 3.9Å; I316-V337 HydrophobicContact CD1-CG1 3.55Å
317	K	87.8	Confident	79.8	Confident	178 Å²	178	85.2 Å²	85.2	77%	0.774	42%	0.424	S	S	*	.	P	Polyproline II helix	trans	-87.5	153.3	172.6	-61.9	-177.3	-179.7	-177.7	0	110.1	Q315 V319	Q315-K317 PolarHBondContact O-N 3Å; K317-V319 PolarHBondContact O-N 3.22Å
318	T	86.4	Confident	78.1	Confident	80 Å²	80	86.5 Å²	86.5	49%	0.491	44%	0.437	S	S	.	.	P	Polyproline II helix	trans	-56.6	126.6	171	-57.4	0	0	0	0	110	R330 F331	T318-R330 HydrophobicContact CG2-CB 4.14Å; T318-F331 WeakPolarHBondContact CA-O 3.42Å; T318-F331 WeakPolarHBondContact CG2-O 3.34Å
319	V	84.5	Confident	77.1	Confident	40 Å²	40	86.4 Å²	86.4	24%	0.242	44%	0.44	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	131.3	-179.7	-170.9	0	0	0	0	109.2	W298 V302 K317 R330 F331	W298-V319 HydrophobicContact CZ2-CB 4.34Å; W298-V319 HydrophobicContact CZ2-CG1 3.95Å; V302-V319 HydrophobicContact CG1-CB 4.49Å; V302-V319 HydrophobicContact CG1-CG1 4.08Å; K317-V319 PolarHBondContact O-N 3.22Å; V319-R330 CarbonylContact O-C 3.57Å; V319-R330 WeakPolarHBondContact O-CA 3.49Å; V319-F331 PolarHBondContact N-O 2.73Å; V319-F331 PolarHBondContact O-N 3.31Å
320	S	81.2	Confident	76.6	Confident	35 Å²	35	90.5 Å²	90.5	25%	0.245	45%	0.454	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	134.7	174	-177.8	0	0	0	0	110.6	S322 S329	S320-S322 VanDerWaalsContact C-N 3.28Å; S320-S322 PolarHBondContact OG-N 3.29Å; S320-S322 PolarHBondContact OG-O 2.98Å; S320-S329 WeakPolarHBondContact CA-O 3.45Å
321	S	72.4	Confident	76.2	Confident	12 Å²	12	88.5 Å²	88.5	8%	0.084	45%	0.447	C	S	.	.	S	Bend	trans	-65.8	-32.6	173.6	69.7	0	0	0	0	112	S329	S321-S329 PolarHBondContact N-O 3.07Å; S321-S329 PolarHBondContact OG-N 2.83Å; S321-S329 PolarHBondContact OG-O 3.16Å
322	S	65.4	Low	76	Confident	41 Å²	41	96.1 Å²	96.1	29%	0.287	47%	0.467	S	S	.	.			trans	-117.7	152.3	-174.4	-51.5	0	0	0	0	112.1	S320 K327 G328	S320-S322 VanDerWaalsContact C-N 3.28Å; S320-S322 PolarHBondContact OG-N 3.29Å; S320-S322 PolarHBondContact OG-O 2.98Å; S322-K327 PolarHBondContact OG-O 3.42Å; S322-G328 WeakPolarHBondContact OG-CA 3.42Å
323	K	57.6	Low	75.8	Confident	180 Å²	180	91.8 Å²	91.8	78%	0.783	45%	0.448	S	S	*	.	S	Bend	trans	-84.5	-13.3	173.2	-72.1	-172.8	177.8	-176.5	0	113.5
324	I	49.9	Very low	75.6	Confident	129 Å²	129	92.7 Å²	92.7	66%	0.662	45%	0.454	S	S	*	.	S	Bend	trans	-88.2	129.2	-178.5	-54.8	173.5	0	0	0	108.8	F326	I324-F326 PolarHBondContact O-N 3.42Å
325	F	47.3	Very low	75.6	Confident	152 Å²	152	89.7 Å²	89.7	67%	0.667	44%	0.439	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63	-2.9	-163.2	-85.8	-87.6	0	0	0	117.3	R330	F325-R330 PolarHBondContact O-NH2 2.74Å
326	F	50	Low	75.8	Confident	157 Å²	157	88.8 Å²	88.8	69%	0.689	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	-143.3	2.4	-174.9	-60.9	-79	0	0	0	116	I324 W580	I324-F326 PolarHBondContact O-N 3.42Å; F326-W580 HydrophobicContact CE2-CZ2 4.44Å; F326-W580 AromaticContact CE2-NE1 3.81Å
327	K	57.1	Low	76.1	Confident	185 Å²	185	87.3 Å²	87.3	80%	0.804	43%	0.426	S	S	*	.	S	Bend	trans	-127.5	39.3	-174.3	-155.8	175.6	-177.9	176.1	0	113.6	S322	S322-K327 PolarHBondContact OG-O 3.42Å
328	G	62.5	Low	76.5	Confident	27 Å²	27	79.8 Å²	79.8	28%	0.278	40%	0.397	S	S	.	.	S	Bend	trans	-138.3	144.8	-174.5	0	0	0	0	0	113.3	S322 R330	S322-G328 WeakPolarHBondContact OG-CA 3.42Å; G328-R330 PolarHBondContact O-N 3.46Å
329	S	76.1	Confident	76.9	Confident	28 Å²	28	82 Å²	82	20%	0.196	40%	0.4	C	S	.	.			trans	-67.8	129.7	169.6	-71.2	0	0	0	0	109.5	K295 W298 S320 S321	K295-S329 WeakPolarHBondContact CE-OG 3.33Å; W298-S329 WeakPolarHBondContact CH2-O 3.47Å; S320-S329 WeakPolarHBondContact CA-O 3.45Å; S321-S329 PolarHBondContact N-O 3.07Å; S321-S329 PolarHBondContact OG-N 2.83Å; S321-S329 PolarHBondContact OG-O 3.16Å
330	R	83.4	Confident	77.4	Confident	152 Å²	152	81.9 Å²	81.9	57%	0.574	40%	0.397	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-109	139.7	174.9	-65.8	177.5	-179.7	151.3	1.4	109.7	T318 V319 F325 G328	T318-R330 HydrophobicContact CG2-CB 4.14Å; V319-R330 CarbonylContact O-C 3.57Å; V319-R330 WeakPolarHBondContact O-CA 3.49Å; F325-R330 PolarHBondContact O-NH2 2.74Å; G328-R330 PolarHBondContact O-N 3.46Å
331	F	86.5	Confident	78.1	Confident	28 Å²	28	80.4 Å²	80.4	12%	0.123	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	128.8	174.9	-175.6	-92.3	0	0	0	109.9	W298 K299 V302 E303 T318 V319 Y333	W298-F331 HydrophobicContact CH2-CB 3.64Å; W298-F331 HydrophobicContact CZ2-CB 4.44Å; W298-F331 HydrophobicContact CZ3-CB 3.95Å; K299-F331 HydrophobicContact CB-CD2 4.5Å; K299-F331 HydrophobicContact CG-CD2 4.15Å; V302-F331 HydrophobicContact CB-CD1 4.44Å; V302-F331 HydrophobicContact CG2-CB 4Å; V302-F331 HydrophobicContact CG2-CD1 3.49Å; V302-F331 VanDerWaalsContact CG2-CD1 3.49Å; V302-F331 HydrophobicContact CG2-CD2 4.31Å; V302-F331 HydrophobicContact CG2-CE1 4.01Å; V302-F331 HydrophobicContact CG2-CG 3.66Å; E303-F331 HydrophobicContact CB-CE1 4.09Å; E303-F331 HydrophobicContact CB-CZ 3.82Å; E303-F331 HydrophobicContact CG-CZ 4.1Å; T318-F331 WeakPolarHBondContact CA-O 3.42Å; T318-F331 WeakPolarHBondContact CG2-O 3.34Å; V319-F331 PolarHBondContact N-O 2.73Å; V319-F331 PolarHBondContact O-N 3.31Å; F331-Y333 HydrophobicContact CE1-CD2 4.45Å
332	R	88.8	Confident	79.2	Confident	200 Å²	200	82 Å²	82	76%	0.755	40%	0.395	S	S	*	.			trans	-114.7	117.6	174	-177.5	174.7	-177.8	152.1	1.5	108.4
333	Y	91	Very high	80.6	Confident	27 Å²	27	85 Å²	85	11%	0.106	41%	0.405	C	S	.	.			trans	-65	143.2	174.9	-175.7	-103.7	0	0	0	111.1	E303 A306 F307 I316 F331 G335 K336 V337	E303-Y333 HydrophobicContact CG-CD2 4.22Å; E303-Y333 HydrophobicContact CG-CE2 4.12Å; A306-Y333 HydrophobicContact CB-CD1 4.26Å; A306-Y333 HydrophobicContact CB-CD2 3.33Å; A306-Y333 HydrophobicContact CB-CE2 3.73Å; A306-Y333 HydrophobicContact CB-CG 3.61Å; F307-Y333 HydrophobicContact CB-CE2 4.47Å; F307-Y333 WeakPolarHBondContact CD2-OH 3.32Å; I316-Y333 HydrophobicContact CD1-CD1 3.36Å; I316-Y333 HydrophobicContact CD1-CE1 3.82Å; I316-Y333 HydrophobicContact CD1-CG 3.9Å; F331-Y333 HydrophobicContact CE1-CD2 4.45Å; Y333-G335 VanDerWaalsContact CE1-O 3.3Å; Y333-G335 WeakPolarHBondContact CE1-O 3.41Å; Y333-K336 PolarHBondContact OH-O 2.94Å; Y333-V337 HydrophobicContact CE1-CG1 4.12Å
334	S	87.6	Confident	82.4	Confident	63 Å²	63	78.1 Å²	78.1	44%	0.441	38%	0.382	S	S	.	.			trans	-140.7	127.3	178.2	-172.4	0	0	0	0	108.8	N90	N90-S334 PolarHBondContact ND2-OG 2.66Å
335	G	91	Very high	84.5	Confident	39 Å²	39	72 Å²	72	40%	0.402	35%	0.351	S	S	.	.	S	Bend	trans	123.9	-179.8	-175.7	0	0	0	0	0	112.3	S313 Y333	S313-G335 WeakPolarHBondContact CB-O 3.32Å; Y333-G335 VanDerWaalsContact CE1-O 3.3Å; Y333-G335 WeakPolarHBondContact CE1-O 3.41Å
336	K	94.9	Very high	86.6	Confident	80 Å²	80	68.3 Å²	68.3	35%	0.348	34%	0.344	S	S	.	.			trans	-83	152.9	174	-66.8	-179.8	-166.7	157.6	0	110.8	D71 F307 Y333 E340 V341	D71-K336 PolarHBondContact OD1-N 3.46Å; D71-K336 IonicContact OD2-NZ 2.84Å; F307-K336 WeakPolarHBondContact CD2-O 3.47Å; Y333-K336 PolarHBondContact OH-O 2.94Å; K336-E340 WeakPolarHBondContact CA-OE2 3.2Å; K336-E340 HydrophobicContact CB-CB 3.98Å; K336-E340 HydrophobicContact CD-CB 4.44Å; K336-E340 HydrophobicContact CG-CB 4.36Å; K336-V341 HydrophobicContact CB-CG2 3.68Å; K336-V341 HydrophobicContact CD-CG2 4.48Å
337	V	96.9	Very high	88.7	Confident	0 Å²	0	66.9 Å²	66.9	0%	0	34%	0.337	C	S	.	.			trans	-85.9	162	169	-59.1	0	0	0	0	110.8	A306 I316 Y333 K339 E340 V341	A306-V337 WeakPolarHBondContact O-CG1 3.42Å; I316-V337 HydrophobicContact CD1-CG1 3.55Å; Y333-V337 HydrophobicContact CE1-CG1 4.12Å; V337-K339 PolarHBondContact O-N 3.16Å; V337-E340 HydrophobicContact CG2-CB 4.2Å; V337-E340 HydrophobicContact CG2-CG 3.76Å; V337-E340 PolarHBondContact N-OE2 3.31Å; V337-E340 WeakPolarHBondContact O-CA 3.47Å; V337-E340 WeakPolarHBondContact O-CB 3.4Å; V337-E340 PolarHBondContact O-N 3.42Å; V337-V341 WeakPolarHBondContact O-CG2 3.41Å; V337-V341 PolarHBondContact O-N 2.81Å
338	A	95.7	Very high	90.5	Very high	20 Å²	20	59.1 Å²	59.1	17%	0.165	30%	0.304	C	S	.	.	H	α-helix	trans	-49.1	-41.9	-175.5	0	0	0	0	0	113.4	F307 Y308 V341 V342	F307-A338 HydrophobicContact CD1-CB 3.86Å; F307-A338 HydrophobicContact CE1-CB 3.55Å; F307-A338 HydrophobicContact CZ-CB 3.99Å; F307-A338 VanDerWaalsContact O-CB 3.28Å; F307-A338 WeakPolarHBondContact O-CB 3.39Å; F307-A338 PolarHBondContact O-N 3.16Å; Y308-A338 HydrophobicContact CD1-CB 4.2Å; A338-V341 PolarHBondContact O-N 2.88Å; A338-V342 WeakPolarHBondContact O-CG2 3.45Å; A338-V342 PolarHBondContact O-N 3.12Å
339	K	94.8	Very high	91.9	Very high	127 Å²	127	67 Å²	67	55%	0.552	33%	0.334	S	S	*	.	H	α-helix	trans	-66	-40.6	178.4	-60.4	-162.5	-167.5	175.5	0	112.8	A311 V337 V341 V342 E343	A311-K339 HydrophobicContact CB-CD 4.29Å; V337-K339 PolarHBondContact O-N 3.16Å; K339-V341 VanDerWaalsContact C-N 3.33Å; K339-V342 PolarHBondContact O-N 3.03Å; K339-E343 WeakPolarHBondContact O-CB 3.49Å; K339-E343 PolarHBondContact O-N 3.11Å
340	E	96.3	Very high	92.7	Very high	38 Å²	38	69.6 Å²	69.6	18%	0.178	34%	0.339	C	S	.	.	H	α-helix	trans	-68.2	-34.8	176.1	-68.5	172.9	159.2	0	0	111.4	K312 S313 K336 V337 E343 A344	K312-E340 VanDerWaalsContact CA-OE1 3.26Å; K312-E340 WeakPolarHBondContact CA-OE1 3.38Å; K312-E340 WeakPolarHBondContact CB-OE1 3.31Å; S313-E340 VanDerWaalsContact CB-OE2 3.29Å; S313-E340 WeakPolarHBondContact CB-OE2 3.16Å; S313-E340 PolarHBondContact N-OE1 2.99Å; S313-E340 PolarHBondContact N-OE2 3.48Å; S313-E340 PolarHBondContact OG-OE1 2.86Å; S313-E340 VanDerWaalsContact OG-OE1 3.13Å; S313-E340 PolarHBondContact OG-OE2 2.63Å; K336-E340 WeakPolarHBondContact CA-OE2 3.2Å; K336-E340 HydrophobicContact CB-CB 3.98Å; K336-E340 HydrophobicContact CD-CB 4.44Å; K336-E340 HydrophobicContact CG-CB 4.36Å; V337-E340 HydrophobicContact CG2-CB 4.2Å; V337-E340 HydrophobicContact CG2-CG 3.76Å; V337-E340 PolarHBondContact N-OE2 3.31Å; V337-E340 WeakPolarHBondContact O-CA 3.47Å; V337-E340 WeakPolarHBondContact O-CB 3.4Å; V337-E340 PolarHBondContact O-N 3.42Å; E340-E343 PolarHBondContact O-N 3.43Å; E340-A344 VanDerWaalsContact O-CB 3.26Å; E340-A344 WeakPolarHBondContact O-CB 3.44Å; E340-A344 PolarHBondContact O-N 3.42Å
341	V	95.8	Very high	92.9	Very high	3 Å²	3	69.2 Å²	69.2	2%	0.018	35%	0.349	C	S	.	.	H	α-helix	trans	-64.7	-48.6	174.9	179.3	0	0	0	0	110.5	D71 Y72 F307 K336 V337 A338 K339 E343 A344 S345	D71-V341 HydrophobicContact CB-CG1 4.23Å; D71-V341 HydrophobicContact CB-CG2 3.41Å; D71-V341 VanDerWaalsContact CB-CG2 3.41Å; Y72-V341 HydrophobicContact CD2-CG1 4.19Å; Y72-V341 HydrophobicContact CE1-CG1 4.17Å; Y72-V341 HydrophobicContact CE2-CG1 3.55Å; F307-V341 HydrophobicContact CE2-CG2 4.03Å; F307-V341 HydrophobicContact CZ-CG2 4.37Å; K336-V341 HydrophobicContact CB-CG2 3.68Å; K336-V341 HydrophobicContact CD-CG2 4.48Å; V337-V341 WeakPolarHBondContact O-CG2 3.41Å; V337-V341 PolarHBondContact O-N 2.81Å; A338-V341 PolarHBondContact O-N 2.88Å; K339-V341 VanDerWaalsContact C-N 3.33Å; V341-E343 VanDerWaalsContact C-N 3.34Å; V341-E343 PolarHBondContact O-N 3.01Å; V341-A344 PolarHBondContact O-N 3.09Å; V341-S345 WeakPolarHBondContact O-CB 3.35Å; V341-S345 PolarHBondContact O-N 3.06Å
342	V	94.9	Very high	92.8	Very high	46 Å²	46	71.8 Å²	71.8	28%	0.279	37%	0.368	S	S	.	.	H	α-helix	trans	-61.8	-41.9	176.4	171.3	0	0	0	0	111.4	K118 A338 K339 S345 S346	K118-V342 HydrophobicContact CB-CG1 4.33Å; K118-V342 HydrophobicContact CD-CG1 4.18Å; A338-V342 WeakPolarHBondContact O-CG2 3.45Å; A338-V342 PolarHBondContact O-N 3.12Å; K339-V342 PolarHBondContact O-N 3.03Å; V342-S345 PolarHBondContact O-N 3.42Å; V342-S346 PolarHBondContact O-N 2.82Å
343	E	94.7	Very high	92.7	Very high	103 Å²	103	63.6 Å²	63.6	48%	0.481	34%	0.341	S	S	.	.	H	α-helix	trans	-65.2	-38.9	176.4	-170.9	-172	161.1	0	0	112.2	K339 E340 V341 S346 K347	K339-E343 WeakPolarHBondContact O-CB 3.49Å; K339-E343 PolarHBondContact O-N 3.11Å; E340-E343 PolarHBondContact O-N 3.43Å; V341-E343 VanDerWaalsContact C-N 3.34Å; V341-E343 PolarHBondContact O-N 3.01Å; E343-S346 PolarHBondContact O-OG 3.23Å; E343-K347 WeakPolarHBondContact O-CG 3.3Å; E343-K347 IonicContact OE1-NZ 2.69Å; E343-K347 PolarHBondContact OE1-NZ 2.7Å
344	A	94.3	Very high	92.4	Very high	36 Å²	36	69.9 Å²	69.9	30%	0.298	37%	0.371	S	S	.	.	H	α-helix	trans	-68	-40.2	174.9	0	0	0	0	0	111.5	E340 V341 K347	E340-A344 VanDerWaalsContact O-CB 3.26Å; E340-A344 WeakPolarHBondContact O-CB 3.44Å; E340-A344 PolarHBondContact O-N 3.42Å; V341-A344 PolarHBondContact O-N 3.09Å; A344-K347 PolarHBondContact O-N 3.36Å
345	S	94.1	Very high	92.5	Very high	2 Å²	2	67.6 Å²	67.6	1%	0.014	35%	0.354	C	S	.	.	H	α-helix	trans	-60.9	-45.8	177.9	178.4	0	0	0	0	111.8	E69 K120 V341 V342 K347 I348	E69-S345 VanDerWaalsContact OE1-CB 3.25Å; E69-S345 WeakPolarHBondContact OE1-CB 3.38Å; E69-S345 PolarHBondContact OE1-OG 3.11Å; K120-S345 WeakPolarHBondContact CB-OG 3.34Å; K120-S345 WeakPolarHBondContact CD-O 3.46Å; K120-S345 PolarHBondContact N-OG 2.93Å; V341-S345 WeakPolarHBondContact O-CB 3.35Å; V341-S345 PolarHBondContact O-N 3.06Å; V342-S345 PolarHBondContact O-N 3.42Å; S345-K347 PolarHBondContact O-N 2.93Å; S345-K347 VanDerWaalsContact O-N 3.13Å; S345-I348 WeakPolarHBondContact O-CB 3.23Å; S345-I348 WeakPolarHBondContact O-CG1 3.48Å; S345-I348 PolarHBondContact O-N 3.37Å; S345-I348 VanDerWaalsContact O-N 3.09Å
346	S	93.1	Very high	92.3	Very high	74 Å²	74	72.8 Å²	72.8	52%	0.517	37%	0.368	S	S	.	.	H	α-helix	trans	-60.5	-29.3	-179.9	72	0	0	0	0	113.2	K120 V342 E343	K120-S346 PolarHBondContact NZ-O 2.74Å; V342-S346 PolarHBondContact O-N 2.82Å; E343-S346 PolarHBondContact O-OG 3.23Å
347	K	94.3	Very high	91.8	Very high	127 Å²	127	72.6 Å²	72.6	55%	0.552	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.1	-2.9	-179.9	-65.6	173.4	-170.9	172.9	0	114.8	E343 A344 S345 Q349	E343-K347 WeakPolarHBondContact O-CG 3.3Å; E343-K347 IonicContact OE1-NZ 2.69Å; E343-K347 PolarHBondContact OE1-NZ 2.7Å; A344-K347 PolarHBondContact O-N 3.36Å; S345-K347 PolarHBondContact O-N 2.93Å; S345-K347 VanDerWaalsContact O-N 3.13Å; K347-Q349 PolarHBondContact O-N 3.22Å
348	I	94.3	Very high	90.4	Very high	21 Å²	21	75.3 Å²	75.3	11%	0.108	39%	0.387	C	S	.	.			trans	-63.3	122.2	179	-64.7	168.9	0	0	0	109.6	L68 E69 K120 E121 S345 R350	L68-I348 HydrophobicContact CB-CD1 3.99Å; L68-I348 HydrophobicContact CD1-CB 4.46Å; L68-I348 HydrophobicContact CD1-CD1 4.07Å; L68-I348 HydrophobicContact CD1-CG1 4Å; L68-I348 HydrophobicContact CD1-CG2 3.69Å; E69-I348 HydrophobicContact CG-CD1 3.97Å; K120-I348 HydrophobicContact CD-CB 4.16Å; K120-I348 VanDerWaalsContact CE-O 3.29Å; K120-I348 WeakPolarHBondContact CE-O 3.27Å; K120-I348 PolarHBondContact NZ-O 3.05Å; E121-I348 HydrophobicContact CG-CD1 3.84Å; S345-I348 WeakPolarHBondContact O-CB 3.23Å; S345-I348 WeakPolarHBondContact O-CG1 3.48Å; S345-I348 PolarHBondContact O-N 3.37Å; S345-I348 VanDerWaalsContact O-N 3.09Å; I348-R350 HydrophobicContact CG2-CG 3.78Å
349	Q	90.9	Very high	88.5	Confident	194 Å²	194	79 Å²	79	91%	0.907	40%	0.404	S	S	*	.			trans	-122.9	59.1	179.9	-67.4	-178.8	10.3	0	0	110.2	K347	K347-Q349 PolarHBondContact O-N 3.22Å
350	R	93.7	Very high	86.5	Confident	82 Å²	82	76 Å²	76	31%	0.309	39%	0.394	S	S	.	.	S	Bend	trans	-132.8	160.3	171.7	68.1	167.3	-173.4	150.2	-7.4	109.8	S66 L68 E121 I348	S66-R350 PolarHBondContact O-NH2 2.96Å; S66-R350 PolarHBondContact OG-NH1 3.1Å; L68-R350 HydrophobicContact CD1-CG 4.25Å; L68-R350 VanDerWaalsContact CD1-NE 3.3Å; E121-R350 VanDerWaalsContact CD-NH2 3.27Å; E121-R350 IonicContact OE1-CZ 2.76Å; E121-R350 IonicContact OE1-NE 3.79Å; E121-R350 PolarHBondContact OE1-NE 2.86Å; E121-R350 IonicContact OE1-NH2 3.19Å; E121-R350 PolarHBondContact OE1-NH2 2.65Å; E121-R350 IonicContact OE2-NH2 2.9Å; E121-R350 PolarHBondContact OE2-NH2 2.96Å; I348-R350 HydrophobicContact CG2-CG 3.78Å
351	D	87.2	Confident	83.9	Confident	144 Å²	144	79.7 Å²	79.7	77%	0.77	42%	0.419	S	S	*	.	P	Polyproline II helix	trans	-64.3	134.7	165.9	-61.4	-45.5	0	0	0	109.3
352	P	83.9	Confident	81.1	Confident	81 Å²	81	88.1 Å²	88.1	53%	0.526	46%	0.458	S	S	.	.	P	Polyproline II helix	trans	-56.2	137.2	176.7	-25	34.2	0	0	0	110.9
353	P	88.2	Confident	78.4	Confident	29 Å²	29	88.2 Å²	88.2	19%	0.188	46%	0.46	C	S	.	.	P	Polyproline II helix	trans	-66	149.1	174.7	30.1	-34.1	0	0	0	110	L123 V355	L123-P353 HydrophobicContact CB-CG 3.93Å; L123-P353 HydrophobicContact CD2-CG 3.69Å; L123-P353 HydrophobicContact CG-CG 4.44Å; P353-V355 PolarHBondContact O-N 3.13Å
354	E	84.9	Confident	75.7	Confident	159 Å²	159	95.1 Å²	95.1	74%	0.743	48%	0.482	S	S	*	.	P	Polyproline II helix	trans	-66.1	126.3	177.7	-171.7	172.8	-174	0	0	111	H356	E354-H356 PolarHBondContact O-N 3.31Å; E354-H356 PolarHBondContact O-ND1 2.91Å
355	V	89.5	Confident	72.9	Confident	14 Å²	14	95.5 Å²	95.5	9%	0.085	48%	0.483	C	S	.	.			trans	-88.1	106	178.7	-179.6	0	0	0	0	108.9	E122 L123 Y126 P353 R357	E122-V355 HydrophobicContact CB-CG2 4.37Å; E122-V355 HydrophobicContact CG-CG2 4.08Å; L123-V355 HydrophobicContact CB-CG2 4.17Å; L123-V355 HydrophobicContact CD1-CG2 4.48Å; Y126-V355 HydrophobicContact CD1-CG1 3.31Å; Y126-V355 HydrophobicContact CD2-CG1 3.97Å; Y126-V355 HydrophobicContact CE1-CG1 3.79Å; Y126-V355 HydrophobicContact CE2-CG1 4.4Å; Y126-V355 HydrophobicContact CG-CG1 3.4Å; P353-V355 PolarHBondContact O-N 3.13Å; V355-R357 HydrophobicContact CG1-CG 4.12Å; V355-R357 PolarHBondContact O-N 3.29Å
356	H	85.3	Confident	70.3	Confident	148 Å²	148	98.9 Å²	98.9	69%	0.685	51%	0.507	S	S	*	.			trans	-77.9	99.4	173.9	-63.7	81.2	0	0	0	109.2	E354 A358	E354-H356 PolarHBondContact O-N 3.31Å; E354-H356 PolarHBondContact O-ND1 2.91Å; H356-A358 PolarHBondContact O-N 3.16Å
357	R	86.4	Confident	67.6	Low	77 Å²	77	103.9 Å²	103.9	29%	0.291	52%	0.521	S	S	.	.			trans	-81.6	113.1	176.2	-63.1	177.6	173.6	78.3	5.1	108.8	E122 Y126 E207 V355	E122-R357 IonicContact OE1-CZ 2.77Å; E122-R357 IonicContact OE1-NH1 3.71Å; E122-R357 IonicContact OE1-NH2 2.66Å; E122-R357 PolarHBondContact OE1-NH2 3.21Å; Y126-R357 HydrophobicContact CE2-CG 3.91Å; E207-R357 WeakPolarHBondContact OE1-CD 3.49Å; E207-R357 IonicContact OE1-CZ 2.89Å; E207-R357 IonicContact OE1-NE 3.48Å; E207-R357 PolarHBondContact OE1-NE 3.13Å; E207-R357 IonicContact OE1-NH2 3.31Å; E207-R357 IonicContact OE2-CZ 3.49Å; E207-R357 IonicContact OE2-NE 3.3Å; E207-R357 IonicContact OE2-NH2 3.07Å; E207-R357 PolarHBondContact OE2-NH2 3.12Å; V355-R357 HydrophobicContact CG1-CG 4.12Å; V355-R357 PolarHBondContact O-N 3.29Å
358	A	66.4	Low	64.5	Low	56 Å²	56	102.8 Å²	102.8	46%	0.463	53%	0.529	S	S	.	.			trans	-82	115.3	171.7	0	0	0	0	0	108.9	H356 I360	H356-A358 PolarHBondContact O-N 3.16Å; A358-I360 PolarHBondContact O-N 2.68Å
359	N	55.8	Low	61.9	Low	99 Å²	99	104.8 Å²	104.8	53%	0.529	54%	0.54	S	S	.	.			trans	-66.2	120.9	173.5	-68	-12.7	0	0	0	109	T361	N359-T361 PolarHBondContact O-N 3.4Å; N359-T361 VanDerWaalsContact O-N 3.11Å
360	I	51.7	Low	59.1	Low	63 Å²	63	100.8 Å²	100.8	32%	0.323	53%	0.525	S	S	.	.	G	3₁₀ helix	trans	-70.5	-5.6	-173.5	-73.6	-175	0	0	0	113.2	E159 A358 Q362 S363	E159-I360 PolarHBondContact OE2-N 3.18Å; A358-I360 PolarHBondContact O-N 2.68Å; I360-Q362 PolarHBondContact O-N 2.94Å; I360-S363 PolarHBondContact O-N 3.14Å
361	T	42.2	Very low	56.3	Low	115 Å²	115	106.5 Å²	106.5	71%	0.706	55%	0.552	S	S	*	*	G	3₁₀ helix	trans	-56.4	-15	175.6	43.3	0	0	0	0	114.2	N359	N359-T361 PolarHBondContact O-N 3.4Å; N359-T361 VanDerWaalsContact O-N 3.11Å
362	Q	38.2	Very low	53.8	Low	181 Å²	181	105.8 Å²	105.8	85%	0.846	54%	0.544	S	S	*	.	G	3₁₀ helix	trans	-101.9	-10.4	171.9	-68.5	-175.1	-8.3	0	0	115.4	I360 R364	I360-Q362 PolarHBondContact O-N 2.94Å; Q362-R364 VanDerWaalsContact C-N 3.33Å; Q362-R364 PolarHBondContact O-N 2.86Å; Q362-R364 VanDerWaalsContact O-N 3.07Å
363	S	36.9	Very low	51.7	Low	47 Å²	47	105.9 Å²	105.9	33%	0.329	54%	0.54	S	S	.	.			trans	-88.8	71.7	178.6	-160.2	0	0	0	0	111	I360 S365	I360-S363 PolarHBondContact O-N 3.14Å; S363-S365 PolarHBondContact O-N 3.29Å; S363-S365 PolarHBondContact OG-OG 3.21Å
364	R	38.8	Very low	49.7	Very low	248 Å²	248	106.3 Å²	106.3	94%	0.936	54%	0.54	S	S	*	.			trans	-68.1	52.1	161.1	-78.6	-173.9	156.1	-171.9	-4.6	111.6	Q362	Q362-R364 VanDerWaalsContact C-N 3.33Å; Q362-R364 PolarHBondContact O-N 2.86Å; Q362-R364 VanDerWaalsContact O-N 3.07Å
365	S	35.9	Very low	47.4	Very low	44 Å²	44	102.6 Å²	102.6	31%	0.308	52%	0.524	S	S	.	.			trans	-114.4	11.7	176.9	69.9	0	0	0	0	114.1	S363 H367 S368	S363-S365 PolarHBondContact O-N 3.29Å; S363-S365 PolarHBondContact OG-OG 3.21Å; S365-H367 PolarHBondContact O-N 3.21Å; S365-H367 VanDerWaalsContact O-N 3.12Å; S365-S368 PolarHBondContact O-N 3.27Å
366	S	39.1	Very low	44.6	Very low	74 Å²	74	108.4 Å²	108.4	52%	0.517	56%	0.555	S	S	.	*	T	Hydrogen-bonded Turn	trans	-70.1	0.8	175.5	-45.7	0	0	0	0	115.1
367	H	36.4	Very low	42.2	Very low	178 Å²	178	106.5 Å²	106.5	82%	0.824	55%	0.548	S	S	*	.	T	Hydrogen-bonded Turn	trans	-113.6	-4.4	176.1	-65.2	-48.8	0	0	0	115.3	S365	S365-H367 PolarHBondContact O-N 3.21Å; S365-H367 VanDerWaalsContact O-N 3.12Å
368	S	29.4	Very low	39.4	Very low	104 Å²	104	111 Å²	111	73%	0.727	57%	0.572	S	S	*	*			trans	-98.2	-5.1	-175.8	-173.8	0	0	0	0	114.7	S365 N370	S365-S368 PolarHBondContact O-N 3.27Å; S368-N370 PolarHBondContact O-N 3.18Å; S368-N370 VanDerWaalsContact O-N 3.15Å
369	L	38.5	Very low	37.6	Very low	64 Å²	64	113.9 Å²	113.9	34%	0.335	59%	0.586	S	S	.	*	S	Bend	trans	-80.9	99.1	169.5	-78	166.5	0	0	0	108.2	K371 I374	L369-K371 PolarHBondContact O-N 3.47Å; L369-I374 HydrophobicContact CB-CD1 4.35Å; L369-I374 HydrophobicContact CD1-CD1 3.52Å; L369-I374 HydrophobicContact CD2-CD1 3.7Å; L369-I374 HydrophobicContact CG-CD1 4.04Å
370	N	32.5	Very low	36.5	Very low	109 Å²	109	116 Å²	116	58%	0.583	60%	0.597	S	S	*	*			trans	-34.3	118.7	157.2	-101.8	-38.7	0	0	0	108.8	S368 Q372 L373	S368-N370 PolarHBondContact O-N 3.18Å; S368-N370 VanDerWaalsContact O-N 3.15Å; N370-Q372 HydrophobicContact CB-CB 4.38Å; N370-Q372 PolarHBondContact O-N 2.83Å; N370-L373 PolarHBondContact O-N 3.16Å
371	K	36.1	Very low	35.3	Very low	202 Å²	202	119.9 Å²	119.9	88%	0.878	61%	0.613	S	S	*	*	T	Hydrogen-bonded Turn	trans	-47.6	-18	172.4	-71.1	178.6	176	-179.8	0	112.4	L369	L369-K371 PolarHBondContact O-N 3.47Å
372	Q	34.1	Very low	34.7	Very low	130 Å²	130	120.4 Å²	120.4	61%	0.607	62%	0.619	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75	-11.3	-179.6	-79.5	149.1	-16.1	0	0	118.1	N370	N370-Q372 HydrophobicContact CB-CB 4.38Å; N370-Q372 PolarHBondContact O-N 2.83Å
373	L	38.5	Very low	34.2	Very low	82 Å²	82	120.1 Å²	120.1	43%	0.429	62%	0.622	S	S	.	*	T	Hydrogen-bonded Turn	trans	-106.1	-11.5	-179.3	-73.2	175.4	0	0	0	114.8	V78 K82 N370	V78-L373 HydrophobicContact CG1-CD2 4.27Å; K82-L373 HydrophobicContact CD-CD2 4.44Å; N370-L373 PolarHBondContact O-N 3.16Å
374	I	47	Very low	34	Very low	39 Å²	39	125.6 Å²	125.6	20%	0.2	65%	0.647	C	S	.	*	T	Hydrogen-bonded Turn	trans	-124.1	-19.4	-162.9	-62	-178.1	0	0	0	114.9	R84 L369	R84-I374 VanDerWaalsContact NH2-C 3.27Å; R84-I374 PolarHBondContact NH2-O 3.11Å; L369-I374 HydrophobicContact CB-CD1 4.35Å; L369-I374 HydrophobicContact CD1-CD1 3.52Å; L369-I374 HydrophobicContact CD2-CD1 3.7Å; L369-I374 HydrophobicContact CG-CD1 4.04Å
375	I	36.2	Very low	33.5	Very low	80 Å²	80	119.7 Å²	119.7	41%	0.41	64%	0.641	S	S	.	*			trans	-151.7	106.8	175.4	-57.6	-179.3	0	0	0	110.7	H138 M377	H138-I375 HydrophobicContact CB-CD1 4.19Å; I375-M377 HydrophobicContact CG2-CB 3.49Å; I375-M377 VanDerWaalsContact CG2-CB 3.49Å; I375-M377 HydrophobicContact CG2-CG 3.91Å; I375-M377 PolarHBondContact O-N 3.48Å
376	N	31.8	Very low	33	Very low	136 Å²	136	122.9 Å²	122.9	73%	0.727	66%	0.663	S	S	*	*			trans	-78.5	84.1	151.2	-78.9	5.3	0	0	0	106.6
377	M	34.8	Very low	32.7	Very low	108 Å²	108	125.4 Å²	125.4	53%	0.532	68%	0.678	S	S	.	*			trans	-140.8	87.3	158.9	-76.4	-73.2	89.4	0	0	106.3	F236 I375	F236-M377 HydrophobicContact CE1-CE 3.39Å; F236-M377 HydrophobicContact CE1-SD 3.92Å; F236-M377 HydrophobicContact CE2-SD 4.4Å; F236-M377 HydrophobicContact CZ-CE 3.35Å; F236-M377 HydrophobicContact CZ-SD 3.55Å; F236-M377 VanDerWaalsContact CZ-SD 3.55Å; I375-M377 HydrophobicContact CG2-CB 3.49Å; I375-M377 VanDerWaalsContact CG2-CB 3.49Å; I375-M377 HydrophobicContact CG2-CG 3.91Å; I375-M377 PolarHBondContact O-N 3.48Å
378	E	27.2	Very low	32.4	Very low	172 Å²	172	124.2 Å²	124.2	80%	0.804	68%	0.676	S	S	*	*	P	Polyproline II helix	trans	-69.6	127.4	153.9	-164.8	157.8	-151	0	0	107.2	L380	E378-L380 PolarHBondContact O-N 3.36Å
379	P	29.1	Very low	32.4	Very low	117 Å²	117	128.5 Å²	128.5	76%	0.76	68%	0.684	S	S	*	*	P	Polyproline II helix	trans	-65.4	122.1	177.5	-15	28.4	0	0	0	109.7
380	L	32.2	Very low	31.8	Very low	143 Å²	143	133.7 Å²	133.7	75%	0.749	71%	0.707	S	S	*	*	P	Polyproline II helix	trans	-68.9	132.1	176.4	-69.8	168.9	0	0	0	110.9	E378	E378-L380 PolarHBondContact O-N 3.36Å
381	Q	27.1	Very low	31.7	Very low	144 Å²	144	138.1 Å²	138.1	67%	0.673	72%	0.724	S	S	*	*	P	Polyproline II helix	trans	-62.8	141.7	171.1	-66.7	175.1	-13.1	0	0	111.4	I461	Q381-I461 VanDerWaalsContact CD-CD1 3.48Å
382	P	28.8	Very low	31.2	Very low	127 Å²	127	137.6 Å²	137.6	83%	0.825	73%	0.725	S	S	*	*	P	Polyproline II helix	trans	-77.6	135	172	-11.4	27.4	0	0	0	112.4
383	L	28.2	Very low	31	Very low	175 Å²	175	140.2 Å²	140.2	92%	0.916	74%	0.737	S	S	*	*	P	Polyproline II helix	trans	-68	139.3	165.2	-73.7	162.8	0	0	0	110.6
384	L	31.4	Very low	30.5	Very low	161 Å²	161	142.5 Å²	142.5	84%	0.843	75%	0.754	S	S	*	*	P	Polyproline II helix	trans	-61.1	146.6	173.4	-69.7	165.7	0	0	0	111.8
385	P	29.2	Very low	29.7	Very low	124 Å²	124	146.4 Å²	146.4	81%	0.805	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-77.6	126.2	173.7	29	-30	0	0	0	111.7
386	S	25.6	Very low	29.3	Very low	111 Å²	111	149.2 Å²	149.2	78%	0.776	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-78.4	153.7	167.2	-47.2	0	0	0	0	111.2
387	P	33.5	Very low	29	Very low	127 Å²	127	148 Å²	148	83%	0.825	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-82.1	158.2	-159.2	32.2	-34.2	0	0	0	115.2
388	I	29.2	Very low	28.6	Very low	154 Å²	154	152 Å²	152	79%	0.79	82%	0.822	S	S	*	*	P	Polyproline II helix	trans	-61.6	137.5	178.8	-65.3	154.7	0	0	0	112.7	Q390	I388-Q390 HydrophobicContact CG2-CG 4.39Å
389	E	28.5	Very low	28.5	Very low	193 Å²	193	147.7 Å²	147.7	90%	0.902	82%	0.824	S	S	*	*			trans	-113	90.4	152.7	-68.1	-177.4	165.2	0	0	106.1
390	Q	27.8	Very low	28.4	Very low	173 Å²	173	147 Å²	147	81%	0.808	83%	0.828	S	S	*	*				43.3	104.2	100.1	-70.6	-168.5	-12.7	0	0	114.6	I388	I388-Q390 HydrophobicContact CG2-CG 4.39Å
391	E	28.8	Very low	28.6	Very low	203 Å²	203	145.5 Å²	145.5	95%	0.949	83%	0.827	S	S	*	*	P	Polyproline II helix	trans	-65.7	127.4	166.7	-67.4	176.3	151.7	0	0	110.1
392	E	27.2	Very low	28.5	Very low	190 Å²	190	145.9 Å²	145.9	89%	0.888	83%	0.833	S	S	*	*	P	Polyproline II helix	trans	-87	119.6	168.2	-85.9	-171.8	148.8	0	0	110.8
393	E	28.7	Very low	28.9	Very low	186 Å²	186	145.2 Å²	145.2	87%	0.869	83%	0.829	S	S	*	*	P	Polyproline II helix	trans	-74.1	138.1	157.5	-72.8	-174.5	140.8	0	0	111.2
394	V	27.8	Very low	28.8	Very low	130 Å²	130	146 Å²	146	79%	0.788	82%	0.824	S	S	*	*			trans	-158.5	162.5	149.8	-133.2	0	0	0	0	110.8
395	P	31.4	Very low	28.5	Very low	120 Å²	120	142.5 Å²	142.5	78%	0.779	82%	0.819	S	S	*	*				-126.4	-178.4	-96.1	42.7	-25.4	0	0	0	114.2
396	V	27.1	Very low	28.3	Very low	140 Å²	140	143.9 Å²	143.9	85%	0.848	82%	0.82	S	S	*	*			trans	-71.5	141.8	176.1	172.8	0	0	0	0	113.2
397	S	25.7	Very low	28.3	Very low	111 Å²	111	144.9 Å²	144.9	78%	0.776	82%	0.821	S	S	*	*			trans	-159.1	132	143.4	-170.9	0	0	0	0	114
398	E	26.5	Very low	28	Very low	191 Å²	191	144.1 Å²	144.1	89%	0.893	82%	0.819	S	S	*	*			trans	-18.8	148.2	171.9	-65.9	176.4	136.4	0	0	123.8
399	G	24.3	Very low	27.8	Very low	82 Å²	82	145.3 Å²	145.3	85%	0.845	82%	0.821	S	S	*	*			trans	154.5	102.1	151.4	0	0	0	0	0	115.8
400	A	26.7	Very low	28.5	Very low	101 Å²	101	140.5 Å²	140.5	84%	0.835	81%	0.807	S	S	*	*			trans	-84.7	-174.7	174.3	0	0	0	0	0	112.7
401	P	37.1	Very low	28.5	Very low	113 Å²	113	139.7 Å²	139.7	73%	0.734	81%	0.807	S	S	*	*			cis	-135.5	166.9	-15.4	36.6	-17	0	0	0	116.4
402	L	24.9	Very low	28.3	Very low	152 Å²	152	135.9 Å²	135.9	80%	0.796	80%	0.798	S	S	*	*			trans	29.4	153.9	143.7	-78.3	153.9	0	0	0	122.7
403	P	37.8	Very low	28.2	Very low	113 Å²	113	132.7 Å²	132.7	73%	0.734	79%	0.791	S	S	*	*			cis	-151.7	156.2	46.2	38.9	-15.8	0	0	0	121.2
404	K	25.5	Very low	28.1	Very low	191 Å²	191	128.7 Å²	128.7	83%	0.83	78%	0.784	S	S	*	*			trans	35.6	133.2	134.8	-56	-176.5	179.1	-177.7	0	124
405	A	25.3	Very low	28	Very low	88 Å²	88	127.9 Å²	127.9	73%	0.727	78%	0.784	S	S	*	*				169.9	109.1	121.2	0	0	0	0	0	109.6
406	D	25.4	Very low	28.5	Very low	153 Å²	153	128.2 Å²	128.2	82%	0.818	79%	0.786	S	S	*	*				73.6	116.9	95.9	-72.6	-21.2	0	0	0	115.8
407	T	26.1	Very low	28.6	Very low	131 Å²	131	128 Å²	128	80%	0.804	79%	0.785	S	S	*	*				163	129.5	111	-59.2	0	0	0	0	114.1
408	S	26.8	Very low	28.7	Very low	112 Å²	112	134.6 Å²	134.6	78%	0.783	79%	0.792	S	S	*	*			trans	73.8	109.4	149.5	64.4	0	0	0	0	124.6
409	E	23.9	Very low	28.6	Very low	178 Å²	178	137 Å²	137	83%	0.832	79%	0.793	S	S	*	*			trans	-52.6	-172.4	145.8	-87.6	-168.3	-172.5	0	0	116.8
410	P	43	Very low	28.6	Very low	93 Å²	93	136.6 Å²	136.6	60%	0.604	79%	0.789	S	S	*	*			cis	-139.2	-178.8	-23.2	27.5	-4.7	0	0	0	114.4
411	L	27.7	Very low	28.6	Very low	156 Å²	156	144.5 Å²	144.5	82%	0.817	80%	0.797	S	S	*	*				171.4	109.4	115.9	-83.4	173.3	0	0	0	114
412	T	24.8	Very low	28	Very low	122 Å²	122	142.5 Å²	142.5	75%	0.748	80%	0.797	S	S	*	*			trans	-6.6	144.9	144.3	5.7	0	0	0	0	119.9
413	V	25.4	Very low	28.1	Very low	123 Å²	123	139.7 Å²	139.7	75%	0.745	80%	0.796	S	S	*	*				180	110.7	82.1	159.5	0	0	0	0	109.2
414	S	27.2	Very low	27.6	Very low	103 Å²	103	141.9 Å²	141.9	72%	0.72	80%	0.801	S	S	*	*				74.4	112.7	104.6	85.1	0	0	0	0	121.2
415	S	26.5	Very low	27.6	Very low	113 Å²	113	136.9 Å²	136.9	79%	0.79	80%	0.796	S	S	*	*				4.3	160.6	128.9	-60	0	0	0	0	120.4
416	P	41.3	Very low	27.7	Very low	127 Å²	127	140.9 Å²	140.9	83%	0.825	80%	0.804	S	S	*	*			cis	-154.4	177.9	46.4	41.1	-17.1	0	0	0	120.9
417	V	28.6	Very low	27.8	Very low	135 Å²	135	138.7 Å²	138.7	82%	0.818	80%	0.8	S	S	*	*			trans	-81.2	149.1	176.9	169	0	0	0	0	112.9
418	R	27.3	Very low	28	Very low	250 Å²	250	141.3 Å²	141.3	94%	0.943	80%	0.804	S	S	*	*			trans	-163.3	142.3	137.9	-125	175.8	178.8	168	-0.8	116.3
419	R	24.2	Very low	28	Very low	242 Å²	242	145.7 Å²	145.7	91%	0.913	81%	0.812	S	S	*	*			trans	-77.5	155.5	178.5	-78.8	173.9	171.4	167.9	-2.5	114.7
420	G	24.9	Very low	28.1	Very low	72 Å²	72	145.4 Å²	145.4	74%	0.742	81%	0.81	S	S	*	*				133.6	125.3	113.4	0	0	0	0	0	120.6
421	R	27.6	Very low	27.4	Very low	267 Å²	267	150 Å²	150	100%	1.008	82%	0.824	S	S	*	*			trans	58.9	145.2	151.5	-74.1	179.8	-179.6	-124.9	-0.3	119.6
422	G	24.6	Very low	27.2	Very low	72 Å²	72	151 Å²	151	74%	0.742	83%	0.825	S	S	*	*			cis	168.5	161.2	-1.1	0	0	0	0	0	110.6
423	A	26.4	Very low	27.3	Very low	93 Å²	93	151.1 Å²	151.1	77%	0.769	83%	0.825	S	S	*	*			trans	69.4	138.7	167.2	0	0	0	0	0	118
424	D	26.3	Very low	27.2	Very low	158 Å²	158	154.1 Å²	154.1	85%	0.845	83%	0.828	S	S	*	*			cis	-159.3	153.4	11.6	-94.7	-32.9	0	0	0	111.2
425	A	25.7	Very low	27.4	Very low	87 Å²	87	158.1 Å²	158.1	72%	0.719	84%	0.835	S	S	*	*			trans	62.4	112.7	145.8	0	0	0	0	0	122.9
426	L	29.2	Very low	27.4	Very low	172 Å²	172	160.5 Å²	160.5	90%	0.901	83%	0.834	S	S	*	*				164.1	150.2	105.2	-83.1	168.8	0	0	0	111.1
427	S	27.2	Very low	26.7	Very low	106 Å²	106	160.3 Å²	160.3	74%	0.741	83%	0.832	S	S	*	*			trans	-76.2	130.8	-164	49.7	0	0	0	0	116.5
428	E	29.4	Very low	26.6	Very low	186 Å²	186	159.4 Å²	159.4	87%	0.869	82%	0.822	S	S	*	*			trans	-145.6	123.3	145.3	-67.6	-170	164.7	0	0	108	E430	E428-E430 PolarHBondContact O-N 2.89Å
429	E	26.7	Very low	26.6	Very low	204 Å²	204	152 Å²	152	95%	0.953	81%	0.805	S	S	*	*			trans	-79.3	96.2	174.8	-69.1	-176.4	166.2	0	0	108.7
430	E	26.9	Very low	26.9	Very low	172 Å²	172	147.9 Å²	147.9	80%	0.804	80%	0.8	S	S	*	*			trans	-84.3	108.9	160.5	-78.9	-172.4	156.8	0	0	108.5	E428 Q432	E428-E430 PolarHBondContact O-N 2.89Å; E430-Q432 PolarHBondContact O-N 2.69Å
431	E	27	Very low	27.1	Very low	191 Å²	191	149.4 Å²	149.4	89%	0.893	80%	0.799	S	S	*	*			trans	-69.6	86.6	165.9	-135.3	-178.9	-172	0	0	108	V433	E431-V433 PolarHBondContact O-N 2.94Å
432	Q	23.5	Very low	27.3	Very low	177 Å²	177	140.9 Å²	140.9	83%	0.827	77%	0.77	S	S	*	*			trans	-67.8	93.8	176.5	-169.4	167.2	37.1	0	0	109	E430 K434	E430-Q432 PolarHBondContact O-N 2.69Å; Q432-K434 PolarHBondContact O-N 2.83Å
433	V	27.9	Very low	27.8	Very low	124 Å²	124	143.3 Å²	143.3	75%	0.752	77%	0.766	S	S	*	*			trans	-58.5	105.5	166.6	178.3	0	0	0	0	107.3	E431 E435	E431-V433 PolarHBondContact O-N 2.94Å; V433-E435 PolarHBondContact O-N 3.02Å
434	K	23.2	Very low	28.2	Very low	185 Å²	185	142.2 Å²	142.2	80%	0.804	76%	0.757	S	S	*	*			trans	-64	104	172.1	-135.4	175.7	-176.6	179.8	0	106.7	Q432 E436	Q432-K434 PolarHBondContact O-N 2.83Å; K434-E436 VanDerWaalsContact C-N 3.34Å; K434-E436 PolarHBondContact O-N 3.3Å
435	E	30.4	Very low	28.8	Very low	188 Å²	188	136.2 Å²	136.2	88%	0.879	72%	0.722	S	S	*	*			trans	-60.4	100.5	165.8	-81.4	-169.6	149.5	0	0	108	V433	V433-E435 PolarHBondContact O-N 3.02Å
436	E	27.6	Very low	29.8	Very low	163 Å²	163	134.1 Å²	134.1	76%	0.762	70%	0.699	S	S	*	*			trans	-67.1	134	164.3	-73.5	-174.1	153.3	0	0	108.5	K434 L438	K434-E436 VanDerWaalsContact C-N 3.34Å; K434-E436 PolarHBondContact O-N 3.3Å; E436-L438 PolarHBondContact O-N 3.28Å
437	P	26.5	Very low	30.1	Very low	122 Å²	122	126.3 Å²	126.3	79%	0.792	66%	0.659	S	S	*	*			trans	-64.4	113.4	176.7	25.2	-31.6	0	0	0	109.5	T439	P437-T439 PolarHBondContact O-N 3.36Å
438	L	26.8	Very low	30.5	Very low	116 Å²	116	125 Å²	125	61%	0.607	65%	0.649	S	S	*	*			trans	-54.3	129.6	178.5	-60.4	167.2	0	0	0	110.4	E436 E442	E436-L438 PolarHBondContact O-N 3.28Å; L438-E442 WeakPolarHBondContact CD2-OE2 3.37Å
439	T	27.6	Very low	30.5	Very low	95 Å²	95	118.9 Å²	118.9	58%	0.583	63%	0.631	S	S	*	*			trans	-75.5	155	179.2	57.8	0	0	0	0	110.8	P437 S441 E442	P437-T439 PolarHBondContact O-N 3.36Å; T439-S441 PolarHBondContact O-N 2.9Å; T439-E442 PolarHBondContact O-N 3.11Å
440	I	29	Very low	30.7	Very low	156 Å²	156	114.1 Å²	114.1	80%	0.8	62%	0.62	S	S	*	*	G	3₁₀ helix	trans	-52.8	-16.9	-174.2	-65.4	168	0	0	0	113.9
441	S	29.3	Very low	30.7	Very low	104 Å²	104	113.9 Å²	113.9	73%	0.727	62%	0.623	S	S	*	*	G	3₁₀ helix	trans	-77.2	-13.4	176	-164.4	0	0	0	0	114.9	T439	T439-S441 PolarHBondContact O-N 2.9Å
442	E	32.6	Very low	30.6	Very low	88 Å²	88	112.2 Å²	112.2	41%	0.411	62%	0.62	S	S	.	*	G	3₁₀ helix	trans	-96.8	-6.6	-178	-71.7	-176.2	111	0	0	114.5	K185 L438 T439	K185-E442 IonicContact NZ-OE1 3.35Å; L438-E442 WeakPolarHBondContact CD2-OE2 3.37Å; T439-E442 PolarHBondContact O-N 3.11Å
443	L	33.8	Very low	30.8	Very low	123 Å²	123	109.1 Å²	109.1	64%	0.644	62%	0.615	S	S	*	*	S	Bend	trans	-84.6	-11.4	179.8	-73.4	167.5	0	0	0	113.9
444	A	35.8	Very low	30.6	Very low	70 Å²	70	110 Å²	110	58%	0.579	62%	0.621	S	S	*	*			trans	-116	95.5	178.6	0	0	0	0	0	110	N446	A444-N446 PolarHBondContact O-N 2.83Å; A444-N446 VanDerWaalsContact O-N 3.11Å
445	Y	38.9	Very low	30.9	Very low	31 Å²	31	106.3 Å²	106.3	12%	0.122	62%	0.616	C	S	.	*			trans	-62.1	116	161.8	174.3	-109.4	0	0	0	107.7	A148 F179 K181 L186 P447	A148-Y445 HydrophobicContact CB-CD1 3.72Å; A148-Y445 HydrophobicContact CB-CE1 4.05Å; A148-Y445 HydrophobicContact CB-CG 4.34Å; F179-Y445 VanDerWaalsContact CB-OH 3.29Å; F179-Y445 WeakPolarHBondContact CB-OH 3.35Å; F179-Y445 AromaticContact CD1-CE1 3.95Å; F179-Y445 HydrophobicContact CD1-CE1 3.95Å; F179-Y445 HydrophobicContact CE1-CE1 4.38Å; F179-Y445 HydrophobicContact CG-CE1 4.45Å; K181-Y445 PolarHBondContact O-OH 3.29Å; L186-Y445 HydrophobicContact CD2-CE2 4.16Å; Y445-P447 HydrophobicContact CE1-CB 4.48Å
446	N	45.6	Very low	30.6	Very low	44 Å²	44	103.1 Å²	103.1	24%	0.235	61%	0.609	C	S	.	*			trans	-113.2	108.9	177.5	-177.4	0.9	0	0	0	107.5	N250 A444 S448 A449	N250-N446 PolarHBondContact ND2-ND2 2.98Å; N250-N446 PolarHBondContact ND2-OD1 3.48Å; A444-N446 PolarHBondContact O-N 2.83Å; A444-N446 VanDerWaalsContact O-N 3.11Å; N446-S448 PolarHBondContact O-N 3.34Å; N446-S448 WeakPolarHBondContact OD1-CA 3.29Å; N446-S448 WeakPolarHBondContact OD1-CB 3.43Å; N446-S448 PolarHBondContact OD1-N 3.29Å; N446-A449 HydrophobicContact CB-CB 3.87Å; N446-A449 WeakPolarHBondContact ND2-CB 3.29Å; N446-A449 PolarHBondContact ND2-N 2.99Å; N446-A449 PolarHBondContact O-N 3.47Å
447	P	35.7	Very low	30.6	Very low	8 Å²	8	102.2 Å²	102.2	5%	0.052	61%	0.609	C	S	.	*	T	Hydrogen-bonded Turn	trans	-59.5	-7	174.6	22.7	-30.4	0	0	0	112.9	L142 P180 K181 Y445	L142-P447 HydrophobicContact CD2-CG 4.22Å; P180-P447 HydrophobicContact CG-CB 4.38Å; K181-P447 WeakPolarHBondContact CD-O 3.47Å; K181-P447 WeakPolarHBondContact CE-O 3.46Å; K181-P447 WeakPolarHBondContact CG-O 3.16Å; Y445-P447 HydrophobicContact CE1-CB 4.48Å
448	S	36.3	Very low	30.8	Very low	78 Å²	78	104 Å²	104	55%	0.545	61%	0.612	S	S	.	*	T	Hydrogen-bonded Turn	trans	-122	4.4	-175.9	-52.1	0	0	0	0	116.2	N446	N446-S448 PolarHBondContact O-N 3.34Å; N446-S448 WeakPolarHBondContact OD1-CA 3.29Å; N446-S448 WeakPolarHBondContact OD1-CB 3.43Å; N446-S448 PolarHBondContact OD1-N 3.29Å
449	A	30.5	Very low	31	Very low	58 Å²	58	105.6 Å²	105.6	48%	0.479	62%	0.621	S	S	.	*			trans	-83.7	130.5	178.3	0	0	0	0	0	112.9	K181 N446	K181-A449 PolarHBondContact NZ-O 3.27Å; N446-A449 HydrophobicContact CB-CB 3.87Å; N446-A449 WeakPolarHBondContact ND2-CB 3.29Å; N446-A449 PolarHBondContact ND2-N 2.99Å; N446-A449 PolarHBondContact O-N 3.47Å
450	S	30.8	Very low	31.3	Very low	104 Å²	104	109.1 Å²	109.1	73%	0.727	63%	0.631	S	S	*	*			trans	-94.6	143.9	176.5	177.4	0	0	0	0	110.2
451	L	26.6	Very low	31.6	Very low	166 Å²	166	106.8 Å²	106.8	87%	0.869	62%	0.619	S	S	*	*			trans	-134.4	86.8	166.8	-71.4	177.2	0	0	0	110.2
452	L	25.2	Very low	31.7	Very low	157 Å²	157	108.8 Å²	108.8	82%	0.822	62%	0.622	S	S	*	*			trans	58.8	165.7	151.3	-53.1	175.5	0	0	0	120.5
453	P	27.3	Very low	31.9	Very low	112 Å²	112	111.9 Å²	111.9	73%	0.727	64%	0.638	S	S	*	*				-125.4	159.8	-67.6	36	-20.1	0	0	0	112.5
454	T	22.9	Very low	32.2	Very low	141 Å²	141	113 Å²	113	87%	0.865	64%	0.644	S	S	*	*			trans	-148.3	142.7	157.5	-6.1	0	0	0	0	108.6
455	P	29.1	Very low	32.3	Very low	109 Å²	109	117.1 Å²	117.1	71%	0.708	65%	0.649	S	S	*	*			trans	-89.3	175.8	-158.9	32.6	-25.3	0	0	0	113
456	V	25.8	Very low	32	Very low	120 Å²	120	123 Å²	123	73%	0.727	68%	0.682	S	S	*	*			trans	87.9	124.7	162.1	-166.4	0	0	0	0	112.9
457	D	26.5	Very low	31.1	Very low	144 Å²	144	127 Å²	127	77%	0.77	71%	0.713	S	S	*	*			cis	-149.1	150.7	5.6	-96.6	-32.6	0	0	0	108.2	D459	D457-D459 PolarHBondContact O-N 2.94Å
458	D	30.2	Very low	30.8	Very low	161 Å²	161	132.3 Å²	132.3	86%	0.861	75%	0.747	S	S	*	*			trans	-87.5	28.1	-166	-87.6	-36.2	0	0	0	116.9
459	D	31.8	Very low	30.5	Very low	149 Å²	149	133.9 Å²	133.9	80%	0.797	76%	0.758	S	S	*	*			trans	-115.9	8.1	-169.9	-77.3	-36.1	0	0	0	117.6	D457	D457-D459 PolarHBondContact O-N 2.94Å
460	E	34.7	Very low	30.4	Very low	168 Å²	168	141.9 Å²	141.9	79%	0.785	78%	0.776	S	S	*	*	S	Bend	trans	-108.9	6.1	-170.4	-127	178.2	-170.1	0	0	117.7
461	I	34	Very low	30.2	Very low	107 Å²	107	143.9 Å²	143.9	55%	0.549	78%	0.778	S	S	.	*	S	Bend	trans	-105.9	-15	-177.1	-72.8	168.3	0	0	0	114.4	Q381	Q381-I461 VanDerWaalsContact CD-CD1 3.48Å
462	D	32	Very low	30.2	Very low	146 Å²	146	144.1 Å²	144.1	78%	0.781	77%	0.774	S	S	*	*	G	3₁₀ helix	trans	-88.7	-4.3	179.3	-87	-13.9	0	0	0	114.8	L464	D462-L464 PolarHBondContact O-N 2.58Å
463	M	37.4	Very low	30.4	Very low	154 Å²	154	144.4 Å²	144.4	76%	0.759	78%	0.776	S	S	*	*	G	3₁₀ helix	trans	-83.6	-1.6	179.1	-69.9	-154	-65.4	0	0	115.3
464	L	40.1	Very low	30.8	Very low	147 Å²	147	146.4 Å²	146.4	77%	0.77	78%	0.781	S	S	*	*	G	3₁₀ helix	trans	-94.8	-8	176.5	-82.6	164.9	0	0	0	113.9	D462	D462-L464 PolarHBondContact O-N 2.58Å
465	F	37.3	Very low	31.3	Very low	156 Å²	156	150.6 Å²	150.6	68%	0.684	78%	0.78	S	S	*	*	S	Bend	trans	-147.1	50.2	-175.1	-62.9	-77.1	0	0	0	112.9
466	D	32.4	Very low	31.5	Very low	153 Å²	153	152.4 Å²	152.4	82%	0.818	78%	0.779	S	S	*	*			trans	167.3	118.8	141.8	-89.8	-24.7	0	0	0	110.5
467	C	26.2	Very low	31.8	Very low	129 Å²	129	154.8 Å²	154.8	87%	0.872	79%	0.788	S	S	*	*			trans	-146.3	126.2	147.7	-136.2	0	0	0	0	111
468	P	29.8	Very low	32.2	Very low	119 Å²	119	151.5 Å²	151.5	77%	0.773	77%	0.773	S	S	*	*			trans	-83.6	152.7	178.6	33.3	-31.4	0	0	0	112.2
469	S	29.3	Very low	32.5	Very low	111 Å²	111	149.4 Å²	149.4	78%	0.776	76%	0.762	S	S	*	*			trans	-72.4	148.1	-168	36.9	0	0	0	0	116.4
470	R	28.6	Very low	32.8	Very low	226 Å²	226	146.6 Å²	146.6	85%	0.853	75%	0.754	S	S	*	*				164	149.2	112.4	-96.5	-177	132.7	163.3	-3.1	115.5
471	L	26.6	Very low	32.9	Very low	147 Å²	147	145.3 Å²	145.3	77%	0.77	75%	0.746	S	S	*	*			trans	77.3	115.6	158.9	-70.4	149.4	0	0	0	114.9
472	E	26.3	Very low	33.1	Very low	170 Å²	170	145.9 Å²	145.9	79%	0.794	75%	0.747	S	S	*	*			cis	-153.7	146	16.8	-61.5	177.8	147	0	0	104.9
473	L	30.1	Very low	33.7	Very low	164 Å²	164	145.2 Å²	145.2	86%	0.859	74%	0.739	S	S	*	*				-174.8	135.9	60.8	-167.2	87.5	0	0	0	107	R475	L473-R475 PolarHBondContact O-N 2.92Å
474	D	35.9	Very low	33.9	Very low	154 Å²	154	143.7 Å²	143.7	82%	0.824	73%	0.733	S	S	*	*			trans	-47.3	123.7	178.7	-73.4	-48.5	0	0	0	114.8
475	R	32.6	Very low	33.9	Very low	228 Å²	228	141.1 Å²	141.1	86%	0.86	72%	0.717	S	S	*	*				175.5	128.4	129.7	-97.9	163.6	159.8	128.8	-0.5	113.1	L473	L473-R475 PolarHBondContact O-N 2.92Å
476	E	33.3	Very low	34.3	Very low	147 Å²	147	136.4 Å²	136.4	69%	0.687	71%	0.707	S	S	*	*			trans	81.4	70.6	151.8	-66.8	169.9	-179.6	0	0	119.5	T478	E476-T478 VanDerWaalsContact C-N 3.27Å; E476-T478 PolarHBondContact O-N 3.44Å
477	D	33	Very low	35	Very low	170 Å²	170	134 Å²	134	91%	0.909	69%	0.694	S	S	*	*			trans	-90.9	59.3	146.9	-94.1	-34.1	0	0	0	109.7
478	T	35.5	Very low	36	Very low	75 Å²	75	133.7 Å²	133.7	46%	0.46	68%	0.68	S	S	.	*			trans	-108.3	-14	-179.1	-32.1	0	0	0	0	112.5	E476	E476-T478 VanDerWaalsContact C-N 3.27Å; E476-T478 PolarHBondContact O-N 3.44Å
479	D	35	Very low	36.7	Very low	118 Å²	118	131.8 Å²	131.8	63%	0.631	66%	0.663	S	S	*	*	H	α-helix	trans	-81.7	-23.6	-167.7	-72.4	-1.3	0	0	0	114.9	F481 E483	D479-F481 VanDerWaalsContact C-N 3.34Å; D479-F481 PolarHBondContact O-N 3.46Å; D479-E483 PolarHBondContact O-N 3.11Å
480	S	39.4	Very low	37.7	Very low	90 Å²	90	129.3 Å²	129.3	63%	0.629	65%	0.649	S	S	*	*	H	α-helix	trans	-78	-18.3	-179.6	72	0	0	0	0	114.1
481	F	35.9	Very low	38.4	Very low	140 Å²	140	124.9 Å²	124.9	61%	0.614	64%	0.636	S	S	*	*	H	α-helix	trans	-89.1	-32.5	176.7	-153.5	-95.1	0	0	0	111.5	D479 E483 L484 E485	D479-F481 VanDerWaalsContact C-N 3.34Å; D479-F481 PolarHBondContact O-N 3.46Å; F481-E483 VanDerWaalsContact C-N 3.3Å; F481-E483 PolarHBondContact O-N 2.84Å; F481-L484 PolarHBondContact O-N 3.38Å; F481-E485 HydrophobicContact CD1-CG 4.44Å; F481-E485 HydrophobicContact CE1-CG 4.47Å; F481-E485 PolarHBondContact O-N 3.24Å; F481-E485 VanDerWaalsContact O-N 3.12Å
482	E	38.4	Very low	39.3	Very low	119 Å²	119	121.6 Å²	121.6	56%	0.556	62%	0.619	S	S	*	*	H	α-helix	trans	-65.7	-29.9	173.6	-70	-167.4	167.8	0	0	112.6	E485 A486	E482-E485 CarbonylContact O-C 3.55Å; E482-E485 PolarHBondContact O-N 3.46Å; E482-A486 VanDerWaalsContact O-CB 3.26Å; E482-A486 WeakPolarHBondContact O-CB 3.43Å; E482-A486 PolarHBondContact O-N 3.42Å
483	E	43.5	Very low	40.6	Very low	132 Å²	132	118.7 Å²	118.7	62%	0.617	61%	0.607	S	S	*	*	H	α-helix	trans	-73.2	-28.8	179.2	-134.6	-175.8	178.8	0	0	113.2	D479 F481 D487	D479-E483 PolarHBondContact O-N 3.11Å; F481-E483 VanDerWaalsContact C-N 3.3Å; F481-E483 PolarHBondContact O-N 2.84Å; E483-D487 PolarHBondContact O-N 3.03Å
484	L	43.6	Very low	41.6	Very low	122 Å²	122	113 Å²	113	64%	0.639	58%	0.583	S	S	*	*	H	α-helix	trans	-77	-38.8	171.1	-77.9	168.8	0	0	0	111.4	F481 A486 E488	F481-L484 PolarHBondContact O-N 3.38Å; L484-A486 VanDerWaalsContact C-N 3.27Å; L484-A486 PolarHBondContact O-N 3.16Å; L484-E488 WeakPolarHBondContact O-CB 3.35Å; L484-E488 PolarHBondContact O-N 3.49Å; L484-E488 VanDerWaalsContact O-N 3.1Å
485	E	40.2	Very low	42.4	Very low	94 Å²	94	110.4 Å²	110.4	44%	0.439	57%	0.566	S	S	.	*	H	α-helix	trans	-67	-27.3	170.7	-76.4	-172.5	173.9	0	0	111.8	F481 E482 N489	F481-E485 HydrophobicContact CD1-CG 4.44Å; F481-E485 HydrophobicContact CE1-CG 4.47Å; F481-E485 PolarHBondContact O-N 3.24Å; F481-E485 VanDerWaalsContact O-N 3.12Å; E482-E485 CarbonylContact O-C 3.55Å; E482-E485 PolarHBondContact O-N 3.46Å; E485-N489 WeakPolarHBondContact O-CA 3.28Å; E485-N489 WeakPolarHBondContact O-CB 2.97Å; E485-N489 PolarHBondContact O-N 3.31Å; E485-N489 PolarHBondContact O-ND2 3.29Å
486	A	44	Very low	43.4	Very low	56 Å²	56	103.2 Å²	103.2	46%	0.463	54%	0.543	S	S	.	.	H	α-helix	trans	-74.1	-37.8	178.5	0	0	0	0	0	113.4	E482 L484 A490	E482-A486 VanDerWaalsContact O-CB 3.26Å; E482-A486 WeakPolarHBondContact O-CB 3.43Å; E482-A486 PolarHBondContact O-N 3.42Å; L484-A486 VanDerWaalsContact C-N 3.27Å; L484-A486 PolarHBondContact O-N 3.16Å; A486-A490 WeakPolarHBondContact O-CB 3.42Å; A486-A490 PolarHBondContact O-N 2.85Å
487	D	47.4	Very low	44.5	Very low	103 Å²	103	101.6 Å²	101.6	55%	0.551	54%	0.535	S	S	*	.	H	α-helix	trans	-72.6	-36.9	172.7	-164.4	38.9	0	0	0	110.5	K295 E483 F491	K295-D487 IonicContact NZ-OD2 3.7Å; E483-D487 PolarHBondContact O-N 3.03Å; D487-F491 WeakPolarHBondContact O-CB 3.22Å; D487-F491 PolarHBondContact O-N 3.08Å
488	E	47	Very low	45.5	Very low	123 Å²	123	100.3 Å²	100.3	58%	0.575	52%	0.524	S	S	*	.	H	α-helix	trans	-69.1	-41.1	173.2	-168.9	165.1	-173.2	0	0	111.7	L484 F491 L492	L484-E488 WeakPolarHBondContact O-CB 3.35Å; L484-E488 PolarHBondContact O-N 3.49Å; L484-E488 VanDerWaalsContact O-N 3.1Å; E488-F491 CarbonylContact O-C 3.6Å; E488-F491 PolarHBondContact O-N 2.78Å; E488-L492 HydrophobicContact CG-CD1 4.13Å; E488-L492 HydrophobicContact CG-CG 4.4Å; E488-L492 VanDerWaalsContact O-CB 3.3Å; E488-L492 WeakPolarHBondContact O-CB 3.41Å; E488-L492 WeakPolarHBondContact O-CG 3.46Å; E488-L492 PolarHBondContact O-N 2.92Å
489	N	45	Very low	46.4	Very low	79 Å²	79	100.4 Å²	100.4	42%	0.422	52%	0.521	S	S	.	.	H	α-helix	trans	-70	-35	174.3	-73.8	-34.6	0	0	0	111.5	E485 F491 L492 M493	E485-N489 WeakPolarHBondContact O-CA 3.28Å; E485-N489 WeakPolarHBondContact O-CB 2.97Å; E485-N489 PolarHBondContact O-N 3.31Å; E485-N489 PolarHBondContact O-ND2 3.29Å; N489-F491 VanDerWaalsContact C-N 3.32Å; N489-L492 PolarHBondContact O-N 2.79Å; N489-M493 WeakPolarHBondContact O-CB 3.43Å; N489-M493 WeakPolarHBondContact O-CG 3.44Å; N489-M493 PolarHBondContact O-N 3.03Å
490	A	49.7	Very low	47.5	Very low	59 Å²	59	99.4 Å²	99.4	49%	0.488	51%	0.511	S	S	.	.	H	α-helix	trans	-66.8	-35.6	173.2	0	0	0	0	0	111.8	A486 A494	A486-A490 WeakPolarHBondContact O-CB 3.42Å; A486-A490 PolarHBondContact O-N 2.85Å; A490-A494 WeakPolarHBondContact O-CB 3.48Å; A490-A494 PolarHBondContact O-N 3.02Å; A490-A494 VanDerWaalsContact O-N 3.1Å
491	F	43.7	Very low	48.6	Very low	132 Å²	132	100.7 Å²	100.7	58%	0.579	51%	0.507	S	S	*	.	H	α-helix	trans	-72.1	-44.9	171.9	-178.6	-95.2	0	0	0	112.1	D487 E488 N489 M493 A494 E495	D487-F491 WeakPolarHBondContact O-CB 3.22Å; D487-F491 PolarHBondContact O-N 3.08Å; E488-F491 CarbonylContact O-C 3.6Å; E488-F491 PolarHBondContact O-N 2.78Å; N489-F491 VanDerWaalsContact C-N 3.32Å; F491-M493 VanDerWaalsContact C-N 3.27Å; F491-M493 PolarHBondContact O-N 3.34Å; F491-A494 CarbonylContact O-C 3.49Å; F491-A494 WeakPolarHBondContact O-CB 3.43Å; F491-A494 PolarHBondContact O-N 2.91Å; F491-A494 VanDerWaalsContact O-N 3.11Å; F491-E495 WeakPolarHBondContact O-CB 3.3Å; F491-E495 PolarHBondContact O-N 3.13Å
492	L	45.8	Very low	49.5	Very low	78 Å²	78	96.2 Å²	96.2	41%	0.408	50%	0.496	S	S	.	.	H	α-helix	trans	-63.8	-32.1	175	-73.7	171.7	0	0	0	111.6	E488 N489 E496	E488-L492 HydrophobicContact CG-CD1 4.13Å; E488-L492 HydrophobicContact CG-CG 4.4Å; E488-L492 VanDerWaalsContact O-CB 3.3Å; E488-L492 WeakPolarHBondContact O-CB 3.41Å; E488-L492 WeakPolarHBondContact O-CG 3.46Å; E488-L492 PolarHBondContact O-N 2.92Å; N489-L492 PolarHBondContact O-N 2.79Å; L492-E496 WeakPolarHBondContact O-CA 3.41Å; L492-E496 WeakPolarHBondContact O-CB 3.31Å; L492-E496 PolarHBondContact O-N 2.8Å
493	M	53.6	Low	50.5	Low	110 Å²	110	97.9 Å²	97.9	54%	0.542	50%	0.497	S	S	.	.	H	α-helix	trans	-72	-35.7	172.9	-74.7	-72.7	-71.6	0	0	111.5	N489 F491 E496 E497	N489-M493 WeakPolarHBondContact O-CB 3.43Å; N489-M493 WeakPolarHBondContact O-CG 3.44Å; N489-M493 PolarHBondContact O-N 3.03Å; F491-M493 VanDerWaalsContact C-N 3.27Å; F491-M493 PolarHBondContact O-N 3.34Å; M493-E496 PolarHBondContact O-N 2.95Å; M493-E497 WeakPolarHBondContact O-CB 3.46Å; M493-E497 PolarHBondContact O-N 3.06Å
494	A	50.9	Low	51.4	Low	43 Å²	43	98.1 Å²	98.1	36%	0.355	50%	0.498	S	S	.	.	H	α-helix	trans	-70.7	-38.3	172.5	0	0	0	0	0	111.8	A490 F491 E497 E498	A490-A494 WeakPolarHBondContact O-CB 3.48Å; A490-A494 PolarHBondContact O-N 3.02Å; A490-A494 VanDerWaalsContact O-N 3.1Å; F491-A494 CarbonylContact O-C 3.49Å; F491-A494 WeakPolarHBondContact O-CB 3.43Å; F491-A494 PolarHBondContact O-N 2.91Å; F491-A494 VanDerWaalsContact O-N 3.11Å; A494-E497 PolarHBondContact O-N 3.05Å; A494-E498 PolarHBondContact O-N 3Å
495	E	52.3	Low	52.3	Low	100 Å²	100	95.1 Å²	95.1	47%	0.467	49%	0.491	S	S	.	.	H	α-helix	trans	-69.2	-36.7	171.9	-170.2	174.2	-176	0	0	110.9	F491 E497 E498 L499	F491-E495 WeakPolarHBondContact O-CB 3.3Å; F491-E495 PolarHBondContact O-N 3.13Å; E495-E497 VanDerWaalsContact C-N 3.33Å; E495-E498 PolarHBondContact O-N 2.89Å; E495-L499 WeakPolarHBondContact O-CA 3.5Å; E495-L499 WeakPolarHBondContact O-CB 3.48Å; E495-L499 PolarHBondContact O-N 3.14Å
496	E	53.3	Low	53.3	Low	78 Å²	78	96 Å²	96	36%	0.364	50%	0.498	S	S	.	.	H	α-helix	trans	-70	-30.6	172.9	-167.6	-173.1	154.6	0	0	111.2	L492 M493 L499 K500	L492-E496 WeakPolarHBondContact O-CA 3.41Å; L492-E496 WeakPolarHBondContact O-CB 3.31Å; L492-E496 PolarHBondContact O-N 2.8Å; M493-E496 PolarHBondContact O-N 2.95Å; E496-L499 CarbonylContact O-C 3.6Å; E496-K500 HydrophobicContact CG-CD 4.44Å; E496-K500 WeakPolarHBondContact O-CA 3.35Å; E496-K500 WeakPolarHBondContact O-CB 3.44Å; E496-K500 WeakPolarHBondContact O-CG 3.36Å; E496-K500 PolarHBondContact O-N 3.15Å; E496-K500 WeakPolarHBondContact OE1-CE 3.32Å; E496-K500 IonicContact OE1-NZ 2.74Å; E496-K500 PolarHBondContact OE1-NZ 2.94Å
497	E	58	Low	54.3	Low	112 Å²	112	96.9 Å²	96.9	52%	0.523	50%	0.501	S	S	.	.	H	α-helix	trans	-71.4	-46.1	173	-166.2	167.3	-154.9	0	0	110.5	M493 A494 E495 L499 K500 E501	M493-E497 WeakPolarHBondContact O-CB 3.46Å; M493-E497 PolarHBondContact O-N 3.06Å; A494-E497 PolarHBondContact O-N 3.05Å; E495-E497 VanDerWaalsContact C-N 3.33Å; E497-L499 VanDerWaalsContact C-N 3.33Å; E497-L499 PolarHBondContact O-N 2.88Å; E497-K500 CarbonylContact O-C 3.57Å; E497-K500 WeakPolarHBondContact O-CB 3.48Å; E497-K500 PolarHBondContact O-N 2.86Å; E497-K500 VanDerWaalsContact O-N 3.16Å; E497-E501 WeakPolarHBondContact O-CG 3.38Å; E497-E501 PolarHBondContact O-N 3.07Å
498	E	52.9	Low	54.8	Low	144 Å²	144	100.3 Å²	100.3	67%	0.673	51%	0.506	S	S	*	.	H	α-helix	trans	-65	-34.9	170.8	-73.2	-151.7	167.7	0	0	112.3	A494 E495 K500 E501 A502	A494-E498 PolarHBondContact O-N 3Å; E495-E498 PolarHBondContact O-N 2.89Å; E498-K500 VanDerWaalsContact C-N 3.35Å; E498-E501 PolarHBondContact O-N 3.32Å; E498-A502 VanDerWaalsContact O-CB 3.22Å; E498-A502 WeakPolarHBondContact O-CB 3.48Å; E498-A502 PolarHBondContact O-N 2.92Å
499	L	55	Low	55.6	Low	77 Å²	77	96.6 Å²	96.6	40%	0.403	49%	0.494	S	S	.	.	H	α-helix	trans	-74.3	-27.6	174.8	-163.3	110.2	0	0	0	111.1	E495 E496 E497 R503	E495-L499 WeakPolarHBondContact O-CA 3.5Å; E495-L499 WeakPolarHBondContact O-CB 3.48Å; E495-L499 PolarHBondContact O-N 3.14Å; E496-L499 CarbonylContact O-C 3.6Å; E497-L499 VanDerWaalsContact C-N 3.33Å; E497-L499 PolarHBondContact O-N 2.88Å; L499-R503 VanDerWaalsContact CD2-CZ 3.45Å; L499-R503 WeakPolarHBondContact O-CB 3.37Å; L499-R503 WeakPolarHBondContact O-CG 3.26Å; L499-R503 PolarHBondContact O-N 3.47Å
500	K	58.8	Low	56.5	Low	97 Å²	97	100 Å²	100	42%	0.422	50%	0.502	S	S	.	.	H	α-helix	trans	-72.4	-40.5	169.7	-87.2	167.6	-175.1	153.4	0	110.7	E496 E497 E498 R503 Q504	E496-K500 HydrophobicContact CG-CD 4.44Å; E496-K500 WeakPolarHBondContact O-CA 3.35Å; E496-K500 WeakPolarHBondContact O-CB 3.44Å; E496-K500 WeakPolarHBondContact O-CG 3.36Å; E496-K500 PolarHBondContact O-N 3.15Å; E496-K500 WeakPolarHBondContact OE1-CE 3.32Å; E496-K500 IonicContact OE1-NZ 2.74Å; E496-K500 PolarHBondContact OE1-NZ 2.94Å; E497-K500 CarbonylContact O-C 3.57Å; E497-K500 WeakPolarHBondContact O-CB 3.48Å; E497-K500 PolarHBondContact O-N 2.86Å; E497-K500 VanDerWaalsContact O-N 3.16Å; E498-K500 VanDerWaalsContact C-N 3.35Å; K500-R503 CarbonylContact O-C 3.55Å; K500-R503 PolarHBondContact O-N 3.47Å; K500-Q504 VanDerWaalsContact O-CB 3.24Å; K500-Q504 WeakPolarHBondContact O-CB 3.49Å; K500-Q504 WeakPolarHBondContact O-CG 3.37Å; K500-Q504 PolarHBondContact O-N 3.44Å
501	E	62.3	Low	57.1	Low	117 Å²	117	98.1 Å²	98.1	55%	0.547	49%	0.485	S	S	.	.	H	α-helix	trans	-65.4	-41.8	172.1	-73.9	-174.2	177	0	0	110.7	E497 E498 Q504 A505	E497-E501 WeakPolarHBondContact O-CG 3.38Å; E497-E501 PolarHBondContact O-N 3.07Å; E498-E501 PolarHBondContact O-N 3.32Å; E501-Q504 CarbonylContact O-C 3.59Å; E501-Q504 PolarHBondContact O-N 2.95Å; E501-A505 VanDerWaalsContact O-CB 3.26Å; E501-A505 WeakPolarHBondContact O-CB 3.37Å; E501-A505 PolarHBondContact O-N 3.48Å
502	A	55	Low	58	Low	46 Å²	46	93.3 Å²	93.3	38%	0.38	47%	0.465	S	S	.	.	H	α-helix	trans	-65.7	-41.3	172.8	0	0	0	0	0	111.6	E498 A505 L506	E498-A502 VanDerWaalsContact O-CB 3.22Å; E498-A502 WeakPolarHBondContact O-CB 3.48Å; E498-A502 PolarHBondContact O-N 2.92Å; A502-A505 PolarHBondContact O-N 3.26Å; A502-L506 WeakPolarHBondContact O-CB 3.44Å; A502-L506 WeakPolarHBondContact O-CG 3.43Å; A502-L506 PolarHBondContact O-N 3.08Å
503	R	59.2	Low	58.6	Low	153 Å²	153	91.9 Å²	91.9	58%	0.577	46%	0.457	S	S	*	.	H	α-helix	trans	-67.6	-34.1	173.3	-80.6	173.9	-178.4	174.5	4.3	111.9	L499 K500 S507	L499-R503 VanDerWaalsContact CD2-CZ 3.45Å; L499-R503 WeakPolarHBondContact O-CB 3.37Å; L499-R503 WeakPolarHBondContact O-CG 3.26Å; L499-R503 PolarHBondContact O-N 3.47Å; K500-R503 CarbonylContact O-C 3.55Å; K500-R503 PolarHBondContact O-N 3.47Å; R503-S507 WeakPolarHBondContact O-CA 3.48Å; R503-S507 WeakPolarHBondContact O-CB 3.43Å; R503-S507 PolarHBondContact O-N 3.27Å
504	Q	62.4	Low	59	Low	137 Å²	137	89.9 Å²	89.9	64%	0.64	45%	0.451	S	S	*	.	H	α-helix	trans	-68	-45	172.5	-86	179.3	-15.5	0	0	109.9	K500 E501 L506 S507 W508	K500-Q504 VanDerWaalsContact O-CB 3.24Å; K500-Q504 WeakPolarHBondContact O-CB 3.49Å; K500-Q504 WeakPolarHBondContact O-CG 3.37Å; K500-Q504 PolarHBondContact O-N 3.44Å; E501-Q504 CarbonylContact O-C 3.59Å; E501-Q504 PolarHBondContact O-N 2.95Å; Q504-L506 VanDerWaalsContact C-N 3.34Å; Q504-L506 PolarHBondContact O-N 3.31Å; Q504-S507 CarbonylContact O-C 3.6Å; Q504-S507 WeakPolarHBondContact O-CB 3.17Å; Q504-S507 PolarHBondContact O-N 3.4Å; Q504-W508 VanDerWaalsContact O-CB 3.29Å; Q504-W508 WeakPolarHBondContact O-CB 3.34Å; Q504-W508 PolarHBondContact O-N 2.85Å
505	A	61.8	Low	59.3	Low	59 Å²	59	89.7 Å²	89.7	49%	0.488	45%	0.454	S	S	.	.	H	α-helix	trans	-63.6	-38.5	174.6	0	0	0	0	0	111.9	E501 A502 W508 S509	E501-A505 VanDerWaalsContact O-CB 3.26Å; E501-A505 WeakPolarHBondContact O-CB 3.37Å; E501-A505 PolarHBondContact O-N 3.48Å; A502-A505 PolarHBondContact O-N 3.26Å; A505-W508 WeakPolarHBondContact O-CB 3.24Å; A505-W508 PolarHBondContact O-N 3.29Å; A505-S509 WeakPolarHBondContact O-CB 3.43Å; A505-S509 PolarHBondContact O-N 3.06Å; A505-S509 PolarHBondContact O-OG 3.37Å
506	L	61.8	Low	59.5	Low	113 Å²	113	95.3 Å²	95.3	59%	0.592	47%	0.471	S	S	*	.	H	α-helix	trans	-71.2	-35.8	173.7	-73.4	169.5	0	0	0	112	A502 Q504 W508 S509 Y510	A502-L506 WeakPolarHBondContact O-CB 3.44Å; A502-L506 WeakPolarHBondContact O-CG 3.43Å; A502-L506 PolarHBondContact O-N 3.08Å; Q504-L506 VanDerWaalsContact C-N 3.34Å; Q504-L506 PolarHBondContact O-N 3.31Å; L506-W508 VanDerWaalsContact C-N 3.31Å; L506-S509 VanDerWaalsContact CA-OG 3.32Å; L506-S509 WeakPolarHBondContact CA-OG 3.32Å; L506-S509 PolarHBondContact O-OG 3.1Å; L506-Y510 WeakPolarHBondContact O-CB 3.43Å; L506-Y510 PolarHBondContact O-N 3.13Å
507	S	64.9	Low	59.7	Low	75 Å²	75	94.4 Å²	94.4	52%	0.524	47%	0.468	S	S	.	.	H	α-helix	trans	-67.7	-36.6	171.4	178	0	0	0	0	110.5	R503 Q504 S511	R503-S507 WeakPolarHBondContact O-CA 3.48Å; R503-S507 WeakPolarHBondContact O-CB 3.43Å; R503-S507 PolarHBondContact O-N 3.27Å; Q504-S507 CarbonylContact O-C 3.6Å; Q504-S507 WeakPolarHBondContact O-CB 3.17Å; Q504-S507 PolarHBondContact O-N 3.4Å; S507-S511 VanDerWaalsContact O-CB 3.27Å; S507-S511 WeakPolarHBondContact O-CB 3.14Å; S507-S511 PolarHBondContact O-N 2.68Å; S507-S511 PolarHBondContact O-OG 3.2Å
508	W	58.7	Low	59.7	Low	175 Å²	175	102.2 Å²	102.2	66%	0.663	49%	0.493	S	S	*	.	H	α-helix	trans	-68.2	-46.1	176	-138.3	56.7	0	0	0	110.3	Q504 A505 L506 Y510 S511 I512	Q504-W508 VanDerWaalsContact O-CB 3.29Å; Q504-W508 WeakPolarHBondContact O-CB 3.34Å; Q504-W508 PolarHBondContact O-N 2.85Å; A505-W508 WeakPolarHBondContact O-CB 3.24Å; A505-W508 PolarHBondContact O-N 3.29Å; L506-W508 VanDerWaalsContact C-N 3.31Å; W508-Y510 PolarHBondContact O-N 3.37Å; W508-S511 WeakPolarHBondContact CA-OG 3.38Å; W508-S511 PolarHBondContact O-N 3.17Å; W508-S511 PolarHBondContact O-OG 2.66Å; W508-I512 HydrophobicContact CE3-CD1 4.32Å; W508-I512 VanDerWaalsContact O-CG1 3.31Å; W508-I512 WeakPolarHBondContact O-CG1 3.33Å; W508-I512 PolarHBondContact O-N 3Å
509	S	63.1	Low	60.2	Low	44 Å²	44	97.8 Å²	97.8	31%	0.308	48%	0.475	S	S	.	.	H	α-helix	trans	-64.5	-38.9	174.2	71.8	0	0	0	0	112	A505 L506 S511 I512 L513	A505-S509 WeakPolarHBondContact O-CB 3.43Å; A505-S509 PolarHBondContact O-N 3.06Å; A505-S509 PolarHBondContact O-OG 3.37Å; L506-S509 VanDerWaalsContact CA-OG 3.32Å; L506-S509 WeakPolarHBondContact CA-OG 3.32Å; L506-S509 PolarHBondContact O-OG 3.1Å; S509-S511 PolarHBondContact O-N 3.43Å; S509-I512 WeakPolarHBondContact O-CB 3.3Å; S509-I512 PolarHBondContact O-N 3.27Å; S509-L513 WeakPolarHBondContact O-CD1 3.47Å; S509-L513 WeakPolarHBondContact O-CG 3.37Å; S509-L513 PolarHBondContact O-N 3.47Å
510	Y	63.8	Low	61.1	Low	151 Å²	151	99.1 Å²	99.1	59%	0.592	48%	0.483	S	S	*	.	H	α-helix	trans	-63.9	-37.9	172.1	-175.8	-100.5	0	0	0	112.2	L506 W508 L513 T514	L506-Y510 WeakPolarHBondContact O-CB 3.43Å; L506-Y510 PolarHBondContact O-N 3.13Å; W508-Y510 PolarHBondContact O-N 3.37Å; Y510-L513 PolarHBondContact O-N 3.33Å; Y510-T514 HydrophobicContact CD1-CG2 4.1Å; Y510-T514 HydrophobicContact CD2-CG2 4.26Å; Y510-T514 HydrophobicContact CE1-CG2 3.67Å; Y510-T514 HydrophobicContact CE2-CG2 3.85Å; Y510-T514 HydrophobicContact CG-CG2 4.37Å; Y510-T514 WeakPolarHBondContact O-CB 3.45Å; Y510-T514 WeakPolarHBondContact O-CG2 3.04Å; Y510-T514 PolarHBondContact O-N 3.47Å; Y510-T514 PolarHBondContact O-OG1 2.93Å
511	S	62	Low	61.7	Low	20 Å²	20	99.4 Å²	99.4	14%	0.14	50%	0.495	C	S	.	.	H	α-helix	trans	-69.7	-31.9	176.3	77	0	0	0	0	113.2	S507 W508 S509 G515 R516 I517	S507-S511 VanDerWaalsContact O-CB 3.27Å; S507-S511 WeakPolarHBondContact O-CB 3.14Å; S507-S511 PolarHBondContact O-N 2.68Å; S507-S511 PolarHBondContact O-OG 3.2Å; W508-S511 WeakPolarHBondContact CA-OG 3.38Å; W508-S511 PolarHBondContact O-N 3.17Å; W508-S511 PolarHBondContact O-OG 2.66Å; S509-S511 PolarHBondContact O-N 3.43Å; S511-G515 PolarHBondContact O-N 2.71Å; S511-G515 VanDerWaalsContact O-N 3.09Å; S511-R516 PolarHBondContact O-N 3.47Å; S511-I517 WeakPolarHBondContact OG-CD1 3.37Å
512	I	61.8	Low	62.1	Low	31 Å²	31	100.5 Å²	100.5	16%	0.159	50%	0.504	C	S	.	.	H	α-helix	trans	-67.4	-41.6	170.8	-71.2	165.6	0	0	0	110.4	W508 S509 I517 V519	W508-I512 HydrophobicContact CE3-CD1 4.32Å; W508-I512 VanDerWaalsContact O-CG1 3.31Å; W508-I512 WeakPolarHBondContact O-CG1 3.33Å; W508-I512 PolarHBondContact O-N 3Å; S509-I512 WeakPolarHBondContact O-CB 3.3Å; S509-I512 PolarHBondContact O-N 3.27Å; I512-I517 HydrophobicContact CG1-CD1 4.39Å; I512-V519 HydrophobicContact CG2-CG2 4.28Å
513	L	59.3	Low	63	Low	47 Å²	47	102.1 Å²	102.1	25%	0.246	51%	0.509	C	S	.	.	H	α-helix	trans	-68.1	-43.6	177.3	-78.4	153.4	0	0	0	112.7	S509 Y510 G515 R528 V531	S509-L513 WeakPolarHBondContact O-CD1 3.47Å; S509-L513 WeakPolarHBondContact O-CG 3.37Å; S509-L513 PolarHBondContact O-N 3.47Å; Y510-L513 PolarHBondContact O-N 3.33Å; L513-G515 VanDerWaalsContact C-N 3.34Å; L513-R528 HydrophobicContact CD2-CG 3.88Å; L513-V531 HydrophobicContact CD1-CG2 3.94Å; L513-V531 HydrophobicContact CD2-CG2 4.22Å
514	T	61.8	Low	63.4	Low	68 Å²	68	97.9 Å²	97.9	42%	0.417	49%	0.494	S	S	.	.	H	α-helix	trans	-84.8	-3.3	-177	56.5	0	0	0	0	114.1	Y510	Y510-T514 HydrophobicContact CD1-CG2 4.1Å; Y510-T514 HydrophobicContact CD2-CG2 4.26Å; Y510-T514 HydrophobicContact CE1-CG2 3.67Å; Y510-T514 HydrophobicContact CE2-CG2 3.85Å; Y510-T514 HydrophobicContact CG-CG2 4.37Å; Y510-T514 WeakPolarHBondContact O-CB 3.45Å; Y510-T514 WeakPolarHBondContact O-CG2 3.04Å; Y510-T514 PolarHBondContact O-N 3.47Å; Y510-T514 PolarHBondContact O-OG1 2.93Å
515	G	56.7	Low	64.1	Low	39 Å²	39	95.2 Å²	95.2	40%	0.402	49%	0.491	S	S	.	.	T	Hydrogen-bonded Turn	trans	82.4	23	169.1	0	0	0	0	0	116	S511 L513 I517	S511-G515 PolarHBondContact O-N 2.71Å; S511-G515 VanDerWaalsContact O-N 3.09Å; L513-G515 VanDerWaalsContact C-N 3.34Å; G515-I517 VanDerWaalsContact C-N 3.33Å
516	R	57.5	Low	65	Low	218 Å²	218	98.9 Å²	98.9	82%	0.823	50%	0.496	S	S	*	.			trans	-80.9	-9.6	175.5	-83.9	-174.3	-145.9	-151.9	3.9	114.5	S511	S511-R516 PolarHBondContact O-N 3.47Å
517	I	57.2	Low	65.6	Low	60 Å²	60	94.8 Å²	94.8	31%	0.308	48%	0.477	S	S	.	.	S	Bend	trans	-118.9	134.2	179.2	-57.2	179.1	0	0	0	108.8	S511 I512 G515 V519	S511-I517 WeakPolarHBondContact OG-CD1 3.37Å; I512-I517 HydrophobicContact CG1-CD1 4.39Å; G515-I517 VanDerWaalsContact C-N 3.33Å; I517-V519 HydrophobicContact CG2-CG1 4.32Å; I517-V519 WeakPolarHBondContact O-CG2 3.05Å; I517-V519 PolarHBondContact O-N 3.26Å
518	W	58.2	Low	66.3	Low	275 Å²	275	97.1 Å²	97.1	100%	1.042	47%	0.474	S	S	*	.			trans	-72.7	89.9	174	-96.2	69.3	0	0	0	110
519	V	62.5	Low	67.5	Low	51 Å²	51	94.6 Å²	94.6	31%	0.309	47%	0.473	S	S	.	.			trans	-112.7	147.3	173.8	-89.8	0	0	0	0	110.9	I512 I517	I512-V519 HydrophobicContact CG2-CG2 4.28Å; I517-V519 HydrophobicContact CG2-CG1 4.32Å; I517-V519 WeakPolarHBondContact O-CG2 3.05Å; I517-V519 PolarHBondContact O-N 3.26Å
520	N	73.8	Confident	68.4	Low	105 Å²	105	96.8 Å²	96.8	56%	0.561	48%	0.481	S	S	*	.			trans	-50.7	132.4	179.8	-174.2	-19.2	0	0	0	111.1	L522 V523 K524	N520-L522 PolarHBondContact O-N 2.8Å; N520-L522 PolarHBondContact OD1-N 3.12Å; N520-V523 HydrophobicContact CB-CG2 4.27Å; N520-V523 PolarHBondContact O-N 3.26Å; N520-K524 PolarHBondContact O-N 2.8Å
521	P	73	Confident	69.2	Low	104 Å²	104	92.8 Å²	92.8	68%	0.675	47%	0.472	S	S	*	.	H	α-helix	trans	-47.5	-33.1	-179.8	-30.8	32.9	0	0	0	115.1	K524 S525	P521-K524 PolarHBondContact O-N 3.02Å; P521-S525 PolarHBondContact O-N 3.08Å; P521-S525 VanDerWaalsContact O-N 3.1Å
522	L	69.3	Low	70.3	Confident	139 Å²	139	96 Å²	96	73%	0.728	49%	0.49	S	S	*	.	H	α-helix	trans	-69.1	-41.6	-178.5	-136.3	136.7	0	0	0	112.4	N520 K524 S525 F526	N520-L522 PolarHBondContact O-N 2.8Å; N520-L522 PolarHBondContact OD1-N 3.12Å; L522-K524 VanDerWaalsContact C-N 3.33Å; L522-K524 PolarHBondContact O-N 3.3Å; L522-S525 PolarHBondContact O-N 3.29Å; L522-F526 PolarHBondContact O-N 3.22Å
523	V	74.1	Confident	71.4	Confident	81 Å²	81	96.4 Å²	96.4	49%	0.491	50%	0.502	S	S	.	.	H	α-helix	trans	-68	-36.1	177.3	178.8	0	0	0	0	110.7	N520 F526 S527	N520-V523 HydrophobicContact CB-CG2 4.27Å; N520-V523 PolarHBondContact O-N 3.26Å; V523-F526 PolarHBondContact O-N 3.3Å; V523-S527 VanDerWaalsContact O-CB 3.32Å; V523-S527 WeakPolarHBondContact O-CB 3.49Å; V523-S527 PolarHBondContact O-N 2.52Å
524	K	69	Low	72.5	Confident	63 Å²	63	98.7 Å²	98.7	27%	0.274	51%	0.514	S	S	.	.	H	α-helix	trans	-66.4	-41.6	176.8	-166.8	178	-169.3	178.7	0	112.1	N520 P521 L522 R528	N520-K524 PolarHBondContact O-N 2.8Å; P521-K524 PolarHBondContact O-N 3.02Å; L522-K524 VanDerWaalsContact C-N 3.33Å; L522-K524 PolarHBondContact O-N 3.3Å; K524-R528 VanDerWaalsContact CE-NH2 3.31Å; K524-R528 VanDerWaalsContact O-CG 3.32Å; K524-R528 WeakPolarHBondContact O-CG 3.44Å; K524-R528 PolarHBondContact O-N 3.3Å; K524-R528 VanDerWaalsContact O-N 3.1Å
525	S	75.7	Confident	73.5	Confident	81 Å²	81	96.8 Å²	96.8	57%	0.566	51%	0.508	S	S	*	.	H	α-helix	trans	-63.9	-45.9	175.5	-167.5	0	0	0	0	111.1	P521 L522 S527 R528 L529	P521-S525 PolarHBondContact O-N 3.08Å; P521-S525 VanDerWaalsContact O-N 3.1Å; L522-S525 PolarHBondContact O-N 3.29Å; S525-S527 PolarHBondContact O-N 2.64Å; S525-R528 PolarHBondContact O-N 2.83Å; S525-L529 PolarHBondContact O-N 3.34Å
526	F	80.6	Confident	74.8	Confident	137 Å²	137	99.9 Å²	99.9	60%	0.601	52%	0.515	S	S	*	.	H	α-helix	trans	-63.2	-44	178.5	-168.7	-96.9	0	0	0	112.6	L522 V523 R528 L529 L530	L522-F526 PolarHBondContact O-N 3.22Å; V523-F526 PolarHBondContact O-N 3.3Å; F526-R528 PolarHBondContact O-N 3.35Å; F526-L529 PolarHBondContact O-N 3.25Å; F526-L530 HydrophobicContact CE1-CD1 3.97Å; F526-L530 WeakPolarHBondContact O-CB 3.48Å; F526-L530 PolarHBondContact O-N 3.46Å
527	S	75.9	Confident	76	Confident	26 Å²	26	94.5 Å²	94.5	18%	0.182	50%	0.501	C	S	.	.	H	α-helix	trans	-61.9	-41.5	176.8	174.6	0	0	0	0	112.3	V523 S525 L530 V531	V523-S527 VanDerWaalsContact O-CB 3.32Å; V523-S527 WeakPolarHBondContact O-CB 3.49Å; V523-S527 PolarHBondContact O-N 2.52Å; S525-S527 PolarHBondContact O-N 2.64Å; S527-L530 PolarHBondContact O-N 2.76Å; S527-V531 VanDerWaalsContact O-CG2 3.25Å; S527-V531 WeakPolarHBondContact O-CG2 3.31Å; S527-V531 PolarHBondContact O-N 2.91Å
528	R	79.5	Confident	77.2	Confident	124 Å²	124	97.9 Å²	97.9	47%	0.468	52%	0.519	S	S	.	.	H	α-helix	trans	-63.8	-44.7	175	-74.2	173.6	-177.4	-169.9	-4.8	112	L513 K524 S525 F526 L530 V531 V532	L513-R528 HydrophobicContact CD2-CG 3.88Å; K524-R528 VanDerWaalsContact CE-NH2 3.31Å; K524-R528 VanDerWaalsContact O-CG 3.32Å; K524-R528 WeakPolarHBondContact O-CG 3.44Å; K524-R528 PolarHBondContact O-N 3.3Å; K524-R528 VanDerWaalsContact O-N 3.1Å; S525-R528 PolarHBondContact O-N 2.83Å; F526-R528 PolarHBondContact O-N 3.35Å; R528-L530 VanDerWaalsContact C-N 3.31Å; R528-L530 PolarHBondContact O-N 3Å; R528-V531 PolarHBondContact O-N 3.43Å; R528-V532 WeakPolarHBondContact O-CB 3.45Å; R528-V532 VanDerWaalsContact O-CG2 3.28Å; R528-V532 WeakPolarHBondContact O-CG2 3.06Å; R528-V532 PolarHBondContact O-N 3.12Å
529	L	82.6	Confident	78.2	Confident	122 Å²	122	92.2 Å²	92.2	64%	0.639	50%	0.503	S	S	*	.	H	α-helix	trans	-61.6	-41.8	178.1	-172.9	68.2	0	0	0	111.3	S525 F526 V532 G533	S525-L529 PolarHBondContact O-N 3.34Å; F526-L529 PolarHBondContact O-N 3.25Å; L529-V532 PolarHBondContact O-N 3.07Å; L529-G533 PolarHBondContact O-N 2.86Å
530	L	81.4	Confident	79.2	Confident	91 Å²	91	94 Å²	94	48%	0.476	51%	0.513	S	S	.	.	H	α-helix	trans	-66.3	-40.5	179	-169.2	137.2	0	0	0	112	F526 S527 R528 G533 L534	F526-L530 HydrophobicContact CE1-CD1 3.97Å; F526-L530 WeakPolarHBondContact O-CB 3.48Å; F526-L530 PolarHBondContact O-N 3.46Å; S527-L530 PolarHBondContact O-N 2.76Å; R528-L530 VanDerWaalsContact C-N 3.31Å; R528-L530 PolarHBondContact O-N 3Å; L530-G533 PolarHBondContact O-N 3.25Å; L530-L534 HydrophobicContact CD2-CD1 3.62Å; L530-L534 HydrophobicContact CD2-CG 4.41Å; L530-L534 HydrophobicContact CG-CD1 4.46Å; L530-L534 WeakPolarHBondContact O-CB 3.28Å; L530-L534 WeakPolarHBondContact O-CG 3.45Å; L530-L534 PolarHBondContact O-N 2.94Å
531	V	82.2	Confident	79.6	Confident	66 Å²	66	93.5 Å²	93.5	40%	0.4	51%	0.506	S	S	.	.	H	α-helix	trans	-67.3	-41.7	175.6	171	0	0	0	0	111.7	L513 S527 R528 G533 G535	L513-V531 HydrophobicContact CD1-CG2 3.94Å; L513-V531 HydrophobicContact CD2-CG2 4.22Å; S527-V531 VanDerWaalsContact O-CG2 3.25Å; S527-V531 WeakPolarHBondContact O-CG2 3.31Å; S527-V531 PolarHBondContact O-N 2.91Å; R528-V531 PolarHBondContact O-N 3.43Å; V531-G533 VanDerWaalsContact C-N 3.34Å; V531-G535 PolarHBondContact O-N 3.37Å
532	V	85.5	Confident	79.9	Confident	88 Å²	88	91.5 Å²	91.5	53%	0.533	49%	0.493	S	S	.	.	H	α-helix	trans	-64.1	-42.1	174.7	172.2	0	0	0	0	110.5	R528 L529 G535 L536	R528-V532 WeakPolarHBondContact O-CB 3.45Å; R528-V532 VanDerWaalsContact O-CG2 3.28Å; R528-V532 WeakPolarHBondContact O-CG2 3.06Å; R528-V532 PolarHBondContact O-N 3.12Å; L529-V532 PolarHBondContact O-N 3.07Å; V532-G535 PolarHBondContact O-N 2.87Å; V532-L536 HydrophobicContact CG1-CD1 3.93Å; V532-L536 HydrophobicContact CG1-CG 4.39Å; V532-L536 WeakPolarHBondContact O-CB 3.34Å; V532-L536 VanDerWaalsContact O-CG 3.29Å; V532-L536 WeakPolarHBondContact O-CG 3.45Å; V532-L536 PolarHBondContact O-N 3.45Å
533	G	83.3	Confident	80.5	Confident	39 Å²	39	90 Å²	90	40%	0.402	49%	0.485	S	S	.	.	H	α-helix	trans	-62.5	-46.7	176.6	0	0	0	0	0	112.9	L529 L530 V531 L536 L537	L529-G533 PolarHBondContact O-N 2.86Å; L530-G533 PolarHBondContact O-N 3.25Å; V531-G533 VanDerWaalsContact C-N 3.34Å; G533-L536 PolarHBondContact O-N 3.12Å; G533-L537 WeakPolarHBondContact O-CB 3.33Å; G533-L537 PolarHBondContact O-N 3.17Å
534	L	82.7	Confident	80.9	Confident	96 Å²	96	89.5 Å²	89.5	50%	0.503	48%	0.48	S	S	.	.	H	α-helix	trans	-65.1	-40.5	175.3	-73.2	173.1	0	0	0	111.9	L530 L537 L538	L530-L534 HydrophobicContact CD2-CD1 3.62Å; L530-L534 HydrophobicContact CD2-CG 4.41Å; L530-L534 HydrophobicContact CG-CD1 4.46Å; L530-L534 WeakPolarHBondContact O-CB 3.28Å; L530-L534 WeakPolarHBondContact O-CG 3.45Å; L530-L534 PolarHBondContact O-N 2.94Å; L534-L537 PolarHBondContact O-N 3.22Å; L534-L538 VanDerWaalsContact O-CG 3.31Å; L534-L538 WeakPolarHBondContact O-CG 3.4Å; L534-L538 PolarHBondContact O-N 2.94Å
535	G	82.7	Confident	81.5	Confident	27 Å²	27	87.4 Å²	87.4	28%	0.278	47%	0.471	S	S	.	.	H	α-helix	trans	-60.9	-48.6	175.2	0	0	0	0	0	111.8	V531 V532 L537 L538 F539	V531-G535 PolarHBondContact O-N 3.37Å; V532-G535 PolarHBondContact O-N 2.87Å; G535-L537 VanDerWaalsContact C-N 3.32Å; G535-L537 PolarHBondContact O-N 3.5Å; G535-L538 PolarHBondContact O-N 3.48Å; G535-F539 VanDerWaalsContact O-CD2 3.24Å; G535-F539 WeakPolarHBondContact O-CD2 3.26Å; G535-F539 PolarHBondContact O-N 3.41Å
536	L	84.5	Confident	81.8	Confident	105 Å²	105	88.9 Å²	88.9	55%	0.55	47%	0.472	S	S	.	.	H	α-helix	trans	-60.4	-42.5	175.7	-74	170.2	0	0	0	111.6	V532 G533 L538 F539 V540	V532-L536 HydrophobicContact CG1-CD1 3.93Å; V532-L536 HydrophobicContact CG1-CG 4.39Å; V532-L536 WeakPolarHBondContact O-CB 3.34Å; V532-L536 VanDerWaalsContact O-CG 3.29Å; V532-L536 WeakPolarHBondContact O-CG 3.45Å; V532-L536 PolarHBondContact O-N 3.45Å; G533-L536 PolarHBondContact O-N 3.12Å; L536-L538 VanDerWaalsContact C-N 3.3Å; L536-L538 PolarHBondContact O-N 2.96Å; L536-F539 PolarHBondContact O-N 3.1Å; L536-F539 VanDerWaalsContact O-N 3.13Å; L536-V540 WeakPolarHBondContact O-CB 3.46Å; L536-V540 VanDerWaalsContact O-CG2 3.26Å; L536-V540 WeakPolarHBondContact O-CG2 3.41Å; L536-V540 PolarHBondContact O-N 3.38Å
537	L	83.2	Confident	81.8	Confident	104 Å²	104	85.6 Å²	85.6	55%	0.545	46%	0.46	S	S	.	.	H	α-helix	trans	-60.6	-40.6	177.3	-170.5	69.6	0	0	0	111.8	G533 L534 G535 F539 F541	G533-L537 WeakPolarHBondContact O-CB 3.33Å; G533-L537 PolarHBondContact O-N 3.17Å; L534-L537 PolarHBondContact O-N 3.22Å; G535-L537 VanDerWaalsContact C-N 3.32Å; G535-L537 PolarHBondContact O-N 3.5Å; L537-F539 PolarHBondContact O-N 3.28Å; L537-F541 WeakPolarHBondContact O-CB 3.2Å; L537-F541 PolarHBondContact O-N 3.35Å
538	L	80.7	Confident	82	Confident	131 Å²	131	84.8 Å²	84.8	69%	0.686	45%	0.454	S	S	*	.	H	α-helix	trans	-65.3	-21.1	177.6	-73.9	171.6	0	0	0	113.9	L534 G535 L536 P542	L534-L538 VanDerWaalsContact O-CG 3.31Å; L534-L538 WeakPolarHBondContact O-CG 3.4Å; L534-L538 PolarHBondContact O-N 2.94Å; G535-L538 PolarHBondContact O-N 3.48Å; L536-L538 VanDerWaalsContact C-N 3.3Å; L536-L538 PolarHBondContact O-N 2.96Å; L538-P542 WeakPolarHBondContact O-CD 3.12Å; L538-P542 WeakPolarHBondContact O-CG 3.41Å
539	F	80.3	Confident	81.8	Confident	157 Å²	157	82.4 Å²	82.4	69%	0.689	45%	0.448	S	S	*	.	H	α-helix	trans	-96.9	-44.5	174.4	-76.6	-77.6	0	0	0	112.5	G535 L536 L537 P542 L543	G535-F539 VanDerWaalsContact O-CD2 3.24Å; G535-F539 WeakPolarHBondContact O-CD2 3.26Å; G535-F539 PolarHBondContact O-N 3.41Å; L536-F539 PolarHBondContact O-N 3.1Å; L536-F539 VanDerWaalsContact O-N 3.13Å; L537-F539 PolarHBondContact O-N 3.28Å; F539-P542 WeakPolarHBondContact O-CD 3.25Å; F539-L543 WeakPolarHBondContact O-CB 3.36Å; F539-L543 PolarHBondContact O-N 2.92Å
540	V	83.4	Confident	81.6	Confident	88 Å²	88	78.2 Å²	78.2	53%	0.533	43%	0.429	S	S	.	.	H	α-helix	trans	-69.2	-39.4	-175.6	174.9	0	0	0	0	111.2	L536 L543 L544	L536-V540 WeakPolarHBondContact O-CB 3.46Å; L536-V540 VanDerWaalsContact O-CG2 3.26Å; L536-V540 WeakPolarHBondContact O-CG2 3.41Å; L536-V540 PolarHBondContact O-N 3.38Å; V540-L543 PolarHBondContact O-N 3.14Å; V540-L544 WeakPolarHBondContact O-CB 3.02Å; V540-L544 PolarHBondContact O-N 2.88Å
541	F	81.6	Confident	81	Confident	95 Å²	95	77.9 Å²	77.9	42%	0.417	45%	0.448	S	S	.	.	H	α-helix	trans	-66.8	-47.7	-177	-177.7	-101	0	0	0	112.9	L537 L543 L544 L545 F569	L537-F541 WeakPolarHBondContact O-CB 3.2Å; L537-F541 PolarHBondContact O-N 3.35Å; F541-L543 VanDerWaalsContact C-N 3.32Å; F541-L543 PolarHBondContact O-N 3.42Å; F541-L544 PolarHBondContact O-N 3.48Å; F541-L545 HydrophobicContact CD1-CD1 3.86Å; F541-L545 HydrophobicContact CE1-CD1 3.45Å; F541-L545 VanDerWaalsContact CE1-CD1 3.45Å; F541-L545 HydrophobicContact CE1-CG 4.31Å; F541-L545 HydrophobicContact CZ-CD1 3.89Å; F541-L545 HydrophobicContact CZ-CG 4.38Å; F541-L545 WeakPolarHBondContact O-CG 3.42Å; F541-L545 PolarHBondContact O-N 2.87Å; F541-F569 HydrophobicContact CZ-CZ 4Å
542	P	80.7	Confident	80.9	Confident	61 Å²	61	78.4 Å²	78.4	40%	0.396	45%	0.447	S	S	.	.	H	α-helix	trans	-62.7	-35.7	172.4	-25.1	36.5	0	0	0	113.6	L538 F539 L544 L545 L546	L538-P542 WeakPolarHBondContact O-CD 3.12Å; L538-P542 WeakPolarHBondContact O-CG 3.41Å; F539-P542 WeakPolarHBondContact O-CD 3.25Å; P542-L544 VanDerWaalsContact C-N 3.33Å; P542-L545 PolarHBondContact O-N 3.2Å; P542-L546 WeakPolarHBondContact O-CB 3.46Å; P542-L546 PolarHBondContact O-N 2.91Å
543	L	81.6	Confident	80.2	Confident	107 Å²	107	81.3 Å²	81.3	56%	0.56	46%	0.46	S	S	*	.	H	α-helix	trans	-65	-40	176.6	-132	119.5	0	0	0	111.4	F539 V540 F541 L546 L547	F539-L543 WeakPolarHBondContact O-CB 3.36Å; F539-L543 PolarHBondContact O-N 2.92Å; V540-L543 PolarHBondContact O-N 3.14Å; F541-L543 VanDerWaalsContact C-N 3.32Å; F541-L543 PolarHBondContact O-N 3.42Å; L543-L546 PolarHBondContact O-N 3.44Å; L543-L547 HydrophobicContact CD2-CD1 4.33Å; L543-L547 WeakPolarHBondContact O-CB 3.4Å; L543-L547 WeakPolarHBondContact O-CG 3.37Å; L543-L547 PolarHBondContact O-N 3.4Å
544	L	82.8	Confident	80	Confident	72 Å²	72	84.1 Å²	84.1	38%	0.377	47%	0.465	S	S	.	.	H	α-helix	trans	-64.5	-41.1	174.7	-177.5	65.3	0	0	0	111.3	V540 F541 P542 L547 L548	V540-L544 WeakPolarHBondContact O-CB 3.02Å; V540-L544 PolarHBondContact O-N 2.88Å; F541-L544 PolarHBondContact O-N 3.48Å; P542-L544 VanDerWaalsContact C-N 3.33Å; L544-L547 PolarHBondContact O-N 2.93Å; L544-L548 HydrophobicContact CD1-CD1 4.3Å; L544-L548 HydrophobicContact CG-CD1 3.91Å; L544-L548 WeakPolarHBondContact O-CB 3.44Å; L544-L548 VanDerWaalsContact O-CG 3.27Å; L544-L548 WeakPolarHBondContact O-CG 3.43Å; L544-L548 PolarHBondContact O-N 2.91Å
545	L	81.5	Confident	79.7	Confident	18 Å²	18	84 Å²	84	9%	0.094	47%	0.473	C	S	.	.	H	α-helix	trans	-65	-41.3	175	-69.4	172.2	0	0	0	112.2	F541 P542 L548 E549 F569 Y574	F541-L545 HydrophobicContact CD1-CD1 3.86Å; F541-L545 HydrophobicContact CE1-CD1 3.45Å; F541-L545 VanDerWaalsContact CE1-CD1 3.45Å; F541-L545 HydrophobicContact CE1-CG 4.31Å; F541-L545 HydrophobicContact CZ-CD1 3.89Å; F541-L545 HydrophobicContact CZ-CG 4.38Å; F541-L545 WeakPolarHBondContact O-CG 3.42Å; F541-L545 PolarHBondContact O-N 2.87Å; P542-L545 PolarHBondContact O-N 3.2Å; L545-L548 CarbonylContact O-C 3.58Å; L545-L548 PolarHBondContact O-N 2.82Å; L545-E549 WeakPolarHBondContact O-CB 3.41Å; L545-E549 PolarHBondContact O-N 3.42Å; L545-F569 HydrophobicContact CD2-CE1 3.82Å; L545-Y574 HydrophobicContact CB-CD2 4.5Å; L545-Y574 HydrophobicContact CB-CE2 3.83Å; L545-Y574 HydrophobicContact CD1-CD2 3.82Å; L545-Y574 HydrophobicContact CD1-CE2 3.77Å; L545-Y574 HydrophobicContact CD2-CD2 4.3Å; L545-Y574 HydrophobicContact CD2-CE2 4.44Å; L545-Y574 HydrophobicContact CG-CD2 4.44Å; L545-Y574 HydrophobicContact CG-CE2 4.23Å
546	L	81.6	Confident	79.6	Confident	113 Å²	113	89 Å²	89	59%	0.592	49%	0.487	S	S	*	.	H	α-helix	trans	-61.2	-42.2	172.5	-97.9	154.4	0	0	0	112.2	P542 L543 E549 S550	P542-L546 WeakPolarHBondContact O-CB 3.46Å; P542-L546 PolarHBondContact O-N 2.91Å; L543-L546 PolarHBondContact O-N 3.44Å; L546-E549 PolarHBondContact O-N 3.35Å; L546-S550 WeakPolarHBondContact O-CB 3.29Å; L546-S550 PolarHBondContact O-N 3.28Å
547	L	81	Confident	79.4	Confident	67 Å²	67	84.6 Å²	84.6	35%	0.351	46%	0.464	S	S	.	.	H	α-helix	trans	-65.1	-43.3	174.6	-78	162.7	0	0	0	111.3	L543 L544 E549 S550 I552 L557 R561	L543-L547 HydrophobicContact CD2-CD1 4.33Å; L543-L547 WeakPolarHBondContact O-CB 3.4Å; L543-L547 WeakPolarHBondContact O-CG 3.37Å; L543-L547 PolarHBondContact O-N 3.4Å; L544-L547 PolarHBondContact O-N 2.93Å; L547-E549 PolarHBondContact O-N 3.3Å; L547-S550 PolarHBondContact O-N 3.45Å; L547-S550 PolarHBondContact O-OG 3.04Å; L547-I552 HydrophobicContact CD2-CD1 4.13Å; L547-L557 HydrophobicContact CB-CD1 4.44Å; L547-R561 PolarHBondContact O-NH2 3.3Å; L547-R561 VanDerWaalsContact O-NH2 3.16Å
548	L	78.9	Confident	79.1	Confident	10 Å²	10	81.1 Å²	81.1	5%	0.052	45%	0.448	C	S	.	.	H	α-helix	trans	-66.8	-21.9	176.1	-75.5	164	0	0	0	112.5	L544 L545 L557 I560 R561 F566	L544-L548 HydrophobicContact CD1-CD1 4.3Å; L544-L548 HydrophobicContact CG-CD1 3.91Å; L544-L548 WeakPolarHBondContact O-CB 3.44Å; L544-L548 VanDerWaalsContact O-CG 3.27Å; L544-L548 WeakPolarHBondContact O-CG 3.43Å; L544-L548 PolarHBondContact O-N 2.91Å; L545-L548 CarbonylContact O-C 3.58Å; L545-L548 PolarHBondContact O-N 2.82Å; L548-L557 HydrophobicContact CD2-CB 4.38Å; L548-L557 HydrophobicContact CD2-CD2 3.73Å; L548-L557 HydrophobicContact CG-CD2 4.18Å; L548-I560 HydrophobicContact CD1-CG2 4.2Å; L548-I560 HydrophobicContact CD2-CB 3.86Å; L548-I560 HydrophobicContact CD2-CD1 4.45Å; L548-I560 HydrophobicContact CD2-CG2 3.56Å; L548-R561 VanDerWaalsContact C-NH2 3.33Å; L548-R561 PolarHBondContact O-NE 3.48Å; L548-R561 PolarHBondContact O-NH2 3.09Å; L548-F566 HydrophobicContact CB-CE2 4.09Å; L548-F566 HydrophobicContact CB-CZ 3.83Å; L548-F566 HydrophobicContact CD1-CD2 4.3Å; L548-F566 HydrophobicContact CD1-CE2 3.63Å; L548-F566 HydrophobicContact CD1-CZ 4.24Å; L548-F566 HydrophobicContact CD2-CE2 4.49Å; L548-F566 HydrophobicContact CG-CE2 4.29Å; L548-F566 HydrophobicContact CG-CZ 4.43Å
549	E	76.8	Confident	79.2	Confident	73 Å²	73	81 Å²	81	34%	0.341	44%	0.444	S	S	.	.	H	α-helix	trans	-92.3	-24.8	173.3	-168.9	168.2	-165.8	0	0	113.2	L545 L546 L547 Y574 K578	L545-E549 WeakPolarHBondContact O-CB 3.41Å; L545-E549 PolarHBondContact O-N 3.42Å; L546-E549 PolarHBondContact O-N 3.35Å; L547-E549 PolarHBondContact O-N 3.3Å; E549-Y574 WeakPolarHBondContact OE2-CE1 3.38Å; E549-Y574 PolarHBondContact OE2-OH 3.07Å; E549-K578 IonicContact OE1-NZ 3.62Å; E549-K578 PolarHBondContact OE1-NZ 3.2Å; E549-K578 IonicContact OE2-NZ 3.2Å
550	S	76.7	Confident	79.2	Confident	34 Å²	34	75.7 Å²	75.7	24%	0.238	42%	0.422	C	S	.	.	S	Bend	trans	-63.5	139.5	179.6	71.6	0	0	0	0	111.3	L546 L547 I552 R561	L546-S550 WeakPolarHBondContact O-CB 3.29Å; L546-S550 PolarHBondContact O-N 3.28Å; L547-S550 PolarHBondContact O-N 3.45Å; L547-S550 PolarHBondContact O-OG 3.04Å; S550-I552 PolarHBondContact O-N 3.13Å; S550-I552 VanDerWaalsContact OG-CD1 3.23Å; S550-I552 WeakPolarHBondContact OG-CD1 3.39Å; S550-I552 VanDerWaalsContact OG-CG1 3.24Å; S550-I552 WeakPolarHBondContact OG-CG1 3.37Å; S550-R561 PolarHBondContact O-NH2 2.96Å
551	G	70.6	Confident	79.1	Confident	84 Å²	84	74.4 Å²	74.4	87%	0.866	41%	0.408	S	S	*	.			trans	-66.8	22.7	175.9	0	0	0	0	0	115	D553	G551-D553 PolarHBondContact O-N 2.98Å
552	I	78.8	Confident	79	Confident	77 Å²	77	77 Å²	77	40%	0.395	42%	0.421	S	S	.	.			trans	-71.6	125.1	178.7	-59.5	175.3	0	0	0	108.8	L547 S550 L554	L547-I552 HydrophobicContact CD2-CD1 4.13Å; S550-I552 PolarHBondContact O-N 3.13Å; S550-I552 VanDerWaalsContact OG-CD1 3.23Å; S550-I552 WeakPolarHBondContact OG-CD1 3.39Å; S550-I552 VanDerWaalsContact OG-CG1 3.24Å; S550-I552 WeakPolarHBondContact OG-CG1 3.37Å; I552-L554 HydrophobicContact CG2-CD1 3.62Å; I552-L554 HydrophobicContact CG2-CG 3.96Å; I552-L554 PolarHBondContact O-N 3.39Å
553	D	70.4	Confident	79.3	Confident	149 Å²	149	76.5 Å²	76.5	80%	0.797	42%	0.417	S	S	*	.			trans	-93.5	66.2	-173.8	-145.1	4.7	0	0	0	110.6	G551	G551-D553 PolarHBondContact O-N 2.98Å
554	L	79.9	Confident	79.1	Confident	98 Å²	98	75.7 Å²	75.7	51%	0.513	42%	0.418	S	S	.	.			trans	-99.3	124.8	171.9	-82.9	156	0	0	0	108.5	I552 F556 L557 C558	I552-L554 HydrophobicContact CG2-CD1 3.62Å; I552-L554 HydrophobicContact CG2-CG 3.96Å; I552-L554 PolarHBondContact O-N 3.39Å; L554-F556 PolarHBondContact O-N 3.21Å; L554-F556 VanDerWaalsContact O-N 3.11Å; L554-L557 HydrophobicContact CB-CB 4.46Å; L554-L557 HydrophobicContact CB-CD1 4.16Å; L554-L557 HydrophobicContact CB-CG 4.22Å; L554-L557 HydrophobicContact CD1-CD1 4.12Å; L554-L557 PolarHBondContact O-N 3.1Å; L554-C558 PolarHBondContact O-N 2.92Å; L554-C558 VanDerWaalsContact O-N 3.16Å
555	S	76.5	Confident	79.1	Confident	95 Å²	95	78.6 Å²	78.6	66%	0.664	43%	0.43	S	S	*	.	H	α-helix	trans	-48.9	-43.1	-175.5	51.4	0	0	0	0	113.7	L557 C558 E559	S555-L557 PolarHBondContact O-N 2.63Å; S555-C558 PolarHBondContact O-N 3.37Å; S555-E559 PolarHBondContact O-N 2.75Å; S555-E559 VanDerWaalsContact O-N 3.09Å
556	F	81.2	Confident	79.1	Confident	132 Å²	132	79 Å²	79	58%	0.579	43%	0.431	S	S	*	.	H	α-helix	trans	-64.9	-37.1	178.1	175.5	-105.1	0	0	0	114.2	L554 I560	L554-F556 PolarHBondContact O-N 3.21Å; L554-F556 VanDerWaalsContact O-N 3.11Å; F556-I560 HydrophobicContact CD1-CD1 3.88Å; F556-I560 HydrophobicContact CD2-CD1 4.5Å; F556-I560 HydrophobicContact CE1-CD1 3.32Å; F556-I560 HydrophobicContact CE2-CD1 4.02Å; F556-I560 HydrophobicContact CG-CD1 4.45Å; F556-I560 HydrophobicContact CZ-CD1 3.42Å; F556-I560 VanDerWaalsContact CZ-CD1 3.42Å; F556-I560 HydrophobicContact CZ-CG1 4.36Å; F556-I560 WeakPolarHBondContact O-CG1 3.42Å; F556-I560 PolarHBondContact O-N 2.67Å
557	L	79.9	Confident	79	Confident	12 Å²	12	78.5 Å²	78.5	6%	0.063	43%	0.425	C	S	.	.	H	α-helix	trans	-73.4	-33.8	178.3	-65	178.5	0	0	0	111.1	L547 L548 L554 S555 I560 R561	L547-L557 HydrophobicContact CB-CD1 4.44Å; L548-L557 HydrophobicContact CD2-CB 4.38Å; L548-L557 HydrophobicContact CD2-CD2 3.73Å; L548-L557 HydrophobicContact CG-CD2 4.18Å; L554-L557 HydrophobicContact CB-CB 4.46Å; L554-L557 HydrophobicContact CB-CD1 4.16Å; L554-L557 HydrophobicContact CB-CG 4.22Å; L554-L557 HydrophobicContact CD1-CD1 4.12Å; L554-L557 PolarHBondContact O-N 3.1Å; S555-L557 PolarHBondContact O-N 2.63Å; L557-I560 PolarHBondContact O-N 3.04Å; L557-R561 VanDerWaalsContact O-CG 3.29Å; L557-R561 WeakPolarHBondContact O-CG 3.45Å; L557-R561 PolarHBondContact O-N 2.74Å
558	C	75.9	Confident	78.9	Confident	30 Å²	30	80.6 Å²	80.6	20%	0.203	43%	0.433	C	S	.	.	H	α-helix	trans	-65.6	-40.3	174.4	-69.4	0	0	0	0	111.8	L554 S555 R561 Q562	L554-C558 PolarHBondContact O-N 2.92Å; L554-C558 VanDerWaalsContact O-N 3.16Å; S555-C558 PolarHBondContact O-N 3.37Å; C558-R561 PolarHBondContact O-N 2.95Å; C558-Q562 WeakPolarHBondContact O-CG 3.47Å; C558-Q562 PolarHBondContact O-N 3.24Å
559	E	82.5	Confident	79.1	Confident	130 Å²	130	83.6 Å²	83.6	61%	0.607	45%	0.446	S	S	*	.	H	α-helix	trans	-61.6	-44.9	173	-75.2	177.2	-174.1	0	0	111.8	S555 R561 Q562 T563	S555-E559 PolarHBondContact O-N 2.75Å; S555-E559 VanDerWaalsContact O-N 3.09Å; E559-R561 PolarHBondContact O-N 2.78Å; E559-Q562 PolarHBondContact O-N 3.1Å; E559-T563 PolarHBondContact O-N 2.93Å
560	I	81.5	Confident	79.3	Confident	44 Å²	44	82 Å²	82	23%	0.226	44%	0.438	C	S	.	.	H	α-helix	trans	-62.6	-42.2	177.5	-67.6	167.5	0	0	0	111.3	L548 F556 L557 Q562 T563 F566	L548-I560 HydrophobicContact CD1-CG2 4.2Å; L548-I560 HydrophobicContact CD2-CB 3.86Å; L548-I560 HydrophobicContact CD2-CD1 4.45Å; L548-I560 HydrophobicContact CD2-CG2 3.56Å; F556-I560 HydrophobicContact CD1-CD1 3.88Å; F556-I560 HydrophobicContact CD2-CD1 4.5Å; F556-I560 HydrophobicContact CE1-CD1 3.32Å; F556-I560 HydrophobicContact CE2-CD1 4.02Å; F556-I560 HydrophobicContact CG-CD1 4.45Å; F556-I560 HydrophobicContact CZ-CD1 3.42Å; F556-I560 VanDerWaalsContact CZ-CD1 3.42Å; F556-I560 HydrophobicContact CZ-CG1 4.36Å; F556-I560 WeakPolarHBondContact O-CG1 3.42Å; F556-I560 PolarHBondContact O-N 2.67Å; L557-I560 PolarHBondContact O-N 3.04Å; I560-Q562 PolarHBondContact O-N 3.08Å; I560-T563 PolarHBondContact O-N 3.34Å; I560-T563 VanDerWaalsContact O-N 3.15Å; I560-T563 PolarHBondContact O-OG1 3.47Å; I560-F566 HydrophobicContact CG2-CB 4.49Å; I560-F566 HydrophobicContact CG2-CD2 4.15Å; I560-F566 HydrophobicContact CG2-CG 4.29Å; I560-F566 VanDerWaalsContact O-CB 3.24Å; I560-F566 WeakPolarHBondContact O-CB 3.47Å
561	R	81	Confident	79.5	Confident	61 Å²	61	88.1 Å²	88.1	23%	0.23	46%	0.458	C	S	.	.	H	α-helix	trans	-59.2	-31.3	178.5	-76.6	172	-174.3	149.8	12.5	113.6	L547 L548 S550 L557 C558 E559 T563 F566	L547-R561 PolarHBondContact O-NH2 3.3Å; L547-R561 VanDerWaalsContact O-NH2 3.16Å; L548-R561 VanDerWaalsContact C-NH2 3.33Å; L548-R561 PolarHBondContact O-NE 3.48Å; L548-R561 PolarHBondContact O-NH2 3.09Å; S550-R561 PolarHBondContact O-NH2 2.96Å; L557-R561 VanDerWaalsContact O-CG 3.29Å; L557-R561 WeakPolarHBondContact O-CG 3.45Å; L557-R561 PolarHBondContact O-N 2.74Å; C558-R561 PolarHBondContact O-N 2.95Å; E559-R561 PolarHBondContact O-N 2.78Å; R561-T563 VanDerWaalsContact C-N 3.34Å; R561-F566 HydrophobicContact CB-CE1 4.49Å; R561-F566 HydrophobicContact CG-CE1 4.1Å
562	Q	80.2	Confident	79.6	Confident	151 Å²	151	89 Å²	89	71%	0.706	44%	0.439	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.6	-2.3	-177.4	-67.9	174.3	11.1	0	0	113.1	C558 E559 I560	C558-Q562 WeakPolarHBondContact O-CG 3.47Å; C558-Q562 PolarHBondContact O-N 3.24Å; E559-Q562 PolarHBondContact O-N 3.1Å; I560-Q562 PolarHBondContact O-N 3.08Å
563	T	85.6	Confident	79.4	Confident	50 Å²	50	92 Å²	92	31%	0.307	45%	0.447	S	S	.	.	S	Bend	trans	-73.4	134.4	175	60.8	0	0	0	0	110.6	E559 I560 R561 E565 F566 E567	E559-T563 PolarHBondContact O-N 2.93Å; I560-T563 PolarHBondContact O-N 3.34Å; I560-T563 VanDerWaalsContact O-N 3.15Å; I560-T563 PolarHBondContact O-OG1 3.47Å; R561-T563 VanDerWaalsContact C-N 3.34Å; T563-E565 WeakPolarHBondContact CB-OE2 3.38Å; T563-E565 PolarHBondContact O-N 2.84Å; T563-F566 PolarHBondContact O-N 3.43Å; T563-F566 WeakPolarHBondContact OG1-CB 3.47Å; T563-F566 PolarHBondContact OG1-N 3.09Å; T563-E567 PolarHBondContact O-N 3.23Å
564	P	78.1	Confident	79.9	Confident	89 Å²	89	86.4 Å²	86.4	58%	0.578	41%	0.414	S	S	*	.	H	α-helix	trans	-61.8	-28.4	-179.6	24.2	-32.6	0	0	0	112.2	Q568	P564-Q568 WeakPolarHBondContact O-CB 3.15Å; P564-Q568 PolarHBondContact O-N 2.83Å
565	E	82.3	Confident	79.8	Confident	133 Å²	133	83.3 Å²	83.3	62%	0.621	40%	0.401	S	S	*	.	H	α-helix	trans	-67.2	-40.6	174.9	-59.3	80.8	-177.6	0	0	111.9	T563 F569	T563-E565 WeakPolarHBondContact CB-OE2 3.38Å; T563-E565 PolarHBondContact O-N 2.84Å; E565-F569 VanDerWaalsContact O-CB 3.25Å; E565-F569 WeakPolarHBondContact O-CB 3.33Å; E565-F569 PolarHBondContact O-N 3.26Å
566	F	82.9	Confident	80	Confident	26 Å²	26	81.3 Å²	81.3	11%	0.114	39%	0.386	C	S	.	.	H	α-helix	trans	-70.8	-43.1	176.3	-178.3	-96.3	0	0	0	111.3	L548 I560 R561 T563 Q568 F569 H570	L548-F566 HydrophobicContact CB-CE2 4.09Å; L548-F566 HydrophobicContact CB-CZ 3.83Å; L548-F566 HydrophobicContact CD1-CD2 4.3Å; L548-F566 HydrophobicContact CD1-CE2 3.63Å; L548-F566 HydrophobicContact CD1-CZ 4.24Å; L548-F566 HydrophobicContact CD2-CE2 4.49Å; L548-F566 HydrophobicContact CG-CE2 4.29Å; L548-F566 HydrophobicContact CG-CZ 4.43Å; I560-F566 HydrophobicContact CG2-CB 4.49Å; I560-F566 HydrophobicContact CG2-CD2 4.15Å; I560-F566 HydrophobicContact CG2-CG 4.29Å; I560-F566 VanDerWaalsContact O-CB 3.24Å; I560-F566 WeakPolarHBondContact O-CB 3.47Å; R561-F566 HydrophobicContact CB-CE1 4.49Å; R561-F566 HydrophobicContact CG-CE1 4.1Å; T563-F566 PolarHBondContact O-N 3.43Å; T563-F566 WeakPolarHBondContact OG1-CB 3.47Å; T563-F566 PolarHBondContact OG1-N 3.09Å; F566-Q568 PolarHBondContact O-N 3.06Å; F566-F569 PolarHBondContact O-N 2.95Å; F566-H570 HydrophobicContact CD1-CB 4.47Å; F566-H570 HydrophobicContact CE1-CB 4.23Å; F566-H570 HydrophobicContact CZ-CB 4.49Å; F566-H570 AromaticContact CZ-ND1 4Å; F566-H570 WeakPolarHBondContact O-CB 2.81Å; F566-H570 PolarHBondContact O-N 3.21Å
567	E	77.9	Confident	79.7	Confident	103 Å²	103	79.7 Å²	79.7	48%	0.481	38%	0.382	S	S	.	.	H	α-helix	trans	-59.9	-46.6	175.9	-74.1	-168.7	156.3	0	0	111.5	T563 F569 H570 Y571	T563-E567 PolarHBondContact O-N 3.23Å; E567-F569 PolarHBondContact O-N 3.12Å; E567-H570 PolarHBondContact O-N 2.84Å; E567-Y571 VanDerWaalsContact O-CD2 3.22Å; E567-Y571 WeakPolarHBondContact O-CD2 3.48Å; E567-Y571 PolarHBondContact O-N 3.09Å
568	Q	79.9	Confident	79.6	Confident	111 Å²	111	83.9 Å²	83.9	52%	0.519	40%	0.4	S	S	.	.	H	α-helix	trans	-60.9	-47.6	176.5	-174.7	178.6	-0.5	0	0	111.3	P564 F566 H570 E572	P564-Q568 WeakPolarHBondContact O-CB 3.15Å; P564-Q568 PolarHBondContact O-N 2.83Å; F566-Q568 PolarHBondContact O-N 3.06Å; Q568-H570 VanDerWaalsContact C-N 3.32Å; Q568-H570 PolarHBondContact O-N 2.77Å; Q568-E572 HydrophobicContact CG-CG 4.16Å; Q568-E572 WeakPolarHBondContact CG-OE2 3.34Å; Q568-E572 PolarHBondContact NE2-OE2 3.29Å; Q568-E572 VanDerWaalsContact O-CB 3.25Å; Q568-E572 WeakPolarHBondContact O-CB 3.43Å; Q568-E572 WeakPolarHBondContact O-CG 3.3Å; Q568-E572 PolarHBondContact O-N 3.13Å
569	F	83.5	Confident	79.7	Confident	73 Å²	73	89.3 Å²	89.3	32%	0.32	42%	0.423	S	S	.	.	H	α-helix	trans	-60	-43.3	177	173.8	-96.6	0	0	0	112.1	F541 L545 E565 F566 E567 Y573 Y574	F541-F569 HydrophobicContact CZ-CZ 4Å; L545-F569 HydrophobicContact CD2-CE1 3.82Å; E565-F569 VanDerWaalsContact O-CB 3.25Å; E565-F569 WeakPolarHBondContact O-CB 3.33Å; E565-F569 PolarHBondContact O-N 3.26Å; F566-F569 PolarHBondContact O-N 2.95Å; E567-F569 PolarHBondContact O-N 3.12Å; F569-Y573 HydrophobicContact CD2-CD2 4.28Å; F569-Y573 WeakPolarHBondContact O-CB 3.45Å; F569-Y573 PolarHBondContact O-N 3.02Å; F569-Y574 PolarHBondContact O-N 3Å; F569-Y574 VanDerWaalsContact O-N 3.09Å
570	H	80.7	Confident	79.4	Confident	39 Å²	39	89 Å²	89	18%	0.181	42%	0.416	C	S	.	.	I	π-helix	trans	-63.9	-49.2	-176.7	-171	78.8	0	0	0	111.2	F566 E567 Q568 Y574 C575	F566-H570 HydrophobicContact CD1-CB 4.47Å; F566-H570 HydrophobicContact CE1-CB 4.23Å; F566-H570 HydrophobicContact CZ-CB 4.49Å; F566-H570 AromaticContact CZ-ND1 4Å; F566-H570 WeakPolarHBondContact O-CB 2.81Å; F566-H570 PolarHBondContact O-N 3.21Å; E567-H570 PolarHBondContact O-N 2.84Å; Q568-H570 VanDerWaalsContact C-N 3.32Å; Q568-H570 PolarHBondContact O-N 2.77Å; H570-Y574 AromaticContact CE1-CD1 3.54Å; H570-Y574 AromaticContact CE1-CE1 3.86Å; H570-Y574 AromaticContact ND1-CD1 3.43Å; H570-Y574 WeakPolarHBondContact ND1-CD1 3.28Å; H570-Y574 PolarHBondContact O-N 2.68Å; H570-C575 PolarHBondContact O-N 2.73Å; H570-C575 PolarHBondContact O-SG 3.3Å; H570-C575 VanDerWaalsContact O-SG 3.4Å
571	Y	80.1	Confident	79.1	Confident	164 Å²	164	90.1 Å²	90.1	64%	0.643	43%	0.425	S	S	*	.	I	π-helix	trans	-77.6	-41.1	-178.8	-74.8	-69.9	0	0	0	113.9	E567	E567-Y571 VanDerWaalsContact O-CD2 3.22Å; E567-Y571 WeakPolarHBondContact O-CD2 3.48Å; E567-Y571 PolarHBondContact O-N 3.09Å
572	E	73.6	Confident	78.9	Confident	102 Å²	102	89.5 Å²	89.5	48%	0.477	43%	0.432	S	S	.	.	I	π-helix	trans	-78.9	-30	-175.9	-68.6	-170.7	158.8	0	0	113.3	Q568	Q568-E572 HydrophobicContact CG-CG 4.16Å; Q568-E572 WeakPolarHBondContact CG-OE2 3.34Å; Q568-E572 PolarHBondContact NE2-OE2 3.29Å; Q568-E572 VanDerWaalsContact O-CB 3.25Å; Q568-E572 WeakPolarHBondContact O-CB 3.43Å; Q568-E572 WeakPolarHBondContact O-CG 3.3Å; Q568-E572 PolarHBondContact O-N 3.13Å
573	Y	74.8	Confident	78.6	Confident	141 Å²	141	83.9 Å²	83.9	55%	0.553	42%	0.415	S	S	*	.	I	π-helix	trans	-125.6	-48.5	-170	-56.3	-87.9	0	0	0	113.8	F569 L577	F569-Y573 HydrophobicContact CD2-CD2 4.28Å; F569-Y573 WeakPolarHBondContact O-CB 3.45Å; F569-Y573 PolarHBondContact O-N 3.02Å; Y573-L577 VanDerWaalsContact O-CB 3.24Å; Y573-L577 WeakPolarHBondContact O-CB 3.48Å; Y573-L577 PolarHBondContact O-N 3.05Å
574	Y	79.5	Confident	78	Confident	30 Å²	30	87 Å²	87	12%	0.118	42%	0.424	C	S	.	.	I	π-helix	trans	-72.1	-49.5	-173.1	-179.5	-104.8	0	0	0	113.3	L545 E549 F569 H570 L577 K578	L545-Y574 HydrophobicContact CB-CD2 4.5Å; L545-Y574 HydrophobicContact CB-CE2 3.83Å; L545-Y574 HydrophobicContact CD1-CD2 3.82Å; L545-Y574 HydrophobicContact CD1-CE2 3.77Å; L545-Y574 HydrophobicContact CD2-CD2 4.3Å; L545-Y574 HydrophobicContact CD2-CE2 4.44Å; L545-Y574 HydrophobicContact CG-CD2 4.44Å; L545-Y574 HydrophobicContact CG-CE2 4.23Å; E549-Y574 WeakPolarHBondContact OE2-CE1 3.38Å; E549-Y574 PolarHBondContact OE2-OH 3.07Å; F569-Y574 PolarHBondContact O-N 3Å; F569-Y574 VanDerWaalsContact O-N 3.09Å; H570-Y574 AromaticContact CE1-CD1 3.54Å; H570-Y574 AromaticContact CE1-CE1 3.86Å; H570-Y574 AromaticContact ND1-CD1 3.43Å; H570-Y574 WeakPolarHBondContact ND1-CD1 3.28Å; H570-Y574 PolarHBondContact O-N 2.68Å; Y574-L577 WeakPolarHBondContact O-CB 3.39Å; Y574-L577 PolarHBondContact O-N 3.37Å; Y574-K578 HydrophobicContact CE1-CD 4.37Å; Y574-K578 WeakPolarHBondContact O-CB 3.33Å; Y574-K578 PolarHBondContact O-N 3.44Å
575	C	79.1	Confident	77.9	Confident	34 Å²	34	86.3 Å²	86.3	23%	0.23	42%	0.418	C	S	.	.	H	α-helix	trans	-59.3	-48.2	179.7	-70.6	0	0	0	0	112.9	H570 L577 K578 E579	H570-C575 PolarHBondContact O-N 2.73Å; H570-C575 PolarHBondContact O-SG 3.3Å; H570-C575 VanDerWaalsContact O-SG 3.4Å; C575-L577 VanDerWaalsContact C-N 3.31Å; C575-L577 PolarHBondContact O-N 2.95Å; C575-K578 PolarHBondContact O-N 2.85Å; C575-E579 WeakPolarHBondContact O-CG 3.48Å; C575-E579 PolarHBondContact O-N 3.45Å
576	P	79.3	Confident	77.5	Confident	53 Å²	53	85.1 Å²	85.1	34%	0.344	42%	0.416	S	S	.	.	H	α-helix	trans	-60.7	-37.8	174.4	-24.7	34.8	0	0	0	113.5	W580	P576-W580 WeakPolarHBondContact O-CB 3.29Å; P576-W580 PolarHBondContact O-N 3.28Å
577	L	74.9	Confident	76.9	Confident	97 Å²	97	88.8 Å²	88.8	51%	0.508	44%	0.436	S	S	.	.	H	α-helix	trans	-66.2	-43.9	176.8	-179.9	65.6	0	0	0	111.2	Y573 Y574 C575 W580 V581	Y573-L577 VanDerWaalsContact O-CB 3.24Å; Y573-L577 WeakPolarHBondContact O-CB 3.48Å; Y573-L577 PolarHBondContact O-N 3.05Å; Y574-L577 WeakPolarHBondContact O-CB 3.39Å; Y574-L577 PolarHBondContact O-N 3.37Å; C575-L577 VanDerWaalsContact C-N 3.31Å; C575-L577 PolarHBondContact O-N 2.95Å; L577-W580 HydrophobicContact CD1-CE3 4.46Å; L577-W580 PolarHBondContact O-N 3.32Å; L577-V581 HydrophobicContact CD1-CG2 4.33Å; L577-V581 HydrophobicContact CG-CG2 4.49Å; L577-V581 VanDerWaalsContact O-CG2 3.31Å; L577-V581 WeakPolarHBondContact O-CG2 3.37Å; L577-V581 PolarHBondContact O-N 3.05Å
578	K	79	Confident	76.5	Confident	101 Å²	101	90.8 Å²	90.8	44%	0.439	44%	0.443	S	S	.	.	H	α-helix	trans	-60.1	-46.7	177.2	-177.3	-176.5	175.1	-174.1	0	111.3	E549 Y574 C575 V581 A582	E549-K578 IonicContact OE1-NZ 3.62Å; E549-K578 PolarHBondContact OE1-NZ 3.2Å; E549-K578 IonicContact OE2-NZ 3.2Å; Y574-K578 HydrophobicContact CE1-CD 4.37Å; Y574-K578 WeakPolarHBondContact O-CB 3.33Å; Y574-K578 PolarHBondContact O-N 3.44Å; C575-K578 PolarHBondContact O-N 2.85Å; K578-V581 PolarHBondContact O-N 3.39Å; K578-A582 WeakPolarHBondContact O-CB 3.18Å; K578-A582 PolarHBondContact O-N 3.47Å
579	E	77.1	Confident	75.9	Confident	144 Å²	144	89 Å²	89	67%	0.673	44%	0.437	S	S	*	.	H	α-helix	trans	-62.2	-42.2	176.4	-72.7	177.9	177.5	0	0	112	C575 A582 G583	C575-E579 WeakPolarHBondContact O-CG 3.48Å; C575-E579 PolarHBondContact O-N 3.45Å; E579-A582 PolarHBondContact O-N 3.46Å; E579-G583 PolarHBondContact O-N 2.95Å
580	W	77.4	Confident	75.2	Confident	123 Å²	123	94.9 Å²	94.9	47%	0.466	46%	0.458	S	S	.	.	H	α-helix	trans	-64.8	-43.2	177	-178.3	88.6	0	0	0	112.4	F326 P576 L577 G583 K584	F326-W580 HydrophobicContact CE2-CZ2 4.44Å; F326-W580 AromaticContact CE2-NE1 3.81Å; P576-W580 WeakPolarHBondContact O-CB 3.29Å; P576-W580 PolarHBondContact O-N 3.28Å; L577-W580 HydrophobicContact CD1-CE3 4.46Å; L577-W580 PolarHBondContact O-N 3.32Å; W580-G583 PolarHBondContact O-N 2.89Å; W580-K584 HydrophobicContact CD2-CG 4.23Å; W580-K584 HydrophobicContact CE3-CG 4.41Å; W580-K584 HydrophobicContact CH2-CG 4.18Å; W580-K584 HydrophobicContact CZ2-CD 4.47Å; W580-K584 HydrophobicContact CZ2-CG 3.99Å; W580-K584 HydrophobicContact CZ3-CG 4.38Å; W580-K584 WeakPolarHBondContact O-CB 3.37Å; W580-K584 WeakPolarHBondContact O-CG 3.44Å; W580-K584 PolarHBondContact O-N 2.92Å
581	V	73.9	Confident	74.3	Confident	68 Å²	68	100.3 Å²	100.3	41%	0.412	49%	0.485	S	S	.	.	H	α-helix	trans	-65.1	-45.6	176.3	171.8	0	0	0	0	110.7	L577 K578 G583 K584 V585	L577-V581 HydrophobicContact CD1-CG2 4.33Å; L577-V581 HydrophobicContact CG-CG2 4.49Å; L577-V581 VanDerWaalsContact O-CG2 3.31Å; L577-V581 WeakPolarHBondContact O-CG2 3.37Å; L577-V581 PolarHBondContact O-N 3.05Å; K578-V581 PolarHBondContact O-N 3.39Å; V581-G583 VanDerWaalsContact C-N 3.31Å; V581-G583 PolarHBondContact O-N 3.46Å; V581-K584 PolarHBondContact O-N 3.42Å; V581-V585 HydrophobicContact CG1-CG2 4.2Å; V581-V585 WeakPolarHBondContact O-CB 3.44Å; V581-V585 WeakPolarHBondContact O-CG2 3.44Å; V581-V585 PolarHBondContact O-N 2.63Å
582	A	77.4	Confident	73.9	Confident	47 Å²	47	97.8 Å²	97.8	39%	0.388	48%	0.483	S	S	.	.	H	α-helix	trans	-59.7	-42.4	176.1	0	0	0	0	0	111.4	K578 E579 V585 N586	K578-A582 WeakPolarHBondContact O-CB 3.18Å; K578-A582 PolarHBondContact O-N 3.47Å; E579-A582 PolarHBondContact O-N 3.46Å; A582-V585 PolarHBondContact O-N 2.92Å; A582-N586 WeakPolarHBondContact O-CB 3.43Å; A582-N586 PolarHBondContact O-N 2.76Å; A582-N586 PolarHBondContact O-ND2 3.09Å
583	G	73.6	Confident	72.8	Confident	33 Å²	33	96.2 Å²	96.2	34%	0.34	49%	0.494	S	S	.	.	H	α-helix	trans	-61.2	-44.1	173.7	0	0	0	0	0	112.8	E579 W580 V581 N586 I587	E579-G583 PolarHBondContact O-N 2.95Å; W580-G583 PolarHBondContact O-N 2.89Å; V581-G583 VanDerWaalsContact C-N 3.31Å; V581-G583 PolarHBondContact O-N 3.46Å; G583-N586 PolarHBondContact O-N 3.37Å; G583-I587 WeakPolarHBondContact O-CD1 3.3Å; G583-I587 WeakPolarHBondContact O-CG1 3.17Å; G583-I587 PolarHBondContact O-N 2.93Å
584	K	72.6	Confident	71.8	Confident	117 Å²	117	93.7 Å²	93.7	51%	0.509	50%	0.496	S	S	.	.	H	α-helix	trans	-67	-41	177.5	-79.7	-70.2	-173.3	179.3	0	113	W580 V581 I587 F588	W580-K584 HydrophobicContact CD2-CG 4.23Å; W580-K584 HydrophobicContact CE3-CG 4.41Å; W580-K584 HydrophobicContact CH2-CG 4.18Å; W580-K584 HydrophobicContact CZ2-CD 4.47Å; W580-K584 HydrophobicContact CZ2-CG 3.99Å; W580-K584 HydrophobicContact CZ3-CG 4.38Å; W580-K584 WeakPolarHBondContact O-CB 3.37Å; W580-K584 WeakPolarHBondContact O-CG 3.44Å; W580-K584 PolarHBondContact O-N 2.92Å; V581-K584 PolarHBondContact O-N 3.42Å; K584-I587 PolarHBondContact O-N 3.22Å; K584-F588 WeakPolarHBondContact O-CB 3.35Å; K584-F588 PolarHBondContact O-N 2.66Å
585	V	76.2	Confident	70.3	Confident	74 Å²	74	101.3 Å²	101.3	45%	0.448	55%	0.554	S	S	.	*	H	α-helix	trans	-65.7	-43	176.1	171.2	0	0	0	0	110.1	V581 A582 I587 F588 L589	V581-V585 HydrophobicContact CG1-CG2 4.2Å; V581-V585 WeakPolarHBondContact O-CB 3.44Å; V581-V585 WeakPolarHBondContact O-CG2 3.44Å; V581-V585 PolarHBondContact O-N 2.63Å; A582-V585 PolarHBondContact O-N 2.92Å; V585-I587 PolarHBondContact O-N 2.94Å; V585-F588 CarbonylContact O-C 3.53Å; V585-F588 PolarHBondContact O-N 3.03Å; V585-F588 VanDerWaalsContact O-N 3.12Å; V585-L589 HydrophobicContact CG1-CD1 3.73Å; V585-L589 HydrophobicContact CG1-CG 4.23Å; V585-L589 WeakPolarHBondContact O-CB 3.29Å; V585-L589 WeakPolarHBondContact O-CG 3.32Å; V585-L589 PolarHBondContact O-N 3.42Å
586	N	73.6	Confident	69.9	Low	107 Å²	107	104.7 Å²	104.7	57%	0.572	57%	0.57	S	S	*	*	H	α-helix	trans	-62.2	-40.7	175.3	-80.9	-22.3	0	0	0	112.3	A582 G583 F588 L589 Y590	A582-N586 WeakPolarHBondContact O-CB 3.43Å; A582-N586 PolarHBondContact O-N 2.76Å; A582-N586 PolarHBondContact O-ND2 3.09Å; G583-N586 PolarHBondContact O-N 3.37Å; N586-F588 VanDerWaalsContact C-N 3.31Å; N586-F588 PolarHBondContact O-N 3.13Å; N586-L589 PolarHBondContact O-N 2.77Å; N586-Y590 WeakPolarHBondContact O-CB 3.11Å; N586-Y590 PolarHBondContact O-N 3.45Å
587	I	70.8	Confident	69.4	Low	104 Å²	104	107.4 Å²	107.4	53%	0.533	58%	0.582	S	S	.	*	H	α-helix	trans	-62.5	-41.1	173.2	-69.7	163	0	0	0	110.7	G583 K584 V585 Y590 M591	G583-I587 WeakPolarHBondContact O-CD1 3.3Å; G583-I587 WeakPolarHBondContact O-CG1 3.17Å; G583-I587 PolarHBondContact O-N 2.93Å; K584-I587 PolarHBondContact O-N 3.22Å; V585-I587 PolarHBondContact O-N 2.94Å; I587-Y590 PolarHBondContact O-N 2.89Å; I587-M591 WeakPolarHBondContact O-CB 3.43Å; I587-M591 WeakPolarHBondContact O-CG 3.24Å; I587-M591 PolarHBondContact O-N 3.02Å
588	F	70.3	Confident	69.1	Low	144 Å²	144	107.9 Å²	107.9	63%	0.632	59%	0.586	S	S	*	*	H	α-helix	trans	-69.4	-39.2	179.9	-154.6	-96.1	0	0	0	112.4	K584 V585 N586 M591 L592	K584-F588 WeakPolarHBondContact O-CB 3.35Å; K584-F588 PolarHBondContact O-N 2.66Å; V585-F588 CarbonylContact O-C 3.53Å; V585-F588 PolarHBondContact O-N 3.03Å; V585-F588 VanDerWaalsContact O-N 3.12Å; N586-F588 VanDerWaalsContact C-N 3.31Å; N586-F588 PolarHBondContact O-N 3.13Å; F588-M591 PolarHBondContact O-N 2.94Å; F588-L592 HydrophobicContact CD1-CD1 3.57Å; F588-L592 HydrophobicContact CD1-CG 4.42Å; F588-L592 HydrophobicContact CE1-CD1 3.62Å; F588-L592 HydrophobicContact CE1-CG 4.45Å; F588-L592 WeakPolarHBondContact O-CB 3.26Å; F588-L592 WeakPolarHBondContact O-CG 3.26Å; F588-L592 PolarHBondContact O-N 3.45Å; F588-L592 VanDerWaalsContact O-N 3.08Å
589	L	67.4	Low	68.5	Low	74 Å²	74	108.4 Å²	108.4	39%	0.387	59%	0.594	S	S	.	*	H	α-helix	trans	-67.6	-39	174.2	-72.9	168.9	0	0	0	111.8	V585 N586 L592 G593 C594	V585-L589 HydrophobicContact CG1-CD1 3.73Å; V585-L589 HydrophobicContact CG1-CG 4.23Å; V585-L589 WeakPolarHBondContact O-CB 3.29Å; V585-L589 WeakPolarHBondContact O-CG 3.32Å; V585-L589 PolarHBondContact O-N 3.42Å; N586-L589 PolarHBondContact O-N 2.77Å; L589-L592 CarbonylContact O-C 3.58Å; L589-L592 PolarHBondContact O-N 3.13Å; L589-L592 VanDerWaalsContact O-N 3.11Å; L589-G593 PolarHBondContact O-N 3.23Å; L589-G593 VanDerWaalsContact O-N 3.11Å; L589-C594 PolarHBondContact O-N 2.76Å
590	Y	68.5	Low	67.9	Low	196 Å²	196	106.1 Å²	106.1	77%	0.769	59%	0.589	S	S	*	*	H	α-helix	trans	-61.9	-42.3	172.8	-172.9	-97.2	0	0	0	111.7	N586 I587 L592 G593	N586-Y590 WeakPolarHBondContact O-CB 3.11Å; N586-Y590 PolarHBondContact O-N 3.45Å; I587-Y590 PolarHBondContact O-N 2.89Å; Y590-L592 PolarHBondContact O-N 2.83Å; Y590-G593 PolarHBondContact O-N 2.83Å
591	M	62.4	Low	67.3	Low	153 Å²	153	105 Å²	105	75%	0.754	60%	0.598	S	S	*	*	H	α-helix	trans	-67.2	-21.9	174.3	-70.7	-71.1	-70	0	0	113.4	I587 F588	I587-M591 WeakPolarHBondContact O-CB 3.43Å; I587-M591 WeakPolarHBondContact O-CG 3.24Å; I587-M591 PolarHBondContact O-N 3.02Å; F588-M591 PolarHBondContact O-N 2.94Å
592	L	69.8	Low	66.8	Low	111 Å²	111	107.6 Å²	107.6	58%	0.581	61%	0.611	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.9	0	176.4	-73.9	167.5	0	0	0	113.5	F588 L589 Y590 C594	F588-L592 HydrophobicContact CD1-CD1 3.57Å; F588-L592 HydrophobicContact CD1-CG 4.42Å; F588-L592 HydrophobicContact CE1-CD1 3.62Å; F588-L592 HydrophobicContact CE1-CG 4.45Å; F588-L592 WeakPolarHBondContact O-CB 3.26Å; F588-L592 WeakPolarHBondContact O-CG 3.26Å; F588-L592 PolarHBondContact O-N 3.45Å; F588-L592 VanDerWaalsContact O-N 3.08Å; L589-L592 CarbonylContact O-C 3.58Å; L589-L592 PolarHBondContact O-N 3.13Å; L589-L592 VanDerWaalsContact O-N 3.11Å; Y590-L592 PolarHBondContact O-N 2.83Å; L592-C594 VanDerWaalsContact C-N 3.28Å; L592-C594 PolarHBondContact O-N 3.25Å
593	G	50.5	Low	66	Low	70 Å²	70	112.3 Å²	112.3	72%	0.722	63%	0.628	S	S	*	*	T	Hydrogen-bonded Turn	trans	72.4	14.9	175.7	0	0	0	0	0	115.2	L589 Y590	L589-G593 PolarHBondContact O-N 3.23Å; L589-G593 VanDerWaalsContact O-N 3.11Å; Y590-G593 PolarHBondContact O-N 2.83Å
594	C	53.9	Low	65.4	Low	87 Å²	87	118.9 Å²	118.9	59%	0.588	65%	0.652	S	S	*	*			trans	-98	102.3	174.3	-68.5	0	0	0	0	108.7	L589 L592	L589-C594 PolarHBondContact O-N 2.76Å; L592-C594 VanDerWaalsContact C-N 3.28Å; L592-C594 PolarHBondContact O-N 3.25Å
595	S	48.8	Very low	64.7	Low	190 Å²	190	119.1 Å²	119.1	100%	1.329	67%	0.665	S	S	*	*			trans	-85.4	0	165.9	-176.3	0	0	0	0	111.5

Retrieved 595 of 595 residues in 96.3 ms (Link to these results)

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